smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
FC(F)(F)[C@H]1CC[C@H](CN2CCC(C3OCCO3)CC2)O1	ZINC000721464838	777053951	/nfs/dbraw/zinc/05/39/51/777053951.db2.gz	FFRRJLJGCXEQNU-VXGBXAGGSA-N	0	3	309.328	2.181	10	0		DEAEHN
FC(F)(F)[C@H]1CC[C@@H](CN2CCC(C3OCCO3)CC2)O1	ZINC000721464830	777054141	/nfs/dbraw/zinc/05/41/41/777054141.db2.gz	FFRRJLJGCXEQNU-NWDGAFQWSA-N	0	3	309.328	2.181	10	0		DEAEHN
CC[C@H](NCc1nc(Br)c[nH]1)[C@@H]1CCCOC1	ZINC000724011149	777220655	/nfs/dbraw/zinc/22/06/55/777220655.db2.gz	CYGJJKQEOHRUGN-ZJUUUORDSA-N	0	3	302.216	2.467	10	0		DEAEHN
COc1cccc(/C(C)=C\C(=O)N2CCN3CCC2CC3)c1	ZINC000588561882	777418552	/nfs/dbraw/zinc/41/85/52/777418552.db2.gz	QBUQRFBDDJTECP-OWBHPGMISA-N	0	3	300.402	2.405	10	0		DEAEHN
C[C@@H]1C[C@@H](NCc2cn(C)nc2Br)C[C@H](C)O1	ZINC000712461582	792189125	/nfs/dbraw/zinc/18/91/25/792189125.db2.gz	RSVSATJRBHESPT-DOFRTFSJSA-N	0	3	302.216	2.228	10	0		DEAEHN
Cn1cc(CNC2(CCO)CCCCC2)c(Br)n1	ZINC000712498196	792190985	/nfs/dbraw/zinc/19/09/85/792190985.db2.gz	JGINPBGMEQDYHV-UHFFFAOYSA-N	0	3	316.243	2.358	10	0		DEAEHN
Cn1cc(CNCCCOCC2CC2)c(Br)n1	ZINC000712481192	792191076	/nfs/dbraw/zinc/19/10/76/792191076.db2.gz	GXSYSLIPZMYHLC-UHFFFAOYSA-N	0	3	302.216	2.089	10	0		DEAEHN
COc1cc(CNCC[C@H]2CCCS2(=O)=O)ccc1Cl	ZINC000714350149	792309903	/nfs/dbraw/zinc/30/99/03/792309903.db2.gz	CCYHNUUTQZJOBU-GFCCVEGCSA-N	0	3	317.838	2.406	10	0		DEAEHN
CC(C)CC[C@@H](N)C(=O)NCc1ncc(Br)s1	ZINC000714944577	792361006	/nfs/dbraw/zinc/36/10/06/792361006.db2.gz	RVBYLGRSINSHHG-MRVPVSSYSA-N	0	3	320.256	2.285	10	0		DEAEHN
C[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C)c1cn(C)nn1	ZINC000715841118	792513115	/nfs/dbraw/zinc/51/31/15/792513115.db2.gz	ZDNYACMKGLTBBU-AGIUHOORSA-N	0	3	323.441	2.111	10	0		DEAEHN
C[C@@H](CNCc1cnn(-c2ccccc2)n1)CC1(C)OCCO1	ZINC000716020488	792553631	/nfs/dbraw/zinc/55/36/31/792553631.db2.gz	IHZJKYGKPWGWSF-CQSZACIVSA-N	0	3	316.405	2.146	10	0		DEAEHN
Cc1cc(CN[C@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)[nH]n1	ZINC000716447391	792959569	/nfs/dbraw/zinc/95/95/69/792959569.db2.gz	PFARSKMRETYQCC-FZMZJTMJSA-N	0	3	308.426	2.453	10	0		DEAEHN
C=Cn1cc(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)cn1	ZINC000700733966	1086332172	/nfs/dbraw/zinc/33/21/72/1086332172.db2.gz	IMOUYFPQVIQSBV-OCCSQVGLSA-N	0	3	306.410	2.471	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NCCSC(C)(C)C	ZINC000702411896	1086431725	/nfs/dbraw/zinc/43/17/25/1086431725.db2.gz	IECYHWJIWNXIDB-HNNXBMFYSA-N	0	3	323.506	2.094	10	0		DEAEHN
C[C@H](N[C@@H]1CON(C(=O)OC(C)(C)C)C1)[C@@H]1CCCCO1	ZINC000703289516	1086492410	/nfs/dbraw/zinc/49/24/10/1086492410.db2.gz	IPFHIHQPNSICER-AVGNSLFASA-N	0	3	300.399	2.085	10	0		DEAEHN
CC[C@@H]1[C@@H](NCc2cncnc2)CCN1C(=O)OC(C)(C)C	ZINC000704618438	1086584815	/nfs/dbraw/zinc/58/48/15/1086584815.db2.gz	AQQINUTUYVYEDQ-UONOGXRCSA-N	0	3	306.410	2.354	10	0		DEAEHN
O=S(=O)([N-][C@]12CCC[C@H]1[NH2+]CC2)c1cccc(Cl)c1F	ZINC000711583967	1087165197	/nfs/dbraw/zinc/16/51/97/1087165197.db2.gz	LHBRCCJAHSWESE-YPMHNXCESA-N	0	3	318.801	2.042	10	0		DEAEHN
C[C@@H]1[C@@H](NC(=O)c2ccc(Br)cc2F)CCN1C	ZINC000719388970	1089079485	/nfs/dbraw/zinc/07/94/85/1089079485.db2.gz	UGDMUQIIMDNJAE-PELKAZGASA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@@H]1[C@H](NC(=O)c2cccc(Br)c2F)CCN1C	ZINC000719388422	1089072372	/nfs/dbraw/zinc/07/23/72/1089072372.db2.gz	PUNULPKRVUODET-LDYMZIIASA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@H]1CC[NH2+]C[C@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1Cl	ZINC000262762282	290603227	/nfs/dbraw/zinc/60/32/27/290603227.db2.gz	JWXDDLRKVNXAOX-GZMMTYOYSA-N	0	3	323.245	2.270	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)cc1	ZINC000278250031	214047838	/nfs/dbraw/zinc/04/78/38/214047838.db2.gz	BWFBMGOPMYPALM-GUYCJALGSA-N	0	3	317.433	2.082	10	0		DEAEHN
CC(C)[C@@H](SCCS(C)(=O)=O)[C@H](N)c1ccccc1	ZINC000081768783	192322889	/nfs/dbraw/zinc/32/28/89/192322889.db2.gz	DHCAEKVXLDKFKO-ZIAGYGMSSA-N	0	3	301.477	2.489	10	0		DEAEHN
CCN[C@H](CSc1nnnn1C)c1ccccc1OCC	ZINC000081843750	192330658	/nfs/dbraw/zinc/33/06/58/192330658.db2.gz	WKBPVPNLPUOWTA-GFCCVEGCSA-N	0	3	307.423	2.052	10	0		DEAEHN
C[C@@H](O)C[C@H](C)c1c(Br)cnn1CCN(C)C	ZINC000163351058	197625771	/nfs/dbraw/zinc/62/57/71/197625771.db2.gz	FERITNBPEVNTAK-VHSXEESVSA-N	0	3	304.232	2.082	10	0		DEAEHN
N[C@H]1CCC[C@@H]1S(=O)(=O)c1ccc(Br)cc1	ZINC000081934013	192340761	/nfs/dbraw/zinc/34/07/61/192340761.db2.gz	XIXAFHJXBRVKNB-QWRGUYRKSA-N	0	3	304.209	2.103	10	0		DEAEHN
CCC[C@H](N)CS(=O)(=O)c1ccc(Br)cc1	ZINC000081933205	192341694	/nfs/dbraw/zinc/34/16/94/192341694.db2.gz	IXIALAKJZMWCQA-JTQLQIEISA-N	0	3	306.225	2.350	10	0		DEAEHN
CCCN[C@H](C)[C@H](C)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000081935184	192342385	/nfs/dbraw/zinc/34/23/85/192342385.db2.gz	UUXGNSZTZYKAKC-NEPJUHHUSA-N	0	3	313.419	2.008	10	0		DEAEHN
CC(C)N[C@@](CSc1ccc(Cl)cn1)(C(N)=O)C1CC1	ZINC000079447795	185171990	/nfs/dbraw/zinc/17/19/90/185171990.db2.gz	QEQMVPIKSIRFBQ-CQSZACIVSA-N	0	3	313.854	2.459	10	0		DEAEHN
CC[C@]1(CO)CCCN(Cc2ccccc2C(=O)N(C)C)C1	ZINC000417983674	529425429	/nfs/dbraw/zinc/42/54/29/529425429.db2.gz	CJKGBKMBPKCNMX-SFHVURJKSA-N	0	3	304.434	2.373	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)s1)N1CCCNC(=O)C1	ZINC000087883142	185234463	/nfs/dbraw/zinc/23/44/63/185234463.db2.gz	XJHNHKNRUCPDPZ-TVQRCGJNSA-N	0	3	301.843	2.002	10	0		DEAEHN
CN[C@H]1CCCN(c2ccc(Br)c(F)c2)C1=O	ZINC000088085378	185239085	/nfs/dbraw/zinc/23/90/85/185239085.db2.gz	KOQXHSKXTPWCJP-NSHDSACASA-N	0	3	301.159	2.303	10	0		DEAEHN
CCCN[C@@H]1CCN(c2c3nsnc3ccc2Cl)C1=O	ZINC000088120680	185240027	/nfs/dbraw/zinc/24/00/27/185240027.db2.gz	CKUMQJDFJDSSRC-SNVBAGLBSA-N	0	3	310.810	2.450	10	0		DEAEHN
C[C@@H](CN)S(=O)(=O)Nc1ccccc1Cc1ccccc1	ZINC000088472174	185252194	/nfs/dbraw/zinc/25/21/94/185252194.db2.gz	NEBIRTTYLJWAGA-ZDUSSCGKSA-N	0	3	304.415	2.366	10	0		DEAEHN
CN(CCC(F)(F)F)C[C@@H](N)c1ccc2c(c1)OCCO2	ZINC000088418222	185249085	/nfs/dbraw/zinc/24/90/85/185249085.db2.gz	AUDQKBLOYWPTSP-LLVKDONJSA-N	0	3	304.312	2.342	10	0		DEAEHN
CN[C@](C)(C[C@@H](C)N1CCC(C(F)(F)F)CC1)C(=O)OC	ZINC000088435532	185250416	/nfs/dbraw/zinc/25/04/16/185250416.db2.gz	YUYXQXOFVMFROW-ZWNOBZJWSA-N	0	3	310.360	2.190	10	0		DEAEHN
CC[NH2+][C@](C)(CCCN1CCC(C(F)(F)F)CC1)C(=O)[O-]	ZINC000088435552	185250474	/nfs/dbraw/zinc/25/04/74/185250474.db2.gz	IFBCZOMFDSNKIN-CYBMUJFWSA-N	0	3	310.360	2.494	10	0		DEAEHN
NC[C@](O)(CN1CCC[C@H](C(F)(F)F)C1)c1ccccc1	ZINC000088439775	185250660	/nfs/dbraw/zinc/25/06/60/185250660.db2.gz	OLOGXUCWZRKQHW-KBPBESRZSA-N	0	3	302.340	2.107	10	0		DEAEHN
CCC[C@@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]CC(C)C)o1	ZINC000088541959	185256009	/nfs/dbraw/zinc/25/60/09/185256009.db2.gz	AMAMBIZPZJGNPJ-GFCCVEGCSA-N	0	3	302.440	2.492	10	0		DEAEHN
COCCCS(=O)(=O)[C@H]1C[C@@H](c2ccccc2)CC[C@@H]1N	ZINC000081986039	192348832	/nfs/dbraw/zinc/34/88/32/192348832.db2.gz	DLTQWHAUQSTCQN-JYJNAYRXSA-N	0	3	311.447	2.101	10	0		DEAEHN
CCN[C@H]1c2ccccc2CC[C@@H]1S(=O)(=O)CCCOC	ZINC000081986162	192348866	/nfs/dbraw/zinc/34/88/66/192348866.db2.gz	YRUUUTKNXHGDNM-HOTGVXAUSA-N	0	3	311.447	2.103	10	0		DEAEHN
CC[C@@H]([C@H](NC)c1ccccc1)S(=O)(=O)C1CCOCC1	ZINC000081989819	192350837	/nfs/dbraw/zinc/35/08/37/192350837.db2.gz	WANRGNCJJDLSAD-JKSUJKDBSA-N	0	3	311.447	2.320	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CC(=O)N1C[C@H](C)C[C@H](C)C1	ZINC000178312434	282217082	/nfs/dbraw/zinc/21/70/82/282217082.db2.gz	CTOTUSMAVXIXDS-HLLBOEOZSA-N	0	3	318.465	2.160	10	0		DEAEHN
CCN[C@H](CS(=O)(=O)CCCOC)c1ccc(C)cc1C	ZINC000082005954	192352929	/nfs/dbraw/zinc/35/29/29/192352929.db2.gz	KBYWVSVQPWVCDN-MRXNPFEDSA-N	0	3	313.463	2.405	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1ccc(C(F)(F)F)cc1	ZINC000090293261	185289863	/nfs/dbraw/zinc/28/98/63/185289863.db2.gz	GSOOEUDELZDRCW-UHFFFAOYSA-N	0	3	322.352	2.078	10	0		DEAEHN
N[C@H]1COC[C@@H]1c1nc(Cc2ccc(Cl)cc2Cl)no1	ZINC000090364353	185292879	/nfs/dbraw/zinc/29/28/79/185292879.db2.gz	JGNJKGUCKPJVHU-ONGXEEELSA-N	0	3	314.172	2.408	10	0		DEAEHN
N[C@H]1COC[C@@H]1C(=O)Nc1ccccc1SCC(F)(F)F	ZINC000090380237	185293754	/nfs/dbraw/zinc/29/37/54/185293754.db2.gz	KGWLQTZXUIXIEL-IUCAKERBSA-N	0	3	320.336	2.253	10	0		DEAEHN
N[C@@H]1COC[C@@H]1C(=O)Nc1ccccc1SC(F)(F)F	ZINC000090379823	185293802	/nfs/dbraw/zinc/29/38/02/185293802.db2.gz	UGHDQSIRUPYDLE-JGVFFNPUSA-N	0	3	306.309	2.211	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000090434115	185296266	/nfs/dbraw/zinc/29/62/66/185296266.db2.gz	HPAWBYLTZFVHFI-MFKMUULPSA-N	0	3	305.765	2.061	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)N(C)Cc1ccc(Cl)c(Cl)c1	ZINC000090434553	185296417	/nfs/dbraw/zinc/29/64/17/185296417.db2.gz	NMMRCPIVAFGNPA-ZWNOBZJWSA-N	0	3	317.216	2.186	10	0		DEAEHN
C[C@]1(C(=O)Nc2ccc(SC(F)F)cc2)COC[C@H]1N	ZINC000090585432	185305096	/nfs/dbraw/zinc/30/50/96/185305096.db2.gz	IXXBDEMFALRKIZ-MFKMUULPSA-N	0	3	302.346	2.304	10	0		DEAEHN
C[C@@]1(C(=O)N(Cc2ccc(Cl)cc2)C2CC2)COC[C@@H]1N	ZINC000090592009	185305676	/nfs/dbraw/zinc/30/56/76/185305676.db2.gz	KFPPDRUYVLNKPB-GOEBONIOSA-N	0	3	308.809	2.195	10	0		DEAEHN
CC(C)N(Cc1cccc(Cl)c1)C(=O)[C@]1(C)COC[C@H]1N	ZINC000090592334	185305820	/nfs/dbraw/zinc/30/58/20/185305820.db2.gz	DOIFDGDWDUDZHP-GDBMZVCRSA-N	0	3	310.825	2.441	10	0		DEAEHN
C[C@]1(C(=O)N(Cc2ccc(Cl)cc2)C2CC2)COC[C@@H]1N	ZINC000090592004	185305841	/nfs/dbraw/zinc/30/58/41/185305841.db2.gz	KFPPDRUYVLNKPB-HOCLYGCPSA-N	0	3	308.809	2.195	10	0		DEAEHN
CN(C)C[C@@H]1CSCCCN1C(=O)NCc1ccccc1	ZINC000090700234	185310652	/nfs/dbraw/zinc/31/06/52/185310652.db2.gz	SLHQMPFMMFMMAS-OAHLLOKOSA-N	0	3	307.463	2.265	10	0		DEAEHN
CCN(CC)C(=O)C[C@H](C)NCc1cn(C)nc1C(F)(F)F	ZINC000090666087	185308740	/nfs/dbraw/zinc/30/87/40/185308740.db2.gz	HCPSTTLTUIZAEG-JTQLQIEISA-N	0	3	320.359	2.176	10	0		DEAEHN
CN[C@H]1c2cc(OC)ccc2CC[C@H]1Sc1nncn1C	ZINC000092389752	185315577	/nfs/dbraw/zinc/31/55/77/185315577.db2.gz	ODKFEHRHCSHKLK-KGLIPLIRSA-N	0	3	304.419	2.191	10	0		DEAEHN
Cc1cc(CN2CCN3CCCC[C@@H]3C2)ccc1-n1cncn1	ZINC000092615985	185328843	/nfs/dbraw/zinc/32/88/43/185328843.db2.gz	FYYULPLFZPYTBQ-QGZVFWFLSA-N	0	3	311.433	2.246	10	0		DEAEHN
CCN1CCN(c2cccc(NC(=O)[C@H]3CC[C@@H](C)O3)c2)CC1	ZINC000184258682	282249797	/nfs/dbraw/zinc/24/97/97/282249797.db2.gz	IOISASWDBOEKRO-RHSMWYFYSA-N	0	3	317.433	2.335	10	0		DEAEHN
CC1(C)C(CNS(=O)(=O)c2ccc(F)c(CN)c2)C1(C)C	ZINC000092817190	185344081	/nfs/dbraw/zinc/34/40/81/185344081.db2.gz	OWQFDDHEJBQSFJ-UHFFFAOYSA-N	0	3	314.426	2.245	10	0		DEAEHN
C[NH2+]Cc1ccc(S(=O)(=O)[N-]C2C(C)(C)C2(C)C)c(F)c1	ZINC000092833336	185345036	/nfs/dbraw/zinc/34/50/36/185345036.db2.gz	DHBUPRYWPAQFHO-UHFFFAOYSA-N	0	3	314.426	2.258	10	0		DEAEHN
CCO[C@H]1C[C@H](N[C@@H]2c3ccccc3C[C@@H]2O)C12CCOCC2	ZINC000186271262	282271359	/nfs/dbraw/zinc/27/13/59/282271359.db2.gz	WJOJPPJKOUTQRI-XLAORIBOSA-N	0	3	317.429	2.209	10	0		DEAEHN
CCc1ncc(CN[C@H]2CCCN(c3ncccn3)C2)s1	ZINC000037924451	539335405	/nfs/dbraw/zinc/33/54/05/539335405.db2.gz	ZFUJHIPYWLSVSR-LBPRGKRZSA-N	0	3	303.435	2.254	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cnc(Cl)cn1	ZINC000192846196	282344398	/nfs/dbraw/zinc/34/43/98/282344398.db2.gz	BYRNSMBIXJKZQJ-LBPRGKRZSA-N	0	3	318.808	2.380	10	0		DEAEHN
c1nc2c(c(NC3CCN([C@H]4CCOC4)CC3)n1)CCCCC2	ZINC000089602760	539412017	/nfs/dbraw/zinc/41/20/17/539412017.db2.gz	XQCDBZZDJHRUPX-HNNXBMFYSA-N	0	3	316.449	2.411	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCC(C)(C)c2ccncc2)CCN1C	ZINC000092362427	539425408	/nfs/dbraw/zinc/42/54/08/539425408.db2.gz	YJFFYYZXIORQFD-ZBFHGGJFSA-N	0	3	318.465	2.483	10	0		DEAEHN
CC[C@@](C)(O)CNCc1ccc(I)o1	ZINC000083463159	192370404	/nfs/dbraw/zinc/37/04/04/192370404.db2.gz	JSIJXIINRODEOA-SNVBAGLBSA-N	0	3	309.147	2.135	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NC[C@@]1(C)CCCO1)c1ccccc1	ZINC000153838912	539546998	/nfs/dbraw/zinc/54/69/98/539546998.db2.gz	SOUYNRJZKXFAOH-DOTOQJQBSA-N	0	3	305.422	2.158	10	0		DEAEHN
C[C@@H](O)C(C)(C)NCc1cc2c(c(Br)c1)OCO2	ZINC000161141424	539589139	/nfs/dbraw/zinc/58/91/39/539589139.db2.gz	HALWYVGXXFLBDE-MRVPVSSYSA-N	0	3	316.195	2.427	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC(c2cccnc2N)CC1	ZINC000616608490	362897830	/nfs/dbraw/zinc/89/78/30/362897830.db2.gz	AHBJABOGRMLGFI-UHFFFAOYSA-N	0	3	320.437	2.368	10	0		DEAEHN
CCc1nn(C)cc1CN1CCC(C(=O)N[C@H](C)C(C)C)CC1	ZINC000179945272	539643437	/nfs/dbraw/zinc/64/34/37/539643437.db2.gz	ROXUELFFWBLZLN-CQSZACIVSA-N	0	3	320.481	2.355	10	0		DEAEHN
COc1cc2c(c(F)c1)CN(Cc1c(C)nn(C)c1C)[C@H]2CN	ZINC000071683469	191007530	/nfs/dbraw/zinc/00/75/30/191007530.db2.gz	ULUSOWMFOXZQGP-KRWDZBQOSA-N	0	3	318.396	2.200	10	0		DEAEHN
COc1ccc(Cl)c2c1CN(Cc1cnn(C)c1)[C@@H]2CN	ZINC000071684015	191008590	/nfs/dbraw/zinc/00/85/90/191008590.db2.gz	KHROYPXGCOHSDQ-CYBMUJFWSA-N	0	3	306.797	2.098	10	0		DEAEHN
CCCNCc1cc(F)c(F)c(S(=O)(=O)N(C)C(C)C)c1	ZINC000138334490	186015992	/nfs/dbraw/zinc/01/59/92/186015992.db2.gz	BIPWCFHZWVXLFV-UHFFFAOYSA-N	0	3	320.405	2.493	10	0		DEAEHN
CCCN[C@@H](C)c1ccc(OC)cc1OCCS(C)(=O)=O	ZINC000138547094	186017965	/nfs/dbraw/zinc/01/79/65/186017965.db2.gz	SKNAASQMRGMXEN-LBPRGKRZSA-N	0	3	315.435	2.179	10	0		DEAEHN
Cc1ccc([C@H]2NC3(CC3)C(=O)N2C2CCN(C)CC2)s1	ZINC000141194761	186029198	/nfs/dbraw/zinc/02/91/98/186029198.db2.gz	SIJKXRVXRYDUNL-AWEZNQCLSA-N	0	3	305.447	2.114	10	0		DEAEHN
CCCN(CCC)[C@]1(CN)CCS(=O)(=O)c2ccccc21	ZINC000147635970	186040563	/nfs/dbraw/zinc/04/05/63/186040563.db2.gz	GKEVCLXRXDRDKA-INIZCTEOSA-N	0	3	310.463	2.140	10	0		DEAEHN
Cc1ccc([C@@H]2NCC(=O)N2[C@@H](CC(C)C)CN(C)C)s1	ZINC000143962135	186034394	/nfs/dbraw/zinc/03/43/94/186034394.db2.gz	CCMQFIGKVRXNBI-XJKSGUPXSA-N	0	3	309.479	2.463	10	0		DEAEHN
CC[C@@H]1N[C@H](c2cccs2)N(C[C@@H]2CCCN(C)C2)C1=O	ZINC000144234688	186034866	/nfs/dbraw/zinc/03/48/66/186034866.db2.gz	LQXIORLZIYQVJO-IPYPFGDCSA-N	0	3	307.463	2.299	10	0		DEAEHN
CCCC[C@@H]1N[C@H](c2ccsc2)N([C@@H]2CCN(C)C2)C1=O	ZINC000145240999	186036848	/nfs/dbraw/zinc/03/68/48/186036848.db2.gz	WOWDNUAKNVJYNO-ILXRZTDVSA-N	0	3	307.463	2.441	10	0		DEAEHN
Cc1ccc([C@H]2NCC(=O)N2C[C@@H](C)N2CCCCC2)s1	ZINC000145700240	186038079	/nfs/dbraw/zinc/03/80/79/186038079.db2.gz	OYPVRGSOEGRIGV-WBMJQRKESA-N	0	3	307.463	2.361	10	0		DEAEHN
CCN[C@@H](c1ccc(Cl)c(OC)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000150147225	186055168	/nfs/dbraw/zinc/05/51/68/186055168.db2.gz	FIDPZPIVEIPWIZ-RISCZKNCSA-N	0	3	317.838	2.434	10	0		DEAEHN
CCOc1cc2c(cc1CNC(=O)[C@H](N)[C@H](C)CC)O[C@@H](C)C2	ZINC000150757697	186064402	/nfs/dbraw/zinc/06/44/02/186064402.db2.gz	QDMOIIIQPINQJE-BWACUDIHSA-N	0	3	320.433	2.398	10	0		DEAEHN
c1cc(CN[C@@H]2CCCSC2)c(OC[C@H]2CCOC2)cn1	ZINC000287133993	219335280	/nfs/dbraw/zinc/33/52/80/219335280.db2.gz	AICOBCSAGXPZFK-DZGCQCFKSA-N	0	3	308.447	2.482	10	0		DEAEHN
Fc1ccc(COC[C@H]2CNCCO2)cc1Br	ZINC000164012077	186146090	/nfs/dbraw/zinc/14/60/90/186146090.db2.gz	YLADHSHTTVLISA-SNVBAGLBSA-N	0	3	304.159	2.093	10	0		DEAEHN
CCC[C@@](F)(CN)c1c(Br)cnn1CCOC	ZINC000164035148	186146226	/nfs/dbraw/zinc/14/62/26/186146226.db2.gz	FBPQFVYFLPLSJK-LLVKDONJSA-N	0	3	308.195	2.216	10	0		DEAEHN
COc1ccc(CNC[C@H](C)[S@](C)=O)cc1Br	ZINC000159714916	186136887	/nfs/dbraw/zinc/13/68/87/186136887.db2.gz	QCANMSOULHSQPM-HUTHGQBESA-N	0	3	320.252	2.314	10	0		DEAEHN
CCOC(=O)[C@H](NCCN(C)C)c1ccc(F)c(Cl)c1	ZINC000163859544	186140252	/nfs/dbraw/zinc/14/02/52/186140252.db2.gz	AJCMBRLDZUKLKE-CYBMUJFWSA-N	0	3	302.777	2.235	10	0		DEAEHN
O=S1(=O)CCC[C@@H](NCc2c[nH]c3cc(Cl)ccc23)C1	ZINC000163880672	186141093	/nfs/dbraw/zinc/14/10/93/186141093.db2.gz	OQZAWJNFDUFMNT-GFCCVEGCSA-N	0	3	312.822	2.488	10	0		DEAEHN
CCCn1ncc(Br)c1C(=O)[C@@]1(C)CCCN1	ZINC000164372272	186157716	/nfs/dbraw/zinc/15/77/16/186157716.db2.gz	MFMMHNNHVRTKFU-GFCCVEGCSA-N	0	3	300.200	2.380	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2nnc(C(F)F)s2)CCN1C	ZINC000175647392	186184779	/nfs/dbraw/zinc/18/47/79/186184779.db2.gz	ZPLMLOVFXCYJGJ-SFYZADRCSA-N	0	3	319.381	2.422	10	0		DEAEHN
CC(C)NC(=O)CCN[C@H](c1ccc2c(c1)OCCO2)C1CC1	ZINC000179733460	186211633	/nfs/dbraw/zinc/21/16/33/186211633.db2.gz	JENAEEVHAGJXNO-SFHVURJKSA-N	0	3	318.417	2.413	10	0		DEAEHN
CC(C)[C@H](NCC(=O)NC(N)=O)c1cccc(C(F)(F)F)c1	ZINC000181897092	186216212	/nfs/dbraw/zinc/21/62/12/186216212.db2.gz	MOQNDHJJZAXWGH-LBPRGKRZSA-N	0	3	317.311	2.187	10	0		DEAEHN
CC(C)N(C)C(=O)[C@@H](C)N[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000181911115	186217665	/nfs/dbraw/zinc/21/76/65/186217665.db2.gz	GZKNJHSIDXSXMV-ZIAGYGMSSA-N	0	3	315.421	2.173	10	0		DEAEHN
C[C@H](NC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C)c1cccs1	ZINC000253246957	186300172	/nfs/dbraw/zinc/30/01/72/186300172.db2.gz	SKPWHUMYBVSHHZ-GKSGUAPZSA-N	0	3	308.447	2.458	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1ccc(C)cc1OC	ZINC000171908398	198005970	/nfs/dbraw/zinc/00/59/70/198005970.db2.gz	GSBDDNZQZUIRPS-AWEZNQCLSA-N	0	3	321.421	2.236	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000173261344	198202934	/nfs/dbraw/zinc/20/29/34/198202934.db2.gz	GJXUXZICTHXNEU-IUODEOHRSA-N	0	3	314.426	2.177	10	0		DEAEHN
C[C@@H](C(=O)N1CCO[C@@H](c2nccs2)C1)N1CCCCCC1	ZINC000173271734	198204149	/nfs/dbraw/zinc/20/41/49/198204149.db2.gz	VWIUVSLIZUPZPT-UONOGXRCSA-N	0	3	323.462	2.308	10	0		DEAEHN
O=C(Nc1ccc2c(c1)CNC2)N1CC[C@@]2(O)CCCC[C@@H]2C1	ZINC000333099094	539948642	/nfs/dbraw/zinc/94/86/42/539948642.db2.gz	ANKQPHJAYXNYHK-QAPCUYQASA-N	0	3	315.417	2.449	10	0		DEAEHN
Cc1csc([C@H](NC(=O)N2CC[C@H](N(C)C)C2)C2CC2)n1	ZINC000173914412	198267796	/nfs/dbraw/zinc/26/77/96/198267796.db2.gz	IOOWLHVFDRZKBR-QWHCGFSZSA-N	0	3	308.451	2.248	10	0		DEAEHN
Cc1ccc(O[C@@H](C)CNC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000173917056	198268407	/nfs/dbraw/zinc/26/84/07/198268407.db2.gz	IDYSKSZHDOOMSN-GJZGRUSLSA-N	0	3	305.422	2.108	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)[C@@H](O)c1ccccc1	ZINC000073010085	191268726	/nfs/dbraw/zinc/26/87/26/191268726.db2.gz	XAYTZGYVRJWYHM-MSOLQXFVSA-N	0	3	312.413	2.009	10	0		DEAEHN
C[C@H]1CC[C@H](C)N(C(=O)C(=O)Nc2cccc(CN(C)C)c2)C1	ZINC000173826799	198257794	/nfs/dbraw/zinc/25/77/94/198257794.db2.gz	COPGRAYMOZGOCO-KBPBESRZSA-N	0	3	317.433	2.334	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCc2cccc3c2OCO3)CCN1C	ZINC000174224990	198308296	/nfs/dbraw/zinc/30/82/96/198308296.db2.gz	VGZKJXRNGBTJDB-GXTWGEPZSA-N	0	3	319.405	2.039	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCc2cccc3c2OCO3)CCN1C	ZINC000174225003	198308462	/nfs/dbraw/zinc/30/84/62/198308462.db2.gz	VGZKJXRNGBTJDB-OCCSQVGLSA-N	0	3	319.405	2.039	10	0		DEAEHN
C[C@H](CC(=O)N1CC[C@@H](N(C)C)C1)C(=O)c1cccc(F)c1	ZINC000174584737	198355783	/nfs/dbraw/zinc/35/57/83/198355783.db2.gz	KJNVKYBEKMQTET-IUODEOHRSA-N	0	3	306.381	2.197	10	0		DEAEHN
O[C@H](CNc1nnc(-c2ccccc2)s1)CN1CCCCC1	ZINC000174684602	198370357	/nfs/dbraw/zinc/37/03/57/198370357.db2.gz	XLMPYJZVVANISQ-CQSZACIVSA-N	0	3	318.446	2.464	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCOC[C@@H]1CC(C)C	ZINC000073203328	191291297	/nfs/dbraw/zinc/29/12/97/191291297.db2.gz	RNXFTCPGLMTBHC-CVEARBPZSA-N	0	3	313.486	2.419	10	0		DEAEHN
O=C1Cc2c(ccc3c2O[C@@H](CNCc2ccccc2)CO3)N1	ZINC000003952389	181058703	/nfs/dbraw/zinc/05/87/03/181058703.db2.gz	DYJIKHYBKVODAC-ZDUSSCGKSA-N	0	3	310.353	2.111	10	0	investigational	DEAEHN
C[C@@H](CNC[C@H](O)c1ccccc1)NC(=O)Cc1ccccc1	ZINC000040504044	354169798	/nfs/dbraw/zinc/16/97/98/354169798.db2.gz	NMIXRSULZCHUEE-YJBOKZPZSA-N	0	3	312.413	2.057	10	0		DEAEHN
CN(C[C@H]1CCN(C)C1)C(=O)c1occc1Br	ZINC000081749525	355446876	/nfs/dbraw/zinc/44/68/76/355446876.db2.gz	KBICIMJOWAYVRJ-VIFPVBQESA-N	0	3	301.184	2.066	10	0		DEAEHN
c1nn(CCN2CCCCC2)cc1Nc1ccc2nccnc2n1	ZINC000092978273	355659197	/nfs/dbraw/zinc/65/91/97/355659197.db2.gz	AZMBVHKRFZYGSB-UHFFFAOYSA-N	0	3	323.404	2.451	10	0		DEAEHN
CC(C)[C@@H](NC(=O)NC[C@@H]1CCCN1C)c1nc(C2CC2)no1	ZINC000170812627	355993955	/nfs/dbraw/zinc/99/39/55/355993955.db2.gz	MWCLEZULBQLPGN-QWHCGFSZSA-N	0	3	321.425	2.038	10	0		DEAEHN
NC(=O)NC(=O)CN[C@H](CCc1ccccc1)c1ccccc1	ZINC000180386904	356049331	/nfs/dbraw/zinc/04/93/31/356049331.db2.gz	KXLGGRSSBUEBCV-MRXNPFEDSA-N	0	3	311.385	2.145	10	0		DEAEHN
CNC(=O)[C@@H]1C[C@@H](c2ccccc2OC(F)(F)F)CCN1	ZINC000080129559	192003829	/nfs/dbraw/zinc/00/38/29/192003829.db2.gz	XEHQKPNLUQMTAJ-ONGXEEELSA-N	0	3	302.296	2.167	10	0		DEAEHN
CC1(C)[C@H]2CC[C@](C)(C2)[C@@H]1NS(=O)(=O)C[C@@H]1CCCCN1	ZINC000080156938	192007278	/nfs/dbraw/zinc/00/72/78/192007278.db2.gz	YZDFCZKNTWKVFA-TTZDDIAXSA-N	0	3	314.495	2.263	10	0		DEAEHN
NC(=S)[C@@H](CN1CCN(CC2CC2)CC1)c1ccccc1	ZINC000080797186	192192414	/nfs/dbraw/zinc/19/24/14/192192414.db2.gz	DCOQTMQAEJYGNB-INIZCTEOSA-N	0	3	303.475	2.084	10	0		DEAEHN
Cc1nc(C)c(CN[C@H]2CCCN(c3ncccn3)C2)s1	ZINC000080693678	192182302	/nfs/dbraw/zinc/18/23/02/192182302.db2.gz	ANTULUBYNCFNOC-ZDUSSCGKSA-N	0	3	303.435	2.309	10	0		DEAEHN
NCc1cc(I)ncc1OC(F)(F)F	ZINC000238666006	356304926	/nfs/dbraw/zinc/30/49/26/356304926.db2.gz	NHZIWYXAWXDOBE-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
Ic1cnc([C@H]2NC[C@@H]2C2CC2)s1	ZINC000306898456	356406239	/nfs/dbraw/zinc/40/62/39/356406239.db2.gz	XHFWMAOOCMLTFN-SVRRBLITSA-N	0	3	306.172	2.418	10	0		DEAEHN
c1cnc(N2CCC[C@@H](NCc3cnc4ccccc4n3)C2)nc1	ZINC000324607563	356458264	/nfs/dbraw/zinc/45/82/64/356458264.db2.gz	JJCXNYYHPPNECL-CQSZACIVSA-N	0	3	320.400	2.178	10	0		DEAEHN
Brc1ccc(CN2CC[C@H]3OCCN[C@H]3C2)s1	ZINC000404284208	283164923	/nfs/dbraw/zinc/16/49/23/283164923.db2.gz	WTHSUJONCCOBOP-WDEREUQCSA-N	0	3	317.252	2.073	10	0		DEAEHN
CC(C)NCc1c(Cl)cccc1N1CCn2cnnc2C1	ZINC000081537726	192286598	/nfs/dbraw/zinc/28/65/98/192286598.db2.gz	UZMPHXTWRNOTKI-UHFFFAOYSA-N	0	3	305.813	2.450	10	0		DEAEHN
CCN(C)S(=O)(=O)c1cc(CNC2CC2)ccc1Cl	ZINC000088940456	192661485	/nfs/dbraw/zinc/66/14/85/192661485.db2.gz	JQXBIKDTNXPCSE-UHFFFAOYSA-N	0	3	302.827	2.232	10	0		DEAEHN
O[C@H](COC[C@@H]1CCCO1)CN1CC[C@H](c2ccccc2F)C1	ZINC000582015116	357287138	/nfs/dbraw/zinc/28/71/38/357287138.db2.gz	HZRGVXUKNLROAX-JYJNAYRXSA-N	0	3	323.408	2.172	10	0		DEAEHN
CCC[C@H](C)CN1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000180132846	199121272	/nfs/dbraw/zinc/12/12/72/199121272.db2.gz	BZQNBZRZJUJSDW-ZWKOTPCHSA-N	0	3	320.477	2.480	10	0		DEAEHN
C[C@H]1Cc2ccccc2CN1C[C@@H]1CCCN(S(C)(=O)=O)C1	ZINC000176348833	291166488	/nfs/dbraw/zinc/16/64/88/291166488.db2.gz	DFILTZIHZIUNKD-GJZGRUSLSA-N	0	3	322.474	2.105	10	0		DEAEHN
CO[C@H]1CN(C(=O)NCCN(C)Cc2ccccc2)CC[C@H]1C	ZINC000187424542	200110955	/nfs/dbraw/zinc/11/09/55/200110955.db2.gz	KATFFGUGYLNGBI-WBVHZDCISA-N	0	3	319.449	2.185	10	0		DEAEHN
CC(=O)Nc1ccc(C)c(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000188365072	200233739	/nfs/dbraw/zinc/23/37/39/200233739.db2.gz	GKOLZQCSFHZRFT-SUMWQHHRSA-N	0	3	317.433	2.412	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)c1cncc(Cl)n1	ZINC000189196259	200362997	/nfs/dbraw/zinc/36/29/97/200362997.db2.gz	KZFOGGFKBFIOLM-ZDUSSCGKSA-N	0	3	318.808	2.033	10	0		DEAEHN
Cn1nc(Br)cc1CNC[C@H]1CC(C)(C)CO1	ZINC000717624988	799426371	/nfs/dbraw/zinc/42/63/71/799426371.db2.gz	KTGDASUOUHYKHP-SNVBAGLBSA-N	0	3	302.216	2.087	10	0		DEAEHN
CSC1(CNC(=O)N[C@H](CN(C)C)c2ccccc2)CC1	ZINC000194819227	201295100	/nfs/dbraw/zinc/29/51/00/201295100.db2.gz	OPKYUCJGLORLNL-CQSZACIVSA-N	0	3	307.463	2.484	10	0		DEAEHN
CCCOC(=O)[C@H](C)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000195284169	201372538	/nfs/dbraw/zinc/37/25/38/201372538.db2.gz	FGHLUQYCDRPARC-DOTOQJQBSA-N	0	3	319.449	2.177	10	0		DEAEHN
CN(Cc1cccnc1)C[C@H]1CCN(CC(=O)OC(C)(C)C)C1	ZINC000195301659	201376113	/nfs/dbraw/zinc/37/61/13/201376113.db2.gz	QHCMMHREUXCROP-MRXNPFEDSA-N	0	3	319.449	2.177	10	0		DEAEHN
Cn1cncc1[C@H]1C[C@H](NCc2cccc3c2OCO3)CCO1	ZINC000275399920	212309738	/nfs/dbraw/zinc/30/97/38/212309738.db2.gz	CLEHTMPPIBJAKN-CZUORRHYSA-N	0	3	315.373	2.159	10	0		DEAEHN
O[C@H]1COCC[C@@H]1NCc1ccc(Br)cc1Cl	ZINC000623765822	365166437	/nfs/dbraw/zinc/16/64/37/365166437.db2.gz	WYTMDCHBWHYCGV-RYUDHWBXSA-N	0	3	320.614	2.342	10	0		DEAEHN
CN1CCOC[C@H]1CNCc1cc(Br)ccc1F	ZINC000623710749	365140519	/nfs/dbraw/zinc/14/05/19/365140519.db2.gz	MPGQDARURWIALL-GFCCVEGCSA-N	0	3	317.202	2.008	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)C[C@H](O)c1cccc(F)c1	ZINC000091229926	193024075	/nfs/dbraw/zinc/02/40/75/193024075.db2.gz	PIGGSQJIIUJAQZ-CVEARBPZSA-N	0	3	310.413	2.342	10	0		DEAEHN
Cc1nc(NC(=O)[C@@H](N)C(C)(C)C)ccc1Br	ZINC000091507096	193066127	/nfs/dbraw/zinc/06/61/27/193066127.db2.gz	JBKDIDCKRBJMOX-SNVBAGLBSA-N	0	3	300.200	2.464	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@H]1O)c1ccc(Br)cc1F	ZINC000624237847	365346977	/nfs/dbraw/zinc/34/69/77/365346977.db2.gz	FSQFLFYCJRZWHD-AQUOVQTQSA-N	0	3	318.186	2.389	10	0		DEAEHN
CC[C@@H]1C[C@H]1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450819793	242264342	/nfs/dbraw/zinc/26/43/42/242264342.db2.gz	MBCDTLRMWRPNAP-LMMKCTJWSA-N	0	3	316.445	2.128	10	0		DEAEHN
COc1ccc(CN2CCC(N3CCO[C@@H](C)C3)CC2)cc1O	ZINC000092079289	193154922	/nfs/dbraw/zinc/15/49/22/193154922.db2.gz	KZFDSYLXGNWLLG-AWEZNQCLSA-N	0	3	320.433	2.086	10	0		DEAEHN
CCNCc1csc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)c1	ZINC000092113452	193161192	/nfs/dbraw/zinc/16/11/92/193161192.db2.gz	CXSSRQHABRSTPE-GHMZBOCLSA-N	0	3	302.465	2.134	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2[C@H](C)CCC[C@H]2C)c(F)c1	ZINC000092115549	193163161	/nfs/dbraw/zinc/16/31/61/193163161.db2.gz	PTMDCWRLURKHCX-VXGBXAGGSA-N	0	3	314.426	2.497	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N(CC)C(C)C)c(F)c1	ZINC000092115589	193163395	/nfs/dbraw/zinc/16/33/95/193163395.db2.gz	PZCLTUCJRVWSSR-UHFFFAOYSA-N	0	3	302.415	2.354	10	0		DEAEHN
CC1CCC(N(C)S(=O)(=O)c2ccc(CN)cc2F)CC1	ZINC000092115901	193163960	/nfs/dbraw/zinc/16/39/60/193163960.db2.gz	FLGVWABDOAEKDW-UHFFFAOYSA-N	0	3	314.426	2.484	10	0		DEAEHN
CN(c1ccccc1F)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092116037	193164041	/nfs/dbraw/zinc/16/40/41/193164041.db2.gz	UNIRRDFCZVWHPI-UHFFFAOYSA-N	0	3	312.341	2.249	10	0		DEAEHN
CC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@H]2CC2(C)C)c(F)c1	ZINC000092116021	193164359	/nfs/dbraw/zinc/16/43/59/193164359.db2.gz	SVIBOAOGQUORMH-ZDUSSCGKSA-N	0	3	300.399	2.012	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)CN[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)c1	ZINC000528757636	284001497	/nfs/dbraw/zinc/00/14/97/284001497.db2.gz	NDUSDBSOKGHRKA-XPZRHXQJSA-N	0	3	304.390	2.229	10	0		DEAEHN
c1cc(CN[C@H]2COC3(CCC3)C2)cc(N2CCSCC2)n1	ZINC000631723350	368357690	/nfs/dbraw/zinc/35/76/90/368357690.db2.gz	HSGCCPRWLBPPQG-OAHLLOKOSA-N	0	3	319.474	2.436	10	0		DEAEHN
O=C(CC/C=C\c1ccccc1)NC[C@@H]1CCCN1CCCO	ZINC000452362148	244194539	/nfs/dbraw/zinc/19/45/39/244194539.db2.gz	KNEVOTWQDYHFRL-JDTSAYOFSA-N	0	3	316.445	2.443	10	0		DEAEHN
COc1cc(C[NH2+]CC2(C)COC2)cc(Br)c1[O-]	ZINC000093232504	193219734	/nfs/dbraw/zinc/21/97/34/193219734.db2.gz	FJVISLQHXRDPAA-UHFFFAOYSA-N	0	3	316.195	2.289	10	0		DEAEHN
COC(=O)[C@@]1(NC2CC2)CC[C@H](N(C)CCC(F)(F)F)C1	ZINC000093831847	193314719	/nfs/dbraw/zinc/31/47/19/193314719.db2.gz	IGQVLEAJDIDDBA-WCQYABFASA-N	0	3	308.344	2.087	10	0		DEAEHN
CN[C@@]1(C(N)=O)CC[C@@H](Oc2ccccc2C(F)(F)F)C1	ZINC000093836634	193314946	/nfs/dbraw/zinc/31/49/46/193314946.db2.gz	ZRSPGFPJAXFYPG-RNCFNFMXSA-N	0	3	302.296	2.080	10	0		DEAEHN
CCN[C@@]1(C(N)=O)CC[C@H](Sc2nc3ccccc3[nH]2)C1	ZINC000093850322	193317335	/nfs/dbraw/zinc/31/73/35/193317335.db2.gz	HJLHYROCIYZNQX-BONVTDFDSA-N	0	3	304.419	2.041	10	0		DEAEHN
CCN[C@]1(C(N)=O)CC[C@H](Sc2nc3ccccc3[nH]2)C1	ZINC000093850321	193318085	/nfs/dbraw/zinc/31/80/85/193318085.db2.gz	HJLHYROCIYZNQX-ZUZCIYMTSA-N	0	3	304.419	2.041	10	0		DEAEHN
CCCN[C@@H]1CCCc2sc([C@H]3CN(C)CCN3C)nc21	ZINC000093896271	193324894	/nfs/dbraw/zinc/32/48/94/193324894.db2.gz	PRMZQGUWIPVGMH-CHWSQXEVSA-N	0	3	308.495	2.438	10	0		DEAEHN
CCCN[C@@H](c1cc(Cl)cnc1N)[C@@H]1CN(CC)CCO1	ZINC000093915257	193327979	/nfs/dbraw/zinc/32/79/79/193327979.db2.gz	XJACFGXMCJZDGD-KBPBESRZSA-N	0	3	312.845	2.079	10	0		DEAEHN
CC1(C)CCC[C@H](CN2CCN(c3nccs3)CC2)[C@H]1O	ZINC000094289137	193356079	/nfs/dbraw/zinc/35/60/79/193356079.db2.gz	NNLXYGUMCZTBJS-ZIAGYGMSSA-N	0	3	309.479	2.452	10	0		DEAEHN
CCC(CC)NC(=O)COc1c(F)cc(CNC)cc1F	ZINC000094346523	193363623	/nfs/dbraw/zinc/36/36/23/193363623.db2.gz	NYULSUPCJXUTIQ-UHFFFAOYSA-N	0	3	300.349	2.368	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@@H](C)Oc1c(F)cc(CN)cc1F	ZINC000094346195	193363707	/nfs/dbraw/zinc/36/37/07/193363707.db2.gz	QGSGSOPLEMABND-VHSXEESVSA-N	0	3	300.349	2.496	10	0		DEAEHN
CCNCc1cc(F)c(OCCCC(=O)N(C)C)c(F)c1	ZINC000094347067	193363837	/nfs/dbraw/zinc/36/38/37/193363837.db2.gz	NSSCZYKRBAGFAD-UHFFFAOYSA-N	0	3	300.349	2.322	10	0		DEAEHN
CNCc1ccc(OCC(=O)Nc2cccc(Cl)c2)cn1	ZINC000094209062	193349743	/nfs/dbraw/zinc/34/97/43/193349743.db2.gz	TXKYUYMRDNVXKU-UHFFFAOYSA-N	0	3	305.765	2.472	10	0		DEAEHN
CCC(N)(CC)C(=O)Nc1cc(C(=O)OC)c(F)cc1F	ZINC000094244252	193354537	/nfs/dbraw/zinc/35/45/37/193354537.db2.gz	NCAYUEWXLNKAGF-UHFFFAOYSA-N	0	3	300.305	2.207	10	0		DEAEHN
CCN(CC)C(C)(C)[C@H](O)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094641324	193388633	/nfs/dbraw/zinc/38/86/33/193388633.db2.gz	HRONOBNUADJUIB-MELADBBJSA-N	0	3	305.484	2.071	10	0		DEAEHN
CCS(=O)(=O)c1ccc(NC(=O)[C@H](CN)CC(C)C)cc1	ZINC000094697651	193391910	/nfs/dbraw/zinc/39/19/10/193391910.db2.gz	NDLUSELVECGYGE-LBPRGKRZSA-N	0	3	312.435	2.040	10	0		DEAEHN
CN1CCCC[C@H]1CNc1nc(Br)cn2ccnc12	ZINC000094489915	193373229	/nfs/dbraw/zinc/37/32/29/193373229.db2.gz	COKOTVBNLAPUHZ-JTQLQIEISA-N	0	3	324.226	2.388	10	0		DEAEHN
CCn1c(-c2cc(C)oc2C)nnc1N1CCN2CCC[C@@H]2C1	ZINC000282774447	217241621	/nfs/dbraw/zinc/24/16/21/217241621.db2.gz	MCHPJRXFSBHTDC-CQSZACIVSA-N	0	3	315.421	2.459	10	0		DEAEHN
C[C@H](NCCN1CCOCC1)c1ccccc1Br	ZINC000019954332	182170297	/nfs/dbraw/zinc/17/02/97/182170297.db2.gz	HSHGIQDHEXODBZ-LBPRGKRZSA-N	0	3	313.239	2.432	10	0		DEAEHN
Cc1ccsc1[C@H](CN)N1CCN(c2nccs2)CC1	ZINC000020565497	182233107	/nfs/dbraw/zinc/23/31/07/182233107.db2.gz	QOWWTZTYYGMDJJ-LBPRGKRZSA-N	0	3	308.476	2.335	10	0		DEAEHN
CC(C)[C@@H]1OCC[C@@H]1CN[C@@H](C(=O)N(C)C)c1ccccc1	ZINC000267441043	206068269	/nfs/dbraw/zinc/06/82/69/206068269.db2.gz	PDSWPAJXBIVFLT-ZACQAIPSSA-N	0	3	304.434	2.467	10	0		DEAEHN
C[C@@H]1CN([C@H](CN)c2ccc(Br)o2)C[C@@H](C)O1	ZINC000022215192	182313745	/nfs/dbraw/zinc/31/37/45/182313745.db2.gz	RQKWILGPCSQRSX-OPRDCNLKSA-N	0	3	303.200	2.151	10	0		DEAEHN
CCc1oc(C(=O)N(CCN(C)C)C[C@H]2CCCO2)cc1C	ZINC000155451885	291606245	/nfs/dbraw/zinc/60/62/45/291606245.db2.gz	BZSJLUAYFFSQPA-CQSZACIVSA-N	0	3	308.422	2.333	10	0		DEAEHN
CC(C)[C@@H](NCc1nnc(C2CC2)n1C)C1(CO)CCCC1	ZINC000459548834	248645083	/nfs/dbraw/zinc/64/50/83/248645083.db2.gz	YJSULDXUXURNND-OAHLLOKOSA-N	0	3	306.454	2.359	10	0		DEAEHN
CCOC(=O)CCN(C)C[C@@H](C(=O)OCC)c1ccccc1	ZINC000039286584	183016364	/nfs/dbraw/zinc/01/63/64/183016364.db2.gz	ZWQJIPBVYNPNIG-OAHLLOKOSA-N	0	3	307.390	2.218	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2ccc(-c3nccs3)cc2)C1	ZINC000040634078	183111849	/nfs/dbraw/zinc/11/18/49/183111849.db2.gz	CXTIHTREPYZXBF-OLZOCXBDSA-N	0	3	303.387	2.126	10	0		DEAEHN
CC[C@H](N)C(=O)Nc1ccc(NC(C)=O)cc1C(F)(F)F	ZINC000040856313	183142616	/nfs/dbraw/zinc/14/26/16/183142616.db2.gz	HSKHTOONYMMLBE-JTQLQIEISA-N	0	3	303.284	2.340	10	0		DEAEHN
COc1ccc([C@@H](NC(=O)[C@@H](N)CCSC)C2CC2)cc1	ZINC000040856195	183143043	/nfs/dbraw/zinc/14/30/43/183143043.db2.gz	VVKSKKZSXYSVIZ-GJZGRUSLSA-N	0	3	308.447	2.343	10	0		DEAEHN
CNCc1cccc(Br)c1O[C@H]1CCC[C@@H]1O	ZINC000042411602	183266004	/nfs/dbraw/zinc/26/60/04/183266004.db2.gz	WSGHFGJYIXXDLR-RYUDHWBXSA-N	0	3	300.196	2.461	10	0		DEAEHN
C[C@@H](O)COc1c(Br)cccc1CNC1CC1	ZINC000042411977	183266197	/nfs/dbraw/zinc/26/61/97/183266197.db2.gz	JZBYJZVBZOGQEZ-SECBINFHSA-N	0	3	300.196	2.461	10	0		DEAEHN
CCCNCc1cccc(Br)c1OCCC(N)=O	ZINC000042411787	183266347	/nfs/dbraw/zinc/26/63/47/183266347.db2.gz	JDGBTMRJLHFQAP-UHFFFAOYSA-N	0	3	315.211	2.203	10	0		DEAEHN
CNCc1ccc(Br)cc1N(CCO)C(C)C	ZINC000042480247	183275207	/nfs/dbraw/zinc/27/52/07/183275207.db2.gz	JLBRGSKSZOPTMR-UHFFFAOYSA-N	0	3	301.228	2.376	10	0		DEAEHN
CCN1CCC(N(C)c2nc(C)cc(C)c2C(N)=S)CC1	ZINC000042681610	183296379	/nfs/dbraw/zinc/29/63/79/183296379.db2.gz	VYNPARUJIDXWTI-UHFFFAOYSA-N	0	3	306.479	2.253	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccc(Cl)cc1)N(C)CC(=O)N1CCCC1	ZINC000042946065	183319777	/nfs/dbraw/zinc/31/97/77/183319777.db2.gz	OTAFUFTYPPSWEX-WBMJQRKESA-N	0	3	309.841	2.283	10	0		DEAEHN
CC[C@@H](N)[C@H](c1cccc(Cl)c1)N(C)CC(=O)NC1CC1	ZINC000043014414	183327537	/nfs/dbraw/zinc/32/75/37/183327537.db2.gz	SYLSHAJZKYEIAD-ZBFHGGJFSA-N	0	3	309.841	2.329	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccc(Cl)s1)N(C)CC(=O)N1CCCC1	ZINC000043253439	183347674	/nfs/dbraw/zinc/34/76/74/183347674.db2.gz	WCGXNWCUWRRZIW-HZMBPMFUSA-N	0	3	315.870	2.344	10	0		DEAEHN
CC(=O)N1CCCN([C@H](c2ccc(Cl)s2)[C@@H](C)N)CC1	ZINC000043254139	183347839	/nfs/dbraw/zinc/34/78/39/183347839.db2.gz	IXPAGFMYBAZTHB-YGRLFVJLSA-N	0	3	315.870	2.344	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccc(Br)s1)N1CCC(O)CC1	ZINC000043258811	183348401	/nfs/dbraw/zinc/34/84/01/183348401.db2.gz	ALEXZEHWKQXYFY-UFBFGSQYSA-N	0	3	319.268	2.356	10	0		DEAEHN
Cc1ccc([C@H](Oc2cccc(S(C)(=O)=O)c2)[C@@H](C)N)o1	ZINC000043366995	183357310	/nfs/dbraw/zinc/35/73/10/183357310.db2.gz	LTOFSEPSVKDLHS-IAQYHMDHSA-N	0	3	309.387	2.459	10	0		DEAEHN
Cc1ccc([C@H](Oc2ccc(S(C)(=O)=O)cc2)[C@@H](C)N)o1	ZINC000043366989	183357591	/nfs/dbraw/zinc/35/75/91/183357591.db2.gz	UJBJXWSZZTXMIH-IAQYHMDHSA-N	0	3	309.387	2.459	10	0		DEAEHN
CN1CCC[C@H](Nc2nc3c(cc2C(N)=S)CCCC3)C1	ZINC000043410900	183360374	/nfs/dbraw/zinc/36/03/74/183360374.db2.gz	NGVCWPAQYYBGKS-LBPRGKRZSA-N	0	3	304.463	2.101	10	0		DEAEHN
C[C@H](C(=O)N1CCCCCC1)N1CCC(Cn2cccn2)CC1	ZINC000105886640	194157788	/nfs/dbraw/zinc/15/77/88/194157788.db2.gz	HSNIDKZRTQIZFT-MRXNPFEDSA-N	0	3	318.465	2.386	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2ncc(-c3ccc(F)cc3)o2)CCO1	ZINC000105926129	194171564	/nfs/dbraw/zinc/17/15/64/194171564.db2.gz	KTSAGHGRXYPKLB-OAHLLOKOSA-N	0	3	319.380	2.243	10	0		DEAEHN
CO[C@H]1C[C@@H](CN(C)C(=O)c2nccc3ccccc32)N(C)C1	ZINC000285338785	218388554	/nfs/dbraw/zinc/38/85/54/218388554.db2.gz	WASNVRLGZPMUFF-GJZGRUSLSA-N	0	3	313.401	2.026	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2ccc(C)c(Br)c2)C1	ZINC000109436560	194263252	/nfs/dbraw/zinc/26/32/52/194263252.db2.gz	ONSKYZZSVLGXBM-PWSUYJOCSA-N	0	3	313.195	2.073	10	0		DEAEHN
CC(C)(C(N)=S)N1CCN(Cc2ccc(F)cc2F)CC1	ZINC000109470833	194266598	/nfs/dbraw/zinc/26/65/98/194266598.db2.gz	DLLOQTXAGHHZJW-UHFFFAOYSA-N	0	3	313.417	2.147	10	0		DEAEHN
C[C@@H](C(N)=S)N1CCN(Cc2ccc(F)cc2Cl)CC1	ZINC000109468552	194266746	/nfs/dbraw/zinc/26/67/46/194266746.db2.gz	TWJFRDVMLIOBHW-JTQLQIEISA-N	0	3	315.845	2.271	10	0		DEAEHN
CN[C@@H](CN1CCN(C)C1=O)c1cccc(C(F)(F)F)c1	ZINC000052885691	183878911	/nfs/dbraw/zinc/87/89/11/183878911.db2.gz	PHVDWJLEBQTAKN-LBPRGKRZSA-N	0	3	301.312	2.333	10	0		DEAEHN
CN(CC1CCCC1)S(=O)(=O)c1ccc(F)c(CN)c1	ZINC000110838671	194363272	/nfs/dbraw/zinc/36/32/72/194363272.db2.gz	RZPNBJCJASXBRF-UHFFFAOYSA-N	0	3	300.399	2.095	10	0		DEAEHN
CCc1ccc(S(=O)(=O)N(CC)[C@@H]2CCCNC2)s1	ZINC000110941612	194372645	/nfs/dbraw/zinc/37/26/45/194372645.db2.gz	BWCITZYWLXXWNK-LLVKDONJSA-N	0	3	302.465	2.073	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1nc(SC)ns1	ZINC000156812226	197142367	/nfs/dbraw/zinc/14/23/67/197142367.db2.gz	UCCJNDFIPOLOOP-SECBINFHSA-N	0	3	315.468	2.208	10	0		DEAEHN
CCNC(C)(C)C(=O)Nc1cc(Cl)ccc1-n1cncn1	ZINC000061290791	184167523	/nfs/dbraw/zinc/16/75/23/184167523.db2.gz	MNPKFGYTBDUHGV-UHFFFAOYSA-N	0	3	307.785	2.247	10	0		DEAEHN
CCNC(C)(C)C(=O)Nc1cc(C(=O)N(C)C)ccc1Cl	ZINC000061290138	184167593	/nfs/dbraw/zinc/16/75/93/184167593.db2.gz	JCXKBKVAQAVQCC-UHFFFAOYSA-N	0	3	311.813	2.368	10	0		DEAEHN
CN(C)CCN1CCN(Cc2nc(Cl)ccc2Cl)CC1	ZINC000061644145	184180172	/nfs/dbraw/zinc/18/01/72/184180172.db2.gz	BEMBPFQDEOYRNL-UHFFFAOYSA-N	0	3	317.264	2.068	10	0		DEAEHN
COc1ccc(Br)cc1[C@@H](N)C[C@@H](C)CC(N)=O	ZINC000061830212	184188882	/nfs/dbraw/zinc/18/88/82/184188882.db2.gz	ZDUJJEUIJNGLAD-KCJUWKMLSA-N	0	3	315.211	2.359	10	0		DEAEHN
Cc1cc(S(=O)(=O)NCc2ccccc2CN)c(C)s1	ZINC000061841293	184189334	/nfs/dbraw/zinc/18/93/34/184189334.db2.gz	FTXBKYBFUHXJPH-UHFFFAOYSA-N	0	3	310.444	2.302	10	0		DEAEHN
CCNCc1cc(Br)cnc1N1CCCOCC1	ZINC000061935338	184196894	/nfs/dbraw/zinc/19/68/94/184196894.db2.gz	BUIHXQFXLMFKKE-UHFFFAOYSA-N	0	3	314.227	2.180	10	0		DEAEHN
COCCCN(C)[C@@H](CN)c1cc2c(c(Cl)c1)OCO2	ZINC000062029707	184202253	/nfs/dbraw/zinc/20/22/53/184202253.db2.gz	IWQVAEFRSILOFQ-LBPRGKRZSA-N	0	3	300.786	2.037	10	0		DEAEHN
NC[C@H](c1ccccc1Br)N1CCn2ccnc2C1	ZINC000062246031	184225212	/nfs/dbraw/zinc/22/52/12/184225212.db2.gz	KIPLGUFWJKYZSI-CYBMUJFWSA-N	0	3	321.222	2.161	10	0		DEAEHN
COCCNCc1ccccc1-n1cc(Br)cn1	ZINC000062738741	184252131	/nfs/dbraw/zinc/25/21/31/184252131.db2.gz	RZWLTTQSVSUANV-UHFFFAOYSA-N	0	3	310.195	2.371	10	0		DEAEHN
COc1ccc([C@@H]2NCCc3nc[nH]c32)cc1CN1CCCC1	ZINC000065408285	184339041	/nfs/dbraw/zinc/33/90/41/184339041.db2.gz	UXTZQWBOZSHQKE-KRWDZBQOSA-N	0	3	312.417	2.249	10	0		DEAEHN
COc1cc(CNCc2cccnc2-n2cccn2)ccc1O	ZINC000192945826	207370183	/nfs/dbraw/zinc/37/01/83/207370183.db2.gz	WLIBNTVEPWBLNR-UHFFFAOYSA-N	0	3	310.357	2.271	10	0		DEAEHN
COc1ccccc1S(=O)(=O)Cc1ccc(F)cc1CN	ZINC000068609488	184493559	/nfs/dbraw/zinc/49/35/59/184493559.db2.gz	HQIWPVZZCVYNAP-UHFFFAOYSA-N	0	3	309.362	2.267	10	0		DEAEHN
O=C1[C@@H](N[C@H]2CCc3ccccc32)CCN1C1CCOCC1	ZINC000358201219	284981578	/nfs/dbraw/zinc/98/15/78/284981578.db2.gz	JKTWXPCNBJDWBP-IRXDYDNUSA-N	0	3	300.402	2.043	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCO[C@H](c3ccsc3)C2)C1	ZINC000119733194	195026771	/nfs/dbraw/zinc/02/67/71/195026771.db2.gz	OIPGEKAFAWMPRD-GJZGRUSLSA-N	0	3	323.462	2.315	10	0		DEAEHN
N[C@@H](c1cc(F)cc(C(F)(F)F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000159215641	197337590	/nfs/dbraw/zinc/33/75/90/197337590.db2.gz	KLFZBSYOXQUJBR-WRWORJQWSA-N	0	3	311.300	2.279	10	0		DEAEHN
COc1cc2c(cc1[C@@H](CN)N1CCSCC1)O[C@@H](C)C2	ZINC000159053812	197322353	/nfs/dbraw/zinc/32/23/53/197322353.db2.gz	ZNNPURILVWNACL-SMDDNHRTSA-N	0	3	308.447	2.067	10	0		DEAEHN
CCCN[C@H]1CCN(c2c(F)c(F)c(F)c(F)c2F)C1=O	ZINC000158938482	197312931	/nfs/dbraw/zinc/31/29/31/197312931.db2.gz	ZWUKNDCGLPUEOS-LURJTMIESA-N	0	3	308.250	2.487	10	0		DEAEHN
C[C@@H](N)c1cccc(S(=O)(=O)N2CCSC(C)(C)C2)c1	ZINC000158873530	197306926	/nfs/dbraw/zinc/30/69/26/197306926.db2.gz	VTUFXAUJBMEFQD-LLVKDONJSA-N	0	3	314.476	2.222	10	0		DEAEHN
C[C@H]([C@H](O)c1c(Br)cnn1CCN(C)C)C1CC1	ZINC000158856082	197306496	/nfs/dbraw/zinc/30/64/96/197306496.db2.gz	AURLOYXPMFCPMH-ZANVPECISA-N	0	3	316.243	2.287	10	0		DEAEHN
N[C@@H](c1ccc2c3c(cccc31)CC2)[C@@H]1CCS(=O)(=O)C1	ZINC000158780135	197300858	/nfs/dbraw/zinc/30/08/58/197300858.db2.gz	BJABGPNOWXBLKX-CXAGYDPISA-N	0	3	301.411	2.373	10	0		DEAEHN
CNCc1sc(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)cc1C	ZINC000158768254	197299818	/nfs/dbraw/zinc/29/98/18/197299818.db2.gz	GXCVGXXNZLPMIL-TXEJJXNPSA-N	0	3	314.476	2.197	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)s1	ZINC000158744986	197297982	/nfs/dbraw/zinc/29/79/82/197297982.db2.gz	QLJMWCIXFZOIIO-TXEJJXNPSA-N	0	3	314.476	2.278	10	0		DEAEHN
CC(C)CO[C@@H]1CCN(C(=O)N[C@@H](CC(C)C)CN(C)C)C1	ZINC000158618407	197288940	/nfs/dbraw/zinc/28/89/40/197288940.db2.gz	YQGKPABRTDSZGN-JKSUJKDBSA-N	0	3	313.486	2.419	10	0		DEAEHN
CCN[C@@H](c1cscn1)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000158593753	197287093	/nfs/dbraw/zinc/28/70/93/197287093.db2.gz	SRCAAKTVDJEEHX-GMXVVIOVSA-N	0	3	302.465	2.397	10	0		DEAEHN
CCN[C@@H](c1cscn1)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000158593476	197287022	/nfs/dbraw/zinc/28/70/22/197287022.db2.gz	SRCAAKTVDJEEHX-NTZNESFSSA-N	0	3	302.465	2.397	10	0		DEAEHN
CN[C@H](Cc1cccc(F)c1Br)C(OC)OC	ZINC000157453730	197188119	/nfs/dbraw/zinc/18/81/19/197188119.db2.gz	OSEYKPIEMHFJCT-SNVBAGLBSA-N	0	3	306.175	2.338	10	0		DEAEHN
C[C@@]1(CNC(=O)c2c[nH]c(=NN)c(Cl)c2)CCCS1	ZINC000157175721	197167764	/nfs/dbraw/zinc/16/77/64/197167764.db2.gz	PQRWNCLOZPZFGQ-LBPRGKRZSA-N	0	3	300.815	2.036	10	0		DEAEHN
Cc1ccccc1[S@](=O)CC(=O)Nc1cccc(CN)c1	ZINC000156013806	197080748	/nfs/dbraw/zinc/08/07/48/197080748.db2.gz	BVFQKJAJDXLWLN-NRFANRHFSA-N	0	3	302.399	2.200	10	0		DEAEHN
Cc1c(F)cccc1NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000120521552	195182505	/nfs/dbraw/zinc/18/25/05/195182505.db2.gz	HQKXYUISLIYBRX-DGCLKSJQSA-N	0	3	321.396	2.014	10	0		DEAEHN
COc1c(C)cc(CN2CCN(C[C@@H](C)O)[C@H](C)C2)cc1C	ZINC000120602796	195199961	/nfs/dbraw/zinc/19/99/61/195199961.db2.gz	NAVOWZBIMCMCJU-HZPDHXFCSA-N	0	3	306.450	2.199	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)C(=O)Nc2cccc(Cl)c2)CCN1C	ZINC000120623526	195204008	/nfs/dbraw/zinc/20/40/08/195204008.db2.gz	RKUQOEPSEALSLJ-FZMZJTMJSA-N	0	3	323.824	2.220	10	0		DEAEHN
c1csc(CN2C[C@@H]3CCN(Cc4ccncc4)C[C@@H]3C2)n1	ZINC000247840307	257116610	/nfs/dbraw/zinc/11/66/10/257116610.db2.gz	PLOLVINQEUXICS-JKSUJKDBSA-N	0	3	314.458	2.492	10	0		DEAEHN
COC[C@H](C)CNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179150513	285336325	/nfs/dbraw/zinc/33/63/25/285336325.db2.gz	QKNPTPMAFPIPAA-VNQPRFMTSA-N	0	3	305.422	2.014	10	0		DEAEHN
COC[C@H](C)OC[C@H](O)CN1CC[C@@H](C)C[C@H]1c1ccco1	ZINC000377082184	285360276	/nfs/dbraw/zinc/36/02/76/285360276.db2.gz	KBHRMLOXORPJOQ-QXSJWSMHSA-N	0	3	311.422	2.465	10	0		DEAEHN
CC(C)N1CCO[C@@H](CN2CCN(C[C@H]3CC=CCC3)CC2)C1	ZINC000121030346	195282338	/nfs/dbraw/zinc/28/23/38/195282338.db2.gz	QLUXXUBMRHXYLX-OALUTQOASA-N	0	3	321.509	2.070	10	0		DEAEHN
CC(C)N(C)CC(=O)N[C@H](C)c1ccccc1-n1cccn1	ZINC000121657542	195325599	/nfs/dbraw/zinc/32/55/99/195325599.db2.gz	LXVVSZSZPMVTEA-CQSZACIVSA-N	0	3	300.406	2.390	10	0		DEAEHN
COc1ccc(C(=O)N2CC[C@H](N(C)C)C2)c(OCC2CC2)c1	ZINC000188400142	533311453	/nfs/dbraw/zinc/31/14/53/533311453.db2.gz	JDEBEHSXCLHBRH-AWEZNQCLSA-N	0	3	318.417	2.260	10	0		DEAEHN
C[C@@H](C(=O)N1CCC(c2cc[nH]n2)CC1)N1CCCCCC1	ZINC000174031242	132506768	/nfs/dbraw/zinc/50/67/68/132506768.db2.gz	RAISMBYBXKHLCZ-AWEZNQCLSA-N	0	3	304.438	2.380	10	0		DEAEHN
CN(C)CCN(CC1CCCCC1)C(=O)NCCc1cn[nH]c1	ZINC000360297727	133173978	/nfs/dbraw/zinc/17/39/78/133173978.db2.gz	YXEZHVDSUCUYEK-UHFFFAOYSA-N	0	3	321.469	2.106	10	0		DEAEHN
C=Cc1ccc(CCNC(=O)NCCNc2ccncc2)cc1	ZINC000362147056	133214100	/nfs/dbraw/zinc/21/41/00/133214100.db2.gz	POIAZHLUMGKVEZ-UHFFFAOYSA-N	0	3	310.401	2.100	10	0		DEAEHN
Cn1ncc(Br)c1CNc1nc2ccc(F)cc2[nH]1	ZINC000362627821	133242102	/nfs/dbraw/zinc/24/21/02/133242102.db2.gz	PSJCERRLPILLRN-UHFFFAOYSA-N	0	3	324.157	2.232	10	0		DEAEHN
CC(C)C[C@H](NC(=O)CC1CCN(C)CC1)C(=O)OC(C)C	ZINC000362852665	133255115	/nfs/dbraw/zinc/25/51/15/133255115.db2.gz	RPNJMKILWTXJDF-HNNXBMFYSA-N	0	3	312.454	2.201	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)CCc2nc(C(C)(C)C)no2)CCN1C	ZINC000123055574	144696662	/nfs/dbraw/zinc/69/66/62/144696662.db2.gz	WZSUUUKQBFLWDD-OLZOCXBDSA-N	0	3	322.453	2.241	10	0		DEAEHN
O=C([C@H]1C[C@H]1c1cccc(F)c1F)N1CCN2CCC1CC2	ZINC000188668570	145015612	/nfs/dbraw/zinc/01/56/12/145015612.db2.gz	YUTSRXMUGPZWHW-KBPBESRZSA-N	0	3	306.356	2.375	10	0		DEAEHN
Cn1ccnc1[C@@H](O)C1CCN(C[C@H](O)CC2CCCC2)CC1	ZINC000190915143	145049996	/nfs/dbraw/zinc/04/99/96/145049996.db2.gz	KVUKAYONXNAZGV-SJORKVTESA-N	0	3	321.465	2.107	10	0		DEAEHN
Cc1csc2c1ncnc2N1CCN(C2CCOCC2)CC1	ZINC000192645406	145076748	/nfs/dbraw/zinc/07/67/48/145076748.db2.gz	UYCRSFFFUAGFLD-UHFFFAOYSA-N	0	3	318.446	2.301	10	0		DEAEHN
C[C@@H]1COCCN1CCN1CCC(Nc2ccccc2F)CC1	ZINC000192760751	145078311	/nfs/dbraw/zinc/07/83/11/145078311.db2.gz	PKNLWQARGDOKPY-OAHLLOKOSA-N	0	3	321.440	2.423	10	0		DEAEHN
Cc1ccc(OCCNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000246133358	145093372	/nfs/dbraw/zinc/09/33/72/145093372.db2.gz	JBDLRHWQUIZCEQ-HOTGVXAUSA-N	0	3	319.449	2.498	10	0		DEAEHN
C[C@H](C(=O)N(C)C)N1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1	ZINC000246273699	145096357	/nfs/dbraw/zinc/09/63/57/145096357.db2.gz	ALOJQFPOTUIABC-DAXOMENPSA-N	0	3	308.397	2.190	10	0		DEAEHN
C[C@H](NC(=O)CN1CCN2CCC[C@H]2C1)c1ccccc1Cl	ZINC000246290952	145097294	/nfs/dbraw/zinc/09/72/94/145097294.db2.gz	IJCVIDMMLJFRNL-KBPBESRZSA-N	0	3	321.852	2.297	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000246357443	145100561	/nfs/dbraw/zinc/10/05/61/145100561.db2.gz	OPJKOFKZTWKJEY-XIRDDKMYSA-N	0	3	300.402	2.105	10	0		DEAEHN
C[C@H]1CCc2ccccc2N1C(=O)CN1CCN2CCC[C@H]2C1	ZINC000246570522	145106864	/nfs/dbraw/zinc/10/68/64/145106864.db2.gz	RKRVLLCNVDXQGB-RDJZCZTQSA-N	0	3	313.445	2.134	10	0		DEAEHN
C[C@@H]1CCc2ccccc2N1C(=O)CN1CCN2CCC[C@H]2C1	ZINC000246570529	145106878	/nfs/dbraw/zinc/10/68/78/145106878.db2.gz	RKRVLLCNVDXQGB-WBVHZDCISA-N	0	3	313.445	2.134	10	0		DEAEHN
Cc1cccc(OCCN2C[C@@H](C)[C@@H](N3CCOCC3)C2)c1	ZINC000246631101	145108813	/nfs/dbraw/zinc/10/88/13/145108813.db2.gz	ZKEPVJSFSYUJHR-AEFFLSMTSA-N	0	3	304.434	2.026	10	0		DEAEHN
CN(C)C(=O)[C@@H](c1ccccc1)N1CC[C@@H](c2cnn(C)c2)C1	ZINC000246815702	145115421	/nfs/dbraw/zinc/11/54/21/145115421.db2.gz	BSYQKRFJLQQWGS-NVXWUHKLSA-N	0	3	312.417	2.039	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@H](C)C(=O)NCCC(C)C	ZINC000246944819	145120124	/nfs/dbraw/zinc/12/01/24/145120124.db2.gz	HTBYNHCDOQGFCI-GDBMZVCRSA-N	0	3	306.454	2.207	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cccc(C(=O)OC)c1	ZINC000247043910	145124223	/nfs/dbraw/zinc/12/42/23/145124223.db2.gz	VRRNYPMTZZTIQK-HOTGVXAUSA-N	0	3	316.401	2.172	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1C[C@@H](O)COc1ccccc1	ZINC000247088142	145126513	/nfs/dbraw/zinc/12/65/13/145126513.db2.gz	PQHHMPKESOHVEG-IAGOWNOFSA-N	0	3	315.417	2.096	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2[nH]nc3ccccc32)C1	ZINC000247296148	145132120	/nfs/dbraw/zinc/13/21/20/145132120.db2.gz	OIBRWCWZANFLFU-GUYCJALGSA-N	0	3	312.417	2.048	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)c2cccc(C[S@](C)=O)c2)C1	ZINC000247302294	145132266	/nfs/dbraw/zinc/13/22/66/145132266.db2.gz	LLHGWVFQQQMTKL-XNVILDLWSA-N	0	3	322.474	2.024	10	0		DEAEHN
O=C(CCN1CCS[C@H]2COCC[C@H]21)Nc1cccc(F)c1	ZINC000247316143	145133548	/nfs/dbraw/zinc/13/35/48/145133548.db2.gz	VWIXIRCKXQBQMY-CABCVRRESA-N	0	3	324.421	2.361	10	0		DEAEHN
Cc1cccc(OC[C@@H](C)NC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000247648834	145142668	/nfs/dbraw/zinc/14/26/68/145142668.db2.gz	WBNJXAGGYPYCOP-CVEARBPZSA-N	0	3	317.433	2.252	10	0		DEAEHN
Cc1c(-c2cc(CN3CC[C@@H]4OCCC[C@H]4C3)on2)cnn1C	ZINC000248612592	145161538	/nfs/dbraw/zinc/16/15/38/145161538.db2.gz	IREBYDRLPLDQAV-GUYCJALGSA-N	0	3	316.405	2.384	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)[C@H]2C[C@H]2c2cc(F)c(F)c(F)c2)C1	ZINC000248651140	145163609	/nfs/dbraw/zinc/16/36/09/145163609.db2.gz	SNNYFJPHLWEOKD-WOPDTQHZSA-N	0	3	312.335	2.370	10	0		DEAEHN
O[C@H](CN1CCC[C@@H](c2nnc3n2CCC3)C1)C1CCCCC1	ZINC000248873173	145171603	/nfs/dbraw/zinc/17/16/03/145171603.db2.gz	DQVCGFQDYRNHIP-HZPDHXFCSA-N	0	3	318.465	2.345	10	0		DEAEHN
CN(C[C@@H](O)COCc1ccccc1)C[C@H](O)CC1CCCC1	ZINC000249113436	145178780	/nfs/dbraw/zinc/17/87/80/145178780.db2.gz	RNQVFVJLLHDTCK-RTBURBONSA-N	0	3	321.461	2.437	10	0		DEAEHN
CCc1csc([C@H]2CCCN(C[C@@H](O)Cn3cccn3)C2)n1	ZINC000249862378	145190885	/nfs/dbraw/zinc/19/08/85/145190885.db2.gz	GQBLHPZODRFTRL-DZGCQCFKSA-N	0	3	320.462	2.143	10	0		DEAEHN
C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC[C@H]2CCCN2C)c1	ZINC000253356513	145201892	/nfs/dbraw/zinc/20/18/92/145201892.db2.gz	ROSRITZBLOQOJF-WQVCFCJDSA-N	0	3	315.417	2.105	10	0		DEAEHN
CC[C@@H](CO)N1CCN(C/C=C\c2ccccc2OC)CC1	ZINC000255752746	145205304	/nfs/dbraw/zinc/20/53/04/145205304.db2.gz	CFLXQNUAEGALFY-QLBOMPFWSA-N	0	3	304.434	2.097	10	0		DEAEHN
CC(C)OCc1cccc(NC(=O)[C@@H](N)C2CCOCC2)c1	ZINC000261647132	145213078	/nfs/dbraw/zinc/21/30/78/145213078.db2.gz	DWIMFYOWFZXZQT-INIZCTEOSA-N	0	3	306.406	2.304	10	0		DEAEHN
O=C(CCn1cc(Cl)cn1)Nc1ccc2c(c1F)CCNC2	ZINC000261675124	145215631	/nfs/dbraw/zinc/21/56/31/145215631.db2.gz	GVXCZYDZPYALBH-UHFFFAOYSA-N	0	3	322.771	2.350	10	0		DEAEHN
COc1ccccc1[C@@H]1CNCCN1Cc1ccn(C(F)F)n1	ZINC000261769452	145224016	/nfs/dbraw/zinc/22/40/16/145224016.db2.gz	RZITWPBQHOWIPI-AWEZNQCLSA-N	0	3	322.359	2.433	10	0		DEAEHN
CN(C[C@@H]1COc2ccccc2O1)C(=O)[C@H]1NCCCC1(C)C	ZINC000261864341	145235584	/nfs/dbraw/zinc/23/55/84/145235584.db2.gz	KRQIHGCAELIESA-CZUORRHYSA-N	0	3	318.417	2.063	10	0		DEAEHN
NC1(C(=O)Nc2cccc(COCC3CC3)c2)CCOCC1	ZINC000261889288	145237863	/nfs/dbraw/zinc/23/78/63/145237863.db2.gz	QGUNDNCGJWVFQT-UHFFFAOYSA-N	0	3	304.390	2.060	10	0		DEAEHN
C[C@@H]1CN(C(=O)C2(N)CCOCC2)CC[C@H]1c1ccccc1	ZINC000261900758	145239470	/nfs/dbraw/zinc/23/94/70/145239470.db2.gz	RQWRESKDXQFPOG-GDBMZVCRSA-N	0	3	302.418	2.147	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C	ZINC000261910863	145241380	/nfs/dbraw/zinc/24/13/80/145241380.db2.gz	QEUHSYJGUZOUQU-FRQCXROJSA-N	0	3	316.445	2.486	10	0		DEAEHN
Cc1[nH]c2c(cc(C)cc2CNC(=O)C2(N)CCOCC2)c1C	ZINC000261936270	145244154	/nfs/dbraw/zinc/24/41/54/145244154.db2.gz	WWTCGOANGAIBEY-UHFFFAOYSA-N	0	3	315.417	2.217	10	0		DEAEHN
COc1cc2c(cc1OC)CCN(Cc1cnc(N)s1)CC2	ZINC000261953984	145246334	/nfs/dbraw/zinc/24/63/34/145246334.db2.gz	GKQNGKYJRKBTPG-UHFFFAOYSA-N	0	3	319.430	2.343	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)NCc1ccc(F)cc1F	ZINC000261976934	145248573	/nfs/dbraw/zinc/24/85/73/145248573.db2.gz	ZSPXYLMLVOILGJ-QEORTHHSSA-N	0	3	324.371	2.114	10	0		DEAEHN
C[C@@H](NC(=O)C[C@H]1CNCCO1)c1ccc(C(F)(F)F)cc1	ZINC000262113590	145263280	/nfs/dbraw/zinc/26/32/80/145263280.db2.gz	JYIAJEDUIIBZRY-MFKMUULPSA-N	0	3	316.323	2.261	10	0		DEAEHN
CC(C)Oc1cccc([C@@H](C)NC(=O)C2(N)CCOCC2)c1	ZINC000262121215	145263790	/nfs/dbraw/zinc/26/37/90/145263790.db2.gz	KQXSCKQDXPFISN-CYBMUJFWSA-N	0	3	306.406	2.159	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)NCc1cccc(Cl)c1	ZINC000262537323	145291249	/nfs/dbraw/zinc/29/12/49/145291249.db2.gz	QMLSSGFYHNOWSA-CPUCHLNUSA-N	0	3	322.836	2.489	10	0		DEAEHN
C[C@@H]1C[NH2+]CC[C@@H]1[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000262745939	145302899	/nfs/dbraw/zinc/30/28/99/145302899.db2.gz	DTXOVJOIKQDJPG-KCJUWKMLSA-N	0	3	323.245	2.270	10	0		DEAEHN
CSCc1ccc(-c2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263119630	145326939	/nfs/dbraw/zinc/32/69/39/145326939.db2.gz	AUAUYQHUXYYFQZ-ZDUSSCGKSA-N	0	3	304.419	2.176	10	0		DEAEHN
Cc1ccc(O[C@@H](C)c2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263135481	145328209	/nfs/dbraw/zinc/32/82/09/145328209.db2.gz	CAIOJPHALQYCDP-GXTWGEPZSA-N	0	3	302.378	2.094	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2cc(F)c(F)cc2Cl)n1	ZINC000263151999	145330031	/nfs/dbraw/zinc/33/00/31/145330031.db2.gz	DDWHKIQZFDPFSY-NSHDSACASA-N	0	3	314.723	2.244	10	0		DEAEHN
C[C@H](c1nc([C@H]2CNCCN2C)no1)c1ccc(F)c(F)c1	ZINC000263175532	145332940	/nfs/dbraw/zinc/33/29/40/145332940.db2.gz	GEPCLHSQGWQSFD-TVQRCGJNSA-N	0	3	308.332	2.076	10	0		DEAEHN
COc1ccc(-c2nc([C@H]3CNCCN3C)no2)c2ccccc12	ZINC000263188876	145334310	/nfs/dbraw/zinc/33/43/10/145334310.db2.gz	HPNFFSQQTAXAJU-OAHLLOKOSA-N	0	3	324.384	2.475	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC[C@H](c3cc(C)n[nH]3)C2)C1	ZINC000332743471	145387212	/nfs/dbraw/zinc/38/72/12/145387212.db2.gz	PDQBNERLFQUIMV-LSDHHAIUSA-N	0	3	319.453	2.091	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC[C@H](c3cc(C)[nH]n3)C2)C1	ZINC000332743471	145387214	/nfs/dbraw/zinc/38/72/14/145387214.db2.gz	PDQBNERLFQUIMV-LSDHHAIUSA-N	0	3	319.453	2.091	10	0		DEAEHN
COC(=O)[C@@H](NC[C@@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000358851777	147219334	/nfs/dbraw/zinc/21/93/34/147219334.db2.gz	MWXJABMLUAPWTL-IRXDYDNUSA-N	0	3	302.418	2.192	10	0		DEAEHN
C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)NCc1ccc2cc[nH]c2n1	ZINC000360712967	147372227	/nfs/dbraw/zinc/37/22/27/147372227.db2.gz	KUZYVWGBOARAIX-WFASDCNBSA-N	0	3	315.421	2.045	10	0		DEAEHN
Cc1ccc(OC[C@H](O)CN2CCC[C@@H](c3cc[nH]n3)C2)cc1	ZINC000249377594	292167841	/nfs/dbraw/zinc/16/78/41/292167841.db2.gz	MLACEKLCXCNXDH-HZPDHXFCSA-N	0	3	315.417	2.337	10	0		DEAEHN
CC(C)Cn1cc(CNC[C@H]2CCC3(CCOCC3)[C@@H]2O)cn1	ZINC000374687616	148278872	/nfs/dbraw/zinc/27/88/72/148278872.db2.gz	OTTGQLHHFRQSMA-IAGOWNOFSA-N	0	3	321.465	2.196	10	0		DEAEHN
CC(C)(C)c1n[nH]cc1CNC[C@H]1CCC2(CCOCC2)[C@@H]1O	ZINC000374707777	148280527	/nfs/dbraw/zinc/28/05/27/148280527.db2.gz	RHPWQBGQGIVZTD-CZUORRHYSA-N	0	3	321.465	2.365	10	0		DEAEHN
COC(=O)C(C)(C)CCN1CC[C@H](c2nc(C3CC3)no2)C1	ZINC000375415132	148369313	/nfs/dbraw/zinc/36/93/13/148369313.db2.gz	OFSRQJFHVUOUTR-LBPRGKRZSA-N	0	3	307.394	2.326	10	0		DEAEHN
CCOC(=O)CCCCN1CC[C@H](c2nc(C3CC3)no2)C1	ZINC000375446561	148373220	/nfs/dbraw/zinc/37/32/20/148373220.db2.gz	XNJLUUIXPHQGQP-ZDUSSCGKSA-N	0	3	307.394	2.470	10	0		DEAEHN
O[C@@H](COC1CCOCC1)CN1CC=C(c2ccccc2)CC1	ZINC000127158956	401722710	/nfs/dbraw/zinc/72/27/10/401722710.db2.gz	IWDOWXPVRWGWHL-GOSISDBHSA-N	0	3	317.429	2.332	10	0		DEAEHN
C[C@@H](NC[C@H](O)COC1CCOCC1)c1ccc(F)c(F)c1	ZINC000127179046	401723353	/nfs/dbraw/zinc/72/33/53/401723353.db2.gz	JVEBYKQWUPZUAS-YPMHNXCESA-N	0	3	315.360	2.172	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CCCc2occc21	ZINC000111824220	401724682	/nfs/dbraw/zinc/72/46/82/401724682.db2.gz	VSNRFQAHQRPFPZ-UKRRQHHQSA-N	0	3	321.421	2.067	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(C)C1CCCCCC1	ZINC000111865196	401726223	/nfs/dbraw/zinc/72/62/23/401726223.db2.gz	WKGNKSTUNBFWAS-INIZCTEOSA-N	0	3	311.470	2.461	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)C1CCCCCC1	ZINC000111865200	401726522	/nfs/dbraw/zinc/72/65/22/401726522.db2.gz	WKGNKSTUNBFWAS-MRXNPFEDSA-N	0	3	311.470	2.461	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N([C@@H](C)C1CC1)C1CC1	ZINC000074167321	401731958	/nfs/dbraw/zinc/73/19/58/401731958.db2.gz	MGKIAVDARJONTE-XJKSGUPXSA-N	0	3	309.454	2.070	10	0		DEAEHN
COC(=O)CNC(=O)CCN[C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000111198375	401700022	/nfs/dbraw/zinc/70/00/22/401700022.db2.gz	OKAKCPUWJYQKAG-MRXNPFEDSA-N	0	3	324.808	2.060	10	0		DEAEHN
CC(C)NC(=O)NC(=O)[C@@H](C)N1CCC[C@@]2(CC=CCC2)C1	ZINC000114494244	401802321	/nfs/dbraw/zinc/80/23/21/401802321.db2.gz	BFMKHMWJGUNIIV-PBHICJAKSA-N	0	3	307.438	2.431	10	0		DEAEHN
COCCN(C)CCCNC(=O)N1CCC[C@@]2(CC=CCC2)C1	ZINC000114589009	401803866	/nfs/dbraw/zinc/80/38/66/401803866.db2.gz	QZKAXPNHPMXXPP-SFHVURJKSA-N	0	3	323.481	2.487	10	0		DEAEHN
CC(C)c1csc([C@@H]2CCCN(CCC(=O)NC(N)=O)C2)n1	ZINC000127842318	401752166	/nfs/dbraw/zinc/75/21/66/401752166.db2.gz	XEDJNSVXKSZJMY-LLVKDONJSA-N	0	3	324.450	2.031	10	0		DEAEHN
CCCC1(CNC(=O)NC[C@@H]2CCCN2CCOC)CCC1	ZINC000128035142	401760194	/nfs/dbraw/zinc/76/01/94/401760194.db2.gz	RZMDHEPDESHUNW-HNNXBMFYSA-N	0	3	311.470	2.367	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H](Cc1ccccc1)N(C)C	ZINC000112881632	401760562	/nfs/dbraw/zinc/76/05/62/401760562.db2.gz	FUVZWEQIFNOUGK-ZWKOTPCHSA-N	0	3	319.493	2.252	10	0		DEAEHN
Cc1ccc(O[C@H](C)C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1	ZINC000113226775	401770400	/nfs/dbraw/zinc/77/04/00/401770400.db2.gz	NLJUVLKUAFRQHZ-XHSDSOJGSA-N	0	3	302.418	2.457	10	0		DEAEHN
C[C@@H]1CCC[C@H](C)N1C(=O)CN1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000128421099	401775954	/nfs/dbraw/zinc/77/59/54/401775954.db2.gz	OXELYCZDTSZMAT-KYHPRHEASA-N	0	3	308.466	2.403	10	0		DEAEHN
C[C@@H](NC(C)(C)CNC(=O)NCC1(C)COC1)c1ccccc1	ZINC000113622445	401783709	/nfs/dbraw/zinc/78/37/09/401783709.db2.gz	UTICEPMYWAMUIE-CQSZACIVSA-N	0	3	319.449	2.452	10	0		DEAEHN
CN(C)Cc1cccc(CNC(=O)NC[C@@H]2CCCC[C@@H]2O)c1	ZINC000077776220	401830926	/nfs/dbraw/zinc/83/09/26/401830926.db2.gz	HRGVZWUHIYLGMY-IRXDYDNUSA-N	0	3	319.449	2.099	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)Cc2cccc3ccccc32)CCO1	ZINC000116784567	401858657	/nfs/dbraw/zinc/85/86/57/401858657.db2.gz	PVCGDRRSOVKEOZ-QGZVFWFLSA-N	0	3	312.413	2.171	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)Nc2nc3ccccc3s2)CCO1	ZINC000116928553	401864424	/nfs/dbraw/zinc/86/44/24/401864424.db2.gz	OVQOLLWTLXMFMJ-NSHDSACASA-N	0	3	320.418	2.091	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N(C)CCOc2ccccc2)C1	ZINC000132390351	401866340	/nfs/dbraw/zinc/86/63/40/401866340.db2.gz	PQTUYMRTJXHCFX-WBVHZDCISA-N	0	3	319.449	2.436	10	0		DEAEHN
C[C@H](CCNCc1ccc(Br)cn1)[S@](C)=O	ZINC000132542225	401869039	/nfs/dbraw/zinc/86/90/39/401869039.db2.gz	KPOTUHMHVDEVHJ-JDNHERCYSA-N	0	3	305.241	2.091	10	0		DEAEHN
Cc1ccc(NC(=O)CN(C)C(=O)CN2CCCC2(C)C)cc1	ZINC000077382736	401813252	/nfs/dbraw/zinc/81/32/52/401813252.db2.gz	ZDUILFYAMXSUHV-UHFFFAOYSA-N	0	3	317.433	2.266	10	0		DEAEHN
COCCC1(CNC(=O)N2CC[C@@H](N3CC=CC3)C2)CCCC1	ZINC000119077422	401924538	/nfs/dbraw/zinc/92/45/38/401924538.db2.gz	GCFKZDTUNKNDMX-MRXNPFEDSA-N	0	3	321.465	2.239	10	0		DEAEHN
c1csc(Cn2cccc2CN[C@@H]2CCc3ncnn3C2)c1	ZINC000119121985	401927174	/nfs/dbraw/zinc/92/71/74/401927174.db2.gz	DMULFKLOKHQFQS-CYBMUJFWSA-N	0	3	313.430	2.294	10	0		DEAEHN
COC(=O)[C@H](O)C1CCN([C@H](C)c2cccc(OC)c2)CC1	ZINC000135352558	401937342	/nfs/dbraw/zinc/93/73/42/401937342.db2.gz	RTZQKDMHUVXJMB-MLGOLLRUSA-N	0	3	307.390	2.002	10	0		DEAEHN
CC[C@@H]1CN(CCCc2cccc(OC)c2)CCN1C[C@@H](C)O	ZINC000119147608	401928782	/nfs/dbraw/zinc/92/87/82/401928782.db2.gz	BNFIAMSOLBZVQA-SJLPKXTDSA-N	0	3	320.477	2.405	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1ccccc1Cl	ZINC000032072822	401875724	/nfs/dbraw/zinc/87/57/24/401875724.db2.gz	PEZAAIYTCZAMCT-LLVKDONJSA-N	0	3	304.843	2.349	10	0		DEAEHN
Cc1cc([C@H]2CN(C(=O)CN(C)C(C)C)CCO2)ccc1F	ZINC000134826741	401916477	/nfs/dbraw/zinc/91/64/77/401916477.db2.gz	UXPNLFIPVZSPHS-MRXNPFEDSA-N	0	3	308.397	2.374	10	0		DEAEHN
COc1cc([C@@H](C)NCCc2nc(C)no2)cc(OC)c1OC	ZINC000089518811	401950876	/nfs/dbraw/zinc/95/08/76/401950876.db2.gz	JHQMAZLLLXHFQN-SNVBAGLBSA-N	0	3	321.377	2.297	10	0		DEAEHN
C[C@@H](O)CCNC(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000136064563	401959673	/nfs/dbraw/zinc/95/96/73/401959673.db2.gz	HRNKPWHQAAPEQE-HZPDHXFCSA-N	0	3	318.461	2.217	10	0		DEAEHN
CC(C)(O)CNC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000119613766	401962139	/nfs/dbraw/zinc/96/21/39/401962139.db2.gz	CJZXLEQGWGCBOJ-GOSISDBHSA-N	0	3	319.449	2.111	10	0		DEAEHN
CCC(CC)(CNCC(=O)Nc1ccccc1OC)C(=O)OC	ZINC000120690497	401998438	/nfs/dbraw/zinc/99/84/38/401998438.db2.gz	VMBJIQZTJVKIDB-UHFFFAOYSA-N	0	3	322.405	2.203	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H](C)N1CCc2ccccc2C1)N(C)C	ZINC000135516345	401943188	/nfs/dbraw/zinc/94/31/88/401943188.db2.gz	HXFJGDITFWWHQD-YJBOKZPZSA-N	0	3	317.477	2.280	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)Cc1ccc(Br)cc1	ZINC000049096275	402012410	/nfs/dbraw/zinc/01/24/10/402012410.db2.gz	SBMGHFVTVXNINK-ZDUSSCGKSA-N	0	3	311.223	2.202	10	0		DEAEHN
C[NH+](C)[C@@H]1CC[C@@H](NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)C1	ZINC000093994643	402022131	/nfs/dbraw/zinc/02/21/31/402022131.db2.gz	SOYYJLILDMNPQR-CHWSQXEVSA-N	0	3	318.417	2.318	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NCc1cscn1	ZINC000050683327	402029403	/nfs/dbraw/zinc/02/94/03/402029403.db2.gz	LHZDZZFAKYSTSK-UHFFFAOYSA-N	0	3	305.403	2.014	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc(C(=O)OC)c(F)c2)C1	ZINC000121449146	402036787	/nfs/dbraw/zinc/03/67/87/402036787.db2.gz	GGYTVLKXIHILKB-LBPRGKRZSA-N	0	3	323.368	2.218	10	0		DEAEHN
CC(C)C[C@H](CCO)CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000120861596	402004435	/nfs/dbraw/zinc/00/44/35/402004435.db2.gz	YOYNLUQJBYXUHU-JYJNAYRXSA-N	0	3	313.486	2.155	10	0		DEAEHN
CCN1CCN(C[C@H](C)CNC(=O)NCCC2=CCCC2)CC1	ZINC000122476655	402080293	/nfs/dbraw/zinc/08/02/93/402080293.db2.gz	VSBCVBZOEWHHQB-MRXNPFEDSA-N	0	3	322.497	2.060	10	0		DEAEHN
Cc1cccc(CNC(=O)N[C@@H](C)CN2CCC[C@H](C)C2)n1	ZINC000056788715	402090355	/nfs/dbraw/zinc/09/03/55/402090355.db2.gz	UAAFGNAMTJBWKE-ZFWWWQNUSA-N	0	3	304.438	2.310	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(Cc2ccccn2)C2CC2)C1	ZINC000057870669	402097806	/nfs/dbraw/zinc/09/78/06/402097806.db2.gz	NNYBYDCIPYRPRG-OAHLLOKOSA-N	0	3	302.422	2.240	10	0		DEAEHN
CCN(CC)C(=O)CCC1CCN(C[C@@H](O)C(F)(F)F)CC1	ZINC000122127476	402063067	/nfs/dbraw/zinc/06/30/67/402063067.db2.gz	OXCJJURAKFMHAI-CYBMUJFWSA-N	0	3	324.387	2.270	10	0		DEAEHN
COc1cccc(Cl)c1CC(=O)NC[C@@H](C)N(C)C1CC1	ZINC000153157699	402130438	/nfs/dbraw/zinc/13/04/38/402130438.db2.gz	PVCKGGSJOUCQDO-LLVKDONJSA-N	0	3	310.825	2.490	10	0		DEAEHN
CCc1noc2ncc(C(=O)N(C)[C@H]3CCN(C)[C@H](C)C3)cc12	ZINC000123524074	402132620	/nfs/dbraw/zinc/13/26/20/402132620.db2.gz	LLWNWRPQFYWKIG-YPMHNXCESA-N	0	3	316.405	2.340	10	0		DEAEHN
C[C@@H]1CCN(C(=O)[C@@H]2CCCc3[nH]ncc32)C[C@@H]1n1ccnc1	ZINC000124457123	402180682	/nfs/dbraw/zinc/18/06/82/402180682.db2.gz	IAFKVIBSFORLFK-IOASZLSFSA-N	0	3	313.405	2.136	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1ccc2c(c1)nnn2C)c1ccccc1	ZINC000103739210	402193838	/nfs/dbraw/zinc/19/38/38/402193838.db2.gz	URBDWXAOEUVDOQ-INIZCTEOSA-N	0	3	323.400	2.001	10	0		DEAEHN
CC(C)c1noc(CCC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)n1	ZINC000124121267	402164942	/nfs/dbraw/zinc/16/49/42/402164942.db2.gz	PWAPHBOYEHDIJE-STQMWFEESA-N	0	3	308.426	2.067	10	0		DEAEHN
Cn1cc(CN2CC[C@H](CNC(=O)CC3=CCCCC3)C2)cn1	ZINC000067878607	402177293	/nfs/dbraw/zinc/17/72/93/402177293.db2.gz	AVEPDXHOWCATRW-MRXNPFEDSA-N	0	3	316.449	2.249	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC[C@H]1c1c(C)nn(C)c1C)N(C)C	ZINC000155631925	402263812	/nfs/dbraw/zinc/26/38/12/402263812.db2.gz	MVKGTKKKGHSFCX-LSDHHAIUSA-N	0	3	306.454	2.431	10	0		DEAEHN
Cc1ccc(F)c(OCC(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000126085195	402263914	/nfs/dbraw/zinc/26/39/14/402263914.db2.gz	ARFIYMCVJARJBM-ZFWWWQNUSA-N	0	3	308.397	2.358	10	0		DEAEHN
COc1cccc2c1CC[C@@H]2NC(=O)N1CC[C@H](N(C)C)C1	ZINC000154794627	402232074	/nfs/dbraw/zinc/23/20/74/402232074.db2.gz	NRQRLUQWBOVESR-WFASDCNBSA-N	0	3	303.406	2.028	10	0		DEAEHN
COc1cc(Cl)ccc1CNC(=O)N1CC[C@@H](N(C)C)C1	ZINC000107858175	402242180	/nfs/dbraw/zinc/24/21/80/402242180.db2.gz	VIKNAWXMVQLGRW-CYBMUJFWSA-N	0	3	311.813	2.194	10	0		DEAEHN
COc1ccc(CNC(=O)N2CC[C@@H](N(C)C)C2)cc1Cl	ZINC000125082840	402212051	/nfs/dbraw/zinc/21/20/51/402212051.db2.gz	LNLFYLVIMBYTCO-GFCCVEGCSA-N	0	3	311.813	2.194	10	0		DEAEHN
C[C@H]1CN(CCC(Cl)(Cl)Cl)C[C@@H]1N1CCOCC1	ZINC000184608738	402283936	/nfs/dbraw/zinc/28/39/36/402283936.db2.gz	ICKPPAZHWGFPCC-QWRGUYRKSA-N	0	3	315.672	2.399	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NOCc1ccc(F)cc1	ZINC000184656520	402288774	/nfs/dbraw/zinc/28/87/74/402288774.db2.gz	FOTPYTUEYZIAEB-OAHLLOKOSA-N	0	3	309.385	2.383	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@H](C)OCc2ccccc2)C1	ZINC000184762569	402298266	/nfs/dbraw/zinc/29/82/66/402298266.db2.gz	GBBBQYJWDPRGHV-VYDXJSESSA-N	0	3	304.434	2.437	10	0		DEAEHN
CCn1c(CN[C@H]2CCCC[C@H]2C(N)=O)nc2cc(F)ccc21	ZINC000184822283	402301873	/nfs/dbraw/zinc/30/18/73/402301873.db2.gz	GDIUXGQWWQALBV-OLZOCXBDSA-N	0	3	318.396	2.329	10	0		DEAEHN
CN(C)CCN(C)C(=O)Cc1coc(-c2ccc(F)cc2)n1	ZINC000176383128	402304750	/nfs/dbraw/zinc/30/47/50/402304750.db2.gz	WTDXFBBFGIUIAC-UHFFFAOYSA-N	0	3	305.353	2.043	10	0		DEAEHN
CC(C)[C@](C)(O)CN1CCC(n2c3ccccc3[nH]c2=O)CC1	ZINC000184940100	402311313	/nfs/dbraw/zinc/31/13/13/402311313.db2.gz	GERYCXRNALHNLC-GOSISDBHSA-N	0	3	317.433	2.374	10	0		DEAEHN
Cn1cc(-c2cc(CN[C@@](C)(CO)C3CCCCC3)on2)cn1	ZINC000185008970	402316831	/nfs/dbraw/zinc/31/68/31/402316831.db2.gz	GVMNRCCKXVGVBC-KRWDZBQOSA-N	0	3	318.421	2.496	10	0		DEAEHN
CN(C)C[C@@](C)(O)CNC(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000228735968	402340141	/nfs/dbraw/zinc/34/01/41/402340141.db2.gz	GIZHCAXNNFBOIA-ZDUSSCGKSA-N	0	3	320.220	2.428	10	0		DEAEHN
CCOc1ccc(CNC(=O)N(C)CCN(C)C2CC2)cc1F	ZINC000185358426	402346343	/nfs/dbraw/zinc/34/63/43/402346343.db2.gz	ODEWHJTVADWUCQ-UHFFFAOYSA-N	0	3	323.412	2.460	10	0		DEAEHN
CC(C)c1nnc(CCC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)o1	ZINC000176896305	402347606	/nfs/dbraw/zinc/34/76/06/402347606.db2.gz	BPMUZGRXCZJGEH-OLZOCXBDSA-N	0	3	308.426	2.067	10	0		DEAEHN
CC[C@H](CNC(=O)N1CC[C@H](N(C)C)C1)Oc1ccccc1C	ZINC000176912131	402349318	/nfs/dbraw/zinc/34/93/18/402349318.db2.gz	BOIVJPTZFVGHIJ-JKSUJKDBSA-N	0	3	319.449	2.498	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CNC(=O)CCC1CCCC1	ZINC000176971119	402355246	/nfs/dbraw/zinc/35/52/46/402355246.db2.gz	CQJPZYAOLJAXSI-MRXNPFEDSA-N	0	3	323.481	2.016	10	0		DEAEHN
COc1ccc(CNC(C)(C)CNC(=O)OC(C)(C)C)cn1	ZINC000232146959	402356733	/nfs/dbraw/zinc/35/67/33/402356733.db2.gz	FTTKLOXTUMQFQO-UHFFFAOYSA-N	0	3	309.410	2.483	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(OC)cc(OC)c1	ZINC000176995963	402357644	/nfs/dbraw/zinc/35/76/44/402357644.db2.gz	APZPQKQMFHMIEJ-AWEZNQCLSA-N	0	3	306.406	2.260	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@@H](c1ccccc1)N(C)C	ZINC000177001230	402358318	/nfs/dbraw/zinc/35/83/18/402358318.db2.gz	FYYBZYIOKPSCNK-IAGOWNOFSA-N	0	3	303.450	2.232	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cnc(C)nc1C(C)C	ZINC000177014757	402359374	/nfs/dbraw/zinc/35/93/74/402359374.db2.gz	LBILGXSXYDXUEI-CQSZACIVSA-N	0	3	304.438	2.465	10	0		DEAEHN
CCOc1ccc(OCC(=O)N(C)C[C@@H]2CCCN2CC)cc1	ZINC000177017241	402359591	/nfs/dbraw/zinc/35/95/91/402359591.db2.gz	MZHHGEPZSVCGJT-HNNXBMFYSA-N	0	3	320.433	2.407	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1cccc(OC)c1	ZINC000177024506	402360095	/nfs/dbraw/zinc/36/00/95/402360095.db2.gz	LWOOMRUFKRMKQD-OAHLLOKOSA-N	0	3	305.422	2.321	10	0		DEAEHN
COC[C@@H](C)OC[C@H](O)CN(C)Cc1ccc(Cl)cc1	ZINC000234824150	402361711	/nfs/dbraw/zinc/36/17/11/402361711.db2.gz	GPJKYYCXCRTLCX-IUODEOHRSA-N	0	3	301.814	2.184	10	0		DEAEHN
CNc1cc(N2CCC[C@@H]2CN[C@@H](C)c2ccccn2)ncn1	ZINC000177125817	402372542	/nfs/dbraw/zinc/37/25/42/402372542.db2.gz	ZFUIQSGNJRGQSW-UONOGXRCSA-N	0	3	312.421	2.233	10	0		DEAEHN
Cc1cccc(OCCN2C[C@H](C)[C@H](N3CCOCC3)C2)c1	ZINC000177247597	402385157	/nfs/dbraw/zinc/38/51/57/402385157.db2.gz	ZKEPVJSFSYUJHR-FUHWJXTLSA-N	0	3	304.434	2.026	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)Nc2nncs2)CN1Cc1ccccc1	ZINC000176677632	402328006	/nfs/dbraw/zinc/32/80/06/402328006.db2.gz	VTFPISPRRIKRTA-YPMHNXCESA-N	0	3	317.418	2.323	10	0		DEAEHN
C[C@@H]1CN(C[C@H](O)c2ccc(Cl)cc2)C[C@@H]1N1CCOCC1	ZINC000177263525	402386282	/nfs/dbraw/zinc/38/62/82/402386282.db2.gz	UYLYWNJUQYJLOX-COXVUDFISA-N	0	3	324.852	2.026	10	0		DEAEHN
CS(=O)(=O)CCCCCNCc1cc(-c2ccccc2)n[nH]1	ZINC000185212639	402334961	/nfs/dbraw/zinc/33/49/61/402334961.db2.gz	JFGJVQPOCJOSFI-UHFFFAOYSA-N	0	3	321.446	2.381	10	0		DEAEHN
CCC[C@H](C(=O)NCCCN(C)c1ccccc1F)N(C)C	ZINC000161701629	402396437	/nfs/dbraw/zinc/39/64/37/402396437.db2.gz	KMEKRSIQCIVXBB-MRXNPFEDSA-N	0	3	309.429	2.499	10	0		DEAEHN
COC(=O)c1ccccc1NC(=O)N(C)C[C@H]1CCCN(C)C1	ZINC000161846109	402401257	/nfs/dbraw/zinc/40/12/57/402401257.db2.gz	DZYJTDSYHJELQC-ZDUSSCGKSA-N	0	3	319.405	2.279	10	0		DEAEHN
CCO[C@H]1C[C@@H](NCc2cccnc2N(C)C)C12CCOCC2	ZINC000186243561	402414410	/nfs/dbraw/zinc/41/44/10/402414410.db2.gz	WIWGPYSHBLECBH-CVEARBPZSA-N	0	3	319.449	2.211	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C(=O)OC)c1ccccc1F	ZINC000177707918	402429107	/nfs/dbraw/zinc/42/91/07/402429107.db2.gz	OLWAIXBNVUZIIA-CJNGLKHVSA-N	0	3	308.397	2.456	10	0		DEAEHN
Cn1c(CN2CCN3CCCC[C@@H]3C2)nnc1-c1ccccc1	ZINC000177768968	402433890	/nfs/dbraw/zinc/43/38/90/402433890.db2.gz	UCQCSCOCPPHMGR-MRXNPFEDSA-N	0	3	311.433	2.152	10	0		DEAEHN
Cc1ccc(C)c(OC[C@H](O)CN2CCN3CCCC[C@@H]3C2)c1	ZINC000177775728	402435392	/nfs/dbraw/zinc/43/53/92/402435392.db2.gz	KYNUXFBYWDGHBB-QZTJIDSGSA-N	0	3	318.461	2.213	10	0		DEAEHN
COC[C@@H](NCc1ccc(N2CCCC2)nc1)C1CCOCC1	ZINC000187750993	402510676	/nfs/dbraw/zinc/51/06/76/402510676.db2.gz	YMOWTBORQUYHDP-QGZVFWFLSA-N	0	3	319.449	2.213	10	0		DEAEHN
C[C@H]1CC[C@H](C(=O)NC2CCN(CCc3ccccc3)CC2)O1	ZINC000178057436	402456032	/nfs/dbraw/zinc/45/60/32/402456032.db2.gz	KJEKYBNQJRIDLR-MAUKXSAKSA-N	0	3	316.445	2.377	10	0		DEAEHN
COC[C@@H](Cc1ccccc1)NCc1cccnc1-n1cncn1	ZINC000178052794	402456173	/nfs/dbraw/zinc/45/61/73/402456173.db2.gz	PHDPENUAMUICTH-QGZVFWFLSA-N	0	3	323.400	2.010	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2c(C)onc2-c2ccccn2)C1	ZINC000178106320	402460971	/nfs/dbraw/zinc/46/09/71/402460971.db2.gz	KBJOZGJZJHOGNN-CYBMUJFWSA-N	0	3	314.389	2.259	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C)C(=O)Nc1ccc(Cl)cn1	ZINC000245471402	402463957	/nfs/dbraw/zinc/46/39/57/402463957.db2.gz	NWXQRYMEDAPJFF-OCCSQVGLSA-N	0	3	324.856	2.478	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)CC(=O)N2CCc3ccccc3C2)C1	ZINC000187902951	402512685	/nfs/dbraw/zinc/51/26/85/402512685.db2.gz	HKSHTXJNCVOVGP-BEFAXECRSA-N	0	3	316.445	2.054	10	0		DEAEHN
CC[C@H]1CN(Cc2csc(C3CC3)n2)CCN1C[C@H](C)O	ZINC000245588440	402472210	/nfs/dbraw/zinc/47/22/10/402472210.db2.gz	FMRYXCGASYQHNT-WFASDCNBSA-N	0	3	309.479	2.298	10	0		DEAEHN
CCC[C@H](CN1CC[C@@H](NS(C)(=O)=O)C1)c1ccccc1	ZINC000245634547	402475780	/nfs/dbraw/zinc/47/57/80/402475780.db2.gz	BNXJOHQOLBWNPG-HZPDHXFCSA-N	0	3	310.463	2.194	10	0		DEAEHN
C[C@H]1C[C@H](CCN2CC[C@@H](NS(C)(=O)=O)C2)C[C@@H](C)C1	ZINC000246151785	402512995	/nfs/dbraw/zinc/51/29/95/402512995.db2.gz	CFDFVZWUYLKQIA-CBBWQLFWSA-N	0	3	302.484	2.072	10	0		DEAEHN
CC(C)[C@](C)(O)CN1CCc2c(cccc2N2CCOC2=O)C1	ZINC000187088165	402482622	/nfs/dbraw/zinc/48/26/22/402482622.db2.gz	BKOFOZUOCFECMJ-GOSISDBHSA-N	0	3	318.417	2.408	10	0		DEAEHN
COc1c(C)cc(CN2CCN(C[C@@H](C)O)[C@@H](C)C2)cc1C	ZINC000245747230	402485482	/nfs/dbraw/zinc/48/54/82/402485482.db2.gz	NAVOWZBIMCMCJU-JKSUJKDBSA-N	0	3	306.450	2.199	10	0		DEAEHN
COc1cccc2c1CC[C@H]2NC(=O)N1CCN2CCC[C@H]2C1	ZINC000245777161	402487260	/nfs/dbraw/zinc/48/72/60/402487260.db2.gz	PPERMVUMPGLNKC-XJKSGUPXSA-N	0	3	315.417	2.172	10	0		DEAEHN
COc1cccc(CCCN2CCN(c3cc(C)[nH]n3)CC2)c1	ZINC000187204236	402487827	/nfs/dbraw/zinc/48/78/27/402487827.db2.gz	AYUYMZOXAWFUJQ-UHFFFAOYSA-N	0	3	314.433	2.482	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)N(C)C	ZINC000245785979	402487854	/nfs/dbraw/zinc/48/78/54/402487854.db2.gz	MWLIBKYMWRRTCP-KBAYOESNSA-N	0	3	317.477	2.496	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2ccc3c(c2)CC(C)(C)O3)C[C@H]1C	ZINC000245805863	402489186	/nfs/dbraw/zinc/48/91/86/402489186.db2.gz	YOCMBFMCGPIZJV-CABCVRRESA-N	0	3	318.461	2.287	10	0		DEAEHN
CCCn1cc(CN2CCN(CCOCC)[C@@H](CC)C2)cn1	ZINC000245804744	402489215	/nfs/dbraw/zinc/48/92/15/402489215.db2.gz	YIUOQWLEHMTWCC-KRWDZBQOSA-N	0	3	308.470	2.226	10	0		DEAEHN
COc1c(C)cc(CN2C[C@@H](C)[C@@H](N3CCOCC3)C2)cc1C	ZINC000245810981	402489604	/nfs/dbraw/zinc/48/96/04/402489604.db2.gz	ZJXIYKOOPIHHDE-AEFFLSMTSA-N	0	3	318.461	2.465	10	0		DEAEHN
CCOC(C)(C)CNC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000187242904	402490128	/nfs/dbraw/zinc/49/01/28/402490128.db2.gz	PSIYRKJTRIRWGC-HNNXBMFYSA-N	0	3	307.438	2.404	10	0		DEAEHN
CCCCN(CCCC)C(=O)CN1C[C@H](C(N)=O)CC[C@H]1C	ZINC000245870928	402493297	/nfs/dbraw/zinc/49/32/97/402493297.db2.gz	WFWHHNDZRZAACY-HUUCEWRRSA-N	0	3	311.470	2.001	10	0		DEAEHN
COc1cccc(OC)c1C(=O)N1CC[C@H]2CC[C@@H](C1)N2C	ZINC000245938371	402498846	/nfs/dbraw/zinc/49/88/46/402498846.db2.gz	AQUCLSXMILGDCD-OLZOCXBDSA-N	0	3	304.390	2.013	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@H](C)C(=O)NC1CCCCC1	ZINC000245943880	402499368	/nfs/dbraw/zinc/49/93/68/402499368.db2.gz	NCRLMXZQAWQAQO-RHSMWYFYSA-N	0	3	318.465	2.493	10	0		DEAEHN
COc1ccccc1CNC(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000246062822	402506376	/nfs/dbraw/zinc/50/63/76/402506376.db2.gz	YNNOTBCKKDIDRO-JKSUJKDBSA-N	0	3	317.433	2.321	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NC[C@@H](C)N2CCC(C)CC2)CC[C@H]1C	ZINC000187621712	402506611	/nfs/dbraw/zinc/50/66/11/402506611.db2.gz	ZUXHJLAULCCRDL-BZUAXINKSA-N	0	3	311.470	2.173	10	0		DEAEHN
COc1ccc(CC[C@@H](C)NCc2cc(C(N)=O)co2)cc1	ZINC000187716001	402509343	/nfs/dbraw/zinc/50/93/43/402509343.db2.gz	FAUHYZOANPBAHV-GFCCVEGCSA-N	0	3	302.374	2.498	10	0		DEAEHN
COc1c(C)cnc(CN2CCC[C@H](C3OCCO3)C2)c1C	ZINC000170930074	402542449	/nfs/dbraw/zinc/54/24/49/402542449.db2.gz	ZARQBYYPPMFYSJ-AWEZNQCLSA-N	0	3	306.406	2.292	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(-c2ncon2)cc1	ZINC000246813896	402545823	/nfs/dbraw/zinc/54/58/23/402545823.db2.gz	CFPHEZRLFUBFPR-WFASDCNBSA-N	0	3	312.373	2.045	10	0		DEAEHN
CC(C)CO[C@@H]1CCN(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)C1	ZINC000246962002	402550826	/nfs/dbraw/zinc/55/08/26/402550826.db2.gz	CHXBIRVKUROCRI-OAGGEKHMSA-N	0	3	311.470	2.172	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(C(F)(F)F)nc1	ZINC000247016482	402553724	/nfs/dbraw/zinc/55/37/24/402553724.db2.gz	FYKHYLISRUAHDU-JQWIXIFHSA-N	0	3	313.323	2.409	10	0		DEAEHN
COC[C@@H](NC(=O)N1CCCN(C2CC2)CC1)c1ccccc1	ZINC000171068331	402554299	/nfs/dbraw/zinc/55/42/99/402554299.db2.gz	XJVKJGQBYIJQPL-QGZVFWFLSA-N	0	3	317.433	2.254	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cn(-c3ccccc3)nc2C)C1	ZINC000171088092	402556314	/nfs/dbraw/zinc/55/63/14/402556314.db2.gz	DSEKUPXSPQHCDV-HNNXBMFYSA-N	0	3	312.417	2.395	10	0		DEAEHN
CC(C)(C)NC(=O)CN1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000247229946	402560962	/nfs/dbraw/zinc/56/09/62/402560962.db2.gz	DBVUSLRVJMBHAJ-HZPDHXFCSA-N	0	3	304.434	2.489	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)COc1ccccc1Cl	ZINC000247252789	402561446	/nfs/dbraw/zinc/56/14/46/402561446.db2.gz	NQJVNJJIMUDVOI-OLZOCXBDSA-N	0	3	308.809	2.414	10	0		DEAEHN
Cc1nnc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)s1	ZINC000179016187	402565175	/nfs/dbraw/zinc/56/51/75/402565175.db2.gz	MIOZWWRYSWYJNG-CHWSQXEVSA-N	0	3	317.418	2.413	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000189958652	402568004	/nfs/dbraw/zinc/56/80/04/402568004.db2.gz	YPASLEHCGXPLRL-KBPBESRZSA-N	0	3	322.453	2.427	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cccc(F)c1	ZINC000246194991	402517265	/nfs/dbraw/zinc/51/72/65/402517265.db2.gz	OIAVGKOOHYHIFW-KGLIPLIRSA-N	0	3	312.410	2.073	10	0		DEAEHN
Cc1ccc(NC(=O)[C@H](C)N2CCN3CCC[C@@H]3C2)cc1C	ZINC000178622981	402518260	/nfs/dbraw/zinc/51/82/60/402518260.db2.gz	NTROCMZVJVNXNO-DOTOQJQBSA-N	0	3	301.434	2.410	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CCC[C@H](C)[C@H]1C	ZINC000247656934	402573857	/nfs/dbraw/zinc/57/38/57/402573857.db2.gz	YQTUOXZRDHBDSA-ZJIFWQFVSA-N	0	3	311.470	2.221	10	0		DEAEHN
CC(C)(C)[C@H]1OCC[C@@H]1CN[C@H](C(N)=O)c1ccc(F)cc1	ZINC000189233138	402532632	/nfs/dbraw/zinc/53/26/32/402532632.db2.gz	MGYDCVHLOLZELN-SNPRPXQTSA-N	0	3	308.397	2.393	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)NCc2ccc(CO)c(F)c2)cc1	ZINC000170855571	402533436	/nfs/dbraw/zinc/53/34/36/402533436.db2.gz	ODRIUXWVBTVPIX-UHFFFAOYSA-N	0	3	316.376	2.310	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)CCCOc2ccc(F)cc2F)C1	ZINC000170864407	402534962	/nfs/dbraw/zinc/53/49/62/402534962.db2.gz	ITYWPCWXHUXFLQ-ZDUSSCGKSA-N	0	3	312.360	2.286	10	0		DEAEHN
CN1CC[C@H](NC(=O)NC[C@@]2(C)CCCO2)[C@H]1c1ccccc1	ZINC000179195029	402579780	/nfs/dbraw/zinc/57/97/80/402579780.db2.gz	KQCIQNMRZFBJSF-LZLYRXPVSA-N	0	3	317.433	2.300	10	0		DEAEHN
CC(C)Oc1cncc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000248171561	402584899	/nfs/dbraw/zinc/58/48/99/402584899.db2.gz	UWTNUNSTZNETPL-XJKSGUPXSA-N	0	3	305.422	2.327	10	0		DEAEHN
C[C@@H](CC1CCCCC1)CN1CC[C@@H](NS(C)(=O)=O)C1	ZINC000248598889	402598343	/nfs/dbraw/zinc/59/83/43/402598343.db2.gz	IRNVBURRGGOSAC-DZGCQCFKSA-N	0	3	302.484	2.216	10	0		DEAEHN
CCSCc1cc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)no1	ZINC000248646267	402600977	/nfs/dbraw/zinc/60/09/77/402600977.db2.gz	RSTJLCPHXMSPAG-RISCZKNCSA-N	0	3	311.451	2.386	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)[C@@H]2CCCO[C@H]2C)o1	ZINC000190478447	402604069	/nfs/dbraw/zinc/60/40/69/402604069.db2.gz	JMGZKLQXVPJGRQ-GOEBONIOSA-N	0	3	308.422	2.293	10	0		DEAEHN
Fc1ccc(-c2noc(CN3CCN4CCC[C@@H]4C3)n2)cc1	ZINC000171642049	402604926	/nfs/dbraw/zinc/60/49/26/402604926.db2.gz	JVPJYNOALGGJGR-CQSZACIVSA-N	0	3	302.353	2.156	10	0		DEAEHN
Cc1nn(C)cc1CN1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190489792	402605276	/nfs/dbraw/zinc/60/52/76/402605276.db2.gz	JVNJNPOOUAKGIT-KRWDZBQOSA-N	0	3	313.449	2.077	10	0		DEAEHN
Cc1cc(C)c2c(c1)[C@H](NC[C@@H]1CN(C)CCO1)CCCO2	ZINC000180493072	402617832	/nfs/dbraw/zinc/61/78/32/402617832.db2.gz	GUSRVZFLBXYCCT-NVXWUHKLSA-N	0	3	304.434	2.437	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1F	ZINC000249219575	402623451	/nfs/dbraw/zinc/62/34/51/402623451.db2.gz	UGMWBGUJTLVFEV-STQMWFEESA-N	0	3	321.396	2.014	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)NCCN1CCC[C@@H](C)C1	ZINC000249416257	402629066	/nfs/dbraw/zinc/62/90/66/402629066.db2.gz	ZJQVJRITQTYVLF-ZIAGYGMSSA-N	0	3	320.437	2.182	10	0		DEAEHN
C[C@@H](NC(=O)CN(C)[C@@]1(CO)CC[C@@H](C)C1)c1cccs1	ZINC000249598260	402636237	/nfs/dbraw/zinc/63/62/37/402636237.db2.gz	XKCMVZJFLXMTRZ-IOASZLSFSA-N	0	3	310.463	2.408	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)CC(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)C1	ZINC000249606411	402636493	/nfs/dbraw/zinc/63/64/93/402636493.db2.gz	ZUEWPODXDNTQRO-QFXBJFAPSA-N	0	3	310.482	2.410	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Cc2c[nH]c3cccc(OC)c23)C1	ZINC000181606296	402651745	/nfs/dbraw/zinc/65/17/45/402651745.db2.gz	HUMNCYUKOOLMMB-CQSZACIVSA-N	0	3	315.417	2.320	10	0		DEAEHN
CCN(CC)C(=O)[C@H]1CCCN1C(=O)[C@@H](C)N1CCCCCC1	ZINC000172365025	402652718	/nfs/dbraw/zinc/65/27/18/402652718.db2.gz	CDDJPIILEBYDDA-HZPDHXFCSA-N	0	3	323.481	2.110	10	0		DEAEHN
CC(C)N(C)c1ccc(CN2C[C@H](C(N)=O)CC[C@H]2C)cn1	ZINC000191239361	402653614	/nfs/dbraw/zinc/65/36/14/402653614.db2.gz	LZLWRYURHVCVGS-UKRRQHHQSA-N	0	3	304.438	2.012	10	0		DEAEHN
Fc1ccc(OCCCN2CC[C@@H](N3CCOCC3)C2)cc1	ZINC000173946912	402721330	/nfs/dbraw/zinc/72/13/30/402721330.db2.gz	BIKPKLDZNJDKHG-MRXNPFEDSA-N	0	3	308.397	2.001	10	0		DEAEHN
CN(CC1CCCCC1)C(=O)CN1CCCN(C2CC2)CC1	ZINC000172542004	402661743	/nfs/dbraw/zinc/66/17/43/402661743.db2.gz	WWYQMUYNHWQMHE-UHFFFAOYSA-N	0	3	307.482	2.195	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1N(C)C(=O)CN1CCCN(C2CC2)CC1	ZINC000172543402	402661779	/nfs/dbraw/zinc/66/17/79/402661779.db2.gz	UHRRTYZCCFNMHM-NVXWUHKLSA-N	0	3	307.482	2.194	10	0		DEAEHN
CN(Cc1cccs1)C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C	ZINC000253206004	402661775	/nfs/dbraw/zinc/66/17/75/402661775.db2.gz	GDJCQJFTQWDONG-XJKCOSOUSA-N	0	3	308.447	2.239	10	0		DEAEHN
C[C@H]1CCCN(CCNC(=O)N2CCCC[C@@H]2c2cn[nH]c2)C1	ZINC000182335082	402681765	/nfs/dbraw/zinc/68/17/65/402681765.db2.gz	MRBVBYLVGCDDQC-GOEBONIOSA-N	0	3	319.453	2.378	10	0		DEAEHN
O=C([C@H]1SCCc2ccccc21)N1CCN2CCC[C@@H]2C1	ZINC000173402910	402695971	/nfs/dbraw/zinc/69/59/71/402695971.db2.gz	XWWCJCQHJKKSLF-ZBFHGGJFSA-N	0	3	302.443	2.324	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H](C)CN(C)Cc1ccccc1)N(C)C	ZINC000182533659	402697831	/nfs/dbraw/zinc/69/78/31/402697831.db2.gz	STMGEKXDADZKKP-DOTOQJQBSA-N	0	3	305.466	2.353	10	0		DEAEHN
CCN(CCNCc1ccc2c(c1)sc(=O)n2C)C1CC1	ZINC000192527121	402734798	/nfs/dbraw/zinc/73/47/98/402734798.db2.gz	WVJJCTPIAXGCKO-UHFFFAOYSA-N	0	3	305.447	2.174	10	0		DEAEHN
CC(C)[C@H]1CN(C)CCN1Cc1ccc2c(c1)sc(=O)n2C	ZINC000192637752	402741748	/nfs/dbraw/zinc/74/17/48/402741748.db2.gz	GMRSJJCHHNUNQA-OAHLLOKOSA-N	0	3	319.474	2.372	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)Nc2cnn(CC3CC3)c2)CCN1C	ZINC000174452763	402741841	/nfs/dbraw/zinc/74/18/41/402741841.db2.gz	ZEQGSBPFACNRPU-WFASDCNBSA-N	0	3	305.426	2.240	10	0		DEAEHN
Cc1c([O-])ccc2c(C[NH2+][C@H](C)[C@H]3CCCO3)cc(=O)oc12	ZINC000183140618	402742547	/nfs/dbraw/zinc/74/25/47/402742547.db2.gz	KJDJGOWVZWKGDK-IAQYHMDHSA-N	0	3	303.358	2.464	10	0		DEAEHN
C[C@H](N[C@@H](C)[C@@H]1CCCO1)C(=O)N1CCc2sccc2C1	ZINC000183153707	402743557	/nfs/dbraw/zinc/74/35/57/402743557.db2.gz	XVRXXDFCQXYRSH-OBJOEFQTSA-N	0	3	308.447	2.178	10	0		DEAEHN
C[C@@H](NCc1ccc(OCCN(C)C)cc1)c1ccnn1C	ZINC000192689519	402744568	/nfs/dbraw/zinc/74/45/68/402744568.db2.gz	ZQHNUFFMFCINJQ-CQSZACIVSA-N	0	3	302.422	2.211	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2C[C@H]2c2cccc(F)c2F)n1	ZINC000263251782	402750673	/nfs/dbraw/zinc/75/06/73/402750673.db2.gz	PZJIHOBXWBZNLR-GMXVVIOVSA-N	0	3	320.343	2.195	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(C2(Cc3ccccc3)CCC2)n1	ZINC000263278758	402753874	/nfs/dbraw/zinc/75/38/74/402753874.db2.gz	TXMZPKVWVWUMNJ-HNNXBMFYSA-N	0	3	312.417	2.310	10	0		DEAEHN
CC[C@@H](Oc1cccc(C)c1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263298572	402755734	/nfs/dbraw/zinc/75/57/34/402755734.db2.gz	WTWGZLQLDDGYDN-LSDHHAIUSA-N	0	3	316.405	2.484	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(Cc3ccccc3F)C2)CC1	ZINC000174887136	402761793	/nfs/dbraw/zinc/76/17/93/402761793.db2.gz	QRBATJVEYARDFY-KRWDZBQOSA-N	0	3	305.441	2.428	10	0		DEAEHN
CN(CC(=O)NC(C)(C)C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000174948855	402765344	/nfs/dbraw/zinc/76/53/44/402765344.db2.gz	CXAGFFSDZYSOEP-QGZVFWFLSA-N	0	3	317.477	2.498	10	0		DEAEHN
Cc1cccc2[nH]c(CCC(=O)NC3CCN(C)CC3)nc21	ZINC000175070893	402776453	/nfs/dbraw/zinc/77/64/53/402776453.db2.gz	GCYNGMXCUFPNIY-UHFFFAOYSA-N	0	3	300.406	2.014	10	0		DEAEHN
COc1cccc(OC)c1C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000175104691	402779818	/nfs/dbraw/zinc/77/98/18/402779818.db2.gz	QUGAXLBULRNIMJ-CHWSQXEVSA-N	0	3	306.406	2.259	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NCCOC1CCCC1	ZINC000194313466	402791826	/nfs/dbraw/zinc/79/18/26/402791826.db2.gz	NKHGODKXECHAAH-UHFFFAOYSA-N	0	3	320.433	2.316	10	0		DEAEHN
CCC[C@H](C(=O)N1CC[C@](C(=O)OCC)(C(C)C)C1)N(C)C	ZINC000194325140	402792396	/nfs/dbraw/zinc/79/23/96/402792396.db2.gz	NGVRSSIEFYHYTH-RHSMWYFYSA-N	0	3	312.454	2.155	10	0		DEAEHN
C[C@H](Oc1ccc(F)c(F)c1)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000195339108	402842974	/nfs/dbraw/zinc/84/29/74/402842974.db2.gz	JEVGLKVLJLCFQO-NWDGAFQWSA-N	0	3	310.344	2.039	10	0		DEAEHN
CC1(C)CN(CCNCc2c[nH]c(-c3ccccc3)n2)CCO1	ZINC000175992041	402846316	/nfs/dbraw/zinc/84/63/16/402846316.db2.gz	OBHBFMJZABPEQP-UHFFFAOYSA-N	0	3	314.433	2.277	10	0		DEAEHN
CC1(C)CN(CCNCc2cnc(-c3ccccc3)[nH]2)CCO1	ZINC000175992041	402846319	/nfs/dbraw/zinc/84/63/19/402846319.db2.gz	OBHBFMJZABPEQP-UHFFFAOYSA-N	0	3	314.433	2.277	10	0		DEAEHN
C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCC(c3ccn[nH]3)CC2)C1	ZINC000195506068	402848108	/nfs/dbraw/zinc/84/81/08/402848108.db2.gz	AHHGDIBOLJBYCP-ZIAGYGMSSA-N	0	3	304.438	2.094	10	0		DEAEHN
CC(C)N(C(=O)CN1CC[C@H](CNc2ccccn2)C1)C(C)C	ZINC000195515671	402848591	/nfs/dbraw/zinc/84/85/91/402848591.db2.gz	CPFZRFHXDZLEKP-MRXNPFEDSA-N	0	3	318.465	2.461	10	0		DEAEHN
CC(C)CCOCCN1CCC(c2ccnn2CCO)CC1	ZINC000195513449	402849028	/nfs/dbraw/zinc/84/90/28/402849028.db2.gz	IDFAYWDEQVKWNL-UHFFFAOYSA-N	0	3	309.454	2.118	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)c1csc(NC2CC2)n1	ZINC000265829640	402954393	/nfs/dbraw/zinc/95/43/93/402954393.db2.gz	PVWCFZPSBJMVMT-NSHDSACASA-N	0	3	308.451	2.322	10	0		DEAEHN
O[C@H](COCc1ccccc1)CN1CCOCC12CCCC2	ZINC000270680556	403212681	/nfs/dbraw/zinc/21/26/81/403212681.db2.gz	UNKCGNQPUPKORT-KRWDZBQOSA-N	0	3	305.418	2.209	10	0		DEAEHN
CC(=O)c1ccc(CC(=O)NCCN2CCCC[C@H]2C)cc1	ZINC000298705160	403443871	/nfs/dbraw/zinc/44/38/71/403443871.db2.gz	CHDVERNXKNSJRH-CQSZACIVSA-N	0	3	302.418	2.422	10	0		DEAEHN
C/C(=C/c1ccc(Cl)cc1)CNCC(=O)N1CCOCC1	ZINC000345706810	403446290	/nfs/dbraw/zinc/44/62/90/403446290.db2.gz	MLOSRBXRNXUCQU-RAXLEYEMSA-N	0	3	308.809	2.192	10	0		DEAEHN
Cn1nccc1[C@H]1[C@H](N[C@@H]2C=CCCCCC2)CC(=O)N1C	ZINC000293710139	403544032	/nfs/dbraw/zinc/54/40/32/403544032.db2.gz	XSFAUZBZLLKUEX-CKEIUWERSA-N	0	3	302.422	2.170	10	0		DEAEHN
Cc1cc(C)n(-c2cncc(N(C)C[C@H]3CCCN(C)C3)n2)n1	ZINC000301381125	403622893	/nfs/dbraw/zinc/62/28/93/403622893.db2.gz	YMPBYFMRSDNYHL-HNNXBMFYSA-N	0	3	314.437	2.057	10	0		DEAEHN
CC1(C)Cc2ccc(C(=O)N3CCN4CCC[C@H]4C3)c(O)c2O1	ZINC000333034020	403650971	/nfs/dbraw/zinc/65/09/71/403650971.db2.gz	ICLXSYMQXBQVRI-ZDUSSCGKSA-N	0	3	316.401	2.026	10	0		DEAEHN
CCCc1occc1C(=O)N1CCN([C@H]2CCCN(C)C2)CC1	ZINC000366946633	404877191	/nfs/dbraw/zinc/87/71/91/404877191.db2.gz	SKOACSOVEKHDJG-HNNXBMFYSA-N	0	3	319.449	2.084	10	0		DEAEHN
C/C(=C/c1cccc(C(F)(F)F)c1)CN[C@@H]1COC[C@H]1O	ZINC000451229265	404910852	/nfs/dbraw/zinc/91/08/52/404910852.db2.gz	LFMFUDUSEWLOLJ-BCSJQMDCSA-N	0	3	301.308	2.458	10	0		DEAEHN
COC(=O)[C@@H](C)CN(Cc1ccc(-c2cc[nH]n2)o1)C1CC1	ZINC000434980949	404948342	/nfs/dbraw/zinc/94/83/42/404948342.db2.gz	BZQMRTHXGYTUKQ-NSHDSACASA-N	0	3	303.362	2.443	10	0		DEAEHN
CC(C)n1ncnc1CNC[C@H](C)N(C)Cc1ccccc1	ZINC000390709714	405047711	/nfs/dbraw/zinc/04/77/11/405047711.db2.gz	VRLQOQZYBWXOIE-HNNXBMFYSA-N	0	3	301.438	2.469	10	0		DEAEHN
Cc1cc(-c2nnc(CN3CCN4CCC[C@@H]4C3)o2)c(C)o1	ZINC000407950843	405073278	/nfs/dbraw/zinc/07/32/78/405073278.db2.gz	IOMJCYGHUTYKQJ-CYBMUJFWSA-N	0	3	302.378	2.226	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N1CC(=O)N1CCO[C@@H](c2cccc(O)c2)C1	ZINC000408351557	405182720	/nfs/dbraw/zinc/18/27/20/405182720.db2.gz	GFIPEQFUQJDQDM-CKEIUWERSA-N	0	3	318.417	2.165	10	0		DEAEHN
CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)NCCNc1ccncc1	ZINC000439041323	405263889	/nfs/dbraw/zinc/26/38/89/405263889.db2.gz	QGXAEWOIAAVKIC-UAGQMJEPSA-N	0	3	319.449	2.406	10	0		DEAEHN
CO[C@@H]1C[C@@H](NCc2ccc(CS(C)(=O)=O)cc2)C12CCC2	ZINC000453064641	405280457	/nfs/dbraw/zinc/28/04/57/405280457.db2.gz	SEOPFKWTRUZOQV-HZPDHXFCSA-N	0	3	323.458	2.278	10	0		DEAEHN
CN(CC[C@@H]1CCOC1)[C@@H]1CCN(c2ccccc2F)C1=O	ZINC000438118806	405233348	/nfs/dbraw/zinc/23/33/48/405233348.db2.gz	YBOWCKZCUXYVHL-CZUORRHYSA-N	0	3	306.381	2.289	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)[C@@H](C)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000420349537	405328723	/nfs/dbraw/zinc/32/87/23/405328723.db2.gz	PMEKOAKXEAJYTH-YUELXQCFSA-N	0	3	315.417	2.043	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)N[C@@H](C)CN1CCCCC1	ZINC000454620509	405372922	/nfs/dbraw/zinc/37/29/22/405372922.db2.gz	OSZLSOQFUHFUQF-LBPRGKRZSA-N	0	3	308.426	2.219	10	0		DEAEHN
COc1nsc(CNCCN(C)C(C)C)c1Br	ZINC000638478388	405498120	/nfs/dbraw/zinc/49/81/20/405498120.db2.gz	YFKZHDNJPDRPEV-UHFFFAOYSA-N	0	3	322.272	2.344	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N2CCCC[C@H]2CN(C)C)cc1	ZINC000577694921	405492567	/nfs/dbraw/zinc/49/25/67/405492567.db2.gz	POFUHCHUCCSOKJ-KRWDZBQOSA-N	0	3	317.433	2.226	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(C/C=C\c2ccc(F)cc2)CC12COC2	ZINC000449366717	405527115	/nfs/dbraw/zinc/52/71/15/405527115.db2.gz	SEEXJJZYJOKNCG-QGZUEGPWSA-N	0	3	319.376	2.350	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(C[C@H](C)c2ccc(F)cc2)CC12COC2	ZINC000449367927	405528777	/nfs/dbraw/zinc/52/87/77/405528777.db2.gz	ZYONEIOTPTZQAI-BBRMVZONSA-N	0	3	321.392	2.441	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2ccc(OCC)cc2)CC12COC2	ZINC000449367339	405529972	/nfs/dbraw/zinc/52/99/72/405529972.db2.gz	VJFBAWSJTANSAA-MRXNPFEDSA-N	0	3	319.401	2.097	10	0		DEAEHN
CN1CCC(CC(=O)N2CCOC[C@H]2c2ccc(F)cc2)CC1	ZINC000456472395	405543677	/nfs/dbraw/zinc/54/36/77/405543677.db2.gz	IENCXAZXMOZTEH-KRWDZBQOSA-N	0	3	320.408	2.458	10	0		DEAEHN
O=C(CNC1CC(OCc2ccccc2)C1)NCC(F)(F)F	ZINC000493889166	405606655	/nfs/dbraw/zinc/60/66/55/405606655.db2.gz	SDPUPQVTHDDSAN-UHFFFAOYSA-N	0	3	316.323	2.002	10	0		DEAEHN
c1c2cccnc2oc1CNCCc1nnc2n1CCCCC2	ZINC000580515524	405629279	/nfs/dbraw/zinc/62/92/79/405629279.db2.gz	KBSJXNKQRRAIEM-UHFFFAOYSA-N	0	3	311.389	2.478	10	0		DEAEHN
Cc1ccc2c(c1)[C@@H](N[C@H](C)CN1CCN(C)CC1)CCCO2	ZINC000155014195	292353477	/nfs/dbraw/zinc/35/34/77/292353477.db2.gz	RJODDYCCWQMVLD-AEFFLSMTSA-N	0	3	317.477	2.434	10	0		DEAEHN
CC(=O)c1cc(C(=O)N[C@@H]2C[C@H](N(C)C)C2(C)C)c(C)nc1C	ZINC000636103077	405742745	/nfs/dbraw/zinc/74/27/45/405742745.db2.gz	ZDRKJSJCIKFCHG-CVEARBPZSA-N	0	3	317.433	2.360	10	0		DEAEHN
C[C@@H]1CCCN1C(=O)CCN1CC[C@@H](c2nc(C3CC3)no2)C1	ZINC000560367033	405799092	/nfs/dbraw/zinc/79/90/92/405799092.db2.gz	CUYTXZQHWDFPST-TZMCWYRMSA-N	0	3	318.421	2.137	10	0		DEAEHN
COc1nsc(CN[C@@H]2CCOC[C@H]2C)c1Br	ZINC000639121199	405898967	/nfs/dbraw/zinc/89/89/67/405898967.db2.gz	NFSPATDFIZBBLV-HTQZYQBOSA-N	0	3	321.240	2.429	10	0		DEAEHN
CCC(=O)N[C@@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450328852	405836937	/nfs/dbraw/zinc/83/69/37/405836937.db2.gz	PNMWKXVKRBFXAI-QGZVFWFLSA-N	0	3	303.450	2.109	10	0		DEAEHN
C[C@@H]1C[C@H]1c1ccc(CNC(=O)NCCNc2ccncc2)o1	ZINC000560752822	405867081	/nfs/dbraw/zinc/86/70/81/405867081.db2.gz	PVLSWUAFRSYZSL-IUODEOHRSA-N	0	3	314.389	2.131	10	0		DEAEHN
c1cc(CNCCC[C@H]2CCO2)c(OC[C@H]2CCOC2)cn1	ZINC000639184142	405953053	/nfs/dbraw/zinc/95/30/53/405953053.db2.gz	ISGLWNYOMRRBDT-HOCLYGCPSA-N	0	3	306.406	2.156	10	0		DEAEHN
COc1nsc(CNCC[C@H](C)CCO)c1Br	ZINC000639214247	405980236	/nfs/dbraw/zinc/98/02/36/405980236.db2.gz	OBZRFVKRLMANIT-QMMMGPOBSA-N	0	3	323.256	2.412	10	0		DEAEHN
c1nc2n(n1)[C@H](CN1CCC[C@@H]1c1ccc3c(c1)OCO3)CC2	ZINC000639473999	406105634	/nfs/dbraw/zinc/10/56/34/406105634.db2.gz	QVKILVXEUOGHGC-UONOGXRCSA-N	0	3	312.373	2.331	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@@H]1CCOC2(CCC2)C1	ZINC000487277599	406221367	/nfs/dbraw/zinc/22/13/67/406221367.db2.gz	LRYJGMGXRGOUGB-SNVBAGLBSA-N	0	3	314.227	2.374	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)c2cncnc2)[C@@H]1c1cccs1	ZINC000546891184	406386371	/nfs/dbraw/zinc/38/63/71/406386371.db2.gz	AJVIGKMBITYHLN-IUODEOHRSA-N	0	3	316.430	2.351	10	0		DEAEHN
c1ccc(N2CC[C@H](CN3CCN(c4ncccn4)CC3)C2)cc1	ZINC000637836785	406439862	/nfs/dbraw/zinc/43/98/62/406439862.db2.gz	UCTCUZVUOCEUGG-QGZVFWFLSA-N	0	3	323.444	2.125	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NC1CCCCCC1	ZINC000637875327	406458025	/nfs/dbraw/zinc/45/80/25/406458025.db2.gz	SPXXSKKYJOHIMW-QGZVFWFLSA-N	0	3	303.450	2.285	10	0		DEAEHN
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)[C@@H]1OCC[C@@H]1N	ZINC000637886253	406462194	/nfs/dbraw/zinc/46/21/94/406462194.db2.gz	ZVJRUCNGLHJBCF-NWDGAFQWSA-N	0	3	303.189	2.068	10	0		DEAEHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)c1cccc2nccnc21	ZINC000548394505	406510407	/nfs/dbraw/zinc/51/04/07/406510407.db2.gz	DWYHPGDXVGLEHG-HNNXBMFYSA-N	0	3	312.417	2.480	10	0		DEAEHN
C[C@H]1CC[C@H](NC(=O)[C@@H](N)CN(C)Cc2ccccc2)CC1	ZINC000637987947	406511584	/nfs/dbraw/zinc/51/15/84/406511584.db2.gz	UYCMPXPJCUIVJA-XIRDDKMYSA-N	0	3	303.450	2.141	10	0		DEAEHN
c1nc(-c2ccncc2)sc1CNCCOC[C@@H]1CCCO1	ZINC000553473227	406761188	/nfs/dbraw/zinc/76/11/88/406761188.db2.gz	DPWBYGVNLMRNGF-AWEZNQCLSA-N	0	3	319.430	2.490	10	0		DEAEHN
COCCCCNCc1snc(OC)c1Br	ZINC000638370712	406730755	/nfs/dbraw/zinc/73/07/55/406730755.db2.gz	FPXWZYPEAZVCAI-UHFFFAOYSA-N	0	3	309.229	2.430	10	0		DEAEHN
C[C@@H](NC(=O)[C@H]1CNCCOC1)c1ccc(Cl)cc1Cl	ZINC000643619218	407018097	/nfs/dbraw/zinc/01/80/97/407018097.db2.gz	PTOZSDXONZXTQU-ZJUUUORDSA-N	0	3	317.216	2.407	10	0		DEAEHN
CN(Cc1cc(Cl)cc(Cl)c1)C(=O)[C@H]1CNCCOC1	ZINC000643645311	407021558	/nfs/dbraw/zinc/02/15/58/407021558.db2.gz	JCBNVVBSLHLFFD-NSHDSACASA-N	0	3	317.216	2.188	10	0		DEAEHN
CC(C(=O)N(Cc1ccoc1)C1CCCCC1)S(C)(=O)=O	ZINC000129457064	196050351	/nfs/dbraw/zinc/05/03/51/196050351.db2.gz	OLGOOWFOLNKJDV-GFCCVEGCSA-N	0	3	313.419	2.374	10	0		DEAEHN
CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)[C@H](C)C1	ZINC000129505720	196053837	/nfs/dbraw/zinc/05/38/37/196053837.db2.gz	ATIOBQUTIDCWIC-IUODEOHRSA-N	0	3	323.412	2.403	10	0		DEAEHN
CC[N@H+]1CC[C@@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)[C@H](C)C1	ZINC000129505720	196053839	/nfs/dbraw/zinc/05/38/39/196053839.db2.gz	ATIOBQUTIDCWIC-IUODEOHRSA-N	0	3	323.412	2.403	10	0		DEAEHN
CCCNc1cc(C)ncc1C(=O)N[C@H](C)CC[S@](C)=O	ZINC000129660555	196066033	/nfs/dbraw/zinc/06/60/33/196066033.db2.gz	KSJNVKTVAKJDSL-WSVYEEACSA-N	0	3	311.451	2.099	10	0		DEAEHN
CC(C)(C)c1csc(NC(=O)C(C)(C)N2CCNCC2)n1	ZINC000129707492	196069015	/nfs/dbraw/zinc/06/90/15/196069015.db2.gz	WTVJONHQRZWJBF-UHFFFAOYSA-N	0	3	310.467	2.063	10	0		DEAEHN
CCN[C@H](CCCS(C)(=O)=O)c1c(OC)cccc1OC	ZINC000131116982	196141668	/nfs/dbraw/zinc/14/16/68/196141668.db2.gz	QWGPMIHWPULCJY-GFCCVEGCSA-N	0	3	315.435	2.179	10	0		DEAEHN
CN(c1nc(C(F)(F)F)ccc1CN)[C@@H]1CCCC[C@@H]1O	ZINC000131177600	196146778	/nfs/dbraw/zinc/14/67/78/196146778.db2.gz	ORASUBZTPBAKCU-MNOVXSKESA-N	0	3	303.328	2.299	10	0		DEAEHN
CS(=O)(=O)CCC[C@H](N)c1ccc(F)cc1Br	ZINC000131306253	196158755	/nfs/dbraw/zinc/15/87/55/196158755.db2.gz	APZJTNPQJMIZNY-NSHDSACASA-N	0	3	324.215	2.413	10	0		DEAEHN
Cc1cccc(NC(=O)[C@]2(C)COC[C@@H]2N)c1Br	ZINC000131436019	196168341	/nfs/dbraw/zinc/16/83/41/196168341.db2.gz	NTVYSTSVBMNVSR-GXFFZTMASA-N	0	3	313.195	2.060	10	0		DEAEHN
CCCN[C@H](Cc1cccc(F)c1F)[C@@H](C)S(C)(=O)=O	ZINC000131485815	196173284	/nfs/dbraw/zinc/17/32/84/196173284.db2.gz	JOQGTAAHTHTIHB-ZWNOBZJWSA-N	0	3	305.390	2.309	10	0		DEAEHN
CS[C@H](C)CCNS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000131612562	196184661	/nfs/dbraw/zinc/18/46/61/196184661.db2.gz	IEAYTXIJWQZLJY-LLVKDONJSA-N	0	3	320.480	2.198	10	0		DEAEHN
CS[C@H](C)CC[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000131612562	196184662	/nfs/dbraw/zinc/18/46/62/196184662.db2.gz	IEAYTXIJWQZLJY-LLVKDONJSA-N	0	3	320.480	2.198	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2CC[C@@H](C)[C@@H](C)C2)cs1	ZINC000131779931	196198238	/nfs/dbraw/zinc/19/82/38/196198238.db2.gz	WHQWTPZNNNRSCH-MNOVXSKESA-N	0	3	302.465	2.134	10	0		DEAEHN
C[C@@H](C(=O)N1CCC(c2cc[nH]n2)CC1)N1[C@H](C)CC[C@@H]1C	ZINC000131934480	196211426	/nfs/dbraw/zinc/21/14/26/196211426.db2.gz	VAAZYIQFQIVCCD-MJBXVCDLSA-N	0	3	304.438	2.377	10	0		DEAEHN
C[C@H]1CNC[C@@H](COCc2cc(F)cc(Br)c2)O1	ZINC000132630000	196272611	/nfs/dbraw/zinc/27/26/11/196272611.db2.gz	VXSWGZZTVHCZNO-ZANVPECISA-N	0	3	318.186	2.482	10	0		DEAEHN
Cc1ccc([C@@H](CN)N[C@@H](C)CCO)c(Br)c1	ZINC000132684023	196275792	/nfs/dbraw/zinc/27/57/92/196275792.db2.gz	QLAOUAJDTVLABQ-GXFFZTMASA-N	0	3	301.228	2.118	10	0		DEAEHN
C[C@H]1CNC[C@@H](COCc2cccc(Br)c2)O1	ZINC000132729241	196278658	/nfs/dbraw/zinc/27/86/58/196278658.db2.gz	IWOXMRKXQNWLGK-GWCFXTLKSA-N	0	3	300.196	2.343	10	0		DEAEHN
COCc1cc([C@H](C)N[C@H]2CCC(=O)N(C)C2)ccc1OC	ZINC000133006554	196304699	/nfs/dbraw/zinc/30/46/99/196304699.db2.gz	BHMYRYKSUQLSKQ-WFASDCNBSA-N	0	3	306.406	2.113	10	0		DEAEHN
COCCN(C)CCCNC(=O)c1[nH]c2ccc(C)cc2c1C	ZINC000133168524	196318075	/nfs/dbraw/zinc/31/80/75/196318075.db2.gz	RBAGFUKCIJXIPH-UHFFFAOYSA-N	0	3	317.433	2.483	10	0		DEAEHN
C[C@H]1CN(C)CC[C@@H]1NC(=O)c1cc(Cl)nc(Cl)c1	ZINC000133729886	196332066	/nfs/dbraw/zinc/33/20/66/196332066.db2.gz	FVKGHEJPEBYPIJ-WPRPVWTQSA-N	0	3	302.205	2.458	10	0		DEAEHN
CCN[C@H](c1c(Br)cnn1C)[C@@H]1CO[C@@H](C)C1	ZINC000133932422	196347180	/nfs/dbraw/zinc/34/71/80/196347180.db2.gz	IQJCTRKFAFZZEW-QXEWZRGKSA-N	0	3	302.216	2.258	10	0		DEAEHN
COCC(C)(C)NC[C@@H](O)c1cccc(Br)c1	ZINC000134309858	196378378	/nfs/dbraw/zinc/37/83/78/196378378.db2.gz	ABEVULGOYFKQBK-GFCCVEGCSA-N	0	3	302.212	2.497	10	0		DEAEHN
CN(C)[C@@H](CNCCNC(=O)OC(C)(C)C)c1cccs1	ZINC000134520659	196398665	/nfs/dbraw/zinc/39/86/65/196398665.db2.gz	VEHNEBUARBPASY-LBPRGKRZSA-N	0	3	313.467	2.465	10	0		DEAEHN
CCOC(=O)[C@@H]1CCCc2sc(N[C@@H]3CCN(C)C3)nc21	ZINC000136700904	196547988	/nfs/dbraw/zinc/54/79/88/196547988.db2.gz	MRORYKBKKKJZQY-GHMZBOCLSA-N	0	3	309.435	2.242	10	0		DEAEHN
Cc1nc2scc(C3CC3)n2c1CNC[C@@]1(C)CCC(=O)N1	ZINC000571762016	292571173	/nfs/dbraw/zinc/57/11/73/292571173.db2.gz	WWBLIAKKXFDGCZ-MRXNPFEDSA-N	0	3	318.446	2.340	10	0		DEAEHN
Cc1cc(C)c(OCC(=O)N2CCN3CCC[C@@H]3C2)c(C)c1	ZINC000195309350	225202756	/nfs/dbraw/zinc/20/27/56/225202756.db2.gz	HGIKPJYBXAYJJJ-MRXNPFEDSA-N	0	3	302.418	2.297	10	0		DEAEHN
CCc1nn(C)cc1CN[C@H]1CCCO[C@@H]1c1ccncc1	ZINC000299741544	229376116	/nfs/dbraw/zinc/37/61/16/229376116.db2.gz	GFDHYYVLNIHJAM-DLBZAZTESA-N	0	3	300.406	2.387	10	0		DEAEHN
CC1(C)CN(C[C@@H](O)CCc2ccccc2)C[C@]2(CCOC2)O1	ZINC000361528220	424844981	/nfs/dbraw/zinc/84/49/81/424844981.db2.gz	VKTPGIFCQMORPF-HKUYNNGSSA-N	0	3	319.445	2.250	10	0		DEAEHN
COc1cc(CNC(=O)N[C@H](CC(C)C)CN(C)C)ccc1O	ZINC000193191776	424866885	/nfs/dbraw/zinc/86/68/85/424866885.db2.gz	CMRPPYDFGPABJP-CQSZACIVSA-N	0	3	323.437	2.176	10	0		DEAEHN
Cc1ncc(-c2noc([C@@H]3CCCN3C3CCCC3)n2)c(N)n1	ZINC000333158752	424919744	/nfs/dbraw/zinc/91/97/44/424919744.db2.gz	HYHJRZOMIRHAIV-ZDUSSCGKSA-N	0	3	314.393	2.497	10	0		DEAEHN
CC(C)C(=O)N1CCO[C@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC000404151859	424925351	/nfs/dbraw/zinc/92/53/51/424925351.db2.gz	QBZASLDSHIVVRU-SJORKVTESA-N	0	3	302.418	2.144	10	0		DEAEHN
O[C@]1(CCNCc2ccc(Br)cc2F)CCOC1	ZINC000404185708	424926243	/nfs/dbraw/zinc/92/62/43/424926243.db2.gz	CWXZBZMMTDNFAV-CYBMUJFWSA-N	0	3	318.186	2.219	10	0		DEAEHN
C[C@H](CNC(=O)c1nscc1Br)N(C)C1CC1	ZINC000404875337	424929561	/nfs/dbraw/zinc/92/95/61/424929561.db2.gz	WHILBNYMFVRTSO-SSDOTTSWSA-N	0	3	318.240	2.118	10	0		DEAEHN
CCc1nc(CNC(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)cs1	ZINC000085403434	267388007	/nfs/dbraw/zinc/38/80/07/267388007.db2.gz	ZMQAXXMTCJKVHW-AAEUAGOBSA-N	0	3	310.467	2.187	10	0		DEAEHN
CN1C[C@@H](CNCc2sccc2Br)CC1=O	ZINC000657694328	425387621	/nfs/dbraw/zinc/38/76/21/425387621.db2.gz	CYIOPUINVRWGRH-MRVPVSSYSA-N	0	3	303.225	2.079	10	0		DEAEHN
Cc1ccc(SCC(=O)N(C)[C@@H](CN)C(F)(F)F)cc1	ZINC000662976380	425770527	/nfs/dbraw/zinc/77/05/27/425770527.db2.gz	OWPRYIDDYUTABX-NSHDSACASA-N	0	3	306.353	2.435	10	0		DEAEHN
C[C@@]1(F)CNCCN(c2cncc(OCC3CCCC3)n2)C1	ZINC000333919045	269004180	/nfs/dbraw/zinc/00/41/80/269004180.db2.gz	OSHNRIBSWKQCMJ-MRXNPFEDSA-N	0	3	308.401	2.183	10	0		DEAEHN
C[C@@]1(F)CNCCN(c2cncc(OC3CCCCC3)n2)C1	ZINC000333918908	269004366	/nfs/dbraw/zinc/00/43/66/269004366.db2.gz	ONBYOYQUHXFECD-MRXNPFEDSA-N	0	3	308.401	2.326	10	0		DEAEHN
CCN1CC[C@H](NC(=O)N2CCC[C@H]2c2noc(C(C)C)n2)C1	ZINC000334110198	269019746	/nfs/dbraw/zinc/01/97/46/269019746.db2.gz	BDAOKGJBHDMDPI-STQMWFEESA-N	0	3	321.425	2.134	10	0		DEAEHN
C[C@@H](NC(=O)N1CCC[C@H]1CN1CCCCC1)c1csnn1	ZINC000334119642	269021780	/nfs/dbraw/zinc/02/17/80/269021780.db2.gz	KFEPXNKOOPXDGH-OLZOCXBDSA-N	0	3	323.466	2.259	10	0		DEAEHN
CCN1CC[C@H](NC(=O)c2ccc(Br)c(F)c2)C1	ZINC000390009079	269097461	/nfs/dbraw/zinc/09/74/61/269097461.db2.gz	SFBCSGLDJKNIOI-JTQLQIEISA-N	0	3	315.186	2.412	10	0		DEAEHN
Cc1oc(Br)cc1C(=O)N(C)C[C@H]1CCN(C)C1	ZINC000396656764	269103538	/nfs/dbraw/zinc/10/35/38/269103538.db2.gz	QOIUVCQCLHMYAJ-JTQLQIEISA-N	0	3	315.211	2.374	10	0		DEAEHN
c1c2cccnc2oc1CNCCc1cn2c(n1)SCC2	ZINC000516241753	269360859	/nfs/dbraw/zinc/36/08/59/269360859.db2.gz	RXLVXRTZSZLQGO-UHFFFAOYSA-N	0	3	300.387	2.462	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N[C@H]1COc2ccccc21	ZINC000195196816	273515860	/nfs/dbraw/zinc/51/58/60/273515860.db2.gz	NHBLXJNNXHHRDE-ZFWWWQNUSA-N	0	3	305.422	2.396	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1nc2cccnc2s1	ZINC000248733640	274375610	/nfs/dbraw/zinc/37/56/10/274375610.db2.gz	MEXURVAJMKGKDQ-MNOVXSKESA-N	0	3	302.403	2.000	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000246944980	275650613	/nfs/dbraw/zinc/65/06/13/275650613.db2.gz	HXEZMZLVPYHCEJ-GRDNDAEWSA-N	0	3	324.490	2.469	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@@H](Cc1ccccc1)N(C)C	ZINC000176999312	276180681	/nfs/dbraw/zinc/18/06/81/276180681.db2.gz	DIOKHSLEQYZGPH-ZWKOTPCHSA-N	0	3	317.477	2.102	10	0		DEAEHN
CN(C)[C@H]1CCCN(C(=O)N[C@H]2CCOc3ccccc32)C1	ZINC000171582820	276868034	/nfs/dbraw/zinc/86/80/34/276868034.db2.gz	GKXPWZUXYFRYJX-ZFWWWQNUSA-N	0	3	303.406	2.246	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)[C@H]2COc3ccccc32)C1	ZINC000247022221	277157555	/nfs/dbraw/zinc/15/75/55/277157555.db2.gz	ZMXVQQKWPKHRFG-VNQPRFMTSA-N	0	3	300.402	2.105	10	0		DEAEHN
COC(C)(C)C[C@@H](C)NCc1c(Br)cnn1C	ZINC000487311853	277177490	/nfs/dbraw/zinc/17/74/90/277177490.db2.gz	QKAMPZNKXZNSME-SECBINFHSA-N	0	3	304.232	2.476	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@@H]2CCOc3ccccc32)C1	ZINC000094635820	278116547	/nfs/dbraw/zinc/11/65/47/278116547.db2.gz	OAQWJVWYPBIUCP-UMVBOHGHSA-N	0	3	309.431	2.456	10	0		DEAEHN
C[C@H](C(=O)N[C@H]1CCCC[C@H]1C)N1CCCN(C2CC2)CC1	ZINC000172346508	278155201	/nfs/dbraw/zinc/15/52/01/278155201.db2.gz	ZYHOOUHVXDWADJ-INMHGKMJSA-N	0	3	307.482	2.240	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN1CCC[C@H](CCC(=O)OC(C)(C)C)C1	ZINC000412059679	278233277	/nfs/dbraw/zinc/23/32/77/278233277.db2.gz	CWHAVBUSRAWIFF-PBHICJAKSA-N	0	3	313.438	2.160	10	0		DEAEHN
C[C@H](N[C@H]1CCc2ncnn2C1)c1ccc(F)cc1N(C)C	ZINC000180594404	278284509	/nfs/dbraw/zinc/28/45/09/278284509.db2.gz	GCCRCVNPHYUXEW-AAEUAGOBSA-N	0	3	303.385	2.149	10	0		DEAEHN
CC(C)CCS(=O)(=O)N1CCCC[C@@H](N2CCCC2)C1	ZINC000107708155	278776780	/nfs/dbraw/zinc/77/67/80/278776780.db2.gz	FASMFRQCKOCCLP-OAHLLOKOSA-N	0	3	302.484	2.313	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CC[C@H]2OCCC[C@H]2C1	ZINC000246416196	279125786	/nfs/dbraw/zinc/12/57/86/279125786.db2.gz	AGKHKUVDLRWLGU-ARFHVFGLSA-N	0	3	311.470	2.173	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@H]1OCCc2ccccc21	ZINC000129603046	279131946	/nfs/dbraw/zinc/13/19/46/279131946.db2.gz	ZVIXOEVIPKQABE-WBVHZDCISA-N	0	3	304.434	2.393	10	0		DEAEHN
Cc1c(CN[C@H](CNC(=O)OC(C)(C)C)C2CC2)cnn1C	ZINC000162867644	280227790	/nfs/dbraw/zinc/22/77/90/280227790.db2.gz	AANCFGZDSANDSV-CQSZACIVSA-N	0	3	308.426	2.121	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN(CC(=O)NC(C)(C)C)C2)n1	ZINC000195516109	281245110	/nfs/dbraw/zinc/24/51/10/281245110.db2.gz	BHLCDXQBJRXFCS-AWEZNQCLSA-N	0	3	304.438	2.039	10	0		DEAEHN
C[C@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)[C@@H]1CCCO1	ZINC000078434830	289868422	/nfs/dbraw/zinc/86/84/22/289868422.db2.gz	TWPXMWJWRXQPKD-BPUTZDHNSA-N	0	3	305.422	2.156	10	0		DEAEHN
CN1CC[C@@H](NC(=O)Cc2ccc(O)cc2)[C@@H]1c1ccccc1	ZINC000180129846	290134521	/nfs/dbraw/zinc/13/45/21/290134521.db2.gz	ITGDFWKFMWBRHZ-MJGOQNOKSA-N	0	3	310.397	2.496	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)N[C@H](CN(C)C)c2ccccc2)n1	ZINC000120257456	301253339	/nfs/dbraw/zinc/25/33/39/301253339.db2.gz	MBRKGYSREXVDFV-NVXWUHKLSA-N	0	3	314.433	2.480	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H]2C[NH2+]CC[C@H]2C)c(Cl)cc1F	ZINC000193399918	301399426	/nfs/dbraw/zinc/39/94/26/301399426.db2.gz	XTEAGIINMUMSMZ-PRHODGIISA-N	0	3	320.817	2.064	10	0		DEAEHN
Cc1ccc(N(C)C(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)cc1	ZINC000262549308	301619656	/nfs/dbraw/zinc/61/96/56/301619656.db2.gz	SCPCUPDXQQPULI-RVKKMQEKSA-N	0	3	302.418	2.490	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)C23CCC(C(=O)OC)(CC2)CC3)C1	ZINC000574468999	326157785	/nfs/dbraw/zinc/15/77/85/326157785.db2.gz	OFWROJZOINJHOI-NNGSBXSVSA-N	0	3	322.449	2.101	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000189958714	335754675	/nfs/dbraw/zinc/75/46/75/335754675.db2.gz	YPASLEHCGXPLRL-ZIAGYGMSSA-N	0	3	322.453	2.427	10	0		DEAEHN
CCCOc1nc(C)ccc1C(=O)N1CC[C@@H](N2CCCC2)C1	ZINC000191090196	337399513	/nfs/dbraw/zinc/39/95/13/337399513.db2.gz	YBYDWFZWOKIYOP-OAHLLOKOSA-N	0	3	317.433	2.489	10	0		DEAEHN
C[C@@H]1CCC[C@H](NC(=O)NC[C@H](O)CN2CCCCC2)CC1	ZINC000190957310	533872652	/nfs/dbraw/zinc/87/26/52/533872652.db2.gz	ANJIPJOSQHDHJO-PMPSAXMXSA-N	0	3	311.470	2.101	10	0		DEAEHN
C[C@H]1COCC[C@@H]1C(=O)NCCCN1CCc2ccccc2C1	ZINC000193989688	534032110	/nfs/dbraw/zinc/03/21/10/534032110.db2.gz	FLCWRSQHHRGETE-YJBOKZPZSA-N	0	3	316.445	2.224	10	0		DEAEHN
CC(=O)CCN(C)C(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000372324273	519413805	/nfs/dbraw/zinc/41/38/05/519413805.db2.gz	JFFWFWORQUOEGT-KRWDZBQOSA-N	0	3	302.418	2.336	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)CSCc2ccncc2)[C@@H](C)C1	ZINC000158886021	519696205	/nfs/dbraw/zinc/69/62/05/519696205.db2.gz	DYFWKYDBSNUBCQ-ZFWWWQNUSA-N	0	3	307.463	2.160	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2ccc(-c3cc[nH]n3)o2)[C@@]12CCCO2	ZINC000366009234	520366905	/nfs/dbraw/zinc/36/69/05/520366905.db2.gz	LIVVYKSLSAEDSQ-ZACQAIPSSA-N	0	3	317.389	2.486	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccc(OCC2CC2)nc1)N(C)C	ZINC000161880522	520590120	/nfs/dbraw/zinc/59/01/20/520590120.db2.gz	OLMPDMXZVTUTJV-HNNXBMFYSA-N	0	3	305.422	2.217	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC[C@@H](c2nncn2C2CC2)C1)N(C)C	ZINC000153482999	520972749	/nfs/dbraw/zinc/97/27/49/520972749.db2.gz	LERCNROIMOJKPA-UKRRQHHQSA-N	0	3	319.453	2.049	10	0		DEAEHN
CCOc1ccc(CNC(=O)N2CCC[C@@H](N(C)C)C2)cc1F	ZINC000106340225	520987827	/nfs/dbraw/zinc/98/78/27/520987827.db2.gz	FUVOIRBOFJMJHU-CQSZACIVSA-N	0	3	323.412	2.460	10	0		DEAEHN
CCC(C)(C)[C@H]1CCCN1CC(=O)N1CCC[C@@H](NC(C)=O)C1	ZINC000246221359	521364755	/nfs/dbraw/zinc/36/47/55/521364755.db2.gz	DKXGRACBUQOOHA-HZPDHXFCSA-N	0	3	323.481	2.014	10	0		DEAEHN
COC[C@@H](C)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000163359740	522173828	/nfs/dbraw/zinc/17/38/28/522173828.db2.gz	RMSRAGYHVRZXAT-QAPCUYQASA-N	0	3	304.434	2.440	10	0		DEAEHN
COC(=O)[C@@H]1CCN(Cc2cccc(NC(C)=O)c2)C[C@H]1C	ZINC000248956058	523718796	/nfs/dbraw/zinc/71/87/96/523718796.db2.gz	AMKXEVPGGNDNJB-MLGOLLRUSA-N	0	3	304.390	2.276	10	0		DEAEHN
Cc1cccc(-c2n[nH]cc2CN2CCO[C@H](CN(C)C)C2)c1	ZINC000128153990	524103668	/nfs/dbraw/zinc/10/36/68/524103668.db2.gz	HQMANQVAUNKNGD-QGZVFWFLSA-N	0	3	314.433	2.148	10	0		DEAEHN
Cc1ccc(CN2CCC[C@H](C(=O)N3CCOCC3)C2)s1	ZINC000179891879	524450093	/nfs/dbraw/zinc/45/00/93/524450093.db2.gz	GXUXNWWZPOLKKB-AWEZNQCLSA-N	0	3	308.447	2.127	10	0		DEAEHN
Cc1cc(NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)ccc1C(N)=O	ZINC000246821051	525171615	/nfs/dbraw/zinc/17/16/15/525171615.db2.gz	XEXVHGQLWOIKRL-JSGCOSHPSA-N	0	3	318.421	2.040	10	0		DEAEHN
COc1ccc([C@H](C)NCCn2ccnc2)cc1NC(C)=O	ZINC000155720407	525321567	/nfs/dbraw/zinc/32/15/67/525321567.db2.gz	IDAVQRTWYJAHRX-LBPRGKRZSA-N	0	3	302.378	2.201	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)C[C@@H](N)c1ccccc1	ZINC000262914479	534912101	/nfs/dbraw/zinc/91/21/01/534912101.db2.gz	RBLCHSSKMRZHTL-OAHLLOKOSA-N	0	3	300.406	2.245	10	0		DEAEHN
COCCCN(C)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000248733736	536493530	/nfs/dbraw/zinc/49/35/30/536493530.db2.gz	DLFQDNJOBSXJRG-NVXWUHKLSA-N	0	3	319.449	2.185	10	0		DEAEHN
Cc1nc2n(n1)CCC[C@@H]2N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2	ZINC000245972365	527187497	/nfs/dbraw/zinc/18/74/97/527187497.db2.gz	ZZDWNYZLTYTCLZ-BYNSBNAKSA-N	0	3	302.422	2.359	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@@H](C)NC[C@@H](C)CS(C)(=O)=O	ZINC000157618656	527585015	/nfs/dbraw/zinc/58/50/15/527585015.db2.gz	FRJZWPDWQZBYJH-VXGBXAGGSA-N	0	3	315.483	2.278	10	0		DEAEHN
CC1(C)CC[C@H](CNC(=O)N2CCN(C3CCCC3)CC2)O1	ZINC000188215070	529041967	/nfs/dbraw/zinc/04/19/67/529041967.db2.gz	VUYVBSLKBFDTNA-OAHLLOKOSA-N	0	3	309.454	2.214	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1ccn([C@@H](C)COC)n1	ZINC000189879317	529066860	/nfs/dbraw/zinc/06/68/60/529066860.db2.gz	PJKKODIEZAMPIG-UONOGXRCSA-N	0	3	323.441	2.039	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccc(NC(=O)C3CC3)cc2)C1	ZINC000328913443	529091269	/nfs/dbraw/zinc/09/12/69/529091269.db2.gz	PNIORELAZYBXBW-INIZCTEOSA-N	0	3	315.417	2.249	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N(C)C(=O)N[C@H]2CCCN(CC)C2)C12CCC2	ZINC000248043614	535391373	/nfs/dbraw/zinc/39/13/73/535391373.db2.gz	ULBGJKLRDCPLHG-ARFHVFGLSA-N	0	3	323.481	2.460	10	0		DEAEHN
CN(C)CCOc1ccccc1-c1nc(C2(N)CCCC2)no1	ZINC000261899103	535912822	/nfs/dbraw/zinc/91/28/22/535912822.db2.gz	YJVPTVJMUXCOPY-UHFFFAOYSA-N	0	3	316.405	2.405	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2cccn2Cc2cccs2)CCO1	ZINC000128205291	535970081	/nfs/dbraw/zinc/97/00/81/535970081.db2.gz	YBSPAQNNMPARTH-INIZCTEOSA-N	0	3	319.474	2.360	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@H](C)N1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000249862865	536163147	/nfs/dbraw/zinc/16/31/47/536163147.db2.gz	GSFDMQXPJKZFEL-BPUTZDHNSA-N	0	3	318.465	2.427	10	0		DEAEHN
CN(c1cccnn1)C1CCN(C[C@@H](O)CC2CCCC2)CC1	ZINC000191334016	536299826	/nfs/dbraw/zinc/29/98/26/536299826.db2.gz	HKOHSZZQIKCKLU-KRWDZBQOSA-N	0	3	318.465	2.318	10	0		DEAEHN
CNC(=O)c1ccc(CN2CC[C@]3(O)CCCC[C@H]3C2)cc1	ZINC000247966322	536423931	/nfs/dbraw/zinc/42/39/31/536423931.db2.gz	GVRPPDRGYPHNAR-FUHWJXTLSA-N	0	3	302.418	2.173	10	0		DEAEHN
COC[C@H](NC(=O)N(C)[C@@H]1CCN(C(C)C)C1)c1ccccc1	ZINC000458247539	536868410	/nfs/dbraw/zinc/86/84/10/536868410.db2.gz	XPSMDMGDAPSMOC-SJORKVTESA-N	0	3	319.449	2.498	10	0		DEAEHN
Cn1cc(CC(=O)O[C@@H]2CCCN(Cc3ccccc3)C2)cn1	ZINC000183174726	625295198	/nfs/dbraw/zinc/29/51/98/625295198.db2.gz	OJPAWAUUPJIVFA-QGZVFWFLSA-N	0	3	313.401	2.170	10	0		DEAEHN
C/C(=C/c1ccc(F)cc1)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000255652394	625597397	/nfs/dbraw/zinc/59/73/97/625597397.db2.gz	OVRRSDGJDGAXRJ-DDKJEQMHSA-N	0	3	306.381	2.018	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1cc2c(cc1OC)C[C@H](C)O2)N(C)C	ZINC000162666141	625600594	/nfs/dbraw/zinc/60/05/94/625600594.db2.gz	DPIDHMHXLREZIR-WFASDCNBSA-N	0	3	320.433	2.365	10	0		DEAEHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@H]2CCOC[C@H]2C)c1	ZINC000192509480	625691748	/nfs/dbraw/zinc/69/17/48/625691748.db2.gz	LFJSHDBHSPDWLD-BYCMXARLSA-N	0	3	316.357	2.015	10	0		DEAEHN
CCCOc1ccc(NC(=O)[C@@H](N)CCOC)cc1Cl	ZINC000052808159	625105964	/nfs/dbraw/zinc/10/59/64/625105964.db2.gz	ONSMTVGIPGUDEY-LBPRGKRZSA-N	0	3	300.786	2.431	10	0		DEAEHN
CC(C)(C)n1cc(CN2CCN(CC[C@H]3CCCO3)CC2)cn1	ZINC000189191396	637353211	/nfs/dbraw/zinc/35/32/11/637353211.db2.gz	UKILIRBYDVVXSH-QGZVFWFLSA-N	0	3	320.481	2.325	10	0		DEAEHN
COC(=O)/C(C)=C\CN(CCCO)[C@@H]1CCc2ccccc21	ZINC000748818221	638594553	/nfs/dbraw/zinc/59/45/53/638594553.db2.gz	SDLXKKGCSCYGNJ-OOXMNIKJSA-N	0	3	303.402	2.478	10	0		DEAEHN
CCN1CC[C@@H](N[C@H](C)c2ccc(N3CCCC3=O)cc2)C1=O	ZINC000802318008	645516847	/nfs/dbraw/zinc/51/68/47/645516847.db2.gz	LWVQFJGEFUSFQE-CZUORRHYSA-N	0	3	315.417	2.085	10	0		DEAEHN
COCC(=O)N[C@H]1CN(C/C(C)=C\c2ccco2)C[C@@H]1C1CC1	ZINC000229938774	646708678	/nfs/dbraw/zinc/70/86/78/646708678.db2.gz	OVHWQXBGPREZAR-WJZHFJKWSA-N	0	3	318.417	2.156	10	0		DEAEHN
C#CCN1CCC(C(=O)Nc2ccnn2C2CCCC2)CC1	ZINC000068918979	648509967	/nfs/dbraw/zinc/50/99/67/648509967.db2.gz	FYGIKXHWEHKGDN-UHFFFAOYSA-N	0	3	300.406	2.282	10	0		DEAEHN
O[C@@H](CN[C@@H]1COc2ccccc21)COCc1cccs1	ZINC000070529739	648943129	/nfs/dbraw/zinc/94/31/29/648943129.db2.gz	WBQUMRLSDUQZLV-SWLSCSKDSA-N	0	3	305.399	2.349	10	0		DEAEHN
O[C@H](CN[C@@H]1COc2ccccc21)COCc1cccs1	ZINC000070529741	648943153	/nfs/dbraw/zinc/94/31/53/648943153.db2.gz	WBQUMRLSDUQZLV-IUODEOHRSA-N	0	3	305.399	2.349	10	0		DEAEHN
N#Cc1sc(NC[C@@H]2NCCc3ccccc32)nc1Cl	ZINC000380315439	685396397	/nfs/dbraw/zinc/39/63/97/685396397.db2.gz	JAQJLFFLRLBXHU-NSHDSACASA-N	0	3	304.806	2.389	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc(OC(C)=O)cc2)CCN1CCOC	ZINC000123090332	684122079	/nfs/dbraw/zinc/12/20/79/684122079.db2.gz	JDCJZLFZACRXDN-KRWDZBQOSA-N	0	3	320.433	2.155	10	0		DEAEHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCO[C@@H]2C)c1	ZINC000192196661	684444433	/nfs/dbraw/zinc/44/44/33/684444433.db2.gz	DRUQBVADSXCZOE-KCPJHIHWSA-N	0	3	316.357	2.158	10	0		DEAEHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2ccnc(C#N)c2)c1	ZINC000193530236	685042669	/nfs/dbraw/zinc/04/26/69/685042669.db2.gz	QZTSFMRSINTNDU-HNNXBMFYSA-N	0	3	304.309	2.223	10	0		DEAEHN
COc1ccccc1[C@H](O)CNC(=O)[C@H](C)N1[C@H](C)CC[C@@H]1C	ZINC000245201830	685109395	/nfs/dbraw/zinc/10/93/95/685109395.db2.gz	MZSIFYKGVWIMMJ-KNCOVGOOSA-N	0	3	320.433	2.106	10	0		DEAEHN
O=S(=O)([N-][C@@H]1CC[NH2+]C12CCCC2)c1ccc(Cl)s1	ZINC000401604101	782246639	/nfs/dbraw/zinc/24/66/39/782246639.db2.gz	GGGLZUWTRSSDQN-SECBINFHSA-N	0	3	320.867	2.355	10	0		DEAEHN
FC(F)(F)[C@@H]1CC[C@@H](CN2CCC[C@@H](C3OCCO3)C2)O1	ZINC000721476233	777095195	/nfs/dbraw/zinc/09/51/95/777095195.db2.gz	LUEBMDCBRRFHFF-WOPDTQHZSA-N	0	3	309.328	2.181	10	0		DEAEHN
C[C@@H]1C[NH2+]C[C@H]1C[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000723784850	777169864	/nfs/dbraw/zinc/16/98/64/777169864.db2.gz	HRUZDVPHNVEPOG-BDAKNGLRSA-N	0	3	323.245	2.127	10	0		DEAEHN
COC1(C)CCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)CC1	ZINC000724111042	777243160	/nfs/dbraw/zinc/24/31/60/777243160.db2.gz	LBFOPVUJAJBBEE-SNVBAGLBSA-N	0	3	305.287	2.436	10	0		DEAEHN
Cn1nc(Br)cc1CNC[C@@H]1CC[C@@H](C2CC2)O1	ZINC000722321072	778616050	/nfs/dbraw/zinc/61/60/50/778616050.db2.gz	PESMIMMTPMSNFH-RYUDHWBXSA-N	0	3	314.227	2.230	10	0		DEAEHN
COC1CCC(NCc2cn(C)nc2Br)CC1	ZINC000712476618	792190715	/nfs/dbraw/zinc/19/07/15/792190715.db2.gz	VNFWKKXTLCLSAG-UHFFFAOYSA-N	0	3	302.216	2.230	10	0		DEAEHN
Cc1cc(CN[C@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)[nH]n1	ZINC000716447394	792958967	/nfs/dbraw/zinc/95/89/67/792958967.db2.gz	PFARSKMRETYQCC-RISCZKNCSA-N	0	3	308.426	2.453	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@H](C)C2CC[NH2+]CC2)sc1Cl	ZINC000716550909	792973068	/nfs/dbraw/zinc/97/30/68/792973068.db2.gz	BUFQWAKMSRWMTG-SECBINFHSA-N	0	3	322.883	2.376	10	0		DEAEHN
CN1CC[C@H](NC(=O)N[C@H]2CCCOCC2)[C@H]1c1ccccc1	ZINC000245640555	797935093	/nfs/dbraw/zinc/93/50/93/797935093.db2.gz	YTNQZWWUOFOIGF-YESZJQIVSA-N	0	3	317.433	2.300	10	0		DEAEHN
C[C@H]1C[C@@H](NCc2cncn2C)CN(C(=O)OC(C)(C)C)C1	ZINC000401765056	801850236	/nfs/dbraw/zinc/85/02/36/801850236.db2.gz	XWJMNPSFQVRXIC-QWHCGFSZSA-N	0	3	308.426	2.155	10	0		DEAEHN
Cc1nc([C@H](C)N[C@@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)n[nH]1	ZINC000401853355	801854403	/nfs/dbraw/zinc/85/44/03/801854403.db2.gz	ULJIKEDIUFCRBK-GMXVVIOVSA-N	0	3	323.441	2.409	10	0		DEAEHN
CC(C)=CC(=O)N1CCO[C@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC000404199734	802007833	/nfs/dbraw/zinc/00/78/33/802007833.db2.gz	HQNAEJVZBCKBRF-MSOLQXFVSA-N	0	3	314.429	2.455	10	0		DEAEHN
Cn1ccc(CNCCC2(CNC(=O)OC(C)(C)C)CC2)n1	ZINC000404555782	802024193	/nfs/dbraw/zinc/02/41/93/802024193.db2.gz	BEKGGTPXBNVKLT-UHFFFAOYSA-N	0	3	308.426	2.205	10	0		DEAEHN
Cc1nn(C)c(CN[C@@H]2CCCN3CCSC[C@H]23)c1Cl	ZINC000720510351	1085266846	/nfs/dbraw/zinc/26/68/46/1085266846.db2.gz	KGLZVZNSZIWCMA-DGCLKSJQSA-N	0	3	314.886	2.051	10	0		DEAEHN
C[C@H]1CN(C(=O)[C@H](N)CN(C)Cc2ccccc2)C(C)(C)C1	ZINC000702337415	1086424942	/nfs/dbraw/zinc/42/49/42/1086424942.db2.gz	KWIGOOINYIPWAG-GDBMZVCRSA-N	0	3	303.450	2.093	10	0		DEAEHN
Cn1cncc1CN[C@]12CCC[C@@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000711640759	1087184645	/nfs/dbraw/zinc/18/46/45/1087184645.db2.gz	QHTOWTHFHGBVQK-YOEHRIQHSA-N	0	3	320.437	2.442	10	0		DEAEHN
O=C(NCc1ncc(Cl)s1)[C@H]1CNCc2ccccc21	ZINC000719407185	1089132370	/nfs/dbraw/zinc/13/23/70/1089132370.db2.gz	ADOBVUWAASPQCA-NSHDSACASA-N	0	3	307.806	2.300	10	0		DEAEHN
O[C@H]1CCCC[C@H]1N1CCN(c2nc3ccccc3o2)CC1	ZINC000179286505	1090496362	/nfs/dbraw/zinc/49/63/62/1090496362.db2.gz	RPTONQJAMOOVIQ-CABCVRRESA-N	0	3	301.390	2.253	10	0		DEAEHN
CN[C@@H](CSCCS(C)(=O)=O)c1cc2ccccc2o1	ZINC000081769093	192322896	/nfs/dbraw/zinc/32/28/96/192322896.db2.gz	GFSRAAUXQOWFCL-LBPRGKRZSA-N	0	3	313.444	2.471	10	0		DEAEHN
CCCN[C@@H]1c2ccccc2OC[C@H]1Sc1nncn1C	ZINC000081866887	192333085	/nfs/dbraw/zinc/33/30/85/192333085.db2.gz	PVFZBLKJYUOFKE-ZIAGYGMSSA-N	0	3	304.419	2.409	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)CCOC)c1cc(C)ccc1C	ZINC000081943233	192343970	/nfs/dbraw/zinc/34/39/70/192343970.db2.gz	HHHZUAVIUPVKNG-INIZCTEOSA-N	0	3	313.463	2.405	10	0		DEAEHN
CCN[C@H](c1ccccc1)[C@@H](C(C)C)S(=O)(=O)CCOC	ZINC000081943738	192344622	/nfs/dbraw/zinc/34/46/22/192344622.db2.gz	CYZHIPDCACRWEJ-HZPDHXFCSA-N	0	3	313.463	2.423	10	0		DEAEHN
CC(C)NCCS(=O)(=O)N1CCC[C@H](C(C)(C)C)CC1	ZINC000079358463	185167003	/nfs/dbraw/zinc/16/70/03/185167003.db2.gz	NOTIIRHEHMDRJI-AWEZNQCLSA-N	0	3	304.500	2.462	10	0		DEAEHN
Cc1cc([C@H]2CCCN(C(=O)[C@@H](C3CC3)N3CCCC3)C2)[nH]n1	ZINC000328704820	231316058	/nfs/dbraw/zinc/31/60/58/231316058.db2.gz	YKQOQANOLRQFQT-DOTOQJQBSA-N	0	3	316.449	2.299	10	0		DEAEHN
CS(=O)(=O)[C@H]1CCC[C@]1(CN)Nc1cccc(Cl)c1	ZINC000087913637	185237457	/nfs/dbraw/zinc/23/74/57/185237457.db2.gz	QFVUFGOXGZMESE-QWHCGFSZSA-N	0	3	302.827	2.047	10	0		DEAEHN
CC(C)[C@H](CN(C)C)NC(=O)c1ccc2nc(N)sc2c1	ZINC000087847499	185233405	/nfs/dbraw/zinc/23/34/05/185233405.db2.gz	XOIYVSNFIWSMHT-LBPRGKRZSA-N	0	3	306.435	2.195	10	0		DEAEHN
N[C@@H]1CCN(c2c3nsnc3c(Cl)cc2Cl)C1=O	ZINC000088120633	185240168	/nfs/dbraw/zinc/24/01/68/185240168.db2.gz	SGEYOVNGTSOUIE-ZCFIWIBFSA-N	0	3	303.174	2.062	10	0		DEAEHN
NCc1ccccc1S(=O)(=O)N1CCC(C(F)(F)F)CC1	ZINC000088419212	185249544	/nfs/dbraw/zinc/24/95/44/185249544.db2.gz	OEFUCWOQRZWZTA-UHFFFAOYSA-N	0	3	322.352	2.108	10	0		DEAEHN
CC1(O)CCN(C[C@H](O)COCc2ccc(Cl)cc2)CC1	ZINC000177306932	282203735	/nfs/dbraw/zinc/20/37/35/282203735.db2.gz	RCFLWNXQLWWRRW-HNNXBMFYSA-N	0	3	313.825	2.064	10	0		DEAEHN
CCC[C@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]CC(C)C)o1	ZINC000088541960	185256157	/nfs/dbraw/zinc/25/61/57/185256157.db2.gz	AMAMBIZPZJGNPJ-LBPRGKRZSA-N	0	3	302.440	2.492	10	0		DEAEHN
Cc1ccccc1S(=O)(=O)[N-]c1ccc(OCC[NH3+])cc1	ZINC000088714800	185262861	/nfs/dbraw/zinc/26/28/61/185262861.db2.gz	YARYCEAOXJFTMH-UHFFFAOYSA-N	0	3	306.387	2.133	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N[C@H](C)C[C@@H](C)CC)o1	ZINC000088551584	185257640	/nfs/dbraw/zinc/25/76/40/185257640.db2.gz	LUXKMLPYWMSVCA-NWDGAFQWSA-N	0	3	302.440	2.492	10	0		DEAEHN
CCCN[C@@H](c1ccc(COC)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000088567526	185258143	/nfs/dbraw/zinc/25/81/43/185258143.db2.gz	RGSYOTKTDPYZEN-HOTGVXAUSA-N	0	3	311.447	2.308	10	0		DEAEHN
CC(C)C[C@](C)(O)CNCC(=O)Nc1c(F)cccc1F	ZINC000090272374	185288636	/nfs/dbraw/zinc/28/86/36/185288636.db2.gz	WNRBTYHTOMGJFS-HNNXBMFYSA-N	0	3	300.349	2.290	10	0		DEAEHN
Cc1cc(Cl)c(NC(=O)[C@@H]2COC[C@H]2N)c2cccnc12	ZINC000090379770	185293406	/nfs/dbraw/zinc/29/34/06/185293406.db2.gz	MMTFFXUEVJXRQZ-ZYHUDNBSSA-N	0	3	305.765	2.109	10	0		DEAEHN
N[C@@H]1COC[C@H]1C(=O)Nc1c(Cl)cccc1C(F)(F)F	ZINC000090379134	185293513	/nfs/dbraw/zinc/29/35/13/185293513.db2.gz	VIFNGSBSLBGZCI-HZGVNTEJSA-N	0	3	308.687	2.271	10	0		DEAEHN
N[C@H]1COC[C@@H]1C(=O)Nc1ccc(SC(F)(F)F)cc1	ZINC000090380641	185293785	/nfs/dbraw/zinc/29/37/85/185293785.db2.gz	DRWJISGHBCHLDN-UWVGGRQHSA-N	0	3	306.309	2.211	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1c1nc(-c2cccc(Br)c2)no1	ZINC000090423180	185295409	/nfs/dbraw/zinc/29/54/09/185295409.db2.gz	NWEXMCLCTRTLLO-WDEREUQCSA-N	0	3	324.178	2.201	10	0		DEAEHN
CN(Cc1ccc(Cl)cc1Cl)C(=O)[C@]1(C)COC[C@@H]1N	ZINC000090591494	185305616	/nfs/dbraw/zinc/30/56/16/185305616.db2.gz	BYHSKWLZURGGFM-GXTWGEPZSA-N	0	3	317.216	2.316	10	0		DEAEHN
C[C@]1(C(=O)Nc2cc(C(F)(F)F)ccc2F)COC[C@H]1N	ZINC000090603847	185306095	/nfs/dbraw/zinc/30/60/95/185306095.db2.gz	CCIWZXJILSMFFM-PWSUYJOCSA-N	0	3	306.259	2.147	10	0		DEAEHN
O=C(c1ccncc1)N1CCCSC[C@H]1CN1CCCC1	ZINC000090700851	185310428	/nfs/dbraw/zinc/31/04/28/185310428.db2.gz	JNUQBTDFZWYWMN-OAHLLOKOSA-N	0	3	305.447	2.125	10	0		DEAEHN
Cc1cc(CN[C@H]2CCCS(=O)(=O)C2)c2ccccc2n1	ZINC000092345775	185313423	/nfs/dbraw/zinc/31/34/23/185313423.db2.gz	LATINMHBPUBFKT-AWEZNQCLSA-N	0	3	304.415	2.210	10	0		DEAEHN
CCN1CCN(c2cccc(NC(=O)[C@H](C)COC)c2)CC1	ZINC000184257737	282249957	/nfs/dbraw/zinc/24/99/57/282249957.db2.gz	KXNIFKFJEUGZNR-CQSZACIVSA-N	0	3	305.422	2.050	10	0		DEAEHN
CN[C@@H]1C(=O)Nc2cc(OC3CCN(C)CC3)c(Cl)cc21	ZINC000092770075	185339617	/nfs/dbraw/zinc/33/96/17/185339617.db2.gz	HPFFHKQMUULOMQ-AWEZNQCLSA-N	0	3	309.797	2.026	10	0		DEAEHN
CCc1nc(C(C)(C)NC(=O)c2ccc(CN(C)C)cc2)no1	ZINC000441719829	529713193	/nfs/dbraw/zinc/71/31/93/529713193.db2.gz	VBXKZSJGOXZWDW-UHFFFAOYSA-N	0	3	316.405	2.359	10	0		DEAEHN
COCCC[C@H](C)C(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000181403954	199292313	/nfs/dbraw/zinc/29/23/13/199292313.db2.gz	XTFMNUHEARHJQS-DOTOQJQBSA-N	0	3	306.450	2.338	10	0		DEAEHN
CC1(NS(=O)(=O)c2cc(F)c(Cl)c(CN)c2)CCC1	ZINC000168573451	197725908	/nfs/dbraw/zinc/72/59/08/197725908.db2.gz	ZMOXAMJZHORLKM-UHFFFAOYSA-N	0	3	306.790	2.159	10	0		DEAEHN
CN(C)c1ccc(NC(=O)NC[C@@H]2N(C)CCCC2(C)C)cn1	ZINC000448013377	529784478	/nfs/dbraw/zinc/78/44/78/529784478.db2.gz	MCPIGPPAYWOTBO-AWEZNQCLSA-N	0	3	319.453	2.390	10	0		DEAEHN
O=C1CC[C@@H](CN[C@H]2CCc3cc(Br)ccc32)N1	ZINC000079928422	539376118	/nfs/dbraw/zinc/37/61/18/539376118.db2.gz	DRRYAGCCNYASPV-AAEUAGOBSA-N	0	3	309.207	2.305	10	0		DEAEHN
CN(C)C(=O)COc1ccccc1CNC[C@@H]1CCC(C)(C)O1	ZINC000189723627	282316703	/nfs/dbraw/zinc/31/67/03/282316703.db2.gz	NONADWSDUZXGRI-HNNXBMFYSA-N	0	3	320.433	2.201	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(CCC(=O)NC(C)C)C2)c1	ZINC000083249913	192368476	/nfs/dbraw/zinc/36/84/76/192368476.db2.gz	DDTNDHBBWSAVMS-CQSZACIVSA-N	0	3	320.433	2.408	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@](C)(OC)c2ccccc2F)C1	ZINC000192067351	282337156	/nfs/dbraw/zinc/33/71/56/282337156.db2.gz	RUCKTAKWJJOCGI-SUMWQHHRSA-N	0	3	308.397	2.288	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCS[C@@H](C)CC1	ZINC000192257566	282340346	/nfs/dbraw/zinc/34/03/46/282340346.db2.gz	FRVILQAKINOQKE-UONOGXRCSA-N	0	3	301.500	2.500	10	0		DEAEHN
CN(Cc1cccn1C)C[C@@H]1CCCN(C)[C@H]1c1cnn(C)c1	ZINC000328622344	530005733	/nfs/dbraw/zinc/00/57/33/530005733.db2.gz	BDTYGJUWRSKOAL-MAUKXSAKSA-N	0	3	315.465	2.274	10	0		DEAEHN
Cc1cc(C)n(CCCNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)n1	ZINC000245587000	282398641	/nfs/dbraw/zinc/39/86/41/282398641.db2.gz	AMOPTIJKJPFUCE-HOCLYGCPSA-N	0	3	321.469	2.014	10	0		DEAEHN
CN(C)C[C@@H]1CN(c2nc(-c3cccc(Cl)c3)no2)CCO1	ZINC000108952106	185543150	/nfs/dbraw/zinc/54/31/50/185543150.db2.gz	GOHRJMMSULMVSA-CYBMUJFWSA-N	0	3	322.796	2.157	10	0		DEAEHN
CNc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000286772989	219159247	/nfs/dbraw/zinc/15/92/47/219159247.db2.gz	NRFRZTVQMYGHMK-QGZVFWFLSA-N	0	3	324.428	2.470	10	0		DEAEHN
CN(Cc1ccc(F)cc1Br)C[C@H]1CNCCO1	ZINC000126874384	539479540	/nfs/dbraw/zinc/47/95/40/539479540.db2.gz	QGLBKAUAAGTUKJ-GFCCVEGCSA-N	0	3	317.202	2.008	10	0		DEAEHN
CCCc1cc(C(=O)N2CCC[C@@H]2Cn2ccnc2C)n[nH]1	ZINC000177153620	539629221	/nfs/dbraw/zinc/62/92/21/539629221.db2.gz	ODYQYUGWSHDXCZ-CQSZACIVSA-N	0	3	301.394	2.172	10	0		DEAEHN
CCc1nn(C)cc1CN1CCC[C@@H](Cn2nc(C)nc2C)C1	ZINC000180121149	539644141	/nfs/dbraw/zinc/64/41/41/539644141.db2.gz	MIEHRZQPTZCFTO-OAHLLOKOSA-N	0	3	316.453	2.103	10	0		DEAEHN
CC[C@H]1CN(c2ncnc3c(C)csc32)CCN1C[C@@H](C)O	ZINC000189979936	539692125	/nfs/dbraw/zinc/69/21/25/539692125.db2.gz	MJMFWNKVHRGPKV-OLZOCXBDSA-N	0	3	320.462	2.281	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2cc(C(F)(F)F)ccn2)C1	ZINC000192424572	539706369	/nfs/dbraw/zinc/70/63/69/539706369.db2.gz	UMQUIVXYKVAIFT-SNVBAGLBSA-N	0	3	302.300	2.268	10	0		DEAEHN
NC[C@@H](NC[C@@H]1CCCO1)c1cc(Br)cs1	ZINC000083774351	192383051	/nfs/dbraw/zinc/38/30/51/192383051.db2.gz	NBSGKZQJYLGWFH-VHSXEESVSA-N	0	3	305.241	2.279	10	0		DEAEHN
CCN[C@@H](C[S@@](=O)C1CCOCC1)c1ccc(OC)cc1	ZINC000084055308	192398183	/nfs/dbraw/zinc/39/81/83/192398183.db2.gz	BOJBRCCLLLIWDR-KKSFZXQISA-N	0	3	311.447	2.274	10	0		DEAEHN
COc1cccc2c1CN(CCc1c(C)nn(C)c1C)[C@@H]2CN	ZINC000071683161	191006795	/nfs/dbraw/zinc/00/67/95/191006795.db2.gz	NUCMYTJZVKZNMM-QGZVFWFLSA-N	0	3	314.433	2.104	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2cc(CN)cc(F)c2F)CC[C@@H]1C	ZINC000139334337	186021504	/nfs/dbraw/zinc/02/15/04/186021504.db2.gz	FLAPVCMRNNHYGL-UWVGGRQHSA-N	0	3	318.389	2.090	10	0		DEAEHN
Cc1ccc([C@@H]2NC3(CCCC3)C(=O)N2CCN(C)C)s1	ZINC000140014630	186025673	/nfs/dbraw/zinc/02/56/73/186025673.db2.gz	PSPYFUSWPOFPFT-CQSZACIVSA-N	0	3	307.463	2.361	10	0		DEAEHN
C[C@@H]1CCC[C@@H](CN)N1[C@@H]1CCS(=O)(=O)c2ccccc21	ZINC000147723477	186041133	/nfs/dbraw/zinc/04/11/33/186041133.db2.gz	YQFPXOBVWQURQL-VNHYZAJKSA-N	0	3	308.447	2.107	10	0		DEAEHN
CCCNCc1sccc1S(=O)(=O)N(C)C1CCC1	ZINC000144666412	186035722	/nfs/dbraw/zinc/03/57/22/186035722.db2.gz	HBASYDZCKOMIKX-UHFFFAOYSA-N	0	3	302.465	2.421	10	0		DEAEHN
CC(C)C[C@@H]1N[C@@H](c2ccsc2)N([C@@H]2CCN(C)C2)C1=O	ZINC000145224062	186036688	/nfs/dbraw/zinc/03/66/88/186036688.db2.gz	UNZQVGSQWDRZLW-QLFBSQMISA-N	0	3	307.463	2.297	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@H](C)C(=O)N2[C@@H](CN(C)C)C(C)C)s1	ZINC000145031120	186036880	/nfs/dbraw/zinc/03/68/80/186036880.db2.gz	GVGDOLRPTAFQIN-VNHYZAJKSA-N	0	3	309.479	2.462	10	0		DEAEHN
C[C@H](CN1CCCC1)N1C(=O)C2(CC2)N[C@@H]1c1ccsc1	ZINC000145809675	186037969	/nfs/dbraw/zinc/03/79/69/186037969.db2.gz	BHZZVKOXTQAGCT-OCCSQVGLSA-N	0	3	305.447	2.195	10	0		DEAEHN
CCCNc1nc(Cl)nc(N2CC[C@H](N3CCCC3)C2)n1	ZINC000149935992	186053710	/nfs/dbraw/zinc/05/37/10/186053710.db2.gz	UBVQWRWQBJGREM-NSHDSACASA-N	0	3	310.833	2.021	10	0		DEAEHN
C/C=C\c1ccc(OCC(=O)NCCN2CCCC2)c(OC)c1	ZINC000255910503	539786581	/nfs/dbraw/zinc/78/65/81/539786581.db2.gz	LMQBRGSXHGSERP-UTCJRWHESA-N	0	3	318.417	2.319	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2cc(C)ccc2Br)C1	ZINC000163970572	186143894	/nfs/dbraw/zinc/14/38/94/186143894.db2.gz	KRJXDMHAABPPSA-SKDRFNHKSA-N	0	3	313.195	2.073	10	0		DEAEHN
Cc1ccc(Br)c(NC(=O)[C@]2(C)COC[C@H]2N)c1	ZINC000163966705	186144067	/nfs/dbraw/zinc/14/40/67/186144067.db2.gz	FMSDPADXUWQUGQ-DGCLKSJQSA-N	0	3	313.195	2.060	10	0		DEAEHN
CNC(=O)c1ccn(-c2ccc(CNC3CC3)cc2Cl)n1	ZINC000164212549	186151836	/nfs/dbraw/zinc/15/18/36/186151836.db2.gz	BSXFIRVRBSPLGH-UHFFFAOYSA-N	0	3	304.781	2.137	10	0		DEAEHN
Cc1csc2nc(CN(C)[C@]3(CO)CC[C@H](C)C3)cc(=O)n12	ZINC000188001865	186242110	/nfs/dbraw/zinc/24/21/10/186242110.db2.gz	JRMJLTSUFSGYTE-MEDUHNTESA-N	0	3	321.446	2.047	10	0		DEAEHN
COCCOc1ccc(NC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000171888735	198002190	/nfs/dbraw/zinc/00/21/90/198002190.db2.gz	YHXUXYYRBLWJPO-OAHLLOKOSA-N	0	3	319.405	2.024	10	0		DEAEHN
Cc1cc(NC(=O)N2CCN3CCC[C@@H]3C2)ccc1N(C)C	ZINC000171889144	198002330	/nfs/dbraw/zinc/00/23/30/198002330.db2.gz	WBBQITHNCKJMAE-OAHLLOKOSA-N	0	3	302.422	2.373	10	0		DEAEHN
CC(C)(C)c1ncc(NC(=O)N2CCN3CCC[C@@H]3C2)cn1	ZINC000171891973	198002959	/nfs/dbraw/zinc/00/29/59/198002959.db2.gz	AOGLKTHBVDFDBH-CYBMUJFWSA-N	0	3	303.410	2.086	10	0		DEAEHN
O=C(NCCOc1ccc(Cl)cc1)N1CCN2CCC[C@H]2C1	ZINC000171898620	198004306	/nfs/dbraw/zinc/00/43/06/198004306.db2.gz	NMPORGCHQHFPRK-AWEZNQCLSA-N	0	3	323.824	2.208	10	0		DEAEHN
O=C(NCCc1cccc(Cl)c1)N1CCN2CCC[C@@H]2C1	ZINC000171898259	198004408	/nfs/dbraw/zinc/00/44/08/198004408.db2.gz	QDCQQHRRIBIUJS-OAHLLOKOSA-N	0	3	307.825	2.372	10	0		DEAEHN
CC1CCC(N2CCN(C(=O)N[C@@H]3CCCOC3)CC2)CC1	ZINC000172150692	198047252	/nfs/dbraw/zinc/04/72/52/198047252.db2.gz	BSULBSKKRTWSFU-HWOWSKLDSA-N	0	3	309.454	2.071	10	0		DEAEHN
C[C@@H]1CSCCN1C(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000172559250	198114875	/nfs/dbraw/zinc/11/48/75/198114875.db2.gz	ZOFUZSKOKOWVDJ-GDBMZVCRSA-N	0	3	321.490	2.306	10	0		DEAEHN
CC(=O)c1ccc(OCCCC(=O)N[C@@H]2CCCN(C)C2)cc1	ZINC000617414507	363125891	/nfs/dbraw/zinc/12/58/91/363125891.db2.gz	KHMVQUTZSKRQES-MRXNPFEDSA-N	0	3	318.417	2.259	10	0		DEAEHN
C[C@H](O)C1CCN(C[C@@H]2CN(c3ccccc3)C(=O)O2)CC1	ZINC000172801865	198151086	/nfs/dbraw/zinc/15/10/86/198151086.db2.gz	ANXRNLOPMTWBSW-XJKSGUPXSA-N	0	3	304.390	2.105	10	0		DEAEHN
O=C(NCCSc1ccccc1)N1CC[C@H](N2CC=CC2)C1	ZINC000173501500	198221882	/nfs/dbraw/zinc/22/18/82/198221882.db2.gz	YCHIJQIQFCMPCN-HNNXBMFYSA-N	0	3	317.458	2.434	10	0		DEAEHN
CSc1ccc(OCCN2CCO[C@@H](CN(C)C)C2)cc1	ZINC000173701658	198242246	/nfs/dbraw/zinc/24/22/46/198242246.db2.gz	JFYUCLJDIUNCSL-HNNXBMFYSA-N	0	3	310.463	2.050	10	0		DEAEHN
CC[C@H](O)CN1CCN(CCCc2cccc(OC)c2)CC1	ZINC000174081618	198289406	/nfs/dbraw/zinc/28/94/06/198289406.db2.gz	CDVWCIGHRDNKTD-KRWDZBQOSA-N	0	3	306.450	2.016	10	0		DEAEHN
CC(C(=O)N1CC[C@@H](C)[C@H]1c1cccc(F)c1)S(C)(=O)=O	ZINC000174439366	198334660	/nfs/dbraw/zinc/33/46/60/198334660.db2.gz	ITNBQYGJNZRPES-GYSYKLTISA-N	0	3	313.394	2.168	10	0		DEAEHN
O=C(NCCc1cc(F)cc(F)c1)N1CC[C@@H](N2CC=CC2)C1	ZINC000174482879	198340922	/nfs/dbraw/zinc/34/09/22/198340922.db2.gz	NDLYKHPSOPFCEX-MRXNPFEDSA-N	0	3	321.371	2.163	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCCCC(C)(C)CO	ZINC000073722604	191348646	/nfs/dbraw/zinc/34/86/46/191348646.db2.gz	KVHPCVNEQZQTBK-CQSZACIVSA-N	0	3	301.475	2.061	10	0		DEAEHN
COc1ccc2c(CC(=O)NC[C@H]3CCCN(C)C3)coc2c1	ZINC000108335715	355734758	/nfs/dbraw/zinc/73/47/58/355734758.db2.gz	LYZRTXJFERFCEP-CYBMUJFWSA-N	0	3	316.401	2.442	10	0		DEAEHN
CCN1CCO[C@@H](CNCc2ccc(Br)cc2)C1	ZINC000113266982	355758366	/nfs/dbraw/zinc/75/83/66/355758366.db2.gz	IPJPICUKAFHZRE-AWEZNQCLSA-N	0	3	313.239	2.259	10	0		DEAEHN
CC(C)C(=O)N1CCC(N[C@@H](c2nccn2C)C2CC2)CC1	ZINC000127564937	355822731	/nfs/dbraw/zinc/82/27/31/355822731.db2.gz	VSJBOVGZODBIKO-OAHLLOKOSA-N	0	3	304.438	2.108	10	0		DEAEHN
CC(=O)NC[C@H]1CCN(Cc2cccc(Cl)c2)C[C@H]1N(C)C	ZINC000169788817	355983799	/nfs/dbraw/zinc/98/37/99/355983799.db2.gz	CWXHKKSROZOMSK-NVXWUHKLSA-N	0	3	323.868	2.228	10	0		DEAEHN
COc1ccc([C@H](C)NC(=O)N2CC[C@@H](N(C)C)C2)cc1F	ZINC000170826820	355994441	/nfs/dbraw/zinc/99/44/41/355994441.db2.gz	NWXKEIZYUVVVIE-WCQYABFASA-N	0	3	309.385	2.241	10	0		DEAEHN
COC(C)(C)CNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179182581	356017045	/nfs/dbraw/zinc/01/70/45/356017045.db2.gz	NRIQKEAFDRHESM-LSDHHAIUSA-N	0	3	305.422	2.156	10	0		DEAEHN
CC(C)OC(=O)CCN[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000182041132	356106474	/nfs/dbraw/zinc/10/64/74/356106474.db2.gz	BVHPAJUFTHVVIE-CYBMUJFWSA-N	0	3	302.378	2.260	10	0		DEAEHN
O=C(Nc1ccc(OC2CNC2)cc1)N1CC(c2cccnc2)C1	ZINC000224888595	356275817	/nfs/dbraw/zinc/27/58/17/356275817.db2.gz	LUDZAZCFGSZZTR-UHFFFAOYSA-N	0	3	324.384	2.064	10	0		DEAEHN
CN(CCNCC(=O)NCc1ccccc1)Cc1ccccc1	ZINC000306878562	356406146	/nfs/dbraw/zinc/40/61/46/356406146.db2.gz	ITDWCMOIRFQPGX-UHFFFAOYSA-N	0	3	311.429	2.024	10	0		DEAEHN
Cc1ccc([O-])c(CN(Cc2cccnc2)C[C@@H]2CC[NH2+]C2)n1	ZINC000328651048	356466582	/nfs/dbraw/zinc/46/65/82/356466582.db2.gz	VUMWJHSGTPMWJG-MRXNPFEDSA-N	0	3	312.417	2.102	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)N(C)CC(=O)Nc1ccccc1SC	ZINC000236938297	202081553	/nfs/dbraw/zinc/08/15/53/202081553.db2.gz	URAGUVNMUKQMCX-IAQYHMDHSA-N	0	3	323.462	2.179	10	0		DEAEHN
CN(CCN1CCCC1)C(=O)c1ncsc1Br	ZINC000579512091	356988033	/nfs/dbraw/zinc/98/80/33/356988033.db2.gz	RSGZQDMDAPKIDU-UHFFFAOYSA-N	0	3	318.240	2.073	10	0		DEAEHN
OCc1ccc(CN2CC[C@](O)(Cc3ccc(F)cc3)C2)o1	ZINC000579579701	356997488	/nfs/dbraw/zinc/99/74/88/356997488.db2.gz	UIWOYGSYRRTQJI-KRWDZBQOSA-N	0	3	305.349	2.091	10	0		DEAEHN
CCCNCc1cc(S(=O)(=O)N[C@H](C)CC)cn1CC	ZINC000088978107	192679735	/nfs/dbraw/zinc/67/97/35/192679735.db2.gz	FOAWAHAXYHPOSW-GFCCVEGCSA-N	0	3	301.456	2.084	10	0		DEAEHN
CCC[C@H](C(=O)NCCCn1cnc2ccccc21)N(C)C	ZINC000179334345	199017789	/nfs/dbraw/zinc/01/77/89/199017789.db2.gz	UMDVSJPKNANCPD-MRXNPFEDSA-N	0	3	302.422	2.273	10	0		DEAEHN
Cc1[nH]c(=O)ccc1C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000180138605	199122263	/nfs/dbraw/zinc/12/22/63/199122263.db2.gz	TZUPXXILWHAOHC-NVXWUHKLSA-N	0	3	311.385	2.271	10	0		DEAEHN
CC[C@H](C)Oc1cc(C(=O)N2CCN3CCC[C@@H]3C2)ccn1	ZINC000180285177	199141518	/nfs/dbraw/zinc/14/15/18/199141518.db2.gz	RCMGPYFQOCAAHQ-DZGCQCFKSA-N	0	3	303.406	2.179	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCc2ccc(Cl)cn2)CCN1C	ZINC000180846162	199217936	/nfs/dbraw/zinc/21/79/36/199217936.db2.gz	FNEBQBNNJMNIBH-BXUZGUMPSA-N	0	3	310.829	2.359	10	0		DEAEHN
C(c1noc2c1CCCC2)N1CCCN(C[C@@H]2CCCO2)CC1	ZINC000595720388	358532251	/nfs/dbraw/zinc/53/22/51/358532251.db2.gz	LZDOGYURVSWKAR-HNNXBMFYSA-N	0	3	319.449	2.240	10	0		DEAEHN
CN(C[C@@H](O)c1cccc(Br)c1)CC1(CO)CC1	ZINC000186808268	200014557	/nfs/dbraw/zinc/01/45/57/200014557.db2.gz	IXCBRIUULOZCSH-CYBMUJFWSA-N	0	3	314.223	2.187	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2)N(C)C	ZINC000178657082	283475433	/nfs/dbraw/zinc/47/54/33/283475433.db2.gz	XIZUAXIDAKXSIX-LRDDRELGSA-N	0	3	317.433	2.479	10	0		DEAEHN
CC(C)C[C@@H](CO)N(C)C(=O)NCc1cccc(CN(C)C)c1	ZINC000188393072	200239731	/nfs/dbraw/zinc/23/97/31/200239731.db2.gz	SFYWNFYBWMKWQI-KRWDZBQOSA-N	0	3	321.465	2.297	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)N(CCN(C)C)Cc1cccc(O)c1	ZINC000189549078	200420628	/nfs/dbraw/zinc/42/06/28/200420628.db2.gz	VSYFQMAZOAMOGB-YOEHRIQHSA-N	0	3	320.433	2.098	10	0		DEAEHN
Cc1nc2n(n1)CCC[C@@H]2N[C@H]1[C@H]2CCO[C@H]2C12CCCC2	ZINC000194111687	201180472	/nfs/dbraw/zinc/18/04/72/201180472.db2.gz	ZZDWNYZLTYTCLZ-CBBWQLFWSA-N	0	3	302.422	2.359	10	0		DEAEHN
C/C(=C/c1cccc(C(F)(F)F)c1)CN(CCO)CCO	ZINC000628370193	366834294	/nfs/dbraw/zinc/83/42/94/366834294.db2.gz	CPAYGSCUXZTEDR-XFXZXTDPSA-N	0	3	303.324	2.395	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2cccc(C)c2C)CC12COC2	ZINC000449357509	240396950	/nfs/dbraw/zinc/39/69/50/240396950.db2.gz	DPBUXZCYKOMTOW-INIZCTEOSA-N	0	3	303.402	2.315	10	0		DEAEHN
NC(=O)N1CCC(NCc2csc(C(F)(F)F)c2)CC1	ZINC000623418650	365023959	/nfs/dbraw/zinc/02/39/59/365023959.db2.gz	ZZRKAQKHHYPSFQ-UHFFFAOYSA-N	0	3	307.341	2.400	10	0		DEAEHN
Cc1ccc(CNC[C@@H]2COCCN2C)cc1Br	ZINC000623711430	365141078	/nfs/dbraw/zinc/14/10/78/365141078.db2.gz	FBFOPIGKWJWVSF-CYBMUJFWSA-N	0	3	313.239	2.178	10	0		DEAEHN
c1ncn2c1c(N1CCN(CC3CC3)CC1)nc1ccccc12	ZINC000623876140	365207744	/nfs/dbraw/zinc/20/77/44/365207744.db2.gz	JOTASXYGZZJXJE-UHFFFAOYSA-N	0	3	307.401	2.415	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccc(Br)nc2)C1	ZINC000091448225	193057766	/nfs/dbraw/zinc/05/77/66/193057766.db2.gz	VCBICHJYDXXYQU-LLVKDONJSA-N	0	3	312.211	2.058	10	0		DEAEHN
CC(C)(C)NCc1cnn([C@@H]2CCS(=O)(=O)C2)c1C(F)F	ZINC000091336111	193041841	/nfs/dbraw/zinc/04/18/41/193041841.db2.gz	QCEJIMCCRIEXGW-SNVBAGLBSA-N	0	3	321.393	2.068	10	0		DEAEHN
CC(C)NCc1cnn([C@@]2(C)CCS(=O)(=O)C2)c1C(C)C	ZINC000091337243	193043442	/nfs/dbraw/zinc/04/34/42/193043442.db2.gz	OWDSPCAVLPICMT-HNNXBMFYSA-N	0	3	313.467	2.038	10	0		DEAEHN
CSCC[C@H](N)C(=O)Nc1ccc(Br)c(C)n1	ZINC000091507162	193067513	/nfs/dbraw/zinc/06/75/13/193067513.db2.gz	IIVITHIFFLRJHK-VIFPVBQESA-N	0	3	318.240	2.171	10	0		DEAEHN
Cc1ccc(C(F)(F)F)cc1NC(=O)[C@]1(C)COC[C@@H]1N	ZINC000091479810	193062035	/nfs/dbraw/zinc/06/20/35/193062035.db2.gz	YURNFOKEQXUDOS-WCQYABFASA-N	0	3	302.296	2.316	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)c2cccc(C(F)(F)F)n2)CCN1C	ZINC000449941308	241276384	/nfs/dbraw/zinc/27/63/84/241276384.db2.gz	PICFJDCYEDNAQF-UWVGGRQHSA-N	0	3	301.312	2.313	10	0		DEAEHN
CCCNCc1ccccc1S(=O)(=O)N1C[C@@H](C)[C@H](C)C1	ZINC000092113893	193161618	/nfs/dbraw/zinc/16/16/18/193161618.db2.gz	RXCFNFSAUTXHLK-ZIAGYGMSSA-N	0	3	310.463	2.463	10	0		DEAEHN
C[NH2+]Cc1ccc(S(=O)(=O)[N-]Cc2ccsc2)c(F)c1	ZINC000092116158	193164140	/nfs/dbraw/zinc/16/41/40/193164140.db2.gz	KVFSVIYHOACQGL-UHFFFAOYSA-N	0	3	314.407	2.085	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)CN[C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)cc1	ZINC000528760182	284002839	/nfs/dbraw/zinc/00/28/39/284002839.db2.gz	WODNKDHWNTWBQD-IMODNSLOSA-N	0	3	304.390	2.229	10	0		DEAEHN
c1cncc([C@@H]2CNCCN2Cc2cccc3c2CCOC3)c1	ZINC000631825197	368404776	/nfs/dbraw/zinc/40/47/76/368404776.db2.gz	BWQPOFMTCMOOIG-IBGZPJMESA-N	0	3	309.413	2.301	10	0		DEAEHN
CCC[C@](C)(N)C(=O)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000262524243	203320260	/nfs/dbraw/zinc/32/02/60/203320260.db2.gz	FYCVIKQVJPGTQB-OCCSQVGLSA-N	0	3	302.777	2.146	10	0		DEAEHN
CC[C@@H](C)CN(CC)S(=O)(=O)c1cc(CN)n(CC)c1	ZINC000093265851	193223117	/nfs/dbraw/zinc/22/31/17/193223117.db2.gz	LVBSCXFFZFNFDP-GFCCVEGCSA-N	0	3	301.456	2.023	10	0		DEAEHN
CN(CCNC(=O)c1sc2cccc(F)c2c1N)C1CC1	ZINC000093412222	193245757	/nfs/dbraw/zinc/24/57/57/193245757.db2.gz	BPRYHOMQRNXINL-UHFFFAOYSA-N	0	3	307.394	2.447	10	0		DEAEHN
Cn1cc(CN2C[C@H]3CCC[C@@H](C2)C3O)c(-c2ccncc2)n1	ZINC000093479880	193257109	/nfs/dbraw/zinc/25/71/09/193257109.db2.gz	CVJRSUNFBYKRIO-MVVMVCHASA-N	0	3	312.417	2.075	10	0		DEAEHN
CC[C@H](NCC(C)(C)S(C)(=O)=O)c1ccc2c(c1)CCO2	ZINC000093522787	193263201	/nfs/dbraw/zinc/26/32/01/193263201.db2.gz	AQHNIKIPADCPGJ-AWEZNQCLSA-N	0	3	311.447	2.485	10	0		DEAEHN
CC[C@@H](CO)N1CCN(Cc2cccc3c2OC(C)(C)C3)CC1	ZINC000093739959	193298653	/nfs/dbraw/zinc/29/86/53/193298653.db2.gz	QEKHLQXJHHQZTA-KRWDZBQOSA-N	0	3	318.461	2.289	10	0		DEAEHN
N[C@]1(c2nc3cc(Br)c(F)cc3[nH]2)CCOC1	ZINC000093728933	193299060	/nfs/dbraw/zinc/29/90/60/193299060.db2.gz	VOAKQISUTPQPKW-LLVKDONJSA-N	0	3	300.131	2.039	10	0		DEAEHN
CN[C@@H](Cc1c(Cl)cccc1Cl)[C@@H]1CN(C)CCN1C	ZINC000093894843	193325061	/nfs/dbraw/zinc/32/50/61/193325061.db2.gz	QOKTVIFXVJWRFI-GJZGRUSLSA-N	0	3	316.276	2.370	10	0		DEAEHN
CCC(N)(CC)C(=O)N(C[C@H]1CCCO1)[C@@H]1CCSC1	ZINC000094244631	193354846	/nfs/dbraw/zinc/35/48/46/193354846.db2.gz	JYBWZTCGJBHGPZ-CHWSQXEVSA-N	0	3	300.468	2.017	10	0		DEAEHN
CC1(C)CCC[C@H]1NS(=O)(=O)c1cccc2c1CCNC2	ZINC000094330102	193359678	/nfs/dbraw/zinc/35/96/78/193359678.db2.gz	MXMYNPFBXMMGRT-OAHLLOKOSA-N	0	3	308.447	2.189	10	0		DEAEHN
CCC[C@@H](C)NC(=O)[C@@H](C)Oc1c(F)cc(CN)cc1F	ZINC000094346194	193363619	/nfs/dbraw/zinc/36/36/19/193363619.db2.gz	QGSGSOPLEMABND-NXEZZACHSA-N	0	3	300.349	2.496	10	0		DEAEHN
Cc1cc(NC(=O)CNC(C)(C)C)ncc1Br	ZINC000094063601	193342177	/nfs/dbraw/zinc/34/21/77/193342177.db2.gz	ZNVJOAPLJDEOKI-UHFFFAOYSA-N	0	3	300.200	2.479	10	0		DEAEHN
CCN[C@H](c1ccc(F)cn1)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094643092	193388645	/nfs/dbraw/zinc/38/86/45/193388645.db2.gz	XWPPGTYHVJHLLP-ZLDLUXBVSA-N	0	3	314.426	2.475	10	0		DEAEHN
CCN1CCC[C@@H](Nc2nc(Br)cn3ccnc23)C1	ZINC000094488921	193373850	/nfs/dbraw/zinc/37/38/50/193373850.db2.gz	HRFKXAABCWQNBO-SNVBAGLBSA-N	0	3	324.226	2.388	10	0		DEAEHN
Brc1cn2ccnc2c(NCCN2CCCCC2)n1	ZINC000094489149	193373995	/nfs/dbraw/zinc/37/39/95/193373995.db2.gz	QPRDUQWDVRVZEI-UHFFFAOYSA-N	0	3	324.226	2.390	10	0		DEAEHN
Brc1cccn2nc(N[C@H]3CCN(C4CC4)C3)nc12	ZINC000094604932	193383664	/nfs/dbraw/zinc/38/36/64/193383664.db2.gz	YQPDDXZMLVNOON-VIFPVBQESA-N	0	3	322.210	2.140	10	0		DEAEHN
O=C(N[C@H]1CCOc2c(F)cccc21)N1CCN2CCC[C@@H]2C1	ZINC000191021844	284212479	/nfs/dbraw/zinc/21/24/79/284212479.db2.gz	ZMQLDRVRXFBCRT-DOMZBBRYSA-N	0	3	319.380	2.139	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@H]1NCc1csc(Br)c1	ZINC000282536110	217070171	/nfs/dbraw/zinc/07/01/71/217070171.db2.gz	ZKUSNDVMRPYGCL-IONNQARKSA-N	0	3	303.225	2.267	10	0		DEAEHN
CCCn1ncc(Br)c1[C@@H](N)[C@@H]1CCCOC1	ZINC000160370140	197404380	/nfs/dbraw/zinc/40/43/80/197404380.db2.gz	BSYOGZBIEHMFKA-KOLCDFICSA-N	0	3	302.216	2.482	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCN([C@@H](CN)c2ccccc2F)CC1	ZINC000020179241	182194683	/nfs/dbraw/zinc/19/46/83/182194683.db2.gz	VVVPUPXREMIWIY-HNNXBMFYSA-N	0	3	323.412	2.378	10	0		DEAEHN
CC(C)(C)NC(=O)COc1ccc(Br)cc1CN	ZINC000020483504	182223076	/nfs/dbraw/zinc/22/30/76/182223076.db2.gz	JZQSXLYMKMDTHL-UHFFFAOYSA-N	0	3	315.211	2.201	10	0		DEAEHN
CCCNC(=O)[C@H](C)Oc1ccc(Br)cc1CN	ZINC000020483378	182223212	/nfs/dbraw/zinc/22/32/12/182223212.db2.gz	WYYQURSXMAAQFB-VIFPVBQESA-N	0	3	315.211	2.201	10	0		DEAEHN
CCOC(=O)N[C@@H](CN)c1ccc(OC)c(OC(F)F)c1	ZINC000020551456	182230100	/nfs/dbraw/zinc/23/01/00/182230100.db2.gz	YGETVNGMIWIZEN-VIFPVBQESA-N	0	3	304.293	2.043	10	0		DEAEHN
CCCCNCc1cc(Br)ccc1OCC(N)=O	ZINC000020873042	182250826	/nfs/dbraw/zinc/25/08/26/182250826.db2.gz	BGWQTZDKRQDMCZ-UHFFFAOYSA-N	0	3	315.211	2.203	10	0		DEAEHN
CC[C@H](C)NCC(=O)Nc1sc2c(c1C(=O)OC)CCC2	ZINC000040415310	183063778	/nfs/dbraw/zinc/06/37/78/183063778.db2.gz	BXJAOWYTSNZRRY-VIFPVBQESA-N	0	3	310.419	2.350	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)N[C@@H]1CCC[C@@H](OCC(F)(F)F)C1	ZINC000040462325	183070858	/nfs/dbraw/zinc/07/08/58/183070858.db2.gz	ZMNSMDLQIKXNKB-QCNOEVLYSA-N	0	3	310.360	2.366	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2ccc(Cl)c3cccnc23)C1	ZINC000040634097	183111762	/nfs/dbraw/zinc/11/17/62/183111762.db2.gz	FOOOJBGADONOGS-ZANVPECISA-N	0	3	305.765	2.204	10	0		DEAEHN
COC(=O)c1c(C)c(C)sc1NC(=O)[C@@H](N)CCSC	ZINC000040852816	183141719	/nfs/dbraw/zinc/14/17/19/183141719.db2.gz	NDQPTXRJPYGVGY-VIFPVBQESA-N	0	3	316.448	2.170	10	0		DEAEHN
COC(=O)c1c2c(sc1NC(=O)[C@H](N)C(C)C)CCCC2	ZINC000040856022	183143141	/nfs/dbraw/zinc/14/31/41/183143141.db2.gz	QSXMQVAIQROHDC-GFCCVEGCSA-N	0	3	310.419	2.335	10	0		DEAEHN
CNCc1cccc(Br)c1OCCn1ccnc1	ZINC000042411573	183265852	/nfs/dbraw/zinc/26/58/52/183265852.db2.gz	CZEHODFXWOAHIN-UHFFFAOYSA-N	0	3	310.195	2.444	10	0		DEAEHN
COc1cccc(NC(=O)CN(CCC(N)=S)C(C)C)c1	ZINC000042529234	183281010	/nfs/dbraw/zinc/28/10/10/183281010.db2.gz	GYCAEWBDXNVJBF-UHFFFAOYSA-N	0	3	309.435	2.020	10	0		DEAEHN
NCc1ccccc1NC(=O)CN(CC(F)(F)F)C1CC1	ZINC000042740768	183303910	/nfs/dbraw/zinc/30/39/10/183303910.db2.gz	BTGACYWBCZBJDU-UHFFFAOYSA-N	0	3	301.312	2.111	10	0		DEAEHN
CCN([C@@H](C)COC)[C@@H](CN)c1ccc(Br)o1	ZINC000042743813	183304200	/nfs/dbraw/zinc/30/42/00/183304200.db2.gz	ICYSANVVVWMMST-UWVGGRQHSA-N	0	3	305.216	2.399	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccc(Br)s1)N1CCC(O)CC1	ZINC000043258814	183347931	/nfs/dbraw/zinc/34/79/31/183347931.db2.gz	ALEXZEHWKQXYFY-PELKAZGASA-N	0	3	319.268	2.356	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccc(Br)s1)N1CCN(C)CC1	ZINC000043258587	183348157	/nfs/dbraw/zinc/34/81/57/183348157.db2.gz	BQAMDGSPYVZYIT-SKDRFNHKSA-N	0	3	318.284	2.146	10	0		DEAEHN
CNC(=O)[C@H]1CCCCN1[C@@H](CN)c1ccc(Cl)s1	ZINC000043253720	183348414	/nfs/dbraw/zinc/34/84/14/183348414.db2.gz	VRBFUOANAWNUTO-ZJUUUORDSA-N	0	3	301.843	2.002	10	0		DEAEHN
CNC(=O)C1CCN([C@H](c2ccc(Cl)s2)[C@@H](C)N)CC1	ZINC000043252800	183348421	/nfs/dbraw/zinc/34/84/21/183348421.db2.gz	FQBZSZRZTBMZRO-RNCFNFMXSA-N	0	3	315.870	2.248	10	0		DEAEHN
Cc1ccc([C@@H]([C@H](C)N)N2CCN(c3nccs3)CC2)o1	ZINC000043363896	183357423	/nfs/dbraw/zinc/35/74/23/183357423.db2.gz	WKBGOXIUHLARHJ-GXTWGEPZSA-N	0	3	306.435	2.255	10	0		DEAEHN
CCNCc1c(N2CCO[C@@H]3CCC[C@@H]32)nc2sccn12	ZINC000043426639	183361773	/nfs/dbraw/zinc/36/17/73/183361773.db2.gz	OVCDSPDHGWPLNW-WCQYABFASA-N	0	3	306.435	2.263	10	0		DEAEHN
Cc1ccc(F)c([N-]S(=O)(=O)c2ccc(CC[NH3+])cc2)c1	ZINC000044594352	183426382	/nfs/dbraw/zinc/42/63/82/183426382.db2.gz	MSKUCCBUZSFNGB-UHFFFAOYSA-N	0	3	308.378	2.436	10	0		DEAEHN
CC(C)COc1ccc([C@@H](C)NCCCS(N)(=O)=O)cc1	ZINC000045067860	183479015	/nfs/dbraw/zinc/47/90/15/183479015.db2.gz	YDWISKRZWPPLHU-CYBMUJFWSA-N	0	3	314.451	2.051	10	0		DEAEHN
C[C@H](CNCc1ccc(Br)c(F)c1)[S@@](C)=O	ZINC000159789690	197364114	/nfs/dbraw/zinc/36/41/14/197364114.db2.gz	XJGVFYJOBZOWQB-BCTVWOGZSA-N	0	3	308.216	2.445	10	0		DEAEHN
CCc1ccc2c(CN[C@@H]3CCc4ncnn4C3)cc(=O)oc2c1	ZINC000105870785	194152369	/nfs/dbraw/zinc/15/23/69/194152369.db2.gz	FFVHJFYUKZZYIP-CQSZACIVSA-N	0	3	324.384	2.052	10	0		DEAEHN
C[C@@H](NC[C@H]1CN(C)CCO1)c1ccc(OC(F)F)cc1	ZINC000105932393	194172310	/nfs/dbraw/zinc/17/23/10/194172310.db2.gz	RCCTTWJFWLFVMT-RISCZKNCSA-N	0	3	300.349	2.269	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)[C@@H](C)COC)c1cccc(OC)c1	ZINC000103362471	284770698	/nfs/dbraw/zinc/77/06/98/284770698.db2.gz	ZCULCLSKBCROSI-YOEHRIQHSA-N	0	3	322.449	2.477	10	0		DEAEHN
CC(C)Oc1cccc(CNC[C@H]2CN(C3CC3)CCO2)c1	ZINC000106379571	194204395	/nfs/dbraw/zinc/20/43/95/194204395.db2.gz	HWJJHIWLMLFJEK-SFHVURJKSA-N	0	3	304.434	2.427	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2ccc(C)c(Br)c2)C1	ZINC000109436554	194263968	/nfs/dbraw/zinc/26/39/68/194263968.db2.gz	ONSKYZZSVLGXBM-JQWIXIFHSA-N	0	3	313.195	2.073	10	0		DEAEHN
Cc1ccc(Cl)cc1S(=O)(=O)N(C)[C@H]1CCCNC1	ZINC000110927803	194369649	/nfs/dbraw/zinc/36/96/49/194369649.db2.gz	JSLVLAURXHJOLR-LBPRGKRZSA-N	0	3	302.827	2.021	10	0		DEAEHN
CCCN([C@H]1CCCNC1)S(=O)(=O)c1c(F)cccc1F	ZINC000110942442	194372549	/nfs/dbraw/zinc/37/25/49/194372549.db2.gz	KTMRIKFXHMUNOW-NSHDSACASA-N	0	3	318.389	2.118	10	0		DEAEHN
CN(C)C[C@H](NC(=O)COc1ccccc1O)c1ccccc1	ZINC000111130265	194393835	/nfs/dbraw/zinc/39/38/35/194393835.db2.gz	HZYCQGUNLDMLTO-HNNXBMFYSA-N	0	3	314.385	2.190	10	0		DEAEHN
C[C@H]1CCCC[C@H]1OCCNC(=O)N1CCCN(C2CC2)CC1	ZINC000057777168	184052889	/nfs/dbraw/zinc/05/28/89/184052889.db2.gz	CIPCDMIVPLZEFE-DOTOQJQBSA-N	0	3	323.481	2.461	10	0		DEAEHN
O=C(NCCNc1ccncc1)NC[C@H]1CCCC(F)(F)C1	ZINC000554605557	291774592	/nfs/dbraw/zinc/77/45/92/291774592.db2.gz	UCHPDUNNKWKWHR-LBPRGKRZSA-N	0	3	312.364	2.040	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(N[C@H]2CCCN(CC)C2)n1	ZINC000061539221	184172839	/nfs/dbraw/zinc/17/28/39/184172839.db2.gz	FFLUJTOIAQMDCF-NSHDSACASA-N	0	3	312.849	2.267	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1ccc(Br)cn1	ZINC000061874615	184191760	/nfs/dbraw/zinc/19/17/60/184191760.db2.gz	YRUWHSAVBWGEGF-NSHDSACASA-N	0	3	312.211	2.010	10	0		DEAEHN
CCCc1nc(N2CCN(CC(F)(F)F)CC2)sc1CN	ZINC000061948572	184197786	/nfs/dbraw/zinc/19/77/86/184197786.db2.gz	HOPPJBXBVXVABJ-UHFFFAOYSA-N	0	3	322.400	2.239	10	0		DEAEHN
C[C@@H](Cc1ccccc1)NS(=O)(=O)c1cccc(CN)c1	ZINC000062187542	184216943	/nfs/dbraw/zinc/21/69/43/184216943.db2.gz	YEZKIBGWTHNOEO-ZDUSSCGKSA-N	0	3	304.415	2.055	10	0		DEAEHN
Nc1c(Cl)ncnc1O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000062365283	184233008	/nfs/dbraw/zinc/23/30/08/184233008.db2.gz	JGPNONISNQKXKK-GFCCVEGCSA-N	0	3	304.781	2.366	10	0		DEAEHN
COCCNCc1ccc(OCCOC)c(Br)c1	ZINC000062728155	184250850	/nfs/dbraw/zinc/25/08/50/184250850.db2.gz	DCJDCVKBQCUBTO-UHFFFAOYSA-N	0	3	318.211	2.210	10	0		DEAEHN
CN[C@@H](CCSc1ccc(Br)cc1)C(N)=O	ZINC000062596970	184245090	/nfs/dbraw/zinc/24/50/90/184245090.db2.gz	PSOLTTXMGGBCJT-JTQLQIEISA-N	0	3	303.225	2.005	10	0		DEAEHN
[NH3+][C@@H]1CCCCC[C@H]1[N-]S(=O)(=O)c1ccc(Cl)s1	ZINC000063213903	184278968	/nfs/dbraw/zinc/27/89/68/184278968.db2.gz	MPWRYTIUHHGSFF-RKDXNWHRSA-N	0	3	308.856	2.340	10	0		DEAEHN
[NH3+][C@@H]1CCCCC[C@@H]1[N-]S(=O)(=O)c1cccc(Cl)c1F	ZINC000063213659	184278997	/nfs/dbraw/zinc/27/89/97/184278997.db2.gz	ABXIMJXUVKVXSM-MNOVXSKESA-N	0	3	320.817	2.417	10	0		DEAEHN
c1ccc(C[C@@H]2CSC(N[C@@H]3CN4CCC3CC4)=N2)cc1	ZINC000063220248	184279501	/nfs/dbraw/zinc/27/95/01/184279501.db2.gz	KCLIKTGYUCMWBH-HZPDHXFCSA-N	0	3	301.459	2.384	10	0		DEAEHN
CC[C@H](C)NCC(=O)Nc1cccc(CCC(=O)N(C)C)c1	ZINC000066068229	184386483	/nfs/dbraw/zinc/38/64/83/184386483.db2.gz	WNYJAVFAAPRTIT-ZDUSSCGKSA-N	0	3	305.422	2.034	10	0		DEAEHN
c1[nH]nc2cc(CN3CCCN(c4cccnn4)CC3)ccc12	ZINC000120122139	195100504	/nfs/dbraw/zinc/10/05/04/195100504.db2.gz	USJTYCIWDMKPIS-UHFFFAOYSA-N	0	3	308.389	2.065	10	0		DEAEHN
c1cn(Cc2ccccc2)c(CN[C@H]2CCc3c[nH]nc3C2)n1	ZINC000539516007	285079552	/nfs/dbraw/zinc/07/95/52/285079552.db2.gz	ZHNUOCUWWYEMBC-INIZCTEOSA-N	0	3	307.401	2.302	10	0		DEAEHN
COC[C@@H](O)CN[C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000539726598	285085486	/nfs/dbraw/zinc/08/54/86/285085486.db2.gz	DRZDMIOLTGQWSR-YOEHRIQHSA-N	0	3	316.401	2.319	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2CC[C@H](C)C2)cc(C)c1F	ZINC000159094010	197326252	/nfs/dbraw/zinc/32/62/52/197326252.db2.gz	JBEWULGNVOJYAS-NSHDSACASA-N	0	3	314.426	2.274	10	0		DEAEHN
CCCCN(CC)S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159054080	197322412	/nfs/dbraw/zinc/32/24/12/197322412.db2.gz	AVXGYEQQFLHQCD-UHFFFAOYSA-N	0	3	302.415	2.404	10	0		DEAEHN
Cc1cc(CNC(C)(C)C)cnc1SCCS(C)(=O)=O	ZINC000158844495	197305858	/nfs/dbraw/zinc/30/58/58/197305858.db2.gz	OWCRTWNMSDJVQJ-UHFFFAOYSA-N	0	3	316.492	2.415	10	0		DEAEHN
CCN[C@H](CS(=O)(=O)c1cccc(Cl)c1)[C@H]1CCOC1	ZINC000158837399	197305732	/nfs/dbraw/zinc/30/57/32/197305732.db2.gz	AMDSBSAHSVKGOZ-SMDDNHRTSA-N	0	3	317.838	2.128	10	0		DEAEHN
CCc1ccc(NC(=O)NCCCN(C)CCOC)cc1F	ZINC000158918360	197311484	/nfs/dbraw/zinc/31/14/84/197311484.db2.gz	UOZNCFSVAKVPRH-UHFFFAOYSA-N	0	3	311.401	2.478	10	0		DEAEHN
CN(CCN[C@H]1CCCc2[nH]c(=O)ccc21)C(=O)OC(C)(C)C	ZINC000158730710	197297254	/nfs/dbraw/zinc/29/72/54/197297254.db2.gz	LSSLDFBTJMEYGI-ZDUSSCGKSA-N	0	3	321.421	2.209	10	0		DEAEHN
CCCN[C@H](CS(=O)(=O)c1ccc(F)cc1)[C@@H]1CCOC1	ZINC000158729237	197296863	/nfs/dbraw/zinc/29/68/63/197296863.db2.gz	GHWDWXUVYDESIX-IUODEOHRSA-N	0	3	315.410	2.004	10	0		DEAEHN
CC(C)CO[C@H]1CCN(C(=O)N[C@@H](CC(C)C)CN(C)C)C1	ZINC000158618118	197288954	/nfs/dbraw/zinc/28/89/54/197288954.db2.gz	YQGKPABRTDSZGN-HOTGVXAUSA-N	0	3	313.486	2.419	10	0		DEAEHN
C[C@@H]1C[C@@H](Nc2nc(Cl)nc(N3CCCC3)n2)CCN1C	ZINC000158605842	197287896	/nfs/dbraw/zinc/28/78/96/197287896.db2.gz	OMPZOUNAKMGZEN-MNOVXSKESA-N	0	3	310.833	2.020	10	0		DEAEHN
CN(C)Cc1ccccc1CNC(=O)c1nnc(Cl)s1	ZINC000157168373	197167186	/nfs/dbraw/zinc/16/71/86/197167186.db2.gz	OBHUFDZQDZAFRG-UHFFFAOYSA-N	0	3	310.810	2.183	10	0		DEAEHN
CC1(C)CCCC[C@H]1NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000156910433	197149175	/nfs/dbraw/zinc/14/91/75/197149175.db2.gz	MXYOYGBEEOMEIE-HUUCEWRRSA-N	0	3	311.470	2.101	10	0		DEAEHN
C[C@@H]1CNC[C@H](C)N1C(=O)c1ccc(OC(F)(F)F)cc1	ZINC000156712969	197135319	/nfs/dbraw/zinc/13/53/19/197135319.db2.gz	MRCGVJOGZDRZGR-AOOOYVTPSA-N	0	3	302.296	2.408	10	0		DEAEHN
COc1ccc([C@H]2C[C@@H](C)N(CCN3CCCC3=O)C2)cc1	ZINC000155257552	197036582	/nfs/dbraw/zinc/03/65/82/197036582.db2.gz	OZVKEUYTJIVQOW-ZBFHGGJFSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)N1C[C@H](C)C[C@@H](C)C1	ZINC000245477355	285242341	/nfs/dbraw/zinc/24/23/41/285242341.db2.gz	UILNYGISCDVHAH-QBPKDAKJSA-N	0	3	309.498	2.296	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1	ZINC000120678439	195214150	/nfs/dbraw/zinc/21/41/50/195214150.db2.gz	FNITWOFKRXTLOX-CJNGLKHVSA-N	0	3	317.433	2.129	10	0		DEAEHN
CC[C@H]1CN(CC2=Cc3ccccc3OC2)CCN1C[C@@H](C)O	ZINC000120726487	195225881	/nfs/dbraw/zinc/22/58/81/195225881.db2.gz	DFJYOXLCMQDABV-QAPCUYQASA-N	0	3	316.445	2.239	10	0		DEAEHN
CCOCCN1CCN(Cc2ccc(COC)cc2)C[C@@H]1C	ZINC000120876807	195256131	/nfs/dbraw/zinc/25/61/31/195256131.db2.gz	ZKSIOAIXKJKQDO-INIZCTEOSA-N	0	3	306.450	2.376	10	0		DEAEHN
COc1cc(C)c([C@H](C)N[C@@H]2CCC(=O)N(C)C2)cc1OC	ZINC000152362514	196813310	/nfs/dbraw/zinc/81/33/10/196813310.db2.gz	FRYQOOSXGBOZLD-QWHCGFSZSA-N	0	3	306.406	2.284	10	0		DEAEHN
CO[C@@H]1CCN(C2CCC2)[C@H]2CN(Cc3cccnc3)C[C@H]21	ZINC000247812729	257117906	/nfs/dbraw/zinc/11/79/06/257117906.db2.gz	DLDGENYHUJEZMN-FGTMMUONSA-N	0	3	301.434	2.155	10	0		DEAEHN
Cc1ccccc1NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000121812856	195352578	/nfs/dbraw/zinc/35/25/78/195352578.db2.gz	FOYNSOLUDCMQCI-AWEZNQCLSA-N	0	3	305.422	2.026	10	0		DEAEHN
CSCCN(C)[C@@H](CN)c1cncc(Br)c1	ZINC000124983912	195700100	/nfs/dbraw/zinc/70/01/00/195700100.db2.gz	APULBHABVOTCOB-NSHDSACASA-N	0	3	304.257	2.139	10	0		DEAEHN
COCCn1ncc(Br)c1[C@H](N)[C@H](C)C1CC1	ZINC000127664189	195898595	/nfs/dbraw/zinc/89/85/95/195898595.db2.gz	HNLPQTQILJUTHT-LDYMZIIASA-N	0	3	302.216	2.338	10	0		DEAEHN
CN(C)CCN(Cc1ccccc1F)C(=O)Nc1nncs1	ZINC000047320962	132483617	/nfs/dbraw/zinc/48/36/17/132483617.db2.gz	UFUWAJKFIMVTKY-UHFFFAOYSA-N	0	3	323.397	2.273	10	0		DEAEHN
C/C(=C\c1ccc(Cl)cc1)CNCCNC(=O)c1ccn[nH]1	ZINC000355774674	133047398	/nfs/dbraw/zinc/04/73/98/133047398.db2.gz	HFZRBZXUFPVQKO-ZRDIBKRKSA-N	0	3	318.808	2.486	10	0		DEAEHN
C[C@@H](NC(=O)NCc1ccc2cc[nH]c2n1)C1=CCN(C)CC1	ZINC000357915034	133109313	/nfs/dbraw/zinc/10/93/13/133109313.db2.gz	IHIULXSZRLFHSS-GFCCVEGCSA-N	0	3	313.405	2.013	10	0		DEAEHN
c1ccc2c(c1)CC[C@@H](CN1CCN(c3cccnn3)CC1)C2	ZINC000359603893	133133966	/nfs/dbraw/zinc/13/39/66/133133966.db2.gz	CLWJXQWPFIPQJC-MRXNPFEDSA-N	0	3	308.429	2.404	10	0		DEAEHN
O=C(NC[C@@H](CO)C1CC1)c1cccc(CN2CCCC2)c1	ZINC000359823128	133147069	/nfs/dbraw/zinc/14/70/69/133147069.db2.gz	ODSULXKZOYZGJX-KRWDZBQOSA-N	0	3	302.418	2.031	10	0		DEAEHN
C[C@@H]1CN(CC(=O)NCCc2cccc3cccnc32)C[C@H]1C	ZINC000362445935	133230597	/nfs/dbraw/zinc/23/05/97/133230597.db2.gz	FSSGOBUUICQZMZ-HUUCEWRRSA-N	0	3	311.429	2.481	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NCCN1CC=CCC1)CC2	ZINC000373624680	133398179	/nfs/dbraw/zinc/39/81/79/133398179.db2.gz	PLUGLOWKWDGOJM-AWEZNQCLSA-N	0	3	316.449	2.016	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NCCN1CC=CCC1)C2	ZINC000373624680	133398180	/nfs/dbraw/zinc/39/81/80/133398180.db2.gz	PLUGLOWKWDGOJM-AWEZNQCLSA-N	0	3	316.449	2.016	10	0		DEAEHN
CCN(CCN1CCCCCC1)C(=O)c1cccc2ncnn21	ZINC000563731758	292071629	/nfs/dbraw/zinc/07/16/29/292071629.db2.gz	ITOBCWIDSZZJQX-UHFFFAOYSA-N	0	3	315.421	2.067	10	0		DEAEHN
C[C@@H]1CCC[C@H]1C(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000344986529	404483821	/nfs/dbraw/zinc/48/38/21/404483821.db2.gz	DFNRXBFXIOPFSI-SUMDDJOVSA-N	0	3	316.445	2.176	10	0		DEAEHN
Cc1ccc(N2CCCC2)c(C(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000116749110	292129494	/nfs/dbraw/zinc/12/94/94/292129494.db2.gz	KFGHHNUBOJTZRI-HNNXBMFYSA-N	0	3	301.434	2.371	10	0		DEAEHN
O=C(NCc1csc(-c2ccccc2)n1)[C@H]1C[C@H](F)CN1	ZINC000188374921	145011309	/nfs/dbraw/zinc/01/13/09/145011309.db2.gz	XUJGSLHHLCPGEZ-WCQYABFASA-N	0	3	305.378	2.126	10	0		DEAEHN
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCN3CCC2CC3)c1	ZINC000188634459	145015166	/nfs/dbraw/zinc/01/51/66/145015166.db2.gz	CMFIFYTTZMSQDA-DLBZAZTESA-N	0	3	300.402	2.105	10	0		DEAEHN
O=C(CSc1ccc(O)cc1)NCc1ccc2c(c1)CNC2	ZINC000188741491	145016997	/nfs/dbraw/zinc/01/69/97/145016997.db2.gz	MCUMWKDYFRSATM-UHFFFAOYSA-N	0	3	314.410	2.404	10	0		DEAEHN
O=C(C1CCCCC1)N1CC[C@H](NCc2ccc(F)nc2)C1	ZINC000189146773	145023044	/nfs/dbraw/zinc/02/30/44/145023044.db2.gz	MWJQUSKPYVVQSF-HNNXBMFYSA-N	0	3	305.397	2.492	10	0		DEAEHN
O[C@H](CC1CCCC1)CN1CCCN(CC(F)(F)F)CC1	ZINC000190377725	145042022	/nfs/dbraw/zinc/04/20/22/145042022.db2.gz	ZRYYHJRMFFKNKS-CQSZACIVSA-N	0	3	308.388	2.498	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@@H]1C)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000191824190	145065074	/nfs/dbraw/zinc/06/50/74/145065074.db2.gz	XOEJUUVWTZCJFT-MJVIPROJSA-N	0	3	315.410	2.305	10	0		DEAEHN
O=C(NC[C@H]1CCN(C2CC2)C1)c1csc(C(F)(F)F)n1	ZINC000192823613	145079475	/nfs/dbraw/zinc/07/94/75/145079475.db2.gz	RFEQZFYNRFIWGW-MRVPVSSYSA-N	0	3	319.352	2.376	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCCN(c2ccccc2)CC1	ZINC000193373752	145085389	/nfs/dbraw/zinc/08/53/89/145085389.db2.gz	BZTMZFGANUZYTG-SFHVURJKSA-N	0	3	306.450	2.376	10	0		DEAEHN
O=C(CCN1CCN2CCCC[C@H]2C1)Nc1cccc(F)c1	ZINC000246200558	145094450	/nfs/dbraw/zinc/09/44/50/145094450.db2.gz	NLFZYVGFGAYEPV-INIZCTEOSA-N	0	3	305.397	2.324	10	0		DEAEHN
C[C@@H]1CN(CCOc2ccc(Cl)cc2)C[C@H]1N1CCOCC1	ZINC000246322602	145098492	/nfs/dbraw/zinc/09/84/92/145098492.db2.gz	DCWFHFBOYQRIEU-RHSMWYFYSA-N	0	3	324.852	2.371	10	0		DEAEHN
COc1cc(OC)cc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1	ZINC000246605054	145108376	/nfs/dbraw/zinc/10/83/76/145108376.db2.gz	JDWLJCCISMFRFH-SUMWQHHRSA-N	0	3	318.417	2.260	10	0		DEAEHN
COc1ccccc1NCC(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000246668188	145110298	/nfs/dbraw/zinc/11/02/98/145110298.db2.gz	FDZLCRFMPUTEDZ-GOEBONIOSA-N	0	3	317.433	2.050	10	0		DEAEHN
CCN(Cc1ccccn1)C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000246718368	145112184	/nfs/dbraw/zinc/11/21/84/145112184.db2.gz	ABFQFQUMBHISDN-ZBFHGGJFSA-N	0	3	304.438	2.342	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N1C[C@@H](C)C[C@H](C)C1	ZINC000246864367	145117211	/nfs/dbraw/zinc/11/72/11/145117211.db2.gz	CTOTUSMAVXIXDS-ZOBUZTSGSA-N	0	3	318.465	2.160	10	0		DEAEHN
CN1CCC[C@@H]2CN(S(=O)(=O)/C=C/c3ccccc3)CC[C@H]21	ZINC000246906404	145119278	/nfs/dbraw/zinc/11/92/78/145119278.db2.gz	GBXJDOQJZBZXAB-WCEBEWAISA-N	0	3	320.458	2.403	10	0		DEAEHN
Cc1cccc(C)c1OCC(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000247037767	145124431	/nfs/dbraw/zinc/12/44/31/145124431.db2.gz	GNACIOYMXGURHW-CVEARBPZSA-N	0	3	302.418	2.377	10	0		DEAEHN
C[C@@H](C(=O)N1CCCCC1)N1CC[C@@H](CNc2ccccn2)C1	ZINC000247445173	145137314	/nfs/dbraw/zinc/13/73/14/145137314.db2.gz	YHUOMRNCSORCFK-HOTGVXAUSA-N	0	3	316.449	2.216	10	0		DEAEHN
C[C@H](Oc1ccc(F)c(F)c1)C(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000247505076	145139576	/nfs/dbraw/zinc/13/95/76/145139576.db2.gz	VIOSZWKOAMFKLU-AGIUHOORSA-N	0	3	324.371	2.427	10	0		DEAEHN
COC(=O)c1ccccc1OCCN1CCN2CCCC[C@H]2C1	ZINC000248406096	145153111	/nfs/dbraw/zinc/15/31/11/145153111.db2.gz	AYCKDFHGOVLYNR-HNNXBMFYSA-N	0	3	318.417	2.022	10	0		DEAEHN
COC(=O)c1ccccc1OCCN1CC[C@@H]2OCCC[C@H]2C1	ZINC000248425174	145153971	/nfs/dbraw/zinc/15/39/71/145153971.db2.gz	NVNQOTGANHMPLU-HOCLYGCPSA-N	0	3	319.401	2.353	10	0		DEAEHN
Cc1cc(C)cc([C@H]2CCN(C[C@@H](O)CN3CCCC3=O)C2)c1	ZINC000248464896	145156151	/nfs/dbraw/zinc/15/61/51/145156151.db2.gz	RHWNSCAWMYFDSF-FUHWJXTLSA-N	0	3	316.445	2.076	10	0		DEAEHN
Cc1nc(C[C@H]2CCCN(CCO[C@H]3CCCCO3)C2)no1	ZINC000248578668	145159348	/nfs/dbraw/zinc/15/93/48/145159348.db2.gz	OAWRTQOROVMVJC-ZBFHGGJFSA-N	0	3	309.410	2.176	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C)N(C)C	ZINC000248795182	145167829	/nfs/dbraw/zinc/16/78/29/145167829.db2.gz	JCWCFFMQAVWUII-KBAYOESNSA-N	0	3	317.477	2.353	10	0		DEAEHN
Cn1cc(-c2cc(CN3CC[C@@]4(O)CCCC[C@H]4C3)on2)cn1	ZINC000248920723	145173457	/nfs/dbraw/zinc/17/34/57/145173457.db2.gz	DZQVKTUJGWNQMX-YOEHRIQHSA-N	0	3	316.405	2.202	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1N[C@H]1CCCN(c2ccccc2F)C1=O	ZINC000249246488	145181700	/nfs/dbraw/zinc/18/17/00/145181700.db2.gz	DZHKDXXZUXURLW-SNPRPXQTSA-N	0	3	306.381	2.336	10	0		DEAEHN
CC(C)N(C)C(=O)[C@@H](C)N1C[C@@H](CO)[C@@H](c2ccsc2)C1	ZINC000249587618	145187505	/nfs/dbraw/zinc/18/75/05/145187505.db2.gz	UJFLQKKOOHDEGL-VHDGCEQUSA-N	0	3	310.463	2.011	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COc2ccc(Cl)cc2)CC[C@@H]1C	ZINC000252059645	145198179	/nfs/dbraw/zinc/19/81/79/145198179.db2.gz	ZPXJVMZYOYLCTO-JGGQBBKZSA-N	0	3	313.825	2.437	10	0		DEAEHN
C[C@H](NC(=O)[C@@H](N)C1CCOCC1)C12CC3CC(CC(C3)C1)C2	ZINC000261720360	145219532	/nfs/dbraw/zinc/21/95/32/145219532.db2.gz	JFUJRLSRAYWQQS-AZBXIESMSA-N	0	3	320.477	2.461	10	0		DEAEHN
COc1ccccc1[C@@H]1CNCCN1Cc1c(C)noc1C	ZINC000261734595	145221363	/nfs/dbraw/zinc/22/13/63/145221363.db2.gz	MGYFXGYXIOLUSG-INIZCTEOSA-N	0	3	301.390	2.447	10	0		DEAEHN
N[C@H](C(=O)Nc1ccnc(-c2ccccc2)c1)C1CCOCC1	ZINC000261764026	145224518	/nfs/dbraw/zinc/22/45/18/145224518.db2.gz	LWLZLIVKZMTENW-KRWDZBQOSA-N	0	3	311.385	2.441	10	0		DEAEHN
COCc1cccc(NC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)c1	ZINC000261810773	145228961	/nfs/dbraw/zinc/22/89/61/145228961.db2.gz	GMSVMCHRHVQCCD-HDMKZQKVSA-N	0	3	318.417	2.304	10	0		DEAEHN
N[C@H](C(=O)NCc1csc2ccccc12)C1CCOCC1	ZINC000261909943	145240548	/nfs/dbraw/zinc/24/05/48/145240548.db2.gz	XKGAJHFLNPRICN-HNNXBMFYSA-N	0	3	304.415	2.271	10	0		DEAEHN
NC1(C(=O)Nc2nc(-c3ccccc3)cs2)CCOCC1	ZINC000261921258	145241982	/nfs/dbraw/zinc/24/19/82/145241982.db2.gz	VBDNXKHLVMIDNY-UHFFFAOYSA-N	0	3	303.387	2.257	10	0		DEAEHN
N[C@H](C(=O)N1CCC(c2ccccc2)CC1)C1CCOCC1	ZINC000261923863	145242448	/nfs/dbraw/zinc/24/24/48/145242448.db2.gz	YZMFVOYATYSNIK-KRWDZBQOSA-N	0	3	302.418	2.147	10	0		DEAEHN
C[C@@H](C[C@H]1COCCN1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000262101507	145261559	/nfs/dbraw/zinc/26/15/59/145261559.db2.gz	IUQPGCCULMRHDF-LRDDRELGSA-N	0	3	303.406	2.214	10	0		DEAEHN
CC(C)C[C@H](N)C(=O)N1CCC[C@@H](c2noc(C3CC3)n2)C1	ZINC000262296445	145274575	/nfs/dbraw/zinc/27/45/75/145274575.db2.gz	JFALCHYEDRXWJX-OLZOCXBDSA-N	0	3	306.410	2.026	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)Nc1ccc(F)c(F)c1	ZINC000262402157	145281377	/nfs/dbraw/zinc/28/13/77/145281377.db2.gz	CKSCIXWNPRZYDK-WNMQOVRZSA-N	0	3	310.344	2.436	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)Nc1cc(F)cc(F)c1	ZINC000262460135	145284948	/nfs/dbraw/zinc/28/49/48/145284948.db2.gz	ILCKKAIJFZAFCQ-XJKCOSOUSA-N	0	3	310.344	2.436	10	0		DEAEHN
CNC(=O)c1cccc(NC(=O)[C@H]2NCCCC2(C)C)c1C	ZINC000262484273	145286918	/nfs/dbraw/zinc/28/69/18/145286918.db2.gz	KETJAKPYGOCSRI-CQSZACIVSA-N	0	3	303.406	2.071	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)NCc1ccccc1Cl	ZINC000262495940	145288234	/nfs/dbraw/zinc/28/82/34/145288234.db2.gz	LJAUXGYBGFPTKF-SUYBPPKGSA-N	0	3	322.836	2.489	10	0		DEAEHN
COc1ccc(OC)c(CNC(=O)[C@H]2NCCCC2(C)C)c1	ZINC000262537340	145291475	/nfs/dbraw/zinc/29/14/75/145291475.db2.gz	QMQKAMYEFLWBEK-OAHLLOKOSA-N	0	3	306.406	2.098	10	0		DEAEHN
C[C@@H](c1nc([C@H]2CNCCN2C)no1)c1ccc(F)c(F)c1	ZINC000263175529	145332827	/nfs/dbraw/zinc/33/28/27/145332827.db2.gz	GEPCLHSQGWQSFD-NOZJJQNGSA-N	0	3	308.332	2.076	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@H]2c2ccc(F)cc2)n1	ZINC000263184914	145333598	/nfs/dbraw/zinc/33/35/98/145333598.db2.gz	HEDPYXKPUWHOHF-BFHYXJOUSA-N	0	3	302.353	2.056	10	0		DEAEHN
CC(C)c1ccc(OCc2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263203916	145336231	/nfs/dbraw/zinc/33/62/31/145336231.db2.gz	JKAWPPJLNOALAE-OAHLLOKOSA-N	0	3	316.405	2.348	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@H]2c2ccc(F)c(F)c2)n1	ZINC000263223073	145338068	/nfs/dbraw/zinc/33/80/68/145338068.db2.gz	MGHFAIICEMJNQK-MISXGVKJSA-N	0	3	320.343	2.195	10	0		DEAEHN
COc1cccc(CN(CCN(C)C)C(=O)NC[C@@H]2C[C@@H]2C)c1	ZINC000358563798	147156774	/nfs/dbraw/zinc/15/67/74/147156774.db2.gz	QXXKDQLLLYHXKK-HOCLYGCPSA-N	0	3	319.449	2.424	10	0		DEAEHN
COC(=O)[C@H](Nc1cccc(CN2CCC(O)CC2)c1)C1CC1	ZINC000358826783	147214251	/nfs/dbraw/zinc/21/42/51/147214251.db2.gz	YCYWWFOFQFAJFP-QGZVFWFLSA-N	0	3	318.417	2.007	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)NC[C@@](C)(O)C2CCCCC2)CCN1C	ZINC000358924185	147232347	/nfs/dbraw/zinc/23/23/47/147232347.db2.gz	DCCSANPGIXERQH-FRFSOERESA-N	0	3	311.470	2.100	10	0		DEAEHN
CC[C@@H](C(=O)N1CCN(CCN(C)C)CC1)c1ccc(F)cc1	ZINC000359293952	147301180	/nfs/dbraw/zinc/30/11/80/147301180.db2.gz	PHCLHYFKYBTQSV-QGZVFWFLSA-N	0	3	321.440	2.025	10	0		DEAEHN
CC(C)n1nccc1CNC[C@@H]1CCC2(CCOCC2)[C@H]1O	ZINC000374684624	148277493	/nfs/dbraw/zinc/27/74/93/148277493.db2.gz	AQJWBHURFSNTGP-HOCLYGCPSA-N	0	3	307.438	2.121	10	0		DEAEHN
Cc1cc(NC(=O)NCCN2CCCC[C@H]2C)ccc1C(N)=O	ZINC000111759932	401723240	/nfs/dbraw/zinc/72/32/40/401723240.db2.gz	MZEWJFYKXLZCBS-CYBMUJFWSA-N	0	3	318.421	2.090	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@@H](C)c1ccccc1C	ZINC000111789307	401723500	/nfs/dbraw/zinc/72/35/00/401723500.db2.gz	CLKCJFVWCABAAE-HOTGVXAUSA-N	0	3	319.449	2.466	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@H](C)c1ccc(C)o1	ZINC000111804096	401724388	/nfs/dbraw/zinc/72/43/88/401724388.db2.gz	VGTQOOZKAFPRIM-KGLIPLIRSA-N	0	3	309.410	2.059	10	0		DEAEHN
COCCN(CCN(C)C)C(=O)NC[C@@H]1C[C@H]1c1ccccc1	ZINC000111890127	401727150	/nfs/dbraw/zinc/72/71/50/401727150.db2.gz	IYRSBKYKVKPVHD-IRXDYDNUSA-N	0	3	319.449	2.010	10	0		DEAEHN
CN1CCC(C(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)CC1	ZINC000074187697	401732513	/nfs/dbraw/zinc/73/25/13/401732513.db2.gz	AAPDAVKHJDBDEU-QZTJIDSGSA-N	0	3	316.445	2.443	10	0		DEAEHN
CC(C)(C)C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000112256068	401734336	/nfs/dbraw/zinc/73/43/36/401734336.db2.gz	IWOVCNBFMOAQPV-UHFFFAOYSA-N	0	3	317.433	2.497	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)c1cnn2c1CCCC2	ZINC000127452369	401736002	/nfs/dbraw/zinc/73/60/02/401736002.db2.gz	HSRKCYJQRJKSDO-AWEZNQCLSA-N	0	3	304.438	2.214	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCC[C@@H]1c1cccn1C	ZINC000074491164	401739908	/nfs/dbraw/zinc/73/99/08/401739908.db2.gz	VZCSCHQXFNTMBC-GOEBONIOSA-N	0	3	304.438	2.356	10	0		DEAEHN
CC(C)CN(CCN(C)C)C(=O)NCc1nccn1CC(C)C	ZINC000074534529	401741723	/nfs/dbraw/zinc/74/17/23/401741723.db2.gz	UOXWWTJOPSSXNJ-UHFFFAOYSA-N	0	3	323.485	2.268	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc(N2CCCC2)nc1	ZINC000072089193	401702668	/nfs/dbraw/zinc/70/26/68/401702668.db2.gz	GVMHVSMWCZWCJY-INIZCTEOSA-N	0	3	318.465	2.388	10	0		DEAEHN
C[C@H]1CN(C2CCN(Cc3ccc4c(c3)CCO4)CC2)CCO1	ZINC000111236544	401703011	/nfs/dbraw/zinc/70/30/11/401703011.db2.gz	JFCGUTYHIKGPBK-HNNXBMFYSA-N	0	3	316.445	2.307	10	0		DEAEHN
CCC[C@H](C)C(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000114414632	401798583	/nfs/dbraw/zinc/79/85/83/401798583.db2.gz	UFNVJLXLNZNBQP-HNNXBMFYSA-N	0	3	318.465	2.228	10	0		DEAEHN
COC(=O)Nc1ccccc1C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000127814963	401751086	/nfs/dbraw/zinc/75/10/86/401751086.db2.gz	GSQRMDPLJHTKKF-QWHCGFSZSA-N	0	3	319.405	2.420	10	0		DEAEHN
Cc1cccc(C)c1OCCCN1CCN(C[C@@H](C)O)[C@H](C)C1	ZINC000112697808	401754460	/nfs/dbraw/zinc/75/44/60/401754460.db2.gz	VAPAZGQYKDLBOZ-QZTJIDSGSA-N	0	3	320.477	2.459	10	0		DEAEHN
C[C@H](NC(=O)N[C@@H](Cc1ccccc1)CN(C)C)[C@@H]1CCCO1	ZINC000127973762	401758078	/nfs/dbraw/zinc/75/80/78/401758078.db2.gz	DGYCHKRNQFTPTC-XIRDDKMYSA-N	0	3	319.449	2.026	10	0		DEAEHN
COC(=O)Nc1ccccc1C(=O)NCCN1CCCC[C@@H]1C	ZINC000112869233	401760201	/nfs/dbraw/zinc/76/02/01/401760201.db2.gz	FGDDOPLBSFIEQO-ZDUSSCGKSA-N	0	3	319.405	2.469	10	0		DEAEHN
CCN(CC)C(=O)[C@@H]1CCCN1CCc1ccc2c(c1)CCO2	ZINC000075673493	401766437	/nfs/dbraw/zinc/76/64/37/401766437.db2.gz	SKUXPALTLOPYDR-KRWDZBQOSA-N	0	3	316.445	2.497	10	0		DEAEHN
C[C@@H]1CN(C(=O)CN(C[C@@H]2CCCO2)C2CCCC2)C[C@H](C)O1	ZINC000075831564	401769811	/nfs/dbraw/zinc/76/98/11/401769811.db2.gz	NOJDMJIVNVAAQT-UXLLHSPISA-N	0	3	324.465	2.046	10	0		DEAEHN
Cc1cc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)nn1C(C)(C)C	ZINC000113230129	401771696	/nfs/dbraw/zinc/77/16/96/401771696.db2.gz	ZSYONWJUBJOWPS-KBPBESRZSA-N	0	3	304.438	2.255	10	0		DEAEHN
CCOc1ccc([N-]S(=O)(=O)c2ccc(CC[NH3+])cc2)cc1	ZINC000011849309	401777222	/nfs/dbraw/zinc/77/72/22/401777222.db2.gz	CIERVQZWKSNVES-UHFFFAOYSA-N	0	3	320.414	2.387	10	0		DEAEHN
COc1ccccc1CCNC(=O)CN1C[C@H](C)CC[C@@H]1C	ZINC000076149377	401785164	/nfs/dbraw/zinc/78/51/64/401785164.db2.gz	NLPSCRKAWCDBGZ-CABCVRRESA-N	0	3	304.434	2.474	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)NCC[C@@H](C)O)c1ccsc1	ZINC000114822361	401811221	/nfs/dbraw/zinc/81/12/21/401811221.db2.gz	MTKRABVNRVSQAA-OCCSQVGLSA-N	0	3	313.467	2.201	10	0		DEAEHN
Cc1ccc(NC(=O)N[C@@H](C)[C@H](C)CO)c(OCCN(C)C)c1	ZINC000077722778	401827364	/nfs/dbraw/zinc/82/73/64/401827364.db2.gz	NIHPOIDGJCHVIB-KGLIPLIRSA-N	0	3	323.437	2.074	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)N[C@@H](C)[C@@H](C)CO)c1ccccc1	ZINC000077754135	401828943	/nfs/dbraw/zinc/82/89/43/401828943.db2.gz	FZJMACVFSMZZAC-YQQAZPJKSA-N	0	3	321.465	2.386	10	0		DEAEHN
C[C@@H](NC(=O)NCc1cccc(CN(C)C)c1)[C@@H]1CCCO1	ZINC000077839667	401834838	/nfs/dbraw/zinc/83/48/38/401834838.db2.gz	MQBKEYKDIBUSNP-CJNGLKHVSA-N	0	3	305.422	2.115	10	0		DEAEHN
CC1(C)NC(=O)N(CCCN2CCC[C@@H]2c2ccco2)C1=O	ZINC000116290478	401848704	/nfs/dbraw/zinc/84/87/04/401848704.db2.gz	JVUJUYQKYHWKPV-GFCCVEGCSA-N	0	3	305.378	2.137	10	0		DEAEHN
COc1ccc(CNC(=O)N[C@@H](CC(C)C)CN(C)C)cc1	ZINC000078377781	401848889	/nfs/dbraw/zinc/84/88/89/401848889.db2.gz	GSDPPHOSAQEWOC-HNNXBMFYSA-N	0	3	307.438	2.471	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2cc3ccccc3s2)CCO1	ZINC000116784442	401858766	/nfs/dbraw/zinc/85/87/66/401858766.db2.gz	QPQQRARXSWAKJT-CYBMUJFWSA-N	0	3	304.415	2.304	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2)CCO1	ZINC000116786207	401859159	/nfs/dbraw/zinc/85/91/59/401859159.db2.gz	ZVJQSGRPPXHTTH-CYBMUJFWSA-N	0	3	316.323	2.108	10	0		DEAEHN
Cc1ccc(C)c(SCC(=O)N2CCO[C@H](CN(C)C)C2)c1	ZINC000116798205	401859787	/nfs/dbraw/zinc/85/97/87/401859787.db2.gz	RFIVXVGUFCVXFV-OAHLLOKOSA-N	0	3	322.474	2.185	10	0		DEAEHN
COc1ccccc1NC(=O)C1CCN(CCC(C)=O)CC1	ZINC000029903666	401860119	/nfs/dbraw/zinc/86/01/19/401860119.db2.gz	SSGJUGPQQXTNHH-UHFFFAOYSA-N	0	3	304.390	2.325	10	0		DEAEHN
C[C@@H](CN1CCN(c2ccc3nncn3n2)CC1)c1ccccc1	ZINC000116878788	401862844	/nfs/dbraw/zinc/86/28/44/401862844.db2.gz	FIBSUAOQJIKNDY-HNNXBMFYSA-N	0	3	322.416	2.050	10	0		DEAEHN
CC(C)COc1ccc(NC(=O)N2CC[C@H](N(C)C)C2)cn1	ZINC000117009390	401867192	/nfs/dbraw/zinc/86/71/92/401867192.db2.gz	XCTWNEWTJWJNSY-AWEZNQCLSA-N	0	3	306.410	2.284	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)CSCc2cscn2)CCN1C	ZINC000132538789	401869328	/nfs/dbraw/zinc/86/93/28/401869328.db2.gz	RSRNEVPRSPYIAK-YPMHNXCESA-N	0	3	313.492	2.317	10	0		DEAEHN
c1csc(-c2noc(-c3ccnc(N4CCNCC4)c3)n2)c1	ZINC000040351954	401924950	/nfs/dbraw/zinc/92/49/50/401924950.db2.gz	QNSLIGIHMGSGGM-UHFFFAOYSA-N	0	3	313.386	2.270	10	0		DEAEHN
CC(C)COC1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000079591477	401877515	/nfs/dbraw/zinc/87/75/15/401877515.db2.gz	STGMHYQOAODINV-UHFFFAOYSA-N	0	3	323.481	2.460	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(O)cc1	ZINC000133363896	401883184	/nfs/dbraw/zinc/88/31/84/401883184.db2.gz	HEQQENRRQWRSEU-QGZVFWFLSA-N	0	3	312.413	2.224	10	0		DEAEHN
Cc1nccn1CCCCNC(=O)NCCN1CCCC[C@H]1C	ZINC000080563987	401890220	/nfs/dbraw/zinc/89/02/20/401890220.db2.gz	QDYFAFVVWXSMSV-OAHLLOKOSA-N	0	3	321.469	2.145	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)NC[C@@H]2CCCN(C)C2)c1	ZINC000081106631	401894539	/nfs/dbraw/zinc/89/45/39/401894539.db2.gz	ZPGFYDHJZJKWSX-AWEZNQCLSA-N	0	3	318.421	2.133	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)Nc2cc(Cl)ccc2F)CCO1	ZINC000118795356	401907779	/nfs/dbraw/zinc/90/77/79/401907779.db2.gz	KYBQODXKJTVRRY-LLVKDONJSA-N	0	3	315.776	2.273	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C)N(C)C	ZINC000137056089	401977933	/nfs/dbraw/zinc/97/79/33/401977933.db2.gz	FEMQWDFHZIAPPO-CVEARBPZSA-N	0	3	309.429	2.275	10	0		DEAEHN
NC(=O)N1CCC(NCc2ccccc2OC2CCC2)CC1	ZINC000090027815	401979263	/nfs/dbraw/zinc/97/92/63/401979263.db2.gz	UYDZJPMOQDFHGS-UHFFFAOYSA-N	0	3	303.406	2.251	10	0		DEAEHN
CCCn1cc(CN(C)[C@H]2CCCN(c3cccnn3)C2)cn1	ZINC000120213735	401982233	/nfs/dbraw/zinc/98/22/33/401982233.db2.gz	MRGBTDXOJWCMOG-INIZCTEOSA-N	0	3	314.437	2.184	10	0		DEAEHN
C[C@@H](NC(=O)[C@@]1(F)CCNC1)c1ccccc1Br	ZINC000150721725	401993918	/nfs/dbraw/zinc/99/39/18/401993918.db2.gz	AHLLNNYFQWRKOW-NOZJJQNGSA-N	0	3	315.186	2.328	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)C(C)(C)c2cccc(Cl)c2)CCO1	ZINC000135547816	401944290	/nfs/dbraw/zinc/94/42/90/401944290.db2.gz	ZFSQZPSVUSULBB-OAHLLOKOSA-N	0	3	324.852	2.407	10	0		DEAEHN
COc1ccc([C@H]2C[C@H](C)N(CC(=O)N3CCCC3)C2)cc1	ZINC000151043312	402012521	/nfs/dbraw/zinc/01/25/21/402012521.db2.gz	HLIHSXXAUKRLAT-HOCLYGCPSA-N	0	3	302.418	2.495	10	0		DEAEHN
C[C@H]1CCCCN1C(=O)CN1CC[C@H](CNc2ccccn2)C1	ZINC000151105604	402016191	/nfs/dbraw/zinc/01/61/91/402016191.db2.gz	LKGNTYSBQUBZKA-JKSUJKDBSA-N	0	3	316.449	2.216	10	0		DEAEHN
O=[S@@](C[C@H]1CCCCN1)c1cccc(Br)n1	ZINC000095092394	402025753	/nfs/dbraw/zinc/02/57/53/402025753.db2.gz	MMLIHXRXBDAPCP-JDNHERCYSA-N	0	3	303.225	2.094	10	0		DEAEHN
Cc1nccn1CCCN(C)C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000122038478	402060201	/nfs/dbraw/zinc/06/02/01/402060201.db2.gz	WGUZHYYFTFVEBA-INIZCTEOSA-N	0	3	323.485	2.199	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(=O)[nH]c(C(C)C)c1	ZINC000121587194	402045476	/nfs/dbraw/zinc/04/54/76/402045476.db2.gz	OMLMQLBLFQXHHQ-AWEZNQCLSA-N	0	3	305.422	2.467	10	0		DEAEHN
O=C(CCN1CCC[C@@H](Cn2cncn2)C1)c1ccc(F)cc1	ZINC000122070313	402060938	/nfs/dbraw/zinc/06/09/38/402060938.db2.gz	JQCWYZLNOGZTDO-CQSZACIVSA-N	0	3	316.380	2.402	10	0		DEAEHN
CC[C@H]1CN(Cc2c[nH]nc2C(C)(C)C)CCN1CCOC	ZINC000120955324	402008070	/nfs/dbraw/zinc/00/80/70/402008070.db2.gz	ZBQDQYFQNWCPME-HNNXBMFYSA-N	0	3	308.470	2.250	10	0		DEAEHN
CCOc1ccccc1CNC(=O)N[C@@H]1CCCN(CC)C1	ZINC000054581937	402069942	/nfs/dbraw/zinc/06/99/42/402069942.db2.gz	TYFAQKOGPJVWLA-OAHLLOKOSA-N	0	3	305.422	2.369	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CC(c3ccccc3)=NO2)CCN1C	ZINC000122774158	402094164	/nfs/dbraw/zinc/09/41/64/402094164.db2.gz	KGIPZQHUSPTEAO-UNEWFSDZSA-N	0	3	315.417	2.121	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2cc(C)ccc2OC)C1	ZINC000057798080	402096788	/nfs/dbraw/zinc/09/67/88/402096788.db2.gz	FBDNMCRJOBNJJW-MRXNPFEDSA-N	0	3	319.449	2.330	10	0		DEAEHN
CC(C)COC[C@@H](NC1CCN(C(N)=O)CC1)c1ccco1	ZINC000152570892	402101084	/nfs/dbraw/zinc/10/10/84/402101084.db2.gz	UMAQGUWSBUJCHV-CQSZACIVSA-N	0	3	309.410	2.126	10	0		DEAEHN
COc1ccc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1OC	ZINC000122928426	402102078	/nfs/dbraw/zinc/10/20/78/402102078.db2.gz	AOVNYYSVDKUDQA-JSGCOSHPSA-N	0	3	306.406	2.259	10	0		DEAEHN
C/C=C/c1ccc(OCC(=O)NC2CCN(C)CC2)c(OC)c1	ZINC000122961552	402103312	/nfs/dbraw/zinc/10/33/12/402103312.db2.gz	YLUQVULOPKVETN-SNAWJCMRSA-N	0	3	318.417	2.318	10	0		DEAEHN
C[C@H](C(=O)NCc1ccccc1F)N1CC[C@H]2OCCC[C@@H]2C1	ZINC000152775613	402108281	/nfs/dbraw/zinc/10/82/81/402108281.db2.gz	BOZHSDIPLNHNGB-FRFSOERESA-N	0	3	320.408	2.331	10	0		DEAEHN
CCC[C@H](C(=O)NCc1nc(-c2cccs2)no1)N(C)C	ZINC000123327334	402122099	/nfs/dbraw/zinc/12/20/99/402122099.db2.gz	QLXJMSNSWAEHSX-SNVBAGLBSA-N	0	3	308.407	2.145	10	0		DEAEHN
COc1ccc(OC)c([C@@H](C)NC[C@@H](C)N2CCOCC2)c1	ZINC000123253315	402118331	/nfs/dbraw/zinc/11/83/31/402118331.db2.gz	MGELOZXIYQVUKJ-ZIAGYGMSSA-N	0	3	308.422	2.075	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2ccc(N(C)C)cc2F)C1	ZINC000122137015	402062899	/nfs/dbraw/zinc/06/28/99/402062899.db2.gz	ZIAMDDISNFUSFB-WBMJQRKESA-N	0	3	307.413	2.350	10	0		DEAEHN
COc1cccc(OC)c1CC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000122215132	402067248	/nfs/dbraw/zinc/06/72/48/402067248.db2.gz	KHTUBJCAWHWWNJ-UONOGXRCSA-N	0	3	320.433	2.187	10	0		DEAEHN
COc1ccc([C@H](C)NC[C@@H](C)N2CCOCC2)c(OC)c1	ZINC000123481131	402130339	/nfs/dbraw/zinc/13/03/39/402130339.db2.gz	ZRVQQGYFOBAULC-KGLIPLIRSA-N	0	3	308.422	2.075	10	0		DEAEHN
COC(=O)c1ccc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1	ZINC000123922042	402154190	/nfs/dbraw/zinc/15/41/90/402154190.db2.gz	IWAXWXATJQYUBL-IUODEOHRSA-N	0	3	304.390	2.028	10	0		DEAEHN
Cc1cc(CN2CCC[C@H](C(=O)N3CCOCC3)C2)ccc1F	ZINC000124465424	402181389	/nfs/dbraw/zinc/18/13/89/402181389.db2.gz	GHPICUHQILWZMZ-INIZCTEOSA-N	0	3	320.408	2.205	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2ccc3c(c2)OCCO3)CCN1C	ZINC000124825956	402199300	/nfs/dbraw/zinc/19/93/00/402199300.db2.gz	KDBFSSYKXQFSKA-TZMCWYRMSA-N	0	3	304.390	2.013	10	0		DEAEHN
COc1cc([C@H](C)N[C@@H](C)CN2CCN(C)CC2)ccc1F	ZINC000153675487	402161805	/nfs/dbraw/zinc/16/18/05/402161805.db2.gz	SKVQGRUACBIWCS-KBPBESRZSA-N	0	3	309.429	2.121	10	0		DEAEHN
CC(C)(C)[C@H](N)C(=O)N1CCC(NC(=O)C2CCCCC2)CC1	ZINC000153813434	402171579	/nfs/dbraw/zinc/17/15/79/402171579.db2.gz	MJGAFDCTGALVJO-OAHLLOKOSA-N	0	3	323.481	2.047	10	0		DEAEHN
COc1ccc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c(OC)c1	ZINC000124277056	402172672	/nfs/dbraw/zinc/17/26/72/402172672.db2.gz	WGGMXOFHDBGNDW-CHWSQXEVSA-N	0	3	306.406	2.259	10	0		DEAEHN
CN(CCCNC(=O)N(C)C[C@@H]1CCCO1)Cc1ccccc1	ZINC000102902162	402174464	/nfs/dbraw/zinc/17/44/64/402174464.db2.gz	LTRAUGVBURUMQH-KRWDZBQOSA-N	0	3	319.449	2.329	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccn(C2CCCC2)n1	ZINC000154812805	402233788	/nfs/dbraw/zinc/23/37/88/402233788.db2.gz	DLMKSXRJJNEXJU-DZGCQCFKSA-N	0	3	302.422	2.307	10	0		DEAEHN
CCc1nnsc1C(=O)N1CCCC[C@@H](N2CCCC2)C1	ZINC000107525684	402234604	/nfs/dbraw/zinc/23/46/04/402234604.db2.gz	HCGQJSUKZRGNHZ-GFCCVEGCSA-N	0	3	308.451	2.191	10	0		DEAEHN
Cc1nn(C)cc1[C@@H](C)NC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000069773786	402243549	/nfs/dbraw/zinc/24/35/49/402243549.db2.gz	IDKJTERATUXEEY-OCCSQVGLSA-N	0	3	309.458	2.065	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)c2c[nH]nc2-c2ccc(F)cc2)C1	ZINC000108462247	402254438	/nfs/dbraw/zinc/25/44/38/402254438.db2.gz	GQXIPHDMXYFWAA-LBPRGKRZSA-N	0	3	316.380	2.287	10	0		DEAEHN
COCCOc1cccc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000155372506	402254558	/nfs/dbraw/zinc/25/45/58/402254558.db2.gz	DETZVSIYMGCELB-YOEHRIQHSA-N	0	3	320.433	2.170	10	0		DEAEHN
COc1ccccc1CCN(C)C(=O)NC[C@H]1CCCN(C)C1	ZINC000108590339	402258159	/nfs/dbraw/zinc/25/81/59/402258159.db2.gz	TXUPLKIMRMPCIJ-OAHLLOKOSA-N	0	3	319.449	2.221	10	0		DEAEHN
C[C@H](C(=O)N1CCO[C@@H](CN(C)C)C1)c1ccc(Cl)s1	ZINC000176608390	402323152	/nfs/dbraw/zinc/32/31/52/402323152.db2.gz	SWBLKZJGPLRCAN-QWRGUYRKSA-N	0	3	316.854	2.294	10	0		DEAEHN
Cc1ccc(OCCN(C)C[C@H](O)COCc2ccco2)cc1	ZINC000070869970	402265816	/nfs/dbraw/zinc/26/58/16/402265816.db2.gz	FUPVCVYWWKGTED-INIZCTEOSA-N	0	3	319.401	2.476	10	0		DEAEHN
CN1CCC(Oc2ccc(NC(=O)C(F)(F)F)cn2)CC1	ZINC000071564932	402275810	/nfs/dbraw/zinc/27/58/10/402275810.db2.gz	SXHQBOTYNQFYMM-UHFFFAOYSA-N	0	3	303.284	2.055	10	0		DEAEHN
Cc1cc2occ(C(=O)N3CCO[C@H](CN(C)C)C3)c2cc1C	ZINC000184556727	402275953	/nfs/dbraw/zinc/27/59/53/402275953.db2.gz	FEVKVGYIGBFGBO-CQSZACIVSA-N	0	3	316.401	2.452	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2cnc(C3CC3)nc2)CCN1C	ZINC000176113415	402279704	/nfs/dbraw/zinc/27/97/04/402279704.db2.gz	LLPCZIPXTJAAFT-RISCZKNCSA-N	0	3	303.410	2.300	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCN(C)c1ccccc1	ZINC000176180215	402287252	/nfs/dbraw/zinc/28/72/52/402287252.db2.gz	HSTPMUJFIXSPPB-KRWDZBQOSA-N	0	3	318.465	2.249	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1ccc(OC)c(O)c1	ZINC000176236880	402293237	/nfs/dbraw/zinc/29/32/37/402293237.db2.gz	HNZWJWRVWGPGSO-CQSZACIVSA-N	0	3	321.421	2.027	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cnc(C(F)(F)F)nc2)CCN1C	ZINC000157554650	402295776	/nfs/dbraw/zinc/29/57/76/402295776.db2.gz	NDTTZYQAIGFJDM-MWLCHTKSSA-N	0	3	316.327	2.050	10	0		DEAEHN
CC(C)OCCN1CCC(NC(=O)NC[C@@H](C)C(C)C)CC1	ZINC000176392193	402305540	/nfs/dbraw/zinc/30/55/40/402305540.db2.gz	PVWWJUQSYXVELG-OAHLLOKOSA-N	0	3	313.486	2.467	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)NC[C@H](C)N(C)C2CC2)s1	ZINC000176438045	402309508	/nfs/dbraw/zinc/30/95/08/402309508.db2.gz	VZHSWCKFWNFPOJ-GXSJLCMTSA-N	0	3	311.451	2.371	10	0		DEAEHN
Cc1nc([C@@H](N[C@@H](C)CCn2cccn2)c2ccccc2)n[nH]1	ZINC000158809354	402312669	/nfs/dbraw/zinc/31/26/69/402312669.db2.gz	YDUVCUQLUWUEJV-BBRMVZONSA-N	0	3	310.405	2.467	10	0		DEAEHN
CCOC(CN1CCC[C@H](Cn2nc(C)nc2C)C1)OCC	ZINC000184968158	402313509	/nfs/dbraw/zinc/31/35/09/402313509.db2.gz	XSAIAJVSEBUHOY-HNNXBMFYSA-N	0	3	310.442	2.006	10	0		DEAEHN
OCC1(NCc2ccc(Br)c(F)c2)CCOCC1	ZINC000226199840	402326088	/nfs/dbraw/zinc/32/60/88/402326088.db2.gz	FVVYEYUYVPHCJZ-UHFFFAOYSA-N	0	3	318.186	2.219	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(-c2ccncc2)on1	ZINC000177037156	402362191	/nfs/dbraw/zinc/36/21/91/402362191.db2.gz	CMMNFVCMCVCKCS-AWEZNQCLSA-N	0	3	314.389	2.293	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@H]2Oc3ccccc3O[C@H]2C)C1	ZINC000177136625	402373672	/nfs/dbraw/zinc/37/36/72/402373672.db2.gz	XXSYIQKVISYEIP-FHIRATQRSA-N	0	3	318.417	2.060	10	0		DEAEHN
CCC[C@H](C(=O)N1CCN([C@@H](C)c2nccs2)CC1)N(C)C	ZINC000185760624	402374580	/nfs/dbraw/zinc/37/45/80/402374580.db2.gz	MCQOUTDYFFJQAW-UONOGXRCSA-N	0	3	324.494	2.079	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H]1CCCC[C@H]1O	ZINC000185771354	402375298	/nfs/dbraw/zinc/37/52/98/402375298.db2.gz	JLZFNXYOQOGQOB-USXIJHARSA-N	0	3	319.449	2.110	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)C(=O)Nc2ccc(Cl)cc2)C1	ZINC000177209091	402381396	/nfs/dbraw/zinc/38/13/96/402381396.db2.gz	GDUAUVJSTYDRGP-RISCZKNCSA-N	0	3	323.824	2.123	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2c(F)cccc2Br)C1	ZINC000226640055	402329730	/nfs/dbraw/zinc/32/97/30/402329730.db2.gz	RXEICLOAMXHOEI-VIFPVBQESA-N	0	3	315.186	2.364	10	0		DEAEHN
O[C@H](COc1ccccc1F)CN1CC[C@H]2OCCC[C@@H]2C1	ZINC000177985965	402449338	/nfs/dbraw/zinc/44/93/38/402449338.db2.gz	RVAZPVAWPLOHKK-IJEWVQPXSA-N	0	3	309.381	2.066	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)CCc2cccc3c2OCO3)CCN1C	ZINC000186041777	402397881	/nfs/dbraw/zinc/39/78/81/402397881.db2.gz	RNCQYEVDOUHACE-ZFWWWQNUSA-N	0	3	318.417	2.289	10	0		DEAEHN
CCc1nc(CCNC(=O)N(C)C[C@@H]2CCCN2CC)cs1	ZINC000177465551	402405480	/nfs/dbraw/zinc/40/54/80/402405480.db2.gz	HZBULWSXBXZLRY-AWEZNQCLSA-N	0	3	324.494	2.374	10	0		DEAEHN
C[C@H](NC(=O)[C@H](N)Cc1ccccc1)c1ccc2c(c1)OCO2	ZINC000237506057	402410776	/nfs/dbraw/zinc/41/07/76/402410776.db2.gz	IAYQATGLJLFUJW-SWLSCSKDSA-N	0	3	312.369	2.163	10	0		DEAEHN
CC(C)C[C@@H]1OCCC[C@H]1NC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000186225715	402412447	/nfs/dbraw/zinc/41/24/47/402412447.db2.gz	HTVDMMMZJAXPNA-BBWFWOEESA-N	0	3	321.465	2.236	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H](C)c1nc2ccccc2n1C)N(C)C	ZINC000162209101	402413273	/nfs/dbraw/zinc/41/32/73/402413273.db2.gz	JUNHWPTWAUKUFK-SWLSCSKDSA-N	0	3	302.422	2.481	10	0		DEAEHN
C[C@]1(CNC(=O)[C@@H]2CCCO2)CCCN1Cc1ccccc1	ZINC000162324740	402416694	/nfs/dbraw/zinc/41/66/94/402416694.db2.gz	IPHGQEOUUVGYJG-FUHWJXTLSA-N	0	3	302.418	2.336	10	0		DEAEHN
CCO[C@H]1C[C@@H](NCc2ccc(C(=O)OC)o2)C12CCOCC2	ZINC000186338636	402422508	/nfs/dbraw/zinc/42/25/08/402422508.db2.gz	JBIFKBXUNCTYBP-CABCVRRESA-N	0	3	323.389	2.130	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)Nc1ccc(C(C)=O)cc1	ZINC000177710076	402428777	/nfs/dbraw/zinc/42/87/77/402428777.db2.gz	TVGPMQMJKHVRKZ-KRWDZBQOSA-N	0	3	317.433	2.244	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN([C@@H]2CCCN(C(C)C)C2=O)C1	ZINC000177713290	402429343	/nfs/dbraw/zinc/42/93/43/402429343.db2.gz	NLBMRGDFIXLMAD-JKSUJKDBSA-N	0	3	318.465	2.482	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C(=O)NC1CC1)c1ccccc1	ZINC000177713998	402429494	/nfs/dbraw/zinc/42/94/94/402429494.db2.gz	SNTGAHDAZWJOFJ-MSOLQXFVSA-N	0	3	315.461	2.422	10	0		DEAEHN
CCS(=O)(=O)C[C@@H](C)N[C@@H](C)c1ccccc1-n1cccn1	ZINC000177332421	402392050	/nfs/dbraw/zinc/39/20/50/402392050.db2.gz	CNFDDSJXDLRMEA-KGLIPLIRSA-N	0	3	321.446	2.346	10	0		DEAEHN
CN(C)Cc1cc(CNC(=O)C2(N)CCCCC2)ccc1F	ZINC000237047499	402392840	/nfs/dbraw/zinc/39/28/40/402392840.db2.gz	YKNLYDOEOCDVEW-UHFFFAOYSA-N	0	3	307.413	2.165	10	0		DEAEHN
CNC(=O)[C@@H]1CCCN1C[C@@H](C)Cc1ccc(OC)c(F)c1	ZINC000186704741	402457561	/nfs/dbraw/zinc/45/75/61/402457561.db2.gz	GLBZHJCXDWGPKN-WFASDCNBSA-N	0	3	308.397	2.223	10	0		DEAEHN
Cc1ccc(CN2CCC(N3CCO[C@H](C)C3)CC2)c(C)n1	ZINC000186727198	402460258	/nfs/dbraw/zinc/46/02/58/402460258.db2.gz	MEOYNEWXKJOCJD-OAHLLOKOSA-N	0	3	303.450	2.384	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NC(=O)N(C)C[C@H]2CCCN2CC)C12CCC2	ZINC000245464745	402463155	/nfs/dbraw/zinc/46/31/55/402463155.db2.gz	ICWCKAWQAAMEQD-BZUAXINKSA-N	0	3	323.481	2.460	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N(C)C[C@@H]2CCCN2CC)C12CCC2	ZINC000245464747	402463234	/nfs/dbraw/zinc/46/32/34/402463234.db2.gz	ICWCKAWQAAMEQD-HRCADAONSA-N	0	3	323.481	2.460	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@H](COC)c1ccc(C)o1	ZINC000245479777	402464652	/nfs/dbraw/zinc/46/46/52/402464652.db2.gz	WRDMLURIMFZYBV-LSDHHAIUSA-N	0	3	323.437	2.401	10	0		DEAEHN
COc1ccc([O-])c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C(C)C)c1	ZINC000245484732	402465280	/nfs/dbraw/zinc/46/52/80/402465280.db2.gz	HZRSXKUZHFPEIM-KGLIPLIRSA-N	0	3	318.417	2.488	10	0		DEAEHN
COc1ccc([O-])c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1	ZINC000245484732	402465281	/nfs/dbraw/zinc/46/52/81/402465281.db2.gz	HZRSXKUZHFPEIM-KGLIPLIRSA-N	0	3	318.417	2.488	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)N(C)CCc2nccs2)C1	ZINC000245502673	402466610	/nfs/dbraw/zinc/46/66/10/402466610.db2.gz	CBNXIDIDQPWHPC-QWHCGFSZSA-N	0	3	310.467	2.056	10	0		DEAEHN
O=C1[C@H](N2CCN3CCC[C@H]3C2)CCN1c1ccc(Cl)cc1	ZINC000246141922	402512449	/nfs/dbraw/zinc/51/24/49/402512449.db2.gz	DGXSIQRGOXQRIR-JKSUJKDBSA-N	0	3	319.836	2.225	10	0		DEAEHN
Cc1ccc(CN2CCCN(Cc3cnn(C)c3)CC2)c(C)n1	ZINC000186982238	402476071	/nfs/dbraw/zinc/47/60/71/402476071.db2.gz	AOAUKWVJTLMSPA-UHFFFAOYSA-N	0	3	313.449	2.140	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N(C(C)C)C(C)C	ZINC000178307525	402482465	/nfs/dbraw/zinc/48/24/65/402482465.db2.gz	AQEFLDZTFSEZHM-INIZCTEOSA-N	0	3	306.454	2.301	10	0		DEAEHN
CC(C)Cc1nnc(NC(=O)N2C[C@@H]3CCCN3C[C@@H]2C)s1	ZINC000245731559	402483794	/nfs/dbraw/zinc/48/37/94/402483794.db2.gz	FFKRTAHUSXWYKN-RYUDHWBXSA-N	0	3	323.466	2.437	10	0		DEAEHN
CNC(=O)c1cccc(CN2CCC[C@H]2Cn2ccnc2C)c1	ZINC000178336151	402486458	/nfs/dbraw/zinc/48/64/58/402486458.db2.gz	NKMXUPLOTWSIBY-KRWDZBQOSA-N	0	3	312.417	2.216	10	0		DEAEHN
CN1CC[C@@H](NC(=O)Cc2ccccc2O)[C@H]1c1ccccc1	ZINC000245847325	402491378	/nfs/dbraw/zinc/49/13/78/402491378.db2.gz	IRLIQGDVYKHYPY-VQIMIIECSA-N	0	3	310.397	2.496	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCCCc2ccccn2)CCN1C	ZINC000178417624	402496508	/nfs/dbraw/zinc/49/65/08/402496508.db2.gz	VGIBJRXYOPJDQU-GOEBONIOSA-N	0	3	304.438	2.138	10	0		DEAEHN
C[C@@H]1CN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)[C@@H](C)CO1	ZINC000246048238	402505339	/nfs/dbraw/zinc/50/53/39/402505339.db2.gz	XUCRRNSRTIHMJS-ABFRBSLYSA-N	0	3	317.433	2.251	10	0		DEAEHN
O=C(NC[C@H](O)CN1CCCCC1)c1cccc(C(F)F)c1	ZINC000178515257	402506063	/nfs/dbraw/zinc/50/60/63/402506063.db2.gz	NPLGRBPOBFJGPL-AWEZNQCLSA-N	0	3	312.360	2.201	10	0		DEAEHN
NC(=O)c1coc(CN[C@@H]2CCCN(Cc3ccccc3)C2)c1	ZINC000187718412	402509534	/nfs/dbraw/zinc/50/95/34/402509534.db2.gz	GWMAENULZOYCOS-MRXNPFEDSA-N	0	3	313.401	2.133	10	0		DEAEHN
COc1c(C)cnc(CN2CCC[C@@H](C3OCCO3)C2)c1C	ZINC000170930077	402542418	/nfs/dbraw/zinc/54/24/18/402542418.db2.gz	ZARQBYYPPMFYSJ-CQSZACIVSA-N	0	3	306.406	2.292	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2ccc3c(c2)OC(C)(C)O3)C1	ZINC000171082002	402555752	/nfs/dbraw/zinc/55/57/52/402555752.db2.gz	LLJFPENKRMPYPW-LBPRGKRZSA-N	0	3	305.378	2.362	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)N[C@H]2CCOc3ccccc32)C1	ZINC000247079301	402556177	/nfs/dbraw/zinc/55/61/77/402556177.db2.gz	IBZHAVNRLXILJU-ZFWWWQNUSA-N	0	3	303.406	2.151	10	0		DEAEHN
CSc1ccc(OCCN2CCN(C[C@H](C)O)[C@@H](C)C2)cc1	ZINC000247236489	402560990	/nfs/dbraw/zinc/56/09/90/402560990.db2.gz	DIZMGQGRQCCEMY-GJZGRUSLSA-N	0	3	324.490	2.174	10	0		DEAEHN
COc1cccc(OC)c1C(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000247324977	402563681	/nfs/dbraw/zinc/56/36/81/402563681.db2.gz	OXGYDRANCFTGSF-OLZOCXBDSA-N	0	3	304.390	2.013	10	0		DEAEHN
COc1ccc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c(OC)c1	ZINC000247458658	402567592	/nfs/dbraw/zinc/56/75/92/402567592.db2.gz	QPWWEFGHPZOSPZ-OLZOCXBDSA-N	0	3	304.390	2.013	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)[C@H]1CCC[C@@H](C)C1	ZINC000247480879	402568631	/nfs/dbraw/zinc/56/86/31/402568631.db2.gz	JKSRDJIFHCOFRR-OWCLPIDISA-N	0	3	311.470	2.317	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@@H]2Oc3ccccc3O[C@H]2C)C1	ZINC000247505771	402570277	/nfs/dbraw/zinc/57/02/77/402570277.db2.gz	XXSYIQKVISYEIP-XJIUQZFPSA-N	0	3	318.417	2.060	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCc2cccnc2)[C@@H]1c1ccccc1	ZINC000179072299	402570489	/nfs/dbraw/zinc/57/04/89/402570489.db2.gz	PNGDXVXJMDTSOP-IRXDYDNUSA-N	0	3	310.401	2.326	10	0		DEAEHN
CCOc1ccc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1OC	ZINC000247521608	402570876	/nfs/dbraw/zinc/57/08/76/402570876.db2.gz	WTOQTMDRQQRDIB-HIFRSBDPSA-N	0	3	318.417	2.403	10	0		DEAEHN
Cc1ccc(C)c(OC[C@@H](O)CN(C)CC2(CO)CC2)c1C	ZINC000190026325	402571031	/nfs/dbraw/zinc/57/10/31/402571031.db2.gz	WSFRCQCFQZLQIK-INIZCTEOSA-N	0	3	307.434	2.056	10	0		DEAEHN
Cc1ccccc1-n1cc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)cn1	ZINC000247527540	402571056	/nfs/dbraw/zinc/57/10/56/402571056.db2.gz	XEZOJLXPZONCST-NVXWUHKLSA-N	0	3	324.428	2.489	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)C[C@H]2c3ccccc3NC2=O)CCN1C	ZINC000247536997	402571693	/nfs/dbraw/zinc/57/16/93/402571693.db2.gz	XTDORGBBFRFBGZ-IPYPFGDCSA-N	0	3	315.417	2.054	10	0		DEAEHN
C[C@H](NC(=O)CN(C)[C@]1(CO)CC[C@@H](C)C1)c1cccs1	ZINC000187992786	402514731	/nfs/dbraw/zinc/51/47/31/402514731.db2.gz	XKCMVZJFLXMTRZ-DVOMOZLQSA-N	0	3	310.463	2.408	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@H]1CCCc2occc21	ZINC000247647719	402573394	/nfs/dbraw/zinc/57/33/94/402573394.db2.gz	VSNRFQAHQRPFPZ-HIFRSBDPSA-N	0	3	321.421	2.067	10	0		DEAEHN
C[C@@H](C(=O)N[C@H]1CCC[C@@H](C)[C@@H]1C)N1CCN2CCC[C@@H]2C1	ZINC000246304093	402524401	/nfs/dbraw/zinc/52/44/01/402524401.db2.gz	JHNPJXZDOVEZBP-HMDCTGQHSA-N	0	3	307.482	2.096	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@H](C)NCCCS(C)(=O)=O	ZINC000178682442	402525867	/nfs/dbraw/zinc/52/58/67/402525867.db2.gz	LEWQGMUWMMHQPC-NSHDSACASA-N	0	3	301.456	2.032	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N[C@H]2Cc3ccccc3[C@@H]2O)cc1	ZINC000178705927	402528669	/nfs/dbraw/zinc/52/86/69/402528669.db2.gz	PDBCEIFQXNKGJZ-ROUUACIJSA-N	0	3	310.397	2.136	10	0		DEAEHN
Cc1ccc(C[C@@H](CO)NCc2cnc3nc(C)cc(C)n23)cc1	ZINC000188974445	402528986	/nfs/dbraw/zinc/52/89/86/402528986.db2.gz	OPXQDXDJYZUDMU-KRWDZBQOSA-N	0	3	324.428	2.348	10	0		DEAEHN
O=C(c1ccccc1OCC1CC1)N1CCN2CCC[C@H]2C1	ZINC000171279114	402573855	/nfs/dbraw/zinc/57/38/55/402573855.db2.gz	YRBJKEYNHWFOSY-HNNXBMFYSA-N	0	3	300.402	2.396	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCCCCOCc2ccccc2)C1	ZINC000170835508	402531257	/nfs/dbraw/zinc/53/12/57/402531257.db2.gz	VZWNTZCRBGJRSN-QGZVFWFLSA-N	0	3	319.449	2.329	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000170857420	402533506	/nfs/dbraw/zinc/53/35/06/402533506.db2.gz	CTEIOAKOZCYGLF-CYBMUJFWSA-N	0	3	300.324	2.410	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)COc2ccc(F)c(Cl)c2)C1	ZINC000170867608	402535775	/nfs/dbraw/zinc/53/57/75/402535775.db2.gz	IDEQVEHIKDSIQR-SNVBAGLBSA-N	0	3	300.761	2.020	10	0		DEAEHN
C[C@H]1CN(C(=O)NCCN(C)Cc2ccccc2)CCS1	ZINC000170878194	402536765	/nfs/dbraw/zinc/53/67/65/402536765.db2.gz	NPHGCIPFCAVJQI-AWEZNQCLSA-N	0	3	307.463	2.265	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000246585411	402537892	/nfs/dbraw/zinc/53/78/92/402537892.db2.gz	YMKZLNWPQTYKJB-GDBMZVCRSA-N	0	3	317.433	2.087	10	0		DEAEHN
CC(C)c1nnc(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)n1C	ZINC000179179804	402578286	/nfs/dbraw/zinc/57/82/86/402578286.db2.gz	FZAJQYZKQOJHEN-ZBFHGGJFSA-N	0	3	317.481	2.387	10	0		DEAEHN
CCN(CC)C(=O)[C@@H]1CCCN1CCC(=O)Nc1ccccc1	ZINC000171344027	402579292	/nfs/dbraw/zinc/57/92/92/402579292.db2.gz	HTTNMDNIJBQDEA-INIZCTEOSA-N	0	3	317.433	2.348	10	0		DEAEHN
CNC(=O)c1cccc(CN2CC[C@@]3(O)CCCC[C@H]3C2)c1	ZINC000248152710	402584276	/nfs/dbraw/zinc/58/42/76/402584276.db2.gz	QXSRRRXYELMDFT-WMZOPIPTSA-N	0	3	302.418	2.173	10	0		DEAEHN
C[C@@H](NC(=O)N1CCN2CCC[C@@H]2C1)c1nc2ccccc2[nH]1	ZINC000171538124	402592256	/nfs/dbraw/zinc/59/22/56/402592256.db2.gz	NUHJSSIDTDMWHH-CHWSQXEVSA-N	0	3	313.405	2.114	10	0		DEAEHN
CCOCCN1CCN(Cc2ccc3c[nH]nc3c2)C[C@H]1CC	ZINC000179513239	402592691	/nfs/dbraw/zinc/59/26/91/402592691.db2.gz	ARQWTYNMQDNXJW-QGZVFWFLSA-N	0	3	316.449	2.496	10	0		DEAEHN
CCOCCN1CCN(C[C@@H](O)CCc2ccccc2)C[C@@H]1C	ZINC000248564105	402596095	/nfs/dbraw/zinc/59/60/95/402596095.db2.gz	KFYKMZBYYAGOED-HKUYNNGSSA-N	0	3	320.477	2.023	10	0		DEAEHN
CCC1(CC)CCCN(CC(=O)N2CCC[C@@H](C(N)=O)C2)CC1	ZINC000190409984	402598547	/nfs/dbraw/zinc/59/85/47/402598547.db2.gz	YRTIMBGDWBQWLA-OAHLLOKOSA-N	0	3	323.481	2.003	10	0		DEAEHN
Cc1ccc(F)cc1NC(=O)[C@H](C)N1CCN2CCC[C@@H]2C1	ZINC000171640725	402604990	/nfs/dbraw/zinc/60/49/90/402604990.db2.gz	FGNWZSDOQKKGPE-DZGCQCFKSA-N	0	3	305.397	2.241	10	0		DEAEHN
CCN(CC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)C1CC1	ZINC000180169044	402608745	/nfs/dbraw/zinc/60/87/45/402608745.db2.gz	XQQYFKKXCTWFTE-SJLPKXTDSA-N	0	3	301.434	2.032	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)[C@H]2CCOC[C@H]2C)CN1Cc1ccccc1	ZINC000248833249	402610020	/nfs/dbraw/zinc/61/00/20/402610020.db2.gz	MXPDGWRZQNSISH-AHCXZYCDSA-N	0	3	316.445	2.438	10	0		DEAEHN
COc1cc(F)cc(CNC(=O)N2CCCN(C3CC3)CC2)c1	ZINC000180548599	402619755	/nfs/dbraw/zinc/61/97/55/402619755.db2.gz	WGPCYNOXOVTWEU-UHFFFAOYSA-N	0	3	321.396	2.214	10	0		DEAEHN
CCCCN(C)C(=O)C1CCN(C(=O)[C@]2(C)CCCCN2)CC1	ZINC000180930351	402630549	/nfs/dbraw/zinc/63/05/49/402630549.db2.gz	MLOAHPIJFYCTDY-SFHVURJKSA-N	0	3	323.481	2.016	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)NCCN1CCC[C@H](C)C1	ZINC000249416254	402629076	/nfs/dbraw/zinc/62/90/76/402629076.db2.gz	ZJQVJRITQTYVLF-UONOGXRCSA-N	0	3	320.437	2.182	10	0		DEAEHN
O[C@@H](COC[C@H]1CCCO1)CN1Cc2ccccc2C2(CC2)C1	ZINC000249429505	402629081	/nfs/dbraw/zinc/62/90/81/402629081.db2.gz	JNKSPNSIJUXNAE-IAGOWNOFSA-N	0	3	317.429	2.090	10	0		DEAEHN
C[C@@H](NC(=O)N1CCCN(C2CC2)CC1)c1cccc(O)c1	ZINC000171945734	402634975	/nfs/dbraw/zinc/63/49/75/402634975.db2.gz	QUBRBEOHVSWOQL-CYBMUJFWSA-N	0	3	303.406	2.333	10	0		DEAEHN
COC(=O)[C@@H](C)CN(C)C[C@@H](O)COc1ccccc1C(C)C	ZINC000249711174	402639176	/nfs/dbraw/zinc/63/91/76/402639176.db2.gz	DWKFBRUARHGLHU-LSDHHAIUSA-N	0	3	323.433	2.291	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(Br)nc1	ZINC000252589795	402658828	/nfs/dbraw/zinc/65/88/28/402658828.db2.gz	CELSSEOHXBFGIR-PWSUYJOCSA-N	0	3	324.222	2.153	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COc2ccc(C)cc2C)CC[C@H]1C	ZINC000251545703	402648290	/nfs/dbraw/zinc/64/82/90/402648290.db2.gz	DVPLOTXCHIHEEF-UWWQBHOKSA-N	0	3	307.434	2.400	10	0		DEAEHN
C[C@H](C(=O)NCc1ccc(F)cc1)N1CCCN(C2CC2)CC1	ZINC000172347018	402651467	/nfs/dbraw/zinc/65/14/67/402651467.db2.gz	ZJLQNPLFFTYKST-CQSZACIVSA-N	0	3	319.424	2.001	10	0		DEAEHN
CCOC(=O)CCN[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1	ZINC000192151533	402714636	/nfs/dbraw/zinc/71/46/36/402714636.db2.gz	CUTGXFFVUSLXQT-XJKSGUPXSA-N	0	3	324.808	2.155	10	0		DEAEHN
C[C@@H](C(=O)Nc1c(F)cccc1F)N1CCCN(C2CC2)CC1	ZINC000172541145	402661733	/nfs/dbraw/zinc/66/17/33/402661733.db2.gz	VKYZZLTYJDFVOE-LBPRGKRZSA-N	0	3	323.387	2.462	10	0		DEAEHN
Cc1cnc([C@@H](NC(=O)N2CC[C@H](N(C)C)C2)C2CC2)s1	ZINC000173914766	402718856	/nfs/dbraw/zinc/71/88/56/402718856.db2.gz	ALZIXDDOGDHXJD-STQMWFEESA-N	0	3	308.451	2.248	10	0		DEAEHN
Cc1cnc([C@@H](NC(=O)N2CC[C@@H](N(C)C)C2)C2CC2)s1	ZINC000173914792	402718942	/nfs/dbraw/zinc/71/89/42/402718942.db2.gz	ALZIXDDOGDHXJD-OLZOCXBDSA-N	0	3	308.451	2.248	10	0		DEAEHN
Cc1ccc(C[C@H](C)NC(=O)N2CCN3CCC[C@@H]3C2)s1	ZINC000172611159	402666279	/nfs/dbraw/zinc/66/62/79/402666279.db2.gz	RLHXTRJEVSPBGO-GXTWGEPZSA-N	0	3	307.463	2.477	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ccc(F)cn1	ZINC000182304890	402679534	/nfs/dbraw/zinc/67/95/34/402679534.db2.gz	USFSVSZEAHMYHM-OAHLLOKOSA-N	0	3	301.365	2.123	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)c2cnc(-c3ccncc3)s2)C1	ZINC000172913009	402679930	/nfs/dbraw/zinc/67/99/30/402679930.db2.gz	VTVIDAIGXSUUTP-LBPRGKRZSA-N	0	3	316.430	2.277	10	0		DEAEHN
CCOc1cc(/C=C/C(=O)N[C@@H]2CCCN(CC)C2)ccc1O	ZINC000182388907	402685541	/nfs/dbraw/zinc/68/55/41/402685541.db2.gz	BFDOBEIPTUMTPA-TUPIDYKKSA-N	0	3	318.417	2.405	10	0		DEAEHN
CCC1CCC(NC(=O)N(C)CCCN2CCN(C)CC2)CC1	ZINC000182417663	402688146	/nfs/dbraw/zinc/68/81/46/402688146.db2.gz	DUPNXAIFFWRJBZ-UHFFFAOYSA-N	0	3	324.513	2.234	10	0		DEAEHN
Cc1cccc(OCCNC(=O)N2CC[C@H](N3CC=CC3)C2)c1	ZINC000173228188	402689068	/nfs/dbraw/zinc/68/90/68/402689068.db2.gz	CJTHQKGAYHXQAZ-INIZCTEOSA-N	0	3	315.417	2.030	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)C[C@](C)(O)c2ccccc2)CCN1C	ZINC000182498590	402695123	/nfs/dbraw/zinc/69/51/23/402695123.db2.gz	FYOHIBWCZUKXDM-HFTRVMKXSA-N	0	3	304.434	2.225	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2	ZINC000262410986	402725542	/nfs/dbraw/zinc/72/55/42/402725542.db2.gz	DDJPUYDQRPELFK-HNNXBMFYSA-N	0	3	301.390	2.288	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@H](C)N[C@@H](C)[C@@H]2CCCO2)c1	ZINC000183094009	402738376	/nfs/dbraw/zinc/73/83/76/402738376.db2.gz	GDOQQRRRTYCPKU-MKBNYLNASA-N	0	3	304.390	2.373	10	0		DEAEHN
CC(C)Cn1cc(CN2CCC(N3CCO[C@@H](C)C3)CC2)cn1	ZINC000183133958	402742029	/nfs/dbraw/zinc/74/20/29/402742029.db2.gz	WBFVNOMKYBMYQP-INIZCTEOSA-N	0	3	320.481	2.224	10	0		DEAEHN
Cn1c2ccc(CN[C@H](CO)CC(C)(C)C)cc2sc1=O	ZINC000192646451	402742379	/nfs/dbraw/zinc/74/23/79/402742379.db2.gz	YWVSVBMROCEXEX-LBPRGKRZSA-N	0	3	308.447	2.487	10	0		DEAEHN
Cn1cc(N2CCC[C@@H](NCC3=Cc4ccccc4OC3)C2)cn1	ZINC000174519478	402745276	/nfs/dbraw/zinc/74/52/76/402745276.db2.gz	YRRRHGXJTOJNFV-QGZVFWFLSA-N	0	3	324.428	2.455	10	0		DEAEHN
C/C(=C/c1nc([C@@H]2CNCCN2C)no1)c1ccc(F)cc1	ZINC000263238936	402749165	/nfs/dbraw/zinc/74/91/65/402749165.db2.gz	OJENKUTWTXOHOD-FPAJZGIOSA-N	0	3	302.353	2.345	10	0		DEAEHN
CS[C@H](c1nc([C@@H]2CNCCN2C)no1)c1ccccc1	ZINC000263275996	402753073	/nfs/dbraw/zinc/75/30/73/402753073.db2.gz	SWFIFPHKCLURES-STQMWFEESA-N	0	3	304.419	2.098	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(Cc3cccc(F)c3)C2)CC1	ZINC000174880037	402760878	/nfs/dbraw/zinc/76/08/78/402760878.db2.gz	YJGNDYZONDNYPL-GOSISDBHSA-N	0	3	305.441	2.428	10	0		DEAEHN
CCN1CCN(C[C@H](C)CNC(=O)N[C@H](C)C2CCCC2)CC1	ZINC000174920284	402763018	/nfs/dbraw/zinc/76/30/18/402763018.db2.gz	UKZHCWZZGOTSNF-HZPDHXFCSA-N	0	3	324.513	2.138	10	0		DEAEHN
C[C@@H](NCCO[C@H]1CCCCO1)c1ccc(-n2cncn2)cc1	ZINC000193083843	402764314	/nfs/dbraw/zinc/76/43/14/402764314.db2.gz	WWEUASYUGWJOBP-PBHICJAKSA-N	0	3	316.405	2.461	10	0		DEAEHN
COC(=O)c1coc(C(=O)NCC(C)(C)N2CCC[C@H](C)C2)c1	ZINC000183445037	402767952	/nfs/dbraw/zinc/76/79/52/402767952.db2.gz	UHSSWWKWRCNKMR-LBPRGKRZSA-N	0	3	322.405	2.307	10	0		DEAEHN
C[C@@H](CN1CCC[C@H](C)C1)NC(=O)NCCOCC1CCC1	ZINC000566536168	292249681	/nfs/dbraw/zinc/24/96/81/292249681.db2.gz	NKGFJAHXKMLDAK-GJZGRUSLSA-N	0	3	311.470	2.223	10	0		DEAEHN
O=C(CCCOc1cccc(F)c1)N1CCN2CCC[C@H]2C1	ZINC000195336652	402841992	/nfs/dbraw/zinc/84/19/92/402841992.db2.gz	ABTKKSZMISXPMR-HNNXBMFYSA-N	0	3	306.381	2.291	10	0		DEAEHN
C[C@H]1COCC[C@H]1C(=O)N(CCN(C)C)Cc1ccccc1F	ZINC000194353580	402793755	/nfs/dbraw/zinc/79/37/55/402793755.db2.gz	MWBKSMVEJMAIKJ-GOEBONIOSA-N	0	3	322.424	2.389	10	0		DEAEHN
CC[C@@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccncc1	ZINC000175311151	402796634	/nfs/dbraw/zinc/79/66/34/402796634.db2.gz	HAAXUJRIGGDVKW-HZPDHXFCSA-N	0	3	300.406	2.188	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)Nc1cccc(OC)c1	ZINC000175348156	402798918	/nfs/dbraw/zinc/79/89/18/402798918.db2.gz	SMQMMKKHSQOTBH-OAHLLOKOSA-N	0	3	305.422	2.050	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)NCCc1ccccc1C	ZINC000175350409	402799035	/nfs/dbraw/zinc/79/90/35/402799035.db2.gz	XKZQFUWTYCBUCC-GOSISDBHSA-N	0	3	317.477	2.070	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)N(C)Cc1ccc(F)cc1	ZINC000175361769	402800078	/nfs/dbraw/zinc/80/00/78/402800078.db2.gz	ADLPBXBKAPNQCU-KRWDZBQOSA-N	0	3	321.440	2.200	10	0		DEAEHN
CC1=NN(c2ccc(C(=O)N3CCN4CCC[C@@H]4C3)cc2)CC1	ZINC000195332212	402842494	/nfs/dbraw/zinc/84/24/94/402842494.db2.gz	GWNUSRHWNBSKNK-QGZVFWFLSA-N	0	3	312.417	2.193	10	0		DEAEHN
Cc1c(C(=O)N2CCN3CCC[C@@H]3C2)cnn1Cc1ccccc1	ZINC000195332513	402842590	/nfs/dbraw/zinc/84/25/90/402842590.db2.gz	AUQYZOSJZQTCGS-QGZVFWFLSA-N	0	3	324.428	2.160	10	0		DEAEHN
COc1cccc2cc([C@H](C)NC[C@H]3CN(C)CCO3)oc21	ZINC000175424518	402805848	/nfs/dbraw/zinc/80/58/48/402805848.db2.gz	BXRBPTORODVYKP-JSGCOSHPSA-N	0	3	304.390	2.423	10	0		DEAEHN
CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1cccc(OC)c1[O-]	ZINC000175436404	402806680	/nfs/dbraw/zinc/80/66/80/402806680.db2.gz	PZFHDFORRJFSSI-CHWSQXEVSA-N	0	3	304.390	2.100	10	0		DEAEHN
CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cccc(OC)c1[O-]	ZINC000175436404	402806688	/nfs/dbraw/zinc/80/66/88/402806688.db2.gz	PZFHDFORRJFSSI-CHWSQXEVSA-N	0	3	304.390	2.100	10	0		DEAEHN
CN1CCC(NC(=O)N(C[C@H]2CCCO2)C2CCCC2)CC1	ZINC000175556402	402817310	/nfs/dbraw/zinc/81/73/10/402817310.db2.gz	NYAWKGYAJRWGPR-MRXNPFEDSA-N	0	3	309.454	2.214	10	0		DEAEHN
CCCCN1CCOC[C@H]1C(=O)Nc1cccc(CN(C)C)c1	ZINC000184251743	402830874	/nfs/dbraw/zinc/83/08/74/402830874.db2.gz	PBGAHFBFPXEMCY-KRWDZBQOSA-N	0	3	319.449	2.188	10	0		DEAEHN
CCOC(=O)N[C@@H]1CCCN(C[C@](C)(O)c2ccccc2)C1	ZINC000195234787	402838461	/nfs/dbraw/zinc/83/84/61/402838461.db2.gz	CQAINOUJVZXEQV-WBVHZDCISA-N	0	3	306.406	2.105	10	0		DEAEHN
Cc1ccc(C(=O)CCC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000195313677	402841340	/nfs/dbraw/zinc/84/13/40/402841340.db2.gz	FIBHEWNQMYZGSO-INIZCTEOSA-N	0	3	300.402	2.265	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N[C@H]1COc2ccccc2C1	ZINC000194191743	402787339	/nfs/dbraw/zinc/78/73/39/402787339.db2.gz	FDIYVHRYIHPQJP-JKSUJKDBSA-N	0	3	319.449	2.266	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN([C@@H](C)C(=O)N(C)C(C)C)C1	ZINC000175202814	402787788	/nfs/dbraw/zinc/78/77/88/402787788.db2.gz	YFIZHTVPGOXAKW-LSDHHAIUSA-N	0	3	306.454	2.338	10	0		DEAEHN
Cc1ccc(C(=O)CCC(=O)N2CCN3CCC[C@@H]3C2)s1	ZINC000195317797	402841811	/nfs/dbraw/zinc/84/18/11/402841811.db2.gz	OUZGEABMHORCGX-CYBMUJFWSA-N	0	3	306.431	2.326	10	0		DEAEHN
Cc1csc(=O)n1CCN1CC[C@H](CNc2ccccn2)C1	ZINC000195515791	402848968	/nfs/dbraw/zinc/84/89/68/402848968.db2.gz	JPLULOCTDSJHJT-CQSZACIVSA-N	0	3	318.446	2.047	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN([C@@H](C)C(=O)NCC(C)C)C2)n1	ZINC000195516198	402849558	/nfs/dbraw/zinc/84/95/58/402849558.db2.gz	QPNNKEXYTSZWRO-JKSUJKDBSA-N	0	3	318.465	2.285	10	0		DEAEHN
CCN(CC)C(=O)[C@@H](C)N1CC[C@H](CNc2cccc(C)n2)C1	ZINC000195516263	402849923	/nfs/dbraw/zinc/84/99/23/402849923.db2.gz	HXCOHXJBWUNSLI-HZPDHXFCSA-N	0	3	318.465	2.381	10	0		DEAEHN
Cc1nc(C[C@@H]2CCCN(CCC(=O)NC3CCCC3)C2)no1	ZINC000195518320	402850433	/nfs/dbraw/zinc/85/04/33/402850433.db2.gz	WXGQGSIFDCGGCH-AWEZNQCLSA-N	0	3	320.437	2.081	10	0		DEAEHN
O=S1(=O)CCC(CN(Cc2cccc(O)c2)CC2CC2)CC1	ZINC000271318747	402857346	/nfs/dbraw/zinc/85/73/46/402857346.db2.gz	STZLKQZSTTWUFN-UHFFFAOYSA-N	0	3	323.458	2.429	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2cc(OC)cc(C)n2)C12CCOCC2	ZINC000274400821	403051713	/nfs/dbraw/zinc/05/17/13/403051713.db2.gz	FPSDKJARBAGNJF-IAGOWNOFSA-N	0	3	320.433	2.462	10	0		DEAEHN
Cc1cc(CO)oc1C(=O)N1CCN(C2CCC2)C[C@H](C)C1	ZINC000293646088	403528050	/nfs/dbraw/zinc/52/80/50/403528050.db2.gz	HVVCWGWDQAIUHN-LBPRGKRZSA-N	0	3	306.406	2.027	10	0		DEAEHN
Cc1cc(NC[C@H]2CN3CCN2CC3)c2cc(F)ccc2n1	ZINC000301762527	403675395	/nfs/dbraw/zinc/67/53/95/403675395.db2.gz	GOKZEUXMCRONKX-AWEZNQCLSA-N	0	3	300.381	2.094	10	0		DEAEHN
CC(=O)[C@@H](C)CCCCC(=O)Nc1ccnn1CCN(C)C	ZINC000294227416	403678013	/nfs/dbraw/zinc/67/80/13/403678013.db2.gz	WPLZGFOFGWQGGO-ZDUSSCGKSA-N	0	3	308.426	2.169	10	0		DEAEHN
Cc1cc(Cl)cnc1NC(=O)NC[C@H]1NC(C)(C)O[C@H]1C	ZINC000333280124	403714754	/nfs/dbraw/zinc/71/47/54/403714754.db2.gz	HMCCRXWVIDVTES-GXSJLCMTSA-N	0	3	312.801	2.278	10	0		DEAEHN
NC(=O)C1CCC(NCc2cnn(Cc3ccccc3)c2)CC1	ZINC000302872352	403738080	/nfs/dbraw/zinc/73/80/80/403738080.db2.gz	OXRVYFQWDAVNPM-UHFFFAOYSA-N	0	3	312.417	2.065	10	0		DEAEHN
C[C@@H]1CC[C@H](NC(=O)N2CCOC3(CNC3)C2)c2ccccc21	ZINC000333454505	403754804	/nfs/dbraw/zinc/75/48/04/403754804.db2.gz	YAWPGRLLVHBUCB-CJNGLKHVSA-N	0	3	315.417	2.009	10	0		DEAEHN
C[C@H](O)CN(CCO)CCOc1c(Cl)cccc1Cl	ZINC000311464562	403970047	/nfs/dbraw/zinc/97/00/47/403970047.db2.gz	WRWFDZQIKYUCMD-JTQLQIEISA-N	0	3	308.205	2.047	10	0		DEAEHN
Cc1ccnc([C@@H](NC(=O)CC2CCN(C)CC2)C2CC2)n1	ZINC000362994818	404037591	/nfs/dbraw/zinc/03/75/91/404037591.db2.gz	ZUOBNTWNVILJNI-INIZCTEOSA-N	0	3	302.422	2.084	10	0		DEAEHN
Cn1nccc1[C@@H]1CCCCN1C(=O)C1CCN(C2CC2)CC1	ZINC000370687669	404403037	/nfs/dbraw/zinc/40/30/37/404403037.db2.gz	DHGFLUSRAWGAJA-KRWDZBQOSA-N	0	3	316.449	2.348	10	0		DEAEHN
Cc1nn(C)c2cc(NC(=O)N3CCN4CCC[C@H]4C3)ccc12	ZINC000291891424	404568956	/nfs/dbraw/zinc/56/89/56/404568956.db2.gz	WJUIVGPUPDHOPO-AWEZNQCLSA-N	0	3	313.405	2.194	10	0		DEAEHN
O=c1[nH]c2ccccc2cc1CN1CCC[C@@H]1Cn1cncn1	ZINC000375788128	404746307	/nfs/dbraw/zinc/74/63/07/404746307.db2.gz	HSFJOBRJXSMMKL-OAHLLOKOSA-N	0	3	309.373	2.197	10	0		DEAEHN
COC(=O)[C@H](NC[C@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000358851774	404777913	/nfs/dbraw/zinc/77/79/13/404777913.db2.gz	MWXJABMLUAPWTL-IAGOWNOFSA-N	0	3	302.418	2.192	10	0		DEAEHN
CN(C)CCOc1ccc(CNC(=O)N2CCC23CCC3)cc1	ZINC000435579613	404991574	/nfs/dbraw/zinc/99/15/74/404991574.db2.gz	MAPXUFDZIRAMDW-UHFFFAOYSA-N	0	3	317.433	2.465	10	0		DEAEHN
CC(C)N1CC[C@@H](NC2CC(OCc3ccccc3)C2)C1=O	ZINC000361545973	405125337	/nfs/dbraw/zinc/12/53/37/405125337.db2.gz	PVVIOROOPMLDFY-OFLPRAFFSA-N	0	3	302.418	2.333	10	0		DEAEHN
CC[C@@H](C(=O)N1CCCC[C@@H]1c1nnc2n1CCCC2)N(C)C	ZINC000408472463	405216038	/nfs/dbraw/zinc/21/60/38/405216038.db2.gz	VJCXIVHJJCIYNO-UONOGXRCSA-N	0	3	319.453	2.008	10	0		DEAEHN
Cc1nc(CN[C@H]2CN(C)C[C@H]2C)sc1Br	ZINC000449404363	405548729	/nfs/dbraw/zinc/54/87/29/405548729.db2.gz	ZHSOQNLHTXUTJU-APPZFPTMSA-N	0	3	304.257	2.254	10	0		DEAEHN
CN(C)[C@]1(CNC(=O)N[C@H]2CCCC(F)(F)C2)CCSC1	ZINC000494422286	405694742	/nfs/dbraw/zinc/69/47/42/405694742.db2.gz	BQTVPKOIVMMWOB-AAEUAGOBSA-N	0	3	321.437	2.301	10	0		DEAEHN
C(c1nc(C2CCOCC2)no1)C1CCN([C@H]2CCOC2)CC1	ZINC000528713544	405719499	/nfs/dbraw/zinc/71/94/99/405719499.db2.gz	CAGHXJFFBGWASS-HNNXBMFYSA-N	0	3	321.421	2.007	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@H](CO)Cc1ccc(C)c(C)c1	ZINC000457320458	405798789	/nfs/dbraw/zinc/79/87/89/405798789.db2.gz	MPUJBFODWACWRX-ZWKOTPCHSA-N	0	3	318.461	2.197	10	0		DEAEHN
c1ccc(N2CC[C@H](CN3CCO[C@]4(CCOC4)C3)C2)cc1	ZINC000639052054	405847246	/nfs/dbraw/zinc/84/72/46/405847246.db2.gz	HTWMELBXTQPPOY-SJLPKXTDSA-N	0	3	302.418	2.004	10	0		DEAEHN
CN(CC(=O)NC1C2CC3CC(C2)CC1C3)C1CCOCC1	ZINC000531343755	405944449	/nfs/dbraw/zinc/94/44/49/405944449.db2.gz	DMENRXZUTRYJIS-UHFFFAOYSA-N	0	3	306.450	2.038	10	0		DEAEHN
c1cc(CNCCC[C@@H]2CCO2)c(OC[C@@H]2CCOC2)cn1	ZINC000639184140	405953289	/nfs/dbraw/zinc/95/32/89/405953289.db2.gz	ISGLWNYOMRRBDT-GDBMZVCRSA-N	0	3	306.406	2.156	10	0		DEAEHN
Cc1ccccc1-c1cccc(CNC[C@@H](O)Cn2ccnn2)c1	ZINC000459703491	406011534	/nfs/dbraw/zinc/01/15/34/406011534.db2.gz	SMUINDHVMIOLAD-GOSISDBHSA-N	0	3	322.412	2.404	10	0		DEAEHN
Cc1ccccc1-c1cccc(CNC[C@H](O)Cn2ccnn2)c1	ZINC000459703492	406011817	/nfs/dbraw/zinc/01/18/17/406011817.db2.gz	SMUINDHVMIOLAD-SFHVURJKSA-N	0	3	322.412	2.404	10	0		DEAEHN
CN1CCC(C(=O)N2CCC[C@H](CC(=O)OC(C)(C)C)C2)CC1	ZINC000531871255	406016958	/nfs/dbraw/zinc/01/69/58/406016958.db2.gz	RCMJVQMIRODFAG-CQSZACIVSA-N	0	3	324.465	2.299	10	0		DEAEHN
O=C(N[C@H]1CCCC(F)(F)C1)N1CC[C@@H](N2CCCC2)C1	ZINC000531772284	406004869	/nfs/dbraw/zinc/00/48/69/406004869.db2.gz	CGFUPXPRTXAFCK-QWHCGFSZSA-N	0	3	301.381	2.444	10	0		DEAEHN
COc1cc(CN[C@@H]2CN(Cc3ccccc3)C[C@H]2C)on1	ZINC000639325382	406045672	/nfs/dbraw/zinc/04/56/72/406045672.db2.gz	WVEVVQGJWQIBBG-CZUORRHYSA-N	0	3	301.390	2.293	10	0		DEAEHN
Cn1ncnc1CN[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000639362602	406064843	/nfs/dbraw/zinc/06/48/43/406064843.db2.gz	ONTIATRREVGPPO-KRWDZBQOSA-N	0	3	313.449	2.350	10	0		DEAEHN
C/C(=C\c1ccccc1)CN(C)C[C@@H](O)CC1(O)CCOCC1	ZINC000639633660	406180073	/nfs/dbraw/zinc/18/00/73/406180073.db2.gz	OORLCSYAEXHSPK-QIPRVMPFSA-N	0	3	319.445	2.314	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@H]1CSc2ccccc21	ZINC000536016286	406248110	/nfs/dbraw/zinc/24/81/10/406248110.db2.gz	CBLCZQUQWFHFNZ-AWEZNQCLSA-N	0	3	314.414	2.062	10	0		DEAEHN
CC[C@H](Oc1ccccc1C)C(=O)NCCNc1ccncc1	ZINC000488532401	406327868	/nfs/dbraw/zinc/32/78/68/406327868.db2.gz	NILQGGOLGFQGTP-INIZCTEOSA-N	0	3	313.401	2.198	10	0		DEAEHN
CC(C)c1ccc(CCNC(=O)CN2CC[C@@H](CO)[C@@H]2C)cc1	ZINC000488716543	406340649	/nfs/dbraw/zinc/34/06/49/406340649.db2.gz	JQOUTKQGCUFJJF-YJBOKZPZSA-N	0	3	318.461	2.171	10	0		DEAEHN
CC(C)N(Cc1ccccc1)C(=O)CN1CC[C@H](CO)[C@@H]1C	ZINC000488730805	406341794	/nfs/dbraw/zinc/34/17/94/406341794.db2.gz	HYNZTFJCAXAWPC-DOTOQJQBSA-N	0	3	304.434	2.126	10	0		DEAEHN
CSc1ccc(CN(C)C(=O)CN2CC[C@@H](CO)[C@H]2C)cc1	ZINC000488809415	406350994	/nfs/dbraw/zinc/35/09/94/406350994.db2.gz	TXDLRVKXTWEVHW-HIFRSBDPSA-N	0	3	322.474	2.070	10	0		DEAEHN
CC(C)C[C@@H]1CCCN1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637920008	406477920	/nfs/dbraw/zinc/47/79/20/406477920.db2.gz	KHGYWRYNEKQVEC-ZWKOTPCHSA-N	0	3	317.477	2.483	10	0		DEAEHN
CCN(C(=O)[C@H](N)CN(C)Cc1ccccc1)c1ccccc1	ZINC000637867729	406454298	/nfs/dbraw/zinc/45/42/98/406454298.db2.gz	BDJOQRXITAXTCA-GOSISDBHSA-N	0	3	311.429	2.499	10	0		DEAEHN
CC[C@@H]1CCC[C@@H]1NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638032766	406533208	/nfs/dbraw/zinc/53/32/08/406533208.db2.gz	APJPZPUZDLQUMG-IKGGRYGDSA-N	0	3	303.450	2.141	10	0		DEAEHN
CC[C@@]1(C)CCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)C1	ZINC000638030812	406533256	/nfs/dbraw/zinc/53/32/56/406533256.db2.gz	LPFWPVRPNBUCDK-AEFFLSMTSA-N	0	3	303.450	2.094	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CCC(C)(C)CC1	ZINC000637980189	406507291	/nfs/dbraw/zinc/50/72/91/406507291.db2.gz	WEXFOQAVZACMNX-INIZCTEOSA-N	0	3	303.450	2.094	10	0		DEAEHN
c1ccc(N2CC[C@H](CN3CCN(c4cccnn4)CC3)C2)cc1	ZINC000638000321	406516950	/nfs/dbraw/zinc/51/69/50/406516950.db2.gz	QQGRZZCNSPULFN-QGZVFWFLSA-N	0	3	323.444	2.125	10	0		DEAEHN
C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)NC[C@@H]1CCCN(C)C1	ZINC000527224756	406599995	/nfs/dbraw/zinc/59/99/95/406599995.db2.gz	AEJTVZNBCPVPBC-GRYCIOLGSA-N	0	3	307.360	2.311	10	0		DEAEHN
Cc1cccc(NC(=O)[C@@H](N)CN(C)Cc2ccccc2)c1O	ZINC000638170527	406603977	/nfs/dbraw/zinc/60/39/77/406603977.db2.gz	SBWSTJYOLUSUQT-HNNXBMFYSA-N	0	3	313.401	2.098	10	0		DEAEHN
OCCN1CCC[C@@H](NCc2c(F)ccc(F)c2Cl)C1	ZINC000527655703	406704922	/nfs/dbraw/zinc/70/49/22/406704922.db2.gz	NPCGNCQJDYHYKX-SNVBAGLBSA-N	0	3	304.768	2.165	10	0		DEAEHN
C[C@H](CCC1CC1)NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638308745	406690087	/nfs/dbraw/zinc/69/00/87/406690087.db2.gz	XHIDMJGZBQSAMY-RHSMWYFYSA-N	0	3	303.450	2.141	10	0		DEAEHN
C[C@@H](NCCOCC1CCC1)c1ccc2c(c1)OCC(=O)N2	ZINC000552280671	406699942	/nfs/dbraw/zinc/69/99/42/406699942.db2.gz	PHVQBEAPLOSGJD-GFCCVEGCSA-N	0	3	304.390	2.485	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N(C)CCC(C)(C)C	ZINC000638375315	406733927	/nfs/dbraw/zinc/73/39/27/406733927.db2.gz	XKLNWXHMIXRRJL-INIZCTEOSA-N	0	3	305.466	2.340	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N1CCC2(CCC2)CC1	ZINC000638439724	406772945	/nfs/dbraw/zinc/77/29/45/406772945.db2.gz	WHEUURDMICZPTR-QGZVFWFLSA-N	0	3	315.461	2.238	10	0		DEAEHN
C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)[C@H]1CNCCOC1	ZINC000643617670	407017478	/nfs/dbraw/zinc/01/74/78/407017478.db2.gz	LXLLJQIRVFKGMW-YOEHRIQHSA-N	0	3	302.418	2.050	10	0		DEAEHN
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)[C@@H]1CNCCOC1	ZINC000643619040	407018478	/nfs/dbraw/zinc/01/84/78/407018478.db2.gz	JXJAKLWCSVLLTC-LLVKDONJSA-N	0	3	317.216	2.188	10	0		DEAEHN
Brc1ccc(-c2noc([C@@H]3CNCCOC3)n2)cc1	ZINC000644512882	407133019	/nfs/dbraw/zinc/13/30/19/407133019.db2.gz	HVCQQRYIQXJCJB-SNVBAGLBSA-N	0	3	324.178	2.203	10	0		DEAEHN
O=C1C[C@H](NCCCCC(F)(F)F)C(=O)N1C1CCCC1	ZINC000130550014	196089294	/nfs/dbraw/zinc/08/92/94/196089294.db2.gz	YXDABZUQBCMBEH-NSHDSACASA-N	0	3	306.328	2.379	10	0		DEAEHN
CCCN[C@H](Cc1ncnn1C)c1ccc(Br)cn1	ZINC000130918829	196122422	/nfs/dbraw/zinc/12/24/22/196122422.db2.gz	GDHDFBHNNOOLFD-GFCCVEGCSA-N	0	3	324.226	2.256	10	0		DEAEHN
CS(=O)(=O)CCC[C@@H](N)c1cccc(F)c1Br	ZINC000131341432	196160795	/nfs/dbraw/zinc/16/07/95/196160795.db2.gz	DIDLRMHVOXWVID-SNVBAGLBSA-N	0	3	324.215	2.413	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@H](C(C)C)C(=O)N2[C@@H](C)CN(C)C)s1	ZINC000131659124	196189043	/nfs/dbraw/zinc/18/90/43/196189043.db2.gz	MFQFAUYYGWJSEI-NILFDRSVSA-N	0	3	309.479	2.462	10	0		DEAEHN
CC(C)N1CCCC[C@H]1C(=O)N[C@@H](C)c1nnc2n1CCCC2	ZINC000131721171	196193847	/nfs/dbraw/zinc/19/38/47/196193847.db2.gz	INRYOFNDTSRFAZ-KBPBESRZSA-N	0	3	319.453	2.055	10	0		DEAEHN
CCOC(CNC1CC(NC(=O)OC(C)(C)C)C1)OCC	ZINC000131785466	196199449	/nfs/dbraw/zinc/19/94/49/196199449.db2.gz	UMDPQTPUXFPQJP-UHFFFAOYSA-N	0	3	302.415	2.031	10	0		DEAEHN
NC1(C(=O)N2CCc3sccc3[C@@H]2C2CC2)CCOCC1	ZINC000132165976	196232309	/nfs/dbraw/zinc/23/23/09/196232309.db2.gz	YKEZMXYYRQAKGX-AWEZNQCLSA-N	0	3	306.431	2.092	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1[C@H](O)C(C)(C)C	ZINC000132223146	196237293	/nfs/dbraw/zinc/23/72/93/196237293.db2.gz	XLCQAAADASZYLZ-NSHDSACASA-N	0	3	304.232	2.287	10	0		DEAEHN
CC[C@@H](C)c1nc(N(CCOC)CCOC)sc1CNC	ZINC000133134238	196313863	/nfs/dbraw/zinc/31/38/63/196313863.db2.gz	WPXQATRXDHJXKT-GFCCVEGCSA-N	0	3	315.483	2.475	10	0		DEAEHN
NCc1cc(-c2nn3c(nnc3C3CCCC3)s2)ccn1	ZINC000134013503	196353085	/nfs/dbraw/zinc/35/30/85/196353085.db2.gz	LSWOZFKIPIESRJ-UHFFFAOYSA-N	0	3	300.391	2.364	10	0		DEAEHN
Cc1cccc(S(=O)(=O)N[C@](C)(CN)c2ccccc2)c1	ZINC000134474315	196395059	/nfs/dbraw/zinc/39/50/59/196395059.db2.gz	AZJQMTGMOQENND-MRXNPFEDSA-N	0	3	304.415	2.147	10	0		DEAEHN
CCCNCc1sccc1S(=O)(=O)N(C)CC(F)F	ZINC000137053305	196562864	/nfs/dbraw/zinc/56/28/64/196562864.db2.gz	GYFKCDUJZOFQTM-UHFFFAOYSA-N	0	3	312.407	2.133	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@@H](C)N1CCC(Cc2nccn2C)CC1	ZINC000105876279	424849626	/nfs/dbraw/zinc/84/96/26/424849626.db2.gz	SHIGFVAOIGEGMK-LSDHHAIUSA-N	0	3	320.481	2.368	10	0		DEAEHN
Cc1ccc([C@@H](C)NC(=O)NC[C@@H](O)CN2CCCCC2)cc1	ZINC000194452112	424875897	/nfs/dbraw/zinc/87/58/97/424875897.db2.gz	YSEYBUCWJNIEGJ-NVXWUHKLSA-N	0	3	319.449	2.202	10	0		DEAEHN
Nc1cc(CN2CC[C@](O)(Cc3cccc(Cl)c3)C2)ccn1	ZINC000365493962	424860656	/nfs/dbraw/zinc/86/06/56/424860656.db2.gz	VNVVRERLNJTVIU-KRWDZBQOSA-N	0	3	317.820	2.497	10	0		DEAEHN
CN(C(=O)c1ccc(CN)o1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000390783559	424917536	/nfs/dbraw/zinc/91/75/36/424917536.db2.gz	UOMDNTNHJXLLED-HNNXBMFYSA-N	0	3	313.401	2.085	10	0		DEAEHN
Cc1nnc(NC[C@@]2(C)CCCN2Cc2ccccc2)nc1C	ZINC000397936906	424921244	/nfs/dbraw/zinc/92/12/44/424921244.db2.gz	XVHWKMQYQYLWHL-GOSISDBHSA-N	0	3	311.433	2.955	10	0		DEAEHN
O[C@]1(CCNCc2ccc(F)cc2Br)CCOC1	ZINC000404195474	424926001	/nfs/dbraw/zinc/92/60/01/424926001.db2.gz	HPDQBBFFEIZAAN-CYBMUJFWSA-N	0	3	318.186	2.219	10	0		DEAEHN
Brc1cnn(CCCNCc2ccns2)c1	ZINC000404480217	424928326	/nfs/dbraw/zinc/92/83/26/424928326.db2.gz	VXVOBBVIYCCFIN-UHFFFAOYSA-N	0	3	301.213	2.282	10	0		DEAEHN
CN(CCN1CCCC1)C(=O)c1nscc1Br	ZINC000404878789	424930000	/nfs/dbraw/zinc/93/00/00/424930000.db2.gz	YQFYXDLSNWSULX-UHFFFAOYSA-N	0	3	318.240	2.073	10	0		DEAEHN
c1nnc2ccc(NC[C@@H]3CCCCN3Cc3ccccc3)nn12	ZINC000560193622	424888553	/nfs/dbraw/zinc/88/85/53/424888553.db2.gz	XQWRSNGFHTUAML-INIZCTEOSA-N	0	3	322.416	2.591	10	0		DEAEHN
NCc1cccnc1NC(=O)NC1C2CC3CC(C2)CC1C3	ZINC000333317625	268925626	/nfs/dbraw/zinc/92/56/26/268925626.db2.gz	MNBWFZOUGGROCH-UHFFFAOYSA-N	0	3	300.406	2.487	10	0		DEAEHN
CC(C)C[C@@H]1C(=O)NCCCN1C(=O)[C@H](C)N1[C@@H](C)CC[C@@H]1C	ZINC000334130747	269023073	/nfs/dbraw/zinc/02/30/73/269023073.db2.gz	UCLQSIAWSHUKOC-YHUYYLMFSA-N	0	3	323.481	2.011	10	0		DEAEHN
Cc1cc(CCN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)on1	ZINC000507222314	269315397	/nfs/dbraw/zinc/31/53/97/269315397.db2.gz	SUCKBAOABWDOSK-LBPRGKRZSA-N	0	3	308.403	2.280	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@@H]1C[C@H]1C1CCCCC1	ZINC000516704771	269367918	/nfs/dbraw/zinc/36/79/18/269367918.db2.gz	UALIKBLWGPMDAC-JKSUJKDBSA-N	0	3	302.422	2.183	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)Nc1nc2ccccc2[nH]1	ZINC000261648991	273592930	/nfs/dbraw/zinc/59/29/30/273592930.db2.gz	FMVMQVRKQDBFFF-MNRXQERYSA-N	0	3	314.389	2.034	10	0		DEAEHN
CCn1c2ccc(Br)cc2nc1NC(=O)[C@H](C)N	ZINC000158163989	273779110	/nfs/dbraw/zinc/77/91/10/273779110.db2.gz	FKYRBLYJQABWDM-ZETCQYMHSA-N	0	3	311.183	2.104	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)CC(=O)NCc2ccc(Cl)cc2)C1	ZINC000187954673	274319115	/nfs/dbraw/zinc/31/91/15/274319115.db2.gz	RVPKWBAXLPJOEN-DYVFJYSZSA-N	0	3	324.852	2.439	10	0		DEAEHN
C/C(=C\c1ccc(F)cc1)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000176739843	275399782	/nfs/dbraw/zinc/39/97/82/275399782.db2.gz	OVRRSDGJDGAXRJ-QSOAKEGCSA-N	0	3	306.381	2.018	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)C[C@H]1c2ccccc2NC1=O	ZINC000126819334	275593897	/nfs/dbraw/zinc/59/38/97/275593897.db2.gz	UDLPVLFBCKBIBB-HIFRSBDPSA-N	0	3	317.433	2.205	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)C[C@H]1c2ccccc2NC1=O	ZINC000126819083	275900102	/nfs/dbraw/zinc/90/01/02/275900102.db2.gz	UDLPVLFBCKBIBB-ZFWWWQNUSA-N	0	3	317.433	2.205	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)Nc1cc(F)cc(F)c1	ZINC000175331808	276182916	/nfs/dbraw/zinc/18/29/16/276182916.db2.gz	YUDMLEQVOJRHDZ-HNNXBMFYSA-N	0	3	311.376	2.319	10	0		DEAEHN
CCOC(=O)CCCCCN1C[C@@]2(CCOC2)OC(C)(C)C1	ZINC000361528757	276276082	/nfs/dbraw/zinc/27/60/82/276276082.db2.gz	WGRIUXWKSVKXDM-QGZVFWFLSA-N	0	3	313.438	2.380	10	0		DEAEHN
COc1ccccc1C[C@@H]1CCCN1CC(=O)N1CCCC1	ZINC000058525565	278051047	/nfs/dbraw/zinc/05/10/47/278051047.db2.gz	RQMUUILCJQCTAQ-INIZCTEOSA-N	0	3	302.418	2.325	10	0		DEAEHN
C[C@@H](NCC(=O)NCc1ccco1)c1ccccc1-n1cccn1	ZINC000177202151	278338692	/nfs/dbraw/zinc/33/86/92/278338692.db2.gz	WVHNJGGIWVJNSK-CQSZACIVSA-N	0	3	324.384	2.432	10	0		DEAEHN
C[C@@H](N[C@H]1CCc2ncnn2C1)c1ccc2c(c1)OCCCO2	ZINC000180583344	278388194	/nfs/dbraw/zinc/38/81/94/278388194.db2.gz	QEQHXISWNVZERC-OCCSQVGLSA-N	0	3	314.389	2.105	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCSC[C@@H](C)C1	ZINC000192344249	278970738	/nfs/dbraw/zinc/97/07/38/278970738.db2.gz	KOROKSJVFNFTLV-KBPBESRZSA-N	0	3	301.500	2.357	10	0		DEAEHN
CC(C)C[C@H](C)S(=O)(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000247511413	279117113	/nfs/dbraw/zinc/11/71/13/279117113.db2.gz	NEIVGWWJBARJSH-RRFJBIMHSA-N	0	3	302.484	2.167	10	0		DEAEHN
C[C@@]1(CNC(=O)[C@@H]2CCCO2)CCCN1Cc1ccccc1	ZINC000162324876	279160736	/nfs/dbraw/zinc/16/07/36/279160736.db2.gz	IPHGQEOUUVGYJG-WMZOPIPTSA-N	0	3	302.418	2.336	10	0		DEAEHN
C[C@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1cn2ccnc2s1	ZINC000190992379	279322927	/nfs/dbraw/zinc/32/29/27/279322927.db2.gz	XAOAJFBTGGHHQC-JHJVBQTASA-N	0	3	320.462	2.492	10	0		DEAEHN
CCS(=O)(=O)NCCCN1CCC[C@]2(CC=CCC2)C1	ZINC000132878123	280019887	/nfs/dbraw/zinc/01/98/87/280019887.db2.gz	MIZSPKISSSBQFB-OAHLLOKOSA-N	0	3	300.468	2.138	10	0		DEAEHN
CN(C)CCN(C[C@H]1CCCO1)C(=O)c1scnc1C1CC1	ZINC000089832602	281623626	/nfs/dbraw/zinc/62/36/26/281623626.db2.gz	VBZJOUVXTIYTGM-CYBMUJFWSA-N	0	3	323.462	2.203	10	0		DEAEHN
C[C@H](Cc1ccccc1)C(=O)Nc1ccn(CCN(C)C)n1	ZINC000112009797	281686005	/nfs/dbraw/zinc/68/60/05/281686005.db2.gz	YECKHCXFPXNMAX-CQSZACIVSA-N	0	3	300.406	2.262	10	0		DEAEHN
O=S1(=O)CC[C@H](N[C@@H]2C[C@@H]3OCCC[C@@H]23)c2ccccc21	ZINC000252059635	304795670	/nfs/dbraw/zinc/79/56/70/304795670.db2.gz	ZPSFZKWCOSUPEV-MHEUCROKSA-N	0	3	307.415	2.062	10	0		DEAEHN
COC[C@H](C)CN1CCN(c2ncnc3ccsc32)CC1	ZINC000187265958	332964916	/nfs/dbraw/zinc/96/49/16/332964916.db2.gz	JZOWOSZIQJSIQM-GFCCVEGCSA-N	0	3	306.435	2.096	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNC[C@@H]1Cc2ccccc2O1	ZINC000582821414	337203050	/nfs/dbraw/zinc/20/30/50/337203050.db2.gz	PCOWZOAZJGIGIS-SFHVURJKSA-N	0	3	320.396	2.420	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)Nc1nnc(C(F)F)s1	ZINC000067586874	500652590	/nfs/dbraw/zinc/65/25/90/500652590.db2.gz	MPJDEVQEYOGYQJ-QMMMGPOBSA-N	0	3	319.381	2.472	10	0		DEAEHN
CC(C)N(CC(=O)N(C)Cc1ccc(Cl)s1)C[C@H](C)O	ZINC000107050206	519635260	/nfs/dbraw/zinc/63/52/60/519635260.db2.gz	VEKUIDWTIXAJRI-NSHDSACASA-N	0	3	318.870	2.451	10	0		DEAEHN
CCCC[C@@H](COC)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000157119485	521059107	/nfs/dbraw/zinc/05/91/07/521059107.db2.gz	GLJDHEYNJPWDFH-GOEBONIOSA-N	0	3	305.422	2.372	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)[C@H](C)Cc2ccc(O)cc2)C1	ZINC000246095689	521619586	/nfs/dbraw/zinc/61/95/86/521619586.db2.gz	MHZVAHXDKYAUNS-GDBMZVCRSA-N	0	3	319.449	2.449	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](C)[C@H]2COc3ccccc32)C1	ZINC000247028115	521645722	/nfs/dbraw/zinc/64/57/22/521645722.db2.gz	UUPUXMASRZCRDK-IJEWVQPXSA-N	0	3	317.433	2.335	10	0		DEAEHN
CCCN(C[C@H]1CCCCO1)C(=O)NCCN(CC)C1CC1	ZINC000106555582	521677118	/nfs/dbraw/zinc/67/71/18/521677118.db2.gz	XOLQGVVBYLCCPH-MRXNPFEDSA-N	0	3	311.470	2.461	10	0		DEAEHN
CN(C)CCN(Cc1ccccn1)C(=O)NC1CCCCC1	ZINC000107076273	521750184	/nfs/dbraw/zinc/75/01/84/521750184.db2.gz	RUACFGCBPIYIQX-UHFFFAOYSA-N	0	3	304.438	2.488	10	0		DEAEHN
COC[C@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)C1CC1	ZINC000157276126	522751895	/nfs/dbraw/zinc/75/18/95/522751895.db2.gz	MXOVYVWUQLVEQS-VBQJREDUSA-N	0	3	319.449	2.210	10	0		DEAEHN
Cn1cc(CNCCN2CCc3c(Cl)cccc3C2)cn1	ZINC000191108095	534734727	/nfs/dbraw/zinc/73/47/27/534734727.db2.gz	ZRXGIVLQJYSCSW-UHFFFAOYSA-N	0	3	304.825	2.221	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCC[C@@H]1C1CCCC1	ZINC000111864254	523824760	/nfs/dbraw/zinc/82/47/60/523824760.db2.gz	NJAPXTPMBOMDEM-IAGOWNOFSA-N	0	3	323.481	2.461	10	0		DEAEHN
COc1ccc(OC)c(CC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000124169315	524812707	/nfs/dbraw/zinc/81/27/07/524812707.db2.gz	RJGPYWXXSBUABG-DZGCQCFKSA-N	0	3	320.433	2.187	10	0		DEAEHN
Cc1ccccc1C(=O)NC1CCN(CCn2ccnc2)CC1	ZINC000131829522	525051379	/nfs/dbraw/zinc/05/13/79/525051379.db2.gz	XOBODAOQITXYAD-UHFFFAOYSA-N	0	3	312.417	2.086	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)CSCc2ccncc2)CCN1C	ZINC000127503566	525415557	/nfs/dbraw/zinc/41/55/57/525415557.db2.gz	YZHTWVFGSRGBKW-UKRRQHHQSA-N	0	3	307.463	2.256	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@@H]2CCCc3c(O)cccc32)C1	ZINC000190308611	529056022	/nfs/dbraw/zinc/05/60/22/529056022.db2.gz	WDFJXZZMEPHUPL-CZUORRHYSA-N	0	3	302.418	2.413	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC000194917102	529057085	/nfs/dbraw/zinc/05/70/85/529057085.db2.gz	WHGPLWRIDPTADI-OWCLPIDISA-N	0	3	305.397	2.465	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)CN[C@@H]1CCC(=O)N[C@@H]1C1CC1	ZINC000328928104	529269869	/nfs/dbraw/zinc/26/98/69/529269869.db2.gz	XPXQKTMCRQGCQO-CKEIUWERSA-N	0	3	307.438	2.265	10	0		DEAEHN
CC(C)Oc1ccccc1CN1CCN(C[C@H](C)O)[C@H](C)C1	ZINC000247805655	535060281	/nfs/dbraw/zinc/06/02/81/535060281.db2.gz	SODHEOOYKMBNFD-CVEARBPZSA-N	0	3	306.450	2.361	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)N1CCN(Cc2ccccc2)CC1	ZINC000261559408	535295832	/nfs/dbraw/zinc/29/58/32/535295832.db2.gz	ZBGNQKQQVVWUBU-QGZVFWFLSA-N	0	3	315.461	2.109	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC(Nc2nccs2)CC1)N(C)C	ZINC000190420499	535310013	/nfs/dbraw/zinc/31/00/13/535310013.db2.gz	YTNIXTULAABGDA-ZDUSSCGKSA-N	0	3	310.467	2.276	10	0		DEAEHN
CCN(CC)C(=O)[C@@H](C)N1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000249865966	535460681	/nfs/dbraw/zinc/46/06/81/535460681.db2.gz	HXCOHXJBWUNSLI-CVEARBPZSA-N	0	3	318.465	2.381	10	0		DEAEHN
CCOCCCNC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000248803593	535537500	/nfs/dbraw/zinc/53/75/00/535537500.db2.gz	JWHVKNBWZQFTEY-WBVHZDCISA-N	0	3	319.449	2.233	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)CCO1	ZINC000247535334	535946094	/nfs/dbraw/zinc/94/60/94/535946094.db2.gz	PVUCWQCUFWMLIY-OWCLPIDISA-N	0	3	322.836	2.233	10	0		DEAEHN
CN1CC[C@@H]2CN(C(=O)Nc3ccc4c(c3)CCCO4)C[C@@H]21	ZINC000454668373	536466330	/nfs/dbraw/zinc/46/63/30/536466330.db2.gz	ANMPXFVVWVNWOW-HIFRSBDPSA-N	0	3	301.390	2.179	10	0		DEAEHN
COc1ccc(C[C@H](C)CN2CCO[C@@H](CN(C)C)C2)cc1F	ZINC000248873483	536516729	/nfs/dbraw/zinc/51/67/29/536516729.db2.gz	LAWNXUJGOYIKTD-HOCLYGCPSA-N	0	3	324.440	2.275	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@H]1C[C@H](C)C[C@H](C)C1	ZINC000246827904	536863243	/nfs/dbraw/zinc/86/32/43/536863243.db2.gz	GNLNNZYVYQDFDW-JJXSEGSLSA-N	0	3	311.470	2.221	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCC[C@]2(CC1)NCCc1nc[nH]c12	ZINC000704098768	568414290	/nfs/dbraw/zinc/41/42/90/568414290.db2.gz	ZJLRDEOATYZFGD-MRXNPFEDSA-N	0	3	306.410	2.172	10	0		DEAEHN
CO[C@H]1CCN([C@H]2CCC[C@H]2NC(=O)c2cncc(Cl)c2)C1	ZINC000888076786	625054248	/nfs/dbraw/zinc/05/42/48/625054248.db2.gz	CTWNGTZVKPKOLR-ZNMIVQPWSA-N	0	3	323.824	2.107	10	0		DEAEHN
COCC[C@H](N)C(=O)NCCc1ccc(Cl)cc1Cl	ZINC000052791105	625103296	/nfs/dbraw/zinc/10/32/96/625103296.db2.gz	XTBRAAFCIVWYDY-LBPRGKRZSA-N	0	3	305.205	2.016	10	0		DEAEHN
CCCOc1ccc(NC(=O)[C@H](N)CCOC)cc1Cl	ZINC000052808158	625105823	/nfs/dbraw/zinc/10/58/23/625105823.db2.gz	ONSMTVGIPGUDEY-GFCCVEGCSA-N	0	3	300.786	2.431	10	0		DEAEHN
COCC[C@H](N)C(=O)N(C)Cc1cc(Cl)cc(Cl)c1	ZINC000052808809	625105869	/nfs/dbraw/zinc/10/58/69/625105869.db2.gz	YTFYKJYFWXMJGQ-LBPRGKRZSA-N	0	3	305.205	2.316	10	0		DEAEHN
COC(=O)/C(C)=C\CN1C[C@@H]2CN(c3ccccc3)C[C@H]2C1	ZINC000748812796	638593888	/nfs/dbraw/zinc/59/38/88/638593888.db2.gz	HQRAYKNLEIGJNN-JMVFYIHGSA-N	0	3	300.402	2.174	10	0		DEAEHN
Cc1sc(CN[C@@H]2CCCNC2=O)cc1Br	ZINC000227824731	646608200	/nfs/dbraw/zinc/60/82/00/646608200.db2.gz	BUCPVYZVNMJLIF-SNVBAGLBSA-N	0	3	303.225	2.187	10	0		DEAEHN
COC(=O)c1ccc2c(cnn2CN(C)C[C@H]2CCCOC2)c1	ZINC000730807810	647408763	/nfs/dbraw/zinc/40/87/63/647408763.db2.gz	YTCRLNWFCAMXET-CYBMUJFWSA-N	0	3	317.389	2.139	10	0		DEAEHN
C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)NNc2ccncc2)cc1	ZINC000180439928	648490434	/nfs/dbraw/zinc/49/04/34/648490434.db2.gz	GDIQULSTKLBXIO-XHDPSFHLSA-N	0	3	310.357	2.433	10	0		DEAEHN
C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NNc2ccncc2)c1	ZINC000180517560	648497474	/nfs/dbraw/zinc/49/74/74/648497474.db2.gz	XRXRHQCEMXPWIW-XHDPSFHLSA-N	0	3	310.357	2.433	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@H](CN[C@@H]2CCn3ccnc32)C1	ZINC000379176398	685390016	/nfs/dbraw/zinc/39/00/16/685390016.db2.gz	QRMFBHXDYMCFRN-CHWSQXEVSA-N	0	3	306.410	2.175	10	0		DEAEHN
O=C(NCCN1CCCCC1)N[C@H]1CCO[C@H]1c1ccccc1	ZINC000083018763	683996261	/nfs/dbraw/zinc/99/62/61/683996261.db2.gz	OPSPMPPIGYUQDL-IRXDYDNUSA-N	0	3	317.433	2.302	10	0		DEAEHN
CC1(OCC(=O)Nc2ccc(SC(F)F)cc2)CNC1	ZINC000098060191	684056498	/nfs/dbraw/zinc/05/64/98/684056498.db2.gz	QGCHSPGDMZDASI-UHFFFAOYSA-N	0	3	302.346	2.318	10	0		DEAEHN
CCOC(CN1CCC(C(=O)N[C@@H](C)C(C)C)CC1)OCC	ZINC000124029831	684131253	/nfs/dbraw/zinc/13/12/53/684131253.db2.gz	RWNOWOVYBBIXNM-AWEZNQCLSA-N	0	3	314.470	2.258	10	0		DEAEHN
COc1ccc([C@H](NC[C@H]2CCCS2(=O)=O)C2CC2)cc1	ZINC000126844859	684157733	/nfs/dbraw/zinc/15/77/33/684157733.db2.gz	JOCDWQPGYIVUEW-HZPDHXFCSA-N	0	3	309.431	2.313	10	0		DEAEHN
Cc1cc(C)cc([C@H](O)CN2CCN(CC(C)(C)O)[C@H](C)C2)c1	ZINC000189927476	684392653	/nfs/dbraw/zinc/39/26/53/684392653.db2.gz	ZEWUUNZBCBDLGK-SJLPKXTDSA-N	0	3	320.477	2.114	10	0		DEAEHN
C[C@H]1COCC[C@H]1C(=O)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000192577998	684452675	/nfs/dbraw/zinc/45/26/75/684452675.db2.gz	BUYJAORCVWUDOS-USXIJHARSA-N	0	3	303.402	2.477	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@H](C)N2CCc3ccccc32)C1	ZINC000195089834	685086192	/nfs/dbraw/zinc/08/61/92/685086192.db2.gz	ZALLULBHQJNPJD-ZBFHGGJFSA-N	0	3	301.434	2.038	10	0		DEAEHN
NC(=O)CC[C@@H]1CCCN(C[C@H](O)c2ccccc2Cl)C1	ZINC000245394276	685110096	/nfs/dbraw/zinc/11/00/96/685110096.db2.gz	FHDDZLHFSMVFNE-WFASDCNBSA-N	0	3	310.825	2.351	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)C[C@H]1CCCOC1	ZINC000249088691	685174225	/nfs/dbraw/zinc/17/42/25/685174225.db2.gz	JWMKUHFXISHZOA-DOTOQJQBSA-N	0	3	304.434	2.440	10	0		DEAEHN
O[C@H]1CCCC[C@@H]1N1CCN(c2ncnc3sccc32)CC1	ZINC000270621841	685204306	/nfs/dbraw/zinc/20/43/06/685204306.db2.gz	OYNCUIKIVZZUGJ-KBPBESRZSA-N	0	3	318.446	2.117	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)/C(C)=C/c1ccc(F)cc1	ZINC000176494767	782475065	/nfs/dbraw/zinc/47/50/65/782475065.db2.gz	PARUWCLXTIYWCT-VSOYFRJCSA-N	0	3	320.408	2.456	10	0		DEAEHN
C[C@H](COCc1ccccc1)NCc1cnc2n1CCOC2	ZINC000722838761	776844810	/nfs/dbraw/zinc/84/48/10/776844810.db2.gz	YRECDXLCUMXUSC-CQSZACIVSA-N	0	3	301.390	2.108	10	0		DEAEHN
C[C@](O)(CNC[C@H](O)c1ccsc1)C(F)(F)C(F)(F)F	ZINC000724056611	777232519	/nfs/dbraw/zinc/23/25/19/777232519.db2.gz	FPOAHKOQCXYSER-IUCAKERBSA-N	0	3	319.295	2.320	10	0		DEAEHN
COC[C@H](CCO)NCc1ccc(Br)c(F)c1	ZINC000217852701	789334943	/nfs/dbraw/zinc/33/49/43/789334943.db2.gz	QVDVBSYGEIJDMJ-JTQLQIEISA-N	0	3	306.175	2.075	10	0		DEAEHN
CCOCC(C)(C)CNCc1cn(C)nc1Br	ZINC000712495893	792190597	/nfs/dbraw/zinc/19/05/97/792190597.db2.gz	KQPSBFDQLORLOU-UHFFFAOYSA-N	0	3	304.232	2.335	10	0		DEAEHN
C[C@H](O)[C@H](O)CNCc1cccc(OCc2ccccc2)c1	ZINC000717337988	799381506	/nfs/dbraw/zinc/38/15/06/799381506.db2.gz	AVQSVWMWVQKVKQ-KBXCAEBGSA-N	0	3	301.386	2.097	10	0		DEAEHN
C[C@@H](C(=O)NCCC1=CCCCC1)N1C[C@H]2CCC[C@@H](C1)C2O	ZINC000172048311	799457417	/nfs/dbraw/zinc/45/74/17/799457417.db2.gz	SJJSCLBUCYIYLV-QTXGHNMQSA-N	0	3	320.477	2.474	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@@H]1C[C@H](NCc2cncnc2)C12CCC2	ZINC000404634135	802026911	/nfs/dbraw/zinc/02/69/11/802026911.db2.gz	HKHSFWOURHNZKR-UONOGXRCSA-N	0	3	318.421	2.402	10	0		DEAEHN
CS[C@@H](CO)[C@@H](C)NCc1ccc(Br)nc1	ZINC000309928581	802214438	/nfs/dbraw/zinc/21/44/38/802214438.db2.gz	WSGBIVJUQPXPNM-SCZZXKLOSA-N	0	3	305.241	2.046	10	0		DEAEHN
C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CCNCc1ccn(C)n1	ZINC000721042579	1085630454	/nfs/dbraw/zinc/63/04/54/1085630454.db2.gz	RIINBGKOUPNICA-ZIAGYGMSSA-N	0	3	322.453	2.403	10	0		DEAEHN
Cc1ccc(CNCCOCCN(C)C(=O)OC(C)(C)C)cn1	ZINC000705930433	1086626587	/nfs/dbraw/zinc/62/65/87/1086626587.db2.gz	ZCLHREPAESYUEU-UHFFFAOYSA-N	0	3	323.437	2.363	10	0		DEAEHN
CN(CCOCCNCc1cccnc1)C(=O)OC(C)(C)C	ZINC000705911766	1086627665	/nfs/dbraw/zinc/62/76/65/1086627665.db2.gz	YEBVPLABNSVJFX-UHFFFAOYSA-N	0	3	309.410	2.055	10	0		DEAEHN
C[C@H]1[C@@H](NC(=O)c2ccc(Br)cc2F)CCN1C	ZINC000719388973	1089080591	/nfs/dbraw/zinc/08/05/91/1089080591.db2.gz	UGDMUQIIMDNJAE-UFBFGSQYSA-N	0	3	315.186	2.411	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)cc1	ZINC000278250033	214047292	/nfs/dbraw/zinc/04/72/92/214047292.db2.gz	BWFBMGOPMYPALM-SUMWQHHRSA-N	0	3	317.433	2.082	10	0		DEAEHN
COc1ccc([C@H](N)CSc2nnc(N(C)C)s2)cc1	ZINC000081769381	192323315	/nfs/dbraw/zinc/32/33/15/192323315.db2.gz	JRTCQAHCWWTOPY-LLVKDONJSA-N	0	3	310.448	2.405	10	0		DEAEHN
CN[C@H](CSCC(=O)OC)c1ccc2c(c1)OCCCO2	ZINC000081792116	192324213	/nfs/dbraw/zinc/32/42/13/192324213.db2.gz	FNUKEVUBFWISGP-GFCCVEGCSA-N	0	3	311.403	2.015	10	0		DEAEHN
CCC[C@@H]1CCCN(C(=O)NC[C@H]2CCCN2CCOC)C1	ZINC000150887582	282107207	/nfs/dbraw/zinc/10/72/07/282107207.db2.gz	ILXSAYIESJIPJD-HZPDHXFCSA-N	0	3	311.470	2.319	10	0		DEAEHN
CN[C@H](CSc1ncccn1)c1ccc2c(c1)OCCO2	ZINC000081871683	192332896	/nfs/dbraw/zinc/33/28/96/192332896.db2.gz	CVHNLXMYZRZAKD-GFCCVEGCSA-N	0	3	303.387	2.301	10	0		DEAEHN
CCCN[C@H]1c2ccccc2OC[C@H]1Sc1nncn1C	ZINC000081866888	192333076	/nfs/dbraw/zinc/33/30/76/192333076.db2.gz	PVFZBLKJYUOFKE-KGLIPLIRSA-N	0	3	304.419	2.409	10	0		DEAEHN
CN[C@H]1c2ccccc2CC[C@@H]1Sc1nnnn1C1CC1	ZINC000081867647	192333607	/nfs/dbraw/zinc/33/36/07/192333607.db2.gz	HBDJBVSLZCDKAA-KBPBESRZSA-N	0	3	301.419	2.376	10	0		DEAEHN
CCCN[C@H]1CCOC[C@H]1S(=O)(=O)c1cc(C)ccc1C	ZINC000081922259	192338689	/nfs/dbraw/zinc/33/86/89/192338689.db2.gz	RGSIAGDBFVJNAV-GOEBONIOSA-N	0	3	311.447	2.234	10	0		DEAEHN
COc1ccc(CN)cc1CS(=O)(=O)c1ccc(C)cc1	ZINC000081920726	192338789	/nfs/dbraw/zinc/33/87/89/192338789.db2.gz	PJCFEBVCHZSKLT-UHFFFAOYSA-N	0	3	305.399	2.436	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)C[C@H]1CCCCO1	ZINC000087159802	282130592	/nfs/dbraw/zinc/13/05/92/282130592.db2.gz	OUBIBHDXYXHJBL-DLBZAZTESA-N	0	3	304.434	2.235	10	0		DEAEHN
CN[C@@H](C)[C@H](C)S(=O)(=O)c1ccc(Br)cc1	ZINC000081933459	192341481	/nfs/dbraw/zinc/34/14/81/192341481.db2.gz	QMWDEENYHGCFGF-IUCAKERBSA-N	0	3	306.225	2.219	10	0		DEAEHN
N[C@H]1CCCC[C@@H]1S(=O)(=O)c1ccccc1Br	ZINC000081931999	192341920	/nfs/dbraw/zinc/34/19/20/192341920.db2.gz	MBIBISLNBXKBIZ-JQWIXIFHSA-N	0	3	318.236	2.493	10	0		DEAEHN
CCC[C@@H](CS(=O)(=O)c1ccc2c(c1)OCCO2)NCC	ZINC000081935417	192342363	/nfs/dbraw/zinc/34/23/63/192342363.db2.gz	XZLAZMLXCULLDT-LBPRGKRZSA-N	0	3	313.419	2.010	10	0		DEAEHN
CCOc1ccc2c(c1)[C@@H](N[C@@H]1CCC(=O)N(C)C1)CCO2	ZINC000152387303	282143497	/nfs/dbraw/zinc/14/34/97/282143497.db2.gz	LUAJGWNRDNFAJY-DOMZBBRYSA-N	0	3	304.390	2.119	10	0		DEAEHN
Cc1ccc(C(=O)N2CCN(C3CCN(C)CC3)CC2)cc1C	ZINC000082348093	185176787	/nfs/dbraw/zinc/17/67/87/185176787.db2.gz	MQABOAYRTUXQTE-UHFFFAOYSA-N	0	3	315.461	2.155	10	0		DEAEHN
CS(=O)(=O)[C@H]1CCC[C@@]1(CN)Nc1cccc(Cl)c1	ZINC000087913635	185237221	/nfs/dbraw/zinc/23/72/21/185237221.db2.gz	QFVUFGOXGZMESE-STQMWFEESA-N	0	3	302.827	2.047	10	0		DEAEHN
COCCN1C(=O)CC[C@@H](N)[C@@H]1c1ccc(Cl)cc1F	ZINC000165614986	197678344	/nfs/dbraw/zinc/67/83/44/197678344.db2.gz	QNQQNZMNTPPCAW-OCCSQVGLSA-N	0	3	300.761	2.116	10	0		DEAEHN
CN1CCCC[C@H]1COc1nc2c(cc1C(N)=S)CCC2	ZINC000088165698	185241068	/nfs/dbraw/zinc/24/10/68/185241068.db2.gz	VJFHJCGQOJNUOA-LBPRGKRZSA-N	0	3	305.447	2.068	10	0		DEAEHN
CN[C@@H]1CCN(c2ccc(Cl)cc2Br)C1=O	ZINC000088123183	185240157	/nfs/dbraw/zinc/24/01/57/185240157.db2.gz	HQWIZDSNQOLKDF-SECBINFHSA-N	0	3	303.587	2.427	10	0		DEAEHN
CSCC[C@H](N)C(=O)Nc1c2nsnc2ccc1Cl	ZINC000088126325	185240468	/nfs/dbraw/zinc/24/04/68/185240468.db2.gz	BYVLNEQMAQLGKK-ZETCQYMHSA-N	0	3	316.839	2.364	10	0		DEAEHN
CC[C@@H](C[NH3+])S(=O)(=O)[N-]c1cc(C(F)(F)F)ccc1F	ZINC000088474008	185252251	/nfs/dbraw/zinc/25/22/51/185252251.db2.gz	XIHWXOFIOOYNED-QMMMGPOBSA-N	0	3	314.304	2.324	10	0		DEAEHN
COC(=O)[C@@](C)(CCCN(C)CCC(F)(F)F)NC1CC1	ZINC000088434661	185250096	/nfs/dbraw/zinc/25/00/96/185250096.db2.gz	BTFCHJXKJPAHJO-CYBMUJFWSA-N	0	3	310.360	2.335	10	0		DEAEHN
CCOC(=O)[C@](C)(CCN1CCC(C(F)(F)F)CC1)NC	ZINC000088435578	185250602	/nfs/dbraw/zinc/25/06/02/185250602.db2.gz	PWBQPYGVZHPVSN-ZDUSSCGKSA-N	0	3	310.360	2.192	10	0		DEAEHN
NN=c1[nH]cc(C(=O)N2CCC[C@H](C(F)(F)F)C2)cc1Cl	ZINC000088438632	185250671	/nfs/dbraw/zinc/25/06/71/185250671.db2.gz	HWRQPKNRUHDROY-QMMMGPOBSA-N	0	3	322.718	2.435	10	0		DEAEHN
CC[C@@H]1CC[C@@H]([NH2+]Cc2ccc(S(=O)(=O)[N-]C)o2)[C@@H]1C	ZINC000088540953	185255891	/nfs/dbraw/zinc/25/58/91/185255891.db2.gz	VUTVXQLRYLQYBY-NQBHXWOUSA-N	0	3	300.424	2.102	10	0		DEAEHN
COc1ccc(CN)cc1CS(=O)(=O)c1ccccc1C	ZINC000081978111	192349370	/nfs/dbraw/zinc/34/93/70/192349370.db2.gz	VGPJCYLBZYCGKG-UHFFFAOYSA-N	0	3	305.399	2.436	10	0		DEAEHN
CN[C@H]1COC[C@H]1c1nc(-c2cccc(Br)c2)no1	ZINC000090423186	185295376	/nfs/dbraw/zinc/29/53/76/185295376.db2.gz	NWEXMCLCTRTLLO-MNOVXSKESA-N	0	3	324.178	2.201	10	0		DEAEHN
CN[C@H]1COC[C@H]1c1nc(-c2ccc(Br)cc2)no1	ZINC000090423229	185295483	/nfs/dbraw/zinc/29/54/83/185295483.db2.gz	DVNRYDISQNTSBQ-MNOVXSKESA-N	0	3	324.178	2.201	10	0		DEAEHN
COc1cccc(C(=O)N2CCCSC[C@H]2CN(C)C)c1	ZINC000090699818	185310625	/nfs/dbraw/zinc/31/06/25/185310625.db2.gz	IOOJIFRDORGOQZ-CQSZACIVSA-N	0	3	308.447	2.205	10	0		DEAEHN
CCC[C@@H]1CC[C@H](N)[C@H](S(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000166864166	197699457	/nfs/dbraw/zinc/69/94/57/197699457.db2.gz	MBNYKRQAXSLSDF-FRRDWIJNSA-N	0	3	319.467	2.039	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N[C@@H]1CCCS(=O)(=O)C1)CCC2	ZINC000092384055	185315110	/nfs/dbraw/zinc/31/51/10/185315110.db2.gz	ZBYPNIFRJWBIJJ-CZUORRHYSA-N	0	3	309.431	2.239	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1c1cc2c(cc1Cl)C(=O)C(=O)N2	ZINC000092772617	185339909	/nfs/dbraw/zinc/33/99/09/185339909.db2.gz	RSVORXBEFRBSPP-VIFPVBQESA-N	0	3	307.781	2.005	10	0		DEAEHN
Cc1ccc(CS(=O)(=O)C(C)C(=O)NC2CCCC2)c(C)n1	ZINC000185233312	282260875	/nfs/dbraw/zinc/26/08/75/282260875.db2.gz	FNDZWOBIXSWPKC-ZDUSSCGKSA-N	0	3	324.446	2.061	10	0		DEAEHN
C[NH2+]CCc1ccc(S(=O)(=O)[N-]C2C(C)(C)C2(C)C)s1	ZINC000092833298	185344881	/nfs/dbraw/zinc/34/48/81/185344881.db2.gz	NAGDTZLWOXDODL-UHFFFAOYSA-N	0	3	316.492	2.223	10	0		DEAEHN
CN1CCC[C@@H](CNc2ccc3nnnn3n2)[C@@H]1c1ccccc1	ZINC000095396577	185352958	/nfs/dbraw/zinc/35/29/58/185352958.db2.gz	IYCRVFMRRVYHFZ-YOEHRIQHSA-N	0	3	323.404	2.014	10	0		DEAEHN
COC(=O)c1csc(NC(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000092929234	185349591	/nfs/dbraw/zinc/34/95/91/185349591.db2.gz	ZACUTAWNGKJSBO-CMPLNLGQSA-N	0	3	323.418	2.235	10	0		DEAEHN
CN1CCN(CCNC(=O)N[C@@H]2CCC23CCCC3)CC1(C)C	ZINC000441038381	529771896	/nfs/dbraw/zinc/77/18/96/529771896.db2.gz	PWQBAYIDTMZWOZ-OAHLLOKOSA-N	0	3	322.497	2.034	10	0		DEAEHN
COc1cc(C[NH2+][C@H]2CCC[C@@H]2O)cc(Br)c1[O-]	ZINC000080203958	539377085	/nfs/dbraw/zinc/37/70/85/539377085.db2.gz	ZDJSYSXDUCQOGD-QWRGUYRKSA-N	0	3	316.195	2.166	10	0		DEAEHN
CN1CCC(NC(=O)N[C@@H]2CCCc3c(O)cccc32)CC1	ZINC000190445977	530050426	/nfs/dbraw/zinc/05/04/26/530050426.db2.gz	UUKUKKINZPGGQQ-OAHLLOKOSA-N	0	3	303.406	2.163	10	0		DEAEHN
COc1cc(C[NH2+][C@@H]2CCOC2)cc(Br)c1[O-]	ZINC000095015630	539433521	/nfs/dbraw/zinc/43/35/21/539433521.db2.gz	BJOOMNHROVTKHS-SECBINFHSA-N	0	3	302.168	2.042	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN(C[C@H](O)C(F)(F)F)C2)n1	ZINC000181712802	199342340	/nfs/dbraw/zinc/34/23/40/199342340.db2.gz	HTUYBEXSBLBPAT-RYUDHWBXSA-N	0	3	303.328	2.047	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@H](C)Cc1c(C)noc1C	ZINC000245421898	282386431	/nfs/dbraw/zinc/38/64/31/282386431.db2.gz	OMUOEYJFHPFNOT-DOMZBBRYSA-N	0	3	322.453	2.348	10	0		DEAEHN
COC(=O)[C@@H]1CCC[C@@H](C(=O)N[C@H](CC(C)C)CN(C)C)C1	ZINC000245452576	282389520	/nfs/dbraw/zinc/38/95/20/282389520.db2.gz	DRBPXTJZDFDKSM-RBSFLKMASA-N	0	3	312.454	2.058	10	0		DEAEHN
CCCO[C@H]1CCCN(C(=O)N[C@H]2CCCN(CC)C2)CC1	ZINC000108562007	185521628	/nfs/dbraw/zinc/52/16/28/185521628.db2.gz	YISSUMHUPKKDFZ-HOTGVXAUSA-N	0	3	311.470	2.461	10	0		DEAEHN
OCC[C@]1(CN[C@H]2CCCOc3ccc(F)cc32)CCOC1	ZINC000125524369	539473666	/nfs/dbraw/zinc/47/36/66/539473666.db2.gz	TUJMKSAPJIGWNC-DOTOQJQBSA-N	0	3	309.381	2.418	10	0		DEAEHN
C[C@H](NCCn1cncn1)c1cc(Br)cs1	ZINC000279808330	215164143	/nfs/dbraw/zinc/16/41/43/215164143.db2.gz	XBAOFFILNLDFQY-QMMMGPOBSA-N	0	3	301.213	2.453	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC[C@@H](n2cccn2)CC1	ZINC000616602450	362896205	/nfs/dbraw/zinc/89/62/05/362896205.db2.gz	XPUWOZFHJNZQOY-CQSZACIVSA-N	0	3	308.426	2.435	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000176258526	539626224	/nfs/dbraw/zinc/62/62/24/539626224.db2.gz	ZJKQNRZPHCNHRM-JKSUJKDBSA-N	0	3	301.434	2.452	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)Nc2cnn(C(C)(C)C)c2)C1	ZINC000180955936	539648391	/nfs/dbraw/zinc/64/83/91/539648391.db2.gz	QTMKZHRKHJWDNW-OCCSQVGLSA-N	0	3	307.442	2.488	10	0		DEAEHN
CC(C)CN(CCN(C)C)C(=O)NCc1ccc(Cl)cn1	ZINC000180844239	539647242	/nfs/dbraw/zinc/64/72/42/539647242.db2.gz	UCEPMCNHWKRDIM-UHFFFAOYSA-N	0	3	312.845	2.464	10	0		DEAEHN
Cc1cc(N2CCC[C@@H](NCc3cccs3)C2=O)n(C)n1	ZINC000080526750	192164975	/nfs/dbraw/zinc/16/49/75/192164975.db2.gz	RAIVRYDMLHKMSK-CYBMUJFWSA-N	0	3	304.419	2.075	10	0		DEAEHN
Cc1cc(N2CCC[C@@H](NCc3ccccc3C)C2=O)n(C)n1	ZINC000080526651	192165215	/nfs/dbraw/zinc/16/52/15/192165215.db2.gz	WRUNKYJXKZJEDP-MRXNPFEDSA-N	0	3	312.417	2.322	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2C)C1	ZINC000190566857	539696344	/nfs/dbraw/zinc/69/63/44/539696344.db2.gz	ZNTCTQDHOOVABG-FPMFFAJLSA-N	0	3	307.463	2.388	10	0		DEAEHN
N[C@H](C[S@@](=O)c1cccs1)c1ccc2c(c1)OCCO2	ZINC000084030531	192395961	/nfs/dbraw/zinc/39/59/61/192395961.db2.gz	ZZHCSZPSVCSUHK-GIPWTMENSA-N	0	3	309.412	2.327	10	0		DEAEHN
C=Cn1cc(CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cn1	ZINC000219395861	539727351	/nfs/dbraw/zinc/72/73/51/539727351.db2.gz	GQNRHZNSSWCAKD-ZDUSSCGKSA-N	0	3	306.410	2.330	10	0		DEAEHN
O=C1CC[C@@H](CNCc2ccc(Br)c(Cl)c2)N1	ZINC000236049294	539736724	/nfs/dbraw/zinc/73/67/24/539736724.db2.gz	QFVPTNNVUGFLPD-VIFPVBQESA-N	0	3	317.614	2.471	10	0		DEAEHN
COC(=O)c1ccc(Cl)c(N[C@H](C)C[C@H]2COCCN2)c1	ZINC000133650010	186003566	/nfs/dbraw/zinc/00/35/66/186003566.db2.gz	VJAOOIUTBKBXSB-PWSUYJOCSA-N	0	3	312.797	2.306	10	0		DEAEHN
NC[C@@H](c1ccc(Cl)s1)N1CCCC2(C1)OCCO2	ZINC000133660954	186003844	/nfs/dbraw/zinc/00/38/44/186003844.db2.gz	XHIQUZNNGCGJIC-JTQLQIEISA-N	0	3	302.827	2.240	10	0		DEAEHN
C[C@H]1CCC[C@](N)(c2nc3c(cccc3S(C)(=O)=O)[nH]2)C1	ZINC000138156776	186014619	/nfs/dbraw/zinc/01/46/19/186014619.db2.gz	QMZYXUVYRIGUIP-ZUZCIYMTSA-N	0	3	307.419	2.331	10	0		DEAEHN
CC[C@@H]1CCCN(S(=O)(=O)c2cc(CN)cc(F)c2F)C1	ZINC000138535912	186017920	/nfs/dbraw/zinc/01/79/20/186017920.db2.gz	PSCOZFQCPLMAHR-SNVBAGLBSA-N	0	3	318.389	2.234	10	0		DEAEHN
CC(C)[C@@H]1CCCN1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000139159911	186020463	/nfs/dbraw/zinc/02/04/63/186020463.db2.gz	CPKXCVKTJXXITF-LBPRGKRZSA-N	0	3	318.389	2.233	10	0		DEAEHN
CC[C@H]1N[C@H](c2cccs2)N(CCN2CCCCC2)C1=O	ZINC000144061566	186034639	/nfs/dbraw/zinc/03/46/39/186034639.db2.gz	OGCCOTZBVCQHBH-HIFRSBDPSA-N	0	3	307.463	2.443	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2cccs2)N(C[C@@H]2CCCN(C)C2)C1=O	ZINC000144234313	186034701	/nfs/dbraw/zinc/03/47/01/186034701.db2.gz	LQXIORLZIYQVJO-VNHYZAJKSA-N	0	3	307.463	2.299	10	0		DEAEHN
CNc1nc(NCCC(F)(F)F)nc(N2CCCCC2)n1	ZINC000150075546	186054123	/nfs/dbraw/zinc/05/41/23/186054123.db2.gz	WAUIBQOXETYWIY-UHFFFAOYSA-N	0	3	304.320	2.268	10	0		DEAEHN
CCOc1cc2c(cc1CNC(=O)[C@H](N)[C@@H](C)CC)O[C@@H](C)C2	ZINC000150757712	186064265	/nfs/dbraw/zinc/06/42/65/186064265.db2.gz	QDMOIIIQPINQJE-NVGCLXPQSA-N	0	3	320.433	2.398	10	0		DEAEHN
COc1ccc(CNC[C@@H](C)[S@](C)=O)cc1Br	ZINC000159715049	186136896	/nfs/dbraw/zinc/13/68/96/186136896.db2.gz	QCANMSOULHSQPM-VVVCHXIZSA-N	0	3	320.252	2.314	10	0		DEAEHN
CCn1ncnc1C[C@@H](N)c1csc(Br)c1	ZINC000163920917	186141930	/nfs/dbraw/zinc/14/19/30/186141930.db2.gz	RMGBZOABRVICKW-MRVPVSSYSA-N	0	3	301.213	2.365	10	0		DEAEHN
C[C@@H]1CN(c2ccc(C(F)(F)F)c(C(N)=S)c2)CCN1C	ZINC000164215837	186152394	/nfs/dbraw/zinc/15/23/94/186152394.db2.gz	FAZICUSYAFRYRN-SECBINFHSA-N	0	3	317.380	2.480	10	0		DEAEHN
N[C@@H](C[C@@H]1CCS(=O)(=O)C1)c1cscc1Br	ZINC000164381760	186157862	/nfs/dbraw/zinc/15/78/62/186157862.db2.gz	SWPVFICRSZIOFN-XVKPBYJWSA-N	0	3	324.265	2.335	10	0		DEAEHN
COC[C@@H](C)C(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1	ZINC000186054265	186236169	/nfs/dbraw/zinc/23/61/69/186236169.db2.gz	OWYZNLRTLHPSKR-PBHICJAKSA-N	0	3	304.434	2.296	10	0		DEAEHN
CCOc1cccc(CNC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000171900460	198004054	/nfs/dbraw/zinc/00/40/54/198004054.db2.gz	KOSPJVSZBSMJBC-HNNXBMFYSA-N	0	3	303.406	2.075	10	0		DEAEHN
O=C(N[C@@H]1C[C@@H]1c1cccc(F)c1)N1CCN2CCC[C@@H]2C1	ZINC000171905034	198005338	/nfs/dbraw/zinc/00/53/38/198005338.db2.gz	YIHBZWSFUBBLFP-BZUAXINKSA-N	0	3	303.381	2.171	10	0		DEAEHN
COc1cc(Cl)ccc1CNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171908055	198006024	/nfs/dbraw/zinc/00/60/24/198006024.db2.gz	IJTJVIZLVVDKCL-CQSZACIVSA-N	0	3	323.824	2.338	10	0		DEAEHN
CCCCn1c(=O)c2sccc2nc1N1CCC[C@H](N)C1	ZINC000057346559	282983441	/nfs/dbraw/zinc/98/34/41/282983441.db2.gz	FFUUWYMAJJAKEF-NSHDSACASA-N	0	3	306.435	2.186	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(-n2ccnc2)cc1	ZINC000172054975	198032199	/nfs/dbraw/zinc/03/21/99/198032199.db2.gz	KVBYBKMAWIVXNS-RHSMWYFYSA-N	0	3	310.401	2.181	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1CCCS(=O)(=O)c1ccccc1	ZINC000172081328	198036606	/nfs/dbraw/zinc/03/66/06/198036606.db2.gz	DWMNQZNFMOWDNA-JKSUJKDBSA-N	0	3	322.474	2.019	10	0		DEAEHN
CC1CCC(N2CCN(C(=O)N[C@H]3CCCOC3)CC2)CC1	ZINC000172150697	198047566	/nfs/dbraw/zinc/04/75/66/198047566.db2.gz	BSULBSKKRTWSFU-PCKAHOCUSA-N	0	3	309.454	2.071	10	0		DEAEHN
Cc1ccc(CCNC(=O)N2CCCN(C3CC3)CC2)cc1	ZINC000172189583	198054353	/nfs/dbraw/zinc/05/43/53/198054353.db2.gz	WSQIVRQMHJXADG-UHFFFAOYSA-N	0	3	301.434	2.417	10	0		DEAEHN
COCCOc1ccc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1	ZINC000172617202	198124953	/nfs/dbraw/zinc/12/49/53/198124953.db2.gz	QNVHCVQVBHYKLC-ZBFHGGJFSA-N	0	3	320.433	2.267	10	0		DEAEHN
CC(C)CO[C@H](C)c1noc(CN2CCCN(C3CC3)CC2)n1	ZINC000080627709	192175317	/nfs/dbraw/zinc/17/53/17/192175317.db2.gz	IRFWFUXWUHUNLG-CQSZACIVSA-N	0	3	322.453	2.473	10	0		DEAEHN
C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)COC1(C)CNC1	ZINC000309773935	539879205	/nfs/dbraw/zinc/87/92/05/539879205.db2.gz	WJCRUNKICKRMJU-AWEZNQCLSA-N	0	3	302.418	2.192	10	0		DEAEHN
O=C(CCN1CCN2CCCC[C@@H]2C1)Nc1ccccc1F	ZINC000172804019	198151870	/nfs/dbraw/zinc/15/18/70/198151870.db2.gz	NMOGBCHZTBCCJE-CQSZACIVSA-N	0	3	305.397	2.324	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)Cc2ccccc2)[C@H](C)C1	ZINC000173259195	198202869	/nfs/dbraw/zinc/20/28/69/198202869.db2.gz	BFUKFUDAVWVSLD-ZBFHGGJFSA-N	0	3	310.463	2.179	10	0		DEAEHN
C[C@@]12CN(C(=O)Nc3ncccc3CN)C[C@H]1[C@@H]1CC[C@H]2C1	ZINC000333272732	539954125	/nfs/dbraw/zinc/95/41/25/539954125.db2.gz	GHWLKNBBEOFIOK-YSLLHCQFSA-N	0	3	300.406	2.440	10	0		DEAEHN
CC[C@@H](O)CN1CCN(Cc2cccc(OC(C)C)c2)CC1	ZINC000174079500	198289150	/nfs/dbraw/zinc/28/91/50/198289150.db2.gz	GNIUTVHXERAOMP-QGZVFWFLSA-N	0	3	306.450	2.362	10	0		DEAEHN
CCCCN(C)CCNC(=O)NC[C@@](C)(O)C1CCCCC1	ZINC000358445466	535221628	/nfs/dbraw/zinc/22/16/28/535221628.db2.gz	NKABZJDMZLLANZ-QGZVFWFLSA-N	0	3	313.486	2.349	10	0		DEAEHN
Cc1ccc2ncnc(NC[C@H](O)CN3CCCCC3)c2c1	ZINC000174685090	198370339	/nfs/dbraw/zinc/37/03/39/198370339.db2.gz	CLTHWYHDKHHDTL-AWEZNQCLSA-N	0	3	300.406	2.197	10	0		DEAEHN
CCOc1ccc(OCCN2CCC(C(=O)N(C)C)CC2)cc1	ZINC000061761351	354631095	/nfs/dbraw/zinc/63/10/95/354631095.db2.gz	MDDZQRYSWZZFFS-UHFFFAOYSA-N	0	3	320.433	2.264	10	0		DEAEHN
CN1CC[C@@H](NC(=O)COCC(F)(F)F)[C@H]1c1ccccc1	ZINC000248062596	283047124	/nfs/dbraw/zinc/04/71/24/283047124.db2.gz	PHYXNWUAXOBZEK-TZMCWYRMSA-N	0	3	316.323	2.127	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N(C)CCOc1ccc(C)cc1	ZINC000074489865	355032268	/nfs/dbraw/zinc/03/22/68/355032268.db2.gz	FLKHCQQQHQNMDF-MRXNPFEDSA-N	0	3	319.449	2.500	10	0		DEAEHN
CO[C@@H](CNC(=O)N[C@H](CC(C)C)CN(C)C)C(C)(C)C	ZINC000073722900	191348406	/nfs/dbraw/zinc/34/84/06/191348406.db2.gz	RZMFYWZTTFQTSF-KGLIPLIRSA-N	0	3	301.475	2.323	10	0		DEAEHN
CO[C@@H](CNC(=O)N[C@@H](CC(C)C)CN(C)C)C(C)(C)C	ZINC000073722898	191348437	/nfs/dbraw/zinc/34/84/37/191348437.db2.gz	RZMFYWZTTFQTSF-KBPBESRZSA-N	0	3	301.475	2.323	10	0		DEAEHN
Cc1cncc(CCNCc2cnn(Cc3ccccc3)c2)n1	ZINC000402723281	540143705	/nfs/dbraw/zinc/14/37/05/540143705.db2.gz	XEYMPLRDFUPHIJ-UHFFFAOYSA-N	0	3	307.401	2.362	10	0		DEAEHN
Cc1ccc(CCNC(=O)N[C@@H](CC(C)C)CN(C)C)cn1	ZINC000111826649	355750442	/nfs/dbraw/zinc/75/04/42/355750442.db2.gz	JEURNSQBWUMGRQ-INIZCTEOSA-N	0	3	306.454	2.208	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCc1ccc(OC(F)F)cc1	ZINC000139396727	355876702	/nfs/dbraw/zinc/87/67/02/355876702.db2.gz	AZZGCKGYMPYLRC-LBPRGKRZSA-N	0	3	313.348	2.181	10	0		DEAEHN
CC(=O)N1CCN(c2ccc(CNC3CCC3)c(F)c2)CC1	ZINC000147228945	355912066	/nfs/dbraw/zinc/91/20/66/355912066.db2.gz	AZHXJUNKRHOQLK-UHFFFAOYSA-N	0	3	305.397	2.136	10	0		DEAEHN
CCCOCc1ccccc1CNC(=O)N1CC[C@H](N(C)C)C1	ZINC000170831392	355994380	/nfs/dbraw/zinc/99/43/80/355994380.db2.gz	DXMLOAZUXIQHME-KRWDZBQOSA-N	0	3	319.449	2.459	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)CSC[C@@H]1CCCCO1	ZINC000171396901	356001328	/nfs/dbraw/zinc/00/13/28/356001328.db2.gz	FQFYRJUKYKIXLW-GJZGRUSLSA-N	0	3	316.511	2.381	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)CSC[C@@H]1CCCCO1	ZINC000171378010	356001757	/nfs/dbraw/zinc/00/17/57/356001757.db2.gz	UOMGNKXACANRCN-CABCVRRESA-N	0	3	314.495	2.279	10	0		DEAEHN
Cc1cccc(CNC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)n1	ZINC000182419723	356126327	/nfs/dbraw/zinc/12/63/27/356126327.db2.gz	VILJLPLTPLSXRT-GOEBONIOSA-N	0	3	302.422	2.016	10	0		DEAEHN
COc1ccc(CCN[C@H]2CCCS(=O)(=O)C2)c(Cl)c1	ZINC000183123042	356160504	/nfs/dbraw/zinc/16/05/04/356160504.db2.gz	BVXYWVRPUNLYMH-LBPRGKRZSA-N	0	3	317.838	2.058	10	0		DEAEHN
C[C@@H](CC1CCCCC1)CN1CC[C@H](NS(C)(=O)=O)C1	ZINC000183357235	356168923	/nfs/dbraw/zinc/16/89/23/356168923.db2.gz	IRNVBURRGGOSAC-ZFWWWQNUSA-N	0	3	302.484	2.216	10	0		DEAEHN
COC[C@@H](C)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000187087059	356212885	/nfs/dbraw/zinc/21/28/85/356212885.db2.gz	LXHHPXROKBOPSR-WFASDCNBSA-N	0	3	309.385	2.304	10	0		DEAEHN
COC[C@@H](C)CN1CCN(Cc2cc(OC)ccc2OC)CC1	ZINC000189549598	356215985	/nfs/dbraw/zinc/21/59/85/356215985.db2.gz	CPWAVVRRDIGNTN-HNNXBMFYSA-N	0	3	322.449	2.104	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H]2CCCO[C@@H]2CC(C)C)C1	ZINC000184678707	356196532	/nfs/dbraw/zinc/19/65/32/356196532.db2.gz	YDXULGSEOFAALO-ARFHVFGLSA-N	0	3	311.470	2.364	10	0		DEAEHN
NC[C@H]1c2ccccc2CCN1C(=O)c1ccncc1Cl	ZINC000227721060	356280304	/nfs/dbraw/zinc/28/03/04/356280304.db2.gz	BBZXTNBBYDFTPM-HNNXBMFYSA-N	0	3	301.777	2.433	10	0		DEAEHN
COC[C@H]1CCN([C@@H](CN)c2ccc(Br)cc2)C1	ZINC000081042132	192219786	/nfs/dbraw/zinc/21/97/86/192219786.db2.gz	VTLUUYDUTPMQIV-FZMZJTMJSA-N	0	3	313.239	2.417	10	0		DEAEHN
CC(C)=CCN[C@@H]1CCC(=O)N(C2CC2)[C@H]1c1ccnn1C	ZINC000284606977	356369591	/nfs/dbraw/zinc/36/95/91/356369591.db2.gz	RIDHZNXGRASBOU-RHSMWYFYSA-N	0	3	302.422	2.170	10	0		DEAEHN
CN(Cc1nc2ccccc2n1C)C[C@@H]1CCc2nccn2C1	ZINC000328625312	356462858	/nfs/dbraw/zinc/46/28/58/356462858.db2.gz	CYWZGNCTJLGYQB-AWEZNQCLSA-N	0	3	309.417	2.464	10	0		DEAEHN
C[C@H](c1nc(C2CC2)no1)N(C)C[C@@H]1CCc2nccn2C1	ZINC000328655569	356466605	/nfs/dbraw/zinc/46/66/05/356466605.db2.gz	YMCDIKDSUWZHIH-NEPJUHHUSA-N	0	3	301.394	2.399	10	0		DEAEHN
C[C@H](C(=O)OC(C)(C)C)N(C)C(=O)[C@H](C)N1CCCCCC1	ZINC000081450497	192268460	/nfs/dbraw/zinc/26/84/60/192268460.db2.gz	RNWOBPCDMMGDSM-UONOGXRCSA-N	0	3	312.454	2.440	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)Nc1ccc(Sc2nncn2C)cc1	ZINC000236912461	202066817	/nfs/dbraw/zinc/06/68/17/202066817.db2.gz	VXXJYYALBWJUAZ-GXFFZTMASA-N	0	3	319.434	2.278	10	0		DEAEHN
CC[C@@H](C)[C@H](N)C(=O)NCCNc1nc2ccccc2s1	ZINC000236927641	202075615	/nfs/dbraw/zinc/07/56/15/202075615.db2.gz	URDRIGXUHUGQGU-MFKMUULPSA-N	0	3	306.435	2.198	10	0		DEAEHN
COc1ccc([C@@H](N)[C@@H]2CCS(=O)(=O)C2)c2ccccc12	ZINC000086020163	192543931	/nfs/dbraw/zinc/54/39/31/192543931.db2.gz	NJLIDKSCHPLPKH-BZNIZROVSA-N	0	3	305.399	2.283	10	0		DEAEHN
OCCN1CCC(NCc2sccc2Br)CC1	ZINC000399218428	356721172	/nfs/dbraw/zinc/72/11/72/356721172.db2.gz	JPVOQACAZJHBKS-UHFFFAOYSA-N	0	3	319.268	2.057	10	0		DEAEHN
COC(=O)COc1c(C)cc(CN[C@@H]2CCCOC2)cc1C	ZINC000237173182	202175806	/nfs/dbraw/zinc/17/58/06/202175806.db2.gz	QEQPOGLHNBZFRC-OAHLLOKOSA-N	0	3	307.390	2.124	10	0		DEAEHN
CNCc1ccc(C)c(S(=O)(=O)NCc2cccs2)c1	ZINC000088974646	192677821	/nfs/dbraw/zinc/67/78/21/192677821.db2.gz	DOCFSVPFGFWQHW-UHFFFAOYSA-N	0	3	310.444	2.254	10	0		DEAEHN
CCOCCN1CCN(Cc2cnn3ccccc23)C[C@H]1CC	ZINC000179513613	199048393	/nfs/dbraw/zinc/04/83/93/199048393.db2.gz	QAJXHWUHLUBDMI-QGZVFWFLSA-N	0	3	316.449	2.267	10	0		DEAEHN
CC(C)(C)NC(=O)CN[C@H](c1ccc2c(c1)OCCO2)C1CC1	ZINC000179750537	199076436	/nfs/dbraw/zinc/07/64/36/199076436.db2.gz	RNFGJBUQJZILEM-KRWDZBQOSA-N	0	3	318.417	2.413	10	0		DEAEHN
CC(C)CSCCN[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000180205169	199130165	/nfs/dbraw/zinc/13/01/65/199130165.db2.gz	UDEXZVQOZZTJLI-GFCCVEGCSA-N	0	3	316.492	2.374	10	0		DEAEHN
CCCn1cc(C(=O)N[C@H](CN(C)C)c2ccccc2)cn1	ZINC000180564836	199176994	/nfs/dbraw/zinc/17/69/94/199176994.db2.gz	XSBSAGUMWJACCF-MRXNPFEDSA-N	0	3	300.406	2.326	10	0		DEAEHN
CCCc1ccccc1NC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000181150101	199257709	/nfs/dbraw/zinc/25/77/09/199257709.db2.gz	LJVWVWNQGIHUSS-OAHLLOKOSA-N	0	3	305.422	2.433	10	0		DEAEHN
C[C@H](CNC1CC1)S(=O)(=O)N1CCCCc2ccccc21	ZINC000089049758	192720452	/nfs/dbraw/zinc/72/04/52/192720452.db2.gz	WDHDSNJNBXQHSH-CYBMUJFWSA-N	0	3	308.447	2.300	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N(C)CC1CCN(C)CC1	ZINC000187780600	200155482	/nfs/dbraw/zinc/15/54/82/200155482.db2.gz	PUTYHBFOCVCSKT-UHFFFAOYSA-N	0	3	323.412	2.318	10	0		DEAEHN
CC(C)(C)OC(=O)CCN1C[C@@H](c2ccsc2)[C@H](CO)C1	ZINC000188093576	200193375	/nfs/dbraw/zinc/19/33/75/200193375.db2.gz	KRAFODBVZJBYRH-KBPBESRZSA-N	0	3	311.447	2.488	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ccnc(F)c1F	ZINC000189196374	200362799	/nfs/dbraw/zinc/36/27/99/200362799.db2.gz	VGAMDEHARBIFID-CYBMUJFWSA-N	0	3	319.355	2.263	10	0		DEAEHN
COC(=O)c1ccccc1OCCN1CC[C@H](C)[C@@H](OC)C1	ZINC000189372476	200388500	/nfs/dbraw/zinc/38/85/00/200388500.db2.gz	AHFPASWXBHKKFL-BBRMVZONSA-N	0	3	307.390	2.209	10	0		DEAEHN
CCc1ccc(S(=O)(=O)N[C@@H]2CNCC[C@@H]2C)cc1CC	ZINC000193407071	201047813	/nfs/dbraw/zinc/04/78/13/201047813.db2.gz	FADNSVRRSKQYMP-BLLLJJGKSA-N	0	3	310.463	2.088	10	0		DEAEHN
Cc1ncc(CNC[C@H]2CN(Cc3ccccc3)CCCO2)o1	ZINC000628252455	366782667	/nfs/dbraw/zinc/78/26/67/366782667.db2.gz	VUMHWAMOFUVHRF-SFHVURJKSA-N	0	3	315.417	2.364	10	0		DEAEHN
CCN(C)C(=O)CCN[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000611406206	361593062	/nfs/dbraw/zinc/59/30/62/361593062.db2.gz	VVKSDFGTOMRGRX-INIZCTEOSA-N	0	3	320.433	2.385	10	0		DEAEHN
Cc1nn(C)c(C)c1NC(=O)NC[C@H]1N(C)CCCC1(C)C	ZINC000448005273	239216519	/nfs/dbraw/zinc/21/65/19/239216519.db2.gz	UFSLQAJSCYJWKI-CYBMUJFWSA-N	0	3	307.442	2.279	10	0		DEAEHN
CC1(C)[C@H](NCc2cccc(S(C)(=O)=O)c2)[C@@H]2CCCO[C@@H]21	ZINC000449177921	240156683	/nfs/dbraw/zinc/15/66/83/240156683.db2.gz	WPJPELVLYWGYLF-XHSDSOJGSA-N	0	3	323.458	2.383	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)Nc1ccc(-c2c[nH]cn2)cc1	ZINC000091135100	193000990	/nfs/dbraw/zinc/00/09/90/193000990.db2.gz	NOMMCOIBOHWDKZ-CYBMUJFWSA-N	0	3	302.403	2.110	10	0		DEAEHN
CN1CCOC[C@H]1CNCc1cc(F)ccc1Br	ZINC000623712164	365141967	/nfs/dbraw/zinc/14/19/67/365141967.db2.gz	ZOWLQPOWOIPUPN-GFCCVEGCSA-N	0	3	317.202	2.008	10	0		DEAEHN
Cc1nc(NC(=O)c2cc[nH]c(=NN)c2)ccc1Br	ZINC000091508586	193067394	/nfs/dbraw/zinc/06/73/94/193067394.db2.gz	UUEAEYFXFYSAPX-UHFFFAOYSA-N	0	3	322.166	2.085	10	0		DEAEHN
Cc1nc(NC(=O)[C@@H](N)CC(C)C)ccc1Br	ZINC000091507176	193067454	/nfs/dbraw/zinc/06/74/54/193067454.db2.gz	IIQVLNXXJPKKTL-JTQLQIEISA-N	0	3	300.200	2.464	10	0		DEAEHN
CCS(=O)(=O)CCC[C@@H](O)C(C)(C)N1CCCCCC1	ZINC000091567703	193074904	/nfs/dbraw/zinc/07/49/04/193074904.db2.gz	YHENXZIMYDHXPL-CQSZACIVSA-N	0	3	305.484	2.217	10	0		DEAEHN
CC[C@@](C)([C@H](NC)c1cc(Cl)cnc1N)N1CCOCC1	ZINC000091612313	193079469	/nfs/dbraw/zinc/07/94/69/193079469.db2.gz	PYGMOOMRUARWFY-HIFRSBDPSA-N	0	3	312.845	2.079	10	0		DEAEHN
C[C@H](NC[C@H]1CN(C)CCO1)c1ccc(Br)s1	ZINC000091667433	193088597	/nfs/dbraw/zinc/08/85/97/193088597.db2.gz	FZBXFOIFCQQZPV-UWVGGRQHSA-N	0	3	319.268	2.492	10	0		DEAEHN
CC(C)C[C@H](C)NC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000091889032	193122299	/nfs/dbraw/zinc/12/22/99/193122299.db2.gz	OSLUCVNOGMFLAW-DLBZAZTESA-N	0	3	324.513	2.233	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2cc(CN)ccc2Cl)C[C@@H]1C	ZINC000092113467	193161216	/nfs/dbraw/zinc/16/12/16/193161216.db2.gz	JSHYZAAZYKZRBK-UWVGGRQHSA-N	0	3	302.827	2.075	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)c(F)c1	ZINC000092115492	193162928	/nfs/dbraw/zinc/16/29/28/193162928.db2.gz	PGGAUDAOKNPCDO-GFCCVEGCSA-N	0	3	314.426	2.356	10	0		DEAEHN
CCC[C@@H](C)N(C)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115706	193163375	/nfs/dbraw/zinc/16/33/75/193163375.db2.gz	KQSDVMQZTIZDOH-LLVKDONJSA-N	0	3	302.415	2.354	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N(C)C2CCCC2)c(F)c1	ZINC000092115598	193163517	/nfs/dbraw/zinc/16/35/17/193163517.db2.gz	DYYWAVDRSCZBMN-UHFFFAOYSA-N	0	3	314.426	2.498	10	0		DEAEHN
C1=CCN([C@H]2CCN(c3nccn4nc(C5CCC5)cc34)C2)C1	ZINC000631130199	368033646	/nfs/dbraw/zinc/03/36/46/368033646.db2.gz	GQBSUQFKVICGRO-HNNXBMFYSA-N	0	3	309.417	2.447	10	0		DEAEHN
O=C(N[C@@H]1CCOc2ccc(F)cc21)N1CCN2CCC[C@H]2C1	ZINC000247657959	284082058	/nfs/dbraw/zinc/08/20/58/284082058.db2.gz	YZEQHOMVXJTFHL-DZGCQCFKSA-N	0	3	319.380	2.139	10	0		DEAEHN
NC[C@@H](c1cc(Cl)cs1)N1CCN(c2ncccn2)CC1	ZINC000093095247	193203024	/nfs/dbraw/zinc/20/30/24/193203024.db2.gz	XXPGIWRGTXKCLV-LBPRGKRZSA-N	0	3	323.853	2.014	10	0		DEAEHN
COCCN([C@H](C)COC)[C@@H](CN)c1cc(Cl)cs1	ZINC000093095613	193203299	/nfs/dbraw/zinc/20/32/99/193203299.db2.gz	DJCZVQFSAZLMTC-PWSUYJOCSA-N	0	3	306.859	2.385	10	0		DEAEHN
CN1CCC2(CC1)CC(=O)NC(=O)[C@@H]2c1cccc(Cl)c1	ZINC000093170801	193211395	/nfs/dbraw/zinc/21/13/95/193211395.db2.gz	MEPZDEDNXAQTGB-AWEZNQCLSA-N	0	3	306.793	2.182	10	0		DEAEHN
CCOCCN(C)C[C@H](O)COCc1ccc(Cl)cc1	ZINC000093313878	193229520	/nfs/dbraw/zinc/22/95/20/193229520.db2.gz	NIRWTFJFEBUTGI-HNNXBMFYSA-N	0	3	301.814	2.186	10	0		DEAEHN
COc1cc(CN2C[C@H]3CCC[C@@H](C2)C3O)cc(OC)c1OC	ZINC000093479861	193257052	/nfs/dbraw/zinc/25/70/52/193257052.db2.gz	NYIBYMUYVMOYHS-VMZNBEPHSA-N	0	3	321.417	2.305	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1[C@H]1CCCN(C(C)C)C1=O	ZINC000248770262	284163532	/nfs/dbraw/zinc/16/35/32/284163532.db2.gz	SNOXGZGFXOLFEW-VGWMRTNUSA-N	0	3	322.449	2.192	10	0		DEAEHN
COc1cc(CN(C)CC2(O)CCCC2)cc2c1OCCO2	ZINC000093503054	193260101	/nfs/dbraw/zinc/26/01/01/193260101.db2.gz	MXUCGWDYJFBVLL-UHFFFAOYSA-N	0	3	307.390	2.203	10	0		DEAEHN
CCN[C@@]1(C(N)=O)CCC[C@H](N(CC(F)(F)F)C(C)C)C1	ZINC000093751258	193300188	/nfs/dbraw/zinc/30/01/88/193300188.db2.gz	RZWJRVIPBHTFBH-AAEUAGOBSA-N	0	3	309.376	2.035	10	0		DEAEHN
NC(=O)[C@@]1(N)CCC[C@H](Sc2ccc(C(F)(F)F)cn2)C1	ZINC000093777633	193305194	/nfs/dbraw/zinc/30/51/94/193305194.db2.gz	XXJHPCPYGRAJQC-JOYOIKCWSA-N	0	3	319.352	2.318	10	0		DEAEHN
CCN[C@@H](c1ccc(Cl)c(OC)c1)[C@H]1CN(C)CCN1C	ZINC000094009139	193338395	/nfs/dbraw/zinc/33/83/95/193338395.db2.gz	MYTSIOIJHPGMTE-ZBFHGGJFSA-N	0	3	311.857	2.245	10	0		DEAEHN
COC(=O)[C@@]1(NC2CC2)CC[C@@H](N(C)CCC(F)(F)F)C1	ZINC000093831846	193314406	/nfs/dbraw/zinc/31/44/06/193314406.db2.gz	IGQVLEAJDIDDBA-DGCLKSJQSA-N	0	3	308.344	2.087	10	0		DEAEHN
NC(=O)[C@@]1(N)CC[C@H](Sc2cccc(Br)c2)C1	ZINC000093852770	193319155	/nfs/dbraw/zinc/31/91/55/193319155.db2.gz	KAHMPLRQHCQHFP-CMPLNLGQSA-N	0	3	315.236	2.277	10	0		DEAEHN
NC(=O)[C@]1(NC2CC2)CC[C@@H](Sc2ncccc2Cl)C1	ZINC000093854119	193319900	/nfs/dbraw/zinc/31/99/00/193319900.db2.gz	JTUGHOBCIDXPEF-YGRLFVJLSA-N	0	3	311.838	2.356	10	0		DEAEHN
CC1(C)CCC[C@H](CN2CCN(c3nccs3)CC2)[C@@H]1O	ZINC000094289135	193356018	/nfs/dbraw/zinc/35/60/18/193356018.db2.gz	NNLXYGUMCZTBJS-KGLIPLIRSA-N	0	3	309.479	2.452	10	0		DEAEHN
CC1(C)CCC[C@@H]1NS(=O)(=O)c1ccc(F)c(CN)c1	ZINC000094326153	193359468	/nfs/dbraw/zinc/35/94/68/193359468.db2.gz	FAZCRAIAMDEISE-ZDUSSCGKSA-N	0	3	300.399	2.141	10	0		DEAEHN
CC[C@@H](C)NC(=O)[C@@H](C)Oc1c(F)cc(CNC)cc1F	ZINC000094346448	193363311	/nfs/dbraw/zinc/36/33/11/193363311.db2.gz	WLGKNTHAISUGCG-NXEZZACHSA-N	0	3	300.349	2.366	10	0		DEAEHN
CS(=O)(=O)CCCOc1c(F)cc(CNC2CC2)cc1F	ZINC000094347673	193363614	/nfs/dbraw/zinc/36/36/14/193363614.db2.gz	QNOIURALQUTGAT-UHFFFAOYSA-N	0	3	319.373	2.030	10	0		DEAEHN
CCNCc1cc(F)c(OCC(=O)N(CC)CC)c(F)c1	ZINC000094346985	193363816	/nfs/dbraw/zinc/36/38/16/193363816.db2.gz	HFRDUCWOJLVDAC-UHFFFAOYSA-N	0	3	300.349	2.322	10	0		DEAEHN
CCNC(C)(C)C(=O)Nc1cc(C)c(Br)cn1	ZINC000094063500	193342239	/nfs/dbraw/zinc/34/22/39/193342239.db2.gz	UCXSJYYARQTNJV-UHFFFAOYSA-N	0	3	300.200	2.479	10	0		DEAEHN
CCOC(=O)COC[C@@H](N)c1ccc(F)c(Br)c1	ZINC000094071863	193343609	/nfs/dbraw/zinc/34/36/09/193343609.db2.gz	WEXSBFWLLPEXCO-LLVKDONJSA-N	0	3	320.158	2.168	10	0		DEAEHN
CCC(N)(CC)C(=O)N1CCCN(Cc2cccs2)CC1	ZINC000094244648	193354418	/nfs/dbraw/zinc/35/44/18/193354418.db2.gz	HWPZLHBCHIVGGR-UHFFFAOYSA-N	0	3	309.479	2.300	10	0		DEAEHN
CCCN[C@H](c1cnccn1)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094641832	193389052	/nfs/dbraw/zinc/38/90/52/193389052.db2.gz	NKAXDFXMYHNOKM-IPYPFGDCSA-N	0	3	311.451	2.121	10	0		DEAEHN
COCCNCc1cc(Cl)c(O[C@H](C)[C@@H](C)O)c(OC)c1	ZINC000094653296	193390968	/nfs/dbraw/zinc/39/09/68/193390968.db2.gz	AXZFTRKWMSQCKC-GHMZBOCLSA-N	0	3	317.813	2.233	10	0		DEAEHN
CCOC(=O)[C@@]1(NCCN(CC)CC)CCCS[C@H]1C	ZINC000094479800	193373124	/nfs/dbraw/zinc/37/31/24/193373124.db2.gz	QPBOANDXGQXIIY-DZGCQCFKSA-N	0	3	302.484	2.135	10	0		DEAEHN
CN(C[C@H]1CCCN1C)c1nc(Br)cn2ccnc12	ZINC000094491367	193373277	/nfs/dbraw/zinc/37/32/77/193373277.db2.gz	RXXWEQCGRNUGJW-SNVBAGLBSA-N	0	3	324.226	2.022	10	0		DEAEHN
CN(CCNC(=O)c1cc(C(F)(F)F)ccc1N)C1CC1	ZINC000094596155	193382377	/nfs/dbraw/zinc/38/23/77/193382377.db2.gz	MGCVLPWNVHMSIP-UHFFFAOYSA-N	0	3	301.312	2.112	10	0		DEAEHN
CCN[C@H](C)c1cc(F)c(C)cc1N(C)CCS(C)(=O)=O	ZINC000094767022	193396075	/nfs/dbraw/zinc/39/60/75/193396075.db2.gz	LNXXOLWVYSHWBQ-GFCCVEGCSA-N	0	3	316.442	2.285	10	0		DEAEHN
CC[C@@H](CO)[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000020194433	182196308	/nfs/dbraw/zinc/19/63/08/182196308.db2.gz	NAOCUGPGCOVODP-VIFPVBQESA-N	0	3	304.184	2.024	10	0		DEAEHN
CC(C)(CNCc1ccc(Br)c(F)c1)OCCO	ZINC000288564850	220242119	/nfs/dbraw/zinc/24/21/19/220242119.db2.gz	ZALQPMRPIDFGTI-UHFFFAOYSA-N	0	3	320.202	2.465	10	0		DEAEHN
COC[C@@H](NC(=O)N(C)[C@H]1CCN(C(C)C)C1)c1ccccc1	ZINC000458247535	248231005	/nfs/dbraw/zinc/23/10/05/248231005.db2.gz	XPSMDMGDAPSMOC-DLBZAZTESA-N	0	3	319.449	2.498	10	0		DEAEHN
COC[C@H](Cc1ccccc1)NCCNC(=O)c1ccccc1	ZINC000162531339	291682226	/nfs/dbraw/zinc/68/22/26/291682226.db2.gz	ZSOBGHFFTUGFEM-SFHVURJKSA-N	0	3	312.413	2.264	10	0		DEAEHN
CCN1CCN(CCNc2ccccc2Br)CC1	ZINC000041563173	183203173	/nfs/dbraw/zinc/20/31/73/183203173.db2.gz	QNOXJEDEONNRPZ-UHFFFAOYSA-N	0	3	312.255	2.499	10	0		DEAEHN
COC[C@@H](C)N(C)[C@@H](CN)c1cc(Br)cs1	ZINC000042517764	183279445	/nfs/dbraw/zinc/27/94/45/183279445.db2.gz	KVZYMVOIIKBHTF-SCZZXKLOSA-N	0	3	307.257	2.477	10	0		DEAEHN
C[C@H](CN1CCCC1)NC(=O)c1cncc(Br)c1	ZINC000042371206	183260494	/nfs/dbraw/zinc/26/04/94/183260494.db2.gz	VMLRUMRFJJJYRT-SNVBAGLBSA-N	0	3	312.211	2.058	10	0		DEAEHN
CCN1CCC(N(C)c2ncc(Br)cc2N)CC1	ZINC000042614931	183291238	/nfs/dbraw/zinc/29/12/38/183291238.db2.gz	ZMMNMAQZUKHGAB-UHFFFAOYSA-N	0	3	313.243	2.347	10	0		DEAEHN
CC(C)CN(CCN(C)C)c1ncc(Br)cc1N	ZINC000042740830	183303656	/nfs/dbraw/zinc/30/36/56/183303656.db2.gz	HSNINYRWWPUEKD-UHFFFAOYSA-N	0	3	315.259	2.450	10	0		DEAEHN
CN(Cc1cscn1)[C@@H](CN)c1ccc2c(c1)OCCO2	ZINC000042862343	183314886	/nfs/dbraw/zinc/31/48/86/183314886.db2.gz	RELIQRHDLLRFQS-ZDUSSCGKSA-N	0	3	305.403	2.046	10	0		DEAEHN
CS(=O)(=O)c1ccc(O[C@H](CN)c2ccc(F)cc2)cc1	ZINC000042942554	183319837	/nfs/dbraw/zinc/31/98/37/183319837.db2.gz	ZXHIKFDSZQOEPE-OAHLLOKOSA-N	0	3	309.362	2.308	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)NCc1cccc(OCCN(C)C)c1	ZINC000043068006	183333321	/nfs/dbraw/zinc/33/33/21/183333321.db2.gz	ZGMCBFGDDVYOFY-AWEZNQCLSA-N	0	3	307.438	2.471	10	0		DEAEHN
NC[C@H](c1ccc(Br)s1)N1CCC(CO)CC1	ZINC000043259487	183349210	/nfs/dbraw/zinc/34/92/10/183349210.db2.gz	ZQOPPFBXSZPRBO-SNVBAGLBSA-N	0	3	319.268	2.215	10	0		DEAEHN
CN(C[C@@H]1CCN(C)C1)C(=O)c1coc(Br)c1	ZINC000104502068	194011860	/nfs/dbraw/zinc/01/18/60/194011860.db2.gz	GSOJZVHQMLYHHD-SECBINFHSA-N	0	3	301.184	2.066	10	0		DEAEHN
COc1ccc(OCCN2CCC[C@@H](n3cncn3)C2)cc1	ZINC000105898055	194163285	/nfs/dbraw/zinc/16/32/85/194163285.db2.gz	FJSDHCOBLKUDNU-CQSZACIVSA-N	0	3	302.378	2.003	10	0		DEAEHN
C[C@H](NC[C@@H]1CN(C)CCO1)c1ccc(OC(F)F)cc1	ZINC000105932386	194173048	/nfs/dbraw/zinc/17/30/48/194173048.db2.gz	RCCTTWJFWLFVMT-SMDDNHRTSA-N	0	3	300.349	2.269	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc3c(c2)OCCO3)CCN1CCOC	ZINC000106112999	194187835	/nfs/dbraw/zinc/18/78/35/194187835.db2.gz	MJOUOGGHBSGQOG-MRXNPFEDSA-N	0	3	320.433	2.000	10	0		DEAEHN
COc1cc(CNC[C@@H]2CN(C3CC3)CCO2)ccc1SC	ZINC000106380411	194204239	/nfs/dbraw/zinc/20/42/39/194204239.db2.gz	BYVJGPYYDDQWBL-OAHLLOKOSA-N	0	3	322.474	2.370	10	0		DEAEHN
O=S(=O)(C[C@@H]1CCC[NH2+]1)[N-]c1ccc(Cl)cc1Cl	ZINC000049640684	183749998	/nfs/dbraw/zinc/74/99/98/183749998.db2.gz	CYFJOAKFWMZQHX-VIFPVBQESA-N	0	3	309.218	2.487	10	0		DEAEHN
CCNc1ccc(Cl)c(C(=O)N[C@H](C)CN2CCCC2)n1	ZINC000050787856	183803650	/nfs/dbraw/zinc/80/36/50/183803650.db2.gz	ARHKADZYOWBBFK-LLVKDONJSA-N	0	3	310.829	2.381	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cscc1Br	ZINC000285453239	218446370	/nfs/dbraw/zinc/44/63/70/218446370.db2.gz	GLANGWLQWPUOSB-QMMMGPOBSA-N	0	3	303.225	2.335	10	0		DEAEHN
COCC[C@@H](N)C(=O)Nc1ccc(C)c(Br)c1	ZINC000109436527	194263331	/nfs/dbraw/zinc/26/33/31/194263331.db2.gz	SCQRMTLJCSAMRD-LLVKDONJSA-N	0	3	301.184	2.060	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)c1cccnc1N1CCCC1	ZINC000046859831	296312477	/nfs/dbraw/zinc/31/24/77/296312477.db2.gz	NYFAOBZSECKMBF-OAHLLOKOSA-N	0	3	316.449	2.286	10	0		DEAEHN
CC[C@H](C(N)=S)N1CCN(CCCc2ccccc2)CC1	ZINC000110460812	194332499	/nfs/dbraw/zinc/33/24/99/194332499.db2.gz	CGSBCIYLKACXKB-MRXNPFEDSA-N	0	3	305.491	2.302	10	0		DEAEHN
CC(C)CNCc1c(Cl)cccc1N1CCNC(=O)[C@@H]1C	ZINC000110662293	194347855	/nfs/dbraw/zinc/34/78/55/194347855.db2.gz	SRNKVOSNIUNHDQ-LBPRGKRZSA-N	0	3	309.841	2.410	10	0		DEAEHN
C[C@@H]1CN(CCNc2cccc(Br)c2)CCN1C	ZINC000110756317	194357052	/nfs/dbraw/zinc/35/70/52/194357052.db2.gz	HUFRCDOCSWMNNN-GFCCVEGCSA-N	0	3	312.255	2.497	10	0		DEAEHN
CN(CC1CCOCC1)c1ncc(Br)cc1CN	ZINC000111174419	194398412	/nfs/dbraw/zinc/39/84/12/194398412.db2.gz	YGHUFXCJWGQCAM-UHFFFAOYSA-N	0	3	314.227	2.166	10	0		DEAEHN
Cc1cc(F)ccc1S(=O)(=O)NCc1ccccc1CN	ZINC000061841354	184189379	/nfs/dbraw/zinc/18/93/79/184189379.db2.gz	LTDQLABZAPNAFN-UHFFFAOYSA-N	0	3	308.378	2.071	10	0		DEAEHN
CN(CCOCC(F)(F)F)Cc1cccc(C(N)=S)c1	ZINC000061942466	184197208	/nfs/dbraw/zinc/19/72/08/184197208.db2.gz	JGXSWNPTPMXNIK-UHFFFAOYSA-N	0	3	306.353	2.332	10	0		DEAEHN
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)[C@H](C)N1CCNCC1	ZINC000062010859	184201431	/nfs/dbraw/zinc/20/14/31/184201431.db2.gz	GIIVCESMCULOGZ-OLZOCXBDSA-N	0	3	309.841	2.153	10	0		DEAEHN
NCc1cc2ccccc2n(CCOCC(F)(F)F)c1=O	ZINC000062336510	184230864	/nfs/dbraw/zinc/23/08/64/184230864.db2.gz	KYCVREMQMOJYLP-UHFFFAOYSA-N	0	3	300.280	2.039	10	0		DEAEHN
COCCNCc1ccc(OCc2ncc(Cl)n2C)cc1	ZINC000062729127	184250756	/nfs/dbraw/zinc/25/07/56/184250756.db2.gz	OEXTWQBYEXEMPK-UHFFFAOYSA-N	0	3	309.797	2.389	10	0		DEAEHN
NCc1ccccc1S(=O)(=O)N1CCC2(CCCC2)CC1	ZINC000062955467	184262556	/nfs/dbraw/zinc/26/25/56/184262556.db2.gz	LZLOWUFILUBLGW-UHFFFAOYSA-N	0	3	308.447	2.490	10	0		DEAEHN
CN[C@@H](CCSc1ccccc1Br)C(N)=O	ZINC000062597129	184245212	/nfs/dbraw/zinc/24/52/12/184245212.db2.gz	KZTAQUXREDLOAL-VIFPVBQESA-N	0	3	303.225	2.005	10	0		DEAEHN
CCN(CC)[C@H](CNCCCS(C)(=O)=O)c1ccccc1	ZINC000063014742	184266903	/nfs/dbraw/zinc/26/69/03/184266903.db2.gz	FCDBQKYVYMEOBU-MRXNPFEDSA-N	0	3	312.479	2.094	10	0		DEAEHN
COCCN1CC[C@@H](CNc2ccc(C(F)(F)F)cn2)C1	ZINC000301125290	532972962	/nfs/dbraw/zinc/97/29/62/532972962.db2.gz	XYYHIOCEMIWQFM-NSHDSACASA-N	0	3	303.328	2.481	10	0		DEAEHN
Cc1nn(C)c(C)c1NC(=O)N1CCCN(C(C)(C)C)CC1	ZINC000537885885	285019938	/nfs/dbraw/zinc/01/99/38/285019938.db2.gz	SRIGDGSQVJNKAF-UHFFFAOYSA-N	0	3	307.442	2.375	10	0		DEAEHN
CC(C)N(CC(=O)NCCOc1ccccc1)C1CCOCC1	ZINC000119631915	195006776	/nfs/dbraw/zinc/00/67/76/195006776.db2.gz	KILCUNPSAXFYGS-UHFFFAOYSA-N	0	3	320.433	2.071	10	0		DEAEHN
C[C@@H](N[C@H]1CCN(c2ncccc2Cl)C1)c1cnn(C)c1	ZINC000119968291	195071606	/nfs/dbraw/zinc/07/16/06/195071606.db2.gz	WQEGHWMUNACSAU-YPMHNXCESA-N	0	3	305.813	2.398	10	0		DEAEHN
CCC[C@@H](N)C(=O)N1CCC([C@@H](O)c2ccc(F)cc2)CC1	ZINC000159288898	197343459	/nfs/dbraw/zinc/34/34/59/197343459.db2.gz	BGDGZGXIFMPOGF-CVEARBPZSA-N	0	3	308.397	2.225	10	0		DEAEHN
CC[C@H]1CN[C@H](c2ccccc2)CN1C1CCS(=O)CC1	ZINC000159195497	197335508	/nfs/dbraw/zinc/33/55/08/197335508.db2.gz	RWFRRTJKZAFQBW-CLIJALBYSA-N	0	3	306.475	2.323	10	0		DEAEHN
CC[C@@H]1CCC[NH2+][C@@H]1C[N-]S(=O)(=O)c1ccc(F)cc1F	ZINC000158998739	197318273	/nfs/dbraw/zinc/31/82/73/197318273.db2.gz	YNIPKEIWVQGVNJ-ZWNOBZJWSA-N	0	3	318.389	2.021	10	0		DEAEHN
CN[C@H](Cc1cc(Br)ccc1OC)c1cn[nH]n1	ZINC000158848608	197306407	/nfs/dbraw/zinc/30/64/07/197306407.db2.gz	IXEJMRNQWOPOMI-SNVBAGLBSA-N	0	3	311.183	2.079	10	0		DEAEHN
NCc1cc(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)ccc1Cl	ZINC000158757653	197299514	/nfs/dbraw/zinc/29/95/14/197299514.db2.gz	XFCKWHDQTRNYHT-PHIMTYICSA-N	0	3	314.838	2.219	10	0		DEAEHN
CCN[C@H](CS(=O)(=O)c1ccccc1Cl)[C@@H]1CCOC1	ZINC000158718918	197296319	/nfs/dbraw/zinc/29/63/19/197296319.db2.gz	RGULCPGHJQQHPM-DGCLKSJQSA-N	0	3	317.838	2.128	10	0		DEAEHN
CCN[C@@H](CS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CCOC1	ZINC000158714550	197296350	/nfs/dbraw/zinc/29/63/50/197296350.db2.gz	JXRAFVZOCSBSEL-RISCZKNCSA-N	0	3	317.838	2.128	10	0		DEAEHN
CCCNc1nc(N(C)C)nc(N2CCS[C@@H](CC)C2)n1	ZINC000158473026	197276466	/nfs/dbraw/zinc/27/64/66/197276466.db2.gz	CFUGQGGORZVEPP-NSHDSACASA-N	0	3	310.471	2.091	10	0		DEAEHN
CCCn1ncc(Br)c1[C@H](O)C(C)(C)N(C)C	ZINC000157586222	197199854	/nfs/dbraw/zinc/19/98/54/197199854.db2.gz	MDUWLJVDVLLATI-NSHDSACASA-N	0	3	304.232	2.429	10	0		DEAEHN
Cc1cc(Nc2ccc(C(N)=O)cc2)c(C(N)=S)c(C)n1	ZINC000156613535	197127526	/nfs/dbraw/zinc/12/75/26/197127526.db2.gz	RJPDRTMQDBRTPT-UHFFFAOYSA-N	0	3	300.387	2.175	10	0		DEAEHN
CCC[C@@H](C(=O)NCCN1c2ccccc2C[C@@H]1C)N(C)C	ZINC000155118065	197023816	/nfs/dbraw/zinc/02/38/16/197023816.db2.gz	SNAFZYAKDNWSFO-YOEHRIQHSA-N	0	3	303.450	2.284	10	0		DEAEHN
CCC[C@H](C(=O)NCCN1c2ccccc2C[C@@H]1C)N(C)C	ZINC000155118169	197023971	/nfs/dbraw/zinc/02/39/71/197023971.db2.gz	SNAFZYAKDNWSFO-WMLDXEAASA-N	0	3	303.450	2.284	10	0		DEAEHN
CC(C)N(CCc1nccs1)C(=O)NC1CCN(C)CC1	ZINC000154975344	197009577	/nfs/dbraw/zinc/00/95/77/197009577.db2.gz	PKZZPMKAYDFWHN-UHFFFAOYSA-N	0	3	310.467	2.200	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1C	ZINC000120495165	195178757	/nfs/dbraw/zinc/17/87/57/195178757.db2.gz	AVMKDGWCMDJIGB-ZBFHGGJFSA-N	0	3	317.433	2.183	10	0		DEAEHN
Cc1cc(F)ccc1NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000120498009	195178891	/nfs/dbraw/zinc/17/88/91/195178891.db2.gz	GITUDKJEWVFVEB-TZMCWYRMSA-N	0	3	321.396	2.014	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2cccc3c2OC(C)(C)C3)C[C@H]1C	ZINC000120606606	195200208	/nfs/dbraw/zinc/20/02/08/195200208.db2.gz	OMNOOIAXVPTYOB-HUUCEWRRSA-N	0	3	318.461	2.287	10	0		DEAEHN
O=C([C@@H]1CN(Cc2ccccc2)C[C@@H]2OCC[C@@H]21)N1CCCC1	ZINC000247805404	257117935	/nfs/dbraw/zinc/11/79/35/257117935.db2.gz	ZBTWXTHTPWRENF-KURKYZTESA-N	0	3	314.429	2.146	10	0		DEAEHN
O=C1C[C@@H]2[C@H](CCN2Cc2ccc3c(c2)OCO3)N1CC1CC1	ZINC000247812804	257118575	/nfs/dbraw/zinc/11/85/75/257118575.db2.gz	BLVSXCMKVORHCY-LSDHHAIUSA-N	0	3	314.385	2.001	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N(C[C@H]1CCOC1)C1CC1	ZINC000121641687	195322304	/nfs/dbraw/zinc/32/23/04/195322304.db2.gz	GQLUEDDTYQSCSQ-HUUCEWRRSA-N	0	3	311.470	2.173	10	0		DEAEHN
C[C@@H](NCc1ccn(C)n1)c1ccc(OCCN(C)C)cc1	ZINC000358243147	133130555	/nfs/dbraw/zinc/13/05/55/133130555.db2.gz	WONLCIUBSXUTSJ-CQSZACIVSA-N	0	3	302.422	2.211	10	0		DEAEHN
C[C@@H](CC1CCOCC1)NCc1cccc(N2CCOCC2)n1	ZINC000360010126	133156800	/nfs/dbraw/zinc/15/68/00/133156800.db2.gz	DRAMJIGXPWVUCR-HNNXBMFYSA-N	0	3	319.449	2.213	10	0		DEAEHN
C[C@H](CC1CCOCC1)NCc1cccc(N2CCOCC2)n1	ZINC000360010127	133157123	/nfs/dbraw/zinc/15/71/23/133157123.db2.gz	DRAMJIGXPWVUCR-OAHLLOKOSA-N	0	3	319.449	2.213	10	0		DEAEHN
C[C@@H]1C[C@@H]1CNC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000360430294	133181536	/nfs/dbraw/zinc/18/15/36/133181536.db2.gz	PGUDDGAWAZSUHW-SRABZTEZSA-N	0	3	301.434	2.462	10	0		DEAEHN
Cc1scc(C(=O)NC2CCN([C@@H]3CCOC3)CC2)c1C	ZINC000362032070	133206613	/nfs/dbraw/zinc/20/66/13/133206613.db2.gz	IEFYPMSOGHNIRJ-CQSZACIVSA-N	0	3	308.447	2.348	10	0		DEAEHN
CO[C@H](CNC(=O)CC1CCN(C)CC1)c1ccc(F)cc1	ZINC000362868192	133256240	/nfs/dbraw/zinc/25/62/40/133256240.db2.gz	OBXZUFLWWGEHDA-MRXNPFEDSA-N	0	3	308.397	2.361	10	0		DEAEHN
Cc1n[nH]cc1CN1CCC[C@H](Cc2nnc3ccccn32)C1	ZINC000368656525	133282705	/nfs/dbraw/zinc/28/27/05/133282705.db2.gz	YDQQIQTYKWGJBU-CQSZACIVSA-N	0	3	310.405	2.216	10	0		DEAEHN
C=Cn1cc(CN[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)cn1	ZINC000376450135	133294935	/nfs/dbraw/zinc/29/49/35/133294935.db2.gz	SOLMYHCZNFFFNE-CVEARBPZSA-N	0	3	302.422	2.254	10	0		DEAEHN
Cc1ccncc1CN[C@H]1CCCN(c2ccccc2C(N)=O)C1	ZINC000373005321	133374158	/nfs/dbraw/zinc/37/41/58/133374158.db2.gz	YDQXBFJBPZBHMA-INIZCTEOSA-N	0	3	324.428	2.248	10	0		DEAEHN
Cc1ccc(C)c(S(=O)(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000246087817	292087825	/nfs/dbraw/zinc/08/78/25/292087825.db2.gz	GHXZRRHBLGDMSA-CABCVRRESA-N	0	3	310.463	2.310	10	0		DEAEHN
CC(C)C[C@H](CO)N(C)C(=O)NC[C@@H](C)N1CCC(C)CC1	ZINC000188534966	145013419	/nfs/dbraw/zinc/01/34/19/145013419.db2.gz	GUBXVEZLMHASEW-HZPDHXFCSA-N	0	3	313.486	2.155	10	0		DEAEHN
Oc1ccc(N2CCN(C[C@@H](O)CC3CCCC3)CC2)cc1	ZINC000191221630	145054640	/nfs/dbraw/zinc/05/46/40/145054640.db2.gz	KXAHDTKNLSVAMA-SFHVURJKSA-N	0	3	304.434	2.455	10	0		DEAEHN
Cc1ccc(CN[C@@H]2CCCOC2)c(-n2cc(Cl)cn2)n1	ZINC000191533867	145060387	/nfs/dbraw/zinc/06/03/87/145060387.db2.gz	YGVOIVJSVHQCBE-CQSZACIVSA-N	0	3	306.797	2.498	10	0		DEAEHN
Cc1csc2c1ncnc2NCCCN1CCC(O)CC1	ZINC000192513881	145074530	/nfs/dbraw/zinc/07/45/30/145074530.db2.gz	SUAXGSDUQGZCIV-UHFFFAOYSA-N	0	3	306.435	2.258	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCC[C@@H]1c1c(C)nn(C)c1C	ZINC000193379749	145085824	/nfs/dbraw/zinc/08/58/24/145085824.db2.gz	CIXMKQYUSZUPNQ-JKSUJKDBSA-N	0	3	309.454	2.351	10	0		DEAEHN
C[C@H]1CN(CCOc2cccc(Cl)c2)C[C@H]1N1CCOCC1	ZINC000246129231	145093235	/nfs/dbraw/zinc/09/32/35/145093235.db2.gz	MCXNOXXKJRFKSP-WMLDXEAASA-N	0	3	324.852	2.371	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1OCCNC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000246141945	145093343	/nfs/dbraw/zinc/09/33/43/145093343.db2.gz	JONUNPZVCDKNJE-BRWVUGGUSA-N	0	3	321.465	2.237	10	0		DEAEHN
CCOCCNC(=O)CN1C[C@H](c2ccccc2C)C[C@H]1C	ZINC000246292544	145097263	/nfs/dbraw/zinc/09/72/63/145097263.db2.gz	AKBPIDQXEACMAT-HZPDHXFCSA-N	0	3	304.434	2.326	10	0		DEAEHN
CCc1ccccc1NC(=O)C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000246344993	145099212	/nfs/dbraw/zinc/09/92/12/145099212.db2.gz	HFZVNUPRDXTYTJ-CJNGLKHVSA-N	0	3	317.433	2.032	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c(C)c1	ZINC000246434416	145102563	/nfs/dbraw/zinc/10/25/63/145102563.db2.gz	NJWHEPIBONSMFY-ZBFHGGJFSA-N	0	3	317.433	2.087	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCN2CCC[C@H]2C1)N(C)c1ccccc1	ZINC000246691724	145111006	/nfs/dbraw/zinc/11/10/06/145111006.db2.gz	AJBZHONDXWZRAQ-RDJZCZTQSA-N	0	3	316.449	2.001	10	0		DEAEHN
COc1ccc(OCCN2CCS[C@H]3COCC[C@H]32)cc1	ZINC000246720187	145112253	/nfs/dbraw/zinc/11/22/53/145112253.db2.gz	FSWIDOJHAZCCOY-CVEARBPZSA-N	0	3	309.431	2.280	10	0		DEAEHN
C[C@@H](NC(=O)CN1CCN2CCC[C@H]2C1)c1ccc(Cl)cc1	ZINC000246751560	145113302	/nfs/dbraw/zinc/11/33/02/145113302.db2.gz	XMEFICWUWBLAFF-CJNGLKHVSA-N	0	3	321.852	2.297	10	0		DEAEHN
O=C(CCN1CCS[C@H]2COCC[C@H]21)Nc1ccccc1F	ZINC000246907126	145119299	/nfs/dbraw/zinc/11/92/99/145119299.db2.gz	MMLJXZBUSGJLHG-CABCVRRESA-N	0	3	324.421	2.361	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)[C@H]2C[C@H]2c2cccc(Cl)c2)CCO1	ZINC000246914643	145119343	/nfs/dbraw/zinc/11/93/43/145119343.db2.gz	HONIGCODNCXWFP-PMPSAXMXSA-N	0	3	322.836	2.233	10	0		DEAEHN
C[C@H](C(=O)Nc1c(F)cccc1F)N1CCN2CCC[C@H]2C1	ZINC000247021562	145124033	/nfs/dbraw/zinc/12/40/33/145124033.db2.gz	CRDLERLYOSLBCJ-NEPJUHHUSA-N	0	3	309.360	2.072	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)[C@H](C)Sc2ccccn2)C1	ZINC000247044815	145124134	/nfs/dbraw/zinc/12/41/34/145124134.db2.gz	IDAMVOPVYAMWHF-HZSPNIEDSA-N	0	3	307.463	2.407	10	0		DEAEHN
Cc1cccc(C)c1OCCCN1CCN(C[C@H](C)O)[C@H](C)C1	ZINC000247102172	145126329	/nfs/dbraw/zinc/12/63/29/145126329.db2.gz	VAPAZGQYKDLBOZ-MSOLQXFVSA-N	0	3	320.477	2.459	10	0		DEAEHN
Fc1ccc(-c2noc(CN3CCN4CCC[C@H]4C3)n2)cc1	ZINC000247123547	145127105	/nfs/dbraw/zinc/12/71/05/145127105.db2.gz	JVPJYNOALGGJGR-AWEZNQCLSA-N	0	3	302.353	2.156	10	0		DEAEHN
CC[C@H]1CN(CCCOc2ccccc2)CCN1C[C@H](C)O	ZINC000247196918	145129102	/nfs/dbraw/zinc/12/91/02/145129102.db2.gz	OQNBXYLOEBMZOT-IRXDYDNUSA-N	0	3	306.450	2.233	10	0		DEAEHN
Cc1cccc(NC(=O)[C@@H](C)N2CCN3CCC[C@H]3C2)c1C	ZINC000247247829	145130623	/nfs/dbraw/zinc/13/06/23/145130623.db2.gz	SVTIBTMRZGRSNP-CVEARBPZSA-N	0	3	301.434	2.410	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)/C=C/c1ccccc1	ZINC000247322487	145133512	/nfs/dbraw/zinc/13/35/12/145133512.db2.gz	OSVVPTLARKRONN-ASVHUPRUSA-N	0	3	306.431	2.156	10	0		DEAEHN
Cc1nn(CC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c(C)c1Cl	ZINC000247433987	145137227	/nfs/dbraw/zinc/13/72/27/145137227.db2.gz	OWXXZVMGIKRTNI-GWCFXTLKSA-N	0	3	312.845	2.094	10	0		DEAEHN
C[C@@H]1CN(C2CCN(C[C@@](C)(O)c3ccccc3)CC2)CCO1	ZINC000247577615	145141559	/nfs/dbraw/zinc/14/15/59/145141559.db2.gz	IALSCYWQBDDHBA-VQIMIIECSA-N	0	3	318.461	2.079	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCC(F)(F)F	ZINC000248391966	145152647	/nfs/dbraw/zinc/15/26/47/145152647.db2.gz	JVUPWCOPTWRVFB-DGCLKSJQSA-N	0	3	315.339	2.368	10	0		DEAEHN
COc1ccc(C)nc1NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000248766472	145167594	/nfs/dbraw/zinc/16/75/94/145167594.db2.gz	GZNZCHMZZRSZFT-QWHCGFSZSA-N	0	3	306.410	2.345	10	0		DEAEHN
C[C@@H](CNC(=O)[C@H](C)N[C@H](C)[C@H]1CCCO1)c1ccccc1	ZINC000248862409	145170537	/nfs/dbraw/zinc/17/05/37/145170537.db2.gz	WHGWVCOTIXPIIR-QSJFSLAZSA-N	0	3	304.434	2.452	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccnn2[C@H](C)C2CC2)C1	ZINC000249462962	145184955	/nfs/dbraw/zinc/18/49/55/145184955.db2.gz	RIASGNARPSUPNH-TZMCWYRMSA-N	0	3	305.426	2.460	10	0		DEAEHN
CN(C(=O)c1ccc(N)cn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000261546047	145206941	/nfs/dbraw/zinc/20/69/41/145206941.db2.gz	KQECRRJLQXXVQT-INIZCTEOSA-N	0	3	310.401	2.010	10	0		DEAEHN
N[C@H](C(=O)Nc1ccc(Br)cc1)C1CCOCC1	ZINC000261772367	145225333	/nfs/dbraw/zinc/22/53/33/145225333.db2.gz	FUAJKEFDVSIGPU-LBPRGKRZSA-N	0	3	313.195	2.142	10	0		DEAEHN
c1cn(-c2ccccc2)nc1CN1CCNC[C@@H]1c1cccnc1	ZINC000261794989	145227123	/nfs/dbraw/zinc/22/71/23/145227123.db2.gz	QLUYTPHNNHCGGA-LJQANCHMSA-N	0	3	319.412	2.414	10	0		DEAEHN
NC1(C(=O)Nc2cc(C3CCCCCC3)[nH]n2)CCOCC1	ZINC000261869691	145236149	/nfs/dbraw/zinc/23/61/49/145236149.db2.gz	NYIUZTQLSBREQJ-UHFFFAOYSA-N	0	3	306.410	2.294	10	0		DEAEHN
Cc1[nH]c2ccc(CNC(=O)[C@@H](N)C3CCOCC3)cc2c1C	ZINC000262048130	145256810	/nfs/dbraw/zinc/25/68/10/145256810.db2.gz	QSEIFRLOSBYLFE-KRWDZBQOSA-N	0	3	315.417	2.155	10	0		DEAEHN
CC1CCC(CNC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)CC1	ZINC000262465995	145285857	/nfs/dbraw/zinc/28/58/57/145285857.db2.gz	IVTKFTLGZOMEPF-PTALEHFISA-N	0	3	308.466	2.461	10	0		DEAEHN
Cc1cnc([C@H](C)NC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)s1	ZINC000262495034	145288086	/nfs/dbraw/zinc/28/80/86/145288086.db2.gz	LGWOGNZSLRMLFV-CENBSLRLSA-N	0	3	323.462	2.161	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)NCc1cccc(Cl)c1	ZINC000262537325	145291363	/nfs/dbraw/zinc/29/13/63/145291363.db2.gz	QMLSSGFYHNOWSA-VBQJREDUSA-N	0	3	322.836	2.489	10	0		DEAEHN
C[C@@H](NC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C)c1ccccc1	ZINC000262587100	145295469	/nfs/dbraw/zinc/29/54/69/145295469.db2.gz	ZWJPMQRMFMRBNS-SCFUHWHPSA-N	0	3	302.418	2.396	10	0		DEAEHN
CC(C)COc1cccc(-c2nc([C@@H]3CNCCN3C)no2)c1	ZINC000263108964	145326351	/nfs/dbraw/zinc/32/63/51/145326351.db2.gz	ACQJGMYZNFQXRB-HNNXBMFYSA-N	0	3	316.405	2.348	10	0		DEAEHN
CN1CCNC[C@H]1c1noc([C@@H]2C[C@H]2c2ccc(F)cc2)n1	ZINC000263184916	145333771	/nfs/dbraw/zinc/33/37/71/145333771.db2.gz	HEDPYXKPUWHOHF-MJBXVCDLSA-N	0	3	302.353	2.056	10	0		DEAEHN
COc1ccc(-c2nc([C@@H]3CNCCN3C)no2)c2ccccc12	ZINC000263188873	145334362	/nfs/dbraw/zinc/33/43/62/145334362.db2.gz	HPNFFSQQTAXAJU-HNNXBMFYSA-N	0	3	324.384	2.475	10	0		DEAEHN
Cc1ccccc1[C@H](C)Cc1nc([C@@H]2CNCCN2C)no1	ZINC000263201417	145335320	/nfs/dbraw/zinc/33/53/20/145335320.db2.gz	JCISNKGATXQNAQ-HIFRSBDPSA-N	0	3	300.406	2.300	10	0		DEAEHN
O[C@H](CCNCc1cnn(Cc2ccccc2)c1)C(F)(F)F	ZINC000349317783	146367702	/nfs/dbraw/zinc/36/77/02/146367702.db2.gz	QEEDWJIQJCQTMP-CQSZACIVSA-N	0	3	313.323	2.334	10	0		DEAEHN
COCCC1(C)CN(C(=O)N[C@H](C)CN2CCC[C@H](C)C2)C1	ZINC000358526211	147150579	/nfs/dbraw/zinc/15/05/79/147150579.db2.gz	BDPVRWOJRJJOTP-LSDHHAIUSA-N	0	3	311.470	2.175	10	0		DEAEHN
CC[C@H](NC[C@@H]1CCC2(CCOCC2)[C@H]1O)c1nccn1C	ZINC000374791860	148290086	/nfs/dbraw/zinc/29/00/86/148290086.db2.gz	HZQCWLPTZLIJSX-KKUMJFAQSA-N	0	3	307.438	2.029	10	0		DEAEHN
Cn1ccc([C@@H](NC2CCN(C)CC2)c2ccc(F)cc2)n1	ZINC000374982677	148311651	/nfs/dbraw/zinc/31/16/51/148311651.db2.gz	UHSOOEYOHVUEAV-KRWDZBQOSA-N	0	3	302.397	2.332	10	0		DEAEHN
Cc1cc(C)nc(N2CCN(CC3(O)CCC(C)CC3)CC2)n1	ZINC000408177955	148572404	/nfs/dbraw/zinc/57/24/04/148572404.db2.gz	SQPGEYFVHYJWKI-UHFFFAOYSA-N	0	3	318.465	2.157	10	0		DEAEHN
CCc1cc(C(=O)N(C)CCCN2CCN(C)CC2)oc1CC	ZINC000127267836	401726732	/nfs/dbraw/zinc/72/67/32/401726732.db2.gz	URXBARFICQBPQN-UHFFFAOYSA-N	0	3	321.465	2.114	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CC[C@H](CC(C)C)C1	ZINC000074167511	401731900	/nfs/dbraw/zinc/73/19/00/401731900.db2.gz	FCJFADNQCOKPOX-CVEARBPZSA-N	0	3	311.470	2.175	10	0		DEAEHN
CC[C@]1(C)CCCN(C(=O)NC[C@@H]2CCCN2CCOC)C1	ZINC000074167175	401732046	/nfs/dbraw/zinc/73/20/46/401732046.db2.gz	OIHRCVJKQNCVHI-DOTOQJQBSA-N	0	3	311.470	2.319	10	0		DEAEHN
CNc1cc(N2CCC[C@@H]2CN[C@H](C)c2ccncc2)ncn1	ZINC000111227156	401701527	/nfs/dbraw/zinc/70/15/27/401701527.db2.gz	NBPAKKRERLVBBF-UKRRQHHQSA-N	0	3	312.421	2.233	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cc(Br)c[nH]2)CCN1C	ZINC000127726053	401747381	/nfs/dbraw/zinc/74/73/81/401747381.db2.gz	WKEAFYSXPQGGTE-GXSJLCMTSA-N	0	3	314.227	2.332	10	0		DEAEHN
CCc1ccccc1NC(=O)CNC(=O)CN[C@H](C)C(C)(C)C	ZINC000114475462	401801313	/nfs/dbraw/zinc/80/13/13/401801313.db2.gz	GCNXZQHNDUOQOS-CYBMUJFWSA-N	0	3	319.449	2.328	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](C)CNc2ccccc2)C1	ZINC000127882270	401754072	/nfs/dbraw/zinc/75/40/72/401754072.db2.gz	BTPDRUJTDWGUIR-HOCLYGCPSA-N	0	3	304.438	2.271	10	0		DEAEHN
C[C@@H]1CN(C(=O)CN(C[C@@H]2CCCO2)C2CCCC2)C[C@@H](C)O1	ZINC000075831569	401769742	/nfs/dbraw/zinc/76/97/42/401769742.db2.gz	NOJDMJIVNVAAQT-INMHGKMJSA-N	0	3	324.465	2.046	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)CSCc1ccncc1	ZINC000113231374	401771636	/nfs/dbraw/zinc/77/16/36/401771636.db2.gz	RHLYGUPPSKGZHG-DZGCQCFKSA-N	0	3	305.447	2.010	10	0		DEAEHN
CC1CCN(C(=O)CN[C@@H]2CCCC[C@H]2n2cccn2)CC1	ZINC000128422018	401776168	/nfs/dbraw/zinc/77/61/68/401776168.db2.gz	JIUDFLLNFBUAKA-HZPDHXFCSA-N	0	3	304.438	2.215	10	0		DEAEHN
COc1cccc(OC)c1C(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000113444727	401779363	/nfs/dbraw/zinc/77/93/63/401779363.db2.gz	OXGYDRANCFTGSF-QWHCGFSZSA-N	0	3	304.390	2.013	10	0		DEAEHN
CN1CCN(C(=O)[C@@H]2CCCc3[nH]ncc32)[C@@H](c2ccccc2)C1	ZINC000132614305	401870584	/nfs/dbraw/zinc/87/05/84/401870584.db2.gz	VPZVMNLJLSFUGT-CRAIPNDOSA-N	0	3	324.428	2.345	10	0		DEAEHN
CN(C)CCn1ccc(NC(=O)C(C)(C)c2cccs2)n1	ZINC000115048723	401818500	/nfs/dbraw/zinc/81/85/00/401818500.db2.gz	CFLUPKZOGIUHLK-UHFFFAOYSA-N	0	3	306.435	2.423	10	0		DEAEHN
CSCCCNC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000077572361	401820873	/nfs/dbraw/zinc/82/08/73/401820873.db2.gz	BRJKNXCYSARWFZ-HNNXBMFYSA-N	0	3	309.479	2.212	10	0		DEAEHN
CC[C@H](CC(=O)N1CCO[C@@H](CN(C)C)C1)c1ccccc1	ZINC000116787310	401859118	/nfs/dbraw/zinc/85/91/18/401859118.db2.gz	PBBVJUOSMPTUHR-WBVHZDCISA-N	0	3	304.434	2.359	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2cc3cc(Cl)ccc3o2)CCO1	ZINC000116792194	401859466	/nfs/dbraw/zinc/85/94/66/401859466.db2.gz	YGDGJLZAPBZBNM-ZDUSSCGKSA-N	0	3	322.792	2.489	10	0		DEAEHN
C[C@H]1CCc2sc(C(=O)N3CCO[C@H](CN(C)C)C3)cc2C1	ZINC000116788330	401859487	/nfs/dbraw/zinc/85/94/87/401859487.db2.gz	JIWKOLUQXDXXSD-GXTWGEPZSA-N	0	3	322.474	2.276	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCC[C@H](c2cc[nH]n2)C1	ZINC000114933359	401815218	/nfs/dbraw/zinc/81/52/18/401815218.db2.gz	RISKXKWKOZBMPQ-LSDHHAIUSA-N	0	3	321.469	2.275	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)C[C@@H]1CCCCO1	ZINC000087159799	401928322	/nfs/dbraw/zinc/92/83/22/401928322.db2.gz	OUBIBHDXYXHJBL-SJORKVTESA-N	0	3	304.434	2.235	10	0		DEAEHN
C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1)[C@@H]1CCCO1	ZINC000079487898	401873663	/nfs/dbraw/zinc/87/36/63/401873663.db2.gz	SGOCRGPKHOKVHK-WBVHZDCISA-N	0	3	319.449	2.327	10	0		DEAEHN
C[C@H](Oc1cccnc1)C(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000117746965	401882641	/nfs/dbraw/zinc/88/26/41/401882641.db2.gz	PCTBBNHFUMNBLV-YOEHRIQHSA-N	0	3	313.401	2.268	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@H]1C(=O)NCCN1CCC(C)CC1	ZINC000117756267	401883165	/nfs/dbraw/zinc/88/31/65/401883165.db2.gz	IPJVTKWLKBRVMW-RHSMWYFYSA-N	0	3	302.418	2.399	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)C[C@@H]2CCOc3ccccc32)C1	ZINC000117783713	401884594	/nfs/dbraw/zinc/88/45/94/401884594.db2.gz	INTXIWWGELFYIH-LSDHHAIUSA-N	0	3	302.418	2.495	10	0		DEAEHN
Cn1nc(C(=O)NCCN2CCCC2)cc1-c1cccc(F)c1	ZINC000034901769	401893783	/nfs/dbraw/zinc/89/37/83/401893783.db2.gz	RCDJNSGWWWHYNB-UHFFFAOYSA-N	0	3	316.380	2.052	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)NC[C@H]2CCCN(C)C2)c1	ZINC000081106636	401894454	/nfs/dbraw/zinc/89/44/54/401894454.db2.gz	ZPGFYDHJZJKWSX-CQSZACIVSA-N	0	3	318.421	2.133	10	0		DEAEHN
C[C@@H](CNCCS(=O)(=O)NCC1CCC1)Cc1ccccc1	ZINC000133814823	401895114	/nfs/dbraw/zinc/89/51/14/401895114.db2.gz	ILLAGQFVOCKEIT-OAHLLOKOSA-N	0	3	324.490	2.174	10	0		DEAEHN
CCN(CCNC(=O)NCCc1cc(F)ccc1F)C1CC1	ZINC000083215462	401900830	/nfs/dbraw/zinc/90/08/30/401900830.db2.gz	OEFVUYDWTLHTTC-UHFFFAOYSA-N	0	3	311.376	2.291	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(CCN3CCCC3=O)C2)c1	ZINC000083252240	401901367	/nfs/dbraw/zinc/90/13/67/401901367.db2.gz	IDTKENKVUARWAH-AWEZNQCLSA-N	0	3	318.417	2.116	10	0		DEAEHN
C[C@@H](O)C1CCN(C(=O)[C@@H]2CCCN2Cc2ccccc2)CC1	ZINC000118729367	401905820	/nfs/dbraw/zinc/90/58/20/401905820.db2.gz	QYJSIMBSNCHAJX-QAPCUYQASA-N	0	3	316.445	2.270	10	0		DEAEHN
CC(C)Oc1ccccc1NC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000118803522	401908500	/nfs/dbraw/zinc/90/85/00/401908500.db2.gz	BAZXPBJCWMKNBR-AWEZNQCLSA-N	0	3	321.421	2.268	10	0		DEAEHN
NC(=O)C1CCC(NCc2ccc(Br)o2)CC1	ZINC000037152282	401910846	/nfs/dbraw/zinc/91/08/46/401910846.db2.gz	CHUBUNZNUBWXSD-UHFFFAOYSA-N	0	3	301.184	2.176	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)Nc1ccc(F)cc1C(=O)N(C)CCN(C)C	ZINC000119454296	401951246	/nfs/dbraw/zinc/95/12/46/401951246.db2.gz	FEWOGVPUIOXZEN-DGCLKSJQSA-N	0	3	321.396	2.054	10	0		DEAEHN
CCCn1cc(CN2CCC[C@@H]2CN2C[C@@H](C)O[C@@H](C)C2)cn1	ZINC000120078613	401976734	/nfs/dbraw/zinc/97/67/34/401976734.db2.gz	VYUBBKUTYFNHMX-SOLBZPMBSA-N	0	3	320.481	2.367	10	0		DEAEHN
CC(C)CCNC(=O)[C@@H](C)N1CCC[C@H](Cc2nccn2C)C1	ZINC000090003946	401977878	/nfs/dbraw/zinc/97/78/78/401977878.db2.gz	KOUPXTWVSDHLJM-HZPDHXFCSA-N	0	3	320.481	2.225	10	0		DEAEHN
Cc1cc(S(=O)(=O)NCCCN2CCCC2)c(C)s1	ZINC000048381885	401999481	/nfs/dbraw/zinc/99/94/81/401999481.db2.gz	YZWRIZAZCYLESA-UHFFFAOYSA-N	0	3	302.465	2.129	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000150793034	401996101	/nfs/dbraw/zinc/99/61/01/401996101.db2.gz	BRDKQGQCZMCIDB-HOCLYGCPSA-N	0	3	317.433	2.087	10	0		DEAEHN
CC[C@H](CCO)[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000135562133	401945450	/nfs/dbraw/zinc/94/54/50/401945450.db2.gz	JLMFNBKCZASQDS-SNVBAGLBSA-N	0	3	318.211	2.414	10	0		DEAEHN
CCC[C@H](O)C[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000135561885	401945531	/nfs/dbraw/zinc/94/55/31/401945531.db2.gz	AEJMMHOKMLVLQF-JTQLQIEISA-N	0	3	318.211	2.414	10	0		DEAEHN
Cc1cccc([C@H](C)CNC(=O)N2CCO[C@H](CN(C)C)C2)c1	ZINC000121028761	402011187	/nfs/dbraw/zinc/01/11/87/402011187.db2.gz	HODNTLCQVDRJTE-NVXWUHKLSA-N	0	3	319.449	2.071	10	0		DEAEHN
CCNC(=O)NC(=O)CN[C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000050273690	402026798	/nfs/dbraw/zinc/02/67/98/402026798.db2.gz	SIBHZTAMTSDNMR-CQSZACIVSA-N	0	3	309.797	2.226	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H](CN(C)C)c2ccccc2)C1	ZINC000052519279	402042983	/nfs/dbraw/zinc/04/29/83/402042983.db2.gz	VOUBRMHTYLJLEH-SJORKVTESA-N	0	3	318.465	2.073	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCOc2ccc(C)cc2)C1	ZINC000052498135	402043157	/nfs/dbraw/zinc/04/31/57/402043157.db2.gz	SWIHOJHXUONJIJ-HNNXBMFYSA-N	0	3	305.422	2.157	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NC[C@@H](CCO)CC(C)C	ZINC000120866589	402005092	/nfs/dbraw/zinc/00/50/92/402005092.db2.gz	XUGCIDRHJSLFME-HOTGVXAUSA-N	0	3	313.486	2.157	10	0		DEAEHN
COc1cccc(OCC(=O)N[C@H](CC(C)C)CN(C)C)c1	ZINC000120963400	402008699	/nfs/dbraw/zinc/00/86/99/402008699.db2.gz	UFRQONJICQRORS-CQSZACIVSA-N	0	3	308.422	2.167	10	0		DEAEHN
COc1ccc([C@H](NCc2cnnn2C)C2CCOCC2)cc1	ZINC000092852789	402009800	/nfs/dbraw/zinc/00/98/00/402009800.db2.gz	WAWXTDOEGSPAAF-KRWDZBQOSA-N	0	3	316.405	2.081	10	0		DEAEHN
CC[N@@H+]1CC[C@@H](N(C)C(=O)c2ccc(OC)cc2[O-])[C@H](C)C1	ZINC000122302678	402071514	/nfs/dbraw/zinc/07/15/14/402071514.db2.gz	WGMGSDFVNYETTN-IUODEOHRSA-N	0	3	306.406	2.203	10	0		DEAEHN
CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(OC)cc2[O-])[C@H](C)C1	ZINC000122302678	402071517	/nfs/dbraw/zinc/07/15/17/402071517.db2.gz	WGMGSDFVNYETTN-IUODEOHRSA-N	0	3	306.406	2.203	10	0		DEAEHN
C[C@H]1CN(CCc2ccc(F)c(F)c2)C[C@@H]1N1CCOCC1	ZINC000152152868	402079102	/nfs/dbraw/zinc/07/91/02/402079102.db2.gz	SSZTUWSXMNZKSC-GUYCJALGSA-N	0	3	310.388	2.160	10	0		DEAEHN
C[C@@H](NCc1ccnn1C)c1ccc(OCCN(C)C)cc1	ZINC000152174117	402080075	/nfs/dbraw/zinc/08/00/75/402080075.db2.gz	RNVPMVPGRSICDI-CQSZACIVSA-N	0	3	302.422	2.211	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cccc(-n3cccn3)c2)CCN1C	ZINC000122667094	402089230	/nfs/dbraw/zinc/08/92/30/402089230.db2.gz	YCTOUVNCCWFDIH-ZBFHGGJFSA-N	0	3	312.417	2.427	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cccc3c2OCCO3)CCN1C	ZINC000122731982	402092062	/nfs/dbraw/zinc/09/20/62/402092062.db2.gz	YPQWGYQVBPWVND-CHWSQXEVSA-N	0	3	304.390	2.013	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@H](C)Oc2cccc(C(C)=O)c2)C1	ZINC000063342666	402112658	/nfs/dbraw/zinc/11/26/58/402112658.db2.gz	ZJLVVOPPFXCEHV-ZBFHGGJFSA-N	0	3	318.417	2.257	10	0		DEAEHN
CC(C(=O)N[C@H](C)c1ccccc1)S(=O)(=O)c1nccs1	ZINC000063871270	402116484	/nfs/dbraw/zinc/11/64/84/402116484.db2.gz	XOCJXCCCPKPMIO-MNOVXSKESA-N	0	3	324.427	2.183	10	0		DEAEHN
Cc1cc(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)ccc1F	ZINC000124465659	402181033	/nfs/dbraw/zinc/18/10/33/402181033.db2.gz	GHPICUHQILWZMZ-MRXNPFEDSA-N	0	3	320.408	2.205	10	0		DEAEHN
CC(C)c1ccccc1OC[C@H](O)CN1CCC[C@@](C)(O)C1	ZINC000124838766	402200177	/nfs/dbraw/zinc/20/01/77/402200177.db2.gz	NHBKRIFZIKKERN-CRAIPNDOSA-N	0	3	307.434	2.397	10	0		DEAEHN
c1ccn2c(c1)nnc2C1CCN(C[C@H]2CCCCO2)CC1	ZINC000067442940	402159903	/nfs/dbraw/zinc/15/99/03/402159903.db2.gz	RRVNBKJVOYGFDH-OAHLLOKOSA-N	0	3	300.406	2.478	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)CN[C@@]2(CO)C[C@H](C)CC(C)(C)C2)C1	ZINC000124075438	402162910	/nfs/dbraw/zinc/16/29/10/402162910.db2.gz	PESMDPSCTNQYMY-RKVPGOIHSA-N	0	3	310.482	2.412	10	0		DEAEHN
C[C@@H](NC(=O)N1CCN(CC2CCCCC2)CC1)[C@@H]1CCCO1	ZINC000067699395	402168439	/nfs/dbraw/zinc/16/84/39/402168439.db2.gz	WLUMEXBQPPPWBS-WBVHZDCISA-N	0	3	323.481	2.461	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)Nc1ccc(F)cn1	ZINC000103071656	402177781	/nfs/dbraw/zinc/17/77/81/402177781.db2.gz	OZIPJUKQDCZTIG-UHFFFAOYSA-N	0	3	303.337	2.413	10	0		DEAEHN
CCc1ccc(CN2CCN(C(=O)[C@@H](CC)N(C)C)CC2)s1	ZINC000154570817	402218792	/nfs/dbraw/zinc/21/87/92/402218792.db2.gz	GDXREJNNJVXARB-MRXNPFEDSA-N	0	3	323.506	2.295	10	0		DEAEHN
CC(C)C[C@@H](CNC(=O)c1ccc(-c2ncon2)cc1)N(C)C	ZINC000107357941	402230679	/nfs/dbraw/zinc/23/06/79/402230679.db2.gz	QDZZKFBIOSXOIU-HNNXBMFYSA-N	0	3	316.405	2.443	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cc3c(s2)CCOC3)C1	ZINC000155647797	402264322	/nfs/dbraw/zinc/26/43/22/402264322.db2.gz	YQODEPWLXLYBGQ-YPMHNXCESA-N	0	3	308.447	2.279	10	0		DEAEHN
COc1ccc(OC)c([C@@H](C)NC[C@@]2(CCO)CCOC2)c1	ZINC000125481099	402234657	/nfs/dbraw/zinc/23/46/57/402234657.db2.gz	LRWXQPSYGHFMOI-CXAGYDPISA-N	0	3	309.406	2.144	10	0		DEAEHN
CC[C@H](C)[C@H](NC(=O)CN[C@@H](C)c1ccccc1C)C(=O)OC	ZINC000155042217	402242597	/nfs/dbraw/zinc/24/25/97/402242597.db2.gz	HNJWGRIOBFSNLV-JDFRZJQESA-N	0	3	320.433	2.350	10	0		DEAEHN
Cc1nn(C)cc1[C@@H](C)NC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000069773789	402243981	/nfs/dbraw/zinc/24/39/81/402243981.db2.gz	IDKJTERATUXEEY-TZMCWYRMSA-N	0	3	309.458	2.065	10	0		DEAEHN
C[C@@H]1CCCCN1C(=O)CN1CCC(Cc2nccn2C)CC1	ZINC000105918373	402211236	/nfs/dbraw/zinc/21/12/36/402211236.db2.gz	AYHDFMRFRDWXKZ-OAHLLOKOSA-N	0	3	318.465	2.076	10	0		DEAEHN
Cc1nc(C)n(C[C@H]2CCCN(CCC(=O)OC(C)(C)C)C2)n1	ZINC000105919703	402211424	/nfs/dbraw/zinc/21/14/24/402211424.db2.gz	LLKBKJWLPNEQSH-HNNXBMFYSA-N	0	3	322.453	2.339	10	0		DEAEHN
COCc1csc(NC(=O)N[C@H]2CN(C(C)C)C[C@H]2C)n1	ZINC000125087283	402212380	/nfs/dbraw/zinc/21/23/80/402212380.db2.gz	LPPDFRBEGVSJDY-PWSUYJOCSA-N	0	3	312.439	2.140	10	0		DEAEHN
CCc1cccc(CC(=O)N(CCN(C)C)C[C@@H]2CCCO2)c1	ZINC000126153527	402267386	/nfs/dbraw/zinc/26/73/86/402267386.db2.gz	NUHXLXQXPREXPF-SFHVURJKSA-N	0	3	318.461	2.361	10	0		DEAEHN
CCc1cccc(NC(=O)NC[C@@H]2CCCN2CCOC)c1	ZINC000110085870	402281368	/nfs/dbraw/zinc/28/13/68/402281368.db2.gz	KCYHGABYAMBERA-INIZCTEOSA-N	0	3	305.422	2.481	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cnc(C(F)(F)F)nc1	ZINC000157884037	402299198	/nfs/dbraw/zinc/29/91/98/402299198.db2.gz	BCGLXQVVJZNOBN-NSHDSACASA-N	0	3	316.327	2.052	10	0		DEAEHN
Cc1nn(C)c(C)c1CNCC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000222084352	402305842	/nfs/dbraw/zinc/30/58/42/402305842.db2.gz	RPDBTLLXUOFFFK-LLVKDONJSA-N	0	3	310.442	2.430	10	0		DEAEHN
CCCCn1cc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c(C)n1	ZINC000184965117	402312906	/nfs/dbraw/zinc/31/29/06/402312906.db2.gz	GKONYVBMKDYZLT-XJKSGUPXSA-N	0	3	306.454	2.450	10	0		DEAEHN
Cc1nn(C)c(CNCC[C@H]2CCOC2)c1Br	ZINC000228730555	402340147	/nfs/dbraw/zinc/34/01/47/402340147.db2.gz	SFMXWKSQSVAZKU-JTQLQIEISA-N	0	3	302.216	2.007	10	0		DEAEHN
O=C(c1ncncc1Cl)N1CCCN(C2CCCC2)CC1	ZINC000176887331	402346563	/nfs/dbraw/zinc/34/65/63/402346563.db2.gz	QKQKZJZNZWWTKB-UHFFFAOYSA-N	0	3	308.813	2.221	10	0		DEAEHN
CC[C@@H](CNC(=O)N1CC[C@@H](N(C)C)C1)Oc1ccccc1C	ZINC000176912145	402349180	/nfs/dbraw/zinc/34/91/80/402349180.db2.gz	BOIVJPTZFVGHIJ-CVEARBPZSA-N	0	3	319.449	2.498	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(F)c(Br)c2)C1	ZINC000231291760	402353848	/nfs/dbraw/zinc/35/38/48/402353848.db2.gz	UBGFGLLIUIRMOT-SNVBAGLBSA-N	0	3	315.186	2.364	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1ncccc1Br	ZINC000231763138	402355554	/nfs/dbraw/zinc/35/55/54/402355554.db2.gz	JOVLJYVFEOLWPS-SNVBAGLBSA-N	0	3	312.211	2.010	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@H]1COc2ccccc2C1	ZINC000176988796	402357535	/nfs/dbraw/zinc/35/75/35/402357535.db2.gz	JSXAXTLWSOEVLA-HZPDHXFCSA-N	0	3	302.418	2.180	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1ccccc1C(=O)OC	ZINC000177024396	402360405	/nfs/dbraw/zinc/36/04/05/402360405.db2.gz	YOJBQMSUUFQCGL-ZDUSSCGKSA-N	0	3	319.405	2.421	10	0		DEAEHN
COC[C@H](C)OC[C@H](O)CN[C@@H](C)c1cccc(Cl)c1	ZINC000234846157	402361282	/nfs/dbraw/zinc/36/12/82/402361282.db2.gz	YMGLCSLLSWCIRV-SLEUVZQESA-N	0	3	301.814	2.403	10	0		DEAEHN
C[NH+]1CCC(CNC(=O)c2ccc3c(c2[O-])CCCC3)CC1	ZINC000185737766	402372995	/nfs/dbraw/zinc/37/29/95/402372995.db2.gz	VRIXVOXXYRGMGV-UHFFFAOYSA-N	0	3	302.418	2.343	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1C(=O)c1cc(C(C)C)[nH]n1	ZINC000177165067	402377260	/nfs/dbraw/zinc/37/72/60/402377260.db2.gz	YIIMXFMDZBNACO-CYBMUJFWSA-N	0	3	301.394	2.343	10	0		DEAEHN
Cc1cccc(OCCN2C[C@@H](C)[C@H](N3CCOCC3)C2)c1	ZINC000177247614	402385280	/nfs/dbraw/zinc/38/52/80/402385280.db2.gz	ZKEPVJSFSYUJHR-SJLPKXTDSA-N	0	3	304.434	2.026	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)s1	ZINC000176688530	402328895	/nfs/dbraw/zinc/32/88/95/402328895.db2.gz	RJCJQXJTPRFDHE-CYZMBNFOSA-N	0	3	323.462	2.468	10	0		DEAEHN
CN1CCN(CCC(C)(C)NC(=O)NCCC2CCCC2)CC1	ZINC000185153209	402328963	/nfs/dbraw/zinc/32/89/63/402328963.db2.gz	VAWBEPFZSOBPQB-UHFFFAOYSA-N	0	3	324.513	2.282	10	0		DEAEHN
O=C(NCCC1=CCCCCC1)NC[C@@H](O)CN1CCCCC1	ZINC000185265210	402339333	/nfs/dbraw/zinc/33/93/33/402339333.db2.gz	ZRBBKSOGZYQACB-QGZVFWFLSA-N	0	3	323.481	2.413	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(Cc3ccnc(Cl)c3)C2)CC1	ZINC000177368480	402395069	/nfs/dbraw/zinc/39/50/69/402395069.db2.gz	DRINYHHXDULSOI-INIZCTEOSA-N	0	3	322.884	2.337	10	0		DEAEHN
CCC[C@H](N)C(=O)NC[C@H](O)c1c(Cl)cccc1Cl	ZINC000161796026	402399575	/nfs/dbraw/zinc/39/95/75/402399575.db2.gz	JUJHLHSCVFZSKD-QWRGUYRKSA-N	0	3	305.205	2.270	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@@H](c2ccccc2F)C1)N(C)C	ZINC000161969200	402405152	/nfs/dbraw/zinc/40/51/52/402405152.db2.gz	BUNOYVOIFNNCTH-HZPDHXFCSA-N	0	3	308.397	2.456	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2cccnc2N(C)C)C12CCOCC2	ZINC000186243511	402414594	/nfs/dbraw/zinc/41/45/94/402414594.db2.gz	WIWGPYSHBLECBH-JKSUJKDBSA-N	0	3	319.449	2.211	10	0		DEAEHN
Cn1ccnc1CC1CCN(C(=O)c2[nH]nc3ccccc32)CC1	ZINC000162562577	402424380	/nfs/dbraw/zinc/42/43/80/402424380.db2.gz	MXKGIZRHNZSZCB-UHFFFAOYSA-N	0	3	323.400	2.391	10	0		DEAEHN
CCC[C@H](C(=O)NCc1cccc(N2CC=CC2)c1)N(C)C	ZINC000162932287	402437135	/nfs/dbraw/zinc/43/71/35/402437135.db2.gz	YMHFGPBZBMWKFB-QGZVFWFLSA-N	0	3	301.434	2.409	10	0		DEAEHN
C[C@H]1CC[C@H](C(N)=O)CN1Cc1ccc2c(c1)COC(C)(C)O2	ZINC000186625836	402448959	/nfs/dbraw/zinc/44/89/59/402448959.db2.gz	KWLRQSPOAYVIJY-JSGCOSHPSA-N	0	3	318.417	2.418	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H](C)c1ccc2c(c1)OCCO2)N(C)C	ZINC000161535145	402390895	/nfs/dbraw/zinc/39/08/95/402390895.db2.gz	BTVMRCFKRZZOKF-TZMCWYRMSA-N	0	3	306.406	2.365	10	0		DEAEHN
CC(=O)N1CCN(CCN(C)Cc2ccc(F)cc2)C(C)(C)C1	ZINC000161614585	402393412	/nfs/dbraw/zinc/39/34/12/402393412.db2.gz	CFOBQKQTONLSDQ-UHFFFAOYSA-N	0	3	321.440	2.200	10	0		DEAEHN
Cc1c(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cnn1CC(C)C	ZINC000163528791	402452397	/nfs/dbraw/zinc/45/23/97/402452397.db2.gz	CTQGWRYOOPHXTI-HIFRSBDPSA-N	0	3	306.454	2.402	10	0		DEAEHN
C[C@H]1CCN(CCCN2C(=O)CNC2=O)[C@H]1c1cccc(F)c1	ZINC000245410462	402458124	/nfs/dbraw/zinc/45/81/24/402458124.db2.gz	RDQBVVBVLRPGML-BLLLJJGKSA-N	0	3	319.380	2.151	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CSC[C@H]1CCCCO1	ZINC000245425056	402458971	/nfs/dbraw/zinc/45/89/71/402458971.db2.gz	DKPBRKHZHTXXSO-HUUCEWRRSA-N	0	3	314.495	2.231	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)NC[C@@H]1CCCS1	ZINC000164390824	402461924	/nfs/dbraw/zinc/46/19/24/402461924.db2.gz	ONGQDLYEPGGRHX-HOTGVXAUSA-N	0	3	321.490	2.354	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)CSCc1cscn1	ZINC000246127421	402512204	/nfs/dbraw/zinc/51/22/04/402512204.db2.gz	QARKUCMVERVMKB-AAEUAGOBSA-N	0	3	311.476	2.071	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)Nc1ccc(OC)cc1	ZINC000245457407	402462517	/nfs/dbraw/zinc/46/25/17/402462517.db2.gz	CCNZZQJYFRPGCG-GDBMZVCRSA-N	0	3	319.449	2.438	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)[C@H](C)N1CCN2CCC[C@H]2C1	ZINC000245482712	402464756	/nfs/dbraw/zinc/46/47/56/402464756.db2.gz	ZLANQJROUSNXFN-WMZOPIPTSA-N	0	3	315.461	2.122	10	0		DEAEHN
COc1ccc(CN2CCN(C[C@H](C)O)[C@H](C)C2)cc1Cl	ZINC000245580813	402472174	/nfs/dbraw/zinc/47/21/74/402472174.db2.gz	CIGIRVVSYFZUOV-OLZOCXBDSA-N	0	3	312.841	2.236	10	0		DEAEHN
C[C@H]1CC[C@](CO)(N(C)CC(=O)N2CCc3ccccc3C2)C1	ZINC000187902980	402512866	/nfs/dbraw/zinc/51/28/66/402512866.db2.gz	HKSHTXJNCVOVGP-KXBFYZLASA-N	0	3	316.445	2.054	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CC(=O)N1CCCCCC1	ZINC000178295739	402481060	/nfs/dbraw/zinc/48/10/60/402481060.db2.gz	MJHFXNJSFUYPPP-MRXNPFEDSA-N	0	3	304.438	2.059	10	0		DEAEHN
C[C@@H](CNC(=O)NC[C@@H]1CCC(C)(C)O1)N1CCC(C)CC1	ZINC000187076972	402481628	/nfs/dbraw/zinc/48/16/28/402481628.db2.gz	QJYPABCUEMTJAR-GJZGRUSLSA-N	0	3	311.470	2.364	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)NCc1cccs1	ZINC000178308973	402483589	/nfs/dbraw/zinc/48/35/89/402483589.db2.gz	PJHAPSWRKQNSAL-AWEZNQCLSA-N	0	3	318.446	2.034	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N1C[C@H](C)C[C@H](C)C1	ZINC000178312412	402483614	/nfs/dbraw/zinc/48/36/14/402483614.db2.gz	CTOTUSMAVXIXDS-UXLLHSPISA-N	0	3	318.465	2.160	10	0		DEAEHN
COc1ccc([C@H](C)NCCN2CCCC2)cc1NC(C)=O	ZINC000178310618	402483648	/nfs/dbraw/zinc/48/36/48/402483648.db2.gz	VPISQOXREQVZEE-ZDUSSCGKSA-N	0	3	305.422	2.400	10	0		DEAEHN
C[C@@H]1Cc2ccccc2CN1C[C@H]1CCCN(S(C)(=O)=O)C1	ZINC000246153403	402513254	/nfs/dbraw/zinc/51/32/54/402513254.db2.gz	DFILTZIHZIUNKD-HUUCEWRRSA-N	0	3	322.474	2.105	10	0		DEAEHN
CCOC(=O)[C@H](Cc1ccccc1)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000187406352	402499122	/nfs/dbraw/zinc/49/91/22/402499122.db2.gz	PSGIMLDIQOZFRR-SZMVWBNQSA-N	0	3	318.461	2.479	10	0		DEAEHN
C[C@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc32)CCS1	ZINC000246041968	402505122	/nfs/dbraw/zinc/50/51/22/402505122.db2.gz	RWLKKRBKFNYTCG-QWHCGFSZSA-N	0	3	306.431	2.345	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)c2ccccc2F)[C@@H](C)C1	ZINC000246049127	402505606	/nfs/dbraw/zinc/50/56/06/402505606.db2.gz	CCIZOMYJUGENNI-JSGCOSHPSA-N	0	3	314.426	2.177	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)N2CCO[C@@H](c3ccsc3)C2)C1	ZINC000246707316	402541542	/nfs/dbraw/zinc/54/15/42/402541542.db2.gz	SDHLQWQQPZKRIB-UKRRQHHQSA-N	0	3	323.462	2.173	10	0		DEAEHN
CC(=O)NC[C@@H]1CCCN(Cc2cnc(-c3ccccc3)[nH]2)C1	ZINC000178873952	402548826	/nfs/dbraw/zinc/54/88/26/402548826.db2.gz	VZHYLPAGYDOBRE-HNNXBMFYSA-N	0	3	312.417	2.425	10	0		DEAEHN
C[C@@H](C(=O)N[C@@H]1CCCC[C@H]1C)N1C[C@H]2CCC[C@@H](C1)C2O	ZINC000246955765	402550863	/nfs/dbraw/zinc/55/08/63/402550863.db2.gz	JLKUOAVMYAFSCO-RFSMNFJQSA-N	0	3	308.466	2.163	10	0		DEAEHN
CC[C@H](C)NC(=O)CN[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000189893286	402564906	/nfs/dbraw/zinc/56/49/06/402564906.db2.gz	BYLQKASTBASOEK-UONOGXRCSA-N	0	3	300.406	2.438	10	0		DEAEHN
C[C@@H](NC[C@H](C)CS(C)(=O)=O)c1cccc(-n2ccnc2)c1	ZINC000189914530	402566913	/nfs/dbraw/zinc/56/69/13/402566913.db2.gz	PYGWVYFCSWMAGP-UONOGXRCSA-N	0	3	321.446	2.204	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)[C@@H]1CCOc2ccccc21	ZINC000247538418	402571599	/nfs/dbraw/zinc/57/15/99/402571599.db2.gz	YECHKHWNRWYYFC-IJEWVQPXSA-N	0	3	300.402	2.248	10	0		DEAEHN
C[C@@H](CNC(=O)N[C@@H](C)[C@H]1CCCO1)N(C)Cc1ccccc1	ZINC000247555613	402572079	/nfs/dbraw/zinc/57/20/79/402572079.db2.gz	QRXDGBIOTJZBQD-YQQAZPJKSA-N	0	3	319.449	2.374	10	0		DEAEHN
C[C@H](NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)[C@H]1CCCO1	ZINC000179101223	402572537	/nfs/dbraw/zinc/57/25/37/402572537.db2.gz	QJLDXNWFMCGZPZ-RKTXRCNFSA-N	0	3	317.433	2.299	10	0		DEAEHN
CCN(CC)C(=O)[C@H](C)N1C[C@H](CO)[C@H](c2ccsc2)C1	ZINC000188157013	402516008	/nfs/dbraw/zinc/51/60/08/402516008.db2.gz	RLWONCAAJOFAEV-CFVMTHIKSA-N	0	3	310.463	2.013	10	0		DEAEHN
O=C(CN1CC[C@H](N2CCCC2)C1)Nc1cc(F)cc(F)c1	ZINC000170744209	402519262	/nfs/dbraw/zinc/51/92/62/402519262.db2.gz	AGPHQKWXKDUPGY-HNNXBMFYSA-N	0	3	309.360	2.073	10	0		DEAEHN
CC(C)[C@@H](NC(=O)CN1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000178628319	402519539	/nfs/dbraw/zinc/51/95/39/402519539.db2.gz	UJYMOIGSMDTESQ-IEBWSBKVSA-N	0	3	315.461	2.280	10	0		DEAEHN
c1cc(-c2noc(CN3CCN4CCCC[C@H]4C3)n2)cs1	ZINC000246253944	402520807	/nfs/dbraw/zinc/52/08/07/402520807.db2.gz	XIHNKMGGSAGYQN-ZDUSSCGKSA-N	0	3	304.419	2.468	10	0		DEAEHN
C[C@H]1CN(C[C@H](O)COCc2ccc(Cl)cc2)CCCO1	ZINC000170764454	402522037	/nfs/dbraw/zinc/52/20/37/402522037.db2.gz	WAHOWBXKZSCTSJ-BBRMVZONSA-N	0	3	313.825	2.328	10	0		DEAEHN
C[C@@H](C(=O)N[C@H]1CCC[C@@H](C)[C@@H]1C)N1CCN2CCC[C@H]2C1	ZINC000246304141	402524239	/nfs/dbraw/zinc/52/42/39/402524239.db2.gz	JHNPJXZDOVEZBP-XAJHFOFHSA-N	0	3	307.482	2.096	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N[C@@H]2Cc3ccccc3[C@@H]2O)cc1	ZINC000178705913	402528778	/nfs/dbraw/zinc/52/87/78/402528778.db2.gz	PDBCEIFQXNKGJZ-MSOLQXFVSA-N	0	3	310.397	2.136	10	0		DEAEHN
CCOc1cccc([C@@H](C)NC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000170835091	402530819	/nfs/dbraw/zinc/53/08/19/402530819.db2.gz	AHGXKQUHWBUKPX-UKRRQHHQSA-N	0	3	305.422	2.492	10	0		DEAEHN
Cc1ccccc1C1(CNC(=O)N2CC[C@@H](N(C)C)C2)CC1	ZINC000170836657	402531402	/nfs/dbraw/zinc/53/14/02/402531402.db2.gz	NAGHEEKYNAXOJB-OAHLLOKOSA-N	0	3	301.434	2.372	10	0		DEAEHN
CCOCCC1(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)CC1	ZINC000246483800	402533203	/nfs/dbraw/zinc/53/32/03/402533203.db2.gz	GDOZBXDKMZDREL-GJZGRUSLSA-N	0	3	311.470	2.317	10	0		DEAEHN
C[C@H](O)C1CCN(CCOCC(F)(F)C(F)(F)F)CC1	ZINC000189265865	402533559	/nfs/dbraw/zinc/53/35/59/402533559.db2.gz	YIEWUBFTGAETHX-VIFPVBQESA-N	0	3	305.287	2.293	10	0		DEAEHN
CC1=NN(c2ccc(C(=O)N3CC[C@H](N(C)C)C3)cc2)CC1	ZINC000170866297	402534955	/nfs/dbraw/zinc/53/49/55/402534955.db2.gz	ABQNNQPTDICGIU-INIZCTEOSA-N	0	3	300.406	2.049	10	0		DEAEHN
CCOC(=O)c1ccccc1NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000179199179	402580059	/nfs/dbraw/zinc/58/00/59/402580059.db2.gz	FYDGOCKDUWJAOC-CYBMUJFWSA-N	0	3	317.389	2.175	10	0		DEAEHN
CN1CC[C@H](NC(=O)Cc2ccc(O)cc2)[C@H]1c1ccccc1	ZINC000247988567	402580110	/nfs/dbraw/zinc/58/01/10/402580110.db2.gz	ITGDFWKFMWBRHZ-PKOBYXMFSA-N	0	3	310.397	2.496	10	0		DEAEHN
CS[C@H](C)CNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179208864	402580984	/nfs/dbraw/zinc/58/09/84/402580984.db2.gz	HIZKFQBDCKMSLW-BPLDGKMQSA-N	0	3	307.463	2.483	10	0		DEAEHN
O[C@H](CN1CC[C@H](COCc2ccccc2)C1)C(F)(F)F	ZINC000248390275	402589077	/nfs/dbraw/zinc/58/90/77/402589077.db2.gz	HVQGVJNITXBJSQ-UONOGXRCSA-N	0	3	303.324	2.448	10	0		DEAEHN
O=C(NC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCOC1	ZINC000171551348	402593554	/nfs/dbraw/zinc/59/35/54/402593554.db2.gz	PSXOPPMGPCZGSG-QGZVFWFLSA-N	0	3	317.433	2.129	10	0		DEAEHN
Cc1csc2c1ncnc2N1CCN(CC(C)(C)O)[C@@H](C)C1	ZINC000248663823	402602409	/nfs/dbraw/zinc/60/24/09/402602409.db2.gz	IPDHYLPWRKJNEO-LBPRGKRZSA-N	0	3	320.462	2.281	10	0		DEAEHN
CCO[C@@H]1C[C@H](O)C12CCN(Cc1ccc(O)c(OC)c1)CC2	ZINC000180086739	402607009	/nfs/dbraw/zinc/60/70/09/402607009.db2.gz	FQNKSMFTKZPHSV-DLBZAZTESA-N	0	3	321.417	2.153	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000248840635	402610749	/nfs/dbraw/zinc/61/07/49/402610749.db2.gz	QNZNMKLTLBCBCR-BSWAZPDLSA-N	0	3	302.418	2.221	10	0		DEAEHN
Cc1ccnc2c1NC(=O)CN2C(=O)c1ccc(CN(C)C)cc1	ZINC000180857384	402628070	/nfs/dbraw/zinc/62/80/70/402628070.db2.gz	RPMIUJZTTVIXHY-UHFFFAOYSA-N	0	3	324.384	2.051	10	0		DEAEHN
CC(C)c1nnc2n1C[C@H](N[C@@H]1CCCc3c1cnn3C)CC2	ZINC000180506864	402618706	/nfs/dbraw/zinc/61/87/06/402618706.db2.gz	NNFUEIRAUQAEDG-TZMCWYRMSA-N	0	3	314.437	2.117	10	0		DEAEHN
CC(C)c1nc2n(n1)C[C@@H](N[C@H]1CCCc3c1cnn3C)CC2	ZINC000180635419	402621896	/nfs/dbraw/zinc/62/18/96/402621896.db2.gz	KTYQICBHBZLPKZ-JSGCOSHPSA-N	0	3	314.437	2.117	10	0		DEAEHN
CCOc1ncc(C(=O)N[C@H]2CCCN(CC)C2)cc1Cl	ZINC000171804578	402623505	/nfs/dbraw/zinc/62/35/05/402623505.db2.gz	OOIMAGPFHQWOSK-LBPRGKRZSA-N	0	3	311.813	2.348	10	0		DEAEHN
Cc1cccc(F)c1NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000249218328	402623820	/nfs/dbraw/zinc/62/38/20/402623820.db2.gz	UAVIWJBQBKKOBK-STQMWFEESA-N	0	3	321.396	2.014	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cccnc2N2CCCCC2)C1	ZINC000171319442	402577433	/nfs/dbraw/zinc/57/74/33/402577433.db2.gz	NWZKZQRZUGXQCU-OAHLLOKOSA-N	0	3	316.449	2.286	10	0		DEAEHN
CN(CCCNC(=O)N1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000171898048	402631786	/nfs/dbraw/zinc/63/17/86/402631786.db2.gz	RTXGZQUSVQXDLA-QGZVFWFLSA-N	0	3	316.449	2.003	10	0		DEAEHN
CC(C)N1CC[C@H](Nc2cc(C(F)(F)F)nc3ncnn32)C1	ZINC000172150502	402642171	/nfs/dbraw/zinc/64/21/71/402642171.db2.gz	YGPKNNRDZSBTEH-VIFPVBQESA-N	0	3	314.315	2.038	10	0		DEAEHN
CN(CCN1CCS[C@H]2COCC[C@@H]21)Cc1ccc(F)cc1	ZINC000181745953	402655792	/nfs/dbraw/zinc/65/57/92/402655792.db2.gz	IUNSXQFDPWAQAB-IRXDYDNUSA-N	0	3	324.465	2.464	10	0		DEAEHN
CN(CC(F)(F)F)C(=O)CN(C[C@H]1CCCO1)C1CCCC1	ZINC000173577972	402703418	/nfs/dbraw/zinc/70/34/18/402703418.db2.gz	XPZUTXLYWAYYCL-CYBMUJFWSA-N	0	3	322.371	2.431	10	0		DEAEHN
CCN(CCNC(=O)N1CCCC[C@H]1c1cn[nH]c1)C1CC1	ZINC000182631996	402704956	/nfs/dbraw/zinc/70/49/56/402704956.db2.gz	VWHMROCQSALSSC-HNNXBMFYSA-N	0	3	305.426	2.131	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc3c(c2)NC(=O)CC3)C1	ZINC000173763723	402711390	/nfs/dbraw/zinc/71/13/90/402711390.db2.gz	GJXPHWNGNQCTGR-CQSZACIVSA-N	0	3	316.405	2.177	10	0		DEAEHN
OC[C@@H]1CN(Cc2ccc3c(c2)CCO3)C[C@H]1c1ccncc1	ZINC000253414785	402664283	/nfs/dbraw/zinc/66/42/83/402664283.db2.gz	YPHZBUPULQFXQI-ROUUACIJSA-N	0	3	310.397	2.224	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NC(=O)N2CC[C@@H](N(C)C)C2)C12CCCC2	ZINC000245498682	286262412	/nfs/dbraw/zinc/26/24/12/286262412.db2.gz	WRDLWWKWPIGEDS-RBSFLKMASA-N	0	3	309.454	2.070	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccc([S@@](C)=O)cc1	ZINC000253550081	402668774	/nfs/dbraw/zinc/66/87/74/402668774.db2.gz	YNBUQIWYNUDOIW-ZCCHDVMBSA-N	0	3	320.458	2.123	10	0		DEAEHN
Cc1ccc(N2CC[C@H](N3CCCN(C4CC4)CC3)C2=O)cc1	ZINC000172811008	402677468	/nfs/dbraw/zinc/67/74/68/402677468.db2.gz	UQIWQNDPQYXZCT-SFHVURJKSA-N	0	3	313.445	2.270	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)/C=C\c2nc3ccccc3s2)C1	ZINC000255076828	402678251	/nfs/dbraw/zinc/67/82/51/402678251.db2.gz	CZUXPKRRNQLOOU-KRZKBDHCSA-N	0	3	301.415	2.472	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)/C=C\c2ccc(OC)c(OC)c2)C1	ZINC000255129806	402679676	/nfs/dbraw/zinc/67/96/76/402679676.db2.gz	IOOCDQOVUZDFOV-WWRUEGTHSA-N	0	3	318.417	2.318	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(C(=O)c3cccc(F)c3)C2)CC1	ZINC000173279545	402690969	/nfs/dbraw/zinc/69/09/69/402690969.db2.gz	UWWDFIYPCNXVJD-KRWDZBQOSA-N	0	3	319.424	2.068	10	0		DEAEHN
Cc1cc2c(cc1C)O[C@H](C(=O)N1C[C@@H]3CCCN3C[C@@H]1C)C2	ZINC000173439233	402697313	/nfs/dbraw/zinc/69/73/13/402697313.db2.gz	KYTLEDRGIZDUEO-ZVZYQTTQSA-N	0	3	314.429	2.302	10	0		DEAEHN
COC(=O)Nc1ccc(NC(=O)N2CC[C@@H](N(C)C)C2)cc1F	ZINC000182586634	402701610	/nfs/dbraw/zinc/70/16/10/402701610.db2.gz	NAMUCXBHGIJYBS-LLVKDONJSA-N	0	3	324.356	2.172	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cccc(OCCCOC)c2)C1	ZINC000173562453	402702917	/nfs/dbraw/zinc/70/29/17/402702917.db2.gz	GGOFFYUWCMRKCD-INIZCTEOSA-N	0	3	320.433	2.316	10	0		DEAEHN
CC1CCC(CNC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)CC1	ZINC000262466002	402725962	/nfs/dbraw/zinc/72/59/62/402725962.db2.gz	IVTKFTLGZOMEPF-UPYBYFBQSA-N	0	3	308.466	2.461	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)Nc1ccc2c(c1)NC(=O)CS2	ZINC000262551336	402727147	/nfs/dbraw/zinc/72/71/47/402727147.db2.gz	SNAZAVURKAWYPP-CQSZACIVSA-N	0	3	319.430	2.448	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(/C=C/c2ccnc3ccccc23)n1	ZINC000263243915	402749600	/nfs/dbraw/zinc/74/96/00/402749600.db2.gz	PBLPHFVSMKWFMY-FYCOFBDGSA-N	0	3	321.384	2.364	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(CCc2ccc(Cl)cc2)n1	ZINC000263252646	402750656	/nfs/dbraw/zinc/75/06/56/402750656.db2.gz	QCJBKGAMZKRVFC-CYBMUJFWSA-N	0	3	306.797	2.084	10	0		DEAEHN
Cc1nc(CC(C)C)sc1-c1nc([C@@H]2CNCCN2C)no1	ZINC000263266487	402752292	/nfs/dbraw/zinc/75/22/92/402752292.db2.gz	RQHNBYKIZQEXNN-NSHDSACASA-N	0	3	321.450	2.276	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@@H]2c2cc(F)ccc2F)n1	ZINC000263276735	402753204	/nfs/dbraw/zinc/75/32/04/402753204.db2.gz	SWMUZWFIFOSBFZ-MPKXVKKWSA-N	0	3	320.343	2.195	10	0		DEAEHN
Cc1nc(CC(C)C)c(-c2nc([C@@H]3CNCCN3C)no2)s1	ZINC000263276815	402753360	/nfs/dbraw/zinc/75/33/60/402753360.db2.gz	SYACWVIQZUELRI-LBPRGKRZSA-N	0	3	321.450	2.276	10	0		DEAEHN
C[C@H](CNCc1cnc(-c2ccco2)s1)N1CCOCC1	ZINC000192994288	402759971	/nfs/dbraw/zinc/75/99/71/402759971.db2.gz	FAVWLKXPMLODBB-GFCCVEGCSA-N	0	3	307.419	2.213	10	0		DEAEHN
CCc1nc(CN2CCCC[C@@H](N3CCN(C)CC3)C2)cs1	ZINC000174903094	402762152	/nfs/dbraw/zinc/76/21/52/402762152.db2.gz	BJBTUEMKMJRQTF-MRXNPFEDSA-N	0	3	322.522	2.307	10	0		DEAEHN
Cn1cc(CN2CCC[C@H](Cn3cncn3)C2)c(C(C)(C)C)n1	ZINC000183406947	402764415	/nfs/dbraw/zinc/76/44/15/402764415.db2.gz	CGXMJKBSYHGFCX-AWEZNQCLSA-N	0	3	316.453	2.221	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(OC)cc1OC	ZINC000174993778	402769799	/nfs/dbraw/zinc/76/97/99/402769799.db2.gz	HBAMQGQWYCNSKI-ZIAGYGMSSA-N	0	3	318.417	2.403	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1nc2cccnc2s1	ZINC000193943304	402779281	/nfs/dbraw/zinc/77/92/81/402779281.db2.gz	MEXURVAJMKGKDQ-WDEREUQCSA-N	0	3	302.403	2.000	10	0		DEAEHN
C[C@@H]1CC[C@H](C)CN1CC(=O)N1CCN(Cc2ccco2)CC1	ZINC000174013803	402723462	/nfs/dbraw/zinc/72/34/62/402723462.db2.gz	UQSFVIZOCHBGCN-JKSUJKDBSA-N	0	3	319.449	2.044	10	0		DEAEHN
COc1ccccc1[C@H](O)CN[C@@H](C)CC(=O)OC(C)(C)C	ZINC000183712192	402791093	/nfs/dbraw/zinc/79/10/93/402791093.db2.gz	GLTASKIAFNCOFF-GXTWGEPZSA-N	0	3	309.406	2.439	10	0		DEAEHN
COc1ccccc1[C@@H](O)CN[C@@H](C)CC(=O)OC(C)(C)C	ZINC000183712159	402791196	/nfs/dbraw/zinc/79/11/96/402791196.db2.gz	GLTASKIAFNCOFF-JSGCOSHPSA-N	0	3	309.406	2.439	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cccnc2OC(C)C)C1	ZINC000194344750	402793213	/nfs/dbraw/zinc/79/32/13/402793213.db2.gz	HSBBJWOMNKEJFQ-ZDUSSCGKSA-N	0	3	306.410	2.475	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)N(CCN(C)C)Cc1ccc(F)cc1	ZINC000194353650	402793677	/nfs/dbraw/zinc/79/36/77/402793677.db2.gz	KIRTZJLIIVNYJU-RHSMWYFYSA-N	0	3	322.424	2.389	10	0		DEAEHN
CC[C@@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccncc1	ZINC000175311121	402796476	/nfs/dbraw/zinc/79/64/76/402796476.db2.gz	HAAXUJRIGGDVKW-JKSUJKDBSA-N	0	3	300.406	2.188	10	0		DEAEHN
CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1cc(OC)ccc1[O-]	ZINC000175437938	402806703	/nfs/dbraw/zinc/80/67/03/402806703.db2.gz	NHXXVFHUINHQPS-QWHCGFSZSA-N	0	3	304.390	2.100	10	0		DEAEHN
CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc(OC)ccc1[O-]	ZINC000175437938	402806705	/nfs/dbraw/zinc/80/67/05/402806705.db2.gz	NHXXVFHUINHQPS-QWHCGFSZSA-N	0	3	304.390	2.100	10	0		DEAEHN
O[C@@H](COc1ccccc1Cl)CN1CCCN(C2CC2)CC1	ZINC000195339243	402842981	/nfs/dbraw/zinc/84/29/81/402842981.db2.gz	JNQRLDDGLXDBCQ-OAHLLOKOSA-N	0	3	324.852	2.250	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000175477752	402810125	/nfs/dbraw/zinc/81/01/25/402810125.db2.gz	KTJSRKMMRZWZNK-LSDHHAIUSA-N	0	3	321.469	2.163	10	0		DEAEHN
Cc1nc2cc(F)cc(C(=O)NC[C@@H]3CCCN3C)c2nc1C	ZINC000194692766	402811059	/nfs/dbraw/zinc/81/10/59/402811059.db2.gz	XGIBBMIILBZHHI-ZDUSSCGKSA-N	0	3	316.380	2.210	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000194818185	402817112	/nfs/dbraw/zinc/81/71/12/402817112.db2.gz	WCUVZSMNTBZSOF-PBHICJAKSA-N	0	3	317.433	2.087	10	0		DEAEHN
CN(Cc1ccc2c(c1)sc(=O)n2C)C[C@H]1CCC[C@@H]1O	ZINC000195043126	402827903	/nfs/dbraw/zinc/82/79/03/402827903.db2.gz	GKAVVVXHXXNKOV-OCCSQVGLSA-N	0	3	306.431	2.193	10	0		DEAEHN
CCN1CCN(CCCCNC(=O)NC2(CC)CCC2)CC1	ZINC000175948532	402844085	/nfs/dbraw/zinc/84/40/85/402844085.db2.gz	XACZRKKZUFIYKW-UHFFFAOYSA-N	0	3	310.486	2.036	10	0		DEAEHN
O=C(CCc1cccc2c1OCO2)N1CCCN(C2CC2)CC1	ZINC000184278505	402832676	/nfs/dbraw/zinc/83/26/76/402832676.db2.gz	AFJAMCWLWCKAGA-UHFFFAOYSA-N	0	3	316.401	2.045	10	0		DEAEHN
CC[C@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1nccs1	ZINC000175157836	402783813	/nfs/dbraw/zinc/78/38/13/402783813.db2.gz	DLCVEFYBCBWMGF-OLZOCXBDSA-N	0	3	306.435	2.250	10	0		DEAEHN
CCc1csc([C@H]2CCCN(C[C@H](O)Cn3cccn3)C2)n1	ZINC000195443017	402846204	/nfs/dbraw/zinc/84/62/04/402846204.db2.gz	GQBLHPZODRFTRL-ZFWWWQNUSA-N	0	3	320.462	2.143	10	0		DEAEHN
c1[nH]c(-c2ccccc2)nc1CNC[C@@H]1CN(C2CC2)CCO1	ZINC000175993256	402846801	/nfs/dbraw/zinc/84/68/01/402846801.db2.gz	KFRVEGFDJMMLFX-QGZVFWFLSA-N	0	3	312.417	2.030	10	0		DEAEHN
c1nc(-c2ccccc2)[nH]c1CNC[C@@H]1CN(C2CC2)CCO1	ZINC000175993256	402846804	/nfs/dbraw/zinc/84/68/04/402846804.db2.gz	KFRVEGFDJMMLFX-QGZVFWFLSA-N	0	3	312.417	2.030	10	0		DEAEHN
CCn1ccnc(N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1=O	ZINC000274173682	403032161	/nfs/dbraw/zinc/03/21/61/403032161.db2.gz	NKVKBQYCEMZABK-ZBFHGGJFSA-N	0	3	312.417	2.196	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@@H](CO)c2ccccc2)C12CCOCC2	ZINC000274428631	403054674	/nfs/dbraw/zinc/05/46/74/403054674.db2.gz	JNLJITDDJNDKLH-YESZJQIVSA-N	0	3	305.418	2.284	10	0		DEAEHN
COc1ccc(NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c(C)n1	ZINC000268344814	403075296	/nfs/dbraw/zinc/07/52/96/403075296.db2.gz	HISTYSPYGCULTO-YPMHNXCESA-N	0	3	306.410	2.345	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@@H]1NCc1ccc(F)c(Br)c1	ZINC000282043184	403116370	/nfs/dbraw/zinc/11/63/70/403116370.db2.gz	AROPHZCZFDFPOX-UFBFGSQYSA-N	0	3	315.186	2.345	10	0		DEAEHN
CN1CCO[C@H](CN(Cc2ccc3c[nH]nc3c2)CC2CC2)C1	ZINC000275789512	403123688	/nfs/dbraw/zinc/12/36/88/403123688.db2.gz	SGBNXWIDGNTILW-KRWDZBQOSA-N	0	3	314.433	2.106	10	0		DEAEHN
COc1cccc2c1ncc(C)c2N1CCO[C@@H](CN(C)C)C1	ZINC000276212472	403153994	/nfs/dbraw/zinc/15/39/94/403153994.db2.gz	KGVGVWBJEDDKRX-AWEZNQCLSA-N	0	3	315.417	2.319	10	0		DEAEHN
C([C@@H]1CCCO1)N1CCN(C[C@@H]2CCCO2)[C@@H]2CCCC[C@H]21	ZINC000339734918	403433718	/nfs/dbraw/zinc/43/37/18/403433718.db2.gz	USNKYCBTIFIBOR-WNRNVDISSA-N	0	3	308.466	2.273	10	0		DEAEHN
CCc1cc(N2CC[C@@H](OCCN3CCCCC3)C2)nc(C)n1	ZINC000302069678	403708269	/nfs/dbraw/zinc/70/82/69/403708269.db2.gz	DUNQRRKNPWZICJ-QGZVFWFLSA-N	0	3	318.465	2.429	10	0		DEAEHN
CCO[C@@H]1CCCC[C@H]1NCC(=O)N1CCO[C@@H]2CCCC[C@@H]21	ZINC000333065858	403658418	/nfs/dbraw/zinc/65/84/18/403658418.db2.gz	JCIWRDIOKJJSNQ-YYIAUSFCSA-N	0	3	324.465	2.094	10	0		DEAEHN
Cc1cccc2c(N3CCc4nn(C)c(=O)cc4C3)ccnc12	ZINC000301688799	403664433	/nfs/dbraw/zinc/66/44/33/403664433.db2.gz	VRMKCEOQPBCCJM-UHFFFAOYSA-N	0	3	306.369	2.200	10	0		DEAEHN
CCN1CCC(NC(=O)c2ncsc2Br)CC1	ZINC000288776626	403767063	/nfs/dbraw/zinc/76/70/63/403767063.db2.gz	YEEMNKYDGCEKIE-UHFFFAOYSA-N	0	3	318.240	2.120	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@@H]2CN1C[C@@H](O)COCc1ccccc1	ZINC000303080314	403746872	/nfs/dbraw/zinc/74/68/72/403746872.db2.gz	MKNIMTXDOGQCET-BHIYHBOVSA-N	0	3	318.461	2.123	10	0		DEAEHN
COc1ccc2c(c1)C(C)(C)C[C@H]2N[C@H]1CCC(=O)N(C)C1=O	ZINC000333560685	403780209	/nfs/dbraw/zinc/78/02/09/403780209.db2.gz	KWLPZUMQBYMECA-LSDHHAIUSA-N	0	3	316.401	2.155	10	0		DEAEHN
Cc1c(C(=O)N[C@@H]2CC[C@@H](N(C)C)C2)[nH]c2c1C(=O)CCC2	ZINC000337156999	403969041	/nfs/dbraw/zinc/96/90/41/403969041.db2.gz	PXYAKXSLBCMMEP-VXGBXAGGSA-N	0	3	303.406	2.055	10	0		DEAEHN
c1ccc([C@@H]2N(C[C@H]3COCCO3)CC23CCOCC3)cc1	ZINC000412014884	404057581	/nfs/dbraw/zinc/05/75/81/404057581.db2.gz	RLAWGKNMSZOYTK-IRXDYDNUSA-N	0	3	303.402	2.256	10	0		DEAEHN
c1cc(-c2ccc(CN3CCS[C@@H]4COCC[C@H]43)o2)n[nH]1	ZINC000369485711	404113108	/nfs/dbraw/zinc/11/31/08/404113108.db2.gz	RWQPBNVOUFJFOI-UKRRQHHQSA-N	0	3	305.403	2.376	10	0		DEAEHN
C[C@@H]1NC(=S)N(C[C@H]2CCCN(C)[C@@H]2c2cccs2)C1=O	ZINC000369676932	404188075	/nfs/dbraw/zinc/18/80/75/404188075.db2.gz	BMPJEGMOMIDKBQ-LOWVWBTDSA-N	0	3	323.487	2.236	10	0		DEAEHN
CC1(C)CCC(=CC(=O)NC[C@@H]2CN3CCC[C@H]3CO2)CC1	ZINC000370964554	404430220	/nfs/dbraw/zinc/43/02/20/404430220.db2.gz	DHZANKFZZZMZNT-JKSUJKDBSA-N	0	3	306.450	2.492	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)nc1	ZINC000297122275	404460107	/nfs/dbraw/zinc/46/01/07/404460107.db2.gz	IGIQFMVHQVLQAS-RISCZKNCSA-N	0	3	304.394	2.231	10	0		DEAEHN
C[C@@]1(CNC(=O)c2ccnnc2)CCN(Cc2ccccc2)C1	ZINC000374155629	404699753	/nfs/dbraw/zinc/69/97/53/404699753.db2.gz	BWNORDDCEKRCST-SFHVURJKSA-N	0	3	310.401	2.119	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(CCCCC(F)(F)F)CC12COC2	ZINC000451138134	404878367	/nfs/dbraw/zinc/87/83/67/404878367.db2.gz	PZVFOUYZQUXVIJ-NSHDSACASA-N	0	3	309.328	2.231	10	0		DEAEHN
CC(C)NC(=O)N1CCO[C@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC000404162391	405068563	/nfs/dbraw/zinc/06/85/63/405068563.db2.gz	YXMHIVQBHZMZDQ-SJORKVTESA-N	0	3	317.433	2.080	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N2CCCN(C3CCCC3)CC2)[nH]1	ZINC000408013731	405089156	/nfs/dbraw/zinc/08/91/56/405089156.db2.gz	NYCDJGMGLZEQPI-UHFFFAOYSA-N	0	3	303.406	2.308	10	0		DEAEHN
Cn1c2ccc(CN3CC[C@H](C(C)(C)C)[C@@H](O)C3)cc2oc1=O	ZINC000408012416	405089542	/nfs/dbraw/zinc/08/95/42/405089542.db2.gz	IPKINMQXXJSETI-ZFWWWQNUSA-N	0	3	318.417	2.360	10	0		DEAEHN
C[C@@H]1[C@@H](C)N(C(=O)c2[nH]nc3ccc(Cl)cc32)CCN1C	ZINC000408022914	405092450	/nfs/dbraw/zinc/09/24/50/405092450.db2.gz	OYMSZKZIRJLNCZ-NXEZZACHSA-N	0	3	306.797	2.381	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)o1	ZINC000408099938	405112426	/nfs/dbraw/zinc/11/24/26/405112426.db2.gz	ZLTNTGGNUMEKGG-KGLIPLIRSA-N	0	3	312.435	2.224	10	0		DEAEHN
C(CN1CCCCC1)O[C@H]1CCN(c2nc(C3CCC3)no2)C1	ZINC000568474250	292342419	/nfs/dbraw/zinc/34/24/19/292342419.db2.gz	ZOMBPJIFLRCSMQ-HNNXBMFYSA-N	0	3	320.437	2.418	10	0		DEAEHN
COC(=O)C1=C(C)O[C@H](CN2CCC(C3CCOCC3)CC2)C1	ZINC000367952760	405202543	/nfs/dbraw/zinc/20/25/43/405202543.db2.gz	WLBWBTWRTQZOPZ-INIZCTEOSA-N	0	3	323.433	2.361	10	0		DEAEHN
COc1ccc(O)cc1C(=O)N1CCCC12CCN(C)CC2	ZINC000408440130	405207625	/nfs/dbraw/zinc/20/76/25/405207625.db2.gz	YKRMFMLRQVUOMJ-UHFFFAOYSA-N	0	3	304.390	2.101	10	0		DEAEHN
CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)NCCNc1ccncc1	ZINC000439041322	405263671	/nfs/dbraw/zinc/26/36/71/405263671.db2.gz	QGXAEWOIAAVKIC-PVAVHDDUSA-N	0	3	319.449	2.406	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCC2(C[C@H]2NCc2cncnc2)CC1	ZINC000368048161	405222952	/nfs/dbraw/zinc/22/29/52/405222952.db2.gz	WZBYKJFKQRRZGO-CQSZACIVSA-N	0	3	318.421	2.356	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)Nc2ccc(N3CCC3=O)cc2)CCN1C	ZINC000439970428	405298428	/nfs/dbraw/zinc/29/84/28/405298428.db2.gz	ZZSOSOQDCONBQR-JSGCOSHPSA-N	0	3	316.405	2.028	10	0		DEAEHN
CCCCN(C)CCNC(=O)Nc1ccc(N2CCC2=O)cc1	ZINC000439964607	405298576	/nfs/dbraw/zinc/29/85/76/405298576.db2.gz	YLNIVGBTTNQGRF-UHFFFAOYSA-N	0	3	318.421	2.277	10	0		DEAEHN
c1ccc(-n2nnnc2CCN[C@@H](c2cccnc2)C2CC2)cc1	ZINC000445767712	405356740	/nfs/dbraw/zinc/35/67/40/405356740.db2.gz	SUUBYQLKRUBPIM-GOSISDBHSA-N	0	3	320.400	2.341	10	0		DEAEHN
COc1nsc(CN[C@H](C)[C@@H]2CCOC2)c1Br	ZINC000638692268	405620114	/nfs/dbraw/zinc/62/01/14/405620114.db2.gz	FVJKMZQFXNCYAU-HTQZYQBOSA-N	0	3	321.240	2.429	10	0		DEAEHN
OCCN(Cc1ccc(-c2cc[nH]n2)o1)C1CCSCC1	ZINC000449684705	405691788	/nfs/dbraw/zinc/69/17/88/405691788.db2.gz	LYYNIPSYQYPXDC-UHFFFAOYSA-N	0	3	307.419	2.360	10	0		DEAEHN
C[C@H](CC1CCC1)NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638994801	405808102	/nfs/dbraw/zinc/80/81/02/405808102.db2.gz	OXYUMNWHIBQMRB-PBHICJAKSA-N	0	3	303.450	2.141	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N(C)C[C@H]2CCCN(C)C2)c1	ZINC000457557497	405895694	/nfs/dbraw/zinc/89/56/94/405895694.db2.gz	FNFBQORZGPSABG-AWEZNQCLSA-N	0	3	318.417	2.195	10	0		DEAEHN
Cc1nccc(N2CCN(CC3Cc4ccccc4C3)CC2)n1	ZINC000584208688	405846662	/nfs/dbraw/zinc/84/66/62/405846662.db2.gz	FTOWKVFQLHJFAS-UHFFFAOYSA-N	0	3	308.429	2.322	10	0		DEAEHN
c1cc(OCCN2CCOCC2)ccc1CN1CC(C2CC2)C1	ZINC000639194981	405962421	/nfs/dbraw/zinc/96/24/21/405962421.db2.gz	AQWDGJXDQQJTRH-UHFFFAOYSA-N	0	3	316.445	2.239	10	0		DEAEHN
c1ccc(N2CC[C@@H](CN3CC[C@@H](Nc4ncccn4)C3)C2)cc1	ZINC000639282089	406019729	/nfs/dbraw/zinc/01/97/29/406019729.db2.gz	NDOBAGSYPDDHTE-DLBZAZTESA-N	0	3	323.444	2.489	10	0		DEAEHN
COc1nsc(CNC(C)(C)CN(C)C)c1Br	ZINC000639246373	406002210	/nfs/dbraw/zinc/00/22/10/406002210.db2.gz	FPGMFTMKMLNIKC-UHFFFAOYSA-N	0	3	322.272	2.344	10	0		DEAEHN
C(c1nc(C2CCC2)no1)N1CCCN(C[C@@H]2CCCO2)CC1	ZINC000639450362	406093544	/nfs/dbraw/zinc/09/35/44/406093544.db2.gz	KXDSJCMKAHXFKI-HNNXBMFYSA-N	0	3	320.437	2.024	10	0		DEAEHN
Cc1c(Cl)c(C(=O)Nc2ccc3c(c2F)CCNC3)nn1C	ZINC000515414898	406068144	/nfs/dbraw/zinc/06/81/44/406068144.db2.gz	XCEGMQRBVDEJGH-UHFFFAOYSA-N	0	3	322.771	2.419	10	0		DEAEHN
CO[C@@H](C)[C@@H](C)NC(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000460669489	406079799	/nfs/dbraw/zinc/07/97/99/406079799.db2.gz	FUNAYOQMIFLLKA-HLLBOEOZSA-N	0	3	319.449	2.231	10	0		DEAEHN
Cc1nn(CC(=O)OC(C)C)c(C)c1CN(C)C1CCOCC1	ZINC000534344711	406185244	/nfs/dbraw/zinc/18/52/44/406185244.db2.gz	HTCUENCWRZNEAG-UHFFFAOYSA-N	0	3	323.437	2.062	10	0		DEAEHN
Cc1cc(C)c([C@H](C)[N@@H+]2CCC[C@@]3(C2)NC(=O)[N-]C3=O)c(C)c1	ZINC000568160816	406199454	/nfs/dbraw/zinc/19/94/54/406199454.db2.gz	SOHSLSNPXMAYFD-KSSFIOAISA-N	0	3	315.417	2.347	10	0		DEAEHN
Cc1cc(C)c([C@H](C)[N@H+]2CCC[C@@]3(C2)NC(=O)[N-]C3=O)c(C)c1	ZINC000568160816	406199457	/nfs/dbraw/zinc/19/94/57/406199457.db2.gz	SOHSLSNPXMAYFD-KSSFIOAISA-N	0	3	315.417	2.347	10	0		DEAEHN
CC(C)N(Cc1ccccc1)C(=O)CN1CC[C@H](CO)[C@H]1C	ZINC000488730806	406341415	/nfs/dbraw/zinc/34/14/15/406341415.db2.gz	HYNZTFJCAXAWPC-NVXWUHKLSA-N	0	3	304.434	2.126	10	0		DEAEHN
CSc1ccc(CN(C)C(=O)CN2CC[C@H](CO)[C@@H]2C)cc1	ZINC000488809413	406351280	/nfs/dbraw/zinc/35/12/80/406351280.db2.gz	TXDLRVKXTWEVHW-DZGCQCFKSA-N	0	3	322.474	2.070	10	0		DEAEHN
C[C@@H](N(C)C(=O)[C@H](N)CN(C)Cc1ccccc1)C(C)(C)C	ZINC000637930076	406482103	/nfs/dbraw/zinc/48/21/03/406482103.db2.gz	SMPKFAVUQMMTBJ-GDBMZVCRSA-N	0	3	305.466	2.339	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N(C(=O)[C@@H](N)CN(C)Cc2ccccc2)C1	ZINC000638007428	406520423	/nfs/dbraw/zinc/52/04/23/406520423.db2.gz	NJMNNTFUYLHKSB-VYDXJSESSA-N	0	3	303.450	2.093	10	0		DEAEHN
O[C@H](COC[C@H]1CCCO1)CN1CC[C@H](c2cccc(F)c2)C1	ZINC000552254109	406699040	/nfs/dbraw/zinc/69/90/40/406699040.db2.gz	MHIKUCADSPTKAX-RYQLBKOJSA-N	0	3	323.408	2.172	10	0		DEAEHN
CC[C@](N)(c1ccc(F)cn1)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000128807367	195993152	/nfs/dbraw/zinc/99/31/52/195993152.db2.gz	RISCYSKVKGHCQD-OSAQELSMSA-N	0	3	314.426	2.388	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2ccc(CN)c(Cl)c2)CC[C@@H]1C	ZINC000129715985	196070014	/nfs/dbraw/zinc/07/00/14/196070014.db2.gz	HJIYSQGOTSGEQY-QWRGUYRKSA-N	0	3	316.854	2.465	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2ccc(CN)cc2Cl)CC[C@@H]1C	ZINC000129714829	196070292	/nfs/dbraw/zinc/07/02/92/196070292.db2.gz	WBWLBAHIUZXINY-QWRGUYRKSA-N	0	3	316.854	2.465	10	0		DEAEHN
C[C@@H](CNS(=O)(=O)c1cccc(CN)c1)c1ccccc1	ZINC000131162579	196145814	/nfs/dbraw/zinc/14/58/14/196145814.db2.gz	NQNZXOXYTSIRDJ-ZDUSSCGKSA-N	0	3	304.415	2.227	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2ccc(Cl)c(CN)c2)CC[C@@H]1C	ZINC000131785845	196199002	/nfs/dbraw/zinc/19/90/02/196199002.db2.gz	MHBJTZJMCPTSME-QWRGUYRKSA-N	0	3	316.854	2.465	10	0		DEAEHN
C[C@@H]1CN(C[C@@H]2CCCN(S(C)(=O)=O)C2)[C@@H]1c1ccccc1	ZINC000132127031	196228196	/nfs/dbraw/zinc/22/81/96/196228196.db2.gz	DHVZQEXMQKEUKB-VYDXJSESSA-N	0	3	322.474	2.351	10	0		DEAEHN
C[C@@H]1CNC[C@@H](COCc2cc(Br)ccc2F)O1	ZINC000132595748	196269146	/nfs/dbraw/zinc/26/91/46/196269146.db2.gz	WKEQBAVYNZEVMU-SKDRFNHKSA-N	0	3	318.186	2.482	10	0		DEAEHN
CCCNC1(c2nc(C)cs2)CCN(C(=O)N(C)C)CC1	ZINC000132904274	196295117	/nfs/dbraw/zinc/29/51/17/196295117.db2.gz	LJGREGQPAOXPLJ-UHFFFAOYSA-N	0	3	310.467	2.424	10	0		DEAEHN
COCc1cc([C@H](C)N[C@@H]2CCC(=O)N(C)C2)ccc1OC	ZINC000133006142	196304255	/nfs/dbraw/zinc/30/42/55/196304255.db2.gz	BHMYRYKSUQLSKQ-SWLSCSKDSA-N	0	3	306.406	2.113	10	0		DEAEHN
CC[C@H](C)c1nc(N(C)CCOC)sc1CNCCOC	ZINC000133138450	196315108	/nfs/dbraw/zinc/31/51/08/196315108.db2.gz	KBNCKEZAVRHAGR-LBPRGKRZSA-N	0	3	315.483	2.475	10	0		DEAEHN
CCC[NH+]1CCC(CNC(=O)c2cc(OC)ccc2[O-])CC1	ZINC000133279990	196326848	/nfs/dbraw/zinc/32/68/48/196326848.db2.gz	UGDTWEAFHQYVAB-UHFFFAOYSA-N	0	3	306.406	2.253	10	0		DEAEHN
CN[C@@H](CC[C@@H]1CCCO1)c1c(Cl)cnn1CCOC	ZINC000133969763	196350730	/nfs/dbraw/zinc/35/07/30/196350730.db2.gz	LVLFZXUYFUDPPY-AAEUAGOBSA-N	0	3	301.818	2.403	10	0		DEAEHN
CCNc1nc(Cl)nc(N2CCN(C3CCCC3)CC2)n1	ZINC000134104602	196361753	/nfs/dbraw/zinc/36/17/53/196361753.db2.gz	CNMQEBWSEMSUFY-UHFFFAOYSA-N	0	3	310.833	2.021	10	0		DEAEHN
CCN[C@H](Cc1ccc(Cl)cc1F)[C@@H](C)S(C)(=O)=O	ZINC000134214162	196371189	/nfs/dbraw/zinc/37/11/89/196371189.db2.gz	JUNGLHZLKAIRTN-NOZJJQNGSA-N	0	3	307.818	2.433	10	0		DEAEHN
COc1ccc(Br)cc1C[C@]1(O)CCCN(C)C1	ZINC000134345545	196380561	/nfs/dbraw/zinc/38/05/61/196380561.db2.gz	PRDFMKWQCVJHKR-CQSZACIVSA-N	0	3	314.223	2.457	10	0		DEAEHN
Cc1cc(C(F)(F)F)ccc1CNC[C@@H]1CN(C)CCO1	ZINC000190946744	225099177	/nfs/dbraw/zinc/09/91/77/225099177.db2.gz	GUWPXZPCOFEEQC-CQSZACIVSA-N	0	3	302.340	2.434	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC[C@@H](n2ccc(N)n2)CC1	ZINC000616629720	422516831	/nfs/dbraw/zinc/51/68/31/422516831.db2.gz	ZSEWPUIBWQTGDJ-CYBMUJFWSA-N	0	3	323.441	2.017	10	0		DEAEHN
CC1(C)CN(C[C@H](O)CCc2ccccc2)C[C@]2(CCOC2)O1	ZINC000361528222	424845470	/nfs/dbraw/zinc/84/54/70/424845470.db2.gz	VKTPGIFCQMORPF-MJGOQNOKSA-N	0	3	319.445	2.250	10	0		DEAEHN
O=C([C@H]1COc2ccc(Cl)cc2C1)N1CCN2CCC[C@@H]2C1	ZINC000195321659	424882300	/nfs/dbraw/zinc/88/23/00/424882300.db2.gz	JUDCAEKZPOSTTK-UKRRQHHQSA-N	0	3	320.820	2.198	10	0		DEAEHN
CN1CC=C(CNC(=O)Nc2cc(C3(C)CCCC3)on2)CC1	ZINC000572462730	424934918	/nfs/dbraw/zinc/93/49/18/424934918.db2.gz	SIYVLNYJOBOBFO-UHFFFAOYSA-N	0	3	318.421	2.890	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc(C)c(OC)c2)CCN1C[C@H](C)O	ZINC000248998758	424886780	/nfs/dbraw/zinc/88/67/80/424886780.db2.gz	PUPBXGWBNMQRMM-RDJZCZTQSA-N	0	3	306.450	2.281	10	0		DEAEHN
C(CN1CCCCCC1)Nc1nnc(C2CCOCC2)s1	ZINC000558890333	424887192	/nfs/dbraw/zinc/88/71/92/424887192.db2.gz	UHIZIZYVCSIGGL-UHFFFAOYSA-N	0	3	310.467	2.720	10	0		DEAEHN
CCCn1nccc1NC(=O)N(CCN(C)C)Cc1ccco1	ZINC000088349400	267398852	/nfs/dbraw/zinc/39/88/52/267398852.db2.gz	GSQJKGORPBREQA-UHFFFAOYSA-N	0	3	319.409	2.482	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)c2ccc(Br)c(F)c2)C1	ZINC000390009080	269097345	/nfs/dbraw/zinc/09/73/45/269097345.db2.gz	SFBCSGLDJKNIOI-SNVBAGLBSA-N	0	3	315.186	2.412	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)c2coc(Br)c2)CCN1C	ZINC000393539871	269099872	/nfs/dbraw/zinc/09/98/72/269099872.db2.gz	XJYQPCSLSRDAMQ-SCZZXKLOSA-N	0	3	301.184	2.255	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)c2coc(Br)c2)CCN1C	ZINC000393539870	269099949	/nfs/dbraw/zinc/09/99/49/269099949.db2.gz	XJYQPCSLSRDAMQ-PSASIEDQSA-N	0	3	301.184	2.255	10	0		DEAEHN
Cc1oc(Br)cc1C(=O)N1CC[C@@H](N(C)C)C1	ZINC000396727984	269104424	/nfs/dbraw/zinc/10/44/24/269104424.db2.gz	NJNWKHUHSKJMGB-SECBINFHSA-N	0	3	301.184	2.127	10	0		DEAEHN
OC1(CNc2ncc(F)cn2)CCN(Cc2ccccc2)CC1	ZINC000397596396	269107011	/nfs/dbraw/zinc/10/70/11/269107011.db2.gz	QCKJQFSZRVOMNO-UHFFFAOYSA-N	0	3	316.380	2.055	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN1CC[C@@H]([C@H]2CCOC2)C1	ZINC000430233214	269127044	/nfs/dbraw/zinc/12/70/44/269127044.db2.gz	KESQSMTUZVQUBS-SJORKVTESA-N	0	3	312.417	2.185	10	0		DEAEHN
C[C@H]1CN(C)CCN1C[C@H](O)Cc1ccccc1C(F)(F)F	ZINC000443411972	269137359	/nfs/dbraw/zinc/13/73/59/269137359.db2.gz	HLFIVJDXOJNCCF-GXTWGEPZSA-N	0	3	316.367	2.245	10	0		DEAEHN
C[C@@H](NCCCN1CCCC1=O)c1nc2ccccc2n1C	ZINC000091265505	274246657	/nfs/dbraw/zinc/24/66/57/274246657.db2.gz	CTDWJKDRAGGRHR-CYBMUJFWSA-N	0	3	300.406	2.236	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H]2CCOc3c(F)cccc32)C1	ZINC000188182876	276167057	/nfs/dbraw/zinc/16/70/57/276167057.db2.gz	UWOXQGUCVMLASE-DOMZBBRYSA-N	0	3	321.396	2.433	10	0		DEAEHN
CCN1CCC[C@@H](N[C@H](C)c2cnc3cc(C)nn3c2C)C1	ZINC000249614580	276168032	/nfs/dbraw/zinc/16/80/32/276168032.db2.gz	PULRBHDLZPJKTQ-UKRRQHHQSA-N	0	3	301.438	2.481	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)N(C)C	ZINC000178645942	276268637	/nfs/dbraw/zinc/26/86/37/276268637.db2.gz	CQGPQALZTATGCC-JKSUJKDBSA-N	0	3	308.397	2.456	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)N1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000123669050	276363221	/nfs/dbraw/zinc/36/32/21/276363221.db2.gz	ZQTNMAYOCBRKDM-JFIYKMOQSA-N	0	3	323.481	2.197	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2C[C@]23CCCc2ccccc23)n1	ZINC000263228128	277116634	/nfs/dbraw/zinc/11/66/34/277116634.db2.gz	NCCNIDAIPYIBES-MDZRGWNJSA-N	0	3	324.428	2.407	10	0		DEAEHN
CN1CC[C@H](NC(=O)[C@@H]2CCn3ccnc3C2)[C@@H]1c1ccccc1	ZINC000180107587	277168153	/nfs/dbraw/zinc/16/81/53/277168153.db2.gz	AUVAELWREBMFRB-RYRKJORJSA-N	0	3	324.428	2.007	10	0		DEAEHN
CS(=O)(=O)N1CCC[C@H](CN2CCCc3ccccc3C2)C1	ZINC000176333571	278110187	/nfs/dbraw/zinc/11/01/87/278110187.db2.gz	OAVBFEVNMLKAJX-OAHLLOKOSA-N	0	3	322.474	2.106	10	0		DEAEHN
CSC[C@H](C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179169339	278136997	/nfs/dbraw/zinc/13/69/97/278136997.db2.gz	AVJREGNFIHESFG-AEGPPILISA-N	0	3	307.463	2.483	10	0		DEAEHN
C[C@H](C(=O)N1CCC[C@@H]1c1cnn(C)c1)N1CCCCCC1	ZINC000176000477	278139633	/nfs/dbraw/zinc/13/96/33/278139633.db2.gz	KHKXUTSPUROVSJ-GDBMZVCRSA-N	0	3	304.438	2.348	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@@H]1COc2ccccc21	ZINC000120425262	288073833	/nfs/dbraw/zinc/07/38/33/288073833.db2.gz	JCOPEMLUQQSADJ-YUELXQCFSA-N	0	3	303.406	2.102	10	0		DEAEHN
CCN(CC)C(=O)[C@@H](c1ccccc1)N1CCN2CCC[C@@H]2C1	ZINC000178635031	279075981	/nfs/dbraw/zinc/07/59/81/279075981.db2.gz	FYHIYKZILKTDDY-QZTJIDSGSA-N	0	3	315.461	2.376	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)/C=C\c2ccc(OC)c(O)c2)C1	ZINC000492704384	279293048	/nfs/dbraw/zinc/29/30/48/279293048.db2.gz	KDVUHNRZYAESCR-IUCKJTJTSA-N	0	3	304.390	2.015	10	0		DEAEHN
C[C@H](CNC(=O)N(C)CCc1ccc(F)cc1)N(C)C1CC1	ZINC000105270177	279328092	/nfs/dbraw/zinc/32/80/92/279328092.db2.gz	GJEKIEPWRYETCE-CYBMUJFWSA-N	0	3	307.413	2.492	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000250120613	288866643	/nfs/dbraw/zinc/86/66/43/288866643.db2.gz	IPWJXESBALYKKL-UAGQMJEPSA-N	0	3	304.434	2.091	10	0		DEAEHN
C[C@H](C1CC1)N(C(=O)CN1CC[C@H]2OCCC[C@H]2C1)C1CC1	ZINC000246565096	289397788	/nfs/dbraw/zinc/39/77/88/289397788.db2.gz	HKHJPBFVELLBBH-UKPHBRMFSA-N	0	3	306.450	2.277	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2scnc2C(C)(C)C)n1	ZINC000263314844	290061786	/nfs/dbraw/zinc/06/17/86/290061786.db2.gz	ZIKHJTWYTORYGS-SECBINFHSA-N	0	3	307.423	2.067	10	0		DEAEHN
NC(=O)N1CCC(N[C@@H]2CCCOc3c(F)cccc32)CC1	ZINC000181088847	303263097	/nfs/dbraw/zinc/26/30/97/303263097.db2.gz	WMUNMCIMFMDHMG-CQSZACIVSA-N	0	3	307.369	2.172	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccc(NC(=O)OC)cc2)C1	ZINC000194653381	517655404	/nfs/dbraw/zinc/65/54/04/517655404.db2.gz	WNSLHZKFLIRXMP-CQSZACIVSA-N	0	3	305.378	2.079	10	0		DEAEHN
CC(C)CCc1nc(CN2CCO[C@@H](CN(C)C)C2)cs1	ZINC000105923947	519697985	/nfs/dbraw/zinc/69/79/85/519697985.db2.gz	VBCZTYHXDHQQBB-HNNXBMFYSA-N	0	3	311.495	2.494	10	0		DEAEHN
CCCCCN(CCO)Cc1cc(OC)c2c(c1)OCCO2	ZINC000126874123	520171860	/nfs/dbraw/zinc/17/18/60/520171860.db2.gz	FIBSFTDSKXNZNY-UHFFFAOYSA-N	0	3	309.406	2.451	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)CCc2ccccc2OC)C1	ZINC000105174165	521618923	/nfs/dbraw/zinc/61/89/23/521618923.db2.gz	NKCJGSOGPMWINJ-MRXNPFEDSA-N	0	3	319.449	2.363	10	0		DEAEHN
COc1ccc(CC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1F	ZINC000124463342	523888098	/nfs/dbraw/zinc/88/80/98/523888098.db2.gz	UNPSMMQOFIZVJS-GXTWGEPZSA-N	0	3	308.397	2.318	10	0		DEAEHN
C[C@H](Cc1ccccc1F)N[C@@H]1CCN(C2CCOCC2)C1=O	ZINC000364848271	524741786	/nfs/dbraw/zinc/74/17/86/524741786.db2.gz	PTUGJECDRXSLBV-CXAGYDPISA-N	0	3	320.408	2.126	10	0		DEAEHN
Cc1ccc(F)c(OCC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000158467901	524827518	/nfs/dbraw/zinc/82/75/18/524827518.db2.gz	ATHJNYNWIDWXBQ-KGLIPLIRSA-N	0	3	308.397	2.454	10	0		DEAEHN
C[C@]1(CNC(=O)C2(O)CCC2)CCCN1Cc1ccccc1	ZINC000154840566	525247189	/nfs/dbraw/zinc/24/71/89/525247189.db2.gz	CHYVUGDMRHKSDY-QGZVFWFLSA-N	0	3	302.418	2.072	10	0		DEAEHN
CN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H]1C[C@H](F)CN1	ZINC000188227338	536466370	/nfs/dbraw/zinc/46/63/70/536466370.db2.gz	NVCMFQLKMRDQTG-NWDGAFQWSA-N	0	3	304.287	2.364	10	0		DEAEHN
CC(=O)N[C@@H]1CCCN(CCCc2ccc3c(c2)CCO3)C1	ZINC000192617971	526853809	/nfs/dbraw/zinc/85/38/09/526853809.db2.gz	QVNSQLFLNSHHTM-QGZVFWFLSA-N	0	3	302.418	2.155	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)CN[C@H]1CCC(=O)N[C@@H]1C1CC1	ZINC000328928108	529269877	/nfs/dbraw/zinc/26/98/77/529269877.db2.gz	XPXQKTMCRQGCQO-JKIFEVAISA-N	0	3	307.438	2.265	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)N1CCc2ccccc2C1	ZINC000261649071	535042244	/nfs/dbraw/zinc/04/22/44/535042244.db2.gz	FOKYJRXTZMWYGT-FRQCXROJSA-N	0	3	314.429	2.104	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)N1CCC[C@@H](n2cc(C)cn2)C1	ZINC000247041772	535494289	/nfs/dbraw/zinc/49/42/89/535494289.db2.gz	DUXDQVLVGZNOHQ-CVEARBPZSA-N	0	3	304.438	2.229	10	0		DEAEHN
CCc1cccc(OCCN2CCN(C[C@@H](C)O)[C@@H](CC)C2)c1	ZINC000247240319	535906165	/nfs/dbraw/zinc/90/61/65/535906165.db2.gz	SGUNKCIWXCFYLF-AEFFLSMTSA-N	0	3	320.477	2.405	10	0		DEAEHN
CN(C)Cc1c2ccccc2oc1C(=O)NC[C@H](CO)C1CC1	ZINC000359773758	535974612	/nfs/dbraw/zinc/97/46/12/535974612.db2.gz	KMKMTIPFIUDWQB-CYBMUJFWSA-N	0	3	316.401	2.243	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)COCc2ccccc2)C1	ZINC000246797950	536469653	/nfs/dbraw/zinc/46/96/53/536469653.db2.gz	ROAHTAHYHYOZNQ-DLBZAZTESA-N	0	3	302.418	2.146	10	0		DEAEHN
COc1ccc(F)cc1CC(=O)N1CC[C@H]2CC[C@@H](C1)N2C	ZINC000248471097	536618002	/nfs/dbraw/zinc/61/80/02/536618002.db2.gz	INFGKGLMKBLINS-CABCVRRESA-N	0	3	306.381	2.072	10	0		DEAEHN
COCc1ccc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)cc1	ZINC000246918120	536748474	/nfs/dbraw/zinc/74/84/74/536748474.db2.gz	WCYVMROQOSNOEO-IRXDYDNUSA-N	0	3	302.418	2.389	10	0		DEAEHN
COc1ccc(NC(=O)CCN2CCN3CCCC[C@H]3C2)cc1	ZINC000248366416	536758973	/nfs/dbraw/zinc/75/89/73/536758973.db2.gz	SBJDTKIFKPZPKJ-INIZCTEOSA-N	0	3	317.433	2.194	10	0		DEAEHN
COc1cc(CNCCN2CC=C(C)CC2)cc2c1OCO2	ZINC000358132929	536798119	/nfs/dbraw/zinc/79/81/19/536798119.db2.gz	HPNDHEHWJYEDCN-UHFFFAOYSA-N	0	3	304.390	2.166	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC[C@H]1CCC[C@H](C)C1	ZINC000247476479	536859753	/nfs/dbraw/zinc/85/97/53/536859753.db2.gz	IGSOPNNQOUZNKG-HRCADAONSA-N	0	3	311.470	2.223	10	0		DEAEHN
COc1ccc(CN[C@@H](C(N)=O)C(C)C)cc1Br	ZINC000107322927	563316081	/nfs/dbraw/zinc/31/60/81/563316081.db2.gz	XXILIUSAZLHSMR-GFCCVEGCSA-N	0	3	315.211	2.057	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@]2(C1)NCCc1nc[nH]c12	ZINC000724104167	563496383	/nfs/dbraw/zinc/49/63/83/563496383.db2.gz	ZBVCGFKBIVDBRN-BZNIZROVSA-N	0	3	306.410	2.218	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)/C(C)=C\c1ccc(F)cc1	ZINC000255632104	625571453	/nfs/dbraw/zinc/57/14/53/625571453.db2.gz	PARUWCLXTIYWCT-AINHQSCGSA-N	0	3	320.408	2.456	10	0		DEAEHN
C[C@@H](O)CCCN(C(=O)OC(C)(C)C)c1ccc(CN)nc1	ZINC000757134188	623048281	/nfs/dbraw/zinc/04/82/81/623048281.db2.gz	LLNUPLBNBNOFKR-GFCCVEGCSA-N	0	3	309.410	2.443	10	0		DEAEHN
CN(CC1CC1)C(=O)CN1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000247486011	624648872	/nfs/dbraw/zinc/64/88/72/624648872.db2.gz	KNSZRAHQYMHYKY-QZTJIDSGSA-N	0	3	316.445	2.443	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)S(=O)(=O)/C=C\c1ccccc1	ZINC000255435491	624723906	/nfs/dbraw/zinc/72/39/06/624723906.db2.gz	WNOISYXHFRIEGF-DVFVSVACSA-N	0	3	308.447	2.403	10	0		DEAEHN
CC(C)OC[C@@H](O)CNCc1csc(Br)c1	ZINC000309342061	625135545	/nfs/dbraw/zinc/13/55/45/625135545.db2.gz	KPNOOZPTXHYKAE-JTQLQIEISA-N	0	3	308.241	2.386	10	0		DEAEHN
COC(=O)/C(C)=C\CN1CCN(CCc2cccs2)CC1	ZINC000748814291	637312303	/nfs/dbraw/zinc/31/23/03/637312303.db2.gz	YNGBFTWAFSMFDM-RZNTYIFUSA-N	0	3	308.447	2.028	10	0		DEAEHN
CCN(C[C@H]1CCOC1)Cn1ncc2cc(C(=O)OC)ccc21	ZINC000738080522	637969190	/nfs/dbraw/zinc/96/91/90/637969190.db2.gz	GHAJFSOHFNVRES-CYBMUJFWSA-N	0	3	317.389	2.139	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)c2ncccn2)[C@H]1c1cccs1	ZINC000743568495	638157813	/nfs/dbraw/zinc/15/78/13/638157813.db2.gz	WCCPCFFUMSEPNS-JSGCOSHPSA-N	0	3	316.430	2.351	10	0		DEAEHN
CC(=O)N1CCC[C@@H]1C(=O)C(C#N)c1nc2ccccc2s1	ZINC000041500969	641584864	/nfs/dbraw/zinc/58/48/64/641584864.db2.gz	USRZQIIJGHXVHS-WCQYABFASA-N	0	3	313.382	2.483	10	0		DEAEHN
CN1CCCN(C(=O)N[C@H]2Cc3ccc(Cl)cc3C2)CC1	ZINC000800740163	645301403	/nfs/dbraw/zinc/30/14/03/645301403.db2.gz	YEAWRPRZZNRYQF-HNNXBMFYSA-N	0	3	307.825	2.154	10	0		DEAEHN
Cn1c2ccccc2nc1C(C#N)C(=O)C=Cc1ccncn1	ZINC000156325740	646412181	/nfs/dbraw/zinc/41/21/81/646412181.db2.gz	RLZRBHWQFJHSBW-KTRBRXNASA-N	0	3	303.325	2.253	10	0		DEAEHN
COCCN(C)CCNC(=O)c1ccc(-c2ccccc2)n1C	ZINC000173439277	646769247	/nfs/dbraw/zinc/76/92/47/646769247.db2.gz	ATQJAIVWYRFYHK-UHFFFAOYSA-N	0	3	315.417	2.000	10	0		DEAEHN
COC(=O)C[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccccc2)C1	ZINC000151558706	646932441	/nfs/dbraw/zinc/93/24/41/646932441.db2.gz	PURFPBDKMOZUHK-HIFRSBDPSA-N	0	3	305.374	2.003	10	0		DEAEHN
CN(Cc1cccs1)C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C	ZINC000228894714	647407234	/nfs/dbraw/zinc/40/72/34/647407234.db2.gz	GDJCQJFTQWDONG-HEHGZKQESA-N	0	3	308.447	2.239	10	0		DEAEHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1cn(C)cn1	ZINC000389805959	685435777	/nfs/dbraw/zinc/43/57/77/685435777.db2.gz	BMMFJJJOGFXARF-TZMCWYRMSA-N	0	3	308.426	2.155	10	0		DEAEHN
C[C@@H](C[C@@H]1CCC(=O)N1)NCc1ccn(Cc2ccccc2)n1	ZINC000389971817	685437151	/nfs/dbraw/zinc/43/71/51/685437151.db2.gz	VRIIAVIPWPGFIR-HOCLYGCPSA-N	0	3	312.417	2.078	10	0		DEAEHN
COc1ccc2ccc(O)c(CN3CCCNC(=O)[C@H]3C)c2c1	ZINC000190699060	684412296	/nfs/dbraw/zinc/41/22/96/684412296.db2.gz	BGQXBALMYRSROV-GFCCVEGCSA-N	0	3	314.385	2.264	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)Cc2ccc(Cl)nc2)C1	ZINC000194171683	685059447	/nfs/dbraw/zinc/05/94/47/685059447.db2.gz	RIPCFKBJCVNKAM-CYBMUJFWSA-N	0	3	310.829	2.361	10	0		DEAEHN
COc1ccccc1[C@H](O)CNC(=O)[C@@H](C)N1[C@H](C)CC[C@@H]1C	ZINC000245201829	685109433	/nfs/dbraw/zinc/10/94/33/685109433.db2.gz	MZSIFYKGVWIMMJ-HLPPOEQASA-N	0	3	320.433	2.106	10	0		DEAEHN
CC[C@@H](NCc1c(Br)cnn1C)[C@@H]1CCCOC1	ZINC000724007672	777220034	/nfs/dbraw/zinc/22/00/34/777220034.db2.gz	KAMASRYQHHXXRP-ZYHUDNBSSA-N	0	3	316.243	2.477	10	0		DEAEHN
C[C@](O)(CN1CCC12CCOCC2)C(F)(F)C(F)(F)F	ZINC000724118063	777246025	/nfs/dbraw/zinc/24/60/25/777246025.db2.gz	QRDKYGRPCYCMEB-VIFPVBQESA-N	0	3	303.271	2.190	10	0		DEAEHN
Brc1ccsc1CNC[C@@H]1C[C@@H]2COC[C@@H]2O1	ZINC000724618071	777398286	/nfs/dbraw/zinc/39/82/86/777398286.db2.gz	QINFWSBCRRYNMG-YWVKMMECSA-N	0	3	318.236	2.404	10	0		DEAEHN
Cc1cnn(C)c1CN[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000721894316	787323712	/nfs/dbraw/zinc/32/37/12/787323712.db2.gz	YXFJEVAQHUYHBI-CHWSQXEVSA-N	0	3	308.426	2.074	10	0		DEAEHN
CC[C@H](NCc1cn(C)nc1Br)[C@H]1CCOC1	ZINC000720644362	1085808535	/nfs/dbraw/zinc/80/85/35/1085808535.db2.gz	AHIJUOMQESSRFH-ONGXEEELSA-N	0	3	302.216	2.087	10	0		DEAEHN
CN1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc(Br)c[nH]1	ZINC000720816616	1086168090	/nfs/dbraw/zinc/16/80/90/1086168090.db2.gz	OPWKYQCOMZFUGS-RYUDHWBXSA-N	0	3	312.211	2.086	10	0		DEAEHN
CN1CCC[C@H]2[C@H]1CCN2C(=O)c1ncccc1Br	ZINC000720818266	1086169066	/nfs/dbraw/zinc/16/90/66/1086169066.db2.gz	UNRZOFUHJCAAJJ-NEPJUHHUSA-N	0	3	324.222	2.153	10	0		DEAEHN
CN1CCOC[C@@H]1CNCc1ccc(CSC(F)F)o1	ZINC000700143036	1086309519	/nfs/dbraw/zinc/30/95/19/1086309519.db2.gz	OCIRNKQEMDLKJQ-JTQLQIEISA-N	0	3	306.378	2.156	10	0		DEAEHN
Cc1ccc(N(C)C(=O)[C@H](N)CN(C)Cc2ccccc2)cc1	ZINC000702409112	1086432271	/nfs/dbraw/zinc/43/22/71/1086432271.db2.gz	OBIYOCUAOKWMFK-GOSISDBHSA-N	0	3	311.429	2.417	10	0		DEAEHN
COC[C@H](C)OC(=O)N[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000704469443	1086580497	/nfs/dbraw/zinc/58/04/97/1086580497.db2.gz	AOYUBXKMOXISDQ-WMLDXEAASA-N	0	3	306.406	2.412	10	0		DEAEHN
Cc1oc(Br)cc1C(=O)N[C@@H]1CCN(C)[C@H]1C	ZINC000719391789	1089082346	/nfs/dbraw/zinc/08/23/46/1089082346.db2.gz	BQFBEWBPHUFDQS-OIBJUYFYSA-N	0	3	301.184	2.173	10	0		DEAEHN
Cc1oc(Br)cc1C(=O)N[C@@H]1CCN(C)[C@@H]1C	ZINC000719391788	1089081039	/nfs/dbraw/zinc/08/10/39/1089081039.db2.gz	BQFBEWBPHUFDQS-GMSGAONNSA-N	0	3	301.184	2.173	10	0		DEAEHN
CN[C@@H](CSCCS(C)(=O)=O)c1cc(C)ccc1C	ZINC000081768722	192322497	/nfs/dbraw/zinc/32/24/97/192322497.db2.gz	HVMFYKOGLBXQQQ-AWEZNQCLSA-N	0	3	301.477	2.342	10	0		DEAEHN
CCc1ccc([C@@H](CSCCS(C)(=O)=O)NC)cc1	ZINC000081769003	192322934	/nfs/dbraw/zinc/32/29/34/192322934.db2.gz	VXZXDIJQOPYJIG-CQSZACIVSA-N	0	3	301.477	2.287	10	0		DEAEHN
Cn1c(SC[C@H](N)c2ccc3ccccc3c2)n[nH]c1=O	ZINC000081881904	192333951	/nfs/dbraw/zinc/33/39/51/192333951.db2.gz	CTTDXNCBFSQUNC-ZDUSSCGKSA-N	0	3	300.387	2.054	10	0		DEAEHN
CCOC(=O)c1c(C)c(C)sc1NC(=O)C(C)=C1CNC1	ZINC000164417639	197653365	/nfs/dbraw/zinc/65/33/65/197653365.db2.gz	OAADETLEMCVVKO-UHFFFAOYSA-N	0	3	308.403	2.400	10	0		DEAEHN
CCOC(=O)CC[C@H]1CCCN(C(=O)CC2CCN(C)CC2)C1	ZINC000612438415	361827798	/nfs/dbraw/zinc/82/77/98/361827798.db2.gz	WPECGSBQXBKFJN-MRXNPFEDSA-N	0	3	324.465	2.300	10	0		DEAEHN
Cc1c([C@H]2OCC[C@@H]2NCc2cnn(C(C)(C)C)c2)cnn1C	ZINC000328643386	231279246	/nfs/dbraw/zinc/27/92/46/231279246.db2.gz	YWAIHGVOOBEAEI-JKSUJKDBSA-N	0	3	317.437	2.300	10	0		DEAEHN
CCC[C@H](C[NH3+])[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000087404218	185223896	/nfs/dbraw/zinc/22/38/96/185223896.db2.gz	VWCTZVRCMZEQJR-MRVPVSSYSA-N	0	3	311.234	2.399	10	0		DEAEHN
CCC[C@H](CN)C(=O)Nc1cc(S(C)(=O)=O)ccc1Cl	ZINC000087517853	185227463	/nfs/dbraw/zinc/22/74/63/185227463.db2.gz	WKHRVGYRKGQZCP-SECBINFHSA-N	0	3	318.826	2.057	10	0		DEAEHN
CC(C)[C@@H](N)CS(=O)(=O)c1ccccc1Br	ZINC000087539924	185228195	/nfs/dbraw/zinc/22/81/95/185228195.db2.gz	PFKVKHMCPQFQPF-JTQLQIEISA-N	0	3	306.225	2.206	10	0		DEAEHN
O[C@@H]1CCOC[C@@H]1[C@@H]1CCCN1Cc1nc2cccnc2s1	ZINC000328807385	231352573	/nfs/dbraw/zinc/35/25/73/231352573.db2.gz	MBYXOPPWDJBAMY-KWCYVHTRSA-N	0	3	319.430	2.053	10	0		DEAEHN
CC[C@@H](N)CS(=O)(=O)Cc1ccc(Br)cc1	ZINC000088074794	185238829	/nfs/dbraw/zinc/23/88/29/185238829.db2.gz	ZMKHRUIOSOXAEW-LLVKDONJSA-N	0	3	306.225	2.101	10	0		DEAEHN
COc1ccc(CN2CCCC[C@@H]2CCO)cc1C(N)=S	ZINC000087832392	185232680	/nfs/dbraw/zinc/23/26/80/185232680.db2.gz	KTQWLKJWMIYERM-CYBMUJFWSA-N	0	3	308.447	2.066	10	0		DEAEHN
CN(C)C[C@@H](O)CNc1ccc(Cl)cc1Br	ZINC000088122950	185240171	/nfs/dbraw/zinc/24/01/71/185240171.db2.gz	KVQUWKGROWCRMC-VIFPVBQESA-N	0	3	307.619	2.437	10	0		DEAEHN
NNc1ccc(C(=O)[N-]c2c3nsnc3ccc2Cl)c[nH+]1	ZINC000088129547	185240256	/nfs/dbraw/zinc/24/02/56/185240256.db2.gz	HPCCOUPJUWIUFE-UHFFFAOYSA-N	0	3	320.765	2.278	10	0		DEAEHN
CC(C)[C@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)(C)C)o1	ZINC000088541820	185255983	/nfs/dbraw/zinc/25/59/83/185255983.db2.gz	ABMCSRWVSCVEDT-NSHDSACASA-N	0	3	302.440	2.491	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@H](C)[C@@H](C)CC)o1	ZINC000088542909	185256454	/nfs/dbraw/zinc/25/64/54/185256454.db2.gz	RBHICWPDJULRCL-NWDGAFQWSA-N	0	3	302.440	2.492	10	0		DEAEHN
CCc1ccc([C@H](NC)[C@@H](C)S(=O)(=O)CCCOC)cc1	ZINC000081986309	192349168	/nfs/dbraw/zinc/34/91/68/192349168.db2.gz	PFFAJXSVXWGWIW-CZUORRHYSA-N	0	3	313.463	2.349	10	0		DEAEHN
N[C@@H]1CCCC[C@H]1S(=O)(=O)c1cccc(Br)c1	ZINC000081982816	192349209	/nfs/dbraw/zinc/34/92/09/192349209.db2.gz	VZGDCABSKIKGPB-VXGBXAGGSA-N	0	3	318.236	2.493	10	0		DEAEHN
CCN[C@H](c1ccc(C)cc1)[C@@H](C)S(=O)(=O)CCCOC	ZINC000081986150	192349354	/nfs/dbraw/zinc/34/93/54/192349354.db2.gz	NKAXFHLFHCLJNL-ZBFHGGJFSA-N	0	3	313.463	2.485	10	0		DEAEHN
Cc1ccccc1S(=O)(=O)[N-]c1ccc(F)c(C(N)=[NH2+])c1	ZINC000088716997	185262983	/nfs/dbraw/zinc/26/29/83/185262983.db2.gz	JJIYVSWABLWUDN-UHFFFAOYSA-N	0	3	307.350	2.219	10	0		DEAEHN
CC[C@H](N)[C@H](C)S(=O)(=O)c1cccc(Br)c1	ZINC000081982633	192349554	/nfs/dbraw/zinc/34/95/54/192349554.db2.gz	HVJBLQIAEUEZQY-KWQFWETISA-N	0	3	306.225	2.349	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1c2ncsc2ccc1Cl	ZINC000090432862	185296102	/nfs/dbraw/zinc/29/61/02/185296102.db2.gz	FSAASTYZGUFZJV-IONNQARKSA-N	0	3	311.794	2.123	10	0		DEAEHN
CN(Cc1cc(Cl)cc(Cl)c1)C(=O)[C@]1(C)COC[C@@H]1N	ZINC000090593638	185305697	/nfs/dbraw/zinc/30/56/97/185305697.db2.gz	MRBRZIVGYPMDGB-GXTWGEPZSA-N	0	3	317.216	2.316	10	0		DEAEHN
CCC(C)(C)NC(=O)CN1CCC[C@H](c2nc(C3CC3)n[nH]2)C1	ZINC000179511290	282227360	/nfs/dbraw/zinc/22/73/60/282227360.db2.gz	FVJUKMTZZGASKQ-ZDUSSCGKSA-N	0	3	319.453	2.166	10	0		DEAEHN
CCC(C)(C)NC(=O)CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1	ZINC000179511290	282227362	/nfs/dbraw/zinc/22/73/62/282227362.db2.gz	FVJUKMTZZGASKQ-ZDUSSCGKSA-N	0	3	319.453	2.166	10	0		DEAEHN
CC(C)S(=O)(=O)N1CCCSC[C@@H]1CN1CCCCC1	ZINC000090701908	185310660	/nfs/dbraw/zinc/31/06/60/185310660.db2.gz	KOQPNJXAEWXBIB-AWEZNQCLSA-N	0	3	320.524	2.018	10	0		DEAEHN
COc1cc(Cl)c([C@@H](N)[C@@H]2CCS(=O)(=O)C2)cc1Cl	ZINC000166835079	197699825	/nfs/dbraw/zinc/69/98/25/197699825.db2.gz	WKXZTHSSSGIBFB-KRTXAFLBSA-N	0	3	324.229	2.437	10	0		DEAEHN
CCCN[C@@H]1c2cc(OC)ccc2CC[C@@H]1S(=O)(=O)CC	ZINC000092388565	185315274	/nfs/dbraw/zinc/31/52/74/185315274.db2.gz	JDSMTJLKZFMYEB-JKSUJKDBSA-N	0	3	311.447	2.485	10	0		DEAEHN
CCN1CCN(c2cccc(NC(=O)[C@@H]3CC[C@@H](C)O3)c2)CC1	ZINC000184258664	282250025	/nfs/dbraw/zinc/25/00/25/282250025.db2.gz	IOISASWDBOEKRO-PBHICJAKSA-N	0	3	317.433	2.335	10	0		DEAEHN
CCCn1cc(CN[C@@H]2C[C@@H](OCC)C23CCOCC3)cn1	ZINC000185669235	282264745	/nfs/dbraw/zinc/26/47/45/282264745.db2.gz	NJMHMZRKDXSNEY-HZPDHXFCSA-N	0	3	307.438	2.357	10	0		DEAEHN
COC(=O)CNC(=O)CCN[C@@H](C)c1ccc2ccccc2c1	ZINC000181497577	199307293	/nfs/dbraw/zinc/30/72/93/199307293.db2.gz	REJWFIWOPKNZFK-ZDUSSCGKSA-N	0	3	314.385	2.170	10	0		DEAEHN
COC(=O)CC1(CC(=O)NCCN2CCCC[C@@H]2C)CCCC1	ZINC000189093916	282307585	/nfs/dbraw/zinc/30/75/85/282307585.db2.gz	KSEGFRZDVNYFMI-HNNXBMFYSA-N	0	3	324.465	2.491	10	0		DEAEHN
CS(=O)(=O)c1ccc(NCc2ccc3c(c2)CNC3)cc1	ZINC000097829764	539435379	/nfs/dbraw/zinc/43/53/79/539435379.db2.gz	HAASSDRGMZTMSM-UHFFFAOYSA-N	0	3	302.399	2.305	10	0		DEAEHN
CO[C@]1(C)C[C@H](NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)C1(C)C	ZINC000245481913	282391178	/nfs/dbraw/zinc/39/11/78/282391178.db2.gz	CVJNBOFXBANWPT-XJIUQZFPSA-N	0	3	311.470	2.314	10	0		DEAEHN
CN(Cc1cncnc1)C1CCN(CCc2ccccn2)CC1	ZINC000122348125	539461199	/nfs/dbraw/zinc/46/11/99/539461199.db2.gz	QJZIPLBNOHQFEF-UHFFFAOYSA-N	0	3	311.433	2.011	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NC[C@@]1(C)CCCO1)c1ccccc1	ZINC000153839077	539547172	/nfs/dbraw/zinc/54/71/72/539547172.db2.gz	SOUYNRJZKXFAOH-NVXWUHKLSA-N	0	3	305.422	2.158	10	0		DEAEHN
NC(=O)c1cccc([C@@H]2COCCN(Cc3ccccc3)C2)c1	ZINC000616661735	362905888	/nfs/dbraw/zinc/90/58/88/362905888.db2.gz	YHMILYPEGYQCKQ-SFHVURJKSA-N	0	3	310.397	2.402	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1cnc(C2CC2)nc1	ZINC000176344930	539626804	/nfs/dbraw/zinc/62/68/04/539626804.db2.gz	DYNODZJIEBYSQR-CQSZACIVSA-N	0	3	303.410	2.302	10	0		DEAEHN
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)NCCC2CC2)C1	ZINC000190720619	539696488	/nfs/dbraw/zinc/69/64/88/539696488.db2.gz	PFCURXNOVOALMY-QGZVFWFLSA-N	0	3	316.449	2.345	10	0		DEAEHN
CN(C1CCC1)S(=O)(=O)c1ccc(CNC(C)(C)C)o1	ZINC000144575148	186035708	/nfs/dbraw/zinc/03/57/08/186035708.db2.gz	VYFLUJFSEHLORV-UHFFFAOYSA-N	0	3	300.424	2.341	10	0		DEAEHN
CCCN[C@H](C)c1ccc(SCCS(C)(=O)=O)cn1	ZINC000149447917	186050394	/nfs/dbraw/zinc/05/03/94/186050394.db2.gz	GEDVQZYGWKUVCD-LLVKDONJSA-N	0	3	302.465	2.279	10	0		DEAEHN
C[C@@H](c1ccc(Cl)cc1)N(C)c1nc(N)nc(N(C)C)n1	ZINC000149562519	186050761	/nfs/dbraw/zinc/05/07/61/186050761.db2.gz	IBHMUCTXUITRLT-VIFPVBQESA-N	0	3	306.801	2.371	10	0		DEAEHN
CC(=O)Nc1ccc(Cl)c(NC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000171080087	197876597	/nfs/dbraw/zinc/87/65/97/197876597.db2.gz	WHOXGKVFHBRQHX-GFCCVEGCSA-N	0	3	324.812	2.466	10	0		DEAEHN
Cc1ccc(S(C)(=O)=O)cc1N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000155887929	186120698	/nfs/dbraw/zinc/12/06/98/186120698.db2.gz	YAELBERUFOPOSE-ZIAGYGMSSA-N	0	3	308.447	2.437	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1ccccc1Br	ZINC000159569662	186127828	/nfs/dbraw/zinc/12/78/28/186127828.db2.gz	LUOJQLHQTJZOJS-SNVBAGLBSA-N	0	3	301.184	2.142	10	0		DEAEHN
C[C@H]1C[C@H](C)N(S(=O)(=O)c2ccc(CN)c(Cl)c2)C1	ZINC000164243559	186153446	/nfs/dbraw/zinc/15/34/46/186153446.db2.gz	LYHMFIUILXHAML-UWVGGRQHSA-N	0	3	302.827	2.218	10	0		DEAEHN
CCOC(=O)c1cc(CC)sc1NC(=O)C(C)=C1CNC1	ZINC000164410514	186158635	/nfs/dbraw/zinc/15/86/35/186158635.db2.gz	BCKRATWJSCOBOW-UHFFFAOYSA-N	0	3	308.403	2.345	10	0		DEAEHN
CC(=O)c1ccccc1OCCN1C[C@@H]2CCC[C@]2(CO)C1	ZINC000626011651	366004307	/nfs/dbraw/zinc/00/43/07/366004307.db2.gz	STMDKCXUDYBWIW-MAUKXSAKSA-N	0	3	303.402	2.362	10	0		DEAEHN
CCOc1ccc(OC)cc1NC(=O)N1CCN2CCC[C@H]2C1	ZINC000171894862	198003102	/nfs/dbraw/zinc/00/31/02/198003102.db2.gz	DYKVKOHREPBUJQ-ZDUSSCGKSA-N	0	3	319.405	2.406	10	0		DEAEHN
COc1ccc(CCCNC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000171903736	198005180	/nfs/dbraw/zinc/00/51/80/198005180.db2.gz	ZHPPLVUDNDPVOZ-MRXNPFEDSA-N	0	3	317.433	2.117	10	0		DEAEHN
CSCC(=O)NCC1(N[C@H](C)c2ccccc2)CCOCC1	ZINC000172062420	198033150	/nfs/dbraw/zinc/03/31/50/198033150.db2.gz	BIFNSEZMWDBHBJ-CQSZACIVSA-N	0	3	322.474	2.366	10	0		DEAEHN
O=C(NC[C@H]1CCCN1Cc1ccccc1)Nc1nncs1	ZINC000172195719	198056433	/nfs/dbraw/zinc/05/64/33/198056433.db2.gz	SSSHJCDNFAUZPV-CYBMUJFWSA-N	0	3	317.418	2.324	10	0		DEAEHN
COCCOc1ccc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000172617208	198124522	/nfs/dbraw/zinc/12/45/22/198124522.db2.gz	QNVHCVQVBHYKLC-HOCLYGCPSA-N	0	3	320.433	2.267	10	0		DEAEHN
c1csc(-c2noc(CN3CCN4CCCC[C@@H]4C3)n2)c1	ZINC000172801858	198150791	/nfs/dbraw/zinc/15/07/91/198150791.db2.gz	BPLQODKULZVHMM-GFCCVEGCSA-N	0	3	304.419	2.468	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)S(=O)(=O)Cc2ccccc2F)CCN1C	ZINC000173269498	198204553	/nfs/dbraw/zinc/20/45/53/198204553.db2.gz	KQVGHWDQZCBYKL-TZMCWYRMSA-N	0	3	314.426	2.070	10	0		DEAEHN
O=C(NCc1cccc2cccnc21)N1CC[C@H](N2CC=CC2)C1	ZINC000174422428	198333113	/nfs/dbraw/zinc/33/31/13/198333113.db2.gz	XFOCZGZGMCSTIY-KRWDZBQOSA-N	0	3	322.412	2.391	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCCc2cccc(O)c2)CCN1C	ZINC000174616264	198359672	/nfs/dbraw/zinc/35/96/72/198359672.db2.gz	GAEJHGHKAOHXPU-UKRRQHHQSA-N	0	3	305.422	2.059	10	0		DEAEHN
C[C@H](CNC(=O)N[C@@H](C)COCc1ccccc1)N(C)C1CC1	ZINC000174734979	198376922	/nfs/dbraw/zinc/37/69/22/198376922.db2.gz	NGHBGUYDQNQJMI-LSDHHAIUSA-N	0	3	319.449	2.374	10	0		DEAEHN
C[C@H](COCc1ccccc1)NC(=O)NC[C@H](C)N(C)C1CC1	ZINC000174734991	198377167	/nfs/dbraw/zinc/37/71/67/198377167.db2.gz	NGHBGUYDQNQJMI-CABCVRRESA-N	0	3	319.449	2.374	10	0		DEAEHN
CCC[C@H](N)C(=O)N(Cc1cc(OC)ccc1OC)C1CC1	ZINC000236796894	202014137	/nfs/dbraw/zinc/01/41/37/202014137.db2.gz	CPZSPKJSSQZDIR-HNNXBMFYSA-N	0	3	306.406	2.322	10	0		DEAEHN
O=C(CCc1ccccc1O)N1CCN(c2ccncc2)CC1	ZINC000061210418	354623909	/nfs/dbraw/zinc/62/39/09/354623909.db2.gz	JJAFHVCYJXFBMQ-UHFFFAOYSA-N	0	3	311.385	2.069	10	0		DEAEHN
NC[C@H](NC(=O)c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000401734604	540142309	/nfs/dbraw/zinc/14/23/09/540142309.db2.gz	XDBBRGCICHCLKW-QMMMGPOBSA-N	0	3	300.202	2.325	10	0		DEAEHN
NC[C@H](NC(=O)c1cc(F)c(Cl)cc1F)C(F)(F)F	ZINC000401748462	540142327	/nfs/dbraw/zinc/14/23/27/540142327.db2.gz	WIVXNXABQNUFPZ-QMMMGPOBSA-N	0	3	302.630	2.238	10	0		DEAEHN
C(O[C@H]1CCCN(C2CCOCC2)C1)c1nc(C2CC2)no1	ZINC000097942598	355706443	/nfs/dbraw/zinc/70/64/43/355706443.db2.gz	BYVBRCIFIBGJAN-AWEZNQCLSA-N	0	3	307.394	2.107	10	0		DEAEHN
Cc1nn(CC(C)C)c(C)c1CC(=O)NC[C@H]1CCCN(C)C1	ZINC000108335150	355734485	/nfs/dbraw/zinc/73/44/85/355734485.db2.gz	YHSPUXQSJWFZAP-MRXNPFEDSA-N	0	3	320.481	2.156	10	0		DEAEHN
COCCN(C)CCNC(=O)N(C)[C@@H](C)Cc1ccc(C)cc1	ZINC000125818160	355813479	/nfs/dbraw/zinc/81/34/79/355813479.db2.gz	DMNWLGXUEUGELX-INIZCTEOSA-N	0	3	321.465	2.146	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)CCCc2nc(C3CC3)no2)CCN1C	ZINC000127546928	355822765	/nfs/dbraw/zinc/82/27/65/355822765.db2.gz	SULTVRNJMCPGBI-OCCSQVGLSA-N	0	3	320.437	2.211	10	0		DEAEHN
COC(C)(C)CNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179182573	356017224	/nfs/dbraw/zinc/01/72/24/356017224.db2.gz	NRIQKEAFDRHESM-HUUCEWRRSA-N	0	3	305.422	2.156	10	0		DEAEHN
NC(=O)C[C@@H](NCC(=O)Nc1ccccc1F)C1CCCCC1	ZINC000182016173	356104994	/nfs/dbraw/zinc/10/49/94/356104994.db2.gz	TWEOXFKRJUQYMW-OAHLLOKOSA-N	0	3	321.396	2.178	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)CN[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000182032188	356105693	/nfs/dbraw/zinc/10/56/93/356105693.db2.gz	ICCOIINIWKHVET-KBPBESRZSA-N	0	3	315.421	2.079	10	0		DEAEHN
COCC[C@@H]1CN(c2ccc(N)c(OC(C)C)c2)CCN1C	ZINC000215976330	356272330	/nfs/dbraw/zinc/27/23/30/356272330.db2.gz	DPJKFPWHNCHLDQ-OAHLLOKOSA-N	0	3	307.438	2.213	10	0		DEAEHN
NCc1cc(OC(F)(F)F)cnc1I	ZINC000238675404	356305213	/nfs/dbraw/zinc/30/52/13/356305213.db2.gz	MCBBQXNKSSBISN-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
CC[C@@](C)(CO)[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000080886409	192199056	/nfs/dbraw/zinc/19/90/56/192199056.db2.gz	WNMPSAKVJDMSOV-ZDUSSCGKSA-N	0	3	318.211	2.414	10	0		DEAEHN
C[C@@H]1CCC[C@@](N)(C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1	ZINC000080917118	192201336	/nfs/dbraw/zinc/20/13/36/192201336.db2.gz	DPMSSIPEDPRGQN-PSLIRLAXSA-N	0	3	309.797	2.285	10	0		DEAEHN
Cn1cc([C@@H]2NC(=O)CC[C@H]2NCc2cnc3ccccn23)cn1	ZINC000328624847	356462571	/nfs/dbraw/zinc/46/25/71/356462571.db2.gz	CQZRTHUPDXTSQF-PBHICJAKSA-N	0	3	324.388	2.018	10	0		DEAEHN
C[C@H](CNc1nnc(Br)s1)CN1CCCC1	ZINC000081664932	192308572	/nfs/dbraw/zinc/30/85/72/192308572.db2.gz	HVZIUPLVIIQASR-MRVPVSSYSA-N	0	3	305.245	2.444	10	0		DEAEHN
Brc1sccc1CNCCCn1cncn1	ZINC000388900044	356706672	/nfs/dbraw/zinc/70/66/72/356706672.db2.gz	UPOBMDIJUJDVRQ-UHFFFAOYSA-N	0	3	301.213	2.282	10	0		DEAEHN
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CSC2(C)C)c1	ZINC000578642550	356849794	/nfs/dbraw/zinc/84/97/94/356849794.db2.gz	PUDXGCMIIOCILF-ZFWWWQNUSA-N	0	3	309.431	2.113	10	0		DEAEHN
CN[C@@H](c1cc(C)c(Br)s1)[C@H]1COCCO1	ZINC000087019247	192611914	/nfs/dbraw/zinc/61/19/14/192611914.db2.gz	NMPHKBJXDLQHEO-PSASIEDQSA-N	0	3	306.225	2.495	10	0		DEAEHN
CCC[C@@H](C)N(C)S(=O)(=O)c1ccc(CNC(C)C)cn1	ZINC000088964549	192673349	/nfs/dbraw/zinc/67/33/49/192673349.db2.gz	JUHNAJUAFZRVMK-CYBMUJFWSA-N	0	3	313.467	2.389	10	0		DEAEHN
Cc1occc1CN(C)S(=O)(=O)c1cc(CN)sc1C	ZINC000088990818	192684052	/nfs/dbraw/zinc/68/40/52/192684052.db2.gz	NRMSESPVSJCNCH-UHFFFAOYSA-N	0	3	314.432	2.237	10	0		DEAEHN
NC(=O)N1CCC(N[C@@H]2CCOc3c(Cl)cccc32)CC1	ZINC000177948884	283297140	/nfs/dbraw/zinc/29/71/40/283297140.db2.gz	FALPZDJVCLNGPY-CYBMUJFWSA-N	0	3	309.797	2.296	10	0		DEAEHN
CSc1ccsc1C(=O)Nc1cnn(CCN(C)C)c1	ZINC000593056547	357997415	/nfs/dbraw/zinc/99/74/15/357997415.db2.gz	JSDWLJSZAHGTCA-UHFFFAOYSA-N	0	3	310.448	2.480	10	0		DEAEHN
Cc1cc(C(=O)N2CC[C@@H](N(C)C)C2)nn1-c1ccc(F)cc1	ZINC000180253479	199136724	/nfs/dbraw/zinc/13/67/24/199136724.db2.gz	PQOQWFRFYWPCOU-OAHLLOKOSA-N	0	3	316.380	2.096	10	0		DEAEHN
Cc1nccn1-c1ccc([C@@H](C)NC[C@@H]2CN(C)CCO2)cc1	ZINC000180490550	199166226	/nfs/dbraw/zinc/16/62/26/199166226.db2.gz	RJQNBVXBHLPOOF-RDTXWAMCSA-N	0	3	314.433	2.162	10	0		DEAEHN
COc1cc([C@H](C)NC[C@@H]2CN(C)CCO2)ccc1SC	ZINC000180498414	199167171	/nfs/dbraw/zinc/16/71/71/199167171.db2.gz	CRCSMUQUTKBLJY-GXTWGEPZSA-N	0	3	310.463	2.398	10	0		DEAEHN
CNC(=O)NC(=O)[C@H](C)N[C@@H](C)c1ccc(C(C)(C)C)cc1	ZINC000056194644	283365415	/nfs/dbraw/zinc/36/54/15/283365415.db2.gz	QDUDWKXYAXRQKY-RYUDHWBXSA-N	0	3	305.422	2.479	10	0		DEAEHN
Cc1c(F)cc(CN)cc1S(=O)(=O)N(C)CC(C)(C)C	ZINC000089013761	192697889	/nfs/dbraw/zinc/69/78/89/192697889.db2.gz	WQMMCFVTMXHBMF-UHFFFAOYSA-N	0	3	302.415	2.259	10	0		DEAEHN
CCC1(CC)CCN(S(=O)(=O)[C@H](C)CNC2CC2)CC1	ZINC000089028477	192708718	/nfs/dbraw/zinc/70/87/18/192708718.db2.gz	KQKBRUKDXMHIPW-CYBMUJFWSA-N	0	3	302.484	2.359	10	0		DEAEHN
CC(=O)N1CC[C@H](NCC[C@H](C)[S@@](C)=O)c2ccccc21	ZINC000598679099	359288395	/nfs/dbraw/zinc/28/83/95/359288395.db2.gz	XCXWCSCVYSTBIO-HCQWSFJTSA-N	0	3	308.447	2.231	10	0		DEAEHN
c1ccc2c(c1)CCN2CCN1CCC(Oc2cnccn2)CC1	ZINC000428969358	237285973	/nfs/dbraw/zinc/28/59/73/237285973.db2.gz	RDPWOWWUCGIUSZ-UHFFFAOYSA-N	0	3	324.428	2.383	10	0		DEAEHN
CCSc1cc(CNC(=O)N2CC[C@@H](N(C)C)C2)ccn1	ZINC000188111214	200195558	/nfs/dbraw/zinc/19/55/58/200195558.db2.gz	JVJIYLVHSTWQOR-CYBMUJFWSA-N	0	3	308.451	2.039	10	0		DEAEHN
CC(C)C[C@H](CO)N(C)C(=O)NC[C@H](c1ccccc1)N(C)C	ZINC000188164419	200202314	/nfs/dbraw/zinc/20/23/14/200202314.db2.gz	HVKJFWIHTXNRDN-IAGOWNOFSA-N	0	3	321.465	2.338	10	0		DEAEHN
CC(C)C[C@@H](CO)N(C)C(=O)NC[C@H](c1ccccc1)N(C)C	ZINC000188164392	200202466	/nfs/dbraw/zinc/20/24/66/200202466.db2.gz	HVKJFWIHTXNRDN-DLBZAZTESA-N	0	3	321.465	2.338	10	0		DEAEHN
CCOc1c(OC)cc(CN(C)CC2(CO)CC2)cc1OC	ZINC000188956918	200327460	/nfs/dbraw/zinc/32/74/60/200327460.db2.gz	MMUDXKOOWVHSNY-UHFFFAOYSA-N	0	3	309.406	2.307	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NC[C@H]1OCCc2ccccc21	ZINC000603343290	360801542	/nfs/dbraw/zinc/80/15/42/360801542.db2.gz	ZKLOOJNLBNUHAH-DLBZAZTESA-N	0	3	302.418	2.291	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1C[C@@H](C)O[C@@H](C(F)(F)F)C1	ZINC000608597723	361236141	/nfs/dbraw/zinc/23/61/41/361236141.db2.gz	AZSYQVVJLMFSEM-IJLUTSLNSA-N	0	3	308.344	2.039	10	0		DEAEHN
COC(=O)CCN1CCC(N2c3ccccc3C[C@@H]2C)CC1	ZINC000609144613	361284481	/nfs/dbraw/zinc/28/44/81/361284481.db2.gz	IWOZBRUCLIAWOX-AWEZNQCLSA-N	0	3	302.418	2.465	10	0		DEAEHN
CC(=O)Nc1cccc([C@@H](C)NC[C@@H](O)COC(C)(C)C)c1	ZINC000193430548	201050254	/nfs/dbraw/zinc/05/02/54/201050254.db2.gz	SSBIEJXKKANGKA-MLGOLLRUSA-N	0	3	308.422	2.472	10	0		DEAEHN
COC(=O)[C@H]1CC12CCN(Cc1c(C)cc(OC)nc1C)CC2	ZINC000611621934	361647242	/nfs/dbraw/zinc/64/72/42/361647242.db2.gz	LAYOVOSASNVEQX-OAHLLOKOSA-N	0	3	318.417	2.482	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(Cc2ccon2)C1	ZINC000195265668	201368699	/nfs/dbraw/zinc/36/86/99/201368699.db2.gz	LOIKVTAJZACEAF-ZDUSSCGKSA-N	0	3	306.435	2.393	10	0		DEAEHN
COc1ccccc1CN[C@H]1CCCO[C@@H]1c1cnn(C)c1	ZINC000275507334	212381117	/nfs/dbraw/zinc/38/11/17/212381117.db2.gz	KBAZQUREDDLXBP-DOTOQJQBSA-N	0	3	301.390	2.439	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)NC2CC(N(C)C)C2)c1C(C)C	ZINC000622008822	364633860	/nfs/dbraw/zinc/63/38/60/364633860.db2.gz	ASIKASAICUMZLF-UHFFFAOYSA-N	0	3	305.422	2.472	10	0		DEAEHN
CCOc1ccc([C@@H](C)NC(=O)C[C@@H]2CSCCN2)cc1	ZINC000091135310	193001767	/nfs/dbraw/zinc/00/17/67/193001767.db2.gz	BMTXKTMHANMIGM-TZMCWYRMSA-N	0	3	308.447	2.358	10	0		DEAEHN
CN(C)c1ccncc1CNC[C@@H]1CCCO[C@H]1c1cn[nH]c1	ZINC000623769214	365167866	/nfs/dbraw/zinc/16/78/66/365167866.db2.gz	PQDJGRZSIJAUKU-SUMWQHHRSA-N	0	3	315.421	2.128	10	0		DEAEHN
CCn1c(C[C@@H]2CNCCO2)nc2cc(Br)ccc21	ZINC000091293253	193032918	/nfs/dbraw/zinc/03/29/18/193032918.db2.gz	BRQICKVDDXEWFS-LLVKDONJSA-N	0	3	324.222	2.350	10	0		DEAEHN
CSc1nc2ccc(NC(=O)C[C@H]3CNCCO3)cc2s1	ZINC000091299829	193034744	/nfs/dbraw/zinc/03/47/44/193034744.db2.gz	NJOJHPARIORMJV-JTQLQIEISA-N	0	3	323.443	2.335	10	0		DEAEHN
O=C(CCN1CC(CO)C1)Nc1cc(Cl)ccc1Cl	ZINC000091464789	193059138	/nfs/dbraw/zinc/05/91/38/193059138.db2.gz	CKFZMPSJECEKEY-UHFFFAOYSA-N	0	3	303.189	2.246	10	0		DEAEHN
C[C@H](CN1CCOCC1)N1CCC(Nc2ccccc2F)CC1	ZINC000091514649	193067440	/nfs/dbraw/zinc/06/74/40/193067440.db2.gz	FAXZTAULZLHODW-OAHLLOKOSA-N	0	3	321.440	2.423	10	0		DEAEHN
Cc1cc(CNC[C@H]2CN(C)CCO2)ccc1Br	ZINC000091667587	193088620	/nfs/dbraw/zinc/08/86/20/193088620.db2.gz	HXKXGMPLFAJNAS-ZDUSSCGKSA-N	0	3	313.239	2.178	10	0		DEAEHN
COCCNCc1c(N2C[C@H](C)[C@H](C)C2)nc2sccn12	ZINC000092086541	193154808	/nfs/dbraw/zinc/15/48/08/193154808.db2.gz	HMDGVSVCJFYIRQ-TXEJJXNPSA-N	0	3	308.451	2.224	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-]C(C)(C)C)c(F)c1	ZINC000092115777	193163254	/nfs/dbraw/zinc/16/32/54/193163254.db2.gz	WGPIYOILPOWJMH-UHFFFAOYSA-N	0	3	302.415	2.402	10	0		DEAEHN
CC(C)NCc1ccc(S(=O)(=O)N(C)C(C)C)c(F)c1	ZINC000092115522	193163386	/nfs/dbraw/zinc/16/33/86/193163386.db2.gz	ZMBQLPFQHAAMOV-UHFFFAOYSA-N	0	3	302.415	2.353	10	0		DEAEHN
CC(C)[C@H]1CCCN1S(=O)(=O)c1ccc(CN)cc1F	ZINC000092116286	193163982	/nfs/dbraw/zinc/16/39/82/193163982.db2.gz	CFRJWCHAVPFBBT-CYBMUJFWSA-N	0	3	300.399	2.094	10	0		DEAEHN
c1c(CNC[C@@H]2CCc3ccccc32)nnn1C[C@@H]1CCOC1	ZINC000631069104	368000242	/nfs/dbraw/zinc/00/02/42/368000242.db2.gz	MGIWYHWHOPHMJM-HOCLYGCPSA-N	0	3	312.417	2.134	10	0		DEAEHN
c1c(CNC[C@H]2CC3CCC2CC3)nnn1C[C@H]1CCOC1	ZINC000631166518	368056278	/nfs/dbraw/zinc/05/62/78/368056278.db2.gz	VGRKCDOTKWQUOB-GYTBAZASSA-N	0	3	304.438	2.231	10	0		DEAEHN
Cc1csc(NC(=O)CN[C@@H](C(C)C)[C@H](CO)C(C)C)n1	ZINC000451600540	243183216	/nfs/dbraw/zinc/18/32/16/243183216.db2.gz	SDMUHQRJEZMXLA-OCCSQVGLSA-N	0	3	313.467	2.269	10	0		DEAEHN
COCC[C@H](NC[C@@H](O)COC)c1cccc(C(F)(F)F)c1	ZINC000451695498	243313996	/nfs/dbraw/zinc/31/39/96/243313996.db2.gz	QGCDZGRMIQWRKK-KGLIPLIRSA-N	0	3	321.339	2.380	10	0		DEAEHN
CN(CC(C)(C)O)[C@H](CN)c1ccccc1Br	ZINC000092958157	193188491	/nfs/dbraw/zinc/18/84/91/193188491.db2.gz	LJCVOPIPDQFLEJ-GFCCVEGCSA-N	0	3	301.228	2.152	10	0		DEAEHN
CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)[C@@H](N)CCSC	ZINC000262533161	203322222	/nfs/dbraw/zinc/32/22/22/203322222.db2.gz	IZEMRRYVZWDNCW-BPNCWPANSA-N	0	3	314.426	2.098	10	0		DEAEHN
CC[C@H](C)CN(CC)S(=O)(=O)c1cc(CN)n(CC)c1	ZINC000093265852	193222727	/nfs/dbraw/zinc/22/27/27/193222727.db2.gz	LVBSCXFFZFNFDP-LBPRGKRZSA-N	0	3	301.456	2.023	10	0		DEAEHN
CCC(CC)N(CC(C)C)S(=O)(=O)c1cc(CN)n(C)c1	ZINC000093326645	193233588	/nfs/dbraw/zinc/23/35/88/193233588.db2.gz	KDKHWYCRFFHAQW-UHFFFAOYSA-N	0	3	315.483	2.319	10	0		DEAEHN
COc1ccccc1C1CC(NCC(C)(C)S(C)(=O)=O)C1	ZINC000093520444	193262937	/nfs/dbraw/zinc/26/29/37/193262937.db2.gz	LYUCUSAQUWRNFG-UHFFFAOYSA-N	0	3	311.447	2.354	10	0		DEAEHN
CN[C@H](C[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1F	ZINC000093700274	193293907	/nfs/dbraw/zinc/29/39/07/193293907.db2.gz	ULEBUHQJMRRBLH-SWLSCSKDSA-N	0	3	314.426	2.148	10	0		DEAEHN
CCC[NH2+][C@@]1(C(=O)[O-])CCC[C@H](N(CC)CCOCC)C1	ZINC000093755074	193300783	/nfs/dbraw/zinc/30/07/83/193300783.db2.gz	HVZBWJRDHFOUOS-HOCLYGCPSA-N	0	3	300.443	2.110	10	0		DEAEHN
Cc1ccc2[nH]c(S[C@H]3CCC[C@@](N)(C(N)=O)C3)nc2c1	ZINC000093779495	193306334	/nfs/dbraw/zinc/30/63/34/193306334.db2.gz	JYPRALNDSKZNAM-BONVTDFDSA-N	0	3	304.419	2.089	10	0		DEAEHN
Cc1ccc2nc(S[C@H]3CCC[C@@](N)(C(N)=O)C3)[nH]c2c1	ZINC000093779495	193306338	/nfs/dbraw/zinc/30/63/38/193306338.db2.gz	JYPRALNDSKZNAM-BONVTDFDSA-N	0	3	304.419	2.089	10	0		DEAEHN
CN[C@H](Cc1cc(F)cc(Br)c1)C(OC)OC	ZINC000094000796	193337944	/nfs/dbraw/zinc/33/79/44/193337944.db2.gz	OKNGBJKYAGOXJT-LLVKDONJSA-N	0	3	306.175	2.338	10	0		DEAEHN
CCCN[C@H](c1cc(Cl)cnc1N)[C@H]1CN(CC)CCO1	ZINC000093915260	193328005	/nfs/dbraw/zinc/32/80/05/193328005.db2.gz	XJACFGXMCJZDGD-ZIAGYGMSSA-N	0	3	312.845	2.079	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)s1)N(C)CCS(C)(=O)=O	ZINC000094297314	193357045	/nfs/dbraw/zinc/35/70/45/193357045.db2.gz	MDQQKFJOMJUFGX-SKDRFNHKSA-N	0	3	324.899	2.156	10	0		DEAEHN
CN(CCNc1nc(C(F)(F)F)ccc1C(N)=S)C1CC1	ZINC000094336173	193361012	/nfs/dbraw/zinc/36/10/12/193361012.db2.gz	UUJODGNSZGTPGG-UHFFFAOYSA-N	0	3	318.368	2.241	10	0		DEAEHN
CC(C)NCc1cc(F)c(OCCC(=O)N(C)C)c(F)c1	ZINC000094347419	193363690	/nfs/dbraw/zinc/36/36/90/193363690.db2.gz	MPXLFBVVLGVCLF-UHFFFAOYSA-N	0	3	300.349	2.320	10	0		DEAEHN
CC[C@](C)(N)C(=O)NCc1cc(F)ccc1Br	ZINC000094235828	193353930	/nfs/dbraw/zinc/35/39/30/193353930.db2.gz	YXAIUVMTFVTVNK-LBPRGKRZSA-N	0	3	303.175	2.332	10	0		DEAEHN
NCc1ccc(OCCS(=O)(=O)c2cccc(F)c2)cc1	ZINC000094627228	193385582	/nfs/dbraw/zinc/38/55/82/193385582.db2.gz	XROJNYOXMAZJGB-UHFFFAOYSA-N	0	3	309.362	2.137	10	0		DEAEHN
CC(C)CNCc1cn([C@H]2CCO[C@]3(CCSC3)C2)nn1	ZINC000094419119	193368401	/nfs/dbraw/zinc/36/84/01/193368401.db2.gz	AKJCFJCJPAVLMJ-LSDHHAIUSA-N	0	3	310.467	2.251	10	0		DEAEHN
CCNCc1nc(CN2C[C@@H]3CCCCN3C[C@@H]2C)cs1	ZINC000094443695	193369750	/nfs/dbraw/zinc/36/97/50/193369750.db2.gz	PQGRKPDQERIYDG-ZFWWWQNUSA-N	0	3	308.495	2.311	10	0		DEAEHN
CCN1CCC[C@@H]1CNc1nc(Br)cn2ccnc12	ZINC000094486813	193373014	/nfs/dbraw/zinc/37/30/14/193373014.db2.gz	OGLCVXZPDGPPTP-SNVBAGLBSA-N	0	3	324.226	2.388	10	0		DEAEHN
CCCN[C@@H]1CCCc2sc([C@@H]3CN4CCN3CC4)nc21	ZINC000094511096	193375758	/nfs/dbraw/zinc/37/57/58/193375758.db2.gz	CJNANCRKOWUXQC-OLZOCXBDSA-N	0	3	306.479	2.192	10	0		DEAEHN
CCCN[C@@H](C)c1cc(F)ccc1O[C@@H]1CCS(=O)(=O)C1	ZINC000094620463	193385160	/nfs/dbraw/zinc/38/51/60/193385160.db2.gz	MTPOFSXQGAWRTM-WCQYABFASA-N	0	3	315.410	2.452	10	0		DEAEHN
CCNCc1ccc(F)c(S(=O)(=O)N2CCC(C)(C)C2)c1	ZINC000094814987	193399927	/nfs/dbraw/zinc/39/99/27/193399927.db2.gz	VCTZKPMFOSRBAI-UHFFFAOYSA-N	0	3	314.426	2.356	10	0		DEAEHN
COc1cccc([C@H]2C[C@H](O)CN2Cc2nc(C)ccc2O)c1	ZINC000282689018	217178037	/nfs/dbraw/zinc/17/80/37/217178037.db2.gz	IVMZNUVHMIMZEA-WMLDXEAASA-N	0	3	314.385	2.412	10	0		DEAEHN
CO[C@@]1(C[NH2+]Cc2ccc([O-])c(Br)c2)CCOC1	ZINC000160104652	197385977	/nfs/dbraw/zinc/38/59/77/197385977.db2.gz	JLBXCCIODOKNOV-CYBMUJFWSA-N	0	3	316.195	2.050	10	0		DEAEHN
CN[C@H](c1c(Br)cnn1CCOC)C1CCC1	ZINC000159979549	197378052	/nfs/dbraw/zinc/37/80/52/197378052.db2.gz	BNQPAVGJTDHCTB-NSHDSACASA-N	0	3	302.216	2.353	10	0		DEAEHN
Cc1ccc([C@@H](CN)N2CCN(c3nccs3)CC2)cc1	ZINC000021046841	182263515	/nfs/dbraw/zinc/26/35/15/182263515.db2.gz	UDYPSSPFWUEXME-OAHLLOKOSA-N	0	3	302.447	2.274	10	0		DEAEHN
Cc1cc(NC(=O)NC[C@@H]2C[C@@H]2C)n(C2CCN(C)CC2)n1	ZINC000531189471	284524226	/nfs/dbraw/zinc/52/42/26/284524226.db2.gz	BIJKJYCUYYOEDY-AAEUAGOBSA-N	0	3	305.426	2.236	10	0		DEAEHN
COc1cc([C@@H](CN)N2CCC(C)CC2)cc(OC)c1OC	ZINC000039789182	183021493	/nfs/dbraw/zinc/02/14/93/183021493.db2.gz	CWMXAWQKDZVRLX-CQSZACIVSA-N	0	3	308.422	2.444	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2ccccc2SC(F)F)C1	ZINC000040630047	183110679	/nfs/dbraw/zinc/11/06/79/183110679.db2.gz	LJDFRKVEAYARSX-WPRPVWTQSA-N	0	3	302.346	2.317	10	0		DEAEHN
COC(=O)[C@H](C)CNCc1cc(Br)ccc1F	ZINC000041069411	183162628	/nfs/dbraw/zinc/16/26/28/183162628.db2.gz	QFDZDXNTBKLTQR-MRVPVSSYSA-N	0	3	304.159	2.487	10	0		DEAEHN
CCOC(=O)COC[C@H](N)c1ccc(Br)cc1	ZINC000041071956	183163464	/nfs/dbraw/zinc/16/34/64/183163464.db2.gz	KTRRGLCZNCBKFQ-NSHDSACASA-N	0	3	302.168	2.029	10	0		DEAEHN
O=C(NCCCCN1CCc2ccccc2C1)c1cnccn1	ZINC000041565775	183203780	/nfs/dbraw/zinc/20/37/80/183203780.db2.gz	UHAPBBNVBWFRIS-UHFFFAOYSA-N	0	3	310.401	2.045	10	0		DEAEHN
OC[C@@H](NC[C@@H]1CCCO1)c1cc(Br)cs1	ZINC000041678620	183216048	/nfs/dbraw/zinc/21/60/48/183216048.db2.gz	PBOSYOJBHUIVMQ-VHSXEESVSA-N	0	3	306.225	2.313	10	0		DEAEHN
COCCN(C)[C@H](CN)c1ccc(OC)c(Br)c1	ZINC000042458586	183272855	/nfs/dbraw/zinc/27/28/55/183272855.db2.gz	PYYFHZMBGBTBCC-GFCCVEGCSA-N	0	3	317.227	2.036	10	0		DEAEHN
COCCN([C@@H](CN)c1c(F)cccc1Cl)[C@@H](C)COC	ZINC000042603299	183290255	/nfs/dbraw/zinc/29/02/55/183290255.db2.gz	JJILAJRHQRQQFB-FZMZJTMJSA-N	0	3	318.820	2.462	10	0		DEAEHN
COc1ccc([C@@H](CN)N(C)Cc2cscn2)c(OC)c1	ZINC000042863880	183314951	/nfs/dbraw/zinc/31/49/51/183314951.db2.gz	IBIUFEKUQLVUCX-CQSZACIVSA-N	0	3	307.419	2.292	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccccc1Cl)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043051533	183333125	/nfs/dbraw/zinc/33/31/25/183333125.db2.gz	LGQYOMVDLCXDMW-KCPJHIHWSA-N	0	3	309.841	2.281	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)cc1)N(C)CC(=O)NC1CC1	ZINC000042945174	183320020	/nfs/dbraw/zinc/32/00/20/183320020.db2.gz	WPAXAGKPHJSHCY-GOEBONIOSA-N	0	3	309.841	2.329	10	0		DEAEHN
CCCN(CC(F)(F)F)S(=O)(=O)Cc1ccccc1CN	ZINC000042768589	183307194	/nfs/dbraw/zinc/30/71/94/183307194.db2.gz	RVDPTOVQCHINIM-UHFFFAOYSA-N	0	3	324.368	2.249	10	0		DEAEHN
Cc1cc(C)c(C(N)=S)c(N(CCN(C)C)CC(C)C)n1	ZINC000042781015	183308288	/nfs/dbraw/zinc/30/82/88/183308288.db2.gz	PZOYMENBELCBLP-UHFFFAOYSA-N	0	3	308.495	2.357	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(C)s1)N(C)CC(=O)N1CCCC1	ZINC000043242119	183346879	/nfs/dbraw/zinc/34/68/79/183346879.db2.gz	HLWJVIBSENESCM-CJNGLKHVSA-N	0	3	309.479	2.389	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccc(Cl)s1)N1CCC(CC(N)=O)CC1	ZINC000043253805	183348286	/nfs/dbraw/zinc/34/82/86/183348286.db2.gz	JGILHOOHGFCPBL-OTYXRUKQSA-N	0	3	315.870	2.377	10	0		DEAEHN
C[C@H](N)[C@@H](c1cc(Br)cs1)N1CCN(C)CC1	ZINC000043284393	183350583	/nfs/dbraw/zinc/35/05/83/183350583.db2.gz	UVZPUVAQXAQHLZ-CABZTGNLSA-N	0	3	318.284	2.146	10	0		DEAEHN
CCCN[C@@H](c1cc(F)ccc1F)[C@@H]1CCS(=O)(=O)C1	ZINC000043301285	183352181	/nfs/dbraw/zinc/35/21/81/183352181.db2.gz	GWHAAWVRHCIKAB-QMTHXVAHSA-N	0	3	303.374	2.440	10	0		DEAEHN
N[C@@H](c1ccc(OC(F)(F)F)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000043300031	183352186	/nfs/dbraw/zinc/35/21/86/183352186.db2.gz	SVRHDCGOYUVTHM-ONGXEEELSA-N	0	3	309.309	2.020	10	0		DEAEHN
CCN[C@H](c1ccc(OC(F)F)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000043300892	183352659	/nfs/dbraw/zinc/35/26/59/183352659.db2.gz	GOEBGGAWXCKOKE-WCQYABFASA-N	0	3	319.373	2.373	10	0		DEAEHN
CCCN[C@@H](c1ccc(F)c(F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000043301254	183352755	/nfs/dbraw/zinc/35/27/55/183352755.db2.gz	YJUSQFCHDBYYAJ-RISCZKNCSA-N	0	3	303.374	2.440	10	0		DEAEHN
CNCc1cc(Br)ccc1O[C@H](C)C(=O)OC	ZINC000043624137	183376423	/nfs/dbraw/zinc/37/64/23/183376423.db2.gz	YELONTRFLLASSC-MRVPVSSYSA-N	0	3	302.168	2.109	10	0		DEAEHN
CCN1CCC[C@H]1CNc1nc2c(cc1C(N)=S)CCC2	ZINC000043408377	183360357	/nfs/dbraw/zinc/36/03/57/183360357.db2.gz	RSXZMNIGBUYZHZ-LBPRGKRZSA-N	0	3	304.463	2.101	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@H](C)N(CCC(N)=S)CC(C)C	ZINC000043418470	183360592	/nfs/dbraw/zinc/36/05/92/183360592.db2.gz	MXJNLCRCPGXSKP-STQMWFEESA-N	0	3	301.500	2.314	10	0		DEAEHN
Cc1nc(CN2CCCN(Cc3cccc(C)c3)CC2)no1	ZINC000105866706	194149884	/nfs/dbraw/zinc/14/98/84/194149884.db2.gz	OGCBLKPYPZYLRM-UHFFFAOYSA-N	0	3	300.406	2.394	10	0		DEAEHN
CC[C@@H]1CN(CCC(=O)Nc2ccccc2)CCN1CCOC	ZINC000105903098	194166958	/nfs/dbraw/zinc/16/69/58/194166958.db2.gz	VXHAOWKARUZQOP-QGZVFWFLSA-N	0	3	319.449	2.058	10	0		DEAEHN
CCOCCN1CCN(CCC(=O)OC(C)(C)C)C[C@@H]1CC	ZINC000105914774	194168753	/nfs/dbraw/zinc/16/87/53/194168753.db2.gz	NASUKSGZWVKLRY-HNNXBMFYSA-N	0	3	314.470	2.151	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@@H]1CCCN1C[C@H](O)COC(C)(C)C	ZINC000105922215	194171947	/nfs/dbraw/zinc/17/19/47/194171947.db2.gz	NDGPHZIXXMIEOG-GJZGRUSLSA-N	0	3	309.454	2.350	10	0		DEAEHN
CC[C@@H]1CN(Cc2cccc(C(=O)OC)c2)CCN1CCOC	ZINC000106115662	194186732	/nfs/dbraw/zinc/18/67/32/194186732.db2.gz	XKUHTHZDVNGMSF-QGZVFWFLSA-N	0	3	320.433	2.016	10	0		DEAEHN
COCCNCc1ccc(OCCCO)c(C(F)(F)F)c1	ZINC000109410648	194261629	/nfs/dbraw/zinc/26/16/29/194261629.db2.gz	QILLEIPSASKGCH-UHFFFAOYSA-N	0	3	307.312	2.203	10	0		DEAEHN
Cn1cnnc1CCNCc1ccc(Br)cc1F	ZINC000109421729	194262325	/nfs/dbraw/zinc/26/23/25/194262325.db2.gz	RYFTXHNGIXMXNZ-UHFFFAOYSA-N	0	3	313.174	2.049	10	0		DEAEHN
CCC[C@@H](C(N)=S)N1CCN(c2ccc(Cl)cn2)CC1	ZINC000109471627	194266541	/nfs/dbraw/zinc/26/65/41/194266541.db2.gz	DVZBJVUUYYCJJT-LBPRGKRZSA-N	0	3	312.870	2.312	10	0		DEAEHN
CCNCc1c(N2CCN(C)C(C)(C)C2)nc2sccn12	ZINC000110731129	194354491	/nfs/dbraw/zinc/35/44/91/194354491.db2.gz	TYDNEDXVCGCDHC-UHFFFAOYSA-N	0	3	307.467	2.036	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccccc1Cl)N1CCNC(=O)C1(C)C	ZINC000110653918	194347461	/nfs/dbraw/zinc/34/74/61/194347461.db2.gz	APOAYFQFOOCHMP-KBPBESRZSA-N	0	3	309.841	2.329	10	0		DEAEHN
CN(Cc1cc(F)cc(C(F)(F)F)c1)C[C@H]1CNCCO1	ZINC000159325701	197345568	/nfs/dbraw/zinc/34/55/68/197345568.db2.gz	ZIQKDYBRADNTOH-CYBMUJFWSA-N	0	3	306.303	2.265	10	0		DEAEHN
CCN(CCOC)[C@H](CN)c1ccc(OC)c(OC)c1Cl	ZINC000110829162	194361758	/nfs/dbraw/zinc/36/17/58/194361758.db2.gz	MNTAFUAGXRYYRA-GFCCVEGCSA-N	0	3	316.829	2.325	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N(C)[C@@H]2CCCNC2)c(Cl)c1	ZINC000110928509	194370811	/nfs/dbraw/zinc/37/08/11/194370811.db2.gz	VVLXKBOQFBSQBC-LLVKDONJSA-N	0	3	302.827	2.021	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)NCc1cccnc1	ZINC000057205841	184029436	/nfs/dbraw/zinc/02/94/36/184029436.db2.gz	PJNCMDUHZDOZEA-QGZVFWFLSA-N	0	3	312.417	2.054	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000057870058	184059895	/nfs/dbraw/zinc/05/98/95/184059895.db2.gz	DKAIBFDLCLFOPX-RYUDHWBXSA-N	0	3	307.360	2.455	10	0		DEAEHN
COC(=O)[C@@](C)(C[C@@H](C)N(C)CCOC(C)C)NC(C)C	ZINC000157499922	197191994	/nfs/dbraw/zinc/19/19/94/197191994.db2.gz	UVXJJCLCFKCVPW-GDBMZVCRSA-N	0	3	302.459	2.052	10	0		DEAEHN
C[C@H](C(=O)Nc1ccccc1C(N)=S)N(C)CC1CCC1	ZINC000061457958	184171264	/nfs/dbraw/zinc/17/12/64/184171264.db2.gz	LRGSRWWJXONJQE-LLVKDONJSA-N	0	3	305.447	2.380	10	0		DEAEHN
CC(C)[NH2+]CCCS(=O)(=O)[N-]c1cc(F)c(F)cc1F	ZINC000061094753	184162116	/nfs/dbraw/zinc/16/21/16/184162116.db2.gz	JYMZSZSSZYEJSJ-UHFFFAOYSA-N	0	3	310.341	2.234	10	0		DEAEHN
CNC(C)(C)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2	ZINC000061318674	184168171	/nfs/dbraw/zinc/16/81/71/184168171.db2.gz	LXWDHLZTFQZMLQ-UHFFFAOYSA-N	0	3	310.419	2.350	10	0		DEAEHN
COCCNC[C@@](C)(O)c1ccc(F)c(Br)c1	ZINC000061689980	184182873	/nfs/dbraw/zinc/18/28/73/184182873.db2.gz	WQTAXSJPKDSAFJ-GFCCVEGCSA-N	0	3	306.175	2.032	10	0		DEAEHN
COCC[C@H](N)C(=O)Nc1cc(Br)ccc1Cl	ZINC000061692422	184183505	/nfs/dbraw/zinc/18/35/05/184183505.db2.gz	DKHYUJQRNMBCTQ-VIFPVBQESA-N	0	3	321.602	2.405	10	0		DEAEHN
O[C@H]1CCN(c2cc(Br)ccc2CNC2CC2)C1	ZINC000061711264	184184885	/nfs/dbraw/zinc/18/48/85/184184885.db2.gz	ANBCHVHGHNMQRF-ZDUSSCGKSA-N	0	3	311.223	2.272	10	0		DEAEHN
CN(Cc1nccn1C)[C@H](CN)c1ccccc1Br	ZINC000062247511	184225312	/nfs/dbraw/zinc/22/53/12/184225312.db2.gz	HFSNSTSLRPAFKH-CYBMUJFWSA-N	0	3	323.238	2.314	10	0		DEAEHN
NC[C@@H](c1cccc(Br)c1)N1CCn2ccnc2C1	ZINC000062246233	184225427	/nfs/dbraw/zinc/22/54/27/184225427.db2.gz	RAKSRDCXTXYUGS-ZDUSSCGKSA-N	0	3	321.222	2.161	10	0		DEAEHN
Cc1cccc(CN2CCC[C@H]2C(=O)N2CCOC[C@@H]2C)c1	ZINC000062509677	184240908	/nfs/dbraw/zinc/24/09/08/184240908.db2.gz	WPKZSTAJIYSJSQ-RDJZCZTQSA-N	0	3	302.418	2.207	10	0		DEAEHN
COCCNCc1cc(Cl)ccc1OCCCC(=O)OC	ZINC000062731080	184251109	/nfs/dbraw/zinc/25/11/09/184251109.db2.gz	QOVVXOKVSWTTRP-UHFFFAOYSA-N	0	3	315.797	2.408	10	0		DEAEHN
CC(C)(C)NCc1c(N2CCC(O)CC2)nc2sccn12	ZINC000062734667	184251374	/nfs/dbraw/zinc/25/13/74/184251374.db2.gz	ACZPHLKVMWLFIA-UHFFFAOYSA-N	0	3	308.451	2.245	10	0		DEAEHN
COCCNCc1cccc(OCCOCC(F)(F)F)c1	ZINC000062731739	184251562	/nfs/dbraw/zinc/25/15/62/184251562.db2.gz	VQDLFBDXBNVUEF-UHFFFAOYSA-N	0	3	307.312	2.380	10	0		DEAEHN
Cn1cc(Br)cc1C(=O)NC[C@H](N)c1ccccc1	ZINC000062837841	184255723	/nfs/dbraw/zinc/25/57/23/184255723.db2.gz	HRIYTFSTZAMVKP-LBPRGKRZSA-N	0	3	322.206	2.217	10	0		DEAEHN
CCNCc1cccc(OCC)c1OCCCS(C)(=O)=O	ZINC000063014343	184266615	/nfs/dbraw/zinc/26/66/15/184266615.db2.gz	MQOCDUVEYVGVGV-UHFFFAOYSA-N	0	3	315.435	2.008	10	0		DEAEHN
Cc1nnc(Sc2ccc(S(C)(=O)=O)cc2)c(CN)c1C	ZINC000063131484	184272170	/nfs/dbraw/zinc/27/21/70/184272170.db2.gz	BECKPXGKSASVCR-UHFFFAOYSA-N	0	3	323.443	2.107	10	0		DEAEHN
COCCC[C@@H](N)C(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1	ZINC000159308631	197344185	/nfs/dbraw/zinc/34/41/85/197344185.db2.gz	VFUVHTPYIMAFLX-IINYFYTJSA-N	0	3	300.349	2.238	10	0		DEAEHN
O=C(NC1CCN(C2CC2)CC1)c1cccc(-n2ccnc2)c1	ZINC000117748503	194844707	/nfs/dbraw/zinc/84/47/07/194844707.db2.gz	YVZPJCIBLCVJJG-UHFFFAOYSA-N	0	3	310.401	2.229	10	0		DEAEHN
CCC[C@@H](C(=O)NCCc1nc2c(cccc2F)n1C)N(C)C	ZINC000162070636	197541447	/nfs/dbraw/zinc/54/14/47/197541447.db2.gz	VNNFMCZNZPYBGZ-AWEZNQCLSA-N	0	3	320.412	2.101	10	0		DEAEHN
CCN[C@@H](Cc1ccncc1)c1c(Br)cnn1C	ZINC000159223451	197336961	/nfs/dbraw/zinc/33/69/61/197336961.db2.gz	XXAFQLMNMFPOFU-LBPRGKRZSA-N	0	3	309.211	2.471	10	0		DEAEHN
C[C@@H]1CN[C@](C)(c2ccccc2)CN1C1CCS(=O)CC1	ZINC000159207351	197336327	/nfs/dbraw/zinc/33/63/27/197336327.db2.gz	HEJJNXQGGIEEJR-PYXVISIKSA-N	0	3	306.475	2.107	10	0		DEAEHN
CCNCc1cccc(Cl)c1OCCCS(C)(=O)=O	ZINC000159129633	197329491	/nfs/dbraw/zinc/32/94/91/197329491.db2.gz	BFBLNVZJVZRYTO-UHFFFAOYSA-N	0	3	305.827	2.263	10	0		DEAEHN
CCCCNS(=O)(=O)c1cc(C)c(F)c(CNCC)c1	ZINC000159089831	197326631	/nfs/dbraw/zinc/32/66/31/197326631.db2.gz	ULEAXRAYJQURHH-UHFFFAOYSA-N	0	3	302.415	2.322	10	0		DEAEHN
CCN(CCNC(=O)N1CCO[C@H](c2cccs2)C1)C1CC1	ZINC000159060033	197323436	/nfs/dbraw/zinc/32/34/36/197323436.db2.gz	LOLPJSFJJKNHRJ-AWEZNQCLSA-N	0	3	323.462	2.315	10	0		DEAEHN
CCC[C@H]1CCN(CCS(=O)(=O)c2ccc(CN)cc2)C1	ZINC000158753071	197299456	/nfs/dbraw/zinc/29/94/56/197299456.db2.gz	SHIGKSJNLLKSCR-HNNXBMFYSA-N	0	3	310.463	2.041	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)ccc1C	ZINC000158749640	197298970	/nfs/dbraw/zinc/29/89/70/197298970.db2.gz	OQVPGZATQRNVNC-KBPBESRZSA-N	0	3	308.447	2.135	10	0		DEAEHN
CNCc1ccc(C)c(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)c1	ZINC000158746725	197298172	/nfs/dbraw/zinc/29/81/72/197298172.db2.gz	RKBBTXXGYCQIAF-GASCZTMLSA-N	0	3	308.447	2.135	10	0		DEAEHN
CCN[C@@H](CS(=O)(=O)c1ccc(C)c(C)c1)[C@H]1CCOC1	ZINC000158731409	197297420	/nfs/dbraw/zinc/29/74/20/197297420.db2.gz	OJNUVCHBUKRZMB-HOCLYGCPSA-N	0	3	311.447	2.092	10	0		DEAEHN
CN(c1ccccc1)C1CCN([C@@H]2CCCCNC2=O)CC1	ZINC000120255798	195129117	/nfs/dbraw/zinc/12/91/17/195129117.db2.gz	RNDWHXNJQPBDQJ-QGZVFWFLSA-N	0	3	301.434	2.256	10	0		DEAEHN
CC[C@@H]1CN(c2ncc(CNCCOC)s2)CCS1	ZINC000158313648	197261967	/nfs/dbraw/zinc/26/19/67/197261967.db2.gz	QQHNFRFJKAWVNG-LLVKDONJSA-N	0	3	301.481	2.211	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)Nc2cccc(C(F)F)c2)CCO1	ZINC000158150884	197248773	/nfs/dbraw/zinc/24/87/73/197248773.db2.gz	JSUPSAZFNTXTTF-ZDUSSCGKSA-N	0	3	313.348	2.419	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)C2(C(N)=S)CCCCCC2)CCN1C	ZINC000157998669	197234180	/nfs/dbraw/zinc/23/41/80/197234180.db2.gz	RANYRRVJPMRLML-CHWSQXEVSA-N	0	3	311.495	2.212	10	0		DEAEHN
CC[C@H](N)CS(=O)(=O)Cc1cccc(F)c1Br	ZINC000157998266	197234089	/nfs/dbraw/zinc/23/40/89/197234089.db2.gz	YWHVUJLUOGEITF-VIFPVBQESA-N	0	3	324.215	2.240	10	0		DEAEHN
CSC1(C(N)=S)CCN(Cc2ccc(CO)cc2)CC1	ZINC000157942123	197229516	/nfs/dbraw/zinc/22/95/16/197229516.db2.gz	YPQUJDDMDVRKGV-UHFFFAOYSA-N	0	3	310.488	2.163	10	0		DEAEHN
CCCCCCN1CCN(c2nc(C)nc3c2cnn3C)CC1	ZINC000157977803	197232255	/nfs/dbraw/zinc/23/22/55/197232255.db2.gz	GOTODWYJYBDVLO-UHFFFAOYSA-N	0	3	316.453	2.374	10	0		DEAEHN
Cc1ccc(CNC2CC2)cc1S(=O)(=O)N(C)CC(F)F	ZINC000157160261	197166963	/nfs/dbraw/zinc/16/69/63/197166963.db2.gz	PSUQIAYLJHPGPX-UHFFFAOYSA-N	0	3	318.389	2.133	10	0		DEAEHN
CN(C)[C@@H](CNC(=O)c1nnc(Cl)s1)c1ccccc1	ZINC000157244961	197172715	/nfs/dbraw/zinc/17/27/15/197172715.db2.gz	RCNQRZLWZJMSTL-JTQLQIEISA-N	0	3	310.810	2.224	10	0		DEAEHN
CCOCCN(C)[C@@H](CN)c1cc2c(c(Cl)c1)OCO2	ZINC000157098779	197161913	/nfs/dbraw/zinc/16/19/13/197161913.db2.gz	HAFRZKDAIIPCRU-LBPRGKRZSA-N	0	3	300.786	2.037	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@](C)(O)c2ccccc2)C1	ZINC000157121669	197164300	/nfs/dbraw/zinc/16/43/00/197164300.db2.gz	MSYZMPWDSWGCBB-CRAIPNDOSA-N	0	3	320.433	2.493	10	0		DEAEHN
COc1cccc(OC)c1CC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000157123915	197163920	/nfs/dbraw/zinc/16/39/20/197163920.db2.gz	TWNHUPDFDCNAQP-CQSZACIVSA-N	0	3	322.449	2.339	10	0		DEAEHN
CC1(C)CCCC[C@H]1NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000156910129	197149154	/nfs/dbraw/zinc/14/91/54/197149154.db2.gz	MXYOYGBEEOMEIE-LSDHHAIUSA-N	0	3	311.470	2.101	10	0		DEAEHN
Cc1ccc([C@@H](C)NC(=O)N2CCO[C@@H](CN(C)C)C2)cc1F	ZINC000156805785	197142413	/nfs/dbraw/zinc/14/24/13/197142413.db2.gz	QHOTWRVZYUSHBI-HIFRSBDPSA-N	0	3	323.412	2.167	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)Nn2cnc3ccccc32)C1	ZINC000156364827	197107936	/nfs/dbraw/zinc/10/79/36/197107936.db2.gz	MJKBJNSTVRFQIR-OCCSQVGLSA-N	0	3	301.394	2.018	10	0		DEAEHN
O=S(=O)([N-]CC[NH2+][C@@H]1CC[C@H]1C1CCC1)c1cccs1	ZINC000558696781	291903310	/nfs/dbraw/zinc/90/33/10/291903310.db2.gz	CKJVKPYEFOYHHC-QWHCGFSZSA-N	0	3	314.476	2.195	10	0		DEAEHN
CCN(CC)c1nc(N)nc(N[C@@H](C)c2nc(C)cs2)n1	ZINC000156165091	197092203	/nfs/dbraw/zinc/09/22/03/197092203.db2.gz	OJQZIDLNPSOJLD-VIFPVBQESA-N	0	3	307.427	2.238	10	0		DEAEHN
COc1ccc([S@](=O)Cc2ccc(OC)c(CN)c2)cc1	ZINC000155948182	197076814	/nfs/dbraw/zinc/07/68/14/197076814.db2.gz	HSCCMQAJJOEQOO-NRFANRHFSA-N	0	3	305.399	2.470	10	0		DEAEHN
COC[C@@H](NC(=O)N(C)[C@@H]1CCN(C(C)C)C1)c1ccccc1	ZINC000458247537	285228057	/nfs/dbraw/zinc/22/80/57/285228057.db2.gz	XPSMDMGDAPSMOC-IAGOWNOFSA-N	0	3	319.449	2.498	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C[C@H](C)NC(=O)C1CCCC1	ZINC000245437461	285271248	/nfs/dbraw/zinc/27/12/48/285271248.db2.gz	WLBBQHRYNLTGJY-HOCLYGCPSA-N	0	3	323.481	2.014	10	0		DEAEHN
O=C1CCCN1C[C@@H]1OC[C@H]2CCN(Cc3ccsc3)C[C@@H]12	ZINC000247960024	257113078	/nfs/dbraw/zinc/11/30/78/257113078.db2.gz	PVGMJLHGOREWGD-OAGGEKHMSA-N	0	3	320.458	2.207	10	0		DEAEHN
Cc1cccc(CN2C[C@@H]3OC[C@H](CNc4ccccn4)[C@@H]3C2)n1	ZINC000247873095	257115704	/nfs/dbraw/zinc/11/57/04/257115704.db2.gz	MJNPRSZRHIDFND-SZMVWBNQSA-N	0	3	324.428	2.344	10	0		DEAEHN
O=C(c1cscn1)N1CC[C@H]2CN(Cc3ccco3)C[C@H]2C1	ZINC000247850342	257115785	/nfs/dbraw/zinc/11/57/85/257115785.db2.gz	INNXIFNAEPBVCL-STQMWFEESA-N	0	3	317.414	2.330	10	0		DEAEHN
CCOCCN1CCN(Cc2ccc(OC)c(O)c2)C[C@@H]1CC	ZINC000120995799	195276807	/nfs/dbraw/zinc/27/68/07/195276807.db2.gz	OFJLMGXIEXNCIC-INIZCTEOSA-N	0	3	322.449	2.334	10	0		DEAEHN
CC[C@H]1N[C@@H](c2ccsc2)N(CC2CCN(C)CC2)C1=O	ZINC000122021143	195390840	/nfs/dbraw/zinc/39/08/40/195390840.db2.gz	JECWMPIWDILXGM-HUUCEWRRSA-N	0	3	307.463	2.299	10	0		DEAEHN
Cc1nc(N)cc(N2CCN(c3ccc(Cl)cc3)CC2)n1	ZINC000126491160	195844800	/nfs/dbraw/zinc/84/48/00/195844800.db2.gz	GHSOQVFQSHQLTR-UHFFFAOYSA-N	0	3	303.797	2.347	10	0		DEAEHN
CCOC(=O)C1C(=O)Nc2c1c(Br)ccc2F	ZINC000725255758	542770541	/nfs/dbraw/zinc/77/05/41/542770541.db2.gz	LTVGJKXIDSQTSP-QMMMGPOBSA-N	0	3	302.099	2.187	10	0		DEAEHN
C[C@@H](NCc1ccn(C)n1)c1cccc(OCCN(C)C)c1	ZINC000358246759	133130952	/nfs/dbraw/zinc/13/09/52/133130952.db2.gz	KTHXQZFTTPMZST-CQSZACIVSA-N	0	3	302.422	2.211	10	0		DEAEHN
O=C(NC[C@H](CO)C1CC1)C1CCN(Cc2ccccc2)CC1	ZINC000359778410	133143849	/nfs/dbraw/zinc/14/38/49/133143849.db2.gz	ODIVJAWIYUIKTD-GOSISDBHSA-N	0	3	316.445	2.033	10	0		DEAEHN
O=C(NCCNc1ccncc1)NCC(F)(F)c1ccccc1	ZINC000360358021	133177605	/nfs/dbraw/zinc/17/76/05/133177605.db2.gz	BEWNKJMRXCNTTD-UHFFFAOYSA-N	0	3	320.343	2.007	10	0		DEAEHN
Cc1ccnc(C2CCN(C[C@@H]3CC4(CC4)C(=O)O3)CC2)n1	ZINC000373038517	133375453	/nfs/dbraw/zinc/37/54/53/133375453.db2.gz	UWDAHXXXERQHMM-AWEZNQCLSA-N	0	3	301.390	2.060	10	0		DEAEHN
Cc1ccc(C)c(S(=O)(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000113305817	292087266	/nfs/dbraw/zinc/08/72/66/292087266.db2.gz	GGIHQRMQDBNPFR-LSDHHAIUSA-N	0	3	308.447	2.161	10	0		DEAEHN
COC1(C[C@@H](C)NC2CC([N@@H+](CC(=O)[O-])CC3CC3)C2)CCC1	ZINC000263524750	292123362	/nfs/dbraw/zinc/12/33/62/292123362.db2.gz	STNFKXAYXXSKRY-IUDNXUCKSA-N	0	3	324.465	2.251	10	0		DEAEHN
COC1(C[C@@H](C)NC2CC([N@H+](CC(=O)[O-])CC3CC3)C2)CCC1	ZINC000263524750	292123364	/nfs/dbraw/zinc/12/33/64/292123364.db2.gz	STNFKXAYXXSKRY-IUDNXUCKSA-N	0	3	324.465	2.251	10	0		DEAEHN
CSCC(=O)NCC1(N[C@@H](C)c2ccccc2)CCOCC1	ZINC000172062415	144814856	/nfs/dbraw/zinc/81/48/56/144814856.db2.gz	BIFNSEZMWDBHBJ-AWEZNQCLSA-N	0	3	322.474	2.366	10	0		DEAEHN
C[C@H]1CC[C@H](CN2CCC(c3nnc4ccccn43)CC2)O1	ZINC000188568859	145013938	/nfs/dbraw/zinc/01/39/38/145013938.db2.gz	FISFVGCZOCXVSZ-DZGCQCFKSA-N	0	3	300.406	2.476	10	0		DEAEHN
Cc1cc2c(cc1C)[C@@H](C(=O)N1CCN3CCC1CC3)CO2	ZINC000188628707	145015186	/nfs/dbraw/zinc/01/51/86/145015186.db2.gz	PYERPRFNESWVBZ-INIZCTEOSA-N	0	3	300.402	2.086	10	0		DEAEHN
C[C@@H](c1nnnn1C1CCCCC1)N1CCCN(C2CC2)CC1	ZINC000188953614	145019821	/nfs/dbraw/zinc/01/98/21/145019821.db2.gz	HXGFFTQNZRNAOP-AWEZNQCLSA-N	0	3	318.469	2.409	10	0		DEAEHN
Cc1nn(C)cc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000189867353	145035540	/nfs/dbraw/zinc/03/55/40/145035540.db2.gz	LNBFQVBMVOYFTL-GOEBONIOSA-N	0	3	313.405	2.295	10	0		DEAEHN
CC1(C)CN(C[C@H](O)Cn2cccn2)CC[C@@H]1C(F)(F)F	ZINC000190173532	145038469	/nfs/dbraw/zinc/03/84/69/145038469.db2.gz	UDCRNWFVAXNHAN-RYUDHWBXSA-N	0	3	305.344	2.154	10	0		DEAEHN
COCOc1ccc(OC)cc1CN[C@@H]1C[C@@H]2OCCC[C@H]12	ZINC000190337478	145041209	/nfs/dbraw/zinc/04/12/09/145041209.db2.gz	ICIOWKRMVOHLQE-INMHGKMJSA-N	0	3	307.390	2.335	10	0		DEAEHN
COC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1CCCCCn1cccn1	ZINC000191184106	145054270	/nfs/dbraw/zinc/05/42/70/145054270.db2.gz	COADSKAHJIZVCP-PMPSAXMXSA-N	0	3	305.422	2.327	10	0		DEAEHN
O=C(NCCN1CCCCCC1)[C@H]1CCCN1c1nccs1	ZINC000192591587	145075932	/nfs/dbraw/zinc/07/59/32/145075932.db2.gz	XDHFBLSQGLGTMW-CQSZACIVSA-N	0	3	322.478	2.104	10	0		DEAEHN
COc1cccc(CN[C@@H]2CCCN(c3cccnn3)C2)c1F	ZINC000192680637	145076981	/nfs/dbraw/zinc/07/69/81/145076981.db2.gz	ZFYHETKORYGMQD-CQSZACIVSA-N	0	3	316.380	2.383	10	0		DEAEHN
COc1cccc(CN[C@H]2CCCN(c3cnn(C)c3)C2)c1F	ZINC000192688992	145077025	/nfs/dbraw/zinc/07/70/25/145077025.db2.gz	WWKODHPYICJFPP-AWEZNQCLSA-N	0	3	318.396	2.326	10	0		DEAEHN
COc1cccc(CN[C@@H]2CCCN(c3ncccn3)C2)c1F	ZINC000192668295	145077299	/nfs/dbraw/zinc/07/72/99/145077299.db2.gz	YEZADDVZTXICAQ-CQSZACIVSA-N	0	3	316.380	2.383	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NC[C@@H]2CCCO[C@@H]2C(C)(C)C)C1	ZINC000246301826	145098074	/nfs/dbraw/zinc/09/80/74/145098074.db2.gz	FICXVLWVRQCNCM-ZNMIVQPWSA-N	0	3	311.470	2.173	10	0		DEAEHN
CC(C)(C)OC[C@H](O)CN1CCC[C@H]1C[C@@H](O)c1ccco1	ZINC000246432516	145103112	/nfs/dbraw/zinc/10/31/12/145103112.db2.gz	DGFAWDMQHLCCNJ-RRFJBIMHSA-N	0	3	311.422	2.344	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCC[C@H]1c1cccn1C	ZINC000246485752	145104000	/nfs/dbraw/zinc/10/40/00/145104000.db2.gz	VZCSCHQXFNTMBC-ZBFHGGJFSA-N	0	3	304.438	2.356	10	0		DEAEHN
CCn1nc(C)c(NC(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1C	ZINC000246525486	145105590	/nfs/dbraw/zinc/10/55/90/145105590.db2.gz	UZEKEXHKELNSGJ-RISCZKNCSA-N	0	3	307.442	2.370	10	0		DEAEHN
Cc1ccc([C@@H](C)NC(=O)CN2CCN3CCC[C@H]3C2)cc1C	ZINC000246573441	145107059	/nfs/dbraw/zinc/10/70/59/145107059.db2.gz	RQECHNGINRRBQG-AEFFLSMTSA-N	0	3	315.461	2.261	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCO[C@@H](c2ccsc2)C1	ZINC000246562397	145107177	/nfs/dbraw/zinc/10/71/77/145107177.db2.gz	KRJLVCCIPJCOGW-HUUCEWRRSA-N	0	3	323.462	2.315	10	0		DEAEHN
CS(=O)(=O)N1CCC[C@@H](CN2CCC[C@H]2c2ccco2)C1	ZINC000246750073	145112286	/nfs/dbraw/zinc/11/22/86/145112286.db2.gz	ZGECPXWPRQDHTE-KBPBESRZSA-N	0	3	312.435	2.088	10	0		DEAEHN
O[C@H](COc1ccccc1F)CN1CC[C@@H]2OCCC[C@@H]2C1	ZINC000246808200	145114990	/nfs/dbraw/zinc/11/49/90/145114990.db2.gz	RVAZPVAWPLOHKK-YCPHGPKFSA-N	0	3	309.381	2.066	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000246837385	145116394	/nfs/dbraw/zinc/11/63/94/145116394.db2.gz	CXGUBDROKMQQTE-GUYCJALGSA-N	0	3	312.413	2.053	10	0		DEAEHN
Cn1cc([C@H]2CCN(C[C@@H](O)c3ccc(F)cc3F)C2)cn1	ZINC000247024987	145123386	/nfs/dbraw/zinc/12/33/86/145123386.db2.gz	NDJKUWFJEGMBAQ-MEDUHNTESA-N	0	3	307.344	2.221	10	0		DEAEHN
CN(C[C@@H]1CCCN(C)C1)C(=O)N[C@H]1COc2ccccc21	ZINC000247056030	145125188	/nfs/dbraw/zinc/12/51/88/145125188.db2.gz	BFDYWODVYOLMRM-HIFRSBDPSA-N	0	3	303.406	2.103	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)[C@H]1Cc2cc(F)ccc2O1	ZINC000247141170	145127468	/nfs/dbraw/zinc/12/74/68/145127468.db2.gz	XVJUPEMZKFCHLG-BLLLJJGKSA-N	0	3	306.381	2.120	10	0		DEAEHN
CC1CCC(N(C(=O)CN2CCN3CCC[C@H]3C2)C2CC2)CC1	ZINC000247177750	145128156	/nfs/dbraw/zinc/12/81/56/145128156.db2.gz	KWMBHTZRNJWQKL-HTWSVDAQSA-N	0	3	319.493	2.336	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccccc1Cl)N1CCN2CCC[C@H]2C1	ZINC000247386586	145135111	/nfs/dbraw/zinc/13/51/11/145135111.db2.gz	WOLGXHRZCUUYCE-STQMWFEESA-N	0	3	307.825	2.447	10	0		DEAEHN
Cc1ncc(CN(C)C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)s1	ZINC000247383192	145135595	/nfs/dbraw/zinc/13/55/95/145135595.db2.gz	PWQYPESWENARDJ-BXUZGUMPSA-N	0	3	310.467	2.322	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000247518691	145140286	/nfs/dbraw/zinc/14/02/86/145140286.db2.gz	WMSOGDJGYFHSRF-IKICRFKJSA-N	0	3	314.429	2.494	10	0		DEAEHN
CN1CCCc2cc(NC(=O)N3CCN4CCC[C@H]4C3)ccc21	ZINC000247601810	145142037	/nfs/dbraw/zinc/14/20/37/145142037.db2.gz	UTIRVXOIEJFRPA-INIZCTEOSA-N	0	3	314.433	2.381	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1C	ZINC000248883173	145172131	/nfs/dbraw/zinc/17/21/31/145172131.db2.gz	DODHYHKVUOBSCZ-DOMZBBRYSA-N	0	3	315.417	2.262	10	0		DEAEHN
C[C@@]1(CNC(=O)[C@H]2CCCO2)CCCN1Cc1ccccc1	ZINC000249435960	145184416	/nfs/dbraw/zinc/18/44/16/145184416.db2.gz	IPHGQEOUUVGYJG-AEFFLSMTSA-N	0	3	302.418	2.336	10	0		DEAEHN
COC(=O)c1ccccc1OCCN1CC[C@H](C)[C@H](OC)C1	ZINC000249576796	145186886	/nfs/dbraw/zinc/18/68/86/145186886.db2.gz	AHFPASWXBHKKFL-XJKSGUPXSA-N	0	3	307.390	2.209	10	0		DEAEHN
CCCCNC(=O)[C@H](C)N1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000249882116	145191150	/nfs/dbraw/zinc/19/11/50/145191150.db2.gz	NTSGHNSMKFFUIM-HOTGVXAUSA-N	0	3	318.465	2.429	10	0		DEAEHN
CCc1nn(C)c(CC)c1CC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000253353657	145202114	/nfs/dbraw/zinc/20/21/14/145202114.db2.gz	WIQCPWPNAUEKNS-UONOGXRCSA-N	0	3	320.481	2.029	10	0		DEAEHN
NC1(C(=O)N2CC[C@@H](CSc3ccccc3)C2)CCOCC1	ZINC000261695731	145217514	/nfs/dbraw/zinc/21/75/14/145217514.db2.gz	DNJVZLVLCPFMLM-CQSZACIVSA-N	0	3	320.458	2.135	10	0		DEAEHN
NC1(C(=O)N2CC[C@H](CSc3ccccc3)C2)CCOCC1	ZINC000261695727	145217875	/nfs/dbraw/zinc/21/78/75/145217875.db2.gz	DNJVZLVLCPFMLM-AWEZNQCLSA-N	0	3	320.458	2.135	10	0		DEAEHN
c1ccc(-c2nc(CN3CCNC[C@H]3c3cccnc3)no2)cc1	ZINC000261713437	145219627	/nfs/dbraw/zinc/21/96/27/145219627.db2.gz	KNQBSUWOPCZMJC-INIZCTEOSA-N	0	3	321.384	2.278	10	0		DEAEHN
CCCOc1ccc([C@@H](C)NC(=O)C2(N)CCOCC2)cc1	ZINC000261785020	145225895	/nfs/dbraw/zinc/22/58/95/145225895.db2.gz	HUBHIGIFJKYESP-CYBMUJFWSA-N	0	3	306.406	2.161	10	0		DEAEHN
CCc1nn(C)c(CC)c1CN1CCNC[C@@H]1c1cccnc1	ZINC000261781692	145226036	/nfs/dbraw/zinc/22/60/36/145226036.db2.gz	UAWZPYKOCHDAIZ-GOSISDBHSA-N	0	3	313.449	2.086	10	0		DEAEHN
N[C@H](C(=O)Nc1ccc2oc(C3CC3)nc2c1)C1CCOCC1	ZINC000261792958	145227372	/nfs/dbraw/zinc/22/73/72/145227372.db2.gz	NQUFEDJGDOUCAW-HNNXBMFYSA-N	0	3	315.373	2.398	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)N1CCN(c2ccccc2F)CC1	ZINC000261839482	145232569	/nfs/dbraw/zinc/23/25/69/145232569.db2.gz	IQTPFVCFQRVCNF-INIZCTEOSA-N	0	3	319.424	2.253	10	0		DEAEHN
CN(CCc1cccc2ccccc21)C(=O)C1(N)CCOCC1	ZINC000261869748	145236449	/nfs/dbraw/zinc/23/64/49/145236449.db2.gz	OBBGHLUCISYIBP-UHFFFAOYSA-N	0	3	312.413	2.349	10	0		DEAEHN
Cc1c(NC(=O)C2(N)CCOCC2)cccc1C(F)(F)F	ZINC000261887589	145237563	/nfs/dbraw/zinc/23/75/63/145237563.db2.gz	QAFVQMYIQNGYTL-UHFFFAOYSA-N	0	3	302.296	2.460	10	0		DEAEHN
Cc1cccc(CN(C)C(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)c1	ZINC000261908718	145239940	/nfs/dbraw/zinc/23/99/40/145239940.db2.gz	PWJBEEYRGWKSOU-FRQCXROJSA-N	0	3	316.445	2.486	10	0		DEAEHN
Cc1ccccc1CCNC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C	ZINC000261923196	145242901	/nfs/dbraw/zinc/24/29/01/145242901.db2.gz	RXUMEMPZMYVMEZ-GPMSIDNRSA-N	0	3	316.445	2.186	10	0		DEAEHN
N[C@@H](C(=O)N1CCC[C@@H](Cc2ccccc2)C1)C1CCOCC1	ZINC000262003287	145252341	/nfs/dbraw/zinc/25/23/41/145252341.db2.gz	NPUMZBNMUMJHHC-FUHWJXTLSA-N	0	3	316.445	2.222	10	0		DEAEHN
CCCc1noc(CN2CCNC[C@@H]2c2ccccc2OC)n1	ZINC000262135913	145265075	/nfs/dbraw/zinc/26/50/75/145265075.db2.gz	DMGUWAARZCAZOR-CQSZACIVSA-N	0	3	316.405	2.177	10	0		DEAEHN
CCC[C@](C)(N)C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1	ZINC000262301506	145275067	/nfs/dbraw/zinc/27/50/67/145275067.db2.gz	KUJQRWSHGHTQRT-ZBEGNZNMSA-N	0	3	311.376	2.177	10	0		DEAEHN
C[C@H]1C[NH2+]CC[C@@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000262790515	145304785	/nfs/dbraw/zinc/30/47/85/145304785.db2.gz	ROEAUSOFEHEFKH-KWQFWETISA-N	0	3	323.245	2.270	10	0		DEAEHN
COc1ccc(OC)c(CNC(=O)[C@@H]2NCCCC2(C)C)c1	ZINC000262537332	145291368	/nfs/dbraw/zinc/29/13/68/145291368.db2.gz	QMQKAMYEFLWBEK-HNNXBMFYSA-N	0	3	306.406	2.098	10	0		DEAEHN
CC(C)[C@@H](c1nc([C@@H]2CNCCN2C)no1)c1ccccc1	ZINC000263174534	145333222	/nfs/dbraw/zinc/33/32/22/145333222.db2.gz	GCAAGDWKVIPXJX-LSDHHAIUSA-N	0	3	300.406	2.434	10	0		DEAEHN
CC(=O)CCC(=O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000309812883	145351060	/nfs/dbraw/zinc/35/10/60/145351060.db2.gz	XBMHPRCTAJRZST-OKZBNKHCSA-N	0	3	314.429	2.382	10	0		DEAEHN
CC/C=C\CCN1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000342186395	145574295	/nfs/dbraw/zinc/57/42/95/145574295.db2.gz	INJBLHGWOKPQOF-DDKKJVIOSA-N	0	3	318.461	2.400	10	0		DEAEHN
CC(C)c1nn(C)cc1C(=O)N1CCN(C2CCC2)C[C@H](C)C1	ZINC000344700562	145914012	/nfs/dbraw/zinc/91/40/12/145914012.db2.gz	PHPIBDTVDYOHSU-AWEZNQCLSA-N	0	3	318.465	2.490	10	0		DEAEHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)NC[C@@](C)(O)C1CCCCC1	ZINC000359208642	147282538	/nfs/dbraw/zinc/28/25/38/147282538.db2.gz	KAVPHVYDWNRLQL-MZMPZRCHSA-N	0	3	323.481	2.100	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1C	ZINC000113305868	292180119	/nfs/dbraw/zinc/18/01/19/292180119.db2.gz	JFTYEHIXZOKDOJ-LSDHHAIUSA-N	0	3	308.447	2.161	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@H](C(=O)N(C)[C@@H]1CCCN(C)C1)C2	ZINC000375264362	148349835	/nfs/dbraw/zinc/34/98/35/148349835.db2.gz	YUBIGSIMESJPDJ-UONOGXRCSA-N	0	3	318.465	2.191	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@@H](C(=O)N(C)[C@@H]1CCCN(C)C1)CC2	ZINC000375264362	148349838	/nfs/dbraw/zinc/34/98/38/148349838.db2.gz	YUBIGSIMESJPDJ-UONOGXRCSA-N	0	3	318.465	2.191	10	0		DEAEHN
CCOCCN(C)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179569628	286074726	/nfs/dbraw/zinc/07/47/26/286074726.db2.gz	DLQGOVSQCXXLIX-JKSUJKDBSA-N	0	3	305.422	2.110	10	0		DEAEHN
C[C@H](CNC(=O)N(C)C[C@@H]1CCCO1)N(C)Cc1ccccc1	ZINC000111875820	401727131	/nfs/dbraw/zinc/72/71/31/401727131.db2.gz	DYWWVGHMCMHJDF-WBVHZDCISA-N	0	3	319.449	2.327	10	0		DEAEHN
COCCOCCNCc1ccc(Br)c(F)c1	ZINC000127421850	401733840	/nfs/dbraw/zinc/73/38/40/401733840.db2.gz	TZQRCZLFBKBLJF-UHFFFAOYSA-N	0	3	306.175	2.341	10	0		DEAEHN
CN1C[C@@H](NCc2ccc(Br)c(F)c2)CCC1=O	ZINC000127476866	401737157	/nfs/dbraw/zinc/73/71/57/401737157.db2.gz	KYRCFAXKIDORFS-JTQLQIEISA-N	0	3	315.186	2.299	10	0		DEAEHN
Cc1cc(C)n2c(CN3CCN(C4CCCC4)CC3)cnc2n1	ZINC000126971160	401715367	/nfs/dbraw/zinc/71/53/67/401715367.db2.gz	MPBXQXRWPPUMRP-UHFFFAOYSA-N	0	3	313.449	2.406	10	0		DEAEHN
C[C@@H]1CN(C(=O)CN2CCC[C@@]3(CC=CCC3)C2)C[C@@H](C)O1	ZINC000114495417	401802492	/nfs/dbraw/zinc/80/24/92/401802492.db2.gz	QYYTWTDYFOYGKQ-NUJGCVRESA-N	0	3	306.450	2.445	10	0		DEAEHN
CCOC(=O)CCCNC(=O)CN1CCC[C@]2(CC=CCC2)C1	ZINC000114495674	401802521	/nfs/dbraw/zinc/80/25/21/401802521.db2.gz	SERIUQXOYBURFZ-GOSISDBHSA-N	0	3	322.449	2.268	10	0		DEAEHN
CCc1nnsc1C(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000114680762	401805805	/nfs/dbraw/zinc/80/58/05/401805805.db2.gz	RMBKFECYSRIYAY-ZDUSSCGKSA-N	0	3	318.446	2.003	10	0		DEAEHN
C(CN1CCO[C@H]2CCCC[C@@H]21)N1CCO[C@H]2CCCC[C@H]21	ZINC000114715947	401807247	/nfs/dbraw/zinc/80/72/47/401807247.db2.gz	MCWCTGOGKOQFQX-MHORFTMASA-N	0	3	308.466	2.273	10	0		DEAEHN
Cc1nc2cccnc2n1-c1cccc(C(=O)NCCN(C)C)c1	ZINC000008592376	401753884	/nfs/dbraw/zinc/75/38/84/401753884.db2.gz	QYROGVDAXBGBOM-UHFFFAOYSA-N	0	3	323.400	2.020	10	0		DEAEHN
CSC(C)(C)CNC(=O)c1ccccc1OCCN(C)C	ZINC000075363424	401758696	/nfs/dbraw/zinc/75/86/96/401758696.db2.gz	DEGIHULJDAWTHJ-UHFFFAOYSA-N	0	3	310.463	2.498	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(-c2ccco2)on1	ZINC000113227745	401772028	/nfs/dbraw/zinc/77/20/28/401772028.db2.gz	QSXFJVITDHPGGU-VXGBXAGGSA-N	0	3	301.346	2.243	10	0		DEAEHN
CCc1nn(C)c(CC)c1CN1CC[C@H](c2cnn(C)c2)C1	ZINC000128558119	401782715	/nfs/dbraw/zinc/78/27/15/401782715.db2.gz	PTBYRDYTSBZBSE-ZDUSSCGKSA-N	0	3	301.438	2.268	10	0		DEAEHN
Cn1cc([C@H]2CCN(C[C@H](O)c3ccc(F)cc3F)C2)cn1	ZINC000116313748	401849294	/nfs/dbraw/zinc/84/92/94/401849294.db2.gz	NDJKUWFJEGMBAQ-ZBEGNZNMSA-N	0	3	307.344	2.221	10	0		DEAEHN
COc1ccc(OC)c(CN2CC[C@H](c3cnn(C)c3)C2)c1	ZINC000116312963	401849643	/nfs/dbraw/zinc/84/96/43/401849643.db2.gz	LFBOLBKUCDWNRO-ZDUSSCGKSA-N	0	3	301.390	2.427	10	0		DEAEHN
COCCN1CCC(NC(=O)N2CCC[C@@H]2c2ccco2)CC1	ZINC000116538057	401854467	/nfs/dbraw/zinc/85/44/67/401854467.db2.gz	TYKQVYAVPJYYLP-OAHLLOKOSA-N	0	3	321.421	2.237	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)C(C)(C)c2ccccc2Cl)CCO1	ZINC000116783201	401858845	/nfs/dbraw/zinc/85/88/45/401858845.db2.gz	YBZOKLNZTIHQHX-CYBMUJFWSA-N	0	3	324.852	2.407	10	0		DEAEHN
Cc1ccc(CCCC(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000116793235	401859207	/nfs/dbraw/zinc/85/92/07/401859207.db2.gz	KBZSRBPACUSZSV-KRWDZBQOSA-N	0	3	304.434	2.107	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2cc3c(s2)CCCCC3)CCO1	ZINC000116786304	401859231	/nfs/dbraw/zinc/85/92/31/401859231.db2.gz	BSXIRHBHULBJKW-AWEZNQCLSA-N	0	3	322.474	2.420	10	0		DEAEHN
Cc1ccccc1[C@H](C)NC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000117023041	401867123	/nfs/dbraw/zinc/86/71/23/401867123.db2.gz	YOKCKVILYVFJHW-GJZGRUSLSA-N	0	3	305.422	2.028	10	0		DEAEHN
CCC1CCC(CNC(=O)N2CCO[C@@H](CN(C)C)C2)CC1	ZINC000117039613	401867720	/nfs/dbraw/zinc/86/77/20/401867720.db2.gz	GCDRGMVVCAJASC-GPANFISMSA-N	0	3	311.470	2.175	10	0		DEAEHN
COc1ccc(CNC(=O)N[C@H](CC(C)C)CN(C)C)cc1O	ZINC000079495849	401874512	/nfs/dbraw/zinc/87/45/12/401874512.db2.gz	RLVCXUWFRBKTKQ-CQSZACIVSA-N	0	3	323.437	2.176	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCCC[C@@H]1C(C)C	ZINC000117495198	401878397	/nfs/dbraw/zinc/87/83/97/401878397.db2.gz	BVDSJTAIEHRLMF-HZPDHXFCSA-N	0	3	311.470	2.317	10	0		DEAEHN
Cc1cc([C@@H]2CN(C(=O)C3CCN(C)CC3)CCO2)ccc1F	ZINC000134862186	401917570	/nfs/dbraw/zinc/91/75/70/401917570.db2.gz	HOGRYDHINYVKII-KRWDZBQOSA-N	0	3	320.408	2.376	10	0		DEAEHN
CCC[C@@](C)(CO)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000086369829	401922655	/nfs/dbraw/zinc/92/26/55/401922655.db2.gz	IBGZOEXYOTZTEI-WMZOPIPTSA-N	0	3	321.465	2.010	10	0		DEAEHN
Cc1cc(CN2CCC[C@@H](n3cncn3)C2)ccc1-n1cncn1	ZINC000119484231	401953537	/nfs/dbraw/zinc/95/35/37/401953537.db2.gz	CUKZYTGLVUGOJE-MRXNPFEDSA-N	0	3	323.404	2.004	10	0		DEAEHN
CCN(CC)C(=O)[C@H](C)N[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000119492091	401954514	/nfs/dbraw/zinc/95/45/14/401954514.db2.gz	HBJMQIVMOPMCBA-KBPBESRZSA-N	0	3	315.421	2.175	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)Cc2ccc(O)cc2Cl)C1	ZINC000136167236	401961701	/nfs/dbraw/zinc/96/17/01/401961701.db2.gz	DQWWUOOKBQRMRM-GFCCVEGCSA-N	0	3	310.825	2.436	10	0		DEAEHN
C[C@@H]1CCC[N@H+](CCNC(=O)Cc2ccc([O-])cc2Cl)C1	ZINC000136167236	401961703	/nfs/dbraw/zinc/96/17/03/401961703.db2.gz	DQWWUOOKBQRMRM-GFCCVEGCSA-N	0	3	310.825	2.436	10	0		DEAEHN
C[C@@H]1CCC[N@@H+](CCNC(=O)Cc2ccc([O-])cc2Cl)C1	ZINC000136167236	401961706	/nfs/dbraw/zinc/96/17/06/401961706.db2.gz	DQWWUOOKBQRMRM-GFCCVEGCSA-N	0	3	310.825	2.436	10	0		DEAEHN
C[C@H](CO)N(C)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000119620315	401961943	/nfs/dbraw/zinc/96/19/43/401961943.db2.gz	LLCUJBTUUREBKI-CRAIPNDOSA-N	0	3	319.449	2.063	10	0		DEAEHN
CC[C@H](CO)N1CCN(Cc2ccc3c(c2)CC(C)(C)O3)CC1	ZINC000136401196	401967214	/nfs/dbraw/zinc/96/72/14/401967214.db2.gz	XOMPROHYYYZFLS-QGZVFWFLSA-N	0	3	318.461	2.289	10	0		DEAEHN
CCNC(=O)N1CC[C@H](N[C@@H](C)c2ccc(F)c(OC)c2)C1	ZINC000090410226	401982004	/nfs/dbraw/zinc/98/20/04/401982004.db2.gz	LXPNATOZXSBEBN-AAEUAGOBSA-N	0	3	309.385	2.289	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCCc2ccc(Cl)nc2)CCN1C	ZINC000119305289	401940012	/nfs/dbraw/zinc/94/00/12/401940012.db2.gz	XJNRHRJCCBAYGO-TZMCWYRMSA-N	0	3	324.856	2.402	10	0		DEAEHN
COC[C@](C)(CCO)NCCOc1ccc(F)cc1Cl	ZINC000091677374	401997190	/nfs/dbraw/zinc/99/71/90/401997190.db2.gz	BGTJCCDUQCUAGK-AWEZNQCLSA-N	0	3	305.777	2.235	10	0		DEAEHN
O=C1NCCC[C@H]1N[C@@H]1CCc2cc(Br)ccc21	ZINC000050395465	402028089	/nfs/dbraw/zinc/02/80/89/402028089.db2.gz	VYVNKMUKUSFSOF-CHWSQXEVSA-N	0	3	309.207	2.305	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](CN(C)C)c2ccccc2)C1	ZINC000052519278	402043066	/nfs/dbraw/zinc/04/30/66/402043066.db2.gz	VOUBRMHTYLJLEH-IRXDYDNUSA-N	0	3	318.465	2.073	10	0		DEAEHN
C[C@@H]1CN(C2CCN(Cc3c[nH]nc3C(C)(C)C)CC2)CCO1	ZINC000092079630	402001912	/nfs/dbraw/zinc/00/19/12/402001912.db2.gz	QRYKFNGGXIFQRH-CQSZACIVSA-N	0	3	320.481	2.392	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCC2(c3cccc(F)c3)CC2)C1	ZINC000120911281	402006588	/nfs/dbraw/zinc/00/65/88/402006588.db2.gz	MGWIDMGRKBMPAA-OAHLLOKOSA-N	0	3	305.397	2.203	10	0		DEAEHN
CC[C@@H]1CN(Cc2cccc(OC)c2OC)CCN1CCOC	ZINC000120945343	402007879	/nfs/dbraw/zinc/00/78/79/402007879.db2.gz	JDSFUWAFYBWQBK-MRXNPFEDSA-N	0	3	322.449	2.246	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cc(-c3ccncc3)on2)CCN1C	ZINC000123283749	402120083	/nfs/dbraw/zinc/12/00/83/402120083.db2.gz	KNYIGTODTSMFSY-GXTWGEPZSA-N	0	3	314.389	2.291	10	0		DEAEHN
C[C@@H](c1nc(-c2cccnc2)no1)N(C)C[C@@H]1CCCN(C)C1	ZINC000152420648	402095556	/nfs/dbraw/zinc/09/55/56/402095556.db2.gz	QPRGECHOGJIENJ-UONOGXRCSA-N	0	3	315.421	2.466	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2ccc(OC)c(F)c2)C1	ZINC000057825372	402096685	/nfs/dbraw/zinc/09/66/85/402096685.db2.gz	NQEYABLZZDRSEF-CYBMUJFWSA-N	0	3	309.385	2.118	10	0		DEAEHN
COCCCN(C)CCNC(=O)CSc1ccccc1C	ZINC000152512816	402098960	/nfs/dbraw/zinc/09/89/60/402098960.db2.gz	PHTPGXHYWSYWDZ-UHFFFAOYSA-N	0	3	310.463	2.172	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CCCN2c2nccs2)CCN1C	ZINC000123046451	402107915	/nfs/dbraw/zinc/10/79/15/402107915.db2.gz	ADLUKWCEWRJZFF-MCIONIFRSA-N	0	3	322.478	2.053	10	0		DEAEHN
CCCc1noc(CCCC(=O)N2CCCN(C3CC3)CC2)n1	ZINC000061604197	402108375	/nfs/dbraw/zinc/10/83/75/402108375.db2.gz	DVIPPROIQVEEGK-UHFFFAOYSA-N	0	3	320.437	2.042	10	0		DEAEHN
O=C(NCCCOc1ccccc1)N1CCCN(C2CC2)CC1	ZINC000061856119	402108868	/nfs/dbraw/zinc/10/88/68/402108868.db2.gz	KLPLLMNZPSXHIZ-UHFFFAOYSA-N	0	3	317.433	2.335	10	0		DEAEHN
C[C@H](CS(C)(=O)=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000152952534	402118739	/nfs/dbraw/zinc/11/87/39/402118739.db2.gz	KLXSUXMXNMNXMX-WBVHZDCISA-N	0	3	324.490	2.064	10	0		DEAEHN
Cc1nn(CC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c(C)c1Cl	ZINC000123279561	402119268	/nfs/dbraw/zinc/11/92/68/402119268.db2.gz	OWXXZVMGIKRTNI-ZWNOBZJWSA-N	0	3	312.845	2.094	10	0		DEAEHN
CC[C@](C)(O)CN1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000123348180	402123346	/nfs/dbraw/zinc/12/33/46/402123346.db2.gz	ZKNJYKLLFQOERN-KRWDZBQOSA-N	0	3	308.397	2.135	10	0		DEAEHN
COC(=O)c1ccccc1NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000153405842	402143633	/nfs/dbraw/zinc/14/36/33/402143633.db2.gz	XFAWPCIPQBIJHW-CHWSQXEVSA-N	0	3	319.405	2.420	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1ccc(OC)nc1C	ZINC000123813565	402147367	/nfs/dbraw/zinc/14/73/67/402147367.db2.gz	QGUDJJAUOQEQQF-ZDUSSCGKSA-N	0	3	306.410	2.347	10	0		DEAEHN
CCCC(=O)N[C@@H]1CCCN(CCCOCC(F)(F)F)C1	ZINC000101563227	402148798	/nfs/dbraw/zinc/14/87/98/402148798.db2.gz	SVVTUDVFGXSBRP-GFCCVEGCSA-N	0	3	310.360	2.336	10	0		DEAEHN
COC[C@@H](C)C(=O)N(CCN(C)C)Cc1ccc(F)cc1F	ZINC000103432739	402187907	/nfs/dbraw/zinc/18/79/07/402187907.db2.gz	CQXMZTVIPKHFEM-GFCCVEGCSA-N	0	3	314.376	2.138	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N[C@@H](CC(C)C)CN(C)C)ccc1F	ZINC000068224458	402188362	/nfs/dbraw/zinc/18/83/62/402188362.db2.gz	NDJFCJFXSWURDA-AWEZNQCLSA-N	0	3	323.412	2.490	10	0		DEAEHN
COc1cccc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1OC	ZINC000124819412	402198529	/nfs/dbraw/zinc/19/85/29/402198529.db2.gz	ACKVZFUPFCFRQV-OLZOCXBDSA-N	0	3	306.406	2.259	10	0		DEAEHN
COc1ccc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(OC)c1	ZINC000124277280	402172762	/nfs/dbraw/zinc/17/27/62/402172762.db2.gz	WGGMXOFHDBGNDW-QWHCGFSZSA-N	0	3	306.406	2.259	10	0		DEAEHN
Cc1ccn2ncc(C(=O)NC[C@@H](c3ccccc3)N(C)C)c2n1	ZINC000068647005	402202982	/nfs/dbraw/zinc/20/29/82/402202982.db2.gz	OWHDRHBZFLICKG-INIZCTEOSA-N	0	3	323.400	2.070	10	0		DEAEHN
CC(C)Oc1ccccc1CNC[C@@H]1CN(C2CC2)CCO1	ZINC000106379659	402213264	/nfs/dbraw/zinc/21/32/64/402213264.db2.gz	JPUJPCGIUQUJLP-QGZVFWFLSA-N	0	3	304.434	2.427	10	0		DEAEHN
C[C@@]1(CNC(=O)C2(O)CCCC2)CCCN1Cc1ccccc1	ZINC000154846449	402235986	/nfs/dbraw/zinc/23/59/86/402235986.db2.gz	SSOWIXGLKLWGMA-SFHVURJKSA-N	0	3	316.445	2.462	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)[C@H]1C[C@@H](C(C)=O)C1(C)C	ZINC000155023397	402242073	/nfs/dbraw/zinc/24/20/73/402242073.db2.gz	WNXYTNDKKBEJSD-LVQVYYBASA-N	0	3	306.450	2.323	10	0		DEAEHN
COC(=O)[C@H](CC(C)C)NC(=O)CN[C@@H](C)c1ccccc1C	ZINC000155015684	402242163	/nfs/dbraw/zinc/24/21/63/402242163.db2.gz	KZTNYTPUQRMVHT-HOCLYGCPSA-N	0	3	320.433	2.350	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2csc(-c3ccoc3)n2)CCO1	ZINC000108373582	402252183	/nfs/dbraw/zinc/25/21/83/402252183.db2.gz	YMXDXPXTFHHXEH-AWEZNQCLSA-N	0	3	307.419	2.166	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(CC(=O)N2CCCCCC2)C1	ZINC000105896413	402210584	/nfs/dbraw/zinc/21/05/84/402210584.db2.gz	JQSOADUDEGXHAK-INIZCTEOSA-N	0	3	318.465	2.485	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(Br)s2)C1	ZINC000070916210	402266972	/nfs/dbraw/zinc/26/69/72/402266972.db2.gz	ZDEYCVLPYWUUCM-QMMMGPOBSA-N	0	3	303.225	2.287	10	0		DEAEHN
Cc1cc2c(cc1C)[C@@H](C(=O)N1CCN3CCC[C@@H]3C1)CO2	ZINC000184880994	402306280	/nfs/dbraw/zinc/30/62/80/402306280.db2.gz	DYPUKQQRGKEOEE-ZBFHGGJFSA-N	0	3	300.402	2.086	10	0		DEAEHN
C[C@H](NC(=O)N(C)CCN(C)C)c1cccc(-n2ccnc2)c1	ZINC000176425465	402307912	/nfs/dbraw/zinc/30/79/12/402307912.db2.gz	JKUCKEPTHDQJEG-AWEZNQCLSA-N	0	3	315.421	2.136	10	0		DEAEHN
C[C@H](C(=O)NC[C@@H](c1ccccc1)N(C)C)C1CCOCC1	ZINC000158554854	402308092	/nfs/dbraw/zinc/30/80/92/402308092.db2.gz	HMBHCGFAVVQTKL-YOEHRIQHSA-N	0	3	304.434	2.468	10	0		DEAEHN
CCc1ccc(CN2CCN(Cc3n[nH]c(CC)n3)CC2)s1	ZINC000158622724	402309387	/nfs/dbraw/zinc/30/93/87/402309387.db2.gz	KKDDPXOJPPBJAO-UHFFFAOYSA-N	0	3	319.478	2.309	10	0		DEAEHN
Cc1nn(C)c(CNCC[C@@H]2CCOC2)c1Br	ZINC000228730548	402340144	/nfs/dbraw/zinc/34/01/44/402340144.db2.gz	SFMXWKSQSVAZKU-SNVBAGLBSA-N	0	3	302.216	2.007	10	0		DEAEHN
Cc1c(Br)cccc1NC(=O)C1(N)CCOCC1	ZINC000229215194	402341371	/nfs/dbraw/zinc/34/13/71/402341371.db2.gz	QRIBSNFRADHQDS-UHFFFAOYSA-N	0	3	313.195	2.204	10	0		DEAEHN
CC(=O)NC[C@H]1CN(c2c(C)cnc3c(C)cccc32)CCO1	ZINC000185310556	402342688	/nfs/dbraw/zinc/34/26/88/402342688.db2.gz	BPTCMSGEPAETBW-HNNXBMFYSA-N	0	3	313.401	2.193	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1ccc(C)c(C)c1	ZINC000176905214	402348547	/nfs/dbraw/zinc/34/85/47/402348547.db2.gz	OGJWSWKAEORJSG-INIZCTEOSA-N	0	3	317.433	2.185	10	0		DEAEHN
CCC[C@@H](N)C(=O)N(Cc1cc(OC)ccc1OC)C1CC1	ZINC000236901374	402387480	/nfs/dbraw/zinc/38/74/80/402387480.db2.gz	CPZSPKJSSQZDIR-OAHLLOKOSA-N	0	3	306.406	2.322	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cccnc1N1CCCC1	ZINC000176980487	402356328	/nfs/dbraw/zinc/35/63/28/402356328.db2.gz	UUSTZQLXDNXBSJ-OAHLLOKOSA-N	0	3	316.449	2.238	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCN(C)c3ccncc32)c(C)s1	ZINC000176978351	402356530	/nfs/dbraw/zinc/35/65/30/402356530.db2.gz	NUPSNQZYWAMVSJ-UHFFFAOYSA-N	0	3	323.443	2.405	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc(NC(C)=O)cc1	ZINC000176994914	402357672	/nfs/dbraw/zinc/35/76/72/402357672.db2.gz	JRCMCPDVMXGDFW-INIZCTEOSA-N	0	3	303.406	2.201	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)C(=O)Nc2ccc(Cl)cc2)[C@@H](C)C1	ZINC000177209109	402381311	/nfs/dbraw/zinc/38/13/11/402381311.db2.gz	GDUAUVJSTYDRGP-FZMZJTMJSA-N	0	3	323.824	2.123	10	0		DEAEHN
C[C@H]1OCC[C@@]1(O)CNCc1ccc(Br)c(F)c1	ZINC000227971147	402334598	/nfs/dbraw/zinc/33/45/98/402334598.db2.gz	WRDZQEYXZLCCPA-NOZJJQNGSA-N	0	3	318.186	2.218	10	0		DEAEHN
CCC[C@H](C(=O)Nc1ccc(OCCN(C)C)cc1)N(C)C	ZINC000161656479	402394665	/nfs/dbraw/zinc/39/46/65/402394665.db2.gz	ZCRMNSOYJNGMRQ-MRXNPFEDSA-N	0	3	307.438	2.296	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cc(OC)c(OC)cc2F)C1	ZINC000177409117	402399532	/nfs/dbraw/zinc/39/95/32/402399532.db2.gz	LQEWFVTWWKBQQO-LLVKDONJSA-N	0	3	310.369	2.057	10	0		DEAEHN
O[C@@H](COC[C@@H]1CCCO1)CN1Cc2ccccc2C2(CC2)C1	ZINC000186212058	402410800	/nfs/dbraw/zinc/41/08/00/402410800.db2.gz	JNKSPNSIJUXNAE-SJORKVTESA-N	0	3	317.429	2.090	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCOCc1ccccc1	ZINC000177577491	402417448	/nfs/dbraw/zinc/41/74/48/402417448.db2.gz	NHYMOXXCFNBWTC-KRWDZBQOSA-N	0	3	319.449	2.329	10	0		DEAEHN
CCOC(=O)c1nn(C)cc1CNC[C@@H]1C[C@@H]1c1ccccc1	ZINC000186349117	402423795	/nfs/dbraw/zinc/42/37/95/402423795.db2.gz	BQSWDSNCSYKYCW-GOEBONIOSA-N	0	3	313.401	2.490	10	0		DEAEHN
C[NH+](C)C[C@@H]1CCN(C(=O)c2ccc3c(c2[O-])CCCC3)C1	ZINC000186360162	402425234	/nfs/dbraw/zinc/42/52/34/402425234.db2.gz	SOTLGLBILOSTEZ-ZDUSSCGKSA-N	0	3	302.418	2.295	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)NC1CCC(C)CC1	ZINC000177703725	402428585	/nfs/dbraw/zinc/42/85/85/402428585.db2.gz	TZVDNPOFRZGYBC-ODZFXCKXSA-N	0	3	309.498	2.486	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)NCc1ccc(C)cc1	ZINC000177704542	402428666	/nfs/dbraw/zinc/42/86/66/402428666.db2.gz	FCGXWJSAYHAJIS-WMZOPIPTSA-N	0	3	317.477	2.416	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)Nc1ccc(Cl)cn1	ZINC000177709515	402429090	/nfs/dbraw/zinc/42/90/90/402429090.db2.gz	NWXQRYMEDAPJFF-JSGCOSHPSA-N	0	3	324.856	2.478	10	0		DEAEHN
CCc1nc(NC(=O)CN(C)C[C@H]2CCCN2CC)sc1C	ZINC000177712475	402429699	/nfs/dbraw/zinc/42/96/99/402429699.db2.gz	HSEUWKYTXMZLSC-CYBMUJFWSA-N	0	3	324.494	2.369	10	0		DEAEHN
Cc1csc([C@H]2CCCN([C@H](C)CN3CCOCC3)C2)n1	ZINC000246098991	402510164	/nfs/dbraw/zinc/51/01/64/402510164.db2.gz	OJQJBFMXZLLYAW-CABCVRRESA-N	0	3	309.479	2.352	10	0		DEAEHN
C[C@@H](NCCNC(=O)c1ccccc1)c1ccc2c(c1)OCO2	ZINC000178023894	402453445	/nfs/dbraw/zinc/45/34/45/402453445.db2.gz	HYWHJXPLFRINMF-CYBMUJFWSA-N	0	3	312.369	2.496	10	0		DEAEHN
Cc1nc(-c2ccccc2)ncc1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000178113167	402461813	/nfs/dbraw/zinc/46/18/13/402461813.db2.gz	RJEGYLCMDGUBAM-MRXNPFEDSA-N	0	3	322.412	2.372	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@@H]1COc2ccccc2C1	ZINC000245461979	402462653	/nfs/dbraw/zinc/46/26/53/402462653.db2.gz	GDQPEALRQMFXAT-HOTGVXAUSA-N	0	3	317.433	2.116	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)N1c2ccccc2C[C@H]1C	ZINC000245478933	402465007	/nfs/dbraw/zinc/46/50/07/402465007.db2.gz	VYGNXUJXTFPUJP-NVXWUHKLSA-N	0	3	315.461	2.380	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCCc2ccccn2)[C@H]1c1ccccc1	ZINC000245620368	402474281	/nfs/dbraw/zinc/47/42/81/402474281.db2.gz	DXUAYNYNSWBWRS-QZTJIDSGSA-N	0	3	324.428	2.369	10	0		DEAEHN
CCc1ccccc1S(=O)(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000186985959	402475867	/nfs/dbraw/zinc/47/58/67/402475867.db2.gz	QRBJFOOLPJEWEM-ZFWWWQNUSA-N	0	3	308.447	2.106	10	0		DEAEHN
COCCCN(C)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000245648132	402476340	/nfs/dbraw/zinc/47/63/40/402476340.db2.gz	MDXAECCBIPIIEY-JKSUJKDBSA-N	0	3	305.422	2.110	10	0		DEAEHN
COCC[C@H](C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245695416	402479927	/nfs/dbraw/zinc/47/99/27/402479927.db2.gz	XZDPQHLIPFIURC-BPUTZDHNSA-N	0	3	305.422	2.156	10	0		DEAEHN
CCN(CCO)CCNC(=O)N[C@H](C)c1ccc(C(C)C)cc1	ZINC000187083301	402481919	/nfs/dbraw/zinc/48/19/19/402481919.db2.gz	YVDPDIGEDDEVOX-OAHLLOKOSA-N	0	3	321.465	2.484	10	0		DEAEHN
CC[C@@H]1CN(Cc2cccc3[nH]ccc32)CCN1C[C@H](C)O	ZINC000245717222	402482709	/nfs/dbraw/zinc/48/27/09/402482709.db2.gz	HEUIZFTUTMCJIY-GOEBONIOSA-N	0	3	301.434	2.445	10	0		DEAEHN
COC[C@@H](C)CN(C)C[C@@H](c1cccs1)N1CCOCC1	ZINC000187232287	402489512	/nfs/dbraw/zinc/48/95/12/402489512.db2.gz	WHOSAHQIXLZFFO-GJZGRUSLSA-N	0	3	312.479	2.336	10	0		DEAEHN
CO[C@H]1CN(C(=O)NCC(C)(C)N2CCCCC2)CC[C@@H]1C	ZINC000187246665	402490211	/nfs/dbraw/zinc/49/02/11/402490211.db2.gz	ANGPQBABECVYFA-GJZGRUSLSA-N	0	3	311.470	2.317	10	0		DEAEHN
Cc1ccc(CN2CCCC[C@@H](N3CCN(C)CC3)C2)c(C)n1	ZINC000187297893	402492347	/nfs/dbraw/zinc/49/23/47/402492347.db2.gz	MVEPUYPYGLNSOI-LJQANCHMSA-N	0	3	316.493	2.300	10	0		DEAEHN
CN(CC(=O)N1CCC[C@@H](C(F)(F)F)C1)C[C@H]1CCCOC1	ZINC000245929529	402498335	/nfs/dbraw/zinc/49/83/35/402498335.db2.gz	PKXJRRNRKLQVBU-CHWSQXEVSA-N	0	3	322.371	2.146	10	0		DEAEHN
Cc1cc(C)n2c(CN(C)C[C@@H]3CCCC[C@H]3O)cnc2n1	ZINC000245951854	402500327	/nfs/dbraw/zinc/50/03/27/402500327.db2.gz	LFYRXOKRSMYVPY-GOEBONIOSA-N	0	3	302.422	2.329	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NC[C@H](C)N2CCC(C)CC2)CC[C@@H]1C	ZINC000187621664	402506703	/nfs/dbraw/zinc/50/67/03/402506703.db2.gz	ZUXHJLAULCCRDL-HRCADAONSA-N	0	3	311.470	2.173	10	0		DEAEHN
Cc1ccccc1CS(=O)(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000246079183	402508041	/nfs/dbraw/zinc/50/80/41/402508041.db2.gz	FSTRGRURAJIGMD-GOEBONIOSA-N	0	3	310.463	2.239	10	0		DEAEHN
CC[C@H](C)[C@@H](C)NC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000246084793	402508557	/nfs/dbraw/zinc/50/85/57/402508557.db2.gz	IEROIGMXAGYVKG-GVDBMIGSSA-N	0	3	324.513	2.233	10	0		DEAEHN
COc1ccc2nc(N3CCN(C[C@H](C)O)[C@H](C)C3)ccc2c1	ZINC000246092141	402509448	/nfs/dbraw/zinc/50/94/48/402509448.db2.gz	GTQAVKKSTAHOFJ-KGLIPLIRSA-N	0	3	315.417	2.135	10	0		DEAEHN
Cc1cc(C)cc(OC[C@H](O)CN2CCN3CCCC[C@H]3C2)c1	ZINC000246921171	402549549	/nfs/dbraw/zinc/54/95/49/402549549.db2.gz	SMQLJNPDELQLPY-ZWKOTPCHSA-N	0	3	318.461	2.213	10	0		DEAEHN
Cc1cccc(C)c1OCCN1CCN(C[C@H](C)O)[C@@H](C)C1	ZINC000246999643	402552692	/nfs/dbraw/zinc/55/26/92/402552692.db2.gz	BLZVRLCKASVIPK-IRXDYDNUSA-N	0	3	306.450	2.069	10	0		DEAEHN
CC[C@@H]1CN(Cc2cc(-c3ccco3)on2)CCN1C[C@H](C)O	ZINC000247007474	402553770	/nfs/dbraw/zinc/55/37/70/402553770.db2.gz	BWHHUNPDIYSXRN-DZGCQCFKSA-N	0	3	319.405	2.212	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccc2c(c1)OCCCO2	ZINC000247116229	402557292	/nfs/dbraw/zinc/55/72/92/402557292.db2.gz	IWEPYBRWNZDQID-ZFWWWQNUSA-N	0	3	316.401	2.157	10	0		DEAEHN
C[C@H](O)CN1CCN(CCOc2cccc(Cl)c2)C[C@@H]1C	ZINC000247161806	402558648	/nfs/dbraw/zinc/55/86/48/402558648.db2.gz	MJNJKQRTEWQQFM-KBPBESRZSA-N	0	3	312.841	2.106	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N(C)CCOc2ccccc2)C1	ZINC000247378780	402565580	/nfs/dbraw/zinc/56/55/80/402565580.db2.gz	PQTUYMRTJXHCFX-NVXWUHKLSA-N	0	3	319.449	2.436	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@H]1CCCc2occc21	ZINC000247647725	402573682	/nfs/dbraw/zinc/57/36/82/402573682.db2.gz	VSNRFQAHQRPFPZ-ZFWWWQNUSA-N	0	3	321.421	2.067	10	0		DEAEHN
C[C@@H](C(=O)NC(=O)NC1CC1)N1CCC[C@]2(CC=CCC2)C1	ZINC000246381826	402527861	/nfs/dbraw/zinc/52/78/61/402527861.db2.gz	NPMPMWKOXITLPO-SUMWQHHRSA-N	0	3	305.422	2.185	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)C1	ZINC000170827963	402529976	/nfs/dbraw/zinc/52/99/76/402529976.db2.gz	FOIDJCONTGAUDG-QJPTWQEYSA-N	0	3	307.360	2.453	10	0		DEAEHN
COc1ccc(Cl)cc1CNC(=O)N1CC[C@H](N(C)C)C1	ZINC000170831582	402530483	/nfs/dbraw/zinc/53/04/83/402530483.db2.gz	DSZONEVXBNJTJE-ZDUSSCGKSA-N	0	3	311.813	2.194	10	0		DEAEHN
CC(C)COC[C@@H](NC(=O)N1CC[C@@H](N(C)C)C1)c1ccco1	ZINC000170836070	402531619	/nfs/dbraw/zinc/53/16/19/402531619.db2.gz	BFZDQVSLKXLUEH-HUUCEWRRSA-N	0	3	323.437	2.339	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)Nc2cccc3c2OCCO3)C1	ZINC000246532792	402535207	/nfs/dbraw/zinc/53/52/07/402535207.db2.gz	UXCMMVGFCNPBHS-TZMCWYRMSA-N	0	3	319.405	2.308	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)N(C)CCC2CCOCC2)C1	ZINC000246542249	402536037	/nfs/dbraw/zinc/53/60/37/402536037.db2.gz	LWPTYRSUHDAUMH-GOEBONIOSA-N	0	3	311.470	2.173	10	0		DEAEHN
CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)NC[C@@](C)(O)CN(C)C)cc1	ZINC000246637485	402539071	/nfs/dbraw/zinc/53/90/71/402539071.db2.gz	RXNIXUDIDGNLGW-JENIJYKNSA-N	0	3	318.461	2.342	10	0		DEAEHN
OC[C@H]1C[C@@H](O)CN1CCCSc1ccccc1Cl	ZINC000179180600	402578959	/nfs/dbraw/zinc/57/89/59/402578959.db2.gz	CHCSVLDOXPOPIZ-VXGBXAGGSA-N	0	3	301.839	2.250	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CC[C@@H](C)[C@H](C)C1	ZINC000248581821	402597674	/nfs/dbraw/zinc/59/76/74/402597674.db2.gz	OWPZBEASMDLZDI-KLHDSHLOSA-N	0	3	311.470	2.221	10	0		DEAEHN
CC(C)=CCC[C@@H](C)CCN1CC[C@@H](NS(C)(=O)=O)C1	ZINC000248648490	402601101	/nfs/dbraw/zinc/60/11/01/402601101.db2.gz	JTTMHOXHQCGRHH-HUUCEWRRSA-N	0	3	302.484	2.383	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@H]1CCN(Cc2ccnn2C)C1	ZINC000190458945	402602134	/nfs/dbraw/zinc/60/21/34/402602134.db2.gz	LGJQRXSLFVQDCG-CQSZACIVSA-N	0	3	319.478	2.139	10	0		DEAEHN
O=C(CCN1CCC[C@@H](n2cncn2)C1)Nc1ccc(F)cc1	ZINC000171619368	402602253	/nfs/dbraw/zinc/60/22/53/402602253.db2.gz	ZVWOHGDWAPENKY-OAHLLOKOSA-N	0	3	317.368	2.083	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@H]1CCN(Cc2cnn(C)c2)C1	ZINC000190462559	402603034	/nfs/dbraw/zinc/60/30/34/402603034.db2.gz	OBODJKBCSQVZMN-CQSZACIVSA-N	0	3	319.478	2.139	10	0		DEAEHN
COCCCN1CCC(Nc2nccnc2OC(C)C)CC1	ZINC000180028365	402605761	/nfs/dbraw/zinc/60/57/61/402605761.db2.gz	UFDNJSBURVULIL-UHFFFAOYSA-N	0	3	308.426	2.177	10	0		DEAEHN
Cc1cc(C)c(CC(=O)NC[C@H](O)CN2CCCCC2)c(C)c1	ZINC000180425238	402616397	/nfs/dbraw/zinc/61/63/97/402616397.db2.gz	WVVMWOYOJRMWMR-KRWDZBQOSA-N	0	3	318.461	2.117	10	0		DEAEHN
CCC(CC)n1nc(C(=O)N2CCN3CCC[C@@H]3C2)cc1C	ZINC000180449141	402616628	/nfs/dbraw/zinc/61/66/28/402616628.db2.gz	HYHRWFUEICRHGC-OAHLLOKOSA-N	0	3	304.438	2.473	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)[C@H]1C[C@@H](C(C)=O)C1(C)C	ZINC000249092470	402620239	/nfs/dbraw/zinc/62/02/39/402620239.db2.gz	WNXYTNDKKBEJSD-YHUYYLMFSA-N	0	3	306.450	2.323	10	0		DEAEHN
Cc1nn(C)cc1[C@H](C)N[C@@H]1CCc2nc(C(C)C)nn2C1	ZINC000180636756	402621784	/nfs/dbraw/zinc/62/17/84/402621784.db2.gz	LQJXCWCDELLZMY-WCQYABFASA-N	0	3	302.426	2.109	10	0		DEAEHN
CO[C@@H]1CN(Cc2cn(C)nc2-c2cccnc2)CC[C@H]1C	ZINC000249195729	402623107	/nfs/dbraw/zinc/62/31/07/402623107.db2.gz	QCIKNQVDNLBTKY-CZUORRHYSA-N	0	3	300.406	2.339	10	0		DEAEHN
CCOc1ncc(C(=O)N2CCN3CCC[C@@H]3C2)cc1Cl	ZINC000171804615	402623488	/nfs/dbraw/zinc/62/34/88/402623488.db2.gz	HCQIBLAITOJIPR-GFCCVEGCSA-N	0	3	309.797	2.054	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1C	ZINC000249264892	402624395	/nfs/dbraw/zinc/62/43/95/402624395.db2.gz	ZJMNGZFKOCQOBA-DZGCQCFKSA-N	0	3	317.433	2.183	10	0		DEAEHN
Cc1cc(CCNC(=O)N2CCC[C@H](N(C)C)C2)cc(C)c1O	ZINC000190919967	402631778	/nfs/dbraw/zinc/63/17/78/402631778.db2.gz	XNAAVOYWGUSBHH-INIZCTEOSA-N	0	3	319.449	2.287	10	0		DEAEHN
Cc1cc(OCCN2CCN(CCO)[C@@H](C)C2)ccc1C(C)C	ZINC000249557282	402634839	/nfs/dbraw/zinc/63/48/39/402634839.db2.gz	KGOTWBZIWXGWCJ-KRWDZBQOSA-N	0	3	320.477	2.496	10	0		DEAEHN
CC[C@H](CNC(=O)N1CCO[C@H](CN(C)C)C1)c1ccccc1	ZINC000172116837	402640749	/nfs/dbraw/zinc/64/07/49/402640749.db2.gz	QHMAVLMIYYZMDA-NVXWUHKLSA-N	0	3	319.449	2.152	10	0		DEAEHN
CCOc1ccc(OC[C@H](O)CN2[C@@H](C)CC(O)C[C@@H]2C)cc1	ZINC000191177325	402648653	/nfs/dbraw/zinc/64/86/53/402648653.db2.gz	LHPBWDWTPLPOEK-OFQRWUPVSA-N	0	3	323.433	2.059	10	0		DEAEHN
CN1CC[C@H](NC(=O)NO[C@H]2CCCCO2)[C@@H]1c1ccccc1	ZINC000251890552	402650647	/nfs/dbraw/zinc/65/06/47/402650647.db2.gz	WXWKPQNWPFCZEB-JYJNAYRXSA-N	0	3	319.405	2.189	10	0		DEAEHN
CCOCCN1CCN(Cc2ccc(CO)cc2)C[C@@H]1CC	ZINC000182752013	402714140	/nfs/dbraw/zinc/71/41/40/402714140.db2.gz	LGVDTJJKKOJYHM-SFHVURJKSA-N	0	3	306.450	2.112	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NCC[C@@H]1CCCCO1	ZINC000182807367	402718243	/nfs/dbraw/zinc/71/82/43/402718243.db2.gz	QLUAGNQHRRCPMC-HNNXBMFYSA-N	0	3	320.433	2.316	10	0		DEAEHN
COc1cc2c(cc1CNCC[C@H](C)[S@](C)=O)O[C@H](C)C2	ZINC000252711296	402660820	/nfs/dbraw/zinc/66/08/20/402660820.db2.gz	JEBUFYQRDAUQBC-IDFMNXDXSA-N	0	3	311.447	2.265	10	0		DEAEHN
CC(C)[C@@H](C)CNC(=O)C(=O)Nc1cccc(CN(C)C)c1	ZINC000172531225	402661091	/nfs/dbraw/zinc/66/10/91/402661091.db2.gz	ZYLKKSGDOJCQMF-ZDUSSCGKSA-N	0	3	305.422	2.095	10	0		DEAEHN
C[C@H]1CN(CC2CCN(C(=O)C3=CCCCO3)CC2)C[C@H](C)O1	ZINC000172747565	402673093	/nfs/dbraw/zinc/67/30/93/402673093.db2.gz	NIJKIFCHXBOMFW-GJZGRUSLSA-N	0	3	322.449	2.029	10	0		DEAEHN
CC(C)[C@H](NCCNC(=O)c1ccn[nH]1)c1ccc(F)c(F)c1	ZINC000182224095	402673923	/nfs/dbraw/zinc/67/39/23/402673923.db2.gz	WAMPRLDDZFZYCV-HNNXBMFYSA-N	0	3	322.359	2.405	10	0		DEAEHN
O[C@@H](CSC[C@@H]1CCCO1)CN1CCc2ccccc2C1	ZINC000191610521	402681391	/nfs/dbraw/zinc/68/13/91/402681391.db2.gz	JVMBSFIJODCBAX-SJORKVTESA-N	0	3	307.459	2.318	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NC[C@@H](c2ccco2)N(C)C)CCN1C	ZINC000173355420	402693931	/nfs/dbraw/zinc/69/39/31/402693931.db2.gz	BWXKWESOHQCYLS-ILXRZTDVSA-N	0	3	322.453	2.006	10	0		DEAEHN
COC[C@H](C)C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000173518908	402700533	/nfs/dbraw/zinc/70/05/33/402700533.db2.gz	SZKPJXIMQXXGJR-HOTGVXAUSA-N	0	3	304.434	2.392	10	0		DEAEHN
COc1cccc(CNC(=O)CN(C(C)C)C2CCOCC2)c1	ZINC000173517610	402700699	/nfs/dbraw/zinc/70/06/99/402700699.db2.gz	GNXGFSMXEPQCRW-UHFFFAOYSA-N	0	3	320.433	2.201	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(N)=O)CN1CCOc1ccc(Cl)c(F)c1	ZINC000191993009	402703107	/nfs/dbraw/zinc/70/31/07/402703107.db2.gz	VSITUUYQNBIKEP-GHMZBOCLSA-N	0	3	314.788	2.444	10	0		DEAEHN
C[C@@H]1CCC[C@H](NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)[C@H]1C	ZINC000262534882	402726841	/nfs/dbraw/zinc/72/68/41/402726841.db2.gz	QFDVHGYPMUONGC-BLDBCPBVSA-N	0	3	308.466	2.460	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1CNC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C	ZINC000262579232	402727088	/nfs/dbraw/zinc/72/70/88/402727088.db2.gz	YQKXFFZVOJJTRG-VPKNTQAGSA-N	0	3	308.466	2.461	10	0		DEAEHN
CC(C)NC(=O)CCN[C@H](C)c1cccc(-n2cccn2)c1	ZINC000183599853	402780657	/nfs/dbraw/zinc/78/06/57/402780657.db2.gz	ZHSQSURQUPKSKH-CQSZACIVSA-N	0	3	300.406	2.438	10	0		DEAEHN
OCc1ccc(CNCCc2csc(N3CCCC3)n2)o1	ZINC000174406703	402739435	/nfs/dbraw/zinc/73/94/35/402739435.db2.gz	VYVKZJNYPHXQFW-UHFFFAOYSA-N	0	3	307.419	2.161	10	0		DEAEHN
C[C@H](Cc1nc([C@H]2CNCCN2C)no1)c1ccccc1F	ZINC000263247483	402750080	/nfs/dbraw/zinc/75/00/80/402750080.db2.gz	PLSZMYOYGYYKIK-BXUZGUMPSA-N	0	3	304.369	2.131	10	0		DEAEHN
CN1CCNC[C@H]1c1noc([C@]2(C)CCCc3ccccc32)n1	ZINC000263250913	402750720	/nfs/dbraw/zinc/75/07/20/402750720.db2.gz	PWFNIGLJPVNYIY-MAUKXSAKSA-N	0	3	312.417	2.288	10	0		DEAEHN
CS[C@@H](c1nc([C@@H]2CNCCN2C)no1)c1ccccc1	ZINC000263275995	402753209	/nfs/dbraw/zinc/75/32/09/402753209.db2.gz	SWFIFPHKCLURES-QWHCGFSZSA-N	0	3	304.419	2.098	10	0		DEAEHN
COc1cc(C[NH2+]CCCCCO)cc(Br)c1[O-]	ZINC000192900610	402755883	/nfs/dbraw/zinc/75/58/83/402755883.db2.gz	HJOZNNKEPWUPPR-UHFFFAOYSA-N	0	3	318.211	2.416	10	0		DEAEHN
COC(=O)COc1ccccc1[C@H](C)N[C@H](C)[C@@H]1CCCO1	ZINC000183348825	402759292	/nfs/dbraw/zinc/75/92/92/402759292.db2.gz	MIOUSEQAXQBDJC-GUTXKFCHSA-N	0	3	307.390	2.457	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NC(=O)N2CC[C@H](N(C)C)C2)C12CCCCC2	ZINC000177621940	286263172	/nfs/dbraw/zinc/26/31/72/286263172.db2.gz	GWONHEWGXRSZRZ-ARFHVFGLSA-N	0	3	323.481	2.460	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cccc(N(C)C(C)=O)c2)C1	ZINC000174949034	402765471	/nfs/dbraw/zinc/76/54/71/402765471.db2.gz	SKKGZFDQBMCPML-HNNXBMFYSA-N	0	3	318.421	2.275	10	0		DEAEHN
CN(CC(=O)NCCN1CCc2ccccc21)C1CCCC1	ZINC000193715198	402775764	/nfs/dbraw/zinc/77/57/64/402775764.db2.gz	HJISEQHIHLBDAB-UHFFFAOYSA-N	0	3	301.434	2.040	10	0		DEAEHN
CC(C)OC(=O)C[C@@H]1CCCN(C[C@H](O)COC(C)(C)C)C1	ZINC000184452514	402844682	/nfs/dbraw/zinc/84/46/82/402844682.db2.gz	OCIWVUGEKBDIQV-GJZGRUSLSA-N	0	3	315.454	2.216	10	0		DEAEHN
COc1ccc(CCCC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000194524402	402801559	/nfs/dbraw/zinc/80/15/59/402801559.db2.gz	ALTQFNZXSSJVBE-MRXNPFEDSA-N	0	3	302.418	2.325	10	0		DEAEHN
C[C@H](NC(=O)NC[C@H](O)CN1CCCCC1)C1CCCCC1	ZINC000175414614	402804716	/nfs/dbraw/zinc/80/47/16/402804716.db2.gz	IDPXQAJHNVOGSO-HOCLYGCPSA-N	0	3	311.470	2.101	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccc(NC(=O)OC)cc2)C1	ZINC000194653360	402808001	/nfs/dbraw/zinc/80/80/01/402808001.db2.gz	WNSLHZKFLIRXMP-AWEZNQCLSA-N	0	3	305.378	2.079	10	0		DEAEHN
Cc1nc(C(F)(F)F)ccc1C(=O)NC[C@@H]1CCCN1C	ZINC000194705726	402811720	/nfs/dbraw/zinc/81/17/20/402811720.db2.gz	YHDIUWRUWLLKLU-JTQLQIEISA-N	0	3	301.312	2.233	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)CCc1cnn(-c2ccccc2)c1	ZINC000194721932	402812509	/nfs/dbraw/zinc/81/25/09/402812509.db2.gz	ZUQLREJHQNKVCI-KRWDZBQOSA-N	0	3	312.417	2.015	10	0		DEAEHN
Cc1ccc(CC(=O)NC(C)(C)CCN2CCN(C)CC2)s1	ZINC000184196353	402825924	/nfs/dbraw/zinc/82/59/24/402825924.db2.gz	VNCGGTLGVQCJNE-UHFFFAOYSA-N	0	3	323.506	2.131	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N[C@H]1COc2ccccc21	ZINC000195196828	402835710	/nfs/dbraw/zinc/83/57/10/402835710.db2.gz	NHBLXJNNXHHRDE-HIFRSBDPSA-N	0	3	305.422	2.396	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1NC(=O)CN1CCC(c2ccn[nH]2)CC1	ZINC000195506646	402848014	/nfs/dbraw/zinc/84/80/14/402848014.db2.gz	QBIJTPLEIUJUJX-UKRRQHHQSA-N	0	3	304.438	2.284	10	0		DEAEHN
COc1cccc(/C(C)=C/C(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000176014105	402848428	/nfs/dbraw/zinc/84/84/28/402848428.db2.gz	WGNIEHLBXQDBNM-UKYUDJEDSA-N	0	3	300.402	2.405	10	0		DEAEHN
CCN(CC)C(=O)[C@@H](C)N1CC[C@H](CNc2ccccn2)C1	ZINC000195515907	402848745	/nfs/dbraw/zinc/84/87/45/402848745.db2.gz	SIVTTZCUNSJKGQ-HUUCEWRRSA-N	0	3	304.438	2.072	10	0		DEAEHN
CCCCn1cc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c(C)n1	ZINC000184524950	402848889	/nfs/dbraw/zinc/84/88/89/402848889.db2.gz	MPKLHNZKYIKBON-ZFWWWQNUSA-N	0	3	304.438	2.300	10	0		DEAEHN
CCOC(=O)C1(O)CCN(c2cc(C)nc3ccccc32)CC1	ZINC000266681561	402983560	/nfs/dbraw/zinc/98/35/60/402983560.db2.gz	ASBZCUGOODHCAP-UHFFFAOYSA-N	0	3	314.385	2.438	10	0		DEAEHN
CCN(CCO)CCNc1ncnc2c3ccccc3oc21	ZINC000274375502	403049398	/nfs/dbraw/zinc/04/93/98/403049398.db2.gz	HPUNBBKQEZLKAE-UHFFFAOYSA-N	0	3	300.362	2.102	10	0		DEAEHN
COCCCC(=O)N1CCC[C@@H](N(C)Cc2ccccn2)CC1	ZINC000276018011	403139743	/nfs/dbraw/zinc/13/97/43/403139743.db2.gz	QNXHGOXPNREAKG-QGZVFWFLSA-N	0	3	319.449	2.321	10	0		DEAEHN
c1c(CNCCCOCCc2ccccc2)nc2ncccn12	ZINC000298242641	403340100	/nfs/dbraw/zinc/34/01/00/403340100.db2.gz	CLTUMOZSRFMKJK-UHFFFAOYSA-N	0	3	310.401	2.468	10	0		DEAEHN
C[C@H](NC(=O)c1snnc1C(C)(C)C)C1=CCN(C)CC1	ZINC000333291716	403717415	/nfs/dbraw/zinc/71/74/15/403717415.db2.gz	KRCSBVPNHMAIKB-JTQLQIEISA-N	0	3	308.451	2.216	10	0		DEAEHN
N[C@@H](CC[NH3+])c1cc(Br)c([O-])c(Br)c1	ZINC000307471517	403952968	/nfs/dbraw/zinc/95/29/68/403952968.db2.gz	RKRHDQSNBPIZPB-QMMMGPOBSA-N	0	3	324.016	2.266	10	0		DEAEHN
COC(=O)C1(N(C)C(=O)CC2CCN(C)CC2)CCCCC1	ZINC000362956741	404024364	/nfs/dbraw/zinc/02/43/64/404024364.db2.gz	CQEBYEWTAWWPFU-UHFFFAOYSA-N	0	3	310.438	2.053	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(C[C@@H](O)CCOC(C)C)CC2	ZINC000349885749	404244444	/nfs/dbraw/zinc/24/44/44/404244444.db2.gz	SVYZGSFUCMXIRD-IBGZPJMESA-N	0	3	319.445	2.466	10	0		DEAEHN
Cn1nccc1[C@@H]1CCC[C@@H](NCc2nnc3ccccn32)C1	ZINC000363923431	404253681	/nfs/dbraw/zinc/25/36/81/404253681.db2.gz	GUKAJKACEGJKLP-ZIAGYGMSSA-N	0	3	310.405	2.279	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)nc1	ZINC000297122272	404459786	/nfs/dbraw/zinc/45/97/86/404459786.db2.gz	IGIQFMVHQVLQAS-FZMZJTMJSA-N	0	3	304.394	2.231	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(CC[C@@H]1CCOC1=O)CC2	ZINC000374329579	404704781	/nfs/dbraw/zinc/70/47/81/404704781.db2.gz	MAOTXIJLDCPWBS-OAHLLOKOSA-N	0	3	301.386	2.243	10	0		DEAEHN
C/C(=C\c1ccccc1)CNC[C@H]1CCCCN1S(C)(=O)=O	ZINC000353089471	404740293	/nfs/dbraw/zinc/74/02/93/404740293.db2.gz	MRRSPJSEVINTPA-OKACTXMXSA-N	0	3	322.474	2.494	10	0		DEAEHN
C[C@H]1[C@H](C)N(C(=O)c2cccc(CN3CCCC3)c2)CCN1C	ZINC000356886074	404716923	/nfs/dbraw/zinc/71/69/23/404716923.db2.gz	SRBCWNQXDMNFPR-HOTGVXAUSA-N	0	3	315.461	2.447	10	0		DEAEHN
CCOC(=O)[C@@H]1CN([C@@H](C)c2cccc(F)c2)CC12COC2	ZINC000451140295	404877608	/nfs/dbraw/zinc/87/76/08/404877608.db2.gz	TYTWANYZECUOLW-WFASDCNBSA-N	0	3	307.365	2.398	10	0		DEAEHN
COCCOC[C@H]1CCN(Cc2ccc(-c3cc[nH]n3)o2)C1	ZINC000435135387	404959896	/nfs/dbraw/zinc/95/98/96/404959896.db2.gz	PBQMCAFEZAPGHZ-ZDUSSCGKSA-N	0	3	305.378	2.155	10	0		DEAEHN
c1cn(-c2ccccc2)nc1CN[C@H]1CCO[C@@]2(CCOC2)C1	ZINC000367365678	405025502	/nfs/dbraw/zinc/02/55/02/405025502.db2.gz	QOHHAWVUGWNDFX-YJBOKZPZSA-N	0	3	313.401	2.300	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)c2ncccc2N)CCN1Cc1ccccc1	ZINC000379661925	405027166	/nfs/dbraw/zinc/02/71/66/405027166.db2.gz	GTWMMXJMZUKTCP-HOCLYGCPSA-N	0	3	324.428	2.447	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ncccc1N	ZINC000382754553	405031941	/nfs/dbraw/zinc/03/19/41/405031941.db2.gz	GERLISVONLSCAM-HNNXBMFYSA-N	0	3	324.428	2.400	10	0		DEAEHN
CCCN1CC[C@@H](NC(=O)c2nscc2Br)C1	ZINC000404868436	405069206	/nfs/dbraw/zinc/06/92/06/405069206.db2.gz	XCYJIMOXIKEKNU-MRVPVSSYSA-N	0	3	318.240	2.120	10	0		DEAEHN
CCN1CCN(CC2(O)CCC(C)CC2)C[C@@H]1c1ncc[nH]1	ZINC000408280418	405161643	/nfs/dbraw/zinc/16/16/43/405161643.db2.gz	HLUGFUMOTGUGQD-ISXOHVOVSA-N	0	3	306.454	2.030	10	0		DEAEHN
Cc1ccc(-c2cc(C(=O)N3CCN(C)C[C@H]3C)n[nH]2)c(C)c1	ZINC000408368554	405187698	/nfs/dbraw/zinc/18/76/98/405187698.db2.gz	JXDYEUACCRWNOM-CQSZACIVSA-N	0	3	312.417	2.470	10	0		DEAEHN
CC(=O)N1CCC(NC(=O)CN(C(C)C)C2CC(C)(C)C2)CC1	ZINC000452107510	405172549	/nfs/dbraw/zinc/17/25/49/405172549.db2.gz	SWUPXSUVWNKHFT-UHFFFAOYSA-N	0	3	323.481	2.013	10	0		DEAEHN
Cc1ccc(F)c(NC(=O)N[C@@H](CO)CN2CCCCC2)c1	ZINC000454304160	405325015	/nfs/dbraw/zinc/32/50/15/405325015.db2.gz	QXPFOMVIKZSTDA-CYBMUJFWSA-N	0	3	309.385	2.102	10	0		DEAEHN
CC=CC[C@H]1NC(=O)N(c2cccc(OCCN(C)C)c2)C1=O	ZINC000445912729	405362655	/nfs/dbraw/zinc/36/26/55/405362655.db2.gz	KWPBLQJVTRISIH-MBVDDHJVSA-N	0	3	317.389	2.018	10	0		DEAEHN
c1ccc(N2CCN(CCCN3CC[C@@]34CCOC4)CC2)cc1	ZINC000421018698	405431576	/nfs/dbraw/zinc/43/15/76/405431576.db2.gz	LNVSVJSYRHAXDX-IBGZPJMESA-N	0	3	315.461	2.064	10	0		DEAEHN
CCN1C[C@@H](NCc2ccc(C(=O)OC(C)(C)C)cc2)CC1=O	ZINC000449520966	405594663	/nfs/dbraw/zinc/59/46/63/405594663.db2.gz	SYUHYOKWRPRFOB-HNNXBMFYSA-N	0	3	318.417	2.352	10	0		DEAEHN
O=C(NC[C@H]1CCCN1CCCO)NCC1CCCCCC1	ZINC000459030739	405704150	/nfs/dbraw/zinc/70/41/50/405704150.db2.gz	RDTUWAKQOUSAJL-MRXNPFEDSA-N	0	3	311.470	2.103	10	0		DEAEHN
CC(C)n1cc(CN2CCC[C@@H]2[C@H]2COCC[C@]2(C)O)cn1	ZINC000583618801	405775957	/nfs/dbraw/zinc/77/59/57/405775957.db2.gz	NRHGXMNLSYMAAH-ZACQAIPSSA-N	0	3	307.438	2.216	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CC[C@@](C)(C(=O)OC(C)(C)C)C1	ZINC000457277202	405776134	/nfs/dbraw/zinc/77/61/34/405776134.db2.gz	YEDQILPVGMUXCK-KBXCAEBGSA-N	0	3	324.465	2.441	10	0		DEAEHN
C[C@H]1CCCN1C(=O)CCN1CC[C@H](c2nc(C3CC3)no2)C1	ZINC000560367031	405800220	/nfs/dbraw/zinc/80/02/20/405800220.db2.gz	CUYTXZQHWDFPST-JSGCOSHPSA-N	0	3	318.421	2.137	10	0		DEAEHN
C(N[C@@H]1CCCC[C@@H]1[C@H]1CCOC1)c1nnc2n1CCCC2	ZINC000530439934	405803722	/nfs/dbraw/zinc/80/37/22/405803722.db2.gz	RSZFEGZXCXNGAN-RRFJBIMHSA-N	0	3	304.438	2.299	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN1CCC(OCCc2ccccc2)CC1	ZINC000450298773	405823218	/nfs/dbraw/zinc/82/32/18/405823218.db2.gz	NNQHHEJQHBUTEV-SFHVURJKSA-N	0	3	305.418	2.050	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)c1cc(C)cc(C(=O)OC)c1	ZINC000457557872	405895865	/nfs/dbraw/zinc/89/58/65/405895865.db2.gz	NVSPKMSFBDOMOO-MRXNPFEDSA-N	0	3	318.417	2.386	10	0		DEAEHN
CC(=O)N1CCC[C@@H]1c1nc(-c2ccc(CN(C)C)cc2)no1	ZINC000632014184	405955476	/nfs/dbraw/zinc/95/54/76/405955476.db2.gz	DISVEBRWBHORQR-OAHLLOKOSA-N	0	3	314.389	2.482	10	0		DEAEHN
CCN(CCO)CCNC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450950019	405996625	/nfs/dbraw/zinc/99/66/25/405996625.db2.gz	UKGBXQJYDOJXHJ-UHFFFAOYSA-N	0	3	316.445	2.445	10	0		DEAEHN
CO[C@@H](C)[C@@H](C)NC(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000460669490	406080071	/nfs/dbraw/zinc/08/00/71/406080071.db2.gz	FUNAYOQMIFLLKA-VYDXJSESSA-N	0	3	319.449	2.231	10	0		DEAEHN
Cc1csc([C@H](C)NC(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)n1	ZINC000532060544	406039373	/nfs/dbraw/zinc/03/93/73/406039373.db2.gz	JSLFJKQGWFMXAO-XHVZSJERSA-N	0	3	308.451	2.294	10	0		DEAEHN
C[C@]1(C(=O)NCCNc2ccncc2)CCc2ccccc2C1	ZINC000533814686	406163319	/nfs/dbraw/zinc/16/33/19/406163319.db2.gz	GNWRAWCOULTNMJ-IBGZPJMESA-N	0	3	309.413	2.227	10	0		DEAEHN
CO[C@@H](C)[C@@H](C)N[C@@H](C)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000519851333	406263173	/nfs/dbraw/zinc/26/31/73/406263173.db2.gz	PWDRZMBDJWXEDA-WAYRAWBGSA-N	0	3	308.466	2.473	10	0		DEAEHN
c1cc(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)no1	ZINC000546493209	406359180	/nfs/dbraw/zinc/35/91/80/406359180.db2.gz	MOKCNEQIPKXPEJ-CYBMUJFWSA-N	0	3	311.345	2.499	10	0		DEAEHN
C[C@H](NCCCn1ccnn1)c1ccc(Br)cn1	ZINC000570598613	406415474	/nfs/dbraw/zinc/41/54/74/406415474.db2.gz	MHFBRBONEKZLTF-JTQLQIEISA-N	0	3	310.199	2.177	10	0		DEAEHN
Cc1ccsc1CNC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637907395	406473013	/nfs/dbraw/zinc/47/30/13/406473013.db2.gz	LNXIBUVSXUXKQL-HNNXBMFYSA-N	0	3	317.458	2.132	10	0		DEAEHN
c1ccc(N2CC[C@H](CN3CCN(c4cnccn4)CC3)C2)cc1	ZINC000637920239	406478293	/nfs/dbraw/zinc/47/82/93/406478293.db2.gz	QZRDNVSQZGTPBU-QGZVFWFLSA-N	0	3	323.444	2.125	10	0		DEAEHN
CSC[C@@H](O)CN1CCC[C@H](CC(=O)OC(C)(C)C)C1	ZINC000548296161	406498055	/nfs/dbraw/zinc/49/80/55/406498055.db2.gz	WCVJKUZQOXZADF-OLZOCXBDSA-N	0	3	303.468	2.154	10	0		DEAEHN
c1ccc(OCCN2CCN(CCC[C@H]3CCO3)CC2)cc1	ZINC000637867433	406454242	/nfs/dbraw/zinc/45/42/42/406454242.db2.gz	ILQBROIKAPEWNJ-SFHVURJKSA-N	0	3	304.434	2.252	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637874247	406456915	/nfs/dbraw/zinc/45/69/15/406456915.db2.gz	GFALMFXGXDBFEH-PVAVHDDUSA-N	0	3	303.450	2.141	10	0		DEAEHN
C[C@H](O)[C@H](C)NCc1cc(Br)cc2c1OCC2	ZINC000129175292	196025526	/nfs/dbraw/zinc/02/55/26/196025526.db2.gz	BPFQFZKUZBTRSW-IUCAKERBSA-N	0	3	300.196	2.243	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCc3cc(F)ccc3C2)C1	ZINC000129167542	196026216	/nfs/dbraw/zinc/02/62/16/196026216.db2.gz	HJNIMCAMRLUERC-MRXNPFEDSA-N	0	3	305.397	2.378	10	0		DEAEHN
OCCOC1CCN(C[C@H]2Cc3cc(Cl)ccc3O2)CC1	ZINC000129327341	196040341	/nfs/dbraw/zinc/04/03/41/196040341.db2.gz	DLJIAKOVNJMXSH-OAHLLOKOSA-N	0	3	311.809	2.117	10	0		DEAEHN
CN(CC[C@H]1COCCN1)Cc1ccccc1Br	ZINC000129402861	196044467	/nfs/dbraw/zinc/04/44/67/196044467.db2.gz	SLRJYOXSMGLHDX-ZDUSSCGKSA-N	0	3	313.239	2.259	10	0		DEAEHN
Brc1ccc(Cc2ncc3c(n2)CCNC3)cc1	ZINC000131105531	196141052	/nfs/dbraw/zinc/14/10/52/196141052.db2.gz	JRDAQDDJWRGUMQ-UHFFFAOYSA-N	0	3	304.191	2.476	10	0		DEAEHN
CS(=O)(=O)CCC[C@@H](N)c1ccc(Br)c(F)c1	ZINC000131370040	196162971	/nfs/dbraw/zinc/16/29/71/196162971.db2.gz	VUXOOZKSIDHJNS-LLVKDONJSA-N	0	3	324.215	2.413	10	0		DEAEHN
O[C@H](CN[C@H]1CCOC1)COc1c(Cl)cccc1Cl	ZINC000131467158	196171323	/nfs/dbraw/zinc/17/13/23/196171323.db2.gz	FVNCWMJHFAKWAX-VHSXEESVSA-N	0	3	306.189	2.112	10	0		DEAEHN
CN[C@H](Cc1cccc(F)c1F)[C@@H]1CCCCS1(=O)=O	ZINC000131482551	196173942	/nfs/dbraw/zinc/17/39/42/196173942.db2.gz	UKRMGSRYWIVYPU-OLZOCXBDSA-N	0	3	303.374	2.063	10	0		DEAEHN
C[C@@H](CN(C)C)N1C(=O)C2(CCCC2)N[C@@H]1c1ccsc1	ZINC000131648435	196187180	/nfs/dbraw/zinc/18/71/80/196187180.db2.gz	PNPLKTGRLAMIMQ-JSGCOSHPSA-N	0	3	307.463	2.441	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2cc(CN)ccc2Cl)CC[C@@H]1C	ZINC000131763162	196197027	/nfs/dbraw/zinc/19/70/27/196197027.db2.gz	VBGFXUHJGODTNB-QWRGUYRKSA-N	0	3	316.854	2.465	10	0		DEAEHN
CN(C)C[C@H](NC(=O)[C@H]1CCCc2n[nH]cc21)c1ccccc1	ZINC000131937564	196211592	/nfs/dbraw/zinc/21/15/92/196211592.db2.gz	XAPYAXPQEQQBBH-YOEHRIQHSA-N	0	3	312.417	2.249	10	0		DEAEHN
C[C@@H]1CNC[C@H](COCc2cc(Br)ccc2F)O1	ZINC000132595338	196268782	/nfs/dbraw/zinc/26/87/82/196268782.db2.gz	WKEQBAVYNZEVMU-BXKDBHETSA-N	0	3	318.186	2.482	10	0		DEAEHN
C[C@H]1CNC[C@@H](COCc2ccc(Br)cc2F)O1	ZINC000132703767	196277268	/nfs/dbraw/zinc/27/72/68/196277268.db2.gz	OGJDLLQLAPFXAI-CABZTGNLSA-N	0	3	318.186	2.482	10	0		DEAEHN
CCC[C@@](C)(O)c1c(Br)cnn1CCN(C)C	ZINC000132858060	196290522	/nfs/dbraw/zinc/29/05/22/196290522.db2.gz	LWJVQWGTOPHNFD-GFCCVEGCSA-N	0	3	304.232	2.215	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1[C@@](C)(O)C(C)(C)C	ZINC000133028177	196306140	/nfs/dbraw/zinc/30/61/40/196306140.db2.gz	ZPBGJROPOZDING-CYBMUJFWSA-N	0	3	318.259	2.461	10	0		DEAEHN
CCOC(=O)Cc1csc(N(CCN(C)C)CC(C)C)n1	ZINC000133864588	196341211	/nfs/dbraw/zinc/34/12/11/196341211.db2.gz	XLELJLSYYGMZOT-UHFFFAOYSA-N	0	3	313.467	2.273	10	0		DEAEHN
CC[C@H](CCO)NCC(=O)Nc1ccc(Br)cc1	ZINC000134389059	196385220	/nfs/dbraw/zinc/38/52/20/196385220.db2.gz	BIUMHTBTDONMQG-LLVKDONJSA-N	0	3	315.211	2.138	10	0		DEAEHN
CC[C@@H]1CC[C@@H](C)N1S(=O)(=O)c1ccc(F)c(CN)c1	ZINC000136105221	196520276	/nfs/dbraw/zinc/52/02/76/196520276.db2.gz	GOURQADANUINEV-ZYHUDNBSSA-N	0	3	300.399	2.236	10	0		DEAEHN
NC(=O)[C@@H]1CN(Cc2cccc3cc[nH]c32)C[C@H]1C(F)(F)F	ZINC000299743922	229380844	/nfs/dbraw/zinc/38/08/44/229380844.db2.gz	PZLFYQBZKXTMLO-VXGBXAGGSA-N	0	3	311.307	2.264	10	0		DEAEHN
C[C@H]1CN(C(=O)NCCCN(C)Cc2ccccc2)C[C@H](C)O1	ZINC000046889422	424822438	/nfs/dbraw/zinc/82/24/38/424822438.db2.gz	WKYWYTZQTSEGLB-HOTGVXAUSA-N	0	3	319.449	2.327	10	0		DEAEHN
CCCCCCNC(=O)CN1CCC(Cc2nccn2C)CC1	ZINC000105875887	424849531	/nfs/dbraw/zinc/84/95/31/424849531.db2.gz	LZKWQGLSUNQWOC-UHFFFAOYSA-N	0	3	320.481	2.371	10	0		DEAEHN
CN(C)CCOc1ccc(CNC(=O)Cc2ccccc2)cc1	ZINC000193965431	424872007	/nfs/dbraw/zinc/87/20/07/424872007.db2.gz	AFWLUINRPBGHHR-UHFFFAOYSA-N	0	3	312.413	2.486	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)CCc2cc(OC)cc(OC)c2)C1	ZINC000194641275	424877848	/nfs/dbraw/zinc/87/78/48/424877848.db2.gz	ATLKUMUYEOAUJA-HNNXBMFYSA-N	0	3	320.433	2.237	10	0		DEAEHN
Cc1nccn1C[C@@H](C)CNC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000194895980	424879711	/nfs/dbraw/zinc/87/97/11/424879711.db2.gz	WOOIQXBVEDEXDO-GOEBONIOSA-N	0	3	323.485	2.103	10	0		DEAEHN
O=C(COc1ccc(F)c(Cl)c1)N1CCN2CCC[C@H]2C1	ZINC000195328492	424881966	/nfs/dbraw/zinc/88/19/66/424881966.db2.gz	VANWNKUXSJQLDP-NSHDSACASA-N	0	3	312.772	2.165	10	0		DEAEHN
O[C@]1(CCNCc2csc(Br)c2)CCOC1	ZINC000404178886	424925514	/nfs/dbraw/zinc/92/55/14/424925514.db2.gz	AUUNBJLGDCVDFC-LLVKDONJSA-N	0	3	306.225	2.142	10	0		DEAEHN
CC[C@@H]1COC(C)(C)CN1C[C@@H](O)COCc1ccccc1	ZINC000403898835	424925625	/nfs/dbraw/zinc/92/56/25/424925625.db2.gz	YZDUCJXPXAINAW-IAGOWNOFSA-N	0	3	307.434	2.454	10	0		DEAEHN
CCCC(=O)N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC000404139314	424925645	/nfs/dbraw/zinc/92/56/45/424925645.db2.gz	GMJGGIWWEMKKGY-IAGOWNOFSA-N	0	3	302.418	2.288	10	0		DEAEHN
CN(C)CC1(NC(=O)c2nscc2Br)CCC1	ZINC000404975482	424930838	/nfs/dbraw/zinc/93/08/38/424930838.db2.gz	AYJVSKKUFWYBDH-UHFFFAOYSA-N	0	3	318.240	2.120	10	0		DEAEHN
CCCNC(=O)N1CCCCC[C@@H]1CN1CCC(OC)CC1	ZINC000257194664	424888805	/nfs/dbraw/zinc/88/88/05/424888805.db2.gz	UMKSCUUNVNZYQB-OAHLLOKOSA-N	0	3	311.470	2.461	10	0		DEAEHN
CC1CCC(N2CCN(C(=O)[C@@H]3CCOC[C@@H]3C)CC2)CC1	ZINC000194374713	267784843	/nfs/dbraw/zinc/78/48/43/267784843.db2.gz	FXDQHVKOZDJHNW-ODZFXCKXSA-N	0	3	308.466	2.382	10	0		DEAEHN
CN(C(=O)[C@H]1CSc2ccccc21)[C@@H](CN)C(F)(F)F	ZINC000662980401	425771904	/nfs/dbraw/zinc/77/19/04/425771904.db2.gz	GXNNBLHPRQDXJU-ONGXEEELSA-N	0	3	304.337	2.224	10	0		DEAEHN
c1c(CNCCc2cnc(C3CC3)nc2)[nH]nc1-c1cccnc1	ZINC000359979155	269045626	/nfs/dbraw/zinc/04/56/26/269045626.db2.gz	QNCVBBIOQHVKBW-UHFFFAOYSA-N	0	3	320.400	2.471	10	0		DEAEHN
CC(C)[C@H]1CC[C@H](C(=O)N2CCN(CCN(C)C)CC2)CC1	ZINC000509668784	269319200	/nfs/dbraw/zinc/31/92/00/269319200.db2.gz	RPPZZLXIPHWLLX-QAQDUYKDSA-N	0	3	309.498	2.155	10	0		DEAEHN
CC(C)N1CCC(NC(=O)c2snnc2C(C)(C)C)CC1	ZINC000188913609	273529202	/nfs/dbraw/zinc/52/92/02/273529202.db2.gz	WSJUKIDIMRMXHP-UHFFFAOYSA-N	0	3	310.467	2.438	10	0		DEAEHN
CC(C)[C@H]1OCCC[C@@H]1CNC(=O)N1CCCN(C2CC2)CC1	ZINC000176826269	276035693	/nfs/dbraw/zinc/03/56/93/276035693.db2.gz	KGDDPTIHJGWYQV-NVXWUHKLSA-N	0	3	323.481	2.317	10	0		DEAEHN
CCN(CC)C(=O)[C@H](c1ccccc1)N1CCN2CCC[C@H]2C1	ZINC000246258010	276320040	/nfs/dbraw/zinc/32/00/40/276320040.db2.gz	FYHIYKZILKTDDY-ROUUACIJSA-N	0	3	315.461	2.376	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H]2CCCC23CCOCC3)C1	ZINC000332702898	276369047	/nfs/dbraw/zinc/36/90/47/276369047.db2.gz	UDHGLTBZRNPWDR-CABCVRRESA-N	0	3	309.454	2.119	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)Nc1nc2ccccn2n1)c1ccccc1	ZINC000184408657	276764574	/nfs/dbraw/zinc/76/45/74/276764574.db2.gz	QZBXDMVUHJMMJC-CQSZACIVSA-N	0	3	324.388	2.154	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)[C@@H]1CCCN1Cc1ccc(F)cc1	ZINC000176299239	277080969	/nfs/dbraw/zinc/08/09/69/277080969.db2.gz	KYGLEOQQXCDICV-IRXDYDNUSA-N	0	3	319.424	2.001	10	0		DEAEHN
CC(C)(C)c1nnc(CN[C@@H]2CCC[C@H]2[C@@H]2COCCN2)s1	ZINC000261978212	277278642	/nfs/dbraw/zinc/27/86/42/277278642.db2.gz	RIXIQTGFXKHCCW-UPJWGTAASA-N	0	3	324.494	2.082	10	0		DEAEHN
COc1ccc2c(c1)CCC[C@H]2NC1CCS(=O)(=O)CC1	ZINC000036331460	277951108	/nfs/dbraw/zinc/95/11/08/277951108.db2.gz	VQPBATSWOFPXKW-MRXNPFEDSA-N	0	3	309.431	2.239	10	0		DEAEHN
COc1ccccc1CN(CCO)C[C@@H](O)C1CCCCC1	ZINC000190512013	278049071	/nfs/dbraw/zinc/04/90/71/278049071.db2.gz	KVEHXHVOTSRKCG-QGZVFWFLSA-N	0	3	307.434	2.431	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@@H]2CNCCC2(F)F)c2ccccc2C1	ZINC000423481290	278056891	/nfs/dbraw/zinc/05/68/91/278056891.db2.gz	NZELBEIEUOTMPC-JKSUJKDBSA-N	0	3	323.387	2.067	10	0		DEAEHN
CC(C)n1ccnc1CN1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000161864636	278134865	/nfs/dbraw/zinc/13/48/65/278134865.db2.gz	QQRPTHWXLFAURN-KRWDZBQOSA-N	0	3	319.497	2.066	10	0		DEAEHN
C[C@@H]1CCC[C@H](NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)[C@H]1C	ZINC000262534887	278521486	/nfs/dbraw/zinc/52/14/86/278521486.db2.gz	QFDVHGYPMUONGC-GDVJQSGWSA-N	0	3	308.466	2.460	10	0		DEAEHN
C[C@@H]1CN(C(=O)[C@H](N)C2CCOCC2)CC[C@@H]1c1ccccc1	ZINC000261762031	278674104	/nfs/dbraw/zinc/67/41/04/278674104.db2.gz	LUGUTOBYTDINEZ-FHLIZLRMSA-N	0	3	316.445	2.393	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1nc2cccnc2s1	ZINC000193885183	278974619	/nfs/dbraw/zinc/97/46/19/278974619.db2.gz	PMIZBHZTJZLUBB-NSHDSACASA-N	0	3	306.435	2.397	10	0		DEAEHN
CC[C@@H](C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1)N(C)C	ZINC000154842081	280078372	/nfs/dbraw/zinc/07/83/72/280078372.db2.gz	KRGZTAWFVDPKHH-PKOBYXMFSA-N	0	3	317.477	2.498	10	0		DEAEHN
Cc1cccc(C(C)C)c1NC(=O)NC[C@]1(O)CCN(C)C1	ZINC000358433523	281200099	/nfs/dbraw/zinc/20/00/99/281200099.db2.gz	HYIBEVMYTRKCBY-QGZVFWFLSA-N	0	3	305.422	2.307	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NC[C@@H]1CCCS1)c1ccccc1	ZINC000162889956	289188726	/nfs/dbraw/zinc/18/87/26/289188726.db2.gz	PAVHZTSGGICWRQ-LSDHHAIUSA-N	0	3	307.463	2.484	10	0		DEAEHN
Cc1nc([C@@H](C)N2CC[C@@H](n3cnc4c3CCCC4)C2)n[nH]1	ZINC000408466854	293358456	/nfs/dbraw/zinc/35/84/56/293358456.db2.gz	MRAHYLFGMNWVFL-DGCLKSJQSA-N	0	3	300.410	2.196	10	0		DEAEHN
COc1cccc(CN(CCN(C)C)C(=O)[C@@H]2CC[C@H](C)O2)c1	ZINC000191954678	295295693	/nfs/dbraw/zinc/29/56/93/295295693.db2.gz	QDECZRFCXFFWHL-YOEHRIQHSA-N	0	3	320.433	2.153	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C	ZINC000261910870	302098569	/nfs/dbraw/zinc/09/85/69/302098569.db2.gz	QEUHSYJGUZOUQU-TXPKVOOTSA-N	0	3	316.445	2.486	10	0		DEAEHN
O=C(NC[C@H]1CCCCN1C1CC1)NC1(CCO)CCCCC1	ZINC000576651503	326309313	/nfs/dbraw/zinc/30/93/13/326309313.db2.gz	MSRPNYSSSINQDY-MRXNPFEDSA-N	0	3	323.481	2.388	10	0		DEAEHN
CC[C@H]1CN(c2nc3c(cccc3F)o2)CCN1C[C@H](C)O	ZINC000577445702	326365999	/nfs/dbraw/zinc/36/59/99/326365999.db2.gz	HEJNXLRFERBCLP-RYUDHWBXSA-N	0	3	307.369	2.248	10	0		DEAEHN
CCN(CC(=O)Nc1ccc2c(c1)OCCO2)C[C@@H](C)COC	ZINC000189544932	333103147	/nfs/dbraw/zinc/10/31/47/333103147.db2.gz	YTPUYUWYRBJHND-CYBMUJFWSA-N	0	3	322.405	2.001	10	0		DEAEHN
O=C(NCCOCC1CCC1)N1CCN(C2CCCCC2)CC1	ZINC000583667682	336284772	/nfs/dbraw/zinc/28/47/72/336284772.db2.gz	LAGYGOMROLJKRO-UHFFFAOYSA-N	0	3	323.481	2.463	10	0		DEAEHN
CC(=O)c1cnc(NC(=O)[C@H]2CNCc3ccccc32)s1	ZINC000583260242	337291168	/nfs/dbraw/zinc/29/11/68/337291168.db2.gz	LGSCRTYXUQUFRH-LBPRGKRZSA-N	0	3	301.371	2.171	10	0		DEAEHN
C/C=C/C=C/COC[C@H](O)CNCCOc1ccccc1OC	ZINC000584627798	337376220	/nfs/dbraw/zinc/37/62/20/337376220.db2.gz	CWVMUVPLVDOCNW-XYWKEYTNSA-N	0	3	321.417	2.173	10	0		DEAEHN
COc1cc(CN(C)CCCO)ccc1OCC(F)(F)F	ZINC000442958969	533780375	/nfs/dbraw/zinc/78/03/75/533780375.db2.gz	DGHIWKOPAFAVGU-UHFFFAOYSA-N	0	3	307.312	2.451	10	0		DEAEHN
Cc1c([C@H]2[C@H](NC/C=C\c3ccccc3)CC(=O)N2C)cnn1C	ZINC000427981572	533959724	/nfs/dbraw/zinc/95/97/24/533959724.db2.gz	OYLNQOIZPZQSGE-YXGRLTDGSA-N	0	3	324.428	2.303	10	0		DEAEHN
COC(=O)c1ccc(NCCN2CCC[C@H](C)C2)nc1OC	ZINC000302326137	534224226	/nfs/dbraw/zinc/22/42/26/534224226.db2.gz	SLMCKNCIIKNQRU-LBPRGKRZSA-N	0	3	307.394	2.021	10	0		DEAEHN
COC(=O)c1ccccc1OCCN1[C@@H](C)CC(O)C[C@@H]1C	ZINC000191153781	534294206	/nfs/dbraw/zinc/29/42/06/534294206.db2.gz	BUYZTFIBOCJVIZ-STQMWFEESA-N	0	3	307.390	2.086	10	0		DEAEHN
C1CCN([C@H]2CCCN(c3nnc(C4CCOCC4)s3)C2)C1	ZINC000338652588	518580258	/nfs/dbraw/zinc/58/02/58/518580258.db2.gz	RKCCAEDDXTXYNC-AWEZNQCLSA-N	0	3	322.478	2.497	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2ccc(-c3cc[nH]n3)o2)[C@]12CCCO2	ZINC000366009232	520428420	/nfs/dbraw/zinc/42/84/20/520428420.db2.gz	LIVVYKSLSAEDSQ-GVDBMIGSSA-N	0	3	317.389	2.486	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@](C)(O)[C@H](C)c2ccccc2)C1	ZINC000245416735	521647046	/nfs/dbraw/zinc/64/70/46/521647046.db2.gz	IRTSBQYLCAWBGW-UWWQBHOKSA-N	0	3	304.434	2.142	10	0		DEAEHN
CN(C)Cc1cccc(CNC(=O)c2cnn3c2CCCC3)c1	ZINC000126930434	521922559	/nfs/dbraw/zinc/92/25/59/521922559.db2.gz	PZAGXQJNXPKNEX-UHFFFAOYSA-N	0	3	312.417	2.211	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000170865899	522102113	/nfs/dbraw/zinc/10/21/13/522102113.db2.gz	YREOBAACAGPNSY-LBPRGKRZSA-N	0	3	316.323	2.290	10	0		DEAEHN
COc1cc(OC)cc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000247069915	522854501	/nfs/dbraw/zinc/85/45/01/522854501.db2.gz	IUQKDVDEGPODLR-BLLLJJGKSA-N	0	3	306.406	2.162	10	0		DEAEHN
CN(C(=O)[C@@]1(F)CCN(C(C)(C)C)C1)C1CCC(CO)CC1	ZINC000365961892	523905600	/nfs/dbraw/zinc/90/56/00/523905600.db2.gz	NIPQJHVEVPEJLX-MQBCKMQZSA-N	0	3	314.445	2.208	10	0		DEAEHN
CCc1ccc([C@@H]2CCCCN2CCC(=O)NCC(=O)OC)o1	ZINC000124854778	524035675	/nfs/dbraw/zinc/03/56/75/524035675.db2.gz	HXYMWEOQTKFBKA-AWEZNQCLSA-N	0	3	322.405	2.048	10	0		DEAEHN
Cc1cc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)nn1C(C)(C)C	ZINC000247327394	524155684	/nfs/dbraw/zinc/15/56/84/524155684.db2.gz	MURWMMXXBXNGMB-DOMZBBRYSA-N	0	3	306.454	2.405	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cccc(C[S@](C)=O)c2)CCN1C	ZINC000127780327	525414611	/nfs/dbraw/zinc/41/46/11/525414611.db2.gz	NZZCBILOMCYMSD-GGRMYQCBSA-N	0	3	322.474	2.120	10	0		DEAEHN
Cc1ccnc(C2CCN(CCC(=O)NC3CCCC3)CC2)n1	ZINC000364961207	525640071	/nfs/dbraw/zinc/64/00/71/525640071.db2.gz	YABZAXVJZFYYES-UHFFFAOYSA-N	0	3	316.449	2.413	10	0		DEAEHN
Fc1cccc(OCCN2CCCN(c3cccnn3)CC2)c1	ZINC000105799836	526395534	/nfs/dbraw/zinc/39/55/34/526395534.db2.gz	XTOFGPYGDXYLPP-UHFFFAOYSA-N	0	3	316.380	2.207	10	0		DEAEHN
COCCCN(C)CCNC(=O)Nc1cccc2c1OCCC2	ZINC000374554279	536507122	/nfs/dbraw/zinc/50/71/22/536507122.db2.gz	OYUIEUCKAXFODO-UHFFFAOYSA-N	0	3	321.421	2.101	10	0		DEAEHN
C/C(=C/c1cccc(C(F)(F)F)c1)CN[C@H](CO)[C@@H](C)O	ZINC000419797515	527499921	/nfs/dbraw/zinc/49/99/21/527499921.db2.gz	UBJLJKXVBIRIJX-NSSNTSGZSA-N	0	3	303.324	2.440	10	0		DEAEHN
CCC[C@@]1(COC)CCCN1C(=O)N[C@@H]1CCCN(CC)C1	ZINC000193471747	527955733	/nfs/dbraw/zinc/95/57/33/527955733.db2.gz	YPXWIVAFZDIVBD-WBVHZDCISA-N	0	3	311.470	2.461	10	0		DEAEHN
CC(C)COc1ccc([C@@H](C)NC(=O)C2(N)CCOCC2)cc1	ZINC000261927038	535233883	/nfs/dbraw/zinc/23/38/83/535233883.db2.gz	VUZWJKKOSYUVLI-CQSZACIVSA-N	0	3	320.433	2.407	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)N1CC[C@]2(O)CCCC[C@H]2C1	ZINC000247188150	535484623	/nfs/dbraw/zinc/48/46/23/535484623.db2.gz	ZQTNMAYOCBRKDM-LZLYRXPVSA-N	0	3	323.481	2.197	10	0		DEAEHN
COc1ccc([C@H](C)NC(=O)N2CCN3CCC[C@H]3C2)cc1F	ZINC000247474125	536896847	/nfs/dbraw/zinc/89/68/47/536896847.db2.gz	HSCLJJJCEPYQBM-JSGCOSHPSA-N	0	3	321.396	2.385	10	0		DEAEHN
COCC[C@@H](N)C(=O)Nc1cc(Br)ccc1C	ZINC000052792695	625320898	/nfs/dbraw/zinc/32/08/98/625320898.db2.gz	MQJHBMLZWNJVTH-SNVBAGLBSA-N	0	3	301.184	2.060	10	0		DEAEHN
F[C@H]1CC2(CC[C@@H]1N1CCC(c3cc[nH]n3)CC1)OCCO2	ZINC000891891048	624647159	/nfs/dbraw/zinc/64/71/59/624647159.db2.gz	KXKSXUAHCDABHW-ZFWWWQNUSA-N	0	3	309.385	2.223	10	0		DEAEHN
COCC[C@@H](N)C(=O)NCCc1ccc(Cl)cc1Cl	ZINC000052791106	625103272	/nfs/dbraw/zinc/10/32/72/625103272.db2.gz	XTBRAAFCIVWYDY-GFCCVEGCSA-N	0	3	305.205	2.016	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc3oc(=O)ccc3c2)C1	ZINC000067719917	640629235	/nfs/dbraw/zinc/62/92/35/640629235.db2.gz	KWKMNEDNNFPTAP-CQSZACIVSA-N	0	3	315.373	2.399	10	0		DEAEHN
COc1ccc([C@H](NC(C)C)C(=O)N2C[C@H](O)CC[C@@H]2C)cc1	ZINC000897995608	640987553	/nfs/dbraw/zinc/98/75/53/640987553.db2.gz	GUUFGOUZNIGUMY-LXZKKBNFSA-N	0	3	320.433	2.106	10	0		DEAEHN
O=C(c1cccc(CN2CCCC2)c1)N1CCO[C@H](C(F)F)C1	ZINC000801423424	645394812	/nfs/dbraw/zinc/39/48/12/645394812.db2.gz	JACQPAGUIPHFKG-HNNXBMFYSA-N	0	3	324.371	2.389	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@@H](C)[C@@H](O)c1ccc(C)cc1	ZINC000804483121	645779333	/nfs/dbraw/zinc/77/93/33/645779333.db2.gz	BMCRYDYJIKRZBB-USXIJHARSA-N	0	3	304.434	2.408	10	0		DEAEHN
COc1c2c(sc1C(=O)NC1CCN(C)CC1)CCCC2	ZINC000223457148	646495532	/nfs/dbraw/zinc/49/55/32/646495532.db2.gz	BIHQEZYVILTINI-UHFFFAOYSA-N	0	3	308.447	2.460	10	0		DEAEHN
Cc1cc(N2CCN(c3ccccc3Cl)CC2)nc(N)n1	ZINC000045723674	646527885	/nfs/dbraw/zinc/52/78/85/646527885.db2.gz	YYYKWUNKHISWHS-UHFFFAOYSA-N	0	3	303.797	2.347	10	0		DEAEHN
CCCOC(=O)CCNC(=O)c1cccc(CN2CCCC2)c1	ZINC000730238663	646851935	/nfs/dbraw/zinc/85/19/35/646851935.db2.gz	TXRKSXMRPHIVSP-UHFFFAOYSA-N	0	3	318.417	2.356	10	0		DEAEHN
C[C@@H](CNC(=O)c1cc(Cl)nc(N(C)C)c1)N1CCCCC1	ZINC000733135189	647892234	/nfs/dbraw/zinc/89/22/34/647892234.db2.gz	RUYQGQUTTSFLGM-LBPRGKRZSA-N	0	3	324.856	2.405	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)CCCN1c1ncc(C=O)cn1	ZINC000382655017	685406009	/nfs/dbraw/zinc/40/60/09/685406009.db2.gz	HYEGYVCADSLKIH-HNNXBMFYSA-N	0	3	310.401	2.390	10	0		DEAEHN
Cn1ncc(CN[C@@H]2CCc3cc(Br)ccc3C2)n1	ZINC000389842700	685436149	/nfs/dbraw/zinc/43/61/49/685436149.db2.gz	KNIOWPOBIVAAMY-CYBMUJFWSA-N	0	3	321.222	2.225	10	0		DEAEHN
O=C(CCc1ccncn1)O[C@H]1CCN(Cc2ccccc2)C1	ZINC000192432939	684449993	/nfs/dbraw/zinc/44/99/93/684449993.db2.gz	GJUIUPCNSQHJMQ-KRWDZBQOSA-N	0	3	311.385	2.227	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2ccc([C@@H](C)O)cc2)C1	ZINC000195087427	685087198	/nfs/dbraw/zinc/08/71/98/685087198.db2.gz	QHLQSWOUEYNSJS-CJNGLKHVSA-N	0	3	305.422	2.023	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NCc1cnc2n1CCOC2	ZINC000722838759	776844958	/nfs/dbraw/zinc/84/49/58/776844958.db2.gz	YRECDXLCUMXUSC-AWEZNQCLSA-N	0	3	301.390	2.108	10	0		DEAEHN
C[C@@H]1C[NH2+]C[C@H]1C[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000723784753	777170510	/nfs/dbraw/zinc/17/05/10/777170510.db2.gz	GYBQURCLLAGLJY-BDAKNGLRSA-N	0	3	323.245	2.127	10	0		DEAEHN
Cn1cc(CNC[C@@H]2CCOC2(C)C)c(Br)n1	ZINC000712458688	792188414	/nfs/dbraw/zinc/18/84/14/792188414.db2.gz	HUHLHSUAJATNCH-JTQLQIEISA-N	0	3	302.216	2.087	10	0		DEAEHN
CS(=O)(=O)[C@H]1C[C@H](NCc2cc(Br)cs2)C1	ZINC000714244147	792305033	/nfs/dbraw/zinc/30/50/33/792305033.db2.gz	ZKDWZDHSRMYYQC-CZMCAQCFSA-N	0	3	324.265	2.176	10	0		DEAEHN
C[C@H](CNCc1cnn(-c2ccccc2)n1)CC1(C)OCCO1	ZINC000716020487	792553313	/nfs/dbraw/zinc/55/33/13/792553313.db2.gz	IHZJKYGKPWGWSF-AWEZNQCLSA-N	0	3	316.405	2.146	10	0		DEAEHN
CS(=O)(=O)C1CC(NCc2cc(Br)cs2)C1	ZINC000716077663	792555590	/nfs/dbraw/zinc/55/55/90/792555590.db2.gz	ZKDWZDHSRMYYQC-UHFFFAOYSA-N	0	3	324.265	2.176	10	0		DEAEHN
COC[C@H](NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)C1CC1	ZINC000245679183	797955391	/nfs/dbraw/zinc/95/53/91/797955391.db2.gz	USIURASNTJSNGP-YESZJQIVSA-N	0	3	317.433	2.156	10	0		DEAEHN
O=S(=O)([N-][C@H]1CC[NH2+]C12CCCC2)c1ccc(Cl)s1	ZINC000401604104	801834845	/nfs/dbraw/zinc/83/48/45/801834845.db2.gz	GGGLZUWTRSSDQN-VIFPVBQESA-N	0	3	320.867	2.355	10	0		DEAEHN
CN1CCC[C@@H]2[C@H]1CCN2C(=O)c1ccc(Br)cn1	ZINC000720819083	1086169615	/nfs/dbraw/zinc/16/96/15/1086169615.db2.gz	YFTOEBIZYRDAMV-CHWSQXEVSA-N	0	3	324.222	2.153	10	0		DEAEHN
c1nn(Cc2ccccc2)cc1CNCCOC1CCOCC1	ZINC000701391153	1086363388	/nfs/dbraw/zinc/36/33/88/1086363388.db2.gz	VWEDWBWNLBKIIV-UHFFFAOYSA-N	0	3	315.417	2.217	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N1CCCCCCC1	ZINC000702388793	1086425858	/nfs/dbraw/zinc/42/58/58/1086425858.db2.gz	BOLGGQFCHPIRGR-QGZVFWFLSA-N	0	3	303.450	2.238	10	0		DEAEHN
COC1(CN[C@@H]2CON(C(=O)OC(C)(C)C)C2)CCCC1	ZINC000703396918	1086498419	/nfs/dbraw/zinc/49/84/19/1086498419.db2.gz	JVTNDBZZYVPAJE-LBPRGKRZSA-N	0	3	300.399	2.086	10	0		DEAEHN
COC1(OC)CC[C@H]1NC[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000710906658	1086690189	/nfs/dbraw/zinc/69/01/89/1086690189.db2.gz	PQRJQHOGMKGKIB-CHWSQXEVSA-N	0	3	314.426	2.127	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@]23CCC[C@@H]2[NH2+]CC3)sc1Cl	ZINC000711622329	1087176798	/nfs/dbraw/zinc/17/67/98/1087176798.db2.gz	JANKZIWKBKQUSZ-CABZTGNLSA-N	0	3	320.867	2.273	10	0		DEAEHN
C[C@@H]1[C@@H](NC(=O)c2c(F)cccc2Br)CCN1C	ZINC000719388966	1089079093	/nfs/dbraw/zinc/07/90/93/1089079093.db2.gz	UBBKVVKOMFTONQ-KCJUWKMLSA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@H]1[C@@H](NC(=O)c2ccsc2Br)CCN1C	ZINC000719399079	1089085103	/nfs/dbraw/zinc/08/51/03/1089085103.db2.gz	YXJBYFNBIUOVFU-CBAPKCEASA-N	0	3	303.225	2.333	10	0		DEAEHN
COCCN1CCC(NC(=O)CSc2ccccc2C)CC1	ZINC000141576384	282102457	/nfs/dbraw/zinc/10/24/57/282102457.db2.gz	SLBKUXNXZWDZPU-UHFFFAOYSA-N	0	3	322.474	2.314	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@@H]1S(=O)(=O)c1ccc(Cl)cc1	ZINC000081920243	192338749	/nfs/dbraw/zinc/33/87/49/192338749.db2.gz	USNOKJSILKTHLW-KGLIPLIRSA-N	0	3	317.838	2.271	10	0		DEAEHN
C[C@H](O)CC(C)(C)c1c(Br)cnn1CCN(C)C	ZINC000163352474	197625443	/nfs/dbraw/zinc/62/54/43/197625443.db2.gz	HZEOPDUGHGNISZ-JTQLQIEISA-N	0	3	318.259	2.256	10	0		DEAEHN
CCOC(=O)CC[C@@H]1CCCN(C(=O)CC2CCN(C)CC2)C1	ZINC000612438414	361827302	/nfs/dbraw/zinc/82/73/02/361827302.db2.gz	WPECGSBQXBKFJN-INIZCTEOSA-N	0	3	324.465	2.300	10	0		DEAEHN
CN(C)C[C@](C)(O)CNC(=O)c1ccc(-c2ccc(F)cc2)o1	ZINC000152890805	282157335	/nfs/dbraw/zinc/15/73/35/282157335.db2.gz	KFZQTVLAUZKGRD-QGZVFWFLSA-N	0	3	320.364	2.128	10	0		DEAEHN
Cc1c([C@H]2OCC[C@@H]2NCCOc2ccccc2)cnn1C	ZINC000328625055	231256007	/nfs/dbraw/zinc/25/60/07/231256007.db2.gz	KJBBGLUIHZSXGF-DLBZAZTESA-N	0	3	301.390	2.227	10	0		DEAEHN
CCCc1nnsc1C(=O)Nc1ccc2c(c1)CNCC2	ZINC000087455906	185225594	/nfs/dbraw/zinc/22/55/94/185225594.db2.gz	FZJAXMLHDBGCBN-UHFFFAOYSA-N	0	3	302.403	2.389	10	0		DEAEHN
CCN[C@@H]1CCN(Cc2sccc2Br)C1=O	ZINC000087575883	185228831	/nfs/dbraw/zinc/22/88/31/185228831.db2.gz	NFSMFDKZRWXPDC-SECBINFHSA-N	0	3	303.225	2.221	10	0		DEAEHN
CCOC(=O)COC[C@@H](N)c1sccc1Br	ZINC000087630827	185229563	/nfs/dbraw/zinc/22/95/63/185229563.db2.gz	VFOJLZUMYHALFG-MRVPVSSYSA-N	0	3	308.197	2.090	10	0		DEAEHN
CCN[C@@H]1CCN(c2ccc(Br)c(F)c2)C1=O	ZINC000088084421	185239178	/nfs/dbraw/zinc/23/91/78/185239178.db2.gz	QDFQEBHDUVGMHJ-LLVKDONJSA-N	0	3	301.159	2.303	10	0		DEAEHN
O=S1(=O)CC[C@@H](N[C@@H]2CCCc3c4ccccc4[nH]c32)C1	ZINC000087816047	185232477	/nfs/dbraw/zinc/23/24/77/185232477.db2.gz	TXTBAHVOFPRVIL-IAQYHMDHSA-N	0	3	304.415	2.322	10	0		DEAEHN
Cc1cnn(CCN2CCC(c3noc(C4CC4)n3)CC2)c1	ZINC000328912465	231384471	/nfs/dbraw/zinc/38/44/71/231384471.db2.gz	OZDLOTQQLRRVHF-UHFFFAOYSA-N	0	3	301.394	2.332	10	0		DEAEHN
COc1ccc(Br)c(-n2nnc([C@H](C)N)c2C)c1	ZINC000088321096	185245589	/nfs/dbraw/zinc/24/55/89/185245589.db2.gz	FVDYSJYVZLWALD-ZETCQYMHSA-N	0	3	311.183	2.367	10	0		DEAEHN
C[NH2+][C@@](C)(CCCCN1CCC(C(F)(F)F)CC1)C(=O)[O-]	ZINC000088435636	185250426	/nfs/dbraw/zinc/25/04/26/185250426.db2.gz	DVQGXNKLVJDNCH-ZDUSSCGKSA-N	0	3	310.360	2.494	10	0		DEAEHN
CCn1ncnc1COc1ccc(Br)cc1CN	ZINC000088585368	185258601	/nfs/dbraw/zinc/25/86/01/185258601.db2.gz	SILNPVCTAIPBLA-UHFFFAOYSA-N	0	3	311.183	2.098	10	0		DEAEHN
CCc1ccc([C@@H](NC)[C@@H](C)S(=O)(=O)CCCOC)cc1	ZINC000081986312	192349504	/nfs/dbraw/zinc/34/95/04/192349504.db2.gz	PFFAJXSVXWGWIW-CJNGLKHVSA-N	0	3	313.463	2.349	10	0		DEAEHN
CN[C@H](c1ccccc1)[C@H](C(C)C)S(=O)(=O)CCCOC	ZINC000081985734	192349915	/nfs/dbraw/zinc/34/99/15/192349915.db2.gz	JPKPHCZEAQIEFK-CVEARBPZSA-N	0	3	313.463	2.423	10	0		DEAEHN
C[C@H](NC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1)C(C)(C)C	ZINC000091855229	299088450	/nfs/dbraw/zinc/08/84/50/299088450.db2.gz	RHZKTHUFIWSLAK-JKSUJKDBSA-N	0	3	324.513	2.233	10	0		DEAEHN
N[C@@H]1COC[C@H]1C(=O)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000090378788	185293592	/nfs/dbraw/zinc/29/35/92/185293592.db2.gz	NWRLQVUZIALKKI-VXNVDRBHSA-N	0	3	308.687	2.271	10	0		DEAEHN
N[C@H]1COC[C@H]1C(=O)Nc1ccc(SC(F)(F)F)cc1	ZINC000090380640	185293630	/nfs/dbraw/zinc/29/36/30/185293630.db2.gz	DRWJISGHBCHLDN-ZJUUUORDSA-N	0	3	306.309	2.211	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000090434110	185296094	/nfs/dbraw/zinc/29/60/94/185296094.db2.gz	HPAWBYLTZFVHFI-GXFFZTMASA-N	0	3	305.765	2.061	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)[C@H]1COC[C@@H]1NC	ZINC000090434237	185296126	/nfs/dbraw/zinc/29/61/26/185296126.db2.gz	OXBPVDPUTAQCON-AAEUAGOBSA-N	0	3	312.797	2.302	10	0		DEAEHN
CSc1nc2ccc(NC(=O)[C@]3(C)COC[C@@H]3N)cc2s1	ZINC000090586066	185305042	/nfs/dbraw/zinc/30/50/42/185305042.db2.gz	ADNVPOAWGCJTJV-SMDDNHRTSA-N	0	3	323.443	2.321	10	0		DEAEHN
CCN(Cc1ccc(Cl)s1)C(=O)[C@@]1(C)COC[C@@H]1N	ZINC000090590616	185305411	/nfs/dbraw/zinc/30/54/11/185305411.db2.gz	KLXXUPLFZAKYQO-GWCFXTLKSA-N	0	3	302.827	2.114	10	0		DEAEHN
C[C@@H](Oc1ccccc1)C(=O)N1CCCSC[C@H]1CN(C)C	ZINC000090699927	185310363	/nfs/dbraw/zinc/31/03/63/185310363.db2.gz	LOAKKQBORCVDHK-HUUCEWRRSA-N	0	3	322.474	2.350	10	0		DEAEHN
CC[N@@H+]1CC[C@H](CNC(=O)c2ccc3c(c2[O-])CCCC3)C1	ZINC000185425063	282261982	/nfs/dbraw/zinc/26/19/82/282261982.db2.gz	DRYOWQYQMGWDPY-CYBMUJFWSA-N	0	3	302.418	2.343	10	0		DEAEHN
CC[N@H+]1CC[C@H](CNC(=O)c2ccc3c(c2[O-])CCCC3)C1	ZINC000185425063	282261984	/nfs/dbraw/zinc/26/19/84/282261984.db2.gz	DRYOWQYQMGWDPY-CYBMUJFWSA-N	0	3	302.418	2.343	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N)[C@H](Sc1nnc(N(C)C)s1)C2	ZINC000092860052	185347007	/nfs/dbraw/zinc/34/70/07/185347007.db2.gz	MRWOGIHTEYCPJI-VXGBXAGGSA-N	0	3	322.459	2.330	10	0		DEAEHN
COC(=O)CNC(=O)[C@H](C)N[C@H](C)c1ccc2ccccc2c1	ZINC000181494986	199306079	/nfs/dbraw/zinc/30/60/79/199306079.db2.gz	PFGULCOGDLCTDE-OLZOCXBDSA-N	0	3	314.385	2.168	10	0		DEAEHN
COc1ccc(C[C@H](C)CN2CCCNC(=O)[C@H]2C)cc1F	ZINC000189082786	282307394	/nfs/dbraw/zinc/30/73/94/282307394.db2.gz	HKRBMZARSZXTMN-QWHCGFSZSA-N	0	3	308.397	2.223	10	0		DEAEHN
CCCC[C@H](COC)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000091343687	282962743	/nfs/dbraw/zinc/96/27/43/282962743.db2.gz	HRWHJKIBOYMLDM-TZMCWYRMSA-N	0	3	314.451	2.190	10	0		DEAEHN
c1nc2c(c(NC3CCN([C@@H]4CCOC4)CC3)n1)CCCCC2	ZINC000089602759	539412337	/nfs/dbraw/zinc/41/23/37/539412337.db2.gz	XQCDBZZDJHRUPX-OAHLLOKOSA-N	0	3	316.449	2.411	10	0		DEAEHN
O[C@H](C[C@H]1CCCN1C[C@H](O)C(F)(F)F)c1ccccc1	ZINC000181726110	199344751	/nfs/dbraw/zinc/34/47/51/199344751.db2.gz	LFCOZRBEPKGFKX-MCIONIFRSA-N	0	3	303.324	2.498	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCC(C)(C)c2ccncc2)C1	ZINC000129164910	539489503	/nfs/dbraw/zinc/48/95/03/539489503.db2.gz	RLCPRXNNXQNXEK-OAHLLOKOSA-N	0	3	304.438	2.143	10	0		DEAEHN
C[C@@H](NC(=O)NCCN(C)C)c1cccc(Br)c1	ZINC000133414936	539506713	/nfs/dbraw/zinc/50/67/13/539506713.db2.gz	XBEUGAWZLMSSBE-SNVBAGLBSA-N	0	3	314.227	2.371	10	0		DEAEHN
CN[C@@H](C)c1cccc(S(=O)(=O)N(C)c2cccnc2)c1	ZINC000070231311	190874413	/nfs/dbraw/zinc/87/44/13/190874413.db2.gz	OWLWGEYXHRATRB-LBPRGKRZSA-N	0	3	305.403	2.187	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000176258551	539626294	/nfs/dbraw/zinc/62/62/94/539626294.db2.gz	ZJKQNRZPHCNHRM-HOTGVXAUSA-N	0	3	301.434	2.452	10	0		DEAEHN
CCOc1ccccc1[C@@H](CC)NC[C@@H](O)CN1CCCC1=O	ZINC000179741334	539642456	/nfs/dbraw/zinc/64/24/56/539642456.db2.gz	YFKFOTFXDULKJH-GDBMZVCRSA-N	0	3	320.433	2.109	10	0		DEAEHN
N[C@@H]1CCCN(c2c(F)cc(F)cc2Br)C1=O	ZINC000070495352	190902493	/nfs/dbraw/zinc/90/24/93/190902493.db2.gz	ATOIQRXEECMFDX-SECBINFHSA-N	0	3	305.122	2.181	10	0		DEAEHN
Cc1cc(N2CCC[C@H](NCc3ccc(C)s3)C2=O)n(C)n1	ZINC000080526683	192165081	/nfs/dbraw/zinc/16/50/81/192165081.db2.gz	QCVUGCAKCVUGEI-AWEZNQCLSA-N	0	3	318.446	2.384	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)NCc1ccc(Cl)cn1	ZINC000183472728	539662689	/nfs/dbraw/zinc/66/26/89/539662689.db2.gz	RPALIRFHTLQGJQ-LBPRGKRZSA-N	0	3	310.829	2.409	10	0		DEAEHN
CN(C)C(=O)C1CCN(CCN(C)Cc2ccc(F)cc2)CC1	ZINC000185148144	539670315	/nfs/dbraw/zinc/67/03/15/539670315.db2.gz	SDFPLZCMDZCTED-UHFFFAOYSA-N	0	3	321.440	2.058	10	0		DEAEHN
CCCN(CC)c1ccc(C(=O)N2CC[C@H](N(C)C)C2)cn1	ZINC000170863784	197840308	/nfs/dbraw/zinc/84/03/08/197840308.db2.gz	IBROBLFHLVWXBY-HNNXBMFYSA-N	0	3	304.438	2.094	10	0		DEAEHN
CC(=O)N1C[C@@H](C(C)C)Oc2ccc(C(=O)[C@@H]3CCCN3)cc21	ZINC000071664384	191000808	/nfs/dbraw/zinc/00/08/08/191000808.db2.gz	DYCUWUCVWCNVPL-YOEHRIQHSA-N	0	3	316.401	2.391	10	0		DEAEHN
COc1cc2c(c(F)c1)CN(Cc1c(C)nn(C)c1C)[C@@H]2CN	ZINC000071683470	191006759	/nfs/dbraw/zinc/00/67/59/191006759.db2.gz	ULUSOWMFOXZQGP-QGZVFWFLSA-N	0	3	318.396	2.200	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NC[C@H]1Cc2ccccc21	ZINC000245482530	539756317	/nfs/dbraw/zinc/75/63/17/539756317.db2.gz	ZJKQNRZPHCNHRM-HZPDHXFCSA-N	0	3	301.434	2.452	10	0		DEAEHN
CCN(CC(C)C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138461674	186017321	/nfs/dbraw/zinc/01/73/21/186017321.db2.gz	BSCKDFHADUXJPV-UHFFFAOYSA-N	0	3	306.378	2.090	10	0		DEAEHN
CC[C@H](C)N(CC)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138463961	186017329	/nfs/dbraw/zinc/01/73/29/186017329.db2.gz	PPBUCCGLKZVRTL-VIFPVBQESA-N	0	3	306.378	2.233	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N(C)CCC(C)C)c1	ZINC000138705624	186018394	/nfs/dbraw/zinc/01/83/94/186018394.db2.gz	FRSCTPHPUYKULL-UHFFFAOYSA-N	0	3	320.405	2.351	10	0		DEAEHN
CC[C@H]1CN(c2ncnc3c(C)cccc32)CCN1C[C@H](C)O	ZINC000246446131	539764379	/nfs/dbraw/zinc/76/43/79/539764379.db2.gz	BPRIPESMJMOFLS-GJZGRUSLSA-N	0	3	314.433	2.220	10	0		DEAEHN
C[C@]1(c2nc(-c3ccc(Br)cn3)no2)CCCN1	ZINC000139790704	186024101	/nfs/dbraw/zinc/02/41/01/186024101.db2.gz	LTDQYNQBQGNSQR-GFCCVEGCSA-N	0	3	309.167	2.493	10	0		DEAEHN
CN[C@H](Cc1ccnc(N)c1)c1ncccc1Br	ZINC000140386653	186026616	/nfs/dbraw/zinc/02/66/16/186026616.db2.gz	RGZQKRYYKZNAIN-LLVKDONJSA-N	0	3	307.195	2.325	10	0		DEAEHN
CC(C)CCCCNS(=O)(=O)c1cccc2c1CCNC2	ZINC000147560294	186040784	/nfs/dbraw/zinc/04/07/84/186040784.db2.gz	WCYABBKKZXYPRQ-UHFFFAOYSA-N	0	3	310.463	2.437	10	0		DEAEHN
CC[C@@H]1N[C@H](c2ccsc2)N(C[C@@H]2CCCCN2C)C1=O	ZINC000144372707	186035170	/nfs/dbraw/zinc/03/51/70/186035170.db2.gz	GOKRGXJHTJEIBD-KKUMJFAQSA-N	0	3	307.463	2.441	10	0		DEAEHN
C[C@@H](CN1C(=O)C2(CCCC2)N[C@@H]1c1cccs1)N(C)C	ZINC000144942201	186035687	/nfs/dbraw/zinc/03/56/87/186035687.db2.gz	NFQQEWGKFRKAOH-JSGCOSHPSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCCN[C@@H]1CCCc2sc([C@@H]3CCS(=O)(=O)C3)nc21	ZINC000150265248	186056085	/nfs/dbraw/zinc/05/60/85/186056085.db2.gz	XHTCTECJDOLXBK-GHMZBOCLSA-N	0	3	314.476	2.422	10	0		DEAEHN
Cc1ccc(NC(=O)[C@H]2CC[C@@H](C)O2)c(OCCN(C)C)c1	ZINC000155825984	186115735	/nfs/dbraw/zinc/11/57/35/186115735.db2.gz	ZVKJEYNVKNBILQ-UKRRQHHQSA-N	0	3	306.406	2.441	10	0		DEAEHN
NCc1ccccc1NC(=O)C[S@@](=O)c1ccccc1F	ZINC000155940788	186124067	/nfs/dbraw/zinc/12/40/67/186124067.db2.gz	RDKOVQQMJSXFHQ-NRFANRHFSA-N	0	3	306.362	2.031	10	0		DEAEHN
COc1cc(CNC[C@H](C)[S@@](C)=O)c(SC)cc1OC	ZINC000159610171	186130628	/nfs/dbraw/zinc/13/06/28/186130628.db2.gz	HTLVTRIQQCIWKB-FVINQWEUSA-N	0	3	317.476	2.282	10	0		DEAEHN
COc1cc(CNC[C@H](C)[S@](C)=O)c(SC)cc1OC	ZINC000159609927	186130714	/nfs/dbraw/zinc/13/07/14/186130714.db2.gz	HTLVTRIQQCIWKB-WVDJIFEKSA-N	0	3	317.476	2.282	10	0		DEAEHN
CC(=O)c1ccc(CC(=O)NC[C@H]2CCN2C(C)(C)C)cc1	ZINC000617017664	363000881	/nfs/dbraw/zinc/00/08/81/363000881.db2.gz	ZVIYBLYTBSMRBW-MRXNPFEDSA-N	0	3	302.418	2.421	10	0		DEAEHN
C[C@@H](CCc1ccccc1)NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171897276	198004395	/nfs/dbraw/zinc/00/43/95/198004395.db2.gz	QKCIZOKMARHXRS-DOTOQJQBSA-N	0	3	301.434	2.497	10	0		DEAEHN
O=C(NCCc1ccccc1Cl)N1CCN2CCC[C@H]2C1	ZINC000171905014	198004639	/nfs/dbraw/zinc/00/46/39/198004639.db2.gz	AYMNJVFHTFBESL-AWEZNQCLSA-N	0	3	307.825	2.372	10	0		DEAEHN
O=C(NC[C@@H]1CCCN1Cc1ccccc1)Nc1nncs1	ZINC000172195722	198056611	/nfs/dbraw/zinc/05/66/11/198056611.db2.gz	SSSHJCDNFAUZPV-ZDUSSCGKSA-N	0	3	317.418	2.324	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2cc3cc(F)ccc3s2)CCO1	ZINC000172306472	198076079	/nfs/dbraw/zinc/07/60/79/198076079.db2.gz	YYTLNIXPHJEBLI-ZDUSSCGKSA-N	0	3	322.405	2.443	10	0		DEAEHN
O=C(Nc1cnn(-c2ccccc2)c1)N1CCN2CCC[C@H]2C1	ZINC000172641782	198130616	/nfs/dbraw/zinc/13/06/16/198130616.db2.gz	CBLZJFWTFKPUON-INIZCTEOSA-N	0	3	311.389	2.184	10	0		DEAEHN
C[C@H](N[C@@H](C)c1ccc2c(c1)CCCC2)C(=O)N1CCNC1=O	ZINC000072789112	191228360	/nfs/dbraw/zinc/22/83/60/191228360.db2.gz	KYHJSGQDUVBPQR-STQMWFEESA-N	0	3	315.417	2.156	10	0		DEAEHN
Cc1csc([C@@H](NC(=O)N2CC[C@H](N(C)C)C2)C2CC2)n1	ZINC000173914422	198268704	/nfs/dbraw/zinc/26/87/04/198268704.db2.gz	IOOWLHVFDRZKBR-STQMWFEESA-N	0	3	308.451	2.248	10	0		DEAEHN
Cc1cccc(O[C@H](C)CNC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000173915631	198268848	/nfs/dbraw/zinc/26/88/48/198268848.db2.gz	QOYWOEYJRQWUBV-CABCVRRESA-N	0	3	305.422	2.108	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cccc(F)c1	ZINC000173827846	198257273	/nfs/dbraw/zinc/25/72/73/198257273.db2.gz	OIAVGKOOHYHIFW-ZIAGYGMSSA-N	0	3	312.410	2.073	10	0		DEAEHN
CC[C@H](CO)N1CCN(CCCc2cccc(OC)c2)CC1	ZINC000174132318	198295497	/nfs/dbraw/zinc/29/54/97/198295497.db2.gz	OXFKBOOKXRQHIU-QGZVFWFLSA-N	0	3	306.450	2.016	10	0		DEAEHN
O=C(N[C@@H]1C[C@@H]1c1cccc(F)c1)N1CC[C@H](N2CC=CC2)C1	ZINC000174403083	198330893	/nfs/dbraw/zinc/33/08/93/198330893.db2.gz	HIDIXRCPBFNVPN-GVDBMIGSSA-N	0	3	315.392	2.337	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)Nc2cnn(CC(F)F)c2)CCN1C	ZINC000174852977	198393097	/nfs/dbraw/zinc/39/30/97/198393097.db2.gz	PRPYEKHBUHNYQT-CMPLNLGQSA-N	0	3	315.368	2.095	10	0		DEAEHN
COC[C@@H]1C[C@@H](OC)CN1Cc1nc2ccccc2nc1C	ZINC000344358693	540010386	/nfs/dbraw/zinc/01/03/86/540010386.db2.gz	FISSUUIQTMTGBW-UONOGXRCSA-N	0	3	301.390	2.174	10	0		DEAEHN
Cc1cccc(N2CCN(CCC(=O)N[C@H]3C[C@@H]3C)CC2)c1	ZINC000073327897	191304664	/nfs/dbraw/zinc/30/46/64/191304664.db2.gz	OEDREVSACVVDQN-RDJZCZTQSA-N	0	3	301.434	2.032	10	0		DEAEHN
O=C(NC1CC1)c1ccnc(N2CCN[C@H](c3ccccc3)C2)c1	ZINC000065255941	354681074	/nfs/dbraw/zinc/68/10/74/354681074.db2.gz	LAGUHNXZUTVANQ-KRWDZBQOSA-N	0	3	322.412	2.125	10	0		DEAEHN
CN(C[C@@H]1CCCN(C)C1)C(=O)Nc1ccc([S@](C)=O)cc1	ZINC000080126817	355348119	/nfs/dbraw/zinc/34/81/19/355348119.db2.gz	HRCGNBHXJOLXCU-MCMMXHMISA-N	0	3	323.462	2.230	10	0		DEAEHN
Cn1cc(CCNCc2cc(O)ccc2Br)cn1	ZINC000126630953	355818433	/nfs/dbraw/zinc/81/84/33/355818433.db2.gz	SCHHESQDQMMIGI-UHFFFAOYSA-N	0	3	310.195	2.221	10	0		DEAEHN
C[C@@H](CCC(C)(C)C)NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000153841036	355938642	/nfs/dbraw/zinc/93/86/42/355938642.db2.gz	KUVRVJOWHVRCNK-GJZGRUSLSA-N	0	3	313.486	2.347	10	0		DEAEHN
COc1ccc(F)cc1[C@H](C)NC[C@H](C)CS(C)(=O)=O	ZINC000179948384	356037072	/nfs/dbraw/zinc/03/70/72/356037072.db2.gz	IREAILPCEYIMAP-QWRGUYRKSA-N	0	3	303.399	2.166	10	0		DEAEHN
CC(C)OC(=O)CCN[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000182041113	356107350	/nfs/dbraw/zinc/10/73/50/356107350.db2.gz	BVHPAJUFTHVVIE-ZDUSSCGKSA-N	0	3	302.378	2.260	10	0		DEAEHN
CCc1cnc(CCN[C@H]2CCCC[C@@H]2S(C)(=O)=O)s1	ZINC000183046483	356157522	/nfs/dbraw/zinc/15/75/22/356157522.db2.gz	NFAURWGSFHMRJY-STQMWFEESA-N	0	3	316.492	2.193	10	0		DEAEHN
CCOc1ccc(NS(=O)(=O)CC(C)(C)C)cc1CN	ZINC000080193860	192011456	/nfs/dbraw/zinc/01/14/56/192011456.db2.gz	POHWROWWNWSHGY-UHFFFAOYSA-N	0	3	300.424	2.332	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)c1c[nH]c(=O)c2ccccc12	ZINC000189712869	356216214	/nfs/dbraw/zinc/21/62/14/356216214.db2.gz	WKVDXVKLDJOTEO-ZDUSSCGKSA-N	0	3	313.401	2.132	10	0		DEAEHN
COc1ccsc1C(=O)N1CCc2ccccc2[C@H]1CN	ZINC000227721291	356280408	/nfs/dbraw/zinc/28/04/08/356280408.db2.gz	MFCQOYMCWXHNEQ-CYBMUJFWSA-N	0	3	302.399	2.455	10	0		DEAEHN
O=C(CCC1CC1)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000400788766	283158468	/nfs/dbraw/zinc/15/84/68/283158468.db2.gz	SOFWMADAYCAGRN-UHFFFAOYSA-N	0	3	316.445	2.320	10	0		DEAEHN
Cn1ncc([C@H]2CCCCCN2)c1I	ZINC000306795078	356405555	/nfs/dbraw/zinc/40/55/55/356405555.db2.gz	GHAMAKFVYDKYPZ-SECBINFHSA-N	0	3	305.163	2.229	10	0		DEAEHN
CN(C[C@@H]1CCc2nccn2C1)C(=O)c1cccc2n[nH]cc21	ZINC000328628502	356464125	/nfs/dbraw/zinc/46/41/25/356464125.db2.gz	NTEAKDOOXYNPTD-LBPRGKRZSA-N	0	3	309.373	2.094	10	0		DEAEHN
C[C@@H](c1nc(C2CC2)no1)N(C)C[C@H]1CCc2nccn2C1	ZINC000328655570	356467021	/nfs/dbraw/zinc/46/70/21/356467021.db2.gz	YMCDIKDSUWZHIH-NWDGAFQWSA-N	0	3	301.394	2.399	10	0		DEAEHN
C[C@@H](C(=O)OC(C)(C)C)N(C)C(=O)[C@H](C)N1CCCCCC1	ZINC000081450495	192268630	/nfs/dbraw/zinc/26/86/30/192268630.db2.gz	RNWOBPCDMMGDSM-KBPBESRZSA-N	0	3	312.454	2.440	10	0		DEAEHN
CCOC(=O)CCCNCc1ccc(Br)cn1	ZINC000081545655	192288017	/nfs/dbraw/zinc/28/80/17/192288017.db2.gz	ROLQMEZNWSPHTK-UHFFFAOYSA-N	0	3	301.184	2.277	10	0		DEAEHN
CCc1ccc([C@H](N)[C@H](C)SCCS(C)(=O)=O)cc1	ZINC000081768193	192320960	/nfs/dbraw/zinc/32/09/60/192320960.db2.gz	ITQJMAVIFYQECK-SMDDNHRTSA-N	0	3	301.477	2.415	10	0		DEAEHN
CCCOc1ccc(C(=O)CCC(=O)N(C)[C@H](C)CN)cc1	ZINC000236937133	202080219	/nfs/dbraw/zinc/08/02/19/202080219.db2.gz	YBRBNACJZSHQCW-CYBMUJFWSA-N	0	3	306.406	2.244	10	0		DEAEHN
CC[C@@H](C)[C@H](N)C(=O)NCc1ccnc(OC2CCCC2)c1	ZINC000236954268	202092125	/nfs/dbraw/zinc/09/21/25/202092125.db2.gz	YMFVWEKZMGXZQR-WBMJQRKESA-N	0	3	305.422	2.393	10	0		DEAEHN
COC(=O)c1cncnc1N[C@H](C)CN(C)Cc1ccccc1	ZINC000381045017	356670266	/nfs/dbraw/zinc/67/02/66/356670266.db2.gz	FMZFRVCIQSYPQP-CYBMUJFWSA-N	0	3	314.389	2.196	10	0		DEAEHN
COc1cc(OC)cc(N2CC[C@@H](NCCC(C)C)C2=O)c1	ZINC000237212390	202192817	/nfs/dbraw/zinc/19/28/17/202192817.db2.gz	BXISTKCJANACKE-MRXNPFEDSA-N	0	3	306.406	2.445	10	0		DEAEHN
c1cnn(Cc2noc([C@H]3CCN(Cc4ccccc4)C3)n2)c1	ZINC000579614260	357005807	/nfs/dbraw/zinc/00/58/07/357005807.db2.gz	XHBQHKSMOOAXGP-HNNXBMFYSA-N	0	3	309.373	2.304	10	0		DEAEHN
CCNCc1cc(F)c(C)c(S(=O)(=O)N(CC)CC)c1	ZINC000088906607	192651010	/nfs/dbraw/zinc/65/10/10/192651010.db2.gz	FDVONDBBMQOLTG-UHFFFAOYSA-N	0	3	302.415	2.274	10	0		DEAEHN
CCCNCc1cc(F)c(C)c(S(=O)(=O)N(C)C2CC2)c1	ZINC000088941211	192663219	/nfs/dbraw/zinc/66/32/19/192663219.db2.gz	QFSGNVQNIHGUKU-UHFFFAOYSA-N	0	3	314.426	2.417	10	0		DEAEHN
O=C(Nc1ccc(C(F)(F)F)nc1)N1CCN2CCC[C@H]2C1	ZINC000179375016	199024431	/nfs/dbraw/zinc/02/44/31/199024431.db2.gz	ZCCDQHZOKQCTIK-NSHDSACASA-N	0	3	314.311	2.412	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H](C)c1ccc(-n2cncn2)cc1)N(C)C	ZINC000179334206	199017827	/nfs/dbraw/zinc/01/78/27/199017827.db2.gz	DSWZTXKXPVMMSM-XJKSGUPXSA-N	0	3	315.421	2.175	10	0		DEAEHN
O=C(C[C@@H](O)c1ccc(Cl)cc1)N1CCN2CCC[C@@H]2C1	ZINC000179816842	199083977	/nfs/dbraw/zinc/08/39/77/199083977.db2.gz	JDQSBDUVJMJHFV-HUUCEWRRSA-N	0	3	308.809	2.070	10	0		DEAEHN
CC1CCN(CC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CC1	ZINC000180153110	199123869	/nfs/dbraw/zinc/12/38/69/199123869.db2.gz	WSKJKHXLBXQSFU-PKOBYXMFSA-N	0	3	315.461	2.280	10	0		DEAEHN
CC1CCN(CC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CC1	ZINC000180152948	199124235	/nfs/dbraw/zinc/12/42/35/199124235.db2.gz	WSKJKHXLBXQSFU-IEBWSBKVSA-N	0	3	315.461	2.280	10	0		DEAEHN
COCCN1CC[C@H](NC(=O)c2c[nH]c3cc(Cl)ccc23)C1	ZINC000593913540	358169983	/nfs/dbraw/zinc/16/99/83/358169983.db2.gz	VDYPJUJPVFILSF-LBPRGKRZSA-N	0	3	321.808	2.272	10	0		DEAEHN
CN(C(=O)CCCCC(=O)OC(C)(C)C)[C@H]1CN2CCC1CC2	ZINC000594287915	358239741	/nfs/dbraw/zinc/23/97/41/358239741.db2.gz	CAWMCCKIEVVNBV-HNNXBMFYSA-N	0	3	324.465	2.441	10	0		DEAEHN
CC[C@H](N[C@H]1CCc2nnc(C(C)C)n2C1)c1cnn(C)c1	ZINC000180508209	199168948	/nfs/dbraw/zinc/16/89/48/199168948.db2.gz	MLFOWRQBKFPXIR-KBPBESRZSA-N	0	3	302.426	2.191	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)N(CCN(C)C)C(C)C)c1	ZINC000180698386	199198629	/nfs/dbraw/zinc/19/86/29/199198629.db2.gz	XEDWPLGHWFVLEO-UHFFFAOYSA-N	0	3	320.437	2.473	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)NCc1ccc(Cl)cn1	ZINC000180828971	199215750	/nfs/dbraw/zinc/21/57/50/199215750.db2.gz	FTQPJPJIODYUCY-RISCZKNCSA-N	0	3	310.829	2.217	10	0		DEAEHN
C[C@H]1CC[C@@](CO)(N(C)CC(=O)N(C)Cc2cccs2)C1	ZINC000187963675	200183803	/nfs/dbraw/zinc/18/38/03/200183803.db2.gz	ZPPFRSGRTHSOKX-XJKSGUPXSA-N	0	3	310.463	2.189	10	0		DEAEHN
COC(=O)c1ccc(CN2C[C@@H](c3ccsc3)[C@H](CO)C2)o1	ZINC000188095527	200193316	/nfs/dbraw/zinc/19/33/16/200193316.db2.gz	WPUVNWDJGXETEL-JSGCOSHPSA-N	0	3	321.398	2.336	10	0		DEAEHN
CC(C)C[C@@H](CO)N(C)C(=O)NC[C@@H](c1ccccc1)N(C)C	ZINC000188164346	200202826	/nfs/dbraw/zinc/20/28/26/200202826.db2.gz	HVKJFWIHTXNRDN-IRXDYDNUSA-N	0	3	321.465	2.338	10	0		DEAEHN
Cc1cccc(OC(F)F)c1NC(=O)c1n[nH]c2c1CNCC2	ZINC000188491340	200255148	/nfs/dbraw/zinc/25/51/48/200255148.db2.gz	GPQKBMPQUYOOEA-UHFFFAOYSA-N	0	3	322.315	2.218	10	0		DEAEHN
CCOc1ccc(OC[C@H](O)CN2CC[C@H](C)[C@H](OC)C2)cc1	ZINC000189371564	200389134	/nfs/dbraw/zinc/38/91/34/200389134.db2.gz	IWNRRURPFYVKFZ-HDMKZQKVSA-N	0	3	323.433	2.182	10	0		DEAEHN
CO[C@H]1CCN(C[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000443613447	238115973	/nfs/dbraw/zinc/11/59/73/238115973.db2.gz	BDANGDDPAFVOJI-STQMWFEESA-N	0	3	303.324	2.330	10	0		DEAEHN
C[C@@H]1CN(CCCCNC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)C[C@@H](C)O1	ZINC000443676456	238120098	/nfs/dbraw/zinc/12/00/98/238120098.db2.gz	TUAZXSXWLURVNY-MTSZKFMLSA-N	0	3	308.466	2.428	10	0		DEAEHN
CC[C@@H](CN1CCCC1)NC(=O)CN(C)c1ccc(Cl)cn1	ZINC000605371807	360963431	/nfs/dbraw/zinc/96/34/31/360963431.db2.gz	CXUKRGZNFQPQBE-AWEZNQCLSA-N	0	3	324.856	2.162	10	0		DEAEHN
O=C(CN1CCCC12CCC2)NCCOc1ccc(F)cc1	ZINC000444778298	238305341	/nfs/dbraw/zinc/30/53/41/238305341.db2.gz	VYWDLUDUHKRYBV-UHFFFAOYSA-N	0	3	306.381	2.339	10	0		DEAEHN
CN(C)CCn1cc(NC(=O)c2cccc3cnccc32)cn1	ZINC000608585443	361234007	/nfs/dbraw/zinc/23/40/07/361234007.db2.gz	RRJPAHCIPGSZQJ-UHFFFAOYSA-N	0	3	309.373	2.245	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCC[C@H](CCC(=O)OCC)C1	ZINC000611043608	361517933	/nfs/dbraw/zinc/51/79/33/361517933.db2.gz	RMAWHQZMZGPDFI-CVEARBPZSA-N	0	3	324.465	2.443	10	0		DEAEHN
O=C(NCCCCO)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000194340186	201205728	/nfs/dbraw/zinc/20/57/28/201205728.db2.gz	OEBZOJOYOKXREK-KRWDZBQOSA-N	0	3	319.449	2.113	10	0		DEAEHN
CSC1(CNC(=O)c2ccccc2OCCN(C)C)CC1	ZINC000194640275	201267295	/nfs/dbraw/zinc/26/72/95/201267295.db2.gz	SYGVKHNAAZYBAL-UHFFFAOYSA-N	0	3	308.447	2.252	10	0		DEAEHN
C(=C\c1ccccc1)\CN[C@H]1CCN(c2ccc3nncn3n2)C1	ZINC000623652618	365117328	/nfs/dbraw/zinc/11/73/28/365117328.db2.gz	LFACVIXKZCJXHG-OUOZUETKSA-N	0	3	320.400	2.006	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@H]1O)c1ccc(Br)s1	ZINC000623767492	365168161	/nfs/dbraw/zinc/16/81/61/365168161.db2.gz	WVQHREDLDLGWAD-XHNCKOQMSA-N	0	3	306.225	2.311	10	0		DEAEHN
C[C@H](N[C@@H]1CCOC[C@@H]1O)c1ccc(Br)s1	ZINC000623767493	365168309	/nfs/dbraw/zinc/16/83/09/365168309.db2.gz	WVQHREDLDLGWAD-YIZRAAEISA-N	0	3	306.225	2.311	10	0		DEAEHN
O=C(CN[C@@H]1CCCC[C@H]1n1cccn1)Nc1nccs1	ZINC000128041142	283849378	/nfs/dbraw/zinc/84/93/78/283849378.db2.gz	IEUVRKQSUAYHAK-VXGBXAGGSA-N	0	3	305.407	2.052	10	0		DEAEHN
CN(C)[C@H]1CCCN(C(=O)c2ccc3nc(N)sc3c2)C1	ZINC000091395546	193050649	/nfs/dbraw/zinc/05/06/49/193050649.db2.gz	DNJKSTRERIARQU-NSHDSACASA-N	0	3	304.419	2.045	10	0		DEAEHN
C[C@]1(C(=O)N2CCCN(CC3CCC3)CC2)CCCNC1=O	ZINC000329008197	291349672	/nfs/dbraw/zinc/34/96/72/291349672.db2.gz	NQUNHRGJXRVBDA-KRWDZBQOSA-N	0	3	307.438	2.077	10	0		DEAEHN
CCS(=O)(=O)CCC[C@H](O)C(C)(C)N1CCCCCC1	ZINC000091567702	193074149	/nfs/dbraw/zinc/07/41/49/193074149.db2.gz	YHENXZIMYDHXPL-AWEZNQCLSA-N	0	3	305.484	2.217	10	0		DEAEHN
CC[C@@](C)(C(=O)Cc1c(Br)c(C)nn1C)N(C)C	ZINC000091568808	193074296	/nfs/dbraw/zinc/07/42/96/193074296.db2.gz	SKFMISRQQBWXLF-ZDUSSCGKSA-N	0	3	316.243	2.333	10	0		DEAEHN
COc1c(C)cc(CN(C)[C@H](C)CN2CCOCC2)cc1C	ZINC000091510289	193066686	/nfs/dbraw/zinc/06/66/86/193066686.db2.gz	JRUKLKKUPNXCHQ-MRXNPFEDSA-N	0	3	306.450	2.465	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@H]1O)c1cccc(Br)c1	ZINC000624235800	365345840	/nfs/dbraw/zinc/34/58/40/365345840.db2.gz	POCIWNXGSDDMBH-TVYUQYBPSA-N	0	3	300.196	2.250	10	0		DEAEHN
O[C@@H]1COCC[C@@H]1N[C@@H]1CCc2sc(Br)cc21	ZINC000624239144	365347269	/nfs/dbraw/zinc/34/72/69/365347269.db2.gz	FGAYVLPKVNFOHB-KXUCPTDWSA-N	0	3	318.236	2.237	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@@H]1O)c1ccc(Br)cc1F	ZINC000624237849	365347315	/nfs/dbraw/zinc/34/73/15/365347315.db2.gz	FSQFLFYCJRZWHD-HJIKLVIJSA-N	0	3	318.186	2.389	10	0		DEAEHN
CN[C@H](c1cccc(OC(F)(F)F)c1)[C@@H]1CN(C)CCO1	ZINC000091717592	193096775	/nfs/dbraw/zinc/09/67/75/193096775.db2.gz	GPYQVAQNJUNBKB-QWHCGFSZSA-N	0	3	304.312	2.176	10	0		DEAEHN
C[C@H](N[C@@H]1CCOC[C@@H]1O)c1ccc(F)c(Br)c1	ZINC000624235584	365344841	/nfs/dbraw/zinc/34/48/41/365344841.db2.gz	MSJPVTMUIQAQRS-CKLFPEKLSA-N	0	3	318.186	2.389	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@@H]1O)c1cccc(Br)c1	ZINC000624235801	365344850	/nfs/dbraw/zinc/34/48/50/365344850.db2.gz	POCIWNXGSDDMBH-XDTLVQLUSA-N	0	3	300.196	2.250	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@H]1O)c1ccc(Br)cc1	ZINC000624235887	365345511	/nfs/dbraw/zinc/34/55/11/365345511.db2.gz	RHTDAXGPOMKTJL-TVYUQYBPSA-N	0	3	300.196	2.250	10	0		DEAEHN
C[C@@H]1CC[C@@H]([N-]S(=O)(=O)c2cccc(Cl)c2Cl)C[NH2+]1	ZINC000624407148	365413716	/nfs/dbraw/zinc/41/37/16/365413716.db2.gz	UMMXBSQABVRHKL-RKDXNWHRSA-N	0	3	323.245	2.412	10	0		DEAEHN
C[C@H](c1ccccc1)[C@@H](O)CN1C[C@]2(CCOC2)OC(C)(C)C1	ZINC000450897481	242364570	/nfs/dbraw/zinc/36/45/70/242364570.db2.gz	QALPZPQXIYAXCV-AYBZRNKSSA-N	0	3	319.445	2.421	10	0		DEAEHN
COC[C@@H](N)Cc1cn(-c2cc(Cl)ccc2Cl)nn1	ZINC000630600121	367750732	/nfs/dbraw/zinc/75/07/32/367750732.db2.gz	XKCSRBMSXMWFMC-VIFPVBQESA-N	0	3	301.177	2.090	10	0		DEAEHN
C[C@@H]1CN(S(=O)(=O)c2cc(Cl)cc(CN)c2F)C[C@H]1C	ZINC000092113813	193161483	/nfs/dbraw/zinc/16/14/83/193161483.db2.gz	GFVUCGZRJHPEKB-RKDXNWHRSA-N	0	3	320.817	2.214	10	0		DEAEHN
CC(C)NCc1cccc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)c1	ZINC000092113712	193161487	/nfs/dbraw/zinc/16/14/87/193161487.db2.gz	RGXUGPWQZWUELZ-OKILXGFUSA-N	0	3	310.463	2.461	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)ccc1F	ZINC000092113602	193161816	/nfs/dbraw/zinc/16/18/16/193161816.db2.gz	DTLVLHIJBMYBGX-TXEJJXNPSA-N	0	3	314.426	2.212	10	0		DEAEHN
CCc1ccc(CNC)cc1S(=O)(=O)N1C[C@@H](C)[C@H](C)C1	ZINC000092113824	193161852	/nfs/dbraw/zinc/16/18/52/193161852.db2.gz	YGULWOFSJUSKHZ-CHWSQXEVSA-N	0	3	310.463	2.245	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)c(F)c1	ZINC000092115477	193162994	/nfs/dbraw/zinc/16/29/94/193162994.db2.gz	ARXFHHGTKKPINJ-NSHDSACASA-N	0	3	300.399	2.108	10	0		DEAEHN
C[NH2+]Cc1ccc(S(=O)(=O)[N-]C2CCCCC2)c(F)c1	ZINC000092115762	193163292	/nfs/dbraw/zinc/16/32/92/193163292.db2.gz	QHVLOIGGBKKPNP-UHFFFAOYSA-N	0	3	300.399	2.156	10	0		DEAEHN
CCCCN(CC)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115518	193163483	/nfs/dbraw/zinc/16/34/83/193163483.db2.gz	QXERIJBDYFBOLZ-UHFFFAOYSA-N	0	3	302.415	2.356	10	0		DEAEHN
c1cc(CNCCCOC[C@H]2CCOC2)n(CC2CCC2)n1	ZINC000631078613	368006260	/nfs/dbraw/zinc/00/62/60/368006260.db2.gz	VLUBBADZTYFDTJ-MRXNPFEDSA-N	0	3	307.438	2.216	10	0		DEAEHN
c1cnc2c(c1)[C@@H](NCc1ccc(-c3nncnn3)cc1)CCC2	ZINC000631644548	368324225	/nfs/dbraw/zinc/32/42/25/368324225.db2.gz	UVMHTXFQZPHGGT-KRWDZBQOSA-N	0	3	318.384	2.496	10	0		DEAEHN
C[C@@H](NC[C@@]1(CCO)CCOC1)c1ccc(F)cc1N(C)C	ZINC000125728047	296130344	/nfs/dbraw/zinc/13/03/44/296130344.db2.gz	UHFIPQMGNITJJX-CXAGYDPISA-N	0	3	310.413	2.331	10	0		DEAEHN
COC(=O)c1cc(C(=O)N[C@@H](CC(C)C)CN2CCCC2)c[nH]1	ZINC000452344194	244179728	/nfs/dbraw/zinc/17/97/28/244179728.db2.gz	NCWUYRJROJWZRL-AWEZNQCLSA-N	0	3	321.421	2.042	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)Nc1cccc(-c2nnc(C)n2C)c1	ZINC000262509867	203315015	/nfs/dbraw/zinc/31/50/15/203315015.db2.gz	AYOQKCBTAKKJHP-HZMBPMFUSA-N	0	3	301.394	2.102	10	0		DEAEHN
CCC[C@](C)(N)C(=O)NCCCc1cc(OC)ccc1OC	ZINC000262578845	203336730	/nfs/dbraw/zinc/33/67/30/203336730.db2.gz	PQDWNWADCPVLEG-KRWDZBQOSA-N	0	3	308.422	2.270	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N(CC)C[C@H](C)CC)cn1C	ZINC000093265727	193222599	/nfs/dbraw/zinc/22/25/99/193222599.db2.gz	LPVAKWGDFVNBTM-CYBMUJFWSA-N	0	3	315.483	2.191	10	0		DEAEHN
CN[C@@H](Cc1cc(Br)ccc1OC)C(OC)OC	ZINC000093304941	193228054	/nfs/dbraw/zinc/22/80/54/193228054.db2.gz	GRSXGMYVKBQREQ-NSHDSACASA-N	0	3	318.211	2.207	10	0		DEAEHN
CS(=O)(=O)c1ccc(Oc2cccc(F)c2C(=N)N)cc1	ZINC000093409128	193246013	/nfs/dbraw/zinc/24/60/13/193246013.db2.gz	LBEADJXAJSVPMZ-UHFFFAOYSA-N	0	3	308.334	2.306	10	0		DEAEHN
C[C@@H]1CCC[C@@]2(CSC(NCC(C)(C)S(C)(=O)=O)=N2)C1	ZINC000093524724	193263760	/nfs/dbraw/zinc/26/37/60/193263760.db2.gz	JXDAGCJMGNHJEI-RISCZKNCSA-N	0	3	318.508	2.451	10	0		DEAEHN
CCOC(=O)[C@@]1(N)CCC[C@@H]1CCN(C)CCC(F)(F)F	ZINC000093596063	193271459	/nfs/dbraw/zinc/27/14/59/193271459.db2.gz	VMZJFWRMDLBBBD-DGCLKSJQSA-N	0	3	310.360	2.321	10	0		DEAEHN
NC(=O)[C@]1(N)CCC[C@H]1CCSc1cc(F)ccc1F	ZINC000093629594	193276634	/nfs/dbraw/zinc/27/66/34/193276634.db2.gz	CEOKZPRFLFASDL-XPTSAGLGSA-N	0	3	300.374	2.430	10	0		DEAEHN
CC[C@H](CO)N1CCN(Cc2ccc(F)c(Cl)c2)CC1	ZINC000093739904	193297904	/nfs/dbraw/zinc/29/79/04/193297904.db2.gz	QFBXJIAYRUTKNU-CYBMUJFWSA-N	0	3	300.805	2.368	10	0		DEAEHN
C[NH2+][C@@H](C)c1ccccc1[N-]S(=O)(=O)CCOC(C)C	ZINC000093665850	193287340	/nfs/dbraw/zinc/28/73/40/193287340.db2.gz	GFWUUPPLOMFHGK-LBPRGKRZSA-N	0	3	300.424	2.134	10	0		DEAEHN
CN[C@]1(C(N)=O)CC[C@@H](Oc2ccccc2C(F)(F)F)C1	ZINC000093836633	193314709	/nfs/dbraw/zinc/31/47/09/193314709.db2.gz	ZRSPGFPJAXFYPG-NOZJJQNGSA-N	0	3	302.296	2.080	10	0		DEAEHN
CN[C@]1(C(N)=O)CC[C@@H](Sc2ccc(C(F)(F)F)cn2)C1	ZINC000093850375	193317267	/nfs/dbraw/zinc/31/72/67/193317267.db2.gz	LTPDUIHTWUPMQZ-BXKDBHETSA-N	0	3	319.352	2.189	10	0		DEAEHN
CN[C@H](c1ccc(Cl)c(Cl)c1)[C@H]1CN(C)CCN1C	ZINC000093894638	193324911	/nfs/dbraw/zinc/32/49/11/193324911.db2.gz	ZSMHPYVTHVDKNE-ZIAGYGMSSA-N	0	3	302.249	2.500	10	0		DEAEHN
CN1CCO[C@H](CNCc2ccc(Br)c(F)c2)C1	ZINC000093938966	193330228	/nfs/dbraw/zinc/33/02/28/193330228.db2.gz	WBOWCYZSOBNIMA-LLVKDONJSA-N	0	3	317.202	2.008	10	0		DEAEHN
CCN[C@@H](Cc1nc2ccccc2s1)[C@@H]1CN(C)CCO1	ZINC000094251518	193355159	/nfs/dbraw/zinc/35/51/59/193355159.db2.gz	YADFVFRLEPTRHX-KBPBESRZSA-N	0	3	305.447	2.148	10	0		DEAEHN
CC[C@H](N)[C@H](c1cccc(Cl)c1)N(C)CCS(C)(=O)=O	ZINC000094297252	193356967	/nfs/dbraw/zinc/35/69/67/193356967.db2.gz	RWVZWHUZVKZQCL-KBPBESRZSA-N	0	3	318.870	2.095	10	0		DEAEHN
CCS(=O)(=O)CCCOc1ccc(CNCC(C)C)nc1	ZINC000094212094	193349662	/nfs/dbraw/zinc/34/96/62/193349662.db2.gz	IRTFPTMDBPHKSH-UHFFFAOYSA-N	0	3	314.451	2.031	10	0		DEAEHN
CC(C)N1CCC[C@](O)([C@@H]2CCC[C@H](S(C)(=O)=O)C2)CC1	ZINC000094639912	193387909	/nfs/dbraw/zinc/38/79/09/193387909.db2.gz	RBYWZJFJNZSLMW-OWCLPIDISA-N	0	3	317.495	2.215	10	0		DEAEHN
CN(CCNC(=O)c1cccc(C(F)(F)F)c1N)C1CC1	ZINC000094599046	193382995	/nfs/dbraw/zinc/38/29/95/193382995.db2.gz	YVRXRWBSUUYRDG-UHFFFAOYSA-N	0	3	301.312	2.112	10	0		DEAEHN
CCNc1c(C(=O)NCCN(C)C)cccc1C(F)(F)F	ZINC000094598334	193383488	/nfs/dbraw/zinc/38/34/88/193383488.db2.gz	RYKQGWQTQZQAMH-UHFFFAOYSA-N	0	3	303.328	2.429	10	0		DEAEHN
Cc1cc(F)c([C@H](C)NC[C@H]2CCS(=O)(=O)C2)cc1F	ZINC000094736792	193394144	/nfs/dbraw/zinc/39/41/44/193394144.db2.gz	CQNMVLLQCXLLND-WDEREUQCSA-N	0	3	303.374	2.359	10	0		DEAEHN
O=C(Nc1cccc(C(F)(F)F)c1)c1n[nH]c2c1CNCC2	ZINC000082807270	284348843	/nfs/dbraw/zinc/34/88/43/284348843.db2.gz	OZSXJUYJECRQRM-UHFFFAOYSA-N	0	3	310.279	2.327	10	0		DEAEHN
CCN1CCN([C@@H](CN)c2ccccc2Br)CC1	ZINC000019439084	182123119	/nfs/dbraw/zinc/12/31/19/182123119.db2.gz	SSZRZESPXZXZSM-AWEZNQCLSA-N	0	3	312.255	2.086	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2ccc(Br)o2)C[C@@H](C)O1	ZINC000022215186	182313791	/nfs/dbraw/zinc/31/37/91/182313791.db2.gz	RQKWILGPCSQRSX-BBBLOLIVSA-N	0	3	303.200	2.151	10	0		DEAEHN
CCN[C@@H](Cc1cc(F)cc(F)c1)[C@H]1CCCCS1(=O)=O	ZINC000097924669	193767798	/nfs/dbraw/zinc/76/77/98/193767798.db2.gz	JLPZLYHMBCCRAG-LSDHHAIUSA-N	0	3	317.401	2.453	10	0		DEAEHN
CCOC(=O)c1c(C2CC2)csc1NC(=O)CNC1CC1	ZINC000040415359	183063726	/nfs/dbraw/zinc/06/37/26/183063726.db2.gz	OEPTZRJRRFVDGO-UHFFFAOYSA-N	0	3	308.403	2.493	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)N[C@H]1CCC[C@@H](OCC(F)(F)F)C1	ZINC000040462326	183071125	/nfs/dbraw/zinc/07/11/25/183071125.db2.gz	ZMNSMDLQIKXNKB-YFKTTZPYSA-N	0	3	310.360	2.366	10	0		DEAEHN
CC(C)C[C@@H](CO)NCc1ccc(I)o1	ZINC000040775834	183132419	/nfs/dbraw/zinc/13/24/19/183132419.db2.gz	BWWJQTDMXCSDCO-VIFPVBQESA-N	0	3	323.174	2.381	10	0		DEAEHN
CN(c1ncnc(Nc2ccccc2)c1N)C1CCN(C)CC1	ZINC000040781125	183132994	/nfs/dbraw/zinc/13/29/94/183132994.db2.gz	FBTYNDMNNGOQBG-UHFFFAOYSA-N	0	3	312.421	2.333	10	0		DEAEHN
CC[C@@H](N)C(=O)Nc1ccc(NC(C)=O)cc1C(F)(F)F	ZINC000040856315	183142754	/nfs/dbraw/zinc/14/27/54/183142754.db2.gz	HSKHTOONYMMLBE-SNVBAGLBSA-N	0	3	303.284	2.340	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2ccc(F)c(C(F)(F)F)c2)C1	ZINC000040713145	183121668	/nfs/dbraw/zinc/12/16/68/183121668.db2.gz	FKVWSMABAPABMQ-KCJUWKMLSA-N	0	3	306.259	2.160	10	0		DEAEHN
COc1cc(OC)cc([C@@H](CN)N(C)Cc2cscn2)c1	ZINC000042863628	183315095	/nfs/dbraw/zinc/31/50/95/183315095.db2.gz	LOTHVEMRCMIVCY-OAHLLOKOSA-N	0	3	307.419	2.292	10	0		DEAEHN
C[C@H](N)[C@H](c1ccc(Cl)cc1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000042945269	183320075	/nfs/dbraw/zinc/32/00/75/183320075.db2.gz	YVUFUAKSUZBBDL-NILFDRSVSA-N	0	3	309.841	2.281	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccccc1Cl)N(C)CC(=O)NC1CC1	ZINC000043051479	183332727	/nfs/dbraw/zinc/33/27/27/183332727.db2.gz	JWHIXGHNOKABNN-ZBFHGGJFSA-N	0	3	309.841	2.329	10	0		DEAEHN
Cn1cc([C@@H](CN)Oc2ccc(Br)cc2F)cn1	ZINC000043235562	183345490	/nfs/dbraw/zinc/34/54/90/183345490.db2.gz	WBFWBAKGBCCOMU-GFCCVEGCSA-N	0	3	314.158	2.401	10	0		DEAEHN
CC[C@H](N)[C@H](c1sccc1C)N1CCCC[C@@H]1C(=O)NC	ZINC000043248710	183346651	/nfs/dbraw/zinc/34/66/51/183346651.db2.gz	XKHAEGZQYTWBNT-BFHYXJOUSA-N	0	3	309.479	2.435	10	0		DEAEHN
C[C@H](N)[C@H](c1ccc(Br)s1)N1CCC(O)CC1	ZINC000043258817	183348901	/nfs/dbraw/zinc/34/89/01/183348901.db2.gz	ALEXZEHWKQXYFY-QPUJVOFHSA-N	0	3	319.268	2.356	10	0		DEAEHN
CN[C@@H](c1ccc(Br)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000043300256	183352117	/nfs/dbraw/zinc/35/21/17/183352117.db2.gz	VQZGDMUGKLTQRL-PWSUYJOCSA-N	0	3	318.236	2.144	10	0		DEAEHN
CNCc1cc(Cl)c(OCCCC(=O)N(C)C)c(OC)c1	ZINC000043447998	183364129	/nfs/dbraw/zinc/36/41/29/183364129.db2.gz	KLLMGDBMTJIMGH-UHFFFAOYSA-N	0	3	314.813	2.315	10	0		DEAEHN
COCCN(C)CCCNC(=O)Nc1nc(C(C)C)cs1	ZINC000043601037	183375569	/nfs/dbraw/zinc/37/55/69/183375569.db2.gz	KGDNQIWLNHXORQ-UHFFFAOYSA-N	0	3	314.455	2.356	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@@H](C)N(CCC(N)=S)CC(C)C	ZINC000043418466	183360547	/nfs/dbraw/zinc/36/05/47/183360547.db2.gz	MXJNLCRCPGXSKP-QWHCGFSZSA-N	0	3	301.500	2.314	10	0		DEAEHN
CC[C@H](C)N1C(=O)C[C@@H](NCCc2ccc(Cl)cc2)C1=O	ZINC000104929552	194053589	/nfs/dbraw/zinc/05/35/89/194053589.db2.gz	BEGDNWSBYFEAGN-SMDDNHRTSA-N	0	3	308.809	2.398	10	0		DEAEHN
CC[C@@H](C)N1C(=O)C[C@@H](NCCc2ccc(Cl)cc2)C1=O	ZINC000104929550	194054108	/nfs/dbraw/zinc/05/41/08/194054108.db2.gz	BEGDNWSBYFEAGN-BXUZGUMPSA-N	0	3	308.809	2.398	10	0		DEAEHN
CCOc1ccccc1NC(=O)[C@@H](C)NCCn1cc(C)cn1	ZINC000105881481	194156314	/nfs/dbraw/zinc/15/63/14/194156314.db2.gz	REKOPGSQAVFOLY-CQSZACIVSA-N	0	3	316.405	2.207	10	0		DEAEHN
Cn1cnnc1CCNCc1cc(Br)ccc1F	ZINC000109420814	194262102	/nfs/dbraw/zinc/26/21/02/194262102.db2.gz	YBILOLGFSNRWLI-UHFFFAOYSA-N	0	3	313.174	2.049	10	0		DEAEHN
COc1cnn(C)c1[C@H](N)Cc1ccccc1Br	ZINC000159334468	197346123	/nfs/dbraw/zinc/34/61/23/197346123.db2.gz	DOHKGZDUWNFORQ-LLVKDONJSA-N	0	3	310.195	2.434	10	0		DEAEHN
CN(C)[C@@H]1CCN(c2nc(-c3ccccc3)c(CO)s2)C1	ZINC000110276167	194319290	/nfs/dbraw/zinc/31/92/90/194319290.db2.gz	PUIOXMIZQVVDSC-CYBMUJFWSA-N	0	3	303.431	2.443	10	0		DEAEHN
C[NH2+][C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccncc2C)cc1	ZINC000111043917	194386643	/nfs/dbraw/zinc/38/66/43/194386643.db2.gz	RXXHAAOYVTVLFZ-LBPRGKRZSA-N	0	3	305.403	2.471	10	0		DEAEHN
CCOCCN(CC)S(=O)(=O)c1cccc([C@H](C)NC)c1	ZINC000111125611	194392955	/nfs/dbraw/zinc/39/29/55/194392955.db2.gz	CGEKEFQBUSNEDK-ZDUSSCGKSA-N	0	3	314.451	2.014	10	0		DEAEHN
C[C@@](O)(Cc1ccccc1Br)C[C@@H]1COCCN1	ZINC000156802796	197142232	/nfs/dbraw/zinc/14/22/32/197142232.db2.gz	MOLLLXGQRMEHAS-TZMCWYRMSA-N	0	3	314.223	2.121	10	0		DEAEHN
CN(CC1CCOCC1)[C@H](CN)c1cc(F)c(F)c(F)c1	ZINC000111159914	194398099	/nfs/dbraw/zinc/39/80/99/194398099.db2.gz	SNPAFLHBTWRZPN-CQSZACIVSA-N	0	3	302.340	2.462	10	0		DEAEHN
CC(=O)N1CCC(NC(=O)CN2CCC[C@H]2CC(C)(C)C)CC1	ZINC000057863634	184058394	/nfs/dbraw/zinc/05/83/94/184058394.db2.gz	FKGFUJBHICEHAV-INIZCTEOSA-N	0	3	323.481	2.014	10	0		DEAEHN
CNC(=O)C[C@H](C)NCc1ccc(Br)c(F)c1	ZINC000269023773	207172248	/nfs/dbraw/zinc/17/22/48/207172248.db2.gz	QFZMRZDOWMZYRN-QMMMGPOBSA-N	0	3	303.175	2.202	10	0		DEAEHN
CN(C)CCOC(=O)c1ccc(NC(=O)c2ccco2)cc1	ZINC000059313237	184136960	/nfs/dbraw/zinc/13/69/60/184136960.db2.gz	KZRWGQYLVOQKHU-UHFFFAOYSA-N	0	3	302.330	2.250	10	0		DEAEHN
COc1ccc(C)cc1NC(=O)CN1CCCN(C2CC2)CC1	ZINC000061040948	184160171	/nfs/dbraw/zinc/16/01/71/184160171.db2.gz	RWNYITPGUGICJP-UHFFFAOYSA-N	0	3	317.433	2.112	10	0		DEAEHN
CCNC(C)(C)C(=O)Nc1cc(S(C)(=O)=O)ccc1Cl	ZINC000061290884	184167700	/nfs/dbraw/zinc/16/77/00/184167700.db2.gz	OJMVZXBVLYCSLI-UHFFFAOYSA-N	0	3	318.826	2.070	10	0		DEAEHN
CCCOc1nc(Cl)nc(N[C@@H](CN(C)C)C(C)C)n1	ZINC000061539285	184173523	/nfs/dbraw/zinc/17/35/23/184173523.db2.gz	AXGXYIIYVJWHRA-JTQLQIEISA-N	0	3	301.822	2.312	10	0		DEAEHN
Cc1nn(C)c(Cl)c1/C=C/C(=O)N1CCCN(C2CC2)CC1	ZINC000061604952	184177480	/nfs/dbraw/zinc/17/74/80/184177480.db2.gz	DNWJUGWYVFKWOE-VOTSOKGWSA-N	0	3	322.840	2.092	10	0		DEAEHN
CN(CCC(N)=S)C(=O)CN1CCC2(CCCCC2)CC1	ZINC000061820032	184188323	/nfs/dbraw/zinc/18/83/23/184188323.db2.gz	JAMHYJVMPAQBRB-UHFFFAOYSA-N	0	3	311.495	2.167	10	0		DEAEHN
CN[C@H](C)c1cnc(N2CCN(CC(F)(F)F)CC2)s1	ZINC000061948522	184197734	/nfs/dbraw/zinc/19/77/34/184197734.db2.gz	YGGNFPKZBYKQAN-SECBINFHSA-N	0	3	308.373	2.108	10	0		DEAEHN
C[C@@H](c1cccc(Cl)c1)N(C)CC(=O)N1CCCNCC1	ZINC000062014483	184201271	/nfs/dbraw/zinc/20/12/71/184201271.db2.gz	NLGJTYCCKDIKST-ZDUSSCGKSA-N	0	3	309.841	2.155	10	0		DEAEHN
CC[C@@H](O)COc1c(Cl)cc(CNCCOC)cc1OC	ZINC000062727883	184250800	/nfs/dbraw/zinc/25/08/00/184250800.db2.gz	QDXPKPQDTMRFRA-GFCCVEGCSA-N	0	3	317.813	2.234	10	0		DEAEHN
COCCNCc1c(N2CCC(C)CC2)nc2sccn12	ZINC000062734050	184251294	/nfs/dbraw/zinc/25/12/94/184251294.db2.gz	LGNDNXSRAOFPTJ-UHFFFAOYSA-N	0	3	308.451	2.368	10	0		DEAEHN
CCC1(CC)CCN(S(=O)(=O)C[C@@H]2CCCCN2)CC1	ZINC000062960075	184262588	/nfs/dbraw/zinc/26/25/88/184262588.db2.gz	PGPHHLBIWRXOMX-AWEZNQCLSA-N	0	3	302.484	2.361	10	0		DEAEHN
Cc1ccc(F)c(S(=O)(=O)[N-][C@@H]2CCCCC[C@@H]2[NH3+])c1	ZINC000063213456	184278334	/nfs/dbraw/zinc/27/83/34/184278334.db2.gz	VAIOYIGRYXMMTH-QWHCGFSZSA-N	0	3	300.399	2.072	10	0		DEAEHN
CN(C)[C@H]1CCN(CC(=O)c2ccccc2Br)C1	ZINC000062966601	184263126	/nfs/dbraw/zinc/26/31/26/184263126.db2.gz	ABGXGWKGLQAVHW-NSHDSACASA-N	0	3	311.223	2.268	10	0		DEAEHN
CC[NH2+][C@H](C)c1cccc([N-]S(=O)(=O)C[C@@H]2CCCO2)c1	ZINC000063155736	184274875	/nfs/dbraw/zinc/27/48/75/184274875.db2.gz	MAGVGVCDXKTYGX-DOMZBBRYSA-N	0	3	312.435	2.278	10	0		DEAEHN
CC[C@@H](C)NCC(=O)Nc1ccc(CCC(=O)N(C)C)cc1	ZINC000066068230	184386265	/nfs/dbraw/zinc/38/62/65/184386265.db2.gz	KHMKKCADZZUXQW-CYBMUJFWSA-N	0	3	305.422	2.034	10	0		DEAEHN
C[C@@H](C[C@@](C)(N)C(N)=O)Sc1ccc(C(F)(F)F)cn1	ZINC000068635525	184494637	/nfs/dbraw/zinc/49/46/37/184494637.db2.gz	HYGTYIHRABVANL-WRWORJQWSA-N	0	3	307.341	2.174	10	0		DEAEHN
CCCNCc1cc(OC)ccc1OC[C@H](O)C(F)(F)F	ZINC000068875821	184498616	/nfs/dbraw/zinc/49/86/16/184498616.db2.gz	KOVJOEINVQAQIH-ZDUSSCGKSA-N	0	3	307.312	2.497	10	0		DEAEHN
O=C1[C@@H](N[C@@H]2CCCc3ccccc32)CCN1C1CCOCC1	ZINC000358190444	284980380	/nfs/dbraw/zinc/98/03/80/284980380.db2.gz	NXMMTRVINIUMAN-MSOLQXFVSA-N	0	3	314.429	2.434	10	0		DEAEHN
CCc1ccc([C@H](C)N[C@@H](C)C(=O)NC(=O)NC2CC2)cc1	ZINC000119672600	195014489	/nfs/dbraw/zinc/01/44/89/195014489.db2.gz	RACQJEMCEBMHAU-RYUDHWBXSA-N	0	3	303.406	2.276	10	0		DEAEHN
C[C@@H](N[C@@H]1CCN(c2ncccc2Cl)C1)c1cnn(C)c1	ZINC000119967986	195071969	/nfs/dbraw/zinc/07/19/69/195071969.db2.gz	WQEGHWMUNACSAU-DGCLKSJQSA-N	0	3	305.813	2.398	10	0		DEAEHN
c1nc(N2CCCC2)ncc1CN1CCC[C@H]2COCC[C@@H]21	ZINC000538790547	285056112	/nfs/dbraw/zinc/05/61/12/285056112.db2.gz	ITIOLBNPVZJFOV-HOTGVXAUSA-N	0	3	302.422	2.078	10	0		DEAEHN
COCOc1ccc(OC)cc1CNC[C@@H]1CCCC[C@@H]1O	ZINC000120070329	195090808	/nfs/dbraw/zinc/09/08/08/195090808.db2.gz	IQXGIIKXPPRHPU-BBRMVZONSA-N	0	3	309.406	2.319	10	0		DEAEHN
N[C@H](c1cc(F)cc(C(F)(F)F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000159215513	197337365	/nfs/dbraw/zinc/33/73/65/197337365.db2.gz	KLFZBSYOXQUJBR-HQJQHLMTSA-N	0	3	311.300	2.279	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1ccccc1OC(F)(F)F	ZINC000159103242	197327377	/nfs/dbraw/zinc/32/73/77/197327377.db2.gz	RKHJMSSCIKMQCF-SECBINFHSA-N	0	3	306.284	2.278	10	0		DEAEHN
Cc1cc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)nn1C(C)(C)C	ZINC000159071689	197324893	/nfs/dbraw/zinc/32/48/93/197324893.db2.gz	MURWMMXXBXNGMB-WFASDCNBSA-N	0	3	306.454	2.405	10	0		DEAEHN
O=C1NCCCC[C@@H]1N1CCC(OCCc2ccccc2)CC1	ZINC000120227475	195123113	/nfs/dbraw/zinc/12/31/13/195123113.db2.gz	CTJADFWWYUAEPX-SFHVURJKSA-N	0	3	316.445	2.379	10	0		DEAEHN
Cc1ccc([C@@H](CN)N(C)[C@@H]2CCOC2)c(Br)c1	ZINC000158646173	197290954	/nfs/dbraw/zinc/29/09/54/197290954.db2.gz	IYJJTERMEXUWJV-BXUZGUMPSA-N	0	3	313.239	2.478	10	0		DEAEHN
CC1(C)CN(C[C@@H](O)c2ccc(C(N)=S)cc2)CCS1	ZINC000158782950	197301293	/nfs/dbraw/zinc/30/12/93/197301293.db2.gz	ZKCBRNHVIARBDI-CYBMUJFWSA-N	0	3	310.488	2.182	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)cc(CN)c1F	ZINC000158761708	197299491	/nfs/dbraw/zinc/29/94/91/197299491.db2.gz	ZNGGSEMMSBQQJE-RYUDHWBXSA-N	0	3	312.410	2.013	10	0		DEAEHN
COc1cnn(C)c1[C@H](N)Cc1ccc(Br)cc1	ZINC000158398238	197269159	/nfs/dbraw/zinc/26/91/59/197269159.db2.gz	VDFBYHZYBQCRDN-LLVKDONJSA-N	0	3	310.195	2.434	10	0		DEAEHN
CCS(=O)(=O)NCCN[C@@H](C)c1ccc(CC(C)C)cc1	ZINC000158306367	197261079	/nfs/dbraw/zinc/26/10/79/197261079.db2.gz	IDBZOSKGBVRMMF-AWEZNQCLSA-N	0	3	312.479	2.475	10	0		DEAEHN
CCOCCN(C)[C@H](CN)c1ccc(Br)cc1	ZINC000157720784	197210257	/nfs/dbraw/zinc/21/02/57/197210257.db2.gz	VHPWGBSVSUSVIU-CYBMUJFWSA-N	0	3	301.228	2.417	10	0		DEAEHN
CCCn1ncc(Br)c1[C@@H](O)C(C)(C)N(C)C	ZINC000157586369	197200180	/nfs/dbraw/zinc/20/01/80/197200180.db2.gz	MDUWLJVDVLLATI-LLVKDONJSA-N	0	3	304.232	2.429	10	0		DEAEHN
CC(C)(C)[C@@H](N)C(=O)N1CCN(c2ccccc2Cl)CC1	ZINC000157626154	197203039	/nfs/dbraw/zinc/20/30/39/197203039.db2.gz	ZIEVCKJCRRPLAV-AWEZNQCLSA-N	0	3	309.841	2.362	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)[C@@H](CN)C1	ZINC000157293953	197177163	/nfs/dbraw/zinc/17/71/63/197177163.db2.gz	XTHMJGXGVURWCJ-HNNXBMFYSA-N	0	3	305.422	2.067	10	0		DEAEHN
CN(C)c1nc(CN2CCN(CC3CCCCC3)CC2)ns1	ZINC000156387887	197109581	/nfs/dbraw/zinc/10/95/81/197109581.db2.gz	PCSSDOUNBFUSCW-UHFFFAOYSA-N	0	3	323.510	2.302	10	0		DEAEHN
OCC1(NCC2=Cc3cc(Br)ccc3OC2)CC1	ZINC000120361040	195150669	/nfs/dbraw/zinc/15/06/69/195150669.db2.gz	IVIROFCXKCCAOS-UHFFFAOYSA-N	0	3	310.191	2.339	10	0		DEAEHN
C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)c1coc(Br)c1	ZINC000120882550	195257159	/nfs/dbraw/zinc/25/71/59/195257159.db2.gz	FMWKGZQKSLINES-ONGXEEELSA-N	0	3	315.211	2.454	10	0		DEAEHN
COC(=O)[C@@H](C)[C@H](NCCC(=O)NC(C)C)c1ccccc1	ZINC000152095454	196771763	/nfs/dbraw/zinc/77/17/63/196771763.db2.gz	HZPHAGUGZQODFR-BBRMVZONSA-N	0	3	306.406	2.041	10	0		DEAEHN
Cc1ccsc1CN1CCOC[C@@H](CC(=O)N(C)C)[C@@H]1C	ZINC000247997815	257112255	/nfs/dbraw/zinc/11/22/55/257112255.db2.gz	MYKGXELWCOLFOF-UONOGXRCSA-N	0	3	310.463	2.372	10	0		DEAEHN
Fc1cnc(N2CCO[C@@H]3CN(CC4CCCCC4)C[C@@H]32)nc1	ZINC000253614727	257104255	/nfs/dbraw/zinc/10/42/55/257104255.db2.gz	VYNYFEXQXHBWHW-JKSUJKDBSA-N	0	3	320.412	2.085	10	0		DEAEHN
COCCCN1C[C@@]2(C[C@H]2N)c2cc(Br)ccc21	ZINC000725247286	542770097	/nfs/dbraw/zinc/77/00/97/542770097.db2.gz	LUINRVMLHZSZST-KGLIPLIRSA-N	0	3	311.223	2.274	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCC[C@](CN)(C(=O)OC(C)(C)C)C1	ZINC000725243962	542770221	/nfs/dbraw/zinc/77/02/21/542770221.db2.gz	BUVGPYGKTYFGAZ-MRXNPFEDSA-N	0	3	314.426	2.304	10	0		DEAEHN
C[C@@H]1CCOCCN1C[C@H](O)COc1cccc2[nH]ccc21	ZINC000362235380	133218945	/nfs/dbraw/zinc/21/89/45/133218945.db2.gz	KMMBHCKRMJESEH-KGLIPLIRSA-N	0	3	304.390	2.018	10	0		DEAEHN
c1ccc(-n2nnnc2CCN2CC[C@H](c3cccnc3)C2)cc1	ZINC000564080996	292085215	/nfs/dbraw/zinc/08/52/15/292085215.db2.gz	VQFHWPJKOPRCGD-INIZCTEOSA-N	0	3	320.400	2.089	10	0		DEAEHN
C[C@@H](NCCOCC1CCC1)c1ccc(-n2cnnn2)cc1	ZINC000564695177	292105065	/nfs/dbraw/zinc/10/50/65/292105065.db2.gz	YOUYEMLGDJCXSO-CYBMUJFWSA-N	0	3	301.394	2.130	10	0		DEAEHN
O=C([C@@H]1C[C@H]1c1c(F)cccc1F)N1CCN2CCC1CC2	ZINC000188667520	145015807	/nfs/dbraw/zinc/01/58/07/145015807.db2.gz	OXDHRKULWMIIKV-CHWSQXEVSA-N	0	3	306.356	2.375	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2cc(C)c(O)c(C)c2)C1	ZINC000188892615	145019119	/nfs/dbraw/zinc/01/91/19/145019119.db2.gz	DRTMWTTZGDCMFT-MRXNPFEDSA-N	0	3	319.449	2.335	10	0		DEAEHN
CCN(CC)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000188956824	145020022	/nfs/dbraw/zinc/02/00/22/145020022.db2.gz	HMXURWAAFKYAMQ-SFHVURJKSA-N	0	3	319.449	2.017	10	0		DEAEHN
COc1ccc(O)cc1C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000189187813	145023805	/nfs/dbraw/zinc/02/38/05/145023805.db2.gz	UIXPZLPTZLYGEE-ZDUSSCGKSA-N	0	3	306.406	2.395	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2C2CC2)C1	ZINC000190619913	145045076	/nfs/dbraw/zinc/04/50/76/145045076.db2.gz	XQBLJXAOHSUBRC-CGTJXYLNSA-N	0	3	313.445	2.408	10	0		DEAEHN
Cc1nsc(N2CCCN(C[C@H](O)CC3CCCC3)CC2)n1	ZINC000191349402	145056449	/nfs/dbraw/zinc/05/64/49/145056449.db2.gz	SJEJEIMQVATEND-OAHLLOKOSA-N	0	3	324.494	2.300	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC(c3ccncc3)CC2)C1	ZINC000192344621	145072684	/nfs/dbraw/zinc/07/26/84/145072684.db2.gz	DYQIEPNSGUUVJX-QGZVFWFLSA-N	0	3	316.449	2.455	10	0		DEAEHN
CCCCOc1ccc(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)c([O-])c1	ZINC000192494104	145074210	/nfs/dbraw/zinc/07/42/10/145074210.db2.gz	MGFUEFFZUPDELS-OKILXGFUSA-N	0	3	318.417	2.205	10	0		DEAEHN
CCCCOc1ccc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c([O-])c1	ZINC000192494104	145074213	/nfs/dbraw/zinc/07/42/13/145074213.db2.gz	MGFUEFFZUPDELS-OKILXGFUSA-N	0	3	318.417	2.205	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC[C@H](n2ccnc2CC)C1	ZINC000193379774	145085945	/nfs/dbraw/zinc/08/59/45/145085945.db2.gz	YDGKGCBBKVBBHY-JKSUJKDBSA-N	0	3	309.454	2.260	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NC[C@H]2CCCO[C@H]2C(C)(C)C)C1	ZINC000246301815	145097912	/nfs/dbraw/zinc/09/79/12/145097912.db2.gz	FICXVLWVRQCNCM-RBSFLKMASA-N	0	3	311.470	2.173	10	0		DEAEHN
CCCCO[C@@H]1C[C@H](NC(=O)N2CC[C@@H](N(C)C)C2)C1(C)C	ZINC000246322526	145098419	/nfs/dbraw/zinc/09/84/19/145098419.db2.gz	AQQDGKZZDPUTRK-QLFBSQMISA-N	0	3	311.470	2.316	10	0		DEAEHN
CCN(CC)[C@@H](C(=O)N1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000246370084	145100501	/nfs/dbraw/zinc/10/05/01/145100501.db2.gz	GMBARYSWMSLSII-ZWKOTPCHSA-N	0	3	315.461	2.376	10	0		DEAEHN
O=C(CN1CC[C@@H]2OCCC[C@H]2C1)N1CCc2sccc2C1	ZINC000246554210	145106573	/nfs/dbraw/zinc/10/65/73/145106573.db2.gz	GZMFKSZNLPLGAK-ZFWWWQNUSA-N	0	3	320.458	2.134	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)N1CC[C@@H]2OCCC[C@H]2C1	ZINC000246630732	145108534	/nfs/dbraw/zinc/10/85/34/145108534.db2.gz	KHXFRERIJPUGPQ-BBWFWOEESA-N	0	3	323.481	2.461	10	0		DEAEHN
C[C@H](CNC(=O)[C@H](C)N1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000246777170	145113513	/nfs/dbraw/zinc/11/35/13/145113513.db2.gz	ZBHRVIDQJHKONQ-RYRKJORJSA-N	0	3	315.461	2.075	10	0		DEAEHN
CC[C@@H](Oc1ccccc1F)C(=O)N1CCN2CCC[C@H]2C1	ZINC000246843943	145116413	/nfs/dbraw/zinc/11/64/13/145116413.db2.gz	LKIPEYXRITYHDH-DZGCQCFKSA-N	0	3	306.381	2.290	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@H](C)C(=O)NCCC(C)C	ZINC000246944840	145120195	/nfs/dbraw/zinc/12/01/95/145120195.db2.gz	HTBYNHCDOQGFCI-ZBFHGGJFSA-N	0	3	306.454	2.207	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@H](C)C(=O)N1CCCCC1	ZINC000246986748	145121798	/nfs/dbraw/zinc/12/17/98/145121798.db2.gz	JZPPVHBJRQMEBI-GDBMZVCRSA-N	0	3	304.438	2.057	10	0		DEAEHN
CC(C)[N@@H+]1C[C@@H](C)[C@H](NC(=O)NCc2ccc([O-])c(F)c2)C1	ZINC000246997591	145122065	/nfs/dbraw/zinc/12/20/65/145122065.db2.gz	GTMIFVMGOFQKEA-BXUZGUMPSA-N	0	3	309.385	2.059	10	0		DEAEHN
CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NCc2ccc([O-])c(F)c2)C1	ZINC000246997591	145122067	/nfs/dbraw/zinc/12/20/67/145122067.db2.gz	GTMIFVMGOFQKEA-BXUZGUMPSA-N	0	3	309.385	2.059	10	0		DEAEHN
CC[C@H](COC)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1	ZINC000247056447	145125120	/nfs/dbraw/zinc/12/51/20/145125120.db2.gz	NNGSWJWKMPDMAG-OFQRWUPVSA-N	0	3	307.438	2.210	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN([C@H](C)C(=O)N(CC)CC)C1	ZINC000247082865	145125728	/nfs/dbraw/zinc/12/57/28/145125728.db2.gz	HCIABRFJAJXSDY-HUUCEWRRSA-N	0	3	306.454	2.339	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)N[C@H]1CCCN(c2ccccc2)C1	ZINC000247073742	145126150	/nfs/dbraw/zinc/12/61/50/145126150.db2.gz	CJENRFHQIBKKRO-RDJZCZTQSA-N	0	3	316.449	2.049	10	0		DEAEHN
CCCCNC(=O)[C@H](C)N1CCC[C@@H](n2ccnc2CC)C1	ZINC000247143877	145127538	/nfs/dbraw/zinc/12/75/38/145127538.db2.gz	LCJLKVIEKQWQAT-LSDHHAIUSA-N	0	3	306.454	2.387	10	0		DEAEHN
CCOC[C@@H]1CCCN(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)C1	ZINC000247480120	145138511	/nfs/dbraw/zinc/13/85/11/145138511.db2.gz	WAGCIAIRZZOZBT-OAGGEKHMSA-N	0	3	311.470	2.173	10	0		DEAEHN
Cc1cccc(OC[C@H](C)NC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000247648835	145142679	/nfs/dbraw/zinc/14/26/79/145142679.db2.gz	WBNJXAGGYPYCOP-HOTGVXAUSA-N	0	3	317.433	2.252	10	0		DEAEHN
CC[C@@H](NC(=O)N1CCN2CCC[C@H]2C1)c1nc(C)cs1	ZINC000247649666	145142797	/nfs/dbraw/zinc/14/27/97/145142797.db2.gz	WFJJNDOUPUTPRQ-QWHCGFSZSA-N	0	3	308.451	2.392	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NC[C@H](C)c1nccs1	ZINC000248553730	145158410	/nfs/dbraw/zinc/15/84/10/145158410.db2.gz	HOMWXXRQEMWRFJ-QWHCGFSZSA-N	0	3	310.467	2.372	10	0		DEAEHN
CC[C@@H]1CN(CCCc2ccccc2OC)CCN1C[C@H](C)O	ZINC000248588785	145160129	/nfs/dbraw/zinc/16/01/29/145160129.db2.gz	RJNVQVSKRYUOEF-FUHWJXTLSA-N	0	3	320.477	2.405	10	0		DEAEHN
C[C@@H](CNC(=O)[C@H](C)N[C@H](C)[C@@H]1CCCO1)c1ccccc1	ZINC000248862407	145170888	/nfs/dbraw/zinc/17/08/88/145170888.db2.gz	WHGWVCOTIXPIIR-IVSAIRAKSA-N	0	3	304.434	2.452	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCSCC1	ZINC000248884911	145172185	/nfs/dbraw/zinc/17/21/85/145172185.db2.gz	SAANZHUZBHYYBD-GDBMZVCRSA-N	0	3	319.474	2.265	10	0		DEAEHN
CCCC[C@@H](C(=O)OC)N1CCC[C@@H](Cc2nccn2C)C1	ZINC000252744180	145200940	/nfs/dbraw/zinc/20/09/40/145200940.db2.gz	VXSAECIQRJLYNZ-GJZGRUSLSA-N	0	3	307.438	2.406	10	0		DEAEHN
Fc1ccc(OCCN2CCNC[C@@H]2c2cccnc2)cc1	ZINC000261602004	145209302	/nfs/dbraw/zinc/20/93/02/145209302.db2.gz	AMKTVQRZNRSKDP-QGZVFWFLSA-N	0	3	301.365	2.246	10	0		DEAEHN
O=C(NC1CCN(c2ccccn2)CC1)c1ccc2c(c1)CNC2	ZINC000261684355	145216268	/nfs/dbraw/zinc/21/62/68/145216268.db2.gz	NBQVQLDAQXOZFB-UHFFFAOYSA-N	0	3	322.412	2.084	10	0		DEAEHN
N[C@@H](C(=O)Nc1ccc(Br)cc1)C1CCOCC1	ZINC000261772363	145225279	/nfs/dbraw/zinc/22/52/79/145225279.db2.gz	FUAJKEFDVSIGPU-GFCCVEGCSA-N	0	3	313.195	2.142	10	0		DEAEHN
N[C@H](C(=O)N1CCC(Cc2ccccc2)CC1)C1CCOCC1	ZINC000261809463	145228863	/nfs/dbraw/zinc/22/88/63/145228863.db2.gz	OPHBPLZNXNMKTA-SFHVURJKSA-N	0	3	316.445	2.222	10	0		DEAEHN
C[C@H](NC(=O)C[C@@H]1CNCCO1)c1ccc(C(F)(F)F)cc1	ZINC000262113586	145263295	/nfs/dbraw/zinc/26/32/95/145263295.db2.gz	JYIAJEDUIIBZRY-GXFFZTMASA-N	0	3	316.323	2.261	10	0		DEAEHN
CCc1ccc(CNC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)s1	ZINC000262419564	145282690	/nfs/dbraw/zinc/28/26/90/145282690.db2.gz	DWCDAQWKNKMCQB-JJRVBVJISA-N	0	3	322.474	2.459	10	0		DEAEHN
CN(CCc1cccs1)C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C	ZINC000262575843	145294359	/nfs/dbraw/zinc/29/43/59/145294359.db2.gz	YDDCRIQRWJSAOU-JJRVBVJISA-N	0	3	322.474	2.282	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-]CC[C@@H]2CC[NH2+]C2)c(Cl)cc1F	ZINC000262726842	145301901	/nfs/dbraw/zinc/30/19/01/145301901.db2.gz	BCOMCJNDEMWHON-JTQLQIEISA-N	0	3	320.817	2.065	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(/C=C/c2ccc(Cl)cc2)n1	ZINC000263140676	145329057	/nfs/dbraw/zinc/32/90/57/145329057.db2.gz	CHKDPKPGAFFILK-LVDDQXARSA-N	0	3	304.781	2.470	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2CCC[C@@H](C(F)(F)F)C2)n1	ZINC000263169306	145331664	/nfs/dbraw/zinc/33/16/64/145331664.db2.gz	FOIVYOOQUYHTKR-GMTAPVOTSA-N	0	3	318.343	2.482	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(CCSc2ccc(F)cc2)n1	ZINC000263193508	145334803	/nfs/dbraw/zinc/33/48/03/145334803.db2.gz	IDQMAEYHMLCOGY-ZDUSSCGKSA-N	0	3	322.409	2.120	10	0		DEAEHN
C[C@H](C(=O)N[C@H]1CCCC[C@H]1C)N1CCC[C@@H](c2nc[nH]n2)C1	ZINC000332966679	145393035	/nfs/dbraw/zinc/39/30/35/145393035.db2.gz	OXIPZDXPIYUUQT-TUVASFSCSA-N	0	3	319.453	2.068	10	0		DEAEHN
c1ccc(N2CCO[C@@H](CN3CCC[C@]4(CCOC4)C3)C2)cc1	ZINC000565174491	292140943	/nfs/dbraw/zinc/14/09/43/292140943.db2.gz	WYWRRLKRWHXHDN-OALUTQOASA-N	0	3	316.445	2.394	10	0		DEAEHN
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C1CCC(=O)CC1	ZINC000348802192	146310362	/nfs/dbraw/zinc/31/03/62/146310362.db2.gz	MBLZWIZZZRATMV-MRXNPFEDSA-N	0	3	314.429	2.384	10	0		DEAEHN
O[C@@H](CCNCc1cn2cc(Cl)ccc2n1)C(F)(F)F	ZINC000349317151	146367227	/nfs/dbraw/zinc/36/72/27/146367227.db2.gz	PLLULTRMKQFNDL-JTQLQIEISA-N	0	3	307.703	2.391	10	0		DEAEHN
CN(C)C1(CNC(=O)NC[C@](C)(O)C2CCCCC2)CCC1	ZINC000359303869	147302761	/nfs/dbraw/zinc/30/27/61/147302761.db2.gz	JUHWSDMJWJVLKQ-INIZCTEOSA-N	0	3	311.470	2.101	10	0		DEAEHN
CCOCc1nc([C@H](C)NC(=O)[C@H](C)N2[C@@H](C)CC[C@@H]2C)no1	ZINC000359506322	147339773	/nfs/dbraw/zinc/33/97/73/147339773.db2.gz	MBRNGKWKAQGLFL-CYDGBPFRSA-N	0	3	324.425	2.045	10	0		DEAEHN
COc1ccc2c(c1)[C@@](O)(CNCc1c[nH]nc1C)CCC2	ZINC000371358263	148092821	/nfs/dbraw/zinc/09/28/21/148092821.db2.gz	YZIOOHUMCWRKMC-KRWDZBQOSA-N	0	3	301.390	2.040	10	0		DEAEHN
COc1ccc2c(c1)[C@](O)(CNCc1c[nH]nc1C)CCC2	ZINC000371358264	148092839	/nfs/dbraw/zinc/09/28/39/148092839.db2.gz	YZIOOHUMCWRKMC-QGZVFWFLSA-N	0	3	301.390	2.040	10	0		DEAEHN
CC(C)n1nccc1CNC[C@H]1CCC2(CCOCC2)[C@H]1O	ZINC000374684625	148277325	/nfs/dbraw/zinc/27/73/25/148277325.db2.gz	AQJWBHURFSNTGP-ZBFHGGJFSA-N	0	3	307.438	2.121	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@@H](C)c1ccc(C)cc1	ZINC000111833637	401725180	/nfs/dbraw/zinc/72/51/80/401725180.db2.gz	JMZFEBAAASMREB-RDJZCZTQSA-N	0	3	319.449	2.466	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2ccc3c(c2)CCC(=O)N3)CCN1C	ZINC000127462317	401736457	/nfs/dbraw/zinc/73/64/57/401736457.db2.gz	JUXAOEFXOFQNDV-DOMZBBRYSA-N	0	3	315.417	2.126	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2csc(-c3ccco3)n2)CCO1	ZINC000071878847	401691241	/nfs/dbraw/zinc/69/12/41/401691241.db2.gz	KEGCURWXSNWOKC-CYBMUJFWSA-N	0	3	307.419	2.166	10	0		DEAEHN
COc1ccc(CN2CC[C@@H](c3cnn(C)c3)C2)c(OC)c1	ZINC000128351103	401773128	/nfs/dbraw/zinc/77/31/28/401773128.db2.gz	ICUCYDRAGDEWFU-CYBMUJFWSA-N	0	3	301.390	2.427	10	0		DEAEHN
CCc1ccc(N2CCN(CCC(=O)NC(C)C)CC2)cc1	ZINC000076060624	401779737	/nfs/dbraw/zinc/77/97/37/401779737.db2.gz	MTVSHVXZCBWDEC-UHFFFAOYSA-N	0	3	303.450	2.286	10	0		DEAEHN
Cc1cnn(CCN[C@@H]2CCCN(c3cccc(F)c3)C2=O)c1	ZINC000115542906	401831083	/nfs/dbraw/zinc/83/10/83/401831083.db2.gz	CRZTXQWOVFHCKW-MRXNPFEDSA-N	0	3	316.380	2.116	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@@H](c2cnn(C)c2)C1)N1CCCCCC1	ZINC000116116540	401842512	/nfs/dbraw/zinc/84/25/12/401842512.db2.gz	UWCHPLJAAYBREW-HUUCEWRRSA-N	0	3	304.438	2.001	10	0		DEAEHN
COc1ccccc1CC1CCN([C@H]2CCN(C)C2=O)CC1	ZINC000116276147	401847438	/nfs/dbraw/zinc/84/74/38/401847438.db2.gz	LQZHOBMJHVAZEF-INIZCTEOSA-N	0	3	302.418	2.180	10	0		DEAEHN
Cn1cc([C@@H]2CCN(C[C@H](O)c3ccc(F)cc3F)C2)cn1	ZINC000116313745	401849328	/nfs/dbraw/zinc/84/93/28/401849328.db2.gz	NDJKUWFJEGMBAQ-BZNIZROVSA-N	0	3	307.344	2.221	10	0		DEAEHN
C[C@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)[C@H]1CCCO1	ZINC000078434838	401851061	/nfs/dbraw/zinc/85/10/61/401851061.db2.gz	TWPXMWJWRXQPKD-CWRNSKLLSA-N	0	3	305.422	2.156	10	0		DEAEHN
CC[C@H](Sc1ccccc1)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000116783278	401858558	/nfs/dbraw/zinc/85/85/58/401858558.db2.gz	RMOSUZFDSWDAAJ-HOCLYGCPSA-N	0	3	322.474	2.346	10	0		DEAEHN
C[C@H]1OCC[C@H]1NCC(=O)Nc1ccccc1Br	ZINC000135295148	401934417	/nfs/dbraw/zinc/93/44/17/401934417.db2.gz	HCBNUCSJHPGJBS-MWLCHTKSSA-N	0	3	313.195	2.155	10	0		DEAEHN
CC[C@@H]1CCCN(C(=O)NC[C@H]2CCCN2CCOC)CC1	ZINC000117495182	401878168	/nfs/dbraw/zinc/87/81/68/401878168.db2.gz	HXZQHVMJZZTNKN-HZPDHXFCSA-N	0	3	311.470	2.319	10	0		DEAEHN
C[C@H](NC(=O)NCCN(C)C)c1ccccc1Br	ZINC000133342240	401882781	/nfs/dbraw/zinc/88/27/81/401882781.db2.gz	UFZDOLMWDHIIEZ-JTQLQIEISA-N	0	3	314.227	2.371	10	0		DEAEHN
CCNC(=O)CNC1CC(c2cccc(Br)c2)C1	ZINC000036850105	401908217	/nfs/dbraw/zinc/90/82/17/401908217.db2.gz	AIUGSEHOEKITKI-UHFFFAOYSA-N	0	3	311.223	2.421	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)Nc2ccc(Cl)c(F)c2)CCO1	ZINC000118805118	401908974	/nfs/dbraw/zinc/90/89/74/401908974.db2.gz	KEKWHDJIHSUPFN-NSHDSACASA-N	0	3	315.776	2.273	10	0		DEAEHN
CCC[C@](C)(CO)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000086369831	401922565	/nfs/dbraw/zinc/92/25/65/401922565.db2.gz	IBGZOEXYOTZTEI-FUHWJXTLSA-N	0	3	321.465	2.010	10	0		DEAEHN
C[C@@H](N[C@H]1CCCN(c2cccnn2)C1)c1cncc(F)c1	ZINC000089732203	401959398	/nfs/dbraw/zinc/95/93/98/401959398.db2.gz	UWCHAPMSUQTHGJ-DOMZBBRYSA-N	0	3	301.369	2.330	10	0		DEAEHN
C[C@]1(CNC(=O)N2CCOCC2)CCCN1Cc1ccccc1	ZINC000119692295	401963448	/nfs/dbraw/zinc/96/34/48/401963448.db2.gz	DYJRTVRKQAEIJZ-GOSISDBHSA-N	0	3	317.433	2.083	10	0		DEAEHN
CCCCOC(=O)CCN1CC[C@H]2[C@H](CCC(=O)N2C2CC2)C1	ZINC000119756365	401965802	/nfs/dbraw/zinc/96/58/02/401965802.db2.gz	XXDNVZPVJGLYHG-ZBFHGGJFSA-N	0	3	322.449	2.195	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@H](C)N1CCC[C@H](Cc2nccn2C)C1	ZINC000090004011	401978904	/nfs/dbraw/zinc/97/89/04/401978904.db2.gz	ZVHDNHWBENUSQJ-HRCADAONSA-N	0	3	320.481	2.368	10	0		DEAEHN
CCCn1cc(CN(C)[C@@H]2CCCN(c3cccnn3)C2)cn1	ZINC000120213561	401982672	/nfs/dbraw/zinc/98/26/72/401982672.db2.gz	MRGBTDXOJWCMOG-MRXNPFEDSA-N	0	3	314.437	2.184	10	0		DEAEHN
C[C@@H](NC[C@@H](O)Cn1cccn1)c1ccccc1Br	ZINC000148932526	401992145	/nfs/dbraw/zinc/99/21/45/401992145.db2.gz	BKZQFFJRISULIJ-VXGBXAGGSA-N	0	3	324.222	2.357	10	0		DEAEHN
CCCc1cc(NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)n(C)n1	ZINC000091093891	401993030	/nfs/dbraw/zinc/99/30/30/401993030.db2.gz	KXAQISZNWICVFF-TZMCWYRMSA-N	0	3	307.442	2.319	10	0		DEAEHN
COc1ccc([C@H](C)NC(=O)C[C@@H]2CSCCN2)cc1F	ZINC000091135120	401994536	/nfs/dbraw/zinc/99/45/36/401994536.db2.gz	UUFOJWBBFDJNJM-CMPLNLGQSA-N	0	3	312.410	2.107	10	0		DEAEHN
CCCOc1cccc(CN2CCN(C[C@@H](C)O)[C@H](C)C2)c1	ZINC000120640472	401996607	/nfs/dbraw/zinc/99/66/07/401996607.db2.gz	LPMWLTDTOAIVAZ-HZPDHXFCSA-N	0	3	306.450	2.362	10	0		DEAEHN
CCC[C@H](C)NC(=O)C(C)S(=O)(=O)Cc1ccccc1F	ZINC000044640645	401946989	/nfs/dbraw/zinc/94/69/89/401946989.db2.gz	DPNYTWCPFBTFSY-RYUDHWBXSA-N	0	3	315.410	2.434	10	0		DEAEHN
C[C@H](NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cnccn1	ZINC000095089253	402025399	/nfs/dbraw/zinc/02/53/99/402025399.db2.gz	QPFLGWDLIKXQCY-STQMWFEESA-N	0	3	306.410	2.384	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@@]2(CCc3ccccc32)C1)N(C)C	ZINC000121537037	402042740	/nfs/dbraw/zinc/04/27/40/402042740.db2.gz	BILUSEWYCGTCQD-MJGOQNOKSA-N	0	3	316.445	2.417	10	0		DEAEHN
CC(C)c1cc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc(=O)[nH]1	ZINC000121548427	402043242	/nfs/dbraw/zinc/04/32/42/402043242.db2.gz	KAOVIWPIRUHZKA-JSGCOSHPSA-N	0	3	305.422	2.465	10	0		DEAEHN
Cc1cnc(CCN(C)C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)s1	ZINC000121727369	402050322	/nfs/dbraw/zinc/05/03/22/402050322.db2.gz	NHYYVDRUVFVHFZ-JSGCOSHPSA-N	0	3	324.494	2.364	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1cn(C)nc1C(C)(C)C	ZINC000092246344	402003461	/nfs/dbraw/zinc/00/34/61/402003461.db2.gz	YWMZBBNSGXTGMF-ZDUSSCGKSA-N	0	3	308.470	2.424	10	0		DEAEHN
COCCN1CCN(C/C=C/c2ccccc2OC)C[C@@H]1C	ZINC000120820451	402003522	/nfs/dbraw/zinc/00/35/22/402003522.db2.gz	WZSYZNHXOFJEDF-BVBGJJFLSA-N	0	3	304.434	2.361	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)Cc1cn2ccccc2n1)c1ccccc1	ZINC000122625466	402088030	/nfs/dbraw/zinc/08/80/30/402088030.db2.gz	WSIPOYSKZCJWSJ-QGZVFWFLSA-N	0	3	322.412	2.296	10	0		DEAEHN
COCCCN(C)CCNC(=O)C(C)(C)c1ccccc1F	ZINC000152412051	402095075	/nfs/dbraw/zinc/09/50/75/402095075.db2.gz	SXICDGRNAVXKQD-UHFFFAOYSA-N	0	3	310.413	2.188	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCCOc2ccc(F)cc2)C1	ZINC000057632486	402096198	/nfs/dbraw/zinc/09/61/98/402096198.db2.gz	DLPGAZFNJHAVTL-OAHLLOKOSA-N	0	3	323.412	2.378	10	0		DEAEHN
COc1ccc(OC)c(CC(=O)NCCN2CCCC[C@@H]2C)c1	ZINC000097327099	402121725	/nfs/dbraw/zinc/12/17/25/402121725.db2.gz	GTNJHPWFCNDQQD-AWEZNQCLSA-N	0	3	320.433	2.237	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cc(-c3cccnc3)on2)CCN1C	ZINC000123025988	402106671	/nfs/dbraw/zinc/10/66/71/402106671.db2.gz	SNBAJNHDJOYMNL-GXTWGEPZSA-N	0	3	314.389	2.291	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)NCc1cccc(Cl)c1	ZINC000061041021	402106890	/nfs/dbraw/zinc/10/68/90/402106890.db2.gz	IJRZWNLNSKMFQP-UHFFFAOYSA-N	0	3	321.852	2.126	10	0		DEAEHN
CC(C)CCC[C@H](C)NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000061955581	402109112	/nfs/dbraw/zinc/10/91/12/402109112.db2.gz	DMDZTLXABQCDJI-HOTGVXAUSA-N	0	3	313.486	2.347	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)NC[C@H](O)C(C)C)c1ccccc1	ZINC000152952063	402118896	/nfs/dbraw/zinc/11/88/96/402118896.db2.gz	RJSWKOJVCZBERV-SJORKVTESA-N	0	3	321.465	2.386	10	0		DEAEHN
COC(=O)c1cccc(OCCN2CC[C@@H]3OCCC[C@@H]3C2)c1	ZINC000153062889	402124756	/nfs/dbraw/zinc/12/47/56/402124756.db2.gz	WJIOOXPBMBJDBE-WBVHZDCISA-N	0	3	319.401	2.353	10	0		DEAEHN
CN1CCO[C@@H]2CN(c3ccnc4ccc(Cl)cc43)C[C@@H]21	ZINC000153140880	402128981	/nfs/dbraw/zinc/12/89/81/402128981.db2.gz	BUFOYLRWCHLRBA-JKSUJKDBSA-N	0	3	303.793	2.407	10	0		DEAEHN
CCN(C)C(=O)CCN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000153287341	402136878	/nfs/dbraw/zinc/13/68/78/402136878.db2.gz	PSRRRALLOPDJEA-UHFFFAOYSA-N	0	3	323.481	2.016	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)N(C)[C@@H]1CCSC1	ZINC000123367951	402123926	/nfs/dbraw/zinc/12/39/26/402123926.db2.gz	JMPGMOCHNWCWQE-JKSUJKDBSA-N	0	3	321.490	2.306	10	0		DEAEHN
C[C@@H](C(=O)NC1CCCC1)N1CCC[C@H](Cc2nccn2C)C1	ZINC000123726851	402143409	/nfs/dbraw/zinc/14/34/09/402143409.db2.gz	SBLJJZQPXMPCOL-LSDHHAIUSA-N	0	3	318.465	2.122	10	0		DEAEHN
COc1ccc(OC)c(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000124481480	402182061	/nfs/dbraw/zinc/18/20/61/402182061.db2.gz	CICBPWHQAIYXHA-STQMWFEESA-N	0	3	306.406	2.259	10	0		DEAEHN
Cc1csc(=O)n1CCN[C@H](C)c1ccc2c(c1)OCCO2	ZINC000102682307	402170453	/nfs/dbraw/zinc/17/04/53/402170453.db2.gz	DVIGSIQKMPTSKJ-GFCCVEGCSA-N	0	3	320.414	2.340	10	0		DEAEHN
C[C@H](CC1=CCN(CCO)CC1)NC(=O)c1cc(F)ccc1F	ZINC000067894442	402177549	/nfs/dbraw/zinc/17/75/49/402177549.db2.gz	WICSWODJIOBYRO-GFCCVEGCSA-N	0	3	324.371	2.098	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccncc1Br	ZINC000154813661	402233815	/nfs/dbraw/zinc/23/38/15/402233815.db2.gz	UIUDJGLLJKKMGX-GHMZBOCLSA-N	0	3	324.222	2.153	10	0		DEAEHN
Cc1ccc(OCCCN2CCO[C@H](CN(C)C)C2)cc1C	ZINC000155287827	402251603	/nfs/dbraw/zinc/25/16/03/402251603.db2.gz	SHYARUWXTTWGIU-GOSISDBHSA-N	0	3	306.450	2.335	10	0		DEAEHN
CN(CCc1ccc(F)cc1)C(=O)NC[C@H]1CCCN(C)C1	ZINC000108588941	402257959	/nfs/dbraw/zinc/25/79/59/402257959.db2.gz	GDBVHCIXFFRFRN-OAHLLOKOSA-N	0	3	307.413	2.351	10	0		DEAEHN
COCc1cc(N2CCNCC2)nc(-c2ccc(Cl)cc2)n1	ZINC000070451674	402260651	/nfs/dbraw/zinc/26/06/51/402260651.db2.gz	MWMKTBNZRCPDCU-UHFFFAOYSA-N	0	3	318.808	2.353	10	0		DEAEHN
COc1ccc(F)cc1-c1ccnc2[nH]c(C3(O)CNC3)cc21	ZINC000217744595	402293625	/nfs/dbraw/zinc/29/36/25/402293625.db2.gz	WVQBLDJFOLMMTR-UHFFFAOYSA-N	0	3	313.332	2.168	10	0		DEAEHN
CC(C)C[C@@H](C)C(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000184827547	402302585	/nfs/dbraw/zinc/30/25/85/402302585.db2.gz	XFBFIFSOMGOCAC-IAGOWNOFSA-N	0	3	309.498	2.297	10	0		DEAEHN
C[C@H](NC(=O)N1CCO[C@H](CN(C)C)C1)[C@@H](C)c1ccccc1	ZINC000176464034	402312107	/nfs/dbraw/zinc/31/21/07/402312107.db2.gz	NRRZFULLJIIWEE-HLLBOEOZSA-N	0	3	319.449	2.151	10	0		DEAEHN
CN(C)C[C@](C)(O)CNC(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000228735978	402340423	/nfs/dbraw/zinc/34/04/23/402340423.db2.gz	GIZHCAXNNFBOIA-CYBMUJFWSA-N	0	3	320.220	2.428	10	0		DEAEHN
Cc1ncc(CN(C)C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)s1	ZINC000176842153	402342050	/nfs/dbraw/zinc/34/20/50/402342050.db2.gz	PWQYPESWENARDJ-FZMZJTMJSA-N	0	3	310.467	2.322	10	0		DEAEHN
CCn1nc(C)c(C(=O)N(C)C[C@H]2CCCN2CC)c1Cl	ZINC000176984075	402356966	/nfs/dbraw/zinc/35/69/66/402356966.db2.gz	XCPILTPJNXBJEJ-GFCCVEGCSA-N	0	3	312.845	2.421	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CCOc1ccccc1OC	ZINC000177026222	402360950	/nfs/dbraw/zinc/36/09/50/402360950.db2.gz	OTWDSFLSIJTJLB-OAHLLOKOSA-N	0	3	320.433	2.407	10	0		DEAEHN
COC[C@H](C)OC[C@H](O)CN[C@H](C)c1cccc(Cl)c1	ZINC000234850500	402361687	/nfs/dbraw/zinc/36/16/87/402361687.db2.gz	YMGLCSLLSWCIRV-YWPYICTPSA-N	0	3	301.814	2.403	10	0		DEAEHN
CC(C)[C@@H]1C[C@@H]1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000185905127	402387947	/nfs/dbraw/zinc/38/79/47/402387947.db2.gz	AUZNZNMXBAOCLN-BZSNNMDCSA-N	0	3	316.445	2.162	10	0		DEAEHN
COC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(Br)cc1	ZINC000228641917	402339279	/nfs/dbraw/zinc/33/92/79/402339279.db2.gz	QIQFAJBSYNSQKS-ZANVPECISA-N	0	3	316.195	2.024	10	0		DEAEHN
COc1cccc(F)c1[C@H](C)NC(=O)C[C@@H]1CSCCN1	ZINC000237288177	402402466	/nfs/dbraw/zinc/40/24/66/402402466.db2.gz	FWEMQZKWKBMAOT-WDEREUQCSA-N	0	3	312.410	2.107	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@@H](C)Cc1c(C)noc1C	ZINC000177535843	402413828	/nfs/dbraw/zinc/41/38/28/402413828.db2.gz	OMUOEYJFHPFNOT-WFASDCNBSA-N	0	3	322.453	2.348	10	0		DEAEHN
Cc1nc(C)c(C(=O)N[C@H](C)CN2CCCCCC2)nc1C	ZINC000186293245	402418189	/nfs/dbraw/zinc/41/81/89/402418189.db2.gz	OVQXQXRRGXJRPU-GFCCVEGCSA-N	0	3	304.438	2.396	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@@H](C)c2cn(C)nc2C)C12CCOCC2	ZINC000186319569	402420980	/nfs/dbraw/zinc/42/09/80/402420980.db2.gz	UTLRUBNYHOLKCU-VBNZEHGJSA-N	0	3	307.438	2.353	10	0		DEAEHN
Cc1cc(OCC(=O)N2CC[C@@H](N(C)C)C2)cc(C)c1Cl	ZINC000162593746	402425819	/nfs/dbraw/zinc/42/58/19/402425819.db2.gz	SETPHJJGIWPFJE-CYBMUJFWSA-N	0	3	310.825	2.498	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc2c(c1)COC(C)(C)O2	ZINC000186394780	402428170	/nfs/dbraw/zinc/42/81/70/402428170.db2.gz	OJWVBZINBUZIFJ-KRWDZBQOSA-N	0	3	309.406	2.209	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C(=O)OC)c1ccccc1F	ZINC000177707931	402428964	/nfs/dbraw/zinc/42/89/64/402428964.db2.gz	OLWAIXBNVUZIIA-BBRMVZONSA-N	0	3	308.397	2.456	10	0		DEAEHN
c1ccc(OCc2n[nH]c(CN[C@H]3CCCSC3)n2)cc1	ZINC000186421578	402429970	/nfs/dbraw/zinc/42/99/70/402429970.db2.gz	XUUUXFUCPNVSBC-LBPRGKRZSA-N	0	3	304.419	2.369	10	0		DEAEHN
C[C@H](C(=O)N1CCC[C@@H]1Cn1ccnc1)N1CCCCCC1	ZINC000177774982	402434886	/nfs/dbraw/zinc/43/48/86/402434886.db2.gz	PKJXOAYEXUPHLF-HZPDHXFCSA-N	0	3	304.438	2.139	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCc1cccc(F)c1	ZINC000177315417	402390627	/nfs/dbraw/zinc/39/06/27/402390627.db2.gz	HCHOTSKTYPPXHS-MRXNPFEDSA-N	0	3	307.413	2.494	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H]1CCN(c2ccccc2)C1)N(C)C	ZINC000161554685	402391716	/nfs/dbraw/zinc/39/17/16/402391716.db2.gz	AWQWOXSQSITVOH-RDJZCZTQSA-N	0	3	303.450	2.359	10	0		DEAEHN
COC[C@@H](NCc1cnn(-c2ccccc2)c1)C1CCOCC1	ZINC000187740037	402510291	/nfs/dbraw/zinc/51/02/91/402510291.db2.gz	SWMYKCBKGDNLRZ-GOSISDBHSA-N	0	3	315.417	2.404	10	0		DEAEHN
COCCN(CCN(C)C)C(=O)c1[nH]c2ccc(C)cc2c1C	ZINC000163845569	402458442	/nfs/dbraw/zinc/45/84/42/402458442.db2.gz	GLLSWRMMCPUKKZ-UHFFFAOYSA-N	0	3	317.433	2.435	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@H](COC)c1ccco1	ZINC000245463361	402463214	/nfs/dbraw/zinc/46/32/14/402463214.db2.gz	HEAIIMPCXZJNKM-ZIAGYGMSSA-N	0	3	309.410	2.093	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1cnc(Cl)cn1)c1ccccc1	ZINC000178161956	402466837	/nfs/dbraw/zinc/46/68/37/402466837.db2.gz	VKLXODWTKFUEPY-ZDUSSCGKSA-N	0	3	304.781	2.163	10	0		DEAEHN
COC(=O)c1nc(N2CC[C@H](N3CCCCC3)C2)sc1C	ZINC000164669535	402467202	/nfs/dbraw/zinc/46/72/02/402467202.db2.gz	WJUXJOHNVDXKTH-LBPRGKRZSA-N	0	3	309.435	2.303	10	0		DEAEHN
Cc1cc(CNC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)on1	ZINC000245653956	402477127	/nfs/dbraw/zinc/47/71/27/402477127.db2.gz	NPSLZBYYKYTGSV-HOTGVXAUSA-N	0	3	314.389	2.228	10	0		DEAEHN
C[C@H](NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)[C@@H]1CCCO1	ZINC000245663913	402477868	/nfs/dbraw/zinc/47/78/68/402477868.db2.gz	QJLDXNWFMCGZPZ-ORQFMDKSSA-N	0	3	317.433	2.299	10	0		DEAEHN
Cc1nccnc1[C@@H](C)NC1CCN(CC(F)(F)F)CC1	ZINC000187915133	402512952	/nfs/dbraw/zinc/51/29/52/402512952.db2.gz	WZMTWHNGESGSRI-LLVKDONJSA-N	0	3	302.344	2.462	10	0		DEAEHN
NCC1(c2nc(Cc3ccc(Cl)cc3)no2)CCOCC1	ZINC000166099359	402481417	/nfs/dbraw/zinc/48/14/17/402481417.db2.gz	GFNSTVRDKVKDCG-UHFFFAOYSA-N	0	3	307.781	2.321	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N1CCc2ccccc21	ZINC000178332615	402485684	/nfs/dbraw/zinc/48/56/84/402485684.db2.gz	JCEUHVKZOVULCL-KRWDZBQOSA-N	0	3	324.428	2.245	10	0		DEAEHN
CCc1ccc([C@H](CNC(=O)CCCCC(N)=O)N(C)C)cc1	ZINC000187178578	402486478	/nfs/dbraw/zinc/48/64/78/402486478.db2.gz	FORUUZWFSAAKSH-INIZCTEOSA-N	0	3	319.449	2.014	10	0		DEAEHN
O=C(c1ccccc1)N1CCCN([C@H]2CCCC[C@H]2O)CC1	ZINC000245802951	402489031	/nfs/dbraw/zinc/48/90/31/402489031.db2.gz	BCAXQNPHLMWNIC-DLBZAZTESA-N	0	3	302.418	2.138	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)N2CCCC[C@H]2c2cn[nH]c2)C1	ZINC000245961691	402501014	/nfs/dbraw/zinc/50/10/14/402501014.db2.gz	MRBVBYLVGCDDQC-ZBFHGGJFSA-N	0	3	319.453	2.378	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000246014500	402503604	/nfs/dbraw/zinc/50/36/04/402503604.db2.gz	LMZDJDKLISRMSK-DAXOMENPSA-N	0	3	315.417	2.057	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NC[C@H](C)N2CCC[C@H](C)C2)CC[C@@H]1C	ZINC000187524111	402503607	/nfs/dbraw/zinc/50/36/07/402503607.db2.gz	PAFHNRGQJPDBBW-YHUYYLMFSA-N	0	3	311.470	2.173	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCCOc2ccccc2)C1	ZINC000246063080	402506707	/nfs/dbraw/zinc/50/67/07/402506707.db2.gz	ZGSTZRZCRUQIEN-DOTOQJQBSA-N	0	3	317.433	2.191	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)n1	ZINC000178524144	402507351	/nfs/dbraw/zinc/50/73/51/402507351.db2.gz	OEKAVKGKOISMCY-PMPSAXMXSA-N	0	3	304.438	2.004	10	0		DEAEHN
CN(Cc1ccccc1)CC(C)(C)NC(=O)CCCCC(N)=O	ZINC000187663504	402507691	/nfs/dbraw/zinc/50/76/91/402507691.db2.gz	LEAARTOVMVFLEJ-UHFFFAOYSA-N	0	3	319.449	2.059	10	0		DEAEHN
Cc1c(O)ccc2c(CN(C)C[C@@H]3CCCO3)cc(=O)oc12	ZINC000170688118	402514397	/nfs/dbraw/zinc/51/43/97/402514397.db2.gz	YXJJSAQRYSNVRQ-ZDUSSCGKSA-N	0	3	303.358	2.418	10	0		DEAEHN
C[C@@H]1CN(CCCOc2cccc(Cl)c2)CCN1CCO	ZINC000187718149	402509225	/nfs/dbraw/zinc/50/92/25/402509225.db2.gz	HICSLHJEPVXGJQ-CQSZACIVSA-N	0	3	312.841	2.107	10	0		DEAEHN
C[C@H]1CN(C2CCN(Cc3cccnc3Cl)CC2)CCO1	ZINC000170928358	402542446	/nfs/dbraw/zinc/54/24/46/402542446.db2.gz	BLYQKBCQUKMXNC-ZDUSSCGKSA-N	0	3	309.841	2.420	10	0		DEAEHN
C[C@H]1OCCC[C@H]1C(=O)N(CCN(C)C)Cc1cccc(O)c1	ZINC000189549012	402544352	/nfs/dbraw/zinc/54/43/52/402544352.db2.gz	VSYFQMAZOAMOGB-RHSMWYFYSA-N	0	3	320.433	2.098	10	0		DEAEHN
CC(=O)NC[C@H]1CCCN(Cc2cnc(-c3ccccc3)[nH]2)C1	ZINC000178873964	402549122	/nfs/dbraw/zinc/54/91/22/402549122.db2.gz	VZHYLPAGYDOBRE-OAHLLOKOSA-N	0	3	312.417	2.425	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc2c(s1)CCOC2	ZINC000247001003	402552817	/nfs/dbraw/zinc/55/28/17/402552817.db2.gz	FOFZDCFQSQQFFS-AAEUAGOBSA-N	0	3	306.431	2.130	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2ccccc2N2CCCC2)C1	ZINC000171071992	402554663	/nfs/dbraw/zinc/55/46/63/402554663.db2.gz	IVFCMCAKWZXVIY-AWEZNQCLSA-N	0	3	302.422	2.455	10	0		DEAEHN
CCC(=O)Nc1cccc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000247130570	402557888	/nfs/dbraw/zinc/55/78/88/402557888.db2.gz	JIZWZPMIFIBIIH-CZUORRHYSA-N	0	3	315.417	2.344	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC[C@@H]1CCCC[C@@H]1C	ZINC000247222031	402560752	/nfs/dbraw/zinc/56/07/52/402560752.db2.gz	BYZUXKDTTXIOHA-HRCADAONSA-N	0	3	311.470	2.223	10	0		DEAEHN
O=C(N[C@@H]1CCc2cc(F)ccc21)N1CCN2CCC[C@H]2C1	ZINC000247374897	402565631	/nfs/dbraw/zinc/56/56/31/402565631.db2.gz	FPNLBTLPWYMIEN-GOEBONIOSA-N	0	3	303.381	2.303	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1Cc1nc(Cc2ccccc2)no1	ZINC000247492969	402569754	/nfs/dbraw/zinc/56/97/54/402569754.db2.gz	UJEZQHMYKHKBIQ-ZBFHGGJFSA-N	0	3	312.417	2.329	10	0		DEAEHN
C[C@H](C(=O)Nc1ccc(Cl)cc1)N1CCN2CCC[C@@H]2C1	ZINC000178623955	402518808	/nfs/dbraw/zinc/51/88/08/402518808.db2.gz	PGBCQMKWMZUGGJ-IUODEOHRSA-N	0	3	307.825	2.447	10	0		DEAEHN
C[C@@H](C(=O)N1CCCc2ccccc21)N1CCN2CCC[C@@H]2C1	ZINC000178625931	402518930	/nfs/dbraw/zinc/51/89/30/402518930.db2.gz	DCQCTJWPGQFQDX-DOTOQJQBSA-N	0	3	313.445	2.134	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)[C@H](C)N2CCN3CCC[C@@H]3C2)c1	ZINC000178637862	402520847	/nfs/dbraw/zinc/52/08/47/402520847.db2.gz	SRZXZJPBWZPPHB-DOTOQJQBSA-N	0	3	301.434	2.410	10	0		DEAEHN
O=C(CN1CCN2CCC[C@H]2C1)Nc1ccc(F)cc1Cl	ZINC000246253893	402521025	/nfs/dbraw/zinc/52/10/25/402521025.db2.gz	FQQNTZUVAXGCKI-LBPRGKRZSA-N	0	3	311.788	2.198	10	0		DEAEHN
CCn1cc(Br)cc1C(=O)NC[C@@H]1CCCN1C	ZINC000171275210	402573534	/nfs/dbraw/zinc/57/35/34/402573534.db2.gz	GPJBYVMICWWFQI-NSHDSACASA-N	0	3	314.227	2.095	10	0		DEAEHN
CCn1nc(C)c(NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1C	ZINC000246425283	402530660	/nfs/dbraw/zinc/53/06/60/402530660.db2.gz	NLWUJOVRPIDZFI-FZMZJTMJSA-N	0	3	307.442	2.466	10	0		DEAEHN
Cc1nc2cc(F)cc(C(=O)N3CC[C@@H](N(C)C)C3)c2nc1C	ZINC000170864876	402535118	/nfs/dbraw/zinc/53/51/18/402535118.db2.gz	WXAAQFPXJLOTHV-CYBMUJFWSA-N	0	3	316.380	2.162	10	0		DEAEHN
CCc1cccc(S(=O)(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000246572180	402537016	/nfs/dbraw/zinc/53/70/16/402537016.db2.gz	SQUYKJDZJQQMFG-UKRRQHHQSA-N	0	3	308.447	2.106	10	0		DEAEHN
COc1cccc(COC[C@@H](O)CN2CCS[C@@H](C)C2)c1	ZINC000170901526	402539808	/nfs/dbraw/zinc/53/98/08/402539808.db2.gz	WOBOKYQPNFVHDU-ZFWWWQNUSA-N	0	3	311.447	2.010	10	0		DEAEHN
CC(C)[C@H](CO)N(Cc1ccccc1)C[C@@H](O)C(F)(F)F	ZINC000248400081	402589174	/nfs/dbraw/zinc/58/91/74/402589174.db2.gz	WVMOPILJSDRPME-UONOGXRCSA-N	0	3	305.340	2.429	10	0		DEAEHN
C[C@@H]1CN(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CCCO1	ZINC000179462209	402590933	/nfs/dbraw/zinc/59/09/33/402590933.db2.gz	VREATRBVZSKXNX-HYVNUMGLSA-N	0	3	317.433	2.252	10	0		DEAEHN
C[C@@H]1CCCN(c2cc(N3CCCN(C4CC4)CC3)ncn2)C1	ZINC000171831402	402627117	/nfs/dbraw/zinc/62/71/17/402627117.db2.gz	DUXZTGGONKRTAU-OAHLLOKOSA-N	0	3	315.465	2.387	10	0		DEAEHN
C[C@H](NC(=O)N1CCN2CCC[C@@H]2C1)c1nc2ccccc2[nH]1	ZINC000171538118	402592156	/nfs/dbraw/zinc/59/21/56/402592156.db2.gz	NUHJSSIDTDMWHH-QWHCGFSZSA-N	0	3	313.405	2.114	10	0		DEAEHN
CCN(CC)C(=O)[C@@H]1CCCN1C[C@@H](O)CCc1ccccc1	ZINC000248569450	402596067	/nfs/dbraw/zinc/59/60/67/402596067.db2.gz	LREGEHHJKJZUGF-ROUUACIJSA-N	0	3	318.461	2.313	10	0		DEAEHN
CCC1(CC)CCCN(CC(=O)N2CCC[C@H](C(N)=O)C2)CC1	ZINC000190409963	402598497	/nfs/dbraw/zinc/59/84/97/402598497.db2.gz	YRTIMBGDWBQWLA-HNNXBMFYSA-N	0	3	323.481	2.003	10	0		DEAEHN
CO[C@@H](C)CNC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000190407694	402598821	/nfs/dbraw/zinc/59/88/21/402598821.db2.gz	XXXVGZXLSCWGHE-RDJZCZTQSA-N	0	3	319.449	2.375	10	0		DEAEHN
C[C@H](c1cnccn1)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000248662299	402602482	/nfs/dbraw/zinc/60/24/82/402602482.db2.gz	YHIWDYRYLWGDOZ-WBVHZDCISA-N	0	3	311.433	2.387	10	0		DEAEHN
C[C@H]1C[C@H](CC[N@@H+]2CCC[C@@]3(C2)NC(=O)[N-]C3=O)C[C@@H](C)C1	ZINC000248682413	402603225	/nfs/dbraw/zinc/60/32/25/402603225.db2.gz	PUFQIBHDKAUZBS-CFAJVAMVSA-N	0	3	307.438	2.123	10	0		DEAEHN
C[C@H]1C[C@H](CC[N@H+]2CCC[C@@]3(C2)NC(=O)[N-]C3=O)C[C@@H](C)C1	ZINC000248682413	402603226	/nfs/dbraw/zinc/60/32/26/402603226.db2.gz	PUFQIBHDKAUZBS-CFAJVAMVSA-N	0	3	307.438	2.123	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(Cc2cncn2C)C1	ZINC000190470183	402603445	/nfs/dbraw/zinc/60/34/45/402603445.db2.gz	JNQOIGMOXYCQEW-AWEZNQCLSA-N	0	3	319.478	2.139	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@H]1CCN(Cc2cc[nH]n2)C1	ZINC000190468868	402603452	/nfs/dbraw/zinc/60/34/52/402603452.db2.gz	HMTPATUSIYOSIJ-CYBMUJFWSA-N	0	3	305.451	2.129	10	0		DEAEHN
Cn1cc([C@@H](NC[C@@H]2CCCN2C)c2cccc(F)c2)cn1	ZINC000180238801	402610865	/nfs/dbraw/zinc/61/08/65/402610865.db2.gz	VBZQYGSGJZRZJI-IRXDYDNUSA-N	0	3	302.397	2.332	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)NCC2CCC2)C1	ZINC000190696439	402618755	/nfs/dbraw/zinc/61/87/55/402618755.db2.gz	SOWJMQODHLHUFU-KRWDZBQOSA-N	0	3	316.449	2.345	10	0		DEAEHN
Cc1ccc2ncnc(N3CCN(CC(C)(C)O)[C@@H](C)C3)c2c1	ZINC000249087727	402620257	/nfs/dbraw/zinc/62/02/57/402620257.db2.gz	TYGSKZROYKVXDI-AWEZNQCLSA-N	0	3	314.433	2.220	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000249107902	402620707	/nfs/dbraw/zinc/62/07/07/402620707.db2.gz	AEKJYGVIOXBOPD-GOEBONIOSA-N	0	3	317.433	2.183	10	0		DEAEHN
Cc1ccc(F)cc1NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000249200364	402623211	/nfs/dbraw/zinc/62/32/11/402623211.db2.gz	QTYGVKLJQHGGJI-GXTWGEPZSA-N	0	3	321.396	2.014	10	0		DEAEHN
CCOC(=O)[C@@H]1CCCCN1C(=O)CN[C@@H](C)c1cccs1	ZINC000180928455	402630240	/nfs/dbraw/zinc/63/02/40/402630240.db2.gz	JWJJERDQRBLTPM-STQMWFEESA-N	0	3	324.446	2.343	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)NC[C@H](C)N2CCC[C@@H](C)C2)n1	ZINC000249944873	402643907	/nfs/dbraw/zinc/64/39/07/402643907.db2.gz	YGESPAHMCHODJY-UHOFOFEASA-N	0	3	306.454	2.298	10	0		DEAEHN
CC(C)(C)OC(=O)CCCCN1CCC[C@@H](n2cncn2)C1	ZINC000181853510	402658692	/nfs/dbraw/zinc/65/86/92/402658692.db2.gz	LMCBCYWBKDABBH-CQSZACIVSA-N	0	3	308.426	2.427	10	0		DEAEHN
C[C@@H](CNC(=O)[C@H]1CCCO[C@H]1C)N(C)Cc1ccccc1	ZINC000251257371	402647251	/nfs/dbraw/zinc/64/72/51/402647251.db2.gz	YGRZZUYBNXEYAR-ZOBUZTSGSA-N	0	3	304.434	2.438	10	0		DEAEHN
C[C@@H]1C[C@H](C)CN(C(=O)CN[C@H]2CCCC[C@@H]2n2cccn2)C1	ZINC000251687239	402648798	/nfs/dbraw/zinc/64/87/98/402648798.db2.gz	ONIUKKUFJMMNJC-YVSFHVDLSA-N	0	3	318.465	2.461	10	0		DEAEHN
COCCN(C)CCCNC(=O)NC[C@@H]1C[C@H]1c1ccccc1	ZINC000252442320	402653611	/nfs/dbraw/zinc/65/36/11/402653611.db2.gz	UYXJHPFJQMYTEW-IRXDYDNUSA-N	0	3	319.449	2.058	10	0		DEAEHN
Cc1nc(C[C@@H]2CCCN(CCO[C@@H]3CCCCO3)C2)no1	ZINC000181682537	402653982	/nfs/dbraw/zinc/65/39/82/402653982.db2.gz	OAWRTQOROVMVJC-GOEBONIOSA-N	0	3	309.410	2.176	10	0		DEAEHN
Cc1nc(C[C@H]2CCCN(CCO[C@@H]3CCCCO3)C2)no1	ZINC000181682556	402654155	/nfs/dbraw/zinc/65/41/55/402654155.db2.gz	OAWRTQOROVMVJC-GDBMZVCRSA-N	0	3	309.410	2.176	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)CCC1CCOCC1	ZINC000173697019	402708694	/nfs/dbraw/zinc/70/86/94/402708694.db2.gz	VYNQAMRMEAXBRC-GOSISDBHSA-N	0	3	318.461	2.482	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)[C@H]2Oc3ccccc3O[C@H]2C)CCN1C	ZINC000172619352	402666830	/nfs/dbraw/zinc/66/68/30/402666830.db2.gz	UQWFOXUOYFFRGV-WSMBLCCSSA-N	0	3	318.417	2.156	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2snnc2C(C)(C)C)CCN1C	ZINC000191430482	402668972	/nfs/dbraw/zinc/66/89/72/402668972.db2.gz	WBLBSSHDQUHTGI-MNOVXSKESA-N	0	3	310.467	2.390	10	0		DEAEHN
COC(=O)[C@H](C)Oc1ccc(CN[C@@H]2C[C@H]3CC[C@@H]2O3)cc1	ZINC000182224681	402673926	/nfs/dbraw/zinc/67/39/26/402673926.db2.gz	VVWNMUARAJJXSW-SRMUXQRQSA-N	0	3	305.374	2.036	10	0		DEAEHN
C[C@H]1C[C@H](N(C)Cc2cc(=O)oc3cc([O-])ccc23)CC[N@@H+]1C	ZINC000182396915	402686687	/nfs/dbraw/zinc/68/66/87/402686687.db2.gz	XLXWPRMSTACNLM-GXTWGEPZSA-N	0	3	316.401	2.413	10	0		DEAEHN
C[C@H]1C[C@H](N(C)Cc2cc(=O)oc3cc([O-])ccc23)CC[N@H+]1C	ZINC000182396915	402686689	/nfs/dbraw/zinc/68/66/89/402686689.db2.gz	XLXWPRMSTACNLM-GXTWGEPZSA-N	0	3	316.401	2.413	10	0		DEAEHN
C[C@H]1C[C@H]([N@H+](C)Cc2cc(=O)oc3cc([O-])ccc23)CCN1C	ZINC000182396915	402686692	/nfs/dbraw/zinc/68/66/92/402686692.db2.gz	XLXWPRMSTACNLM-GXTWGEPZSA-N	0	3	316.401	2.413	10	0		DEAEHN
C[C@H]1C[C@H]([N@@H+](C)Cc2cc(=O)oc3cc([O-])ccc23)CCN1C	ZINC000182396915	402686695	/nfs/dbraw/zinc/68/66/95/402686695.db2.gz	XLXWPRMSTACNLM-GXTWGEPZSA-N	0	3	316.401	2.413	10	0		DEAEHN
CCCc1cc(NC(=O)[C@@H](NC2CCOCC2)C(C)C)n[nH]1	ZINC000173267708	402690217	/nfs/dbraw/zinc/69/02/17/402690217.db2.gz	UHZLFBOIBFFKOO-HNNXBMFYSA-N	0	3	308.426	2.094	10	0		DEAEHN
Cc1cc(NC(=O)CCN[C@H](C)c2ccc3c(c2)OCO3)no1	ZINC000192478057	402731375	/nfs/dbraw/zinc/73/13/75/402731375.db2.gz	IDWFUZFNEYHNEU-LLVKDONJSA-N	0	3	317.345	2.391	10	0		DEAEHN
CC1CCN(CCNCc2ccc3c(c2)sc(=O)n3C)CC1	ZINC000192475716	402731487	/nfs/dbraw/zinc/73/14/87/402731487.db2.gz	FGXYSDHRPQHHOQ-UHFFFAOYSA-N	0	3	319.474	2.422	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@H](C)N[C@H](C)[C@@H]2CCCO2)c1	ZINC000183094032	402738386	/nfs/dbraw/zinc/73/83/86/402738386.db2.gz	GDOQQRRRTYCPKU-WQGACYEGSA-N	0	3	304.390	2.373	10	0		DEAEHN
CC1(C)CCc2ccccc2[C@H]1NCC(=O)N1CCOCC1	ZINC000183130724	402741925	/nfs/dbraw/zinc/74/19/25/402741925.db2.gz	KOJPKRXCPWIRBQ-QGZVFWFLSA-N	0	3	302.418	2.149	10	0		DEAEHN
CCCOc1ccc(CNC(=O)CN[C@@H](C)[C@@H]2CCCO2)cc1	ZINC000183138572	402742354	/nfs/dbraw/zinc/74/23/54/402742354.db2.gz	MDYGCSMXTCAVSD-YOEHRIQHSA-N	0	3	320.433	2.249	10	0		DEAEHN
C[C@@H](Cc1nc([C@@H]2CNCCN2C)no1)c1cccc(F)c1	ZINC000263174520	402746436	/nfs/dbraw/zinc/74/64/36/402746436.db2.gz	GBQZGMCXKSRGAW-FZMZJTMJSA-N	0	3	304.369	2.131	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)[C@H](C)N[C@@H](C)[C@@H]1CCCO1	ZINC000183217402	402747816	/nfs/dbraw/zinc/74/78/16/402747816.db2.gz	NKBGSOIUYTWVAQ-ZOBUZTSGSA-N	0	3	304.434	2.499	10	0		DEAEHN
CC[C@H](Oc1ccccc1F)c1nc([C@H]2CNCCN2C)no1	ZINC000263238963	402748860	/nfs/dbraw/zinc/74/88/60/402748860.db2.gz	OJQWUHFVGFPGBE-OLZOCXBDSA-N	0	3	320.368	2.315	10	0		DEAEHN
C[C@H]1CCc2c(-c3nc([C@@H]4CNCCN4C)no3)csc2C1	ZINC000263312537	402757321	/nfs/dbraw/zinc/75/73/21/402757321.db2.gz	YXPISMVDXVUCEP-GWCFXTLKSA-N	0	3	318.446	2.499	10	0		DEAEHN
CSCCCC(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000183414813	402765211	/nfs/dbraw/zinc/76/52/11/402765211.db2.gz	DYMVNRSYTXIYHO-INIZCTEOSA-N	0	3	322.474	2.013	10	0		DEAEHN
CCOc1ncccc1C(=O)N1C[C@H]2CCCN2C[C@@H]1CC	ZINC000175006319	402770682	/nfs/dbraw/zinc/77/06/82/402770682.db2.gz	YENMVDIZYWOTIC-UONOGXRCSA-N	0	3	303.406	2.179	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)/C=C/c1ccc(F)cc1	ZINC000175218096	402789217	/nfs/dbraw/zinc/78/92/17/402789217.db2.gz	NABSMXJIBMPTNT-OCHBPSSRSA-N	0	3	314.426	2.446	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cc(OC)ccc2OC)C1	ZINC000194317769	402792450	/nfs/dbraw/zinc/79/24/50/402792450.db2.gz	MRBMXXHNNCLBEO-GFCCVEGCSA-N	0	3	307.394	2.310	10	0		DEAEHN
O=C(c1cc(-c2ccc(F)cc2)n[nH]1)N1CCN2CCC[C@H]2C1	ZINC000195330540	402842169	/nfs/dbraw/zinc/84/21/69/402842169.db2.gz	FGOMKCFGCJCGGE-AWEZNQCLSA-N	0	3	314.364	2.136	10	0		DEAEHN
Cc1cc(C)cc([C@@H]2CCN(C(=O)C(C)S(C)(=O)=O)C2)c1	ZINC000183778287	402797083	/nfs/dbraw/zinc/79/70/83/402797083.db2.gz	YUJGBHJKABJRHC-ZIAGYGMSSA-N	0	3	309.431	2.052	10	0		DEAEHN
CC(C)(C)n1nc(C(=O)N2CCN3CCC[C@H]3C2)cc1C1CC1	ZINC000195334124	402842451	/nfs/dbraw/zinc/84/24/51/402842451.db2.gz	FIBHAXPBTCAFKI-AWEZNQCLSA-N	0	3	316.449	2.436	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)N3CCN4CCC[C@H]4C3)cc2)c1	ZINC000195334056	402842567	/nfs/dbraw/zinc/84/25/67/402842567.db2.gz	GPDXHMUNKWLWLR-KRWDZBQOSA-N	0	3	310.401	2.101	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Cc2c(C)nn(CC(C)C)c2C)C1	ZINC000194641795	402807504	/nfs/dbraw/zinc/80/75/04/402807504.db2.gz	LYOCYBAEVDSNMM-MRXNPFEDSA-N	0	3	320.481	2.299	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)NCCN1CCC[C@@H](C)C1	ZINC000175477613	402810211	/nfs/dbraw/zinc/81/02/11/402810211.db2.gz	UEXPJVUMXGSFIZ-OAHLLOKOSA-N	0	3	321.469	2.070	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)CC[C@H]1CCOC1	ZINC000175834723	402836961	/nfs/dbraw/zinc/83/69/61/402836961.db2.gz	CCHKUCRVYZONLZ-IRXDYDNUSA-N	0	3	304.434	2.092	10	0		DEAEHN
C[C@H]1COCC[C@@H]1C(=O)Nc1ccc(OCCN(C)C)cc1	ZINC000194068983	402783251	/nfs/dbraw/zinc/78/32/51/402783251.db2.gz	RNTMACNLDIFSID-BBRMVZONSA-N	0	3	306.406	2.238	10	0		DEAEHN
CCC[C@H](C)CC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000176003857	402847174	/nfs/dbraw/zinc/84/71/74/402847174.db2.gz	KKJAMYVOKIQCLD-IRXDYDNUSA-N	0	3	309.498	2.441	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(C(=O)C3C(C)(C)C3(C)C)C2)CC1	ZINC000176005518	402847364	/nfs/dbraw/zinc/84/73/64/402847364.db2.gz	TXIYZVDLQYDWTR-OAHLLOKOSA-N	0	3	321.509	2.297	10	0		DEAEHN
O=C(CN1CCC(c2ccn[nH]2)CC1)Nc1cccc(F)c1	ZINC000195506721	402848407	/nfs/dbraw/zinc/84/84/07/402848407.db2.gz	DFQVDFMVAOLTDX-UHFFFAOYSA-N	0	3	302.353	2.367	10	0		DEAEHN
Cc1cc2c(cc1C)[C@H](C(=O)N1C[C@H]3CCCN3C[C@@H]1C)CO2	ZINC000184525573	402849223	/nfs/dbraw/zinc/84/92/23/402849223.db2.gz	VCUYQHFILUWAAI-ZMSDIMECSA-N	0	3	314.429	2.475	10	0		DEAEHN
CCSCc1cc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)no1	ZINC000184525379	402849396	/nfs/dbraw/zinc/84/93/96/402849396.db2.gz	JWNBECQEXRELDZ-RYUDHWBXSA-N	0	3	309.435	2.236	10	0		DEAEHN
CCCCNC(=O)CN1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000195516112	402849683	/nfs/dbraw/zinc/84/96/83/402849683.db2.gz	BVNHCMRWKMIRMB-HNNXBMFYSA-N	0	3	304.438	2.040	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN(CC(=O)NC(C)(C)C)C2)n1	ZINC000195516110	402849825	/nfs/dbraw/zinc/84/98/25/402849825.db2.gz	BHLCDXQBJRXFCS-CQSZACIVSA-N	0	3	304.438	2.039	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N[C@@H](CO)c2ccccc2)C12CCOCC2	ZINC000274428620	403054504	/nfs/dbraw/zinc/05/45/04/403054504.db2.gz	JNLJITDDJNDKLH-GVDBMIGSSA-N	0	3	305.418	2.284	10	0		DEAEHN
O=C(CN1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O)NCc1ccccc1	ZINC000281310460	403063381	/nfs/dbraw/zinc/06/33/81/403063381.db2.gz	HZQSIGBWJQPRFL-KSZLIROESA-N	0	3	316.445	2.318	10	0		DEAEHN
Cc1nc2cccc(C(=O)N(C)[C@H]3CCN(C)[C@H](C)C3)c2[nH]1	ZINC000283824726	403226572	/nfs/dbraw/zinc/22/65/72/403226572.db2.gz	FMVHJQXYOAHWLN-YPMHNXCESA-N	0	3	300.406	2.426	10	0		DEAEHN
c1ccc2c(c1)ncnc2N1CCC(CN2CCOCC2)CC1	ZINC000298713345	403446199	/nfs/dbraw/zinc/44/61/99/403446199.db2.gz	LHBDDWLBZJBQLX-UHFFFAOYSA-N	0	3	312.417	2.178	10	0		DEAEHN
CCn1cc(CCN2C[C@H](O)C[C@H]2c2cccc(F)c2)cn1	ZINC000286380637	403513015	/nfs/dbraw/zinc/51/30/15/403513015.db2.gz	ZBZCBGAZMGWCCM-SJORKVTESA-N	0	3	303.381	2.393	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)N[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000343512709	403618393	/nfs/dbraw/zinc/61/83/93/403618393.db2.gz	NEASBKMTLVPJDE-WFASDCNBSA-N	0	3	318.421	2.274	10	0		DEAEHN
O=C(Nc1ccc2c(c1F)CCNC2)N1CCO[C@H](C2CC2)C1	ZINC000333342186	403729825	/nfs/dbraw/zinc/72/98/25/403729825.db2.gz	PWLZDALRAYFLEW-HNNXBMFYSA-N	0	3	319.380	2.114	10	0		DEAEHN
Cc1cncc(-c2nc(CN3CCN4CCCC[C@@H]4C3)no2)c1	ZINC000333635895	403799352	/nfs/dbraw/zinc/79/93/52/403799352.db2.gz	BCEUDWBCEJHPQK-OAHLLOKOSA-N	0	3	313.405	2.110	10	0		DEAEHN
CCC[C@@H](O)CN1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000295948822	404024470	/nfs/dbraw/zinc/02/44/70/404024470.db2.gz	LQDKVSRUVDVUGG-HZPDHXFCSA-N	0	3	319.449	2.296	10	0		DEAEHN
c1ccc([C@H]2N(C[C@@H]3COCCO3)CC23CCOCC3)cc1	ZINC000412014883	404057935	/nfs/dbraw/zinc/05/79/35/404057935.db2.gz	RLAWGKNMSZOYTK-IAGOWNOFSA-N	0	3	303.402	2.256	10	0		DEAEHN
C[C@H](N[C@@H]1CCC(=O)N[C@H]1C1CC1)C(=O)N1CCCCCC1	ZINC000328844984	404162177	/nfs/dbraw/zinc/16/21/77/404162177.db2.gz	RJVKKTPDCSNLNX-BJJXKVORSA-N	0	3	307.438	2.265	10	0		DEAEHN
C/C(=C\C(=O)NC[C@@H]1CN2CCC[C@@H]2CO1)c1cccc(F)c1	ZINC000363515341	404171385	/nfs/dbraw/zinc/17/13/85/404171385.db2.gz	FSZKSUUWFXVWGL-UTTIPUOZSA-N	0	3	318.392	2.208	10	0		DEAEHN
O=C(CN1CCCC12CCC2)NC(=O)NCc1cccs1	ZINC000373103470	404528003	/nfs/dbraw/zinc/52/80/03/404528003.db2.gz	GSURFUJLLAFIGQ-UHFFFAOYSA-N	0	3	307.419	2.092	10	0		DEAEHN
Cc1nc([C@H](C)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)no1	ZINC000330251723	404601247	/nfs/dbraw/zinc/60/12/47/404601247.db2.gz	NRIGRMXAVJHSJA-MCIONIFRSA-N	0	3	322.453	2.260	10	0		DEAEHN
O=C(CN1CCCC[C@@H](CO)C1)N(Cc1ccccc1)C1CC1	ZINC000374038020	404675464	/nfs/dbraw/zinc/67/54/64/404675464.db2.gz	MNUADBWCSMYHNT-QGZVFWFLSA-N	0	3	316.445	2.272	10	0		DEAEHN
COc1ccccc1N1CCC[C@H](NCc2c(C)cnn2C)C1	ZINC000375770080	404743166	/nfs/dbraw/zinc/74/31/66/404743166.db2.gz	SDEBFHZZMYGLQZ-HNNXBMFYSA-N	0	3	314.433	2.496	10	0		DEAEHN
COC[C@H](O)CCNCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000360976956	404867625	/nfs/dbraw/zinc/86/76/25/404867625.db2.gz	ZHNKWEQSWXPOSQ-OAHLLOKOSA-N	0	3	309.406	2.129	10	0		DEAEHN
c1cc(-c2ccc(CN3CCC(O[C@H]4CCOC4)CC3)o2)n[nH]1	ZINC000435135562	404959940	/nfs/dbraw/zinc/95/99/40/404959940.db2.gz	ROWHPEMQRJOKHS-HNNXBMFYSA-N	0	3	317.389	2.440	10	0		DEAEHN
CCn1cnnc1[C@@H]1CCC[N@H+](Cc2nc(C)ccc2[O-])C1	ZINC000378349178	404937860	/nfs/dbraw/zinc/93/78/60/404937860.db2.gz	NZXMIDHFFALUCR-CYBMUJFWSA-N	0	3	301.394	2.087	10	0		DEAEHN
CCn1cnnc1[C@@H]1CCC[N@@H+](Cc2nc(C)ccc2[O-])C1	ZINC000378349178	404937863	/nfs/dbraw/zinc/93/78/63/404937863.db2.gz	NZXMIDHFFALUCR-CYBMUJFWSA-N	0	3	301.394	2.087	10	0		DEAEHN
Cc1nc([C@H]2CCCN(Cc3ccc(-c4cc[nH]n4)o3)C2)n[nH]1	ZINC000434986635	404948687	/nfs/dbraw/zinc/94/86/87/404948687.db2.gz	IEYKCCKEBPJXFW-LBPRGKRZSA-N	0	3	312.377	2.476	10	0		DEAEHN
Cc1n[nH]c([C@H]2CCCN(Cc3ccc(-c4cc[nH]n4)o3)C2)n1	ZINC000434986635	404948693	/nfs/dbraw/zinc/94/86/93/404948693.db2.gz	IEYKCCKEBPJXFW-LBPRGKRZSA-N	0	3	312.377	2.476	10	0		DEAEHN
C[C@H]1OCC[C@@]1(O)CNCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000435034427	404950978	/nfs/dbraw/zinc/95/09/78/404950978.db2.gz	NEXNOEWKGWVNPT-FZKQIMNGSA-N	0	3	321.417	2.271	10	0		DEAEHN
C/C=C\CNC[C@H](O)COc1ccc(Br)cc1	ZINC000385081482	405034233	/nfs/dbraw/zinc/03/42/33/405034233.db2.gz	WULSDYBXFVLIOZ-DLGQBQFBSA-N	0	3	300.196	2.355	10	0		DEAEHN
CCOC(=O)COc1ccc(CN(CC)[C@@H]2CCOC2)cc1	ZINC000361254584	404995133	/nfs/dbraw/zinc/99/51/33/404995133.db2.gz	ZPMAJRSRDRSGRM-OAHLLOKOSA-N	0	3	307.390	2.239	10	0		DEAEHN
O[C@H](CC1CCCC1)CN1CCOC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000408041274	405096913	/nfs/dbraw/zinc/09/69/13/405096913.db2.gz	BXNLTTVMFJIDFF-XMTFNYHQSA-N	0	3	311.466	2.180	10	0		DEAEHN
CCN1CC[C@H](CNC(=O)[C@H](C)CC(=O)c2ccccc2F)C1	ZINC000361364073	405040476	/nfs/dbraw/zinc/04/04/76/405040476.db2.gz	ABSLJZCCSLYAJJ-ZIAGYGMSSA-N	0	3	320.408	2.493	10	0		DEAEHN
Cn1c2ccc(CN3CC[C@]4(O)CCCC[C@@H]4C3)cc2oc1=O	ZINC000408066788	405102500	/nfs/dbraw/zinc/10/25/00/405102500.db2.gz	CRZWQEHNZXPKRU-RDTXWAMCSA-N	0	3	316.401	2.259	10	0		DEAEHN
Brc1cnccc1N1CCC[C@@H](c2nc[nH]n2)C1	ZINC000408106472	405114066	/nfs/dbraw/zinc/11/40/66/405114066.db2.gz	KXTGAAPAYYALJY-SECBINFHSA-N	0	3	308.183	2.346	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)c2ccc3c(c2[O-])CCCC3)CC[N@@H+]1C	ZINC000408414993	405201798	/nfs/dbraw/zinc/20/17/98/405201798.db2.gz	MTBHLELBONOMSI-TZMCWYRMSA-N	0	3	302.418	2.484	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)c2ccc3c(c2[O-])CCCC3)CC[N@H+]1C	ZINC000408414993	405201800	/nfs/dbraw/zinc/20/18/00/405201800.db2.gz	MTBHLELBONOMSI-TZMCWYRMSA-N	0	3	302.418	2.484	10	0		DEAEHN
C[C@H]1CN(c2ncnc3c2CCCCC3)CCN1CC(C)(C)O	ZINC000408436872	405206346	/nfs/dbraw/zinc/20/63/46/405206346.db2.gz	KUPWSVCHHDQLOK-AWEZNQCLSA-N	0	3	318.465	2.027	10	0		DEAEHN
Cc1cc2c(ncnc2N2CCN(CC3(O)CCC3)CC2)s1	ZINC000408443976	405208784	/nfs/dbraw/zinc/20/87/84/405208784.db2.gz	SFCPLYVRVUZNLE-UHFFFAOYSA-N	0	3	318.446	2.037	10	0		DEAEHN
FC(F)(F)C1CCC(CN2CCN3CCOC[C@H]3C2)CC1	ZINC000368399441	405239353	/nfs/dbraw/zinc/23/93/53/405239353.db2.gz	JSXNGSRGBWEJNN-JXQTWKCFSA-N	0	3	306.372	2.372	10	0		DEAEHN
COc1ccccc1/C=C\CN1CCN(CC(C)(C)O)C[C@H]1C	ZINC000438257994	405239362	/nfs/dbraw/zinc/23/93/62/405239362.db2.gz	RNOMRCGDSIQORN-DZFYGRHCSA-N	0	3	318.461	2.485	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCOc2ccc(OC)cc2C1	ZINC000456159948	405522209	/nfs/dbraw/zinc/52/22/09/405522209.db2.gz	OQPMQRGXRFVLLR-INIZCTEOSA-N	0	3	318.417	2.291	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNCCC[C@H]1CCOC1	ZINC000449692078	405695478	/nfs/dbraw/zinc/69/54/78/405695478.db2.gz	ZYRVFJPJERJRBH-INIZCTEOSA-N	0	3	300.406	2.233	10	0		DEAEHN
O=C(NCC1CCCCCC1)N[C@H]1CCCN(CCCO)C1	ZINC000459038358	405708612	/nfs/dbraw/zinc/70/86/12/405708612.db2.gz	ZGGLQCPSCLXULU-INIZCTEOSA-N	0	3	311.470	2.103	10	0		DEAEHN
OC[C@@H](CNCc1ccc(-c2cc[nH]n2)o1)Cc1ccco1	ZINC000559477837	405740074	/nfs/dbraw/zinc/74/00/74/405740074.db2.gz	GOEIHCPOROUWNI-GFCCVEGCSA-N	0	3	301.346	2.204	10	0		DEAEHN
CC1=C(C(=O)NC[C@@H]2CCN(C)[C@H]2c2cccnc2)CCCO1	ZINC000583621928	405778274	/nfs/dbraw/zinc/77/82/74/405778274.db2.gz	VEJIPIWSTCXNJW-RDJZCZTQSA-N	0	3	315.417	2.275	10	0		DEAEHN
CS(=O)(=O)NC[C@@H]1CCCN(Cc2ccc(C3CC3)cc2)C1	ZINC000459286689	405836964	/nfs/dbraw/zinc/83/69/64/405836964.db2.gz	XETUFKOERAMCPU-HNNXBMFYSA-N	0	3	322.474	2.325	10	0		DEAEHN
CCC(=O)N[C@H]1CCCN(CCN(C)Cc2ccccc2)C1	ZINC000450328851	405837210	/nfs/dbraw/zinc/83/72/10/405837210.db2.gz	PNMWKXVKRBFXAI-KRWDZBQOSA-N	0	3	303.450	2.109	10	0		DEAEHN
CN(C)CCN(CCN(C)C)C(=O)CC/C=C/c1ccccc1	ZINC000530641393	405837946	/nfs/dbraw/zinc/83/79/46/405837946.db2.gz	HOTNSFVPFSYHFV-XYOKQWHBSA-N	0	3	317.477	2.432	10	0		DEAEHN
CCn1nncc1CN1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000459334099	405858016	/nfs/dbraw/zinc/85/80/16/405858016.db2.gz	DFCCCLWNTCAFCV-MRXNPFEDSA-N	0	3	313.449	2.394	10	0		DEAEHN
COCCOC[C@H](O)CN1CC[C@@H](C)C[C@H]1c1ccc(C)o1	ZINC000450460029	405909426	/nfs/dbraw/zinc/90/94/26/405909426.db2.gz	ZAUPXVYFJKJQTN-BMFZPTHFSA-N	0	3	311.422	2.385	10	0		DEAEHN
Cc1ccc(CN(C)C)cc1NC(=O)c1cn2cccnc2n1	ZINC000531136050	405914710	/nfs/dbraw/zinc/91/47/10/405914710.db2.gz	FVYITBUCLKSFPN-UHFFFAOYSA-N	0	3	309.373	2.352	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)N[C@@H]3CN(C4CC4)C[C@H]3C)cc2)c1	ZINC000531567235	405979589	/nfs/dbraw/zinc/97/95/89/405979589.db2.gz	GPVLITRMSGIJIK-RDTXWAMCSA-N	0	3	324.428	2.393	10	0		DEAEHN
c1ccc(CN2CCCO[C@@H](CN3C[C@@H]4C[C@H]3CS4)C2)cc1	ZINC000459784543	406046012	/nfs/dbraw/zinc/04/60/12/406046012.db2.gz	AEUDCQMPYYSGEX-KSZLIROESA-N	0	3	318.486	2.467	10	0		DEAEHN
CO[C@@H]1CC[C@@H](NC(=O)Nc2ccccc2CCN(C)C)C1	ZINC000471964793	406133534	/nfs/dbraw/zinc/13/35/34/406133534.db2.gz	JXTRQNNCWLSGSS-HUUCEWRRSA-N	0	3	305.422	2.480	10	0		DEAEHN
c1ccc(CN2CC[C@H](N3CCO[C@@]4(CCSC4)C3)C2)cc1	ZINC000569238719	406226596	/nfs/dbraw/zinc/22/65/96/406226596.db2.gz	PUMWHBWYWBGTOE-ROUUACIJSA-N	0	3	318.486	2.469	10	0		DEAEHN
CO[C@H]1CCC[C@H]1CNCc1c(Br)cnn1C	ZINC000487552138	406245278	/nfs/dbraw/zinc/24/52/78/406245278.db2.gz	WRSDMRCVAPPKRB-CABZTGNLSA-N	0	3	302.216	2.087	10	0		DEAEHN
COC[C@@H](NCCCCS(C)(=O)=O)c1ccc(Cl)cc1	ZINC000488675316	406337626	/nfs/dbraw/zinc/33/76/26/406337626.db2.gz	NAALXHRVNWKMTN-CQSZACIVSA-N	0	3	319.854	2.442	10	0		DEAEHN
CC(C)N(CC1CC1)C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637936735	406486402	/nfs/dbraw/zinc/48/64/02/406486402.db2.gz	ZIFDRCFDGWYKLK-KRWDZBQOSA-N	0	3	303.450	2.093	10	0		DEAEHN
N[C@@H]1CCO[C@@H]1C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000637868209	406454260	/nfs/dbraw/zinc/45/42/60/406454260.db2.gz	VZTYUXAEOINONH-SJORKVTESA-N	0	3	312.369	2.320	10	0		DEAEHN
CC(=O)N1CCN(C[C@@H]2CCN(c3ccccc3)C2)[C@H](C)C1	ZINC000638094323	406567309	/nfs/dbraw/zinc/56/73/09/406567309.db2.gz	RBVVSGLSMLLGFG-WBVHZDCISA-N	0	3	301.434	2.066	10	0		DEAEHN
CCc1cnc(CNC[C@H]2CCC3(CCOCC3)[C@H]2O)s1	ZINC000548992067	406571242	/nfs/dbraw/zinc/57/12/42/406571242.db2.gz	UKLSCIPZZYNPLK-DOMZBBRYSA-N	0	3	310.463	2.363	10	0		DEAEHN
O=C([C@H]1CNCCOC1)N(Cc1ccccc1)c1ccccc1	ZINC000643618477	407018193	/nfs/dbraw/zinc/01/81/93/407018193.db2.gz	PTMAEKAUFJWPDL-KRWDZBQOSA-N	0	3	310.397	2.456	10	0		DEAEHN
CCNCc1cnc(Sc2ccc(S(C)(=O)=O)cc2)nc1	ZINC000128900915	196002861	/nfs/dbraw/zinc/00/28/61/196002861.db2.gz	FRKNWVOVKRSPBX-UHFFFAOYSA-N	0	3	323.443	2.141	10	0		DEAEHN
CCc1cc(CC)n(Cc2nc(=NN)c3ccsc3[nH]2)n1	ZINC000130662608	196099384	/nfs/dbraw/zinc/09/93/84/196099384.db2.gz	JGCKAWVIYXAXGY-UHFFFAOYSA-N	0	3	302.407	2.347	10	0		DEAEHN
Cc1c(CN)cccc1S(=O)(=O)NCCCC(F)(F)F	ZINC000131217503	196150489	/nfs/dbraw/zinc/15/04/89/196150489.db2.gz	PWPKKLWQSROADX-UHFFFAOYSA-N	0	3	310.341	2.075	10	0		DEAEHN
CCc1ccc(CN)cc1S(=O)(=O)NCCCC(F)(F)F	ZINC000131221986	196151352	/nfs/dbraw/zinc/15/13/52/196151352.db2.gz	SXRIYBWNULXDQZ-UHFFFAOYSA-N	0	3	324.368	2.329	10	0		DEAEHN
C(c1nn2c(nnc2C2CCCC2)s1)[C@@H]1CSCCN1	ZINC000133980176	196350875	/nfs/dbraw/zinc/35/08/75/196350875.db2.gz	QJEXIZUBXBKWFQ-SNVBAGLBSA-N	0	3	309.464	2.091	10	0		DEAEHN
C[C@@](CN)(Nc1ccccc1S(C)(=O)=O)c1ccccc1	ZINC000134474772	196395157	/nfs/dbraw/zinc/39/51/57/196395157.db2.gz	LQJKDPPKEZFYBX-INIZCTEOSA-N	0	3	304.415	2.376	10	0		DEAEHN
CCSc1cccc(N2CCCC[C@@H]2C(=O)NC)c1CN	ZINC000136518529	196539635	/nfs/dbraw/zinc/53/96/35/196539635.db2.gz	HWZCPJMRCZFODB-CQSZACIVSA-N	0	3	307.463	2.362	10	0		DEAEHN
CN[C@H](CN(C)CC(F)F)c1ccc2c(c1)OCCCO2	ZINC000136811694	196553736	/nfs/dbraw/zinc/55/37/36/196553736.db2.gz	PVJHBWIDLYKLEN-GFCCVEGCSA-N	0	3	300.349	2.305	10	0		DEAEHN
Cc1ccc(CNC(C)C)cc1S(=O)(=O)N(C)CC(F)F	ZINC000137044054	196561808	/nfs/dbraw/zinc/56/18/08/196561808.db2.gz	ZARPSLDJINRLQB-UHFFFAOYSA-N	0	3	320.405	2.379	10	0		DEAEHN
Cc1nnc(NC(=O)N[C@@H](CN(C)C)c2ccccc2)s1	ZINC000043408750	424811972	/nfs/dbraw/zinc/81/19/72/424811972.db2.gz	GUNVBMRIEMSWNP-LBPRGKRZSA-N	0	3	305.407	2.271	10	0		DEAEHN
CC(C)C(=O)N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC000404151855	424925153	/nfs/dbraw/zinc/92/51/53/424925153.db2.gz	QBZASLDSHIVVRU-IAGOWNOFSA-N	0	3	302.418	2.144	10	0		DEAEHN
CC(C)O[C@@H]1CCCN(C[C@H](O)COCc2ccccc2)C1	ZINC000404487759	424928393	/nfs/dbraw/zinc/92/83/93/424928393.db2.gz	ODNDTBIJZYEMJO-ZWKOTPCHSA-N	0	3	307.434	2.454	10	0		DEAEHN
Cc1ccc(CNC(=O)CN(C)[C@]2(CO)CC[C@@H](C)C2)cc1F	ZINC000249567155	424887588	/nfs/dbraw/zinc/88/75/88/424887588.db2.gz	NHHANRDWSKQPMP-FZKQIMNGSA-N	0	3	322.424	2.233	10	0		DEAEHN
CO[C@@](C)(CNCc1cnn(C)c1C)COCc1ccccc1	ZINC000657591656	425370942	/nfs/dbraw/zinc/37/09/42/425370942.db2.gz	KFYMOEAZQUBHIT-SFHVURJKSA-N	0	3	317.433	2.440	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)NCc1nccn1CC(C)C	ZINC000176625065	267541338	/nfs/dbraw/zinc/54/13/38/267541338.db2.gz	AZHNEJURRXVPPH-HNNXBMFYSA-N	0	3	321.469	2.213	10	0		DEAEHN
NC[C@H](NC(=O)CCOc1ccccc1Cl)C(F)(F)F	ZINC000655509431	425585757	/nfs/dbraw/zinc/58/57/57/425585757.db2.gz	NIRFTGKVDCXGBA-JTQLQIEISA-N	0	3	310.703	2.115	10	0		DEAEHN
Cc1ccccc1SCC(=O)N(C)[C@H](CN)C(F)(F)F	ZINC000662976375	425770642	/nfs/dbraw/zinc/77/06/42/425770642.db2.gz	OSLLLLKRZBNQQP-LLVKDONJSA-N	0	3	306.353	2.435	10	0		DEAEHN
CO[C@@H](C)[C@@H](C)N[C@H](C)c1cc(S(N)(=O)=O)c(C)cc1C	ZINC000514895395	269336043	/nfs/dbraw/zinc/33/60/43/269336043.db2.gz	XDJYOMPTPWKHLK-UPJWGTAASA-N	0	3	314.451	2.025	10	0		DEAEHN
O[C@H](CN1CCC(Nc2ccccn2)CC1)CC(F)(F)F	ZINC000526057021	269502149	/nfs/dbraw/zinc/50/21/49/269502149.db2.gz	WMZFXXZKQSTCOO-LBPRGKRZSA-N	0	3	303.328	2.271	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)Nn1cnc2ccccc21	ZINC000079496081	275594153	/nfs/dbraw/zinc/59/41/53/275594153.db2.gz	VCOIDJNZFGVSPV-CYBMUJFWSA-N	0	3	303.410	2.266	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@H](c2ccc(F)cc2)C1)N(C)C	ZINC000178645925	276037817	/nfs/dbraw/zinc/03/78/17/276037817.db2.gz	CQGPQALZTATGCC-CVEARBPZSA-N	0	3	308.397	2.456	10	0		DEAEHN
CC1(C)C[C@H](NCC(=O)N2CCO[C@H]3CCCC[C@@H]32)C(C)(C)O1	ZINC000132458971	276148264	/nfs/dbraw/zinc/14/82/64/276148264.db2.gz	XOQBRHQNYWVGNF-KKUMJFAQSA-N	0	3	324.465	2.092	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1ccc(F)cc1C	ZINC000176903483	276179423	/nfs/dbraw/zinc/17/94/23/276179423.db2.gz	FJZZCRUAXAVSCR-AWEZNQCLSA-N	0	3	321.396	2.015	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)N1CCCc2ccccc21	ZINC000175344882	276182369	/nfs/dbraw/zinc/18/23/69/276182369.db2.gz	NVAFQWFZOCUBOW-KRWDZBQOSA-N	0	3	315.461	2.382	10	0		DEAEHN
CCN1CCN(CC2(O)CCC(C)CC2)C[C@H]1c1ncc[nH]1	ZINC000408280417	276193976	/nfs/dbraw/zinc/19/39/76/276193976.db2.gz	HLUGFUMOTGUGQD-CKDBGZEDSA-N	0	3	306.454	2.030	10	0		DEAEHN
CCn1c(CN[C@H]2CCCC[C@@H]2C(N)=O)nc2cc(F)ccc21	ZINC000184822247	276710105	/nfs/dbraw/zinc/71/01/05/276710105.db2.gz	GDIUXGQWWQALBV-STQMWFEESA-N	0	3	318.396	2.329	10	0		DEAEHN
CC(=O)N1CCc2cc(NC(=O)[C@H]3NCCCC3(C)C)ccc21	ZINC000261891282	277012255	/nfs/dbraw/zinc/01/22/55/277012255.db2.gz	NURQSYSMFWWKQE-MRXNPFEDSA-N	0	3	315.417	2.312	10	0		DEAEHN
CC(=O)N[C@H](C(=O)NCCN1[C@H](C)CCC[C@H]1C)C1CCCC1	ZINC000341062670	277050714	/nfs/dbraw/zinc/05/07/14/277050714.db2.gz	CLBINWFCUSZENL-CPUCHLNUSA-N	0	3	323.481	2.060	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000115810259	277080404	/nfs/dbraw/zinc/08/04/04/277080404.db2.gz	CJENRFHQIBKKRO-WBVHZDCISA-N	0	3	316.449	2.049	10	0		DEAEHN
CC(=O)c1ccccc1OCCN(C[C@@H]1CCC(=O)N1)C(C)C	ZINC000412088853	277115754	/nfs/dbraw/zinc/11/57/54/277115754.db2.gz	SPHFOZHJXNINIA-HNNXBMFYSA-N	0	3	318.417	2.257	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2CCSc3ccccc32)n1	ZINC000263298552	277116522	/nfs/dbraw/zinc/11/65/22/277116522.db2.gz	WSYQYZPVDRFMCU-QWHCGFSZSA-N	0	3	316.430	2.273	10	0		DEAEHN
CC(C)(C)[C@H](N)C(=O)N1CCC(C(=O)N2CCCCCC2)CC1	ZINC000150767087	277247918	/nfs/dbraw/zinc/24/79/18/277247918.db2.gz	JNOQYJNKNDNDTM-OAHLLOKOSA-N	0	3	323.481	2.001	10	0		DEAEHN
C[C@@H]1CN(C(=O)[C@@H](N)C2CCOCC2)CC[C@@H]1c1ccccc1	ZINC000261762034	277839331	/nfs/dbraw/zinc/83/93/31/277839331.db2.gz	LUGUTOBYTDINEZ-JLSDUUJJSA-N	0	3	316.445	2.393	10	0		DEAEHN
CC(C)[C@@H]1OCCC[C@@H]1CNC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000176799553	277839630	/nfs/dbraw/zinc/83/96/30/277839630.db2.gz	XKGSCWFHLTYDOY-IKGGRYGDSA-N	0	3	321.465	2.093	10	0		DEAEHN
Cc1cnn([C@@H]2CCCN(C[C@@H]3CC4(CCC4)C(=O)O3)C2)c1	ZINC000192009884	279034366	/nfs/dbraw/zinc/03/43/66/279034366.db2.gz	TUVUVKUGGOHVBU-CABCVRRESA-N	0	3	303.406	2.314	10	0		DEAEHN
C[C@H](C(=O)N[C@@H]1CCCC[C@H]1C)N1CCCN(C2CC2)CC1	ZINC000172346516	279228131	/nfs/dbraw/zinc/22/81/31/279228131.db2.gz	ZYHOOUHVXDWADJ-BFYDXBDKSA-N	0	3	307.482	2.240	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccccc1NC(=O)OC	ZINC000176992305	279300734	/nfs/dbraw/zinc/30/07/34/279300734.db2.gz	PAEBDCAWUBLGFO-CYBMUJFWSA-N	0	3	319.405	2.421	10	0		DEAEHN
CCS(=O)(=O)C[C@@H](C)N[C@@H]1CCOC2(CCCCC2)C1	ZINC000408102876	280001080	/nfs/dbraw/zinc/00/10/80/280001080.db2.gz	DOHOZMIXKYMFNI-ZIAGYGMSSA-N	0	3	303.468	2.281	10	0		DEAEHN
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CCCC1(C)C	ZINC000176074847	280809291	/nfs/dbraw/zinc/80/92/91/280809291.db2.gz	KEJHYXJKMYNLAC-UHFFFAOYSA-N	0	3	317.433	2.396	10	0		DEAEHN
CC[C@H]1CN(CCN2C(=O)CNC2=O)CC[C@H]1c1ccccc1	ZINC000245411207	281167654	/nfs/dbraw/zinc/16/76/54/281167654.db2.gz	VUNQGHVRFSUACA-GOEBONIOSA-N	0	3	315.417	2.054	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1[C@H](N[C@H]2C=CCCC2)CC(=O)N1C	ZINC000330346149	293733143	/nfs/dbraw/zinc/73/31/43/293733143.db2.gz	GCUOYDHGBAZMBY-JJRVBVJISA-N	0	3	302.422	2.007	10	0		DEAEHN
COc1ccc2c(c1)[C@H](NCC1(O)CCOCC1)CCCO2	ZINC000178634975	295274112	/nfs/dbraw/zinc/27/41/12/295274112.db2.gz	DEZVEKSVVYGDDN-OAHLLOKOSA-N	0	3	307.390	2.040	10	0		DEAEHN
C[C@H](CC(=O)N(C)c1ccccc1)NCC1(C)OCCCO1	ZINC000190661705	298284594	/nfs/dbraw/zinc/28/45/94/298284594.db2.gz	FMRNRAYUVRRZJI-CQSZACIVSA-N	0	3	306.406	2.171	10	0		DEAEHN
C[C@@H]1CCCN(c2cc(NC[C@@H]3CCCN(C)C3)ncn2)C1	ZINC000302004843	533702825	/nfs/dbraw/zinc/70/28/25/533702825.db2.gz	ZNSPPTLSUMRVSV-CABCVRRESA-N	0	3	303.454	2.467	10	0		DEAEHN
CN[C@H](C)C(=O)NCc1cc(Cl)ccc1Br	ZINC000576171273	326274825	/nfs/dbraw/zinc/27/48/25/326274825.db2.gz	JFBVKVGCZILIFA-SSDOTTSWSA-N	0	3	305.603	2.327	10	0		DEAEHN
CC[C@@H]1CN(c2nc3c(cccc3F)o2)CCN1C[C@H](C)O	ZINC000577445701	326366089	/nfs/dbraw/zinc/36/60/89/326366089.db2.gz	HEJNXLRFERBCLP-NWDGAFQWSA-N	0	3	307.369	2.248	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNC[C@H]1Cc2ccccc2O1	ZINC000582821413	337203048	/nfs/dbraw/zinc/20/30/48/337203048.db2.gz	PCOWZOAZJGIGIS-GOSISDBHSA-N	0	3	320.396	2.420	10	0		DEAEHN
CCOC(=O)C(C(=O)OCC)[C@@H](c1ccc(F)cc1)N(C)C	ZINC000584651321	337380903	/nfs/dbraw/zinc/38/09/03/337380903.db2.gz	VMYKQAQMUMMBTQ-CQSZACIVSA-N	0	3	311.353	2.171	10	0		DEAEHN
Cc1cc(Cl)ccc1OCC(=O)N1CCN2CCC[C@H]2C1	ZINC000195315655	533787948	/nfs/dbraw/zinc/78/79/48/533787948.db2.gz	GOYCWLMRHPDELB-AWEZNQCLSA-N	0	3	308.809	2.334	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1cc(C)sc1C	ZINC000032072680	517643294	/nfs/dbraw/zinc/64/32/94/517643294.db2.gz	FZVVZHYCVVFAFK-JTQLQIEISA-N	0	3	304.481	2.374	10	0		DEAEHN
CC(C)COc1ccccc1CNC1CCN(C(N)=O)CC1	ZINC000130796517	519765050	/nfs/dbraw/zinc/76/50/50/519765050.db2.gz	JSAVWTBOSQWTET-UHFFFAOYSA-N	0	3	305.422	2.354	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](C)Cc2c(C)noc2C)C1	ZINC000247453226	521646454	/nfs/dbraw/zinc/64/64/54/521646454.db2.gz	ZNJKXQOPSYAUFR-RISCZKNCSA-N	0	3	308.426	2.006	10	0		DEAEHN
CNC(=O)c1ccc(CN(C)CCc2ncc(C)s2)cc1	ZINC000157421675	521808174	/nfs/dbraw/zinc/80/81/74/521808174.db2.gz	LFAZDCJGDMLXDM-UHFFFAOYSA-N	0	3	303.431	2.486	10	0		DEAEHN
O=C(CN[C@@H]1CCC(=O)N[C@H]1C1CC1)Nc1ccc(F)cc1	ZINC000328929024	534594873	/nfs/dbraw/zinc/59/48/73/534594873.db2.gz	YGVSQGAIJZBDDE-CJNGLKHVSA-N	0	3	305.353	2.251	10	0		DEAEHN
COC(=O)c1ccc(CN(C)C[C@@H](O)COC(C)(C)C)cc1	ZINC000157544565	521998807	/nfs/dbraw/zinc/99/88/07/521998807.db2.gz	YFJRKAVAHVJPDA-OAHLLOKOSA-N	0	3	309.406	2.081	10	0		DEAEHN
CCc1nc(CNC(=O)N2CC[C@@H](N3CCCC3)C2)cs1	ZINC000107854087	522329976	/nfs/dbraw/zinc/32/99/76/522329976.db2.gz	ZWYKHMNLKFSXAW-CYBMUJFWSA-N	0	3	308.451	2.085	10	0		DEAEHN
CCc1noc(CC)c1CC(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000247020001	522886708	/nfs/dbraw/zinc/88/67/08/522886708.db2.gz	HJVKQAKHPMNNBM-DOMZBBRYSA-N	0	3	307.438	2.187	10	0		DEAEHN
CC[C@H]1CN(CCCCCn2cccn2)CCN1CCOC	ZINC000105837413	523273762	/nfs/dbraw/zinc/27/37/62/523273762.db2.gz	XAJXEEUMWMQAPJ-KRWDZBQOSA-N	0	3	308.470	2.096	10	0		DEAEHN
COc1ccccc1CCN(C)CCn1c(C)csc1=O	ZINC000104710384	524408309	/nfs/dbraw/zinc/40/83/09/524408309.db2.gz	UBZSCULTKOMPBX-UHFFFAOYSA-N	0	3	306.431	2.401	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(-n2ccnc2C)cc1	ZINC000450677480	534789878	/nfs/dbraw/zinc/78/98/78/534789878.db2.gz	GNXKDXNTANDOHB-SJCJKPOMSA-N	0	3	301.390	2.171	10	0		DEAEHN
COc1ccc(O)cc1C(=O)N[C@@H](C)CN1CCC[C@@H](C)C1	ZINC000249121021	524779271	/nfs/dbraw/zinc/77/92/71/524779271.db2.gz	PVXMWTJWPFACOG-OLZOCXBDSA-N	0	3	306.406	2.251	10	0		DEAEHN
c1ccc(CSCCCN2CCN3CCOC[C@@H]3C2)cc1	ZINC000363807732	526476025	/nfs/dbraw/zinc/47/60/25/526476025.db2.gz	YVQVJONGOZAHNF-KRWDZBQOSA-N	0	3	306.475	2.326	10	0		DEAEHN
CC1(C)CC[C@@H](CNC(=O)N2CCN(C3CCCC3)CC2)O1	ZINC000188215098	529021839	/nfs/dbraw/zinc/02/18/39/529021839.db2.gz	VUYVBSLKBFDTNA-HNNXBMFYSA-N	0	3	309.454	2.214	10	0		DEAEHN
CC(C)(CNC(=O)C1(N)CCOCC1)c1ccc(Cl)cc1	ZINC000261880078	535092443	/nfs/dbraw/zinc/09/24/43/535092443.db2.gz	PCCAQLCUIMKFDE-UHFFFAOYSA-N	0	3	310.825	2.242	10	0		DEAEHN
CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1cc(OC)ccc1[O-]	ZINC000246572924	535876335	/nfs/dbraw/zinc/87/63/35/535876335.db2.gz	NHXXVFHUINHQPS-OLZOCXBDSA-N	0	3	304.390	2.100	10	0		DEAEHN
CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc(OC)ccc1[O-]	ZINC000246572924	535876341	/nfs/dbraw/zinc/87/63/41/535876341.db2.gz	NHXXVFHUINHQPS-OLZOCXBDSA-N	0	3	304.390	2.100	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(C[C@@H](O)COC(C)(C)C)C1	ZINC000247062286	536174832	/nfs/dbraw/zinc/17/48/32/536174832.db2.gz	GAMGQJJCPOMWPN-HUUCEWRRSA-N	0	3	309.454	2.258	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2[nH]nc3ccccc32)C1	ZINC000247296157	536471710	/nfs/dbraw/zinc/47/17/10/536471710.db2.gz	OIBRWCWZANFLFU-SUMWQHHRSA-N	0	3	312.417	2.048	10	0		DEAEHN
COCCO[C@@H]1CCCN(CCN(C)Cc2ccc(F)cc2)C1	ZINC000248569137	536556629	/nfs/dbraw/zinc/55/66/29/536556629.db2.gz	QCRMDANDMZGWKX-GOSISDBHSA-N	0	3	324.440	2.385	10	0		DEAEHN
COCCOc1ccccc1CNCCN1CC=C(C)CC1	ZINC000358125597	536730827	/nfs/dbraw/zinc/73/08/27/536730827.db2.gz	AAIGLDWPBNMUHN-UHFFFAOYSA-N	0	3	304.434	2.453	10	0		DEAEHN
COc1ccc(CN[C@@H]2CCC[C@H]2[C@@H]2COCCN2)c(F)c1	ZINC000261933507	536897474	/nfs/dbraw/zinc/89/74/74/536897474.db2.gz	LZVLFZCQKRHUGS-OIISXLGYSA-N	0	3	308.397	2.081	10	0		DEAEHN
COc1cccc(CC(=O)N2CCN([C@H](C)C3CC3)CC2)c1	ZINC000074766957	633813223	/nfs/dbraw/zinc/81/32/23/633813223.db2.gz	FVIHMFREWVHMFX-CQSZACIVSA-N	0	3	302.418	2.180	10	0		DEAEHN
c1cn(-c2cc(CNCc3cnc4ccccn34)ccn2)cn1	ZINC000236571613	635989078	/nfs/dbraw/zinc/98/90/78/635989078.db2.gz	KMXGDKWIUAAMJF-UHFFFAOYSA-N	0	3	304.357	2.205	10	0		DEAEHN
C[C@@H]1[C@@H](OC(=O)c2cccc(CN3CCCC3)c2)CC(=O)N1C	ZINC000806080595	644651064	/nfs/dbraw/zinc/65/10/64/644651064.db2.gz	HSVIYJIRHROJBL-CJNGLKHVSA-N	0	3	316.401	2.058	10	0		DEAEHN
C[C@H]1CN2CCCC[C@@H]2CN1c1nc(Cl)nc2nc[nH]c21	ZINC000165507090	646500411	/nfs/dbraw/zinc/50/04/11/646500411.db2.gz	YHRIHFYIDRDJIE-VHSXEESVSA-N	0	3	306.801	2.069	10	0		DEAEHN
C[C@@H](NC[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1nccn1C	ZINC000230412497	646729070	/nfs/dbraw/zinc/72/90/70/646729070.db2.gz	BWBFQSVZBXGIEJ-CHWSQXEVSA-N	0	3	308.426	2.328	10	0		DEAEHN
CCOC(CN[C@H](C)c1ccc(-n2cncn2)cc1)OCC	ZINC000125356562	684145272	/nfs/dbraw/zinc/14/52/72/684145272.db2.gz	QEOFLYSYRIJZRA-CYBMUJFWSA-N	0	3	304.394	2.317	10	0		DEAEHN
Cc1cc(C)c(N2CC[C@H](N[C@H]3CCCOC3)C2=O)c(C)c1	ZINC000189457667	684380838	/nfs/dbraw/zinc/38/08/38/684380838.db2.gz	UCWNUXRAFUMXTG-HOTGVXAUSA-N	0	3	302.418	2.486	10	0		DEAEHN
CN(C)C[C@H](NC(=O)[C@@H]1CSCCS1)c1ccccc1	ZINC000192933023	684460584	/nfs/dbraw/zinc/46/05/84/684460584.db2.gz	WTIKUIIEKXZBBP-KBPBESRZSA-N	0	3	310.488	2.254	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cccnc1SC(F)F	ZINC000194727235	685076493	/nfs/dbraw/zinc/07/64/93/685076493.db2.gz	QDZDPTDOULOEBQ-VIFPVBQESA-N	0	3	301.362	2.220	10	0		DEAEHN
CCc1nocc1CN(C)C[C@H]1CCO[C@@H]1c1cnn(C)c1	ZINC000886074681	691998158	/nfs/dbraw/zinc/99/81/58/691998158.db2.gz	NPUJJMRMWKCSGS-WBMJQRKESA-N	0	3	304.394	2.180	10	0		DEAEHN
CCN(CCO)CCNC(=O)/C(C)=C\c1ccc(Cl)cc1	ZINC000588488340	777272159	/nfs/dbraw/zinc/27/21/59/777272159.db2.gz	HBGCEZOPRJPLCB-SEYXRHQNSA-N	0	3	310.825	2.174	10	0		DEAEHN
COc1ccccc1/C(C)=C\C(=O)N1CCN2CCC1CC2	ZINC000588561895	777418406	/nfs/dbraw/zinc/41/84/06/777418406.db2.gz	QQMAZWDFWIYBER-YPKPFQOOSA-N	0	3	300.402	2.405	10	0		DEAEHN
Cc1n[nH]cc1CN[C@H]1CN(C(=O)OC(C)(C)C)CC1(C)C	ZINC000721850090	780347308	/nfs/dbraw/zinc/34/73/08/780347308.db2.gz	QOCKVZJQHACTNM-ZDUSSCGKSA-N	0	3	308.426	2.453	10	0		DEAEHN
Cn1cc(CN[C@@H]2CN(C(=O)OC(C)(C)C)CC2(C)C)cn1	ZINC000721853385	780371104	/nfs/dbraw/zinc/37/11/04/780371104.db2.gz	ZRFABRYYKSEFBV-CYBMUJFWSA-N	0	3	308.426	2.155	10	0		DEAEHN
C[C@H](C(=O)NC12CC3CC(CC(C3)C1)C2)N(C)CC1CC(O)C1	ZINC000190112635	786065571	/nfs/dbraw/zinc/06/55/71/786065571.db2.gz	JNVNAFVULJQPMK-CKTWYIBQSA-N	0	3	320.477	2.163	10	0		DEAEHN
Cn1cc(CNC[C@H]2CCOC2(C)C)c(Br)n1	ZINC000712458690	792189087	/nfs/dbraw/zinc/18/90/87/792189087.db2.gz	HUHLHSUAJATNCH-SNVBAGLBSA-N	0	3	302.216	2.087	10	0		DEAEHN
C[C@@H](NC1CC(C(N)=O)C1)c1sccc1Br	ZINC000716775295	793007159	/nfs/dbraw/zinc/00/71/59/793007159.db2.gz	PQANVJKOEGYPRV-JECWYVHBSA-N	0	3	303.225	2.425	10	0		DEAEHN
C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CCNCc1cc[nH]n1	ZINC000721032706	1085599869	/nfs/dbraw/zinc/59/98/69/1085599869.db2.gz	WFJFMGTZRLDQFL-CHWSQXEVSA-N	0	3	308.426	2.392	10	0		DEAEHN
CO[C@@H]1CCC[C@@H](NCc2cn(C)nc2Br)C1	ZINC000720645727	1085802061	/nfs/dbraw/zinc/80/20/61/1085802061.db2.gz	LZIFYTOSECNBSV-GHMZBOCLSA-N	0	3	302.216	2.230	10	0		DEAEHN
CN1CCC[C@H]2[C@@H]1CCN2C(=O)c1ccc(Br)nc1	ZINC000720831667	1086194819	/nfs/dbraw/zinc/19/48/19/1086194819.db2.gz	WMBJZICQTOLZGB-RYUDHWBXSA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@]12CN(Cc3ccccc3)C[C@H]1CN(c1ncc(C=O)cn1)C2	ZINC000702091392	1086406602	/nfs/dbraw/zinc/40/66/02/1086406602.db2.gz	YTYGMMGSRQULNR-PKOBYXMFSA-N	0	3	322.412	2.247	10	0		DEAEHN
C[C@H](CNC(=O)[C@@H](N)CN(C)Cc1ccccc1)C(C)(C)C	ZINC000702358486	1086423251	/nfs/dbraw/zinc/42/32/51/1086423251.db2.gz	SALLJVAOXSRNPB-ZBFHGGJFSA-N	0	3	305.466	2.244	10	0		DEAEHN
Cc1ccc(CNC(C)(C)CNS(C)(=O)=O)cc1Cl	ZINC000708293371	1086678258	/nfs/dbraw/zinc/67/82/58/1086678258.db2.gz	RECXFWRZSVSLPC-UHFFFAOYSA-N	0	3	304.843	2.066	10	0		DEAEHN
NC(=O)CC1CC(NCc2cc(Br)ccc2F)C1	ZINC000718560840	1088597891	/nfs/dbraw/zinc/59/78/91/1088597891.db2.gz	UTXZLYBGJPBISB-UHFFFAOYSA-N	0	3	315.186	2.332	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000278296480	214073684	/nfs/dbraw/zinc/07/36/84/214073684.db2.gz	HOQNURYFBHTISP-SUMWQHHRSA-N	0	3	317.433	2.224	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCCOc1ccc(Cl)cc1	ZINC000139401306	282101093	/nfs/dbraw/zinc/10/10/93/282101093.db2.gz	FOTSIXWAZSYOFA-ZDUSSCGKSA-N	0	3	311.813	2.112	10	0		DEAEHN
CCN[C@@H](CSCC(=O)OCC)c1ccc2c(c1)OCO2	ZINC000081795694	192324790	/nfs/dbraw/zinc/32/47/90/192324790.db2.gz	PSBGHJXDLNRFOL-LBPRGKRZSA-N	0	3	311.403	2.362	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NC[C@H]1CCCS1)c1ccccc1	ZINC000162890221	282116609	/nfs/dbraw/zinc/11/66/09/282116609.db2.gz	PAVHZTSGGICWRQ-HUUCEWRRSA-N	0	3	307.463	2.484	10	0		DEAEHN
c1ccc(CN2CCCN(CCOC3CCOCC3)CC2)cc1	ZINC000625062423	365630386	/nfs/dbraw/zinc/63/03/86/365630386.db2.gz	SUFBPCXSSAAONS-UHFFFAOYSA-N	0	3	318.461	2.390	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)c2n[nH]c3ccc(Cl)cc32)C1	ZINC000278507512	214200336	/nfs/dbraw/zinc/20/03/36/214200336.db2.gz	AGLCVLBQBBEQEI-LLVKDONJSA-N	0	3	306.797	2.383	10	0		DEAEHN
N[C@@H]1CCC[C@H]1S(=O)(=O)c1ccccc1Br	ZINC000081932223	192341378	/nfs/dbraw/zinc/34/13/78/192341378.db2.gz	ZRJMOIDTZCOAHG-MWLCHTKSSA-N	0	3	304.209	2.103	10	0		DEAEHN
CCCN[C@H](CS(=O)(=O)CCOC)c1ccc(CC)cc1	ZINC000081961904	192345162	/nfs/dbraw/zinc/34/51/62/192345162.db2.gz	YTWLRLQLMJCDMK-MRXNPFEDSA-N	0	3	313.463	2.351	10	0		DEAEHN
CC(C)N[C@@](CSc1ncccc1Cl)(C(N)=O)C1CC1	ZINC000079448579	185172283	/nfs/dbraw/zinc/17/22/83/185172283.db2.gz	HMVMODQIVTXTPP-CQSZACIVSA-N	0	3	313.854	2.459	10	0		DEAEHN
O=c1[nH]ccnc1N1CCC[C@@H](NCc2cccc3cc[nH]c32)C1	ZINC000328646619	231282863	/nfs/dbraw/zinc/28/28/63/231282863.db2.gz	STHRVYTYACHYOR-OAHLLOKOSA-N	0	3	323.400	2.422	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)c2cccc(C)c2)[C@H](C)C1	ZINC000173255308	282189703	/nfs/dbraw/zinc/18/97/03/282189703.db2.gz	YLPZDBAJDKJMTQ-GDBMZVCRSA-N	0	3	310.463	2.346	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N2CCN3CCC[C@@H]3C2)C12CCCC2	ZINC000173513249	282191143	/nfs/dbraw/zinc/19/11/43/282191143.db2.gz	IVZXMJORLQNAQA-OWCLPIDISA-N	0	3	321.465	2.214	10	0		DEAEHN
CCCNCC(=O)Nc1ccc(OC)c(Br)c1	ZINC000088321922	185245746	/nfs/dbraw/zinc/24/57/46/185245746.db2.gz	ILCQXEWQGUSNDK-UHFFFAOYSA-N	0	3	301.184	2.396	10	0		DEAEHN
C[C@H](C(=O)Nc1cccc(CN)c1)N(C)CCC(F)(F)F	ZINC000088417592	185249295	/nfs/dbraw/zinc/24/92/95/185249295.db2.gz	OFBQICWUAFKJNM-SNVBAGLBSA-N	0	3	303.328	2.357	10	0		DEAEHN
CC(C)CC[C@@H](C)NCc1ccc(S(=O)(=O)N(C)C)o1	ZINC000088539911	185255358	/nfs/dbraw/zinc/25/53/58/185255358.db2.gz	CUARBTXXVYDKPM-GFCCVEGCSA-N	0	3	302.440	2.444	10	0		DEAEHN
CCCC[C@@H](CC)C[NH2+]Cc1ccc(S(=O)(=O)[N-]C)o1	ZINC000088539921	185255594	/nfs/dbraw/zinc/25/55/94/185255594.db2.gz	VNLQJXVGZMQZAK-GFCCVEGCSA-N	0	3	302.440	2.494	10	0		DEAEHN
CC(C)[C@@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)(C)C)o1	ZINC000088541819	185255887	/nfs/dbraw/zinc/25/58/87/185255887.db2.gz	ABMCSRWVSCVEDT-LLVKDONJSA-N	0	3	302.440	2.491	10	0		DEAEHN
CNCc1cc(Cl)cc(Cl)c1OCc1ncnn1C	ZINC000088571707	185258328	/nfs/dbraw/zinc/25/83/28/185258328.db2.gz	BUMBCURQSYPFQZ-UHFFFAOYSA-N	0	3	301.177	2.420	10	0		DEAEHN
Cc1ccccc1S(=O)(=O)NC1C[C@H]2CCC[C@@H](C1)N2C	ZINC000088719090	185263304	/nfs/dbraw/zinc/26/33/04/185263304.db2.gz	CWPBJPMLOPAAMS-GOOCMWNKSA-N	0	3	308.447	2.289	10	0		DEAEHN
CC[C@@H](NC[C@](C)(O)CO)c1cccc(Br)c1	ZINC000090284463	185289313	/nfs/dbraw/zinc/28/93/13/185289313.db2.gz	QONJQHUWRPGOTB-OLZOCXBDSA-N	0	3	302.212	2.233	10	0		DEAEHN
Cc1cc(Cl)c(NC(=O)[C@H]2COC[C@H]2N)c2cccnc12	ZINC000090379771	185293738	/nfs/dbraw/zinc/29/37/38/185293738.db2.gz	MMTFFXUEVJXRQZ-CMPLNLGQSA-N	0	3	305.765	2.109	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1cc(Cl)cc2cccnc21	ZINC000090432811	185295776	/nfs/dbraw/zinc/29/57/76/185295776.db2.gz	ZWHYTUHNMOOISZ-AAEUAGOBSA-N	0	3	305.765	2.061	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1nc2ccc(Cl)cc2s1	ZINC000090431480	185296022	/nfs/dbraw/zinc/29/60/22/185296022.db2.gz	NEPZJJLRRDBYFM-WCBMZHEXSA-N	0	3	311.794	2.123	10	0		DEAEHN
C[C@@]1(C(=O)Nc2ccc(-c3nccs3)cc2)COC[C@@H]1N	ZINC000090589673	185305340	/nfs/dbraw/zinc/30/53/40/185305340.db2.gz	LMBFDXQGFXLJSV-SWLSCSKDSA-N	0	3	303.387	2.112	10	0		DEAEHN
C[C@]1(c2nc(Cc3c(F)cccc3Cl)no2)COC[C@H]1N	ZINC000090573784	185304315	/nfs/dbraw/zinc/30/43/15/185304315.db2.gz	YVBGWNFJFVYUKN-RISCZKNCSA-N	0	3	311.744	2.068	10	0		DEAEHN
C[C@]1(c2nc(Cc3ccc(F)cc3Cl)no2)COC[C@H]1N	ZINC000090573793	185304465	/nfs/dbraw/zinc/30/44/65/185304465.db2.gz	MQGCAMZQXGNLPF-RISCZKNCSA-N	0	3	311.744	2.068	10	0		DEAEHN
C[C@]1(C(=O)Nc2ccccc2SC(F)F)COC[C@H]1N	ZINC000090580452	185304896	/nfs/dbraw/zinc/30/48/96/185304896.db2.gz	MLDGCCXMDSONKD-MFKMUULPSA-N	0	3	302.346	2.304	10	0		DEAEHN
COc1cccc(C(=O)N2CCCSC[C@@H]2CN(C)C)c1	ZINC000090699819	185310375	/nfs/dbraw/zinc/31/03/75/185310375.db2.gz	IOOJIFRDORGOQZ-AWEZNQCLSA-N	0	3	308.447	2.205	10	0		DEAEHN
CCCn1nc(C)c(CN2CCC(n3cncn3)CC2)c1C	ZINC000092647593	185331248	/nfs/dbraw/zinc/33/12/48/185331248.db2.gz	UIKNGVMPFZJFHL-UHFFFAOYSA-N	0	3	302.426	2.339	10	0		DEAEHN
N[C@H](CO)[C@H](O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000167797284	197713960	/nfs/dbraw/zinc/71/39/60/197713960.db2.gz	VZXZBPNJPFPPCA-RKDXNWHRSA-N	0	3	303.202	2.077	10	0		DEAEHN
CNCc1sccc1S(=O)(=O)NC1C(C)(C)C1(C)C	ZINC000092833214	185344816	/nfs/dbraw/zinc/34/48/16/185344816.db2.gz	ZDPMDVYOWMVBJO-UHFFFAOYSA-N	0	3	302.465	2.180	10	0		DEAEHN
COc1cc(C)ccc1OCC(=O)NC1CCN(C2CC2)CC1	ZINC000073944567	539351295	/nfs/dbraw/zinc/35/12/95/539351295.db2.gz	BGJRFACLYHZMLW-UHFFFAOYSA-N	0	3	318.417	2.125	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccccc2CCOC)C1	ZINC000189469215	282310657	/nfs/dbraw/zinc/31/06/57/282310657.db2.gz	NOOIYTINBCVOSV-OAHLLOKOSA-N	0	3	305.422	2.481	10	0		DEAEHN
CN1CCCC(C)(C)[C@H]1CNC(=O)NCCc1ccccc1O	ZINC000448258235	530051742	/nfs/dbraw/zinc/05/17/42/530051742.db2.gz	VLDIXEXVNFCUEE-MRXNPFEDSA-N	0	3	319.449	2.354	10	0		DEAEHN
COC[C@H](NC[C@]1(CCO)CCOC1)c1ccc(Cl)cc1	ZINC000194083369	282362284	/nfs/dbraw/zinc/36/22/84/282362284.db2.gz	SAMSBBVHBSQBAC-HOTGVXAUSA-N	0	3	313.825	2.406	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N2CCC3(C2)CC[NH+](C)CC3)cc1[O-]	ZINC000614964290	362500497	/nfs/dbraw/zinc/50/04/97/362500497.db2.gz	WRZPTZUHGOPHIC-UHFFFAOYSA-N	0	3	316.401	2.153	10	0		DEAEHN
Cc1cc(C)n2c(CN3CCC[C@@H]3Cn3ccnc3)cnc2n1	ZINC000097103947	539435352	/nfs/dbraw/zinc/43/53/52/539435352.db2.gz	VTDFSMPZYMXOGE-OAHLLOKOSA-N	0	3	310.405	2.207	10	0		DEAEHN
CC1(OCC(=O)Nc2ccc(OC(F)F)c(Cl)c2)CNC1	ZINC000098060351	539435925	/nfs/dbraw/zinc/43/59/25/539435925.db2.gz	INLDPSXORPTYOZ-UHFFFAOYSA-N	0	3	320.723	2.258	10	0		DEAEHN
CS(=O)(=O)c1ccccc1NCc1ccc2c(c1)CNC2	ZINC000097829648	539435161	/nfs/dbraw/zinc/43/51/61/539435161.db2.gz	WYALWAYMARTPTI-UHFFFAOYSA-N	0	3	302.399	2.305	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN(C[C@H](O)C(F)(F)F)C2)n1	ZINC000181712819	199342394	/nfs/dbraw/zinc/34/23/94/199342394.db2.gz	HTUYBEXSBLBPAT-NEPJUHHUSA-N	0	3	303.328	2.047	10	0		DEAEHN
O[C@H](C[C@@H]1CCCN1C[C@H](O)C(F)(F)F)c1ccccc1	ZINC000181726074	199344543	/nfs/dbraw/zinc/34/45/43/199344543.db2.gz	LFCOZRBEPKGFKX-MJBXVCDLSA-N	0	3	303.324	2.498	10	0		DEAEHN
COc1ncc(C)cc1NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000245433595	282387975	/nfs/dbraw/zinc/38/79/75/282387975.db2.gz	QFBILLIQMZHTAG-STQMWFEESA-N	0	3	306.410	2.345	10	0		DEAEHN
CC(=O)[C@@H](C)CCCCC(=O)Nc1cnn(CCN(C)C)c1	ZINC000155079883	539556991	/nfs/dbraw/zinc/55/69/91/539556991.db2.gz	DBMITFBAFWUFMQ-ZDUSSCGKSA-N	0	3	308.426	2.169	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2CCCC[C@@H]2C(F)(F)F)n1	ZINC000263274264	282974402	/nfs/dbraw/zinc/97/44/02/282974402.db2.gz	SQBHEBUKYLWXPI-GARJFASQSA-N	0	3	318.343	2.482	10	0		DEAEHN
CCN1C(=O)C[C@@H](N)[C@H]1c1cc(Cl)c2c(c1)OCCCO2	ZINC000070293263	190878795	/nfs/dbraw/zinc/87/87/95/190878795.db2.gz	UWSUBXSESWMPFO-BXUZGUMPSA-N	0	3	310.781	2.122	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCCC[C@@H](n2ccnc2)C1	ZINC000616631197	362900686	/nfs/dbraw/zinc/90/06/86/362900686.db2.gz	YSLRIODBVVMFON-CQSZACIVSA-N	0	3	308.426	2.435	10	0		DEAEHN
Cc1ccc(S(=O)(=O)CCCN2CCC(N(C)C)CC2)cc1	ZINC000180548898	539645760	/nfs/dbraw/zinc/64/57/60/539645760.db2.gz	ARCJGJUDHHGLFG-UHFFFAOYSA-N	0	3	324.490	2.185	10	0		DEAEHN
CCN1CCN(C(=O)[C@@H](C)N[C@@H](C)c2ccc(C)c(F)c2)CC1	ZINC000181347070	539651268	/nfs/dbraw/zinc/65/12/68/539651268.db2.gz	OMLQWGLJYLYHIN-LSDHHAIUSA-N	0	3	321.440	2.337	10	0		DEAEHN
COc1ccc(C)cc1NC(=O)[C@H](C)N[C@H](C)[C@@H]1CCCO1	ZINC000183203859	539660279	/nfs/dbraw/zinc/66/02/79/539660279.db2.gz	GUTMNIMSNXDERB-IPYPFGDCSA-N	0	3	306.406	2.488	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)[C@H](C)N[C@H](C)[C@@H]1CCCO1	ZINC000183226029	539660303	/nfs/dbraw/zinc/66/03/03/539660303.db2.gz	SPIBJLYAJNUMLC-WQGACYEGSA-N	0	3	304.390	2.373	10	0		DEAEHN
COC(=O)COC[C@H](N)c1sc(C)cc1Br	ZINC000083678645	192378304	/nfs/dbraw/zinc/37/83/04/192378304.db2.gz	WYXRMBQPWVXGCJ-QMMMGPOBSA-N	0	3	308.197	2.008	10	0		DEAEHN
COC[C@H](N)Cc1nc(-c2cc(Br)cs2)no1	ZINC000071306067	190954793	/nfs/dbraw/zinc/95/47/93/190954793.db2.gz	VZXJFABEJIJBCD-SSDOTTSWSA-N	0	3	318.196	2.077	10	0		DEAEHN
Cc1c(C(=O)NCc2cccc(OCCN(C)C)c2)ccn1C	ZINC000195209985	539721263	/nfs/dbraw/zinc/72/12/63/539721263.db2.gz	GQALIZSHDDTAMM-UHFFFAOYSA-N	0	3	315.417	2.204	10	0		DEAEHN
COc1cc2c(c(OC)c1)[C@H](CN)N(Cc1nccs1)C2	ZINC000071683928	191006853	/nfs/dbraw/zinc/00/68/53/191006853.db2.gz	KISZJZCOEHMVQR-LBPRGKRZSA-N	0	3	305.403	2.176	10	0		DEAEHN
COc1cc2c(c(OC)c1OC)[C@H](CN)N(Cc1ccco1)C2	ZINC000071684620	191008745	/nfs/dbraw/zinc/00/87/45/191008745.db2.gz	OCKYULNIUKNNJT-ZDUSSCGKSA-N	0	3	318.373	2.321	10	0		DEAEHN
COc1cc2c(c(OC)c1)[C@@H](CN)N(CCc1nccs1)C2	ZINC000071683949	191009032	/nfs/dbraw/zinc/00/90/32/191009032.db2.gz	UJCUSRZDNJYHQO-CYBMUJFWSA-N	0	3	319.430	2.218	10	0		DEAEHN
O=C(c1cccc2ccccc21)[C@@H]1CCCN(C(CO)CO)C1	ZINC000071752686	191023383	/nfs/dbraw/zinc/02/33/83/191023383.db2.gz	BYOKXILOCQONRF-OAHLLOKOSA-N	0	3	313.397	2.088	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NC[C@H]1Cc2ccccc21	ZINC000245482527	539756382	/nfs/dbraw/zinc/75/63/82/539756382.db2.gz	ZJKQNRZPHCNHRM-CVEARBPZSA-N	0	3	301.434	2.452	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccccc1-n1ccnc1)N(C)C	ZINC000138492945	186017208	/nfs/dbraw/zinc/01/72/08/186017208.db2.gz	NREUIOZBGBBKOS-MRXNPFEDSA-N	0	3	300.406	2.219	10	0		DEAEHN
CCN[C@@H](c1cncs1)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000147684631	186041238	/nfs/dbraw/zinc/04/12/38/186041238.db2.gz	FUTORUNVHWNQSQ-NTZNESFSSA-N	0	3	302.465	2.397	10	0		DEAEHN
Cc1ccc([C@H]2N[C@H](C)C(=O)N2CCN2CCCCC2)s1	ZINC000144039789	186034314	/nfs/dbraw/zinc/03/43/14/186034314.db2.gz	OAGDDYYCMQNGJC-HIFRSBDPSA-N	0	3	307.463	2.361	10	0		DEAEHN
C[C@H](CN1C(=O)[C@H](C)N[C@H]1c1ccsc1)N1CCCCC1	ZINC000145683910	186037088	/nfs/dbraw/zinc/03/70/88/186037088.db2.gz	SRFFKCHYOUXZGQ-VNHYZAJKSA-N	0	3	307.463	2.441	10	0		DEAEHN
NC1(C(=O)NCc2ccccc2Cl)Cc2ccccc2C1	ZINC000150688095	186056809	/nfs/dbraw/zinc/05/68/09/186056809.db2.gz	NNQXCMDCMNLAJX-UHFFFAOYSA-N	0	3	300.789	2.453	10	0		DEAEHN
CCCNc1nc(NCCSC)nc(N2CCCCC2)n1	ZINC000155808544	186114565	/nfs/dbraw/zinc/11/45/65/186114565.db2.gz	VUPUVNMRHGKRHS-UHFFFAOYSA-N	0	3	310.471	2.459	10	0		DEAEHN
CCC[C@H](C(=O)NC1CCN(c2ccc(C)cn2)CC1)N(C)C	ZINC000164039653	186146365	/nfs/dbraw/zinc/14/63/65/186146365.db2.gz	QOWRXNULIBGUMB-MRXNPFEDSA-N	0	3	318.465	2.205	10	0		DEAEHN
COc1cccc(CNC[C@H](C)[S@](C)=O)c1OC(F)F	ZINC000159670219	186134103	/nfs/dbraw/zinc/13/41/03/186134103.db2.gz	WLTIDMRCPBQHMS-GWNMQOMSSA-N	0	3	307.362	2.153	10	0		DEAEHN
C[C@H](NCCn1ccnn1)c1ccc(Br)s1	ZINC000159673169	186134815	/nfs/dbraw/zinc/13/48/15/186134815.db2.gz	QMLWRWNAMKXVRX-QMMMGPOBSA-N	0	3	301.213	2.453	10	0		DEAEHN
Cc1ccc(C(N)=O)cc1NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000175736956	186191482	/nfs/dbraw/zinc/19/14/82/186191482.db2.gz	MDXQTYYPBYRCCG-OCCSQVGLSA-N	0	3	318.421	2.040	10	0		DEAEHN
CC[C@H](CNC(=O)N1CC[C@H](N(C)C)C1)Oc1cccc(F)c1	ZINC000175641568	186184277	/nfs/dbraw/zinc/18/42/77/186184277.db2.gz	NAZBFIWMFWWBHT-LSDHHAIUSA-N	0	3	323.412	2.329	10	0		DEAEHN
CC(C)N(C)C(=O)[C@H](C)N[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000181911095	186217969	/nfs/dbraw/zinc/21/79/69/186217969.db2.gz	GZKNJHSIDXSXMV-KBPBESRZSA-N	0	3	315.421	2.173	10	0		DEAEHN
COc1cc(F)c(NC(=O)N2CCN3CCC[C@@H]3C2)cc1OC	ZINC000171894949	198003160	/nfs/dbraw/zinc/00/31/60/198003160.db2.gz	ZJMPGDNNOSLDAT-LLVKDONJSA-N	0	3	323.368	2.155	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)Nc2cccc3cccnc32)CCO1	ZINC000172046887	198030561	/nfs/dbraw/zinc/03/05/61/198030561.db2.gz	WWEXBLKZGRLYBI-CQSZACIVSA-N	0	3	314.389	2.029	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1CCCS(=O)(=O)c1ccccc1	ZINC000172081324	198036529	/nfs/dbraw/zinc/03/65/29/198036529.db2.gz	DWMNQZNFMOWDNA-HZPDHXFCSA-N	0	3	322.474	2.019	10	0		DEAEHN
C[C@@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)C1CCCC1	ZINC000172247955	198064729	/nfs/dbraw/zinc/06/47/29/198064729.db2.gz	MJHITJKLYITTGK-CYBMUJFWSA-N	0	3	317.433	2.382	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2ccc(-c3ccccc3)[nH]2)CCO1	ZINC000172307655	198077307	/nfs/dbraw/zinc/07/73/07/198077307.db2.gz	NBAHDBJYYMBFPD-HNNXBMFYSA-N	0	3	313.401	2.084	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2ccc(-n3ccnc3)cc2)CCN1C	ZINC000172620607	198127000	/nfs/dbraw/zinc/12/70/00/198127000.db2.gz	MJJDQNWHASYQOS-RHSMWYFYSA-N	0	3	312.417	2.427	10	0		DEAEHN
CCN(C(=O)c1ccc(Br)cn1)[C@H]1CCN(C)C1	ZINC000617556781	363185081	/nfs/dbraw/zinc/18/50/81/363185081.db2.gz	XKSHAARBYFVDGC-NSHDSACASA-N	0	3	312.211	2.010	10	0		DEAEHN
Cc1cccc(CS(=O)(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000173274221	198204297	/nfs/dbraw/zinc/20/42/97/198204297.db2.gz	BHWGYCJRQUISCR-ZBFHGGJFSA-N	0	3	310.463	2.239	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)S(=O)(=O)Cc2ccc(F)cc2)CCN1C	ZINC000173269735	198204856	/nfs/dbraw/zinc/20/48/56/198204856.db2.gz	ARYZUZAKNGLRSD-WFASDCNBSA-N	0	3	314.426	2.070	10	0		DEAEHN
CSc1ccc(OCCN2CCO[C@H](CN(C)C)C2)cc1	ZINC000173701644	198242779	/nfs/dbraw/zinc/24/27/79/198242779.db2.gz	JFYUCLJDIUNCSL-OAHLLOKOSA-N	0	3	310.463	2.050	10	0		DEAEHN
Cc1cccc(CS(=O)(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000173885059	198265339	/nfs/dbraw/zinc/26/53/39/198265339.db2.gz	WCMLPSAXYRMIRG-HOCLYGCPSA-N	0	3	310.463	2.143	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2ccc3c(c2)OCCO3)CCN1C	ZINC000174113004	198292712	/nfs/dbraw/zinc/29/27/12/198292712.db2.gz	RNWFDOSZCIKUOW-OCCSQVGLSA-N	0	3	319.405	2.404	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N(C)CCc1ccccc1OC	ZINC000074498750	355033460	/nfs/dbraw/zinc/03/34/60/355033460.db2.gz	WBUUVPQIJVNNFH-MRXNPFEDSA-N	0	3	319.449	2.363	10	0		DEAEHN
CC1CCN(C(=O)CN[C@@]2(CO)C[C@@H](C)CC(C)(C)C2)CC1	ZINC000080903342	355391296	/nfs/dbraw/zinc/39/12/96/355391296.db2.gz	CSUOSHIGYPTWOI-YJBOKZPZSA-N	0	3	310.482	2.412	10	0		DEAEHN
CCN1CCO[C@@H](CNCc2ccc(Br)s2)C1	ZINC000113266924	355758321	/nfs/dbraw/zinc/75/83/21/355758321.db2.gz	ONGXDSYUVRSQCS-JTQLQIEISA-N	0	3	319.268	2.321	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)CCCc2nc(C3CC3)no2)CCN1C	ZINC000127547156	355823038	/nfs/dbraw/zinc/82/30/38/355823038.db2.gz	SULTVRNJMCPGBI-JSGCOSHPSA-N	0	3	320.437	2.211	10	0		DEAEHN
CC(C)(C)N1CCN(C[C@@H](C(N)=S)c2ccccc2)CC1	ZINC000080797102	192192290	/nfs/dbraw/zinc/19/22/90/192192290.db2.gz	ZDVQLJVXWQHHGK-OAHLLOKOSA-N	0	3	305.491	2.472	10	0		DEAEHN
CCN(CCNC(=O)Nc1cccc(N(C)C(C)=O)c1)C1CC1	ZINC000081107876	192226316	/nfs/dbraw/zinc/22/63/16/192226316.db2.gz	OAOUWYQFKYIIJI-UHFFFAOYSA-N	0	3	318.421	2.275	10	0		DEAEHN
CCC[C@@H](N)C(=O)N[C@@H](C)c1ccc(N2CCCC2=O)cc1	ZINC000236982011	202106243	/nfs/dbraw/zinc/10/62/43/202106243.db2.gz	VXCYOZBWSKJFQB-SWLSCSKDSA-N	0	3	303.406	2.118	10	0		DEAEHN
COc1cc(CN2CC[C@@H](CO)[C@@H]2C)ccc1OC(F)F	ZINC000386351328	356696257	/nfs/dbraw/zinc/69/62/57/356696257.db2.gz	YIYSAUXIRPHTPL-JQWIXIFHSA-N	0	3	301.333	2.499	10	0		DEAEHN
OCc1ccc(CN2CC[C@@](O)(Cc3ccc(F)cc3)C2)o1	ZINC000579579702	356997197	/nfs/dbraw/zinc/99/71/97/356997197.db2.gz	UIWOYGSYRRTQJI-QGZVFWFLSA-N	0	3	305.349	2.091	10	0		DEAEHN
CCCNCc1cc(S(=O)(=O)NC(C)(C)C)cn1CC	ZINC000088976403	192677024	/nfs/dbraw/zinc/67/70/24/192677024.db2.gz	DPUCJAKPUZTUAG-UHFFFAOYSA-N	0	3	301.456	2.084	10	0		DEAEHN
Cn1cc(C(=O)N2CCN3CCC[C@@H]3C2)c(-c2cccs2)n1	ZINC000179332043	199016413	/nfs/dbraw/zinc/01/64/13/199016413.db2.gz	PVQODXKQEPFTSV-GFCCVEGCSA-N	0	3	316.430	2.069	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc3c[nH]nc3c2)CCN1CCOC	ZINC000179512134	199048321	/nfs/dbraw/zinc/04/83/21/199048321.db2.gz	LNEFHTWQJMMNIB-INIZCTEOSA-N	0	3	302.422	2.106	10	0		DEAEHN
Cc1cc(C(=O)N2CC[C@@H](N(C)C)C2)nn1-c1ccc(C)cc1	ZINC000180253435	199137287	/nfs/dbraw/zinc/13/72/87/199137287.db2.gz	DPEUDWQFIOJRIV-MRXNPFEDSA-N	0	3	312.417	2.265	10	0		DEAEHN
C[C@H](NCC(=O)NC(C)(C)C)c1ccccc1-n1cccn1	ZINC000177200779	299275769	/nfs/dbraw/zinc/27/57/69/299275769.db2.gz	KTKJDLXYVCOVHW-ZDUSSCGKSA-N	0	3	300.406	2.438	10	0		DEAEHN
Cc1cccc2c1ncc(C)c2NCCN1CCCS1(=O)=O	ZINC000185284708	199834405	/nfs/dbraw/zinc/83/44/05/199834405.db2.gz	RRSJHNIQKOVMGY-UHFFFAOYSA-N	0	3	319.430	2.299	10	0		DEAEHN
CCCNCc1cc(F)c(C)c(S(=O)(=O)N[C@@H]2C[C@@H]2C)c1	ZINC000089023890	192703876	/nfs/dbraw/zinc/70/38/76/192703876.db2.gz	WNNWYLMMEYUQAF-IINYFYTJSA-N	0	3	314.426	2.320	10	0		DEAEHN
CNCc1sccc1S(=O)(=O)N1CCC[C@H]2CCC[C@@H]21	ZINC000089049650	192720800	/nfs/dbraw/zinc/72/08/00/192720800.db2.gz	ZZTXKIFBUPMAIW-NEPJUHHUSA-N	0	3	314.476	2.421	10	0		DEAEHN
CC[C@H](CO)N1CCN(Cc2ccc3nc(C)ccc3c2)CC1	ZINC000187386296	200105104	/nfs/dbraw/zinc/10/51/04/200105104.db2.gz	IROKIMYRHVDNSK-GOSISDBHSA-N	0	3	313.445	2.432	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)N(C)C[C@@H]1CCCN(C)C1	ZINC000187484260	200118522	/nfs/dbraw/zinc/11/85/22/200118522.db2.gz	CGWOBPILTOMMPQ-ZIAGYGMSSA-N	0	3	320.437	2.134	10	0		DEAEHN
COc1ccc([C@H](C)N[C@@H]2C[C@H](O)C2(C)C)cc1NC(C)=O	ZINC000187682838	200143885	/nfs/dbraw/zinc/14/38/85/200143885.db2.gz	DUMPVKPRDJHWGM-JQAFLVLXSA-N	0	3	306.406	2.464	10	0		DEAEHN
COc1cccc(CN2C[C@@H](c3ccsc3)[C@H](CO)C2)n1	ZINC000188063142	200187897	/nfs/dbraw/zinc/18/78/97/200187897.db2.gz	HCRKZJBIHJFCJF-ZFWWWQNUSA-N	0	3	304.415	2.360	10	0		DEAEHN
CCSc1cc(CNC(=O)N2CCN3CCC[C@@H]3C2)ccn1	ZINC000188104420	200193775	/nfs/dbraw/zinc/19/37/75/200193775.db2.gz	BBNBQRUHDSZKHJ-CQSZACIVSA-N	0	3	320.462	2.183	10	0		DEAEHN
COCc1cccc(CC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000188226154	200211944	/nfs/dbraw/zinc/21/19/44/200211944.db2.gz	NRRDTXAQYSLPEC-WMLDXEAASA-N	0	3	304.434	2.317	10	0		DEAEHN
Cc1nn(C)c(C)c1CN1C[C@@H](c2ccsc2)[C@H](CO)C1	ZINC000188136583	200199166	/nfs/dbraw/zinc/19/91/66/200199166.db2.gz	FXDXKBKUPMDWRD-HOCLYGCPSA-N	0	3	305.447	2.306	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)NCCCN1CCc2ccccc2C1	ZINC000188403924	200240503	/nfs/dbraw/zinc/24/05/03/200240503.db2.gz	YAPHEQCVDAIMLK-YJBOKZPZSA-N	0	3	316.445	2.366	10	0		DEAEHN
C[C@H](NCC1(C)OCCCO1)c1ccc(-n2cncn2)cc1	ZINC000190669322	200572136	/nfs/dbraw/zinc/57/21/36/200572136.db2.gz	PKPSBZBAOOXFBJ-ZDUSSCGKSA-N	0	3	302.378	2.071	10	0		DEAEHN
COc1cccc(C[C@@H](C)NC(=O)N[C@@H]2CCN(C3CC3)C2)c1	ZINC000604199807	360889671	/nfs/dbraw/zinc/88/96/71/360889671.db2.gz	QFGJRHCBSYUFRA-UKRRQHHQSA-N	0	3	317.433	2.162	10	0		DEAEHN
O[C@@]1(Cn2ccnn2)CCN(Cc2ccc(-c3ccccc3)o2)C1	ZINC000671493128	540978766	/nfs/dbraw/zinc/97/87/66/540978766.db2.gz	VKUKKCQJPQNNAW-SFHVURJKSA-N	0	3	324.384	2.175	10	0		DEAEHN
CCCN(C)CC(=O)N[C@H](Cc1nccn1C)c1ccccc1	ZINC000608207492	361183982	/nfs/dbraw/zinc/18/39/82/361183982.db2.gz	HDJNRTOVJJOFLB-MRXNPFEDSA-N	0	3	314.433	2.162	10	0		DEAEHN
COC(=O)CCN1CCC(N2c3ccccc3C[C@H]2C)CC1	ZINC000609144614	361284063	/nfs/dbraw/zinc/28/40/63/361284063.db2.gz	IWOZBRUCLIAWOX-CQSZACIVSA-N	0	3	302.418	2.465	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2nc3cccnc3s2)CCN1C	ZINC000193958858	201152442	/nfs/dbraw/zinc/15/24/42/201152442.db2.gz	WQSNDJRXJXVPHF-MNOVXSKESA-N	0	3	304.419	2.246	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@H]2C[C@@H](O)C23CCC3)c2ccccc21	ZINC000621764255	364538776	/nfs/dbraw/zinc/53/87/76/364538776.db2.gz	BWYZLMOSMUGUPW-BHYGNILZSA-N	0	3	300.402	2.377	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2cc(F)ccc2C)CC12COC2	ZINC000449357504	240392708	/nfs/dbraw/zinc/39/27/08/240392708.db2.gz	DOEYGSXCCKORHX-OAHLLOKOSA-N	0	3	307.365	2.146	10	0		DEAEHN
CN(CC1CC(O)C1)[C@@H](CN)c1ccccc1Br	ZINC000091451468	193058644	/nfs/dbraw/zinc/05/86/44/193058644.db2.gz	OXLKWBQNFFBWIB-MGULZYLOSA-N	0	3	313.239	2.152	10	0		DEAEHN
Cc1csc([C@H](C)NCCC2(CS(C)(=O)=O)CC2)n1	ZINC000624010843	365252345	/nfs/dbraw/zinc/25/23/45/365252345.db2.gz	ZCSJZYFZFDTYDR-NSHDSACASA-N	0	3	302.465	2.317	10	0		DEAEHN
CCS(=O)(=O)CCn1ncc(CNCC(C)C)c1C(F)F	ZINC000091339832	193043018	/nfs/dbraw/zinc/04/30/18/193043018.db2.gz	FEBWPZZCBZLPDP-UHFFFAOYSA-N	0	3	323.409	2.001	10	0		DEAEHN
CCS(=O)(=O)CCn1ncc(CNC(C)(C)C)c1C(F)F	ZINC000091339762	193043913	/nfs/dbraw/zinc/04/39/13/193043913.db2.gz	QNXHUKDJWIFEPP-UHFFFAOYSA-N	0	3	323.409	2.144	10	0		DEAEHN
CSC1(C(N)=S)CCN(CCOCC(F)(F)F)CC1	ZINC000091487996	193063178	/nfs/dbraw/zinc/06/31/78/193063178.db2.gz	ODRNPXOAYDXNHQ-UHFFFAOYSA-N	0	3	316.414	2.049	10	0		DEAEHN
C[C@H](NC[C@@H]1COCCN1C)c1ccccc1Br	ZINC000624172813	365317731	/nfs/dbraw/zinc/31/77/31/365317731.db2.gz	VBDPQNODYWZXBV-NWDGAFQWSA-N	0	3	313.239	2.430	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@H]1O)c1ccc(F)c(Br)c1	ZINC000624235582	365344817	/nfs/dbraw/zinc/34/48/17/365344817.db2.gz	MSJPVTMUIQAQRS-AQUOVQTQSA-N	0	3	318.186	2.389	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H]2CC[C@@H](C)[NH2+]C2)sc1Cl	ZINC000624405067	365411481	/nfs/dbraw/zinc/41/14/81/365411481.db2.gz	BEPQPXDKEFLUEA-RKDXNWHRSA-N	0	3	308.856	2.129	10	0		DEAEHN
CCOc1ccccc1CN1CCN(CC[C@H](C)O)[C@@H](C)C1	ZINC000450907597	242385456	/nfs/dbraw/zinc/38/54/56/242385456.db2.gz	KXLDGVNTXNUGIN-HOTGVXAUSA-N	0	3	306.450	2.362	10	0		DEAEHN
COC[C@H](N)Cc1cn(-c2ccc(Cl)cc2Cl)nn1	ZINC000630586512	367741879	/nfs/dbraw/zinc/74/18/79/367741879.db2.gz	YWZWUKJAPBQPCC-SECBINFHSA-N	0	3	301.177	2.090	10	0		DEAEHN
Cc1oc(CNC(C)C)cc1S(=O)(=O)N1C[C@H](C)[C@@H](C)C1	ZINC000092113500	193161462	/nfs/dbraw/zinc/16/14/62/193161462.db2.gz	OQGCUCQFXPRFKN-RYUDHWBXSA-N	0	3	314.451	2.363	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N(C)[C@H](C)C(C)C)c(F)c1	ZINC000092115697	193163036	/nfs/dbraw/zinc/16/30/36/193163036.db2.gz	COODKCQIBLFNQF-LLVKDONJSA-N	0	3	302.415	2.210	10	0		DEAEHN
CC[C@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)cc1F	ZINC000092115787	193163593	/nfs/dbraw/zinc/16/35/93/193163593.db2.gz	XIIKSSFFACWJOX-NSHDSACASA-N	0	3	302.415	2.401	10	0		DEAEHN
Cn1nncc1CN[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000631207016	368079034	/nfs/dbraw/zinc/07/90/34/368079034.db2.gz	ZSVOOGQOIPSCKR-KRWDZBQOSA-N	0	3	313.449	2.350	10	0		DEAEHN
c1nc2nc(N3CCN4CCC3CC4)cc(-c3ccccc3)n2n1	ZINC000631239120	368097378	/nfs/dbraw/zinc/09/73/78/368097378.db2.gz	OUPUDBXGGGRENP-UHFFFAOYSA-N	0	3	320.400	2.076	10	0		DEAEHN
CC1(C)C[NH2+]CC[C@@H]([N-]S(=O)(=O)c2ccc(Cl)s2)C1	ZINC000631979456	368478768	/nfs/dbraw/zinc/47/87/68/368478768.db2.gz	SOSZKRDOBBKSJE-SECBINFHSA-N	0	3	322.883	2.458	10	0		DEAEHN
COCCNCc1sc(N(C)[C@@H](C)COC)nc1C(C)C	ZINC000092999849	193192300	/nfs/dbraw/zinc/19/23/00/193192300.db2.gz	MCQTWSQUEQYFOG-LBPRGKRZSA-N	0	3	315.483	2.474	10	0		DEAEHN
CC[C@H](C)CN(CC)S(=O)(=O)c1cccc2c1CCNC2	ZINC000093255306	193221118	/nfs/dbraw/zinc/22/11/18/193221118.db2.gz	FPQMPXXELJXVER-ZDUSSCGKSA-N	0	3	310.463	2.389	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N(CC)C[C@@H](C)CC)cn1C	ZINC000093265728	193223203	/nfs/dbraw/zinc/22/32/03/193223203.db2.gz	LPVAKWGDFVNBTM-ZDUSSCGKSA-N	0	3	315.483	2.191	10	0		DEAEHN
CCC[NH2+][C@@]1(C(=O)[O-])CCC[C@@H](N(CC)CCOCC)C1	ZINC000093755078	193299271	/nfs/dbraw/zinc/29/92/71/193299271.db2.gz	HVZBWJRDHFOUOS-ZBFHGGJFSA-N	0	3	300.443	2.110	10	0		DEAEHN
Cc1nnc(Sc2nc(C(F)(F)F)ccc2C(=N)N)o1	ZINC000094337101	193361318	/nfs/dbraw/zinc/36/13/18/193361318.db2.gz	SRLRJBOQOLDRSC-UHFFFAOYSA-N	0	3	303.269	2.227	10	0		DEAEHN
CCN(C)C(=O)COc1c(F)cc(CNC(C)C)cc1F	ZINC000094347457	193363200	/nfs/dbraw/zinc/36/32/00/193363200.db2.gz	HGIXKVNQUXAFGC-UHFFFAOYSA-N	0	3	300.349	2.320	10	0		DEAEHN
CCNC(=O)[C@H](C)Oc1c(F)cc(CNC(C)C)cc1F	ZINC000094347340	193363244	/nfs/dbraw/zinc/36/32/44/193363244.db2.gz	LBJVTIVVPGBITR-JTQLQIEISA-N	0	3	300.349	2.366	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@H](C)Oc1c(F)cc(CNC)cc1F	ZINC000094346451	193363652	/nfs/dbraw/zinc/36/36/52/193363652.db2.gz	WLGKNTHAISUGCG-UWVGGRQHSA-N	0	3	300.349	2.366	10	0		DEAEHN
CS(=O)(=O)[C@H]1CCC[C@H](Oc2c(F)cc(CN)cc2F)C1	ZINC000094634587	193385932	/nfs/dbraw/zinc/38/59/32/193385932.db2.gz	DKCOEOZJIRZVCR-QWRGUYRKSA-N	0	3	319.373	2.158	10	0		DEAEHN
CCC(CC)([C@H](O)[C@@H]1CCC[C@H](S(C)(=O)=O)C1)N(C)C	ZINC000094641350	193388944	/nfs/dbraw/zinc/38/89/44/193388944.db2.gz	TUBBPNDTHMXJJR-HZSPNIEDSA-N	0	3	305.484	2.071	10	0		DEAEHN
CC(C)CNCc1cn([C@@H]2CCO[C@@]3(CCSC3)C2)nn1	ZINC000094419120	193368640	/nfs/dbraw/zinc/36/86/40/193368640.db2.gz	AKJCFJCJPAVLMJ-CABCVRRESA-N	0	3	310.467	2.251	10	0		DEAEHN
NC(=S)c1ccc(F)cc1CN1CCN2CCCC[C@@H]2C1	ZINC000094439539	193370404	/nfs/dbraw/zinc/37/04/04/193370404.db2.gz	WCRGUPIDZUTRRR-CQSZACIVSA-N	0	3	307.438	2.130	10	0		DEAEHN
CCN[C@@H](C)c1cc(F)c(C)cc1Sc1n[nH]c(=O)n1C	ZINC000094768529	193396565	/nfs/dbraw/zinc/39/65/65/193396565.db2.gz	DWKLVMMZEMQQQL-VIFPVBQESA-N	0	3	310.398	2.378	10	0		DEAEHN
CN(C)C[C@H]1C[C@@H](O)CN1C(=O)c1cc(Cl)ccc1Cl	ZINC000097250340	193697594	/nfs/dbraw/zinc/69/75/94/193697594.db2.gz	PPWLZMVISJYRNM-GHMZBOCLSA-N	0	3	317.216	2.130	10	0		DEAEHN
Cn1ncc(Br)c1[C@@H](N)C(C)(C)N1CCCCC1	ZINC000160858592	197445143	/nfs/dbraw/zinc/44/51/43/197445143.db2.gz	SDBKZUOWIOQHEV-GFCCVEGCSA-N	0	3	315.259	2.447	10	0		DEAEHN
C[C@H](C(=O)Nc1c(Cl)cccc1Cl)N1CCNCC1	ZINC000020269993	182201782	/nfs/dbraw/zinc/20/17/82/182201782.db2.gz	BUGMDWREQWITRC-SECBINFHSA-N	0	3	302.205	2.226	10	0		DEAEHN
Cc1ccc(Cl)c(NC(=O)CN2CCNCC2)c1Cl	ZINC000020362622	182211711	/nfs/dbraw/zinc/21/17/11/182211711.db2.gz	NHQFLVPREGHXSG-UHFFFAOYSA-N	0	3	302.205	2.146	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2cc(Br)cs2)CCO1	ZINC000020475214	182221544	/nfs/dbraw/zinc/22/15/44/182221544.db2.gz	QJCJXRPSFSTLKR-SCZZXKLOSA-N	0	3	305.241	2.231	10	0		DEAEHN
CC[C@H](C)NC(=O)COc1ccc(Br)cc1CN	ZINC000020483481	182223177	/nfs/dbraw/zinc/22/31/77/182223177.db2.gz	DZKAHRWPGWORFP-VIFPVBQESA-N	0	3	315.211	2.201	10	0		DEAEHN
Clc1nc2ccccc2cc1CNCCN1CCOCC1	ZINC000020968511	182256598	/nfs/dbraw/zinc/25/65/98/182256598.db2.gz	CPZDSBOESDXNJX-UHFFFAOYSA-N	0	3	305.809	2.310	10	0		DEAEHN
CCn1nc(NC(=O)N2CCN3CCC[C@H]3C2)cc1C1CC1	ZINC000267427685	206058383	/nfs/dbraw/zinc/05/83/83/206058383.db2.gz	BJPBCXNIQUZEDZ-ZDUSSCGKSA-N	0	3	303.410	2.092	10	0		DEAEHN
O=C(CNC[C@H]1CCOC1)Nc1cccc(Br)c1	ZINC000038094130	182989514	/nfs/dbraw/zinc/98/95/14/182989514.db2.gz	DHETZZLCIZOAPM-SNVBAGLBSA-N	0	3	313.195	2.014	10	0		DEAEHN
Ic1ccc(CNC[C@@H]2CCCOC2)o1	ZINC000038044902	182978976	/nfs/dbraw/zinc/97/89/76/182978976.db2.gz	ZVJFXPQMTZTCRI-VIFPVBQESA-N	0	3	321.158	2.400	10	0		DEAEHN
O=C1C(CNCCc2ccccc2)=CC2=CC=C[C@@H]3CCN1[C@H]23	ZINC000039287460	183016398	/nfs/dbraw/zinc/01/63/98/183016398.db2.gz	KLIANTXYBOVEAE-APWZRJJASA-N	0	3	306.409	2.472	10	0		DEAEHN
CC(C)[C@H](CNS(=O)(=O)c1ccc(F)cc1)N1CCCC1	ZINC000040435959	183066675	/nfs/dbraw/zinc/06/66/75/183066675.db2.gz	MCIQXSDBNUFULE-HNNXBMFYSA-N	0	3	314.426	2.224	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)NCCOC)c1ccc(C)cc1	ZINC000040654355	183114471	/nfs/dbraw/zinc/11/44/71/183114471.db2.gz	ZSXQGRGHIAVJOQ-INIZCTEOSA-N	0	3	307.438	2.324	10	0		DEAEHN
CCOC(=O)C(=O)NC[C@@H](c1ccc(C)cc1)N(CC)CC	ZINC000040615389	183109572	/nfs/dbraw/zinc/10/95/72/183109572.db2.gz	FOUVBHKQRJVOAY-HNNXBMFYSA-N	0	3	306.406	2.057	10	0		DEAEHN
COC(=O)c1c2c(sc1NC(=O)[C@@H](N)C(C)(C)C)CCC2	ZINC000040858935	183142820	/nfs/dbraw/zinc/14/28/20/183142820.db2.gz	QMHNJFBQZCVEQS-LLVKDONJSA-N	0	3	310.419	2.335	10	0		DEAEHN
COC(=O)c1c2c(sc1NC(=O)[C@H]1CCCCN1)CCC2	ZINC000040858828	183143137	/nfs/dbraw/zinc/14/31/37/183143137.db2.gz	JRZLDLFPZXWMKL-SNVBAGLBSA-N	0	3	308.403	2.104	10	0		DEAEHN
CC(C)NCC(=O)NCc1cc(Br)ccc1F	ZINC000041069551	183162300	/nfs/dbraw/zinc/16/23/00/183162300.db2.gz	CLWLNEGJGZGBLI-UHFFFAOYSA-N	0	3	303.175	2.202	10	0		DEAEHN
CNCc1cccc(Br)c1O[C@H](C)C(=O)N(C)C	ZINC000042411496	183265136	/nfs/dbraw/zinc/26/51/36/183265136.db2.gz	PGMBKCLWHRTJHP-SECBINFHSA-N	0	3	315.211	2.024	10	0		DEAEHN
CCNCc1cccc(Br)c1OCC(=O)N(C)C	ZINC000042411688	183266210	/nfs/dbraw/zinc/26/62/10/183266210.db2.gz	XMAIKJSQPNECMA-UHFFFAOYSA-N	0	3	315.211	2.026	10	0		DEAEHN
CC(C)N(CCCO)[C@@H](C)C(=O)Nc1ccc(Cl)cc1N	ZINC000042482920	183275429	/nfs/dbraw/zinc/27/54/29/183275429.db2.gz	YBVZQXDGEZWXHT-NSHDSACASA-N	0	3	313.829	2.342	10	0		DEAEHN
CC(C)CN(CCN(C)C)Cc1cc(C(N)=S)ccc1F	ZINC000042766075	183306272	/nfs/dbraw/zinc/30/62/72/183306272.db2.gz	YDZBAOUIMJLWCJ-UHFFFAOYSA-N	0	3	311.470	2.480	10	0		DEAEHN
CS(=O)(=O)c1ccc(O[C@H](CN)c2ccccc2F)cc1	ZINC000043048665	183332039	/nfs/dbraw/zinc/33/20/39/183332039.db2.gz	AWRBEOPDDFUXNR-OAHLLOKOSA-N	0	3	309.362	2.308	10	0		DEAEHN
CNC(=O)C1CCN([C@@H](c2ccc(Cl)s2)[C@@H](C)N)CC1	ZINC000043252803	183348119	/nfs/dbraw/zinc/34/81/19/183348119.db2.gz	FQBZSZRZTBMZRO-NOZJJQNGSA-N	0	3	315.870	2.248	10	0		DEAEHN
CC(C)NC(=O)CN(C)[C@@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043254104	183348347	/nfs/dbraw/zinc/34/83/47/183348347.db2.gz	XXGCYRJZVQQAAJ-NOZJJQNGSA-N	0	3	303.859	2.246	10	0		DEAEHN
COCCN(C)[C@H](c1ccc(Br)s1)[C@@H](C)N	ZINC000043261641	183349097	/nfs/dbraw/zinc/34/90/97/183349097.db2.gz	VIYYLUQYOMEKNS-KCJUWKMLSA-N	0	3	307.257	2.477	10	0		DEAEHN
N[C@@H](c1ccc(F)c(Br)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000043299825	183351522	/nfs/dbraw/zinc/35/15/22/183351522.db2.gz	SAZBQZCEEBDZJO-KCJUWKMLSA-N	0	3	322.199	2.023	10	0		DEAEHN
CCN[C@H](c1ccc(OC(F)F)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000043300890	183352519	/nfs/dbraw/zinc/35/25/19/183352519.db2.gz	GOEBGGAWXCKOKE-DGCLKSJQSA-N	0	3	319.373	2.373	10	0		DEAEHN
CC[C@H](N)[C@H](Oc1cccc(S(C)(=O)=O)c1)C(F)(F)F	ZINC000043385222	183358063	/nfs/dbraw/zinc/35/80/63/183358063.db2.gz	DAHNVFGACRWVEC-QWRGUYRKSA-N	0	3	311.325	2.137	10	0		DEAEHN
CCC[C@@H](C)NC(=O)[C@@H](C)N(CCC(N)=S)CC(C)C	ZINC000043418464	183360565	/nfs/dbraw/zinc/36/05/65/183360565.db2.gz	MXJNLCRCPGXSKP-CHWSQXEVSA-N	0	3	301.500	2.314	10	0		DEAEHN
CN[C@H](CN(C)CC(F)(F)F)c1cc(OC)ccc1OC	ZINC000043900629	183389328	/nfs/dbraw/zinc/38/93/28/183389328.db2.gz	IPUSGJOUCOMIKY-GFCCVEGCSA-N	0	3	306.328	2.458	10	0		DEAEHN
COc1ccc2c(c1)CCN2C(=O)NC[C@H](C)N(C)C1CC1	ZINC000105265490	194089691	/nfs/dbraw/zinc/08/96/91/194089691.db2.gz	JELARCLCWQIZIF-LBPRGKRZSA-N	0	3	303.406	2.250	10	0		DEAEHN
CC[C@H](c1ccccc1)N1CCN(c2ccc3nncn3n2)CC1	ZINC000105817417	194136077	/nfs/dbraw/zinc/13/60/77/194136077.db2.gz	BAHHISKJDXACKQ-MRXNPFEDSA-N	0	3	322.416	2.398	10	0		DEAEHN
COc1ccc(CCN2CCCN(c3cccnn3)CC2)cc1	ZINC000105799010	194131881	/nfs/dbraw/zinc/13/18/81/194131881.db2.gz	SIVHSZDLAUTOQZ-UHFFFAOYSA-N	0	3	312.417	2.240	10	0		DEAEHN
COCCN1CCN(CCCOCCc2ccccc2)C[C@@H]1C	ZINC000105833843	194142211	/nfs/dbraw/zinc/14/22/11/194142211.db2.gz	PRFRFTGTBOTERG-SFHVURJKSA-N	0	3	320.477	2.288	10	0		DEAEHN
CC(C)(C)OCCN1CCCN(Cc2noc(C3CC3)n2)CC1	ZINC000105867652	194150740	/nfs/dbraw/zinc/15/07/40/194150740.db2.gz	YBTLNDHTGGAQTL-UHFFFAOYSA-N	0	3	322.453	2.270	10	0		DEAEHN
CC(C)[NH2+]CCCS(=O)(=O)[N-]c1ccc(F)c(F)c1F	ZINC000049640862	183750830	/nfs/dbraw/zinc/75/08/30/183750830.db2.gz	QZSWAGMAGPFLNC-UHFFFAOYSA-N	0	3	310.341	2.234	10	0		DEAEHN
CCNc1cc(C(=O)N[C@H](CN(C)C)C(C)C)cc(Cl)n1	ZINC000050779749	183803936	/nfs/dbraw/zinc/80/39/36/183803936.db2.gz	MYQHEZYYPUNEGM-GFCCVEGCSA-N	0	3	312.845	2.483	10	0		DEAEHN
CCC[C@H](C(N)=S)N1CCN(c2nc(CC)cs2)CC1	ZINC000109471764	194267448	/nfs/dbraw/zinc/26/74/48/194267448.db2.gz	BITIPHUBHCDDQI-GFCCVEGCSA-N	0	3	312.508	2.282	10	0		DEAEHN
CN([C@H]1CCCNC1)S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000110928429	194370341	/nfs/dbraw/zinc/37/03/41/194370341.db2.gz	JAAQVUKUXQBPPK-JTQLQIEISA-N	0	3	323.245	2.366	10	0		DEAEHN
CNCCS(=O)(=O)Nc1ccc(C(F)(F)F)cc1Cl	ZINC000111042602	194386533	/nfs/dbraw/zinc/38/65/33/194386533.db2.gz	GPXXWJLPCNQXRL-UHFFFAOYSA-N	0	3	316.732	2.320	10	0		DEAEHN
Cc1ccccc1OCc1nc2c(c(N3CCNCC3)n1)CCC2	ZINC000057328728	184033321	/nfs/dbraw/zinc/03/33/21/184033321.db2.gz	SHEMVGWQGLSUGF-UHFFFAOYSA-N	0	3	324.428	2.262	10	0		DEAEHN
c1ccc(OCCCNCc2ccc3c(c2)OCCO3)nc1	ZINC000057353386	184035472	/nfs/dbraw/zinc/03/54/72/184035472.db2.gz	PRJWJCQPKWRFTF-UHFFFAOYSA-N	0	3	300.358	2.412	10	0		DEAEHN
CCNc1nc(NC[C@@H]2CCCS2)nc(N2CCCC2)n1	ZINC000157650965	197205147	/nfs/dbraw/zinc/20/51/47/197205147.db2.gz	FIBUXJXTQHISPB-NSHDSACASA-N	0	3	308.455	2.211	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccc(Br)cn2)C1	ZINC000061874296	184191237	/nfs/dbraw/zinc/19/12/37/184191237.db2.gz	GTCUCXIMHJGHOB-LLVKDONJSA-N	0	3	312.211	2.058	10	0		DEAEHN
COC(=O)c1sc(N2CCC[C@H]2CN(C)C)nc1Cl	ZINC000061654768	184181312	/nfs/dbraw/zinc/18/13/12/184181312.db2.gz	QKFVHXBZHFDOGD-QMMMGPOBSA-N	0	3	303.815	2.114	10	0		DEAEHN
O=C(NCCCc1ccccc1)N1CCCN(C2CC2)CC1	ZINC000061794536	184187889	/nfs/dbraw/zinc/18/78/89/184187889.db2.gz	LTJKMWZLXDUSII-UHFFFAOYSA-N	0	3	301.434	2.499	10	0		DEAEHN
C[C@H](CC(N)=O)C[C@@H](N)c1cc2c(cc1Cl)OCCCO2	ZINC000061830313	184188790	/nfs/dbraw/zinc/18/87/90/184188790.db2.gz	LXGLRGVYGQQIFM-JOYOIKCWSA-N	0	3	312.797	2.403	10	0		DEAEHN
C[C@H]1CN(c2nc3sccn3c2CNC2CC2)CCCO1	ZINC000061920140	184195598	/nfs/dbraw/zinc/19/55/98/184195598.db2.gz	KPUGZUDTGCUCHX-NSHDSACASA-N	0	3	306.435	2.263	10	0		DEAEHN
C[C@@H](c1ccc(Cl)cc1)N(C)S(=O)(=O)[C@@H]1CCCNC1	ZINC000062010837	184200976	/nfs/dbraw/zinc/20/09/76/184200976.db2.gz	OKPXWWACXRMZGD-SMDDNHRTSA-N	0	3	316.854	2.415	10	0		DEAEHN
CN(Cc1nccn1C)c1nc2c(s1)[C@H](N)CC(C)(C)C2	ZINC000062327854	184231151	/nfs/dbraw/zinc/23/11/51/184231151.db2.gz	UFFGMAAFKKNXRB-SNVBAGLBSA-N	0	3	305.451	2.485	10	0		DEAEHN
CCCN(CCO)c1nc2sccn2c1CNC(C)(C)C	ZINC000062736935	184251005	/nfs/dbraw/zinc/25/10/05/184251005.db2.gz	VJYITUAAXHDLPE-UHFFFAOYSA-N	0	3	310.467	2.493	10	0		DEAEHN
COCCNCc1c(N(C)[C@H](C)C2CC2)nc2sccn12	ZINC000062735990	184251044	/nfs/dbraw/zinc/25/10/44/184251044.db2.gz	BOTYVCCQCZMLJH-LLVKDONJSA-N	0	3	308.451	2.367	10	0		DEAEHN
CN1CCC(OC(=O)c2cccc(Br)c2N)CC1	ZINC000062827001	184254686	/nfs/dbraw/zinc/25/46/86/184254686.db2.gz	FNINXNWCBXLUKG-UHFFFAOYSA-N	0	3	313.195	2.282	10	0		DEAEHN
[NH3+][C@@H]1CCCCC[C@H]1[N-]S(=O)(=O)c1ccc(F)cc1Cl	ZINC000063213335	184278429	/nfs/dbraw/zinc/27/84/29/184278429.db2.gz	SLFPQXLHEASMNM-VXGBXAGGSA-N	0	3	320.817	2.417	10	0		DEAEHN
CN(C)[C@@H]1CCN(CC(=O)c2cccc(Br)c2)C1	ZINC000062966612	184263147	/nfs/dbraw/zinc/26/31/47/184263147.db2.gz	GHTAPRDZSFCUGA-CYBMUJFWSA-N	0	3	311.223	2.268	10	0		DEAEHN
[NH3+][C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000063175790	184276583	/nfs/dbraw/zinc/27/65/83/184276583.db2.gz	KRUMIAREPSYOSA-BDAKNGLRSA-N	0	3	309.218	2.152	10	0		DEAEHN
CC[C@H](C)N(CC)S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159067216	197323208	/nfs/dbraw/zinc/32/32/08/197323208.db2.gz	XPJDHUXPCSNMKY-NSHDSACASA-N	0	3	302.415	2.402	10	0		DEAEHN
CN(C(=O)C[C@H]1CCOc2ccccc21)C1CCN(C)CC1	ZINC000117741666	194844599	/nfs/dbraw/zinc/84/45/99/194844599.db2.gz	RBDDSBWHSQKUQA-CQSZACIVSA-N	0	3	302.418	2.495	10	0		DEAEHN
Cc1ccc(CNC[C@H]2CN(C)CCO2)cc1Br	ZINC000119917254	195061689	/nfs/dbraw/zinc/06/16/89/195061689.db2.gz	YCHOIIOYMBMUSK-ZDUSSCGKSA-N	0	3	313.239	2.178	10	0		DEAEHN
CN1CCN([C@H](CN)c2cc(F)cc(C(F)(F)F)c2)CC1	ZINC000159275705	197341007	/nfs/dbraw/zinc/34/10/07/197341007.db2.gz	XCODERNEAPBHJN-CYBMUJFWSA-N	0	3	305.319	2.092	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)Cc2ccco2)cc(CN)c1F	ZINC000159069051	197324281	/nfs/dbraw/zinc/32/42/81/197324281.db2.gz	KUDVOVCKXVQDTD-UHFFFAOYSA-N	0	3	312.366	2.007	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCCC[C@@H]2C)cc(CN)c1F	ZINC000159050532	197321621	/nfs/dbraw/zinc/32/16/21/197321621.db2.gz	BOUSBXYFFXKBRJ-NSHDSACASA-N	0	3	300.399	2.156	10	0		DEAEHN
COc1ccccc1C[C@H](N)c1c(Br)cnn1C	ZINC000158865023	197307723	/nfs/dbraw/zinc/30/77/23/197307723.db2.gz	BCEHRDVAFIYISH-NSHDSACASA-N	0	3	310.195	2.434	10	0		DEAEHN
CCc1ccc(CN)cc1S(=O)(=O)N1C[C@@H]2CCC[C@@H]2C1	ZINC000158752901	197298908	/nfs/dbraw/zinc/29/89/08/197298908.db2.gz	CIGOMCGMIUKRCV-GASCZTMLSA-N	0	3	308.447	2.128	10	0		DEAEHN
CN[C@@H](CS(=O)(=O)c1ccc(C(C)C)cc1)[C@H]1CCOC1	ZINC000158714259	197296322	/nfs/dbraw/zinc/29/63/22/197296322.db2.gz	DZPAAJDTTDVNRZ-HOCLYGCPSA-N	0	3	311.447	2.208	10	0		DEAEHN
CCCNc1nc(N(C)C)nc(N2CCS[C@H](CC)C2)n1	ZINC000158472879	197275880	/nfs/dbraw/zinc/27/58/80/197275880.db2.gz	CFUGQGGORZVEPP-LLVKDONJSA-N	0	3	310.471	2.091	10	0		DEAEHN
NCc1cc(C(F)(F)F)ccc1NC(=O)N1CCOCC1	ZINC000158348398	197264161	/nfs/dbraw/zinc/26/41/61/197264161.db2.gz	RVSVRHILGGYQRE-UHFFFAOYSA-N	0	3	303.284	2.028	10	0		DEAEHN
CC(C)(C)[C@@H](NC[C@H](O)CN1CCOCC1)c1ccc(F)cc1	ZINC000157829355	197218898	/nfs/dbraw/zinc/21/88/98/197218898.db2.gz	PFEQOABGKSXIAS-IRXDYDNUSA-N	0	3	324.440	2.196	10	0		DEAEHN
C[C@@](O)(Cc1sccc1Br)C[C@@H]1COCCN1	ZINC000156858539	197145704	/nfs/dbraw/zinc/14/57/04/197145704.db2.gz	CVLMZVIERRRRQC-SKDRFNHKSA-N	0	3	320.252	2.183	10	0		DEAEHN
CC(C)C[C@@H](C[NH+](C)C)NC(=O)NCc1ccc([O-])c(F)c1	ZINC000156763354	197138652	/nfs/dbraw/zinc/13/86/52/197138652.db2.gz	XZXJVRNHOVSBTE-ZDUSSCGKSA-N	0	3	311.401	2.307	10	0		DEAEHN
COc1cc(C)cc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1O	ZINC000155422166	197053202	/nfs/dbraw/zinc/05/32/02/197053202.db2.gz	BQJJQLXYCAMHBC-JSGCOSHPSA-N	0	3	306.406	2.168	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)N(C1CC1)C1CCCC1	ZINC000175346934	285239224	/nfs/dbraw/zinc/23/92/24/285239224.db2.gz	SQUVZYMPBKCQAG-QGZVFWFLSA-N	0	3	307.482	2.336	10	0		DEAEHN
OCC1(CNC2c3ccccc3CCc3ccccc32)COC1	ZINC000180977978	285247449	/nfs/dbraw/zinc/24/74/49/285247449.db2.gz	DPBNTIIHJKXJSP-UHFFFAOYSA-N	0	3	309.409	2.473	10	0		DEAEHN
CC[C@@H]1CN(Cc2cc(F)c(F)cc2F)CCN1C[C@@H](C)O	ZINC000120760711	195232675	/nfs/dbraw/zinc/23/26/75/195232675.db2.gz	ILNPOQPVCYDCGB-DGCLKSJQSA-N	0	3	316.367	2.381	10	0		DEAEHN
CN(C)C(=O)C[C@@H]1OC[C@@H]2CN(Cc3ccccc3F)CC[C@H]12	ZINC000247959669	257112488	/nfs/dbraw/zinc/11/24/88/257112488.db2.gz	DZRPRSPWUNNGHV-ZOBUZTSGSA-N	0	3	320.408	2.141	10	0		DEAEHN
Cc1cncc(C(=O)N2CC[C@]3(C2)CCC[C@@H](CN(C)C)O3)c1	ZINC000247950727	257114223	/nfs/dbraw/zinc/11/42/23/257114223.db2.gz	BZJSHTBRHACHQV-WMZOPIPTSA-N	0	3	317.433	2.105	10	0		DEAEHN
CC[C@H]1N[C@H](c2cccs2)N(CC2CCN(C)CC2)C1=O	ZINC000122004809	195389516	/nfs/dbraw/zinc/38/95/16/195389516.db2.gz	GKIRXBSJPFQTET-HIFRSBDPSA-N	0	3	307.463	2.299	10	0		DEAEHN
CN(C[C@@H]1CNCCO1)C(=O)c1cc2ccc(F)cc2s1	ZINC000125822325	195787882	/nfs/dbraw/zinc/78/78/82/195787882.db2.gz	YQDXLODOQMJHRH-LBPRGKRZSA-N	0	3	308.378	2.101	10	0		DEAEHN
COc1cccc(CN[C@H](C)c2ccc(S(N)(=O)=O)cc2)c1	ZINC000121529125	132155982	/nfs/dbraw/zinc/15/59/82/132155982.db2.gz	JRXWJBVFOXBPAA-GFCCVEGCSA-N	0	3	320.414	2.193	10	0		DEAEHN
CCc1nc([C@@H](C)NC(=O)N2CC[C@@H](N3CC=CC3)C2)cs1	ZINC000174847760	132511085	/nfs/dbraw/zinc/51/10/85/132511085.db2.gz	QOCGHIOLTHHKMW-CHWSQXEVSA-N	0	3	320.462	2.422	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@@H](C)NCCCS(C)(=O)=O	ZINC000178682433	132535580	/nfs/dbraw/zinc/53/55/80/132535580.db2.gz	LEWQGMUWMMHQPC-LLVKDONJSA-N	0	3	301.456	2.032	10	0		DEAEHN
C[C@H]1OCC[C@@H]1NC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000355848207	133052167	/nfs/dbraw/zinc/05/21/67/133052167.db2.gz	CMHVBOPIBQPZNY-PBHICJAKSA-N	0	3	302.418	2.192	10	0		DEAEHN
Cn1c2cccc(F)c2nc1NC(=O)CC1CCN(C)CC1	ZINC000362895037	133257792	/nfs/dbraw/zinc/25/77/92/133257792.db2.gz	HSISRJZPPWGJHD-UHFFFAOYSA-N	0	3	304.369	2.383	10	0		DEAEHN
COc1cccc(N2CCC[C@@H](NCc3[nH]ncc3C)C2=O)c1	ZINC000368091623	133259924	/nfs/dbraw/zinc/25/99/24/133259924.db2.gz	HBLWDYAEQRMVKV-OAHLLOKOSA-N	0	3	314.389	2.012	10	0		DEAEHN
Cc1cc(CCNC(=O)[C@H]2CCCCN2C2CCCC2)on1	ZINC000376392005	133292793	/nfs/dbraw/zinc/29/27/93/133292793.db2.gz	PNWWLGCHSROMRG-MRXNPFEDSA-N	0	3	305.422	2.439	10	0		DEAEHN
O=S1(=O)CCCC[C@H]1CNC1CC(OCc2ccccc2)C1	ZINC000563853443	292076202	/nfs/dbraw/zinc/07/62/02/292076202.db2.gz	OXFANQBWQNXZFQ-JCYILVPMSA-N	0	3	323.458	2.291	10	0		DEAEHN
O=C(NC1CCN(CC[C@@H]2CCOC2=O)CC1)C1CCCCC1	ZINC000120283642	144670944	/nfs/dbraw/zinc/67/09/44/144670944.db2.gz	SEULQWBGWVMBSJ-OAHLLOKOSA-N	0	3	322.449	2.101	10	0		DEAEHN
CC[C@@]1(CO)CCCN(Cc2cc(-c3cnn(C)c3)no2)C1	ZINC000187602555	145001552	/nfs/dbraw/zinc/00/15/52/145001552.db2.gz	SOIIXXXJRJGJPQ-MRXNPFEDSA-N	0	3	304.394	2.060	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(C[C@H](O)CSC)C2)c1	ZINC000187935240	145004846	/nfs/dbraw/zinc/00/48/46/145004846.db2.gz	XFOTXZMXFYCKPJ-OCCSQVGLSA-N	0	3	311.447	2.217	10	0		DEAEHN
CCOC1CC(CCNC(=O)N(C)C[C@@H]2CCCN2CC)C1	ZINC000191686664	145063044	/nfs/dbraw/zinc/06/30/44/145063044.db2.gz	RCWRLBCBXJLNNK-PCKAHOCUSA-N	0	3	311.470	2.317	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2ccc(C3CCC3)cc2)CCO1	ZINC000191870837	145066445	/nfs/dbraw/zinc/06/64/45/145066445.db2.gz	KGSHGXRPVQUPDE-QGZVFWFLSA-N	0	3	302.418	2.357	10	0		DEAEHN
Cc1csc2c1ncnc2N1CCN(C[C@@H]2CCOC2)CC1	ZINC000192666716	145077062	/nfs/dbraw/zinc/07/70/62/145077062.db2.gz	QJIHRSHJGAHLKF-ZDUSSCGKSA-N	0	3	318.446	2.158	10	0		DEAEHN
CCc1nc(C2CCN(Cc3cccnc3OC)CC2)n[nH]1	ZINC000193578872	145087131	/nfs/dbraw/zinc/08/71/31/145087131.db2.gz	JDBMNDCXNCWMKC-UHFFFAOYSA-N	0	3	301.394	2.150	10	0		DEAEHN
CCc1n[nH]c(C2CCN(Cc3cccnc3OC)CC2)n1	ZINC000193578872	145087132	/nfs/dbraw/zinc/08/71/32/145087132.db2.gz	JDBMNDCXNCWMKC-UHFFFAOYSA-N	0	3	301.394	2.150	10	0		DEAEHN
CCc1nnc(C2CCN(Cc3cccnc3OC)CC2)[nH]1	ZINC000193578872	145087134	/nfs/dbraw/zinc/08/71/34/145087134.db2.gz	JDBMNDCXNCWMKC-UHFFFAOYSA-N	0	3	301.394	2.150	10	0		DEAEHN
Cc1cc(C(=O)CN2C[C@H]3CN(C)C[C@H]3C2)c(C)n1C1CC1	ZINC000193656552	145088733	/nfs/dbraw/zinc/08/87/33/145088733.db2.gz	ULZLGUVZZLWXIX-GASCZTMLSA-N	0	3	301.434	2.116	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)Cc2ccccc2C)[C@@H](C)C1	ZINC000246127833	145093200	/nfs/dbraw/zinc/09/32/00/145093200.db2.gz	JLANVHAWVSCBMP-RDJZCZTQSA-N	0	3	324.490	2.487	10	0		DEAEHN
CCOc1ccc(OC[C@H](O)CN2CCS[C@@H](C)C2)cc1	ZINC000246203910	145094305	/nfs/dbraw/zinc/09/43/05/145094305.db2.gz	YCYBRBXBDIPKNM-UONOGXRCSA-N	0	3	311.447	2.262	10	0		DEAEHN
c1ccc(Cc2noc(CN3CCN4CCCC[C@H]4C3)n2)cc1	ZINC000246239166	145096149	/nfs/dbraw/zinc/09/61/49/145096149.db2.gz	UMLHOXAVFPASDS-INIZCTEOSA-N	0	3	312.417	2.331	10	0		DEAEHN
CCc1ccc(NC(=O)[C@H](C)N2CCN3CCC[C@H]3C2)cc1	ZINC000246287786	145097235	/nfs/dbraw/zinc/09/72/35/145097235.db2.gz	IGHYDONQACXFEJ-YOEHRIQHSA-N	0	3	301.434	2.356	10	0		DEAEHN
C[C@@H](C(=O)NCCC1=CCCCC1)N1CCN2CCC[C@H]2C1	ZINC000246403580	145101707	/nfs/dbraw/zinc/10/17/07/145101707.db2.gz	QEVDKCXORKOWLJ-RDJZCZTQSA-N	0	3	305.466	2.162	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)Cc2cccc(C)c2)[C@@H](C)C1	ZINC000246485921	145104251	/nfs/dbraw/zinc/10/42/51/145104251.db2.gz	WZGUDSYOWCOXNL-RDJZCZTQSA-N	0	3	324.490	2.487	10	0		DEAEHN
C[C@H](CN1CC[C@@H](Cc2ccc(F)cc2)C1)CS(C)(=O)=O	ZINC000246577527	145107414	/nfs/dbraw/zinc/10/74/14/145107414.db2.gz	OJDQNQVCWYIOIO-HIFRSBDPSA-N	0	3	313.438	2.371	10	0		DEAEHN
CN(C)c1ccc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c(F)c1	ZINC000246669181	145109772	/nfs/dbraw/zinc/10/97/72/145109772.db2.gz	LGMCIPQUFOEUPM-GUYCJALGSA-N	0	3	319.424	2.448	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cn(CCC(C)C)nn1	ZINC000246958683	145120869	/nfs/dbraw/zinc/12/08/69/145120869.db2.gz	MKMDBQYGQXZMAW-CABCVRRESA-N	0	3	319.453	2.023	10	0		DEAEHN
COc1cccc([C@@H](C)CC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000247016765	145123912	/nfs/dbraw/zinc/12/39/12/145123912.db2.gz	SGFUXVNEYHYBBO-HOCLYGCPSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1CCO[C@@H](c2cccc(O)c2)C1	ZINC000247019338	145123935	/nfs/dbraw/zinc/12/39/35/145123935.db2.gz	KSEMINFWWXTQOP-IAGOWNOFSA-N	0	3	318.417	2.167	10	0		DEAEHN
C[C@H](NC(=O)N1CCC[C@@H](N(C)C)C1)[C@@H]1COc2ccccc21	ZINC000247083879	145126070	/nfs/dbraw/zinc/12/60/70/145126070.db2.gz	VZOHDIOPKZXRMI-LZWOXQAQSA-N	0	3	317.433	2.287	10	0		DEAEHN
C[C@H](CNC(=O)N1CCN2CCC[C@H]2C1)Oc1ccccc1F	ZINC000247176379	145128101	/nfs/dbraw/zinc/12/81/01/145128101.db2.gz	RMMJKWWWSLUMEF-KGLIPLIRSA-N	0	3	321.396	2.083	10	0		DEAEHN
O=C([C@H]1SCCc2ccccc21)N1CCN2CCC[C@H]2C1	ZINC000247240823	145130783	/nfs/dbraw/zinc/13/07/83/145130783.db2.gz	XWWCJCQHJKKSLF-HOCLYGCPSA-N	0	3	302.443	2.324	10	0		DEAEHN
Cc1nn(C)c2sc(C(=O)N3C[C@H]4CCCN4C[C@H]3C)cc12	ZINC000247399211	145136057	/nfs/dbraw/zinc/13/60/57/145136057.db2.gz	PHNJGBGYHJETCL-ZYHUDNBSSA-N	0	3	318.446	2.252	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccc(F)c(F)c1)N1CCN2CCC[C@H]2C1	ZINC000247441710	145137333	/nfs/dbraw/zinc/13/73/33/145137333.db2.gz	ZZSPSXBSSGXPSN-AAEUAGOBSA-N	0	3	309.360	2.072	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N1CC[C@@]2(CCOC2)C1)c1ccccc1	ZINC000247503457	145139562	/nfs/dbraw/zinc/13/95/62/145139562.db2.gz	XTVQGGAHGARBST-RLFYNMQTSA-N	0	3	302.418	2.365	10	0		DEAEHN
C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)N1CC[C@@H](c2cnn(C)c2)C1	ZINC000247571320	145141218	/nfs/dbraw/zinc/14/12/18/145141218.db2.gz	WSUAWUBTVJEETG-KLHDSHLOSA-N	0	3	318.465	2.387	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2ccc(OC(F)F)cc2)C[C@H]1C	ZINC000247806858	145144120	/nfs/dbraw/zinc/14/41/20/145144120.db2.gz	SXIFDRNOQHVCRE-OLZOCXBDSA-N	0	3	314.376	2.175	10	0		DEAEHN
CC(C)Oc1ccc(CN2CCN(C[C@H](C)O)[C@H](C)C2)cc1	ZINC000247772070	145144202	/nfs/dbraw/zinc/14/42/02/145144202.db2.gz	PMXMJJXZFFMKML-CVEARBPZSA-N	0	3	306.450	2.361	10	0		DEAEHN
COc1cccc(NC(=O)CCN2CCN3CCCC[C@H]3C2)c1	ZINC000248357240	145152187	/nfs/dbraw/zinc/15/21/87/145152187.db2.gz	PGCLUMRMYPFMNK-INIZCTEOSA-N	0	3	317.433	2.194	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cnn(CC(C)C)c1	ZINC000248459114	145156140	/nfs/dbraw/zinc/15/61/40/145156140.db2.gz	VLCXMMUVULAJML-HOTGVXAUSA-N	0	3	304.438	2.238	10	0		DEAEHN
COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@@H](C)[C@H]1CCCO1	ZINC000248607852	145161037	/nfs/dbraw/zinc/16/10/37/145161037.db2.gz	PMIBDJDWCMFSRZ-RZLSGREXSA-N	0	3	320.433	2.418	10	0		DEAEHN
C[C@H](CS(=O)(=O)c1ccccc1)N[C@H]1CCO[C@@H](C2CC2)C1	ZINC000248878322	145171219	/nfs/dbraw/zinc/17/12/19/145171219.db2.gz	RJEJXBARFFIVNA-UKPHBRMFSA-N	0	3	323.458	2.396	10	0		DEAEHN
O=C1C[C@H](c2ccccc2)N(C[C@@H](O)CC2CCCC2)CCN1	ZINC000249108209	145179015	/nfs/dbraw/zinc/17/90/15/145179015.db2.gz	QTWDAIUGSMRRCN-ZWKOTPCHSA-N	0	3	316.445	2.491	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)C(=O)Nc1cccc(C)c1	ZINC000249123265	145179581	/nfs/dbraw/zinc/17/95/81/145179581.db2.gz	CCKBGFAQAFNFNV-HOTGVXAUSA-N	0	3	315.417	2.019	10	0		DEAEHN
O=C1NCCCC[C@@H]1N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000249321256	145182062	/nfs/dbraw/zinc/18/20/62/145182062.db2.gz	LQINHBINHYFZIT-KRWDZBQOSA-N	0	3	319.424	2.002	10	0		DEAEHN
Fc1ccccc1-c1noc(CN2CCN3CCC[C@H]3C2)n1	ZINC000249332946	145182115	/nfs/dbraw/zinc/18/21/15/145182115.db2.gz	HTGNBACRGBXILC-LBPRGKRZSA-N	0	3	302.353	2.156	10	0		DEAEHN
CCN(CC)C(=O)[C@H](C)N1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000249865968	145191112	/nfs/dbraw/zinc/19/11/12/145191112.db2.gz	HXCOHXJBWUNSLI-HOTGVXAUSA-N	0	3	318.465	2.381	10	0		DEAEHN
CC[C@@H](C)NC(=O)CN1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000249869251	145191170	/nfs/dbraw/zinc/19/11/70/145191170.db2.gz	IZNZTKDCPARKBS-HIFRSBDPSA-N	0	3	304.438	2.039	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NC[C@H](c2ccccc2)N(C)C)CC[C@H]1C	ZINC000251943331	145197331	/nfs/dbraw/zinc/19/73/31/145197331.db2.gz	UUIUWNZMOXIESH-DJIMGWMZSA-N	0	3	319.449	2.356	10	0		DEAEHN
N[C@@H](C(=O)Nc1ccnc(-c2ccccc2)c1)C1CCOCC1	ZINC000261764029	145224358	/nfs/dbraw/zinc/22/43/58/145224358.db2.gz	LWLZLIVKZMTENW-QGZVFWFLSA-N	0	3	311.385	2.441	10	0		DEAEHN
CN(CC12CC3CC(CC(C3)C1)C2)C(=O)[C@H](N)C1CCOCC1	ZINC000261796779	145227426	/nfs/dbraw/zinc/22/74/26/145227426.db2.gz	GUCQNUDYXFJLHI-MUGCCGGLSA-N	0	3	320.477	2.415	10	0		DEAEHN
N[C@@H](CC1CCCCC1)C(=O)NC[C@@H]1COc2ccccc2O1	ZINC000261882771	145236979	/nfs/dbraw/zinc/23/69/79/145236979.db2.gz	MUOPOGYMKPLSDC-CABCVRRESA-N	0	3	318.417	2.240	10	0		DEAEHN
NC1(C(=O)NCC2(Cc3ccccc3)CCC2)CCOCC1	ZINC000261876641	145237315	/nfs/dbraw/zinc/23/73/15/145237315.db2.gz	OROJHXQCQGBHRD-UHFFFAOYSA-N	0	3	302.418	2.024	10	0		DEAEHN
c1cc(N2CCCC2)ncc1N[C@@H]1CCC[C@@H]1[C@H]1COCCN1	ZINC000261887949	145238016	/nfs/dbraw/zinc/23/80/16/145238016.db2.gz	GAZIXYUDMGELFW-GVDBMIGSSA-N	0	3	316.449	2.251	10	0		DEAEHN
COc1cc(NC(=O)[C@H]2NCCCC2(C)C)ccc1NC(C)=O	ZINC000261947148	145245702	/nfs/dbraw/zinc/24/57/02/145245702.db2.gz	VUTYZOCLMYSVOX-OAHLLOKOSA-N	0	3	319.405	2.370	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)Nc1ccc2n[nH]cc2c1	ZINC000261953546	145246628	/nfs/dbraw/zinc/24/66/28/145246628.db2.gz	WSOLYNDXLLKOIC-DXCKQFNASA-N	0	3	314.389	2.034	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1	ZINC000262301484	145274763	/nfs/dbraw/zinc/27/47/63/145274763.db2.gz	KUJQRWSHGHTQRT-BDJLRTHQSA-N	0	3	311.376	2.177	10	0		DEAEHN
C[C@H](Cc1cccs1)NC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C	ZINC000262398950	145281734	/nfs/dbraw/zinc/28/17/34/145281734.db2.gz	CDPBLEOHFMRECV-LRCAOYNASA-N	0	3	322.474	2.328	10	0		DEAEHN
CC(=O)Nc1ccc(CNC(=O)[C@@H]2NCCCC2(C)C)cc1	ZINC000262489528	145287408	/nfs/dbraw/zinc/28/74/08/145287408.db2.gz	KUMICOSLSNGHEO-HNNXBMFYSA-N	0	3	303.406	2.039	10	0		DEAEHN
CN(CCc1cccs1)C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C	ZINC000262575842	145294146	/nfs/dbraw/zinc/29/41/46/145294146.db2.gz	YDDCRIQRWJSAOU-GRDNDAEWSA-N	0	3	322.474	2.282	10	0		DEAEHN
Cc1[nH]c2ccc(CNC(=O)C[C@@H]3CSCCN3)cc2c1C	ZINC000262808376	145306296	/nfs/dbraw/zinc/30/62/96/145306296.db2.gz	QPBZSYSLOCHIDG-CQSZACIVSA-N	0	3	317.458	2.496	10	0		DEAEHN
Cc1c(-c2nc([C@H]3CNCCN3C)no2)cnc2ccccc21	ZINC000263147953	145329721	/nfs/dbraw/zinc/32/97/21/145329721.db2.gz	CWAIDMWZNOTWTK-OAHLLOKOSA-N	0	3	309.373	2.169	10	0		DEAEHN
CSc1ccc(C)c(-c2nc([C@H]3CNCCN3C)no2)c1	ZINC000263177702	145333244	/nfs/dbraw/zinc/33/32/44/145333244.db2.gz	GIWFLSQZYJHATH-CYBMUJFWSA-N	0	3	304.419	2.343	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(CCc2cc3ccccc3o2)n1	ZINC000263182007	145333577	/nfs/dbraw/zinc/33/35/77/145333577.db2.gz	GUSKCTDFOWGCMO-AWEZNQCLSA-N	0	3	312.373	2.177	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@H](c2ccccc2)N(C)C)C1	ZINC000358488649	147143067	/nfs/dbraw/zinc/14/30/67/147143067.db2.gz	WVYLBKBRYZSBMB-MRXNPFEDSA-N	0	3	319.449	2.357	10	0		DEAEHN
C[C@H](CC1CCCCC1)C(=O)N1CCN(CCN(C)C)CC1	ZINC000358490807	147144178	/nfs/dbraw/zinc/14/41/78/147144178.db2.gz	DJRMFDMGRJVYAE-MRXNPFEDSA-N	0	3	309.498	2.299	10	0		DEAEHN
C/C(=C\c1ccc(C)cc1)C(=O)NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000371500266	148110401	/nfs/dbraw/zinc/11/04/01/148110401.db2.gz	MKGSGZUYICKQOW-MGJGCBFKSA-N	0	3	314.429	2.378	10	0		DEAEHN
CN(C)[C@H](CNC(=O)CN1CCCC12CCC2)c1ccccc1	ZINC000373103108	148211051	/nfs/dbraw/zinc/21/10/51/148211051.db2.gz	DJCQICWBVQZRBN-QGZVFWFLSA-N	0	3	315.461	2.424	10	0		DEAEHN
C/C(=C\C(C)(C)C)C(=O)N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1	ZINC000375379939	148364941	/nfs/dbraw/zinc/36/49/41/148364941.db2.gz	OGMIAHFAQPUJNZ-CRMBIJGISA-N	0	3	321.509	2.463	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1ccc2c(c1O)OC(C)(C)C2	ZINC000408407146	148600310	/nfs/dbraw/zinc/60/03/10/148600310.db2.gz	KESKFMUPRVCSMU-ZDUSSCGKSA-N	0	3	318.417	2.272	10	0		DEAEHN
CCOC(=O)CCCNC(=O)CN[C@@H](C)c1ccccc1C	ZINC000127120380	401720957	/nfs/dbraw/zinc/72/09/57/401720957.db2.gz	BHCMNVREUDOVEF-AWEZNQCLSA-N	0	3	306.406	2.105	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@H](C)c1ccccc1	ZINC000111790450	401723757	/nfs/dbraw/zinc/72/37/57/401723757.db2.gz	DPPUEZBSODKENM-ZBFHGGJFSA-N	0	3	305.422	2.158	10	0		DEAEHN
CC[C@@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1nccs1	ZINC000074365783	401737194	/nfs/dbraw/zinc/73/71/94/401737194.db2.gz	QGWZCXXQOPWSGA-FRRDWIJNSA-N	0	3	308.451	2.472	10	0		DEAEHN
COC(=O)CNC(=O)CCN[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000111198377	401699596	/nfs/dbraw/zinc/69/95/96/401699596.db2.gz	OKAKCPUWJYQKAG-INIZCTEOSA-N	0	3	324.808	2.060	10	0		DEAEHN
COc1ccc(NC(=O)NC(=O)CN2C[C@@H](C)CC[C@H]2C)cc1	ZINC000072897505	401713673	/nfs/dbraw/zinc/71/36/73/401713673.db2.gz	SXWYWASIEDJDFI-QWHCGFSZSA-N	0	3	319.405	2.464	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cc(Cl)nc(N3CCCC3)c2)C1	ZINC000112635050	401751952	/nfs/dbraw/zinc/75/19/52/401751952.db2.gz	NGRYLCCYQZCFDW-ZDUSSCGKSA-N	0	3	322.840	2.111	10	0		DEAEHN
OCCOCCNCc1ccc(OCc2ccccc2)cc1	ZINC000010435642	401770287	/nfs/dbraw/zinc/77/02/87/401770287.db2.gz	KMKIKOBKTOGCGC-UHFFFAOYSA-N	0	3	301.386	2.364	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(-c2ncon2)cc1	ZINC000113222408	401770876	/nfs/dbraw/zinc/77/08/76/401770876.db2.gz	CFPHEZRLFUBFPR-SWLSCSKDSA-N	0	3	312.373	2.045	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)COc1ccccc1Cl	ZINC000113223674	401770897	/nfs/dbraw/zinc/77/08/97/401770897.db2.gz	NQJVNJJIMUDVOI-QWHCGFSZSA-N	0	3	308.809	2.414	10	0		DEAEHN
Cc1cccc(O[C@H](C)C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000113229469	401771362	/nfs/dbraw/zinc/77/13/62/401771362.db2.gz	LWNKIBRCIKFMMG-XHSDSOJGSA-N	0	3	302.418	2.457	10	0		DEAEHN
COC(=O)Nc1ccc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1	ZINC000113233183	401771888	/nfs/dbraw/zinc/77/18/88/401771888.db2.gz	LHOJYUILKSZIPA-IUODEOHRSA-N	0	3	317.389	2.174	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1Cc1nc(-c2ccsc2)no1	ZINC000113269354	401773880	/nfs/dbraw/zinc/77/38/80/401773880.db2.gz	KKMVXHOHWPVFNG-DGCLKSJQSA-N	0	3	304.419	2.467	10	0		DEAEHN
COc1ccc(CN2CC[C@@H](c3cnn(C)c3)C2)cc1OC	ZINC000128488775	401778931	/nfs/dbraw/zinc/77/89/31/401778931.db2.gz	HPIHGIZOJUCAKG-CQSZACIVSA-N	0	3	301.390	2.427	10	0		DEAEHN
COc1ccc2c(c1)CCN2C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1	ZINC000130313055	401827064	/nfs/dbraw/zinc/82/70/64/401827064.db2.gz	NKJXGOLFOZWSFF-TZMCWYRMSA-N	0	3	315.417	2.393	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)NCc1ccc(F)c(CN(C)C)c1	ZINC000115415288	401827183	/nfs/dbraw/zinc/82/71/83/401827183.db2.gz	HHOVHTAAWPBKFR-QGZVFWFLSA-N	0	3	321.440	2.378	10	0		DEAEHN
O=C1CCCN1CCN1CCC(Oc2ccc(F)cc2)CC1	ZINC000115557461	401831797	/nfs/dbraw/zinc/83/17/97/401831797.db2.gz	FPBPWQNNGXJNKC-UHFFFAOYSA-N	0	3	306.381	2.291	10	0		DEAEHN
Cc1nccn1CCCN(C)CC(=O)Nc1ccccc1F	ZINC000130796277	401839499	/nfs/dbraw/zinc/83/94/99/401839499.db2.gz	VYEXOTPLAZDDKH-UHFFFAOYSA-N	0	3	304.369	2.291	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc([S@](C)=O)cc1	ZINC000078615026	401858542	/nfs/dbraw/zinc/85/85/42/401858542.db2.gz	BFSBZIWQAMLUFI-LHSJRXKWSA-N	0	3	310.463	2.130	10	0		DEAEHN
C[C@H](c1cn(-c2ccccc2)nn1)N1CCN2CCCC[C@@H]2C1	ZINC000129977350	401813823	/nfs/dbraw/zinc/81/38/23/401813823.db2.gz	PFABSWDINZPMTR-NVXWUHKLSA-N	0	3	311.433	2.498	10	0		DEAEHN
CN(C)CCSc1nnc(CNc2ccc(F)cc2)n1C	ZINC000040177419	401924377	/nfs/dbraw/zinc/92/43/77/401924377.db2.gz	MDCMGGKPRWAPDI-UHFFFAOYSA-N	0	3	309.414	2.220	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)[C@@H]1CCCn2ccnc21	ZINC000080653667	401890998	/nfs/dbraw/zinc/89/09/98/401890998.db2.gz	VJZIBIRUODXUME-HUUCEWRRSA-N	0	3	304.438	2.141	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1c(C)cccc1F	ZINC000133935391	401896252	/nfs/dbraw/zinc/89/62/52/401896252.db2.gz	MFNJKBDFGSIDJF-ZDUSSCGKSA-N	0	3	309.385	2.366	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1cc(C)ccc1OC	ZINC000036076764	401902137	/nfs/dbraw/zinc/90/21/37/401902137.db2.gz	CGQOTOGEPUVGED-ZDUSSCGKSA-N	0	3	314.451	2.012	10	0		DEAEHN
COc1ccc2c(c1)CCC[C@@H]2NC1CCS(=O)(=O)CC1	ZINC000036331459	401904479	/nfs/dbraw/zinc/90/44/79/401904479.db2.gz	VQPBATSWOFPXKW-INIZCTEOSA-N	0	3	309.431	2.239	10	0		DEAEHN
CC(C)Oc1ccccc1NC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000118803520	401908588	/nfs/dbraw/zinc/90/85/88/401908588.db2.gz	BAZXPBJCWMKNBR-CQSZACIVSA-N	0	3	321.421	2.268	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cnn(-c3ccccc3)c2)C1	ZINC000118964287	401915303	/nfs/dbraw/zinc/91/53/03/401915303.db2.gz	KOWRMPRVMBUABH-CQSZACIVSA-N	0	3	313.405	2.478	10	0		DEAEHN
CCN(CC)C(=O)[C@@H](C)N[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000119492209	401954241	/nfs/dbraw/zinc/95/42/41/401954241.db2.gz	HBJMQIVMOPMCBA-ZIAGYGMSSA-N	0	3	315.421	2.175	10	0		DEAEHN
CC[C@@H](CO)NC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000119583191	401960349	/nfs/dbraw/zinc/96/03/49/401960349.db2.gz	VNTCDWUGFMSDQQ-WMZOPIPTSA-N	0	3	319.449	2.111	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)N[C@@H]1CCCN(CC)C1	ZINC000119781973	401966471	/nfs/dbraw/zinc/96/64/71/401966471.db2.gz	APDXGNINLKXCQQ-CYBMUJFWSA-N	0	3	310.467	2.201	10	0		DEAEHN
C[C@@H](NC(=O)NC[C@@](C)(O)CN(C)C)c1cccc(Cl)c1	ZINC000120252753	401984356	/nfs/dbraw/zinc/98/43/56/401984356.db2.gz	YUGICVBVFJEFON-IAQYHMDHSA-N	0	3	313.829	2.013	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(=O)N(CCN(C)C)Cc2ccccc2F)O1	ZINC000150817466	401996997	/nfs/dbraw/zinc/99/69/97/401996997.db2.gz	NJVIZMPCTOAOSH-CJNGLKHVSA-N	0	3	308.397	2.283	10	0		DEAEHN
O=S(=O)([C@H]1CCN(CCCc2ccccc2)C1)N1CCCC1	ZINC000135661392	401949977	/nfs/dbraw/zinc/94/99/77/401949977.db2.gz	GLQFRYXENBXYMZ-KRWDZBQOSA-N	0	3	322.474	2.119	10	0		DEAEHN
C[C@@H](C(=O)NC1CCCC1)N1CCN(C[C@@H]2CC=CCC2)CC1	ZINC000093077597	402011048	/nfs/dbraw/zinc/01/10/48/402011048.db2.gz	MHOPZASNJAVUJV-DLBZAZTESA-N	0	3	319.493	2.408	10	0		DEAEHN
COc1ccc([C@@H]2C[C@@H](C)N(CC(=O)N3CCCC3)C2)cc1	ZINC000151043369	402012830	/nfs/dbraw/zinc/01/28/30/402012830.db2.gz	HLIHSXXAUKRLAT-GDBMZVCRSA-N	0	3	302.418	2.495	10	0		DEAEHN
Cc1cnc(CCN(C)C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)s1	ZINC000121352668	402030288	/nfs/dbraw/zinc/03/02/88/402030288.db2.gz	ZREJXTLYHFTKNG-YPMHNXCESA-N	0	3	322.478	2.261	10	0		DEAEHN
CN(CCCNC(=O)NCc1cscn1)Cc1ccccc1	ZINC000051308652	402033328	/nfs/dbraw/zinc/03/33/28/402033328.db2.gz	GISIWCKRZBQVGA-UHFFFAOYSA-N	0	3	318.446	2.464	10	0		DEAEHN
Cc1noc(C)c1[C@H](C)CNC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000151481017	402039195	/nfs/dbraw/zinc/03/91/95/402039195.db2.gz	BLVMYGAGMYQDJM-IUODEOHRSA-N	0	3	318.421	2.051	10	0		DEAEHN
Cn1ncc2c1CCC[C@H]2NCc1cccnc1-n1ccnc1	ZINC000151546902	402042722	/nfs/dbraw/zinc/04/27/22/402042722.db2.gz	GJYPICMPQYOKFL-OAHLLOKOSA-N	0	3	308.389	2.168	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)Cc2ccc3c(c2)OCO3)C1	ZINC000052594764	402044415	/nfs/dbraw/zinc/04/44/15/402044415.db2.gz	HNAWCBPYJSQNCO-CQSZACIVSA-N	0	3	319.405	2.041	10	0		DEAEHN
C[C@@H](C(=O)NCCN(C)Cc1ccccc1)C1CCOCC1	ZINC000122267707	402069377	/nfs/dbraw/zinc/06/93/77/402069377.db2.gz	HGPPKOCCYZJLSG-OAHLLOKOSA-N	0	3	304.434	2.297	10	0		DEAEHN
CC[C@H]1CN(CCc2ccc(F)c(F)c2)CCN1C[C@@H](C)O	ZINC000152048964	402072844	/nfs/dbraw/zinc/07/28/44/402072844.db2.gz	WSRZAQCFVOWOJE-HIFRSBDPSA-N	0	3	312.404	2.284	10	0		DEAEHN
O[C@@H](Cn1cnc2ccccc21)CN1CCc2ccccc2C1	ZINC000058137210	402098696	/nfs/dbraw/zinc/09/86/96/402098696.db2.gz	DQPOZPIVWUOICX-QGZVFWFLSA-N	0	3	307.397	2.456	10	0		DEAEHN
COc1ccc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1OC	ZINC000122928010	402101555	/nfs/dbraw/zinc/10/15/55/402101555.db2.gz	AOVNYYSVDKUDQA-GXTWGEPZSA-N	0	3	306.406	2.259	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)CN(C)Cc2ccccc2)CCN1C	ZINC000123265881	402118824	/nfs/dbraw/zinc/11/88/24/402118824.db2.gz	OGICMNJKIHYKKL-RDJZCZTQSA-N	0	3	303.450	2.060	10	0		DEAEHN
O=C(CN1CC[C@H]2OCCC[C@@H]2C1)N1CCc2ccccc2C1	ZINC000153166972	402130957	/nfs/dbraw/zinc/13/09/57/402130957.db2.gz	ORVJMUAIBZZLPH-QZTJIDSGSA-N	0	3	314.429	2.072	10	0		DEAEHN
O=S(=O)(CCCC(F)(F)F)NCc1ccc2c(c1)CNC2	ZINC000097829553	402133096	/nfs/dbraw/zinc/13/30/96/402133096.db2.gz	UVFONUYZBSYPBP-UHFFFAOYSA-N	0	3	322.352	2.052	10	0		DEAEHN
c1cc(-c2noc(CN3CCC[C@H]3CN3CCCC3)n2)co1	ZINC000066537024	402136210	/nfs/dbraw/zinc/13/62/10/402136210.db2.gz	VNXCIBPNWVYPLT-AWEZNQCLSA-N	0	3	302.378	2.390	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)C(=O)c2ccc(Cl)cc2)CCN1C	ZINC000123762016	402145158	/nfs/dbraw/zinc/14/51/58/402145158.db2.gz	VMPCUPSGPCQDKP-FZMZJTMJSA-N	0	3	308.809	2.464	10	0		DEAEHN
COC(=O)CCC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000067360918	402157295	/nfs/dbraw/zinc/15/72/95/402157295.db2.gz	CCTSOQJDOQPNCQ-MRXNPFEDSA-N	0	3	318.417	2.111	10	0		DEAEHN
Cc1cc(CN2CCN(C[C@@H](C)O)[C@H](C)C2)c2ccccc2n1	ZINC000124589468	402186850	/nfs/dbraw/zinc/18/68/50/402186850.db2.gz	BPFWJYSJJZAXTK-HZPDHXFCSA-N	0	3	313.445	2.430	10	0		DEAEHN
O=C([C@H](C1CC1)N1CCCC1)N1CCCC[C@H]1c1cn[nH]c1	ZINC000124172895	402167670	/nfs/dbraw/zinc/16/76/70/402167670.db2.gz	VQXOOLYMPPIDMK-HOTGVXAUSA-N	0	3	302.422	2.338	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCCc2csc(C(C)(C)C)n2)C1	ZINC000153846226	402174204	/nfs/dbraw/zinc/17/42/04/402174204.db2.gz	FWASNRYAJQVAIT-ZDUSSCGKSA-N	0	3	324.494	2.329	10	0		DEAEHN
CCc1cc(NCCN(C)CCOC)nc(-c2ccccn2)n1	ZINC000068698953	402204287	/nfs/dbraw/zinc/20/42/87/402204287.db2.gz	GJHFOYFNNWRJHW-UHFFFAOYSA-N	0	3	315.421	2.091	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCCc2csc(C(C)(C)C)n2)C1	ZINC000153846325	402174851	/nfs/dbraw/zinc/17/48/51/402174851.db2.gz	FWASNRYAJQVAIT-CYBMUJFWSA-N	0	3	324.494	2.329	10	0		DEAEHN
Cc1ccc(F)c(OCC(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000126085059	402263742	/nfs/dbraw/zinc/26/37/42/402263742.db2.gz	ARFIYMCVJARJBM-DZGCQCFKSA-N	0	3	308.397	2.358	10	0		DEAEHN
C[C@H]1CN(CC2CCN(C(=O)C3=COCCC3)CC2)C[C@H](C)O1	ZINC000107586590	402235824	/nfs/dbraw/zinc/23/58/24/402235824.db2.gz	WABIYFXKCPOAGX-GJZGRUSLSA-N	0	3	322.449	2.029	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cccc(-c2nc[nH]n2)c1	ZINC000154933986	402238979	/nfs/dbraw/zinc/23/89/79/402238979.db2.gz	GHWOSOVSJPHTGE-HNNXBMFYSA-N	0	3	313.405	2.028	10	0		DEAEHN
O=S(=O)(Cc1ccccc1)N1CCCC[C@@H](N2CCCC2)C1	ZINC000107707752	402239210	/nfs/dbraw/zinc/23/92/10/402239210.db2.gz	BZGBEEOPUNZUDD-QGZVFWFLSA-N	0	3	322.474	2.467	10	0		DEAEHN
COc1ccc2nc(C(=O)NC[C@H]3CCCN(C)C3)ccc2c1	ZINC000108326783	402249964	/nfs/dbraw/zinc/24/99/64/402249964.db2.gz	XCONCKMQRVATRN-CYBMUJFWSA-N	0	3	313.401	2.315	10	0		DEAEHN
CCCN(C[C@H]1CCCCO1)C(=O)NC[C@H]1CCCN(C)C1	ZINC000108590357	402257758	/nfs/dbraw/zinc/25/77/58/402257758.db2.gz	KTQLUNPRWJSTSK-HZPDHXFCSA-N	0	3	311.470	2.319	10	0		DEAEHN
C(c1noc2c1CCCC2)N1CCC(CN2CCOCC2)CC1	ZINC000108859320	402262952	/nfs/dbraw/zinc/26/29/52/402262952.db2.gz	IITNVXLGQJONEY-UHFFFAOYSA-N	0	3	319.449	2.098	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(CC(=O)N2CCCCCC2)C1	ZINC000105896411	402210575	/nfs/dbraw/zinc/21/05/75/402210575.db2.gz	JQSOADUDEGXHAK-MRXNPFEDSA-N	0	3	318.465	2.485	10	0		DEAEHN
COc1c(C)cnc(CN2CCC[C@@H](Cn3cncn3)C2)c1C	ZINC000105919360	402211157	/nfs/dbraw/zinc/21/11/57/402211157.db2.gz	ZPARUPRMFJALEQ-OAHLLOKOSA-N	0	3	315.421	2.211	10	0		DEAEHN
CC(C)OCCN1CCC(NC(=O)N2CCCC2(C)C)CC1	ZINC000176618363	402323596	/nfs/dbraw/zinc/32/35/96/402323596.db2.gz	ZAUROEIHTRFYFG-UHFFFAOYSA-N	0	3	311.470	2.460	10	0		DEAEHN
CCn1nccc1CCN1C[C@@H](O)C[C@@H]1c1cccc(OC)c1	ZINC000225787171	402323835	/nfs/dbraw/zinc/32/38/35/402323835.db2.gz	YRPGMLGYUMTPSX-FUHWJXTLSA-N	0	3	315.417	2.262	10	0		DEAEHN
COCCN(C)CCNC(=O)c1cc(C)c(F)cc1Cl	ZINC000126293792	402274250	/nfs/dbraw/zinc/27/42/50/402274250.db2.gz	JLAFSFYPGOEKQX-UHFFFAOYSA-N	0	3	302.777	2.096	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2ccc(OC(C)(C)C)cc2)CCO1	ZINC000176059583	402274786	/nfs/dbraw/zinc/27/47/86/402274786.db2.gz	KGZKKQNJHZFOFG-MRXNPFEDSA-N	0	3	320.433	2.267	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CCCC1	ZINC000184659935	402289335	/nfs/dbraw/zinc/28/93/35/402289335.db2.gz	LLRWAUYJUHEIIM-GFCCVEGCSA-N	0	3	324.446	2.197	10	0		DEAEHN
CCOC[C@@H]1CCN(CC(=O)N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000176337526	402300999	/nfs/dbraw/zinc/30/09/99/402300999.db2.gz	FIPLUHWCNWXFBB-OLZOCXBDSA-N	0	3	322.371	2.146	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)NCCOCc1ccccc1	ZINC000176368503	402303720	/nfs/dbraw/zinc/30/37/20/402303720.db2.gz	HVBYORGGVOCLFW-MRXNPFEDSA-N	0	3	319.449	2.377	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@@H](COC)c1ccco1	ZINC000176437772	402309808	/nfs/dbraw/zinc/30/98/08/402309808.db2.gz	HEAIIMPCXZJNKM-KBPBESRZSA-N	0	3	309.410	2.093	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)CSCc2cccnc2)C1	ZINC000158816588	402312517	/nfs/dbraw/zinc/31/25/17/402312517.db2.gz	HFDMWZRCNBKVIN-HIFRSBDPSA-N	0	3	307.463	2.160	10	0		DEAEHN
CCC1(CO)CCN(Cc2cc(-c3cnn(C)c3)no2)CC1	ZINC000185045057	402319543	/nfs/dbraw/zinc/31/95/43/402319543.db2.gz	FXAVOKVMXZBLRU-UHFFFAOYSA-N	0	3	304.394	2.060	10	0		DEAEHN
Cc1cccc2c1ncc(C)c2NCCCNS(C)(=O)=O	ZINC000185266700	402340072	/nfs/dbraw/zinc/34/00/72/402340072.db2.gz	BSIAGELVYYIAGK-UHFFFAOYSA-N	0	3	307.419	2.203	10	0		DEAEHN
COC(=O)c1ccc(C(=O)N[C@@H](C)CN2CCCCCC2)o1	ZINC000185443249	402352690	/nfs/dbraw/zinc/35/26/90/402352690.db2.gz	OAJKUQWCYGDRHP-LBPRGKRZSA-N	0	3	308.378	2.061	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@@H]1Cc2cc(F)ccc2O1	ZINC000177015053	402359342	/nfs/dbraw/zinc/35/93/42/402359342.db2.gz	PPYAEDQETQAKKR-HOCLYGCPSA-N	0	3	306.381	2.072	10	0		DEAEHN
CCOc1ccc(OCC(=O)N(C)C[C@H]2CCCN2CC)cc1	ZINC000177017228	402359956	/nfs/dbraw/zinc/35/99/56/402359956.db2.gz	MZHHGEPZSVCGJT-OAHLLOKOSA-N	0	3	320.433	2.407	10	0		DEAEHN
COC[C@@H](C)OC[C@@H](O)CN[C@H](C)c1cccc(Cl)c1	ZINC000234785154	402360899	/nfs/dbraw/zinc/36/08/99/402360899.db2.gz	YMGLCSLLSWCIRV-JMSVASOKSA-N	0	3	301.814	2.403	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@@H](C)Cc1c(C)nn(C)c1C	ZINC000177044621	402363803	/nfs/dbraw/zinc/36/38/03/402363803.db2.gz	PPSCZMYYISXHFA-XJKSGUPXSA-N	0	3	320.481	2.158	10	0		DEAEHN
CCO[C@H]1C[C@@H](NCc2cnn3ccccc23)C12CCOCC2	ZINC000185663993	402368068	/nfs/dbraw/zinc/36/80/68/402368068.db2.gz	BDTLOMOUBIBMIM-SJORKVTESA-N	0	3	315.417	2.398	10	0		DEAEHN
CCc1cccc(OCCN2C[C@H](C)[C@H](N3CCOCC3)C2)c1	ZINC000177223739	402383274	/nfs/dbraw/zinc/38/32/74/402383274.db2.gz	PRAOYZKDVNPJOH-QFBILLFUSA-N	0	3	318.461	2.280	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCC1(OC)CCCCC1	ZINC000185920484	402389050	/nfs/dbraw/zinc/38/90/50/402389050.db2.gz	NZPLQOMTRLZTDQ-OAHLLOKOSA-N	0	3	311.470	2.461	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N2CC[C@H](N(C)C)C2)C1(CC)CC	ZINC000176676976	402327811	/nfs/dbraw/zinc/32/78/11/402327811.db2.gz	PGJGJVWSSYBFJQ-SOUVJXGZSA-N	0	3	311.470	2.316	10	0		DEAEHN
CC[C@H]1CN(c2ncnc3cccc(C)c32)CCN1CCOC	ZINC000176807265	402339420	/nfs/dbraw/zinc/33/94/20/402339420.db2.gz	MMMNJXVJTUUSGP-HNNXBMFYSA-N	0	3	314.433	2.485	10	0		DEAEHN
COC(=O)c1coc(C(=O)NCc2cccc(CN(C)C)c2)c1	ZINC000186204571	402410365	/nfs/dbraw/zinc/41/03/65/402410365.db2.gz	GCRRUYGYJSBHCZ-UHFFFAOYSA-N	0	3	316.357	2.058	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCCNc1ccccn1	ZINC000177524499	402412380	/nfs/dbraw/zinc/41/23/80/402412380.db2.gz	SLZDCSAEPCNGPJ-OAHLLOKOSA-N	0	3	319.453	2.009	10	0		DEAEHN
C[NH+](C)C1CCN(C(=O)c2ccc3c(c2[O-])CCCC3)CC1	ZINC000186230752	402413330	/nfs/dbraw/zinc/41/33/30/402413330.db2.gz	ODYBRVORGQSHTQ-UHFFFAOYSA-N	0	3	302.418	2.437	10	0		DEAEHN
CCOc1cccnc1C(=O)N[C@H](C)CN1CCCCCC1	ZINC000186290500	402418261	/nfs/dbraw/zinc/41/82/61/402418261.db2.gz	WMCKFPGHHPZAPA-CQSZACIVSA-N	0	3	305.422	2.475	10	0		DEAEHN
CCO[C@H]1C[C@H](N[C@H](CO)c2ccccc2)C12CCOCC2	ZINC000186341201	402422731	/nfs/dbraw/zinc/42/27/31/402422731.db2.gz	JNLJITDDJNDKLH-IKGGRYGDSA-N	0	3	305.418	2.284	10	0		DEAEHN
COc1cc(CN2CCC(C(=O)N(C)C)CC2)cc(OC)c1	ZINC000162599499	402425811	/nfs/dbraw/zinc/42/58/11/402425811.db2.gz	JZEILMNWKYROPA-UHFFFAOYSA-N	0	3	306.406	2.004	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)NCCCCOCc1ccccc1	ZINC000238052212	402434397	/nfs/dbraw/zinc/43/43/97/402434397.db2.gz	ZPGWSEAREWJKMR-MRXNPFEDSA-N	0	3	322.474	2.195	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)CN[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000163078064	402440984	/nfs/dbraw/zinc/44/09/84/402440984.db2.gz	ZRQQVLOYMKNNNE-ZIAGYGMSSA-N	0	3	315.421	2.079	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(-c3cncnc3)cc2F)C1	ZINC000186590521	402445266	/nfs/dbraw/zinc/44/52/66/402445266.db2.gz	YPKKACPFYYNNID-AWEZNQCLSA-N	0	3	314.364	2.059	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NC1Cc2ccccc2C1	ZINC000186607104	402447315	/nfs/dbraw/zinc/44/73/15/402447315.db2.gz	YGUJCKPIKRZBSZ-KRWDZBQOSA-N	0	3	303.450	2.429	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCc1ccn2ccnc2c1	ZINC000177968556	402447840	/nfs/dbraw/zinc/44/78/40/402447840.db2.gz	OGFZBYXJPLJAJC-HNNXBMFYSA-N	0	3	317.437	2.110	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H]1CCN(c2ccccc2)C1)N(C)C	ZINC000161554933	402391424	/nfs/dbraw/zinc/39/14/24/402391424.db2.gz	AWQWOXSQSITVOH-WBVHZDCISA-N	0	3	303.450	2.359	10	0		DEAEHN
COc1cc(F)c(NC(=O)N2CCN3CCC[C@@H]3C2)cc1F	ZINC000177355733	402394495	/nfs/dbraw/zinc/39/44/95/402394495.db2.gz	MPIWTWDYDRJKKA-SNVBAGLBSA-N	0	3	311.332	2.285	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@H]2CCCN2Cc2ccccc2)C1	ZINC000245238143	402452956	/nfs/dbraw/zinc/45/29/56/402452956.db2.gz	YGBZVBILLZITTB-QZTJIDSGSA-N	0	3	315.461	2.252	10	0		DEAEHN
C[C@@H](NCc1cccnc1-n1cncn1)c1ccc2c(c1)OCO2	ZINC000178048915	402455596	/nfs/dbraw/zinc/45/55/96/402455596.db2.gz	DQUGODDFLRARGW-GFCCVEGCSA-N	0	3	323.356	2.242	10	0		DEAEHN
COC(=O)[C@@H]1CCCCN1CCN(C)Cc1ccc(F)cc1	ZINC000245407464	402456870	/nfs/dbraw/zinc/45/68/70/402456870.db2.gz	BEGQGZSUSMZBCE-INIZCTEOSA-N	0	3	308.397	2.285	10	0		DEAEHN
COC[C@H](NC(=O)NCCN1CCCC[C@H]1C)c1ccc(C)o1	ZINC000245424809	402459227	/nfs/dbraw/zinc/45/92/27/402459227.db2.gz	CZQIUUZIVFYAHZ-HIFRSBDPSA-N	0	3	323.437	2.449	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@H](C)CCc1cccn1C	ZINC000245430260	402459593	/nfs/dbraw/zinc/45/95/93/402459593.db2.gz	ZPNJXJWMGQMHFH-NVXWUHKLSA-N	0	3	320.481	2.472	10	0		DEAEHN
NC1(C(=O)NCCc2coc(-c3ccc(F)cc3)n2)CCCC1	ZINC000178101408	402461116	/nfs/dbraw/zinc/46/11/16/402461116.db2.gz	MRMWTXGUXRGNGU-UHFFFAOYSA-N	0	3	317.364	2.411	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)NCC1CCCCC1	ZINC000245474111	402464545	/nfs/dbraw/zinc/46/45/45/402464545.db2.gz	QPGHGUAIDSLMII-NVXWUHKLSA-N	0	3	309.498	2.488	10	0		DEAEHN
CCOc1ccc2c(c1)[C@@H](NC1CCN(C(N)=O)CC1)CCO2	ZINC000178178652	402468270	/nfs/dbraw/zinc/46/82/70/402468270.db2.gz	JHSVMOMJUGWGHY-HNNXBMFYSA-N	0	3	319.405	2.042	10	0		DEAEHN
C[C@@H](N[C@@H]1CCCN(c2ncccn2)C1)c1cncc(F)c1	ZINC000178194804	402470049	/nfs/dbraw/zinc/47/00/49/402470049.db2.gz	KZWFDTKBQYDWOG-IUODEOHRSA-N	0	3	301.369	2.330	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)c1cc(O)ccc1OC	ZINC000186957466	402473998	/nfs/dbraw/zinc/47/39/98/402473998.db2.gz	FEFAIRZZWSPWOS-CYBMUJFWSA-N	0	3	306.406	2.395	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1csc(Br)c1	ZINC000165451054	402476118	/nfs/dbraw/zinc/47/61/18/402476118.db2.gz	KTPAKBBUZPDQLM-LLVKDONJSA-N	0	3	308.241	2.388	10	0		DEAEHN
COc1ccc(O)cc1C(=O)NC[C@H](c1ccccc1)N(C)C	ZINC000187108991	402483082	/nfs/dbraw/zinc/48/30/82/402483082.db2.gz	OVTFBJHIKPPBSC-MRXNPFEDSA-N	0	3	314.385	2.434	10	0		DEAEHN
CCCOc1cccc(CN2CCN(C[C@H](C)O)[C@H](C)C2)c1	ZINC000245740511	402484958	/nfs/dbraw/zinc/48/49/58/402484958.db2.gz	LPMWLTDTOAIVAZ-CVEARBPZSA-N	0	3	306.450	2.362	10	0		DEAEHN
NC1(C(=O)N2CCC[C@@H](C(F)(F)F)C2)Cc2ccccc2C1	ZINC000178330562	402485737	/nfs/dbraw/zinc/48/57/37/402485737.db2.gz	JOLFIKCBMXYLNW-CYBMUJFWSA-N	0	3	312.335	2.284	10	0		DEAEHN
COc1ccc(CNC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cc1	ZINC000245856418	402491331	/nfs/dbraw/zinc/49/13/31/402491331.db2.gz	DQKDHJVJLJYOGS-DOTOQJQBSA-N	0	3	317.433	2.321	10	0		DEAEHN
CCOc1ncccc1NC(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000246158605	402513558	/nfs/dbraw/zinc/51/35/58/402513558.db2.gz	CZVVZFMYPDXAKF-OCCSQVGLSA-N	0	3	306.410	2.331	10	0		DEAEHN
COC(=O)c1cncc(NC(=O)c2cccc(CN(C)C)c2)c1	ZINC000178399246	402494057	/nfs/dbraw/zinc/49/40/57/402494057.db2.gz	JCEJWTWWJGSEOD-UHFFFAOYSA-N	0	3	313.357	2.182	10	0		DEAEHN
CC(C)c1nnc(CN2CCN(C)CC23CCCCC3)n1C	ZINC000178404627	402494760	/nfs/dbraw/zinc/49/47/60/402494760.db2.gz	AEADPPLWNRGDIJ-UHFFFAOYSA-N	0	3	305.470	2.389	10	0		DEAEHN
COC[C@@H](C)CNc1cccc(CN2CCC(C(N)=O)CC2)c1	ZINC000187495623	402502846	/nfs/dbraw/zinc/50/28/46/402502846.db2.gz	HDSXFJKFUJWAFB-AWEZNQCLSA-N	0	3	319.449	2.078	10	0		DEAEHN
CC[C@]1(CO)CCCN(C[C@H](O)COc2ccc(C)cc2)C1	ZINC000187602991	402506169	/nfs/dbraw/zinc/50/61/69/402506169.db2.gz	RGQYUUZINJPGFK-WMZOPIPTSA-N	0	3	307.434	2.219	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C)cc2)[C@@H](C)C1	ZINC000246065465	402506633	/nfs/dbraw/zinc/50/66/33/402506633.db2.gz	DQWVQNYQERZOGV-HOCLYGCPSA-N	0	3	310.463	2.346	10	0		DEAEHN
CC1(C)CC[C@@H](CN[C@H](Cc2ccc(Cl)cc2)C(N)=O)O1	ZINC000187648328	402507282	/nfs/dbraw/zinc/50/72/82/402507282.db2.gz	NBQKFJTXIFGQIN-UONOGXRCSA-N	0	3	310.825	2.284	10	0		DEAEHN
COc1ccc(C[C@@H](C)NCc2cc(C(N)=O)co2)cc1OC	ZINC000187707438	402509105	/nfs/dbraw/zinc/50/91/05/402509105.db2.gz	AXNXDXPZGRDXNU-LLVKDONJSA-N	0	3	318.373	2.117	10	0		DEAEHN
CC(C)(C)OC(=O)[C@H]1CCN(C[C@H](O)Cc2ccccc2)C1	ZINC000178837265	402545627	/nfs/dbraw/zinc/54/56/27/402545627.db2.gz	LPBYKWGZWYOLID-JKSUJKDBSA-N	0	3	305.418	2.254	10	0		DEAEHN
COc1cc(OC)cc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000246996923	402552913	/nfs/dbraw/zinc/55/29/13/402552913.db2.gz	FLFNQZRICADCDK-JSGCOSHPSA-N	0	3	304.390	2.013	10	0		DEAEHN
COC(=O)N(C)c1ccc(NC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000171081646	402555821	/nfs/dbraw/zinc/55/58/21/402555821.db2.gz	PIBRPSPSKFRJKR-CQSZACIVSA-N	0	3	320.393	2.057	10	0		DEAEHN
O=C([C@@H]1C[C@@H]1c1c(F)cccc1F)N1CCN2CCC[C@H]2C1	ZINC000247256319	402561269	/nfs/dbraw/zinc/56/12/69/402561269.db2.gz	QASYMQWHGBQXQM-RWMBFGLXSA-N	0	3	306.356	2.375	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1cc(N)nc(Cl)c1)c1ccccc1	ZINC000171184150	402564536	/nfs/dbraw/zinc/56/45/36/402564536.db2.gz	AZAXFNSOXYUVFX-CYBMUJFWSA-N	0	3	318.808	2.350	10	0		DEAEHN
C[C@@H](C(=O)N1C[C@H](C)C[C@@H](C)C1)N1CCCN(C2CC2)CC1	ZINC000246181059	402516340	/nfs/dbraw/zinc/51/63/40/402516340.db2.gz	RLPOOSGROQRZRC-OAGGEKHMSA-N	0	3	307.482	2.050	10	0		DEAEHN
CCN1CCN(CCC(=O)NCc2ccc(SC)cc2)CC1	ZINC000171271916	402573248	/nfs/dbraw/zinc/57/32/48/402573248.db2.gz	BUWQKZYJOLYZST-UHFFFAOYSA-N	0	3	321.490	2.052	10	0		DEAEHN
C[C@@H](NC(=O)CN1CCN2CCC[C@@H]2C1)c1ccccc1Cl	ZINC000178631278	402519394	/nfs/dbraw/zinc/51/93/94/402519394.db2.gz	IJCVIDMMLJFRNL-ZIAGYGMSSA-N	0	3	321.852	2.297	10	0		DEAEHN
C[C@@H]1CN([C@H]2CCc3ccc(F)cc32)C[C@H]1N1CCOCC1	ZINC000246308420	402524036	/nfs/dbraw/zinc/52/40/36/402524036.db2.gz	CHFDVNBGGVMPGG-JEBQAFNWSA-N	0	3	304.409	2.466	10	0		DEAEHN
C[C@H]1C[C@H]1NC(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	ZINC000170823117	402530002	/nfs/dbraw/zinc/53/00/02/402530002.db2.gz	XFANSWLDYDGKMG-XJKSGUPXSA-N	0	3	315.417	2.136	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C	ZINC000247656929	402573912	/nfs/dbraw/zinc/57/39/12/402573912.db2.gz	YQTUOXZRDHBDSA-CAOSSQGBSA-N	0	3	311.470	2.221	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CC(=O)NCCC(C)(C)C	ZINC000178748431	402534708	/nfs/dbraw/zinc/53/47/08/402534708.db2.gz	XMYZJAKTENGITE-OAHLLOKOSA-N	0	3	306.454	2.208	10	0		DEAEHN
COC(=O)c1cccc(OCCN2CC[C@@H](C)[C@@H](OC)C2)c1	ZINC000189348662	402534764	/nfs/dbraw/zinc/53/47/64/402534764.db2.gz	QQKUEEKNYOWCFG-CJNGLKHVSA-N	0	3	307.390	2.209	10	0		DEAEHN
CN(C)c1nc2sc(C(=O)N3CC[C@@H](N(C)C)C3)cc2s1	ZINC000170864935	402534975	/nfs/dbraw/zinc/53/49/75/402534975.db2.gz	ZSUGLYLWDVFVSD-SECBINFHSA-N	0	3	324.475	2.200	10	0		DEAEHN
COCCc1ccccc1NC(=O)N1CCN2CCC[C@H]2C1	ZINC000189457175	402538974	/nfs/dbraw/zinc/53/89/74/402538974.db2.gz	DEWOQNDDCGCZNH-HNNXBMFYSA-N	0	3	303.406	2.187	10	0		DEAEHN
CCCN(CCC)C(=O)CCC(=O)N[C@H]1CCCN(CC)C1	ZINC000170903726	402539936	/nfs/dbraw/zinc/53/99/36/402539936.db2.gz	RMCUJSSHUPQNTN-HNNXBMFYSA-N	0	3	311.470	2.016	10	0		DEAEHN
Cc1nn(C)c2ncc(CN3CC[C@@]4(O)CCCC[C@H]4C3)cc12	ZINC000247943695	402578598	/nfs/dbraw/zinc/57/85/98/402578598.db2.gz	DHBIVVUTUAKABU-YJBOKZPZSA-N	0	3	314.433	2.404	10	0		DEAEHN
COCc1cccc(CN2CCCN(c3cccnn3)CC2)c1	ZINC000179212157	402581670	/nfs/dbraw/zinc/58/16/70/402581670.db2.gz	RJMSUWQJCQGTHA-UHFFFAOYSA-N	0	3	312.417	2.335	10	0		DEAEHN
CC(C)n1cc(CN2CCC(N3CCO[C@@H](C)C3)CC2)cn1	ZINC000179345718	402586483	/nfs/dbraw/zinc/58/64/83/402586483.db2.gz	XNMCEQGZHUJNPZ-HNNXBMFYSA-N	0	3	306.454	2.149	10	0		DEAEHN
C[C@H](CC1CCCCC1)CN1CC[C@@H](NS(C)(=O)=O)C1	ZINC000248598890	402598173	/nfs/dbraw/zinc/59/81/73/402598173.db2.gz	IRNVBURRGGOSAC-UKRRQHHQSA-N	0	3	302.484	2.216	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)[C@@H]2CCCO[C@@H]2C)o1	ZINC000190478406	402604213	/nfs/dbraw/zinc/60/42/13/402604213.db2.gz	JMGZKLQXVPJGRQ-GDBMZVCRSA-N	0	3	308.422	2.293	10	0		DEAEHN
CC(C)N(Cc1ccccc1)C(=O)[C@H](C)NCCn1cccn1	ZINC000171645191	402605042	/nfs/dbraw/zinc/60/50/42/402605042.db2.gz	JOZIRZNCOHSUQG-INIZCTEOSA-N	0	3	314.433	2.298	10	0		DEAEHN
C[C@H]1CN(C2CCN(C[C@](C)(O)c3ccccc3)CC2)CCO1	ZINC000171647845	402605766	/nfs/dbraw/zinc/60/57/66/402605766.db2.gz	IALSCYWQBDDHBA-LPHOPBHVSA-N	0	3	318.461	2.079	10	0		DEAEHN
CC(C)Cc1cc(C(=O)N2CCCN(C3CC3)CC2)cc(=O)[nH]1	ZINC000180192285	402609519	/nfs/dbraw/zinc/60/95/19/402609519.db2.gz	YDAGCADLTCDJJK-UHFFFAOYSA-N	0	3	317.433	2.296	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@H]2CCCc3cccnc32)C1	ZINC000248835104	402610378	/nfs/dbraw/zinc/61/03/78/402610378.db2.gz	CTSBRKDCRAUGBB-KBMXLJTQSA-N	0	3	301.434	2.346	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cn2ccnc2s1	ZINC000248966084	402616164	/nfs/dbraw/zinc/61/61/64/402616164.db2.gz	RUVIWAGEEJMPAH-NEPJUHHUSA-N	0	3	304.419	2.095	10	0		DEAEHN
C[C@@H](NC[C@@H](O)CN1CCCC1=O)c1cc2ccccc2o1	ZINC000180442701	402616913	/nfs/dbraw/zinc/61/69/13/402616913.db2.gz	BIBQOXROYDEVGC-TZMCWYRMSA-N	0	3	302.374	2.067	10	0		DEAEHN
CCc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc3c(c1)OCO3)CC2	ZINC000180631070	402621903	/nfs/dbraw/zinc/62/19/03/402621903.db2.gz	HHTZGNZWDLINLF-AAEUAGOBSA-N	0	3	314.389	2.235	10	0		DEAEHN
COC(=O)c1ccc(C)c(NC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000171807248	402624021	/nfs/dbraw/zinc/62/40/21/402624021.db2.gz	XSVJSLQHBOBGMH-CQSZACIVSA-N	0	3	317.389	2.094	10	0		DEAEHN
C[C@@H](CNC(=O)NCCCc1ccccn1)N1CCC[C@H](C)C1	ZINC000179170806	402577531	/nfs/dbraw/zinc/57/75/31/402577531.db2.gz	WPMAWNCQMFSXBS-HOTGVXAUSA-N	0	3	318.465	2.434	10	0		DEAEHN
Cc1cccc(OC[C@@H](C)NC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000171903842	402632422	/nfs/dbraw/zinc/63/24/22/402632422.db2.gz	WBNJXAGGYPYCOP-HZPDHXFCSA-N	0	3	317.433	2.252	10	0		DEAEHN
CCN(CC)C(=O)[C@H](C)N1C[C@@H](c2ccsc2)[C@H](CO)C1	ZINC000249581992	402635356	/nfs/dbraw/zinc/63/53/56/402635356.db2.gz	RLWONCAAJOFAEV-QEJZJMRPSA-N	0	3	310.463	2.013	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(CCC(C)C)C1CC1	ZINC000171908311	402633303	/nfs/dbraw/zinc/63/33/03/402633303.db2.gz	PYTWMVNZNOKXLZ-MRXNPFEDSA-N	0	3	311.470	2.317	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cnn(CC(C)C)c1	ZINC000181221705	402638541	/nfs/dbraw/zinc/63/85/41/402638541.db2.gz	VLCXMMUVULAJML-HZPDHXFCSA-N	0	3	304.438	2.238	10	0		DEAEHN
CCN1CCN(C(=O)[C@H](C)N[C@H](C)c2ccc(C)c(F)c2)CC1	ZINC000181347129	402642245	/nfs/dbraw/zinc/64/22/45/402642245.db2.gz	OMLQWGLJYLYHIN-CABCVRRESA-N	0	3	321.440	2.337	10	0		DEAEHN
C[C@H]1OCCC[C@@H]1C(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000191139617	402644723	/nfs/dbraw/zinc/64/47/23/402644723.db2.gz	CPUVRFPMZRENCQ-PBHICJAKSA-N	0	3	320.433	2.058	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@H]2CN1c1ncc(Br)cn1	ZINC000252662405	402660293	/nfs/dbraw/zinc/66/02/93/402660293.db2.gz	YPNJLVNWJJUXOG-PWSUYJOCSA-N	0	3	311.227	2.302	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COc2cc(C)ccc2C)CC[C@H]1C	ZINC000252002645	402652310	/nfs/dbraw/zinc/65/23/10/402652310.db2.gz	WSRRTAPQAGLSRK-SOLBZPMBSA-N	0	3	307.434	2.400	10	0		DEAEHN
COC(=O)CNC(=O)CCN[C@H](C)c1ccc(C(C)(C)C)cc1	ZINC000182609097	402703526	/nfs/dbraw/zinc/70/35/26/402703526.db2.gz	KIXQFDZEQRUORT-CYBMUJFWSA-N	0	3	320.433	2.314	10	0		DEAEHN
c1cc([C@H]2CCCN2CCCN2CCOCC2)cc2c1OCO2	ZINC000173642024	402706375	/nfs/dbraw/zinc/70/63/75/402706375.db2.gz	NRJZCYIHNGULKJ-MRXNPFEDSA-N	0	3	318.417	2.275	10	0		DEAEHN
Cc1c([C@@H](C)NC[C@]2(CCO)CCOC2)cnn1C(C)(C)C	ZINC000191344660	402662768	/nfs/dbraw/zinc/66/27/68/402662768.db2.gz	CBBDVMLUNLYIIY-DYVFJYSZSA-N	0	3	309.454	2.386	10	0		DEAEHN
O=C(Nc1ccc(-c2ncon2)cc1)N1CCN2CCC1CC2	ZINC000191383539	402665747	/nfs/dbraw/zinc/66/57/47/402665747.db2.gz	IRFNAEFEMPMHSG-UHFFFAOYSA-N	0	3	313.361	2.049	10	0		DEAEHN
Cc1cc(N2CC[C@@H](N3CC=CC3)C2)nc(-c2ccncc2)n1	ZINC000172773115	402674916	/nfs/dbraw/zinc/67/49/16/402674916.db2.gz	HYWFUUKURYUNCE-MRXNPFEDSA-N	0	3	307.401	2.298	10	0		DEAEHN
c1ccc(Cc2noc(CN3CCN4CCCC[C@@H]4C3)n2)cc1	ZINC000172803119	402676764	/nfs/dbraw/zinc/67/67/64/402676764.db2.gz	UMLHOXAVFPASDS-MRXNPFEDSA-N	0	3	312.417	2.331	10	0		DEAEHN
O=C([C@@H]1SCCc2ccccc21)N1CCN2CCC[C@@H]2C1	ZINC000173402942	402696032	/nfs/dbraw/zinc/69/60/32/402696032.db2.gz	XWWCJCQHJKKSLF-GDBMZVCRSA-N	0	3	302.443	2.324	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NC[C@@H]2Cc3ccccc32)CCN1C	ZINC000174246180	402733876	/nfs/dbraw/zinc/73/38/76/402733876.db2.gz	OIIFNZYIOPEEDZ-VNQPRFMTSA-N	0	3	301.434	2.450	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NC[C@@H]2Cc3ccccc32)CCN1C	ZINC000174246207	402733974	/nfs/dbraw/zinc/73/39/74/402733974.db2.gz	OIIFNZYIOPEEDZ-KBMXLJTQSA-N	0	3	301.434	2.450	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@H](C)N[C@@H](C)[C@H]2CCCO2)c1	ZINC000183094053	402738090	/nfs/dbraw/zinc/73/80/90/402738090.db2.gz	GDOQQRRRTYCPKU-MQIPJXDCSA-N	0	3	304.390	2.373	10	0		DEAEHN
COCc1csc(NC(=O)N2CCC[C@H]2CN2CCCC2)n1	ZINC000174373244	402738624	/nfs/dbraw/zinc/73/86/24/402738624.db2.gz	HREWHNSNUOWCGE-ZDUSSCGKSA-N	0	3	324.450	2.382	10	0		DEAEHN
COCc1csc(NC(=O)N[C@H](C)CN2CCCCC2)n1	ZINC000174398329	402739584	/nfs/dbraw/zinc/73/95/84/402739584.db2.gz	DYQQMSPZFKMGAW-LLVKDONJSA-N	0	3	312.439	2.285	10	0		DEAEHN
COCc1csc(NC(=O)NCCN2CCCC[C@@H]2C)n1	ZINC000174403504	402739651	/nfs/dbraw/zinc/73/96/51/402739651.db2.gz	LFMPKHQATCCMSF-NSHDSACASA-N	0	3	312.439	2.285	10	0		DEAEHN
C[C@H](NCc1cccc(CN2CCOCC2)c1)c1ccnn1C	ZINC000192694646	402744370	/nfs/dbraw/zinc/74/43/70/402744370.db2.gz	ZKINIDKMDUJKMB-HNNXBMFYSA-N	0	3	314.433	2.103	10	0		DEAEHN
COc1ccccc1[C@H](C)NC(=O)CN[C@H](C)[C@@H]1CCCO1	ZINC000183189630	402745435	/nfs/dbraw/zinc/74/54/35/402745435.db2.gz	XHSYFUJWTXUWHP-GUTXKFCHSA-N	0	3	306.406	2.030	10	0		DEAEHN
COC[C@@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccccc1	ZINC000174625941	402748951	/nfs/dbraw/zinc/74/89/51/402748951.db2.gz	RWWDWHAGMJHUIG-IAGOWNOFSA-N	0	3	315.417	2.030	10	0		DEAEHN
CC(C)CCC[C@H](C)NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000192804495	402751081	/nfs/dbraw/zinc/75/10/81/402751081.db2.gz	DMDZTLXABQCDJI-JKSUJKDBSA-N	0	3	313.486	2.347	10	0		DEAEHN
C[C@@H](Oc1ccccc1Cl)c1nc([C@@H]2CNCCN2C)no1	ZINC000263257052	402751204	/nfs/dbraw/zinc/75/12/04/402751204.db2.gz	QOZIDOCOGHEQOV-PWSUYJOCSA-N	0	3	322.796	2.439	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2Cc3ccccc3S2)n1	ZINC000263269683	402752783	/nfs/dbraw/zinc/75/27/83/402752783.db2.gz	SARWOIBWJNQOAP-YPMHNXCESA-N	0	3	302.403	2.035	10	0		DEAEHN
C[C@H](Cc1cccc(F)c1)c1nc([C@H]2CNCCN2C)no1	ZINC000263283221	402754148	/nfs/dbraw/zinc/75/41/48/402754148.db2.gz	UPNFPPNUTDZQHV-BXUZGUMPSA-N	0	3	304.369	2.131	10	0		DEAEHN
CCCN(C)c1ccc(-c2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263299237	402755887	/nfs/dbraw/zinc/75/58/87/402755887.db2.gz	WWODNMNOTVBRMV-HNNXBMFYSA-N	0	3	315.421	2.159	10	0		DEAEHN
COc1ccccc1N1CC[C@@H](N[C@@H](C)c2ccnn2C)C1	ZINC000192952863	402758242	/nfs/dbraw/zinc/75/82/42/402758242.db2.gz	BVWNHYRVIXVGBL-UONOGXRCSA-N	0	3	300.406	2.358	10	0		DEAEHN
CC(C)N1CCC[C@H](N[C@H](C)c2ccc3c(c2)OCO3)C1=O	ZINC000174986851	402769253	/nfs/dbraw/zinc/76/92/53/402769253.db2.gz	KKKIYKKKQKWWTD-OCCSQVGLSA-N	0	3	304.390	2.465	10	0		DEAEHN
Cc1ccc(OC[C@@H](O)CN2CCC[C@H](c3cc[nH]n3)C2)cc1	ZINC000193847212	402776536	/nfs/dbraw/zinc/77/65/36/402776536.db2.gz	MLACEKLCXCNXDH-HOTGVXAUSA-N	0	3	315.417	2.337	10	0		DEAEHN
CN(C(=O)c1ccc2c(c1O)CCCC2)[C@@H]1CCCN(C)C1	ZINC000182862792	402722806	/nfs/dbraw/zinc/72/28/06/402722806.db2.gz	RQXOWLCQBSTWHM-CQSZACIVSA-N	0	3	302.418	2.437	10	0		DEAEHN
CCc1cnc(CCNC(=O)NCCN2CCCC[C@H]2C)s1	ZINC000173991043	402723080	/nfs/dbraw/zinc/72/30/80/402723080.db2.gz	NAUMNQDUBOVRSA-CYBMUJFWSA-N	0	3	324.494	2.422	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN([C@@H]3CCN(C(C)C)C3=O)C2)n1	ZINC000175252527	402791898	/nfs/dbraw/zinc/79/18/98/402791898.db2.gz	DJTYJQNZLRTCEI-HZPDHXFCSA-N	0	3	316.449	2.133	10	0		DEAEHN
C[C@H]1COCC[C@@H]1C(=O)N(CCN(C)C)Cc1cccc(F)c1	ZINC000194354771	402793537	/nfs/dbraw/zinc/79/35/37/402793537.db2.gz	XRXYUFVWDDFEMB-YOEHRIQHSA-N	0	3	322.424	2.389	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)N3CCN4CCC[C@@H]4C3)cc2)c1	ZINC000195334046	402842403	/nfs/dbraw/zinc/84/24/03/402842403.db2.gz	GPDXHMUNKWLWLR-QGZVFWFLSA-N	0	3	310.401	2.101	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)[C@@H]2CCOC[C@H]2C)o1	ZINC000194690606	402810704	/nfs/dbraw/zinc/81/07/04/402810704.db2.gz	KARMMOCTBZSEOX-CZUORRHYSA-N	0	3	308.422	2.151	10	0		DEAEHN
C[C@H]1COCC[C@@H]1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000194818202	402817118	/nfs/dbraw/zinc/81/71/18/402817118.db2.gz	WCUVZSMNTBZSOF-YOEHRIQHSA-N	0	3	317.433	2.087	10	0		DEAEHN
COC[C@H](NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1)c1ccco1	ZINC000175742628	402828409	/nfs/dbraw/zinc/82/84/09/402828409.db2.gz	AUHWZAKUUYQNSA-IHRRRGAJSA-N	0	3	309.410	2.091	10	0		DEAEHN
CC(C)c1nc(C2(NC(=O)C3CCN(C)CC3)CCCC2)no1	ZINC000175804933	402833979	/nfs/dbraw/zinc/83/39/79/402833979.db2.gz	YBHJAGLHUZZODQ-UHFFFAOYSA-N	0	3	320.437	2.420	10	0		DEAEHN
CC1CCN(CCNC(=O)N[C@@H]2COc3ccccc32)CC1	ZINC000195197554	402836151	/nfs/dbraw/zinc/83/61/51/402836151.db2.gz	WNGHVNRCKVKALF-OAHLLOKOSA-N	0	3	303.406	2.151	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1cccc(OC(F)(F)F)c1	ZINC000175853517	402837769	/nfs/dbraw/zinc/83/77/69/402837769.db2.gz	LRDIZFXCIGVRPE-CYBMUJFWSA-N	0	3	307.312	2.462	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc(OC(F)(F)F)cc1	ZINC000175852177	402838115	/nfs/dbraw/zinc/83/81/15/402838115.db2.gz	PCIZEPBEAOYXAD-ZDUSSCGKSA-N	0	3	307.312	2.462	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCC[C@@H]2CCCCO2)CCN1C	ZINC000184383991	402839338	/nfs/dbraw/zinc/83/93/38/402839338.db2.gz	QVNDIPKXBSKFJS-PMPSAXMXSA-N	0	3	311.470	2.460	10	0		DEAEHN
CC(C)[C@@H](CNC(=O)N1CC[C@@H](N(C)C)C1)c1cccnc1	ZINC000175897830	402840916	/nfs/dbraw/zinc/84/09/16/402840916.db2.gz	MYPWHGKTWLTAAT-HZPDHXFCSA-N	0	3	304.438	2.167	10	0		DEAEHN
Cc1ccc(C(=O)CCC(=O)N2CCN3CCC[C@H]3C2)s1	ZINC000195317805	402841651	/nfs/dbraw/zinc/84/16/51/402841651.db2.gz	OUZGEABMHORCGX-ZDUSSCGKSA-N	0	3	306.431	2.326	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)[C@H](C)N1CCN2CCC[C@@H]2C1	ZINC000175206906	402787950	/nfs/dbraw/zinc/78/79/50/402787950.db2.gz	ZLANQJROUSNXFN-FUHWJXTLSA-N	0	3	315.461	2.122	10	0		DEAEHN
C[C@@H](C(=O)N1CCC[C@@H]1c1cnn(C)c1)N1CCCCCC1	ZINC000176000466	402847256	/nfs/dbraw/zinc/84/72/56/402847256.db2.gz	KHKXUTSPUROVSJ-GOEBONIOSA-N	0	3	304.438	2.348	10	0		DEAEHN
Cc1ccccc1CNC(=O)CN1CCC(c2ccn[nH]2)CC1	ZINC000195505837	402847930	/nfs/dbraw/zinc/84/79/30/402847930.db2.gz	QXXLDQMEXDVDOR-UHFFFAOYSA-N	0	3	312.417	2.214	10	0		DEAEHN
CN(C)C(=O)c1cccc(CN2CCC(c3cc[nH]n3)CC2)c1	ZINC000195507054	402848140	/nfs/dbraw/zinc/84/81/40/402848140.db2.gz	BGIDXZGHYPEZDT-UHFFFAOYSA-N	0	3	312.417	2.491	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N[C@@H](CC(C)C)CN(C)C)cc1	ZINC000278404018	402864233	/nfs/dbraw/zinc/86/42/33/402864233.db2.gz	GGBPSGZGBKITEO-INIZCTEOSA-N	0	3	319.449	2.375	10	0		DEAEHN
CC[C@H]1CN(c2ncnc3ccc(C)cc32)CCN1C[C@H](C)O	ZINC000266369184	402968985	/nfs/dbraw/zinc/96/89/85/402968985.db2.gz	LJRBNSKVMYYSOJ-GJZGRUSLSA-N	0	3	314.433	2.220	10	0		DEAEHN
CC(C)c1nn(C)cc1NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000280823205	403040456	/nfs/dbraw/zinc/04/04/56/403040456.db2.gz	UGSDYQQQHOICNJ-STQMWFEESA-N	0	3	307.442	2.490	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@@H]1NCc1ccc(F)c(Br)c1	ZINC000282043132	403116332	/nfs/dbraw/zinc/11/63/32/403116332.db2.gz	AROPHZCZFDFPOX-PELKAZGASA-N	0	3	315.186	2.345	10	0		DEAEHN
C/C(=C\c1ccccc1)CN1CCN(CCC(=O)N(C)C)CC1	ZINC000271171147	403273071	/nfs/dbraw/zinc/27/30/71/403273071.db2.gz	FGCUTFQPDILLHN-BMRADRMJSA-N	0	3	315.461	2.186	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@H](C)N[C@H]2CCOC[C@@H]2C)c1	ZINC000278046393	403282274	/nfs/dbraw/zinc/28/22/74/403282274.db2.gz	XURUPXNGVSGSIL-MKBNYLNASA-N	0	3	304.390	2.231	10	0		DEAEHN
c1c(CNC[C@@H]2CCCN2Cc2ccccc2)nc2ncccn12	ZINC000298530684	403405974	/nfs/dbraw/zinc/40/59/74/403405974.db2.gz	SCWWASUAOLULDW-SFHVURJKSA-N	0	3	321.428	2.484	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1N(C)C(=O)CN1CCC[C@H](c2nc[nH]n2)C1	ZINC000333096407	403665481	/nfs/dbraw/zinc/66/54/81/403665481.db2.gz	UJNBSUXMJVRNSQ-QLFBSQMISA-N	0	3	319.453	2.021	10	0		DEAEHN
Cc1cc(Cl)cnc1NC(=O)NC[C@@H]1NC(C)(C)O[C@H]1C	ZINC000333280139	403714525	/nfs/dbraw/zinc/71/45/25/403714525.db2.gz	HMCCRXWVIDVTES-ONGXEEELSA-N	0	3	312.801	2.278	10	0		DEAEHN
CC(=O)c1ncc(C(=O)NCCN(C)C2CCCCC2)s1	ZINC000411451219	403861395	/nfs/dbraw/zinc/86/13/95/403861395.db2.gz	ZBMZSVWMNAEWKX-UHFFFAOYSA-N	0	3	309.435	2.340	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCC[C@@H](CC(=O)OC(C)C)C1	ZINC000361807929	403877320	/nfs/dbraw/zinc/87/73/20/403877320.db2.gz	LLZNNJMUKCQLQX-HOTGVXAUSA-N	0	3	324.465	2.441	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)CCN(C[C@@H](O)C(F)(F)F)C1	ZINC000323892143	404097093	/nfs/dbraw/zinc/09/70/93/404097093.db2.gz	GALHLXGFMIILOJ-DZGCQCFKSA-N	0	3	316.367	2.364	10	0		DEAEHN
Cn1nccc1CN1C[C@@H](F)C[C@H]1CNCc1ccsc1	ZINC000328637839	404121999	/nfs/dbraw/zinc/12/19/99/404121999.db2.gz	OWMFOTRBLWQOKB-ZFWWWQNUSA-N	0	3	308.426	2.184	10	0		DEAEHN
C[C@H]1CCN(CC(=O)N2CCC[C@H](C(N)=O)C2)CC12CCC2	ZINC000329157352	404248146	/nfs/dbraw/zinc/24/81/46/404248146.db2.gz	WFSBXTRYFVUDGS-KBPBESRZSA-N	0	3	307.438	2.272	10	0		DEAEHN
c1ncn(Cc2ccccc2CNCc2ccc3c[nH]nc3c2)n1	ZINC000337818205	404259652	/nfs/dbraw/zinc/25/96/52/404259652.db2.gz	PVTDREUOZKRFGD-UHFFFAOYSA-N	0	3	318.384	2.493	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1CCC(c2nccc(C)n2)CC1	ZINC000363855854	404226524	/nfs/dbraw/zinc/22/65/24/404226524.db2.gz	NVWINARMNMXVBW-MRXNPFEDSA-N	0	3	316.449	2.365	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)N1CCC(c2nccc(C)n2)CC1	ZINC000363855850	404226755	/nfs/dbraw/zinc/22/67/55/404226755.db2.gz	NVWINARMNMXVBW-INIZCTEOSA-N	0	3	316.449	2.365	10	0		DEAEHN
Cc1nc([C@H]2CCCN2C(=O)[C@@H](C)N2CCCCCC2)no1	ZINC000329416633	404331382	/nfs/dbraw/zinc/33/13/82/404331382.db2.gz	ZGRDBTCWEVIDKQ-TZMCWYRMSA-N	0	3	306.410	2.306	10	0		DEAEHN
CO[C@@H]1COC[C@H]1n1cc(CN[C@H]2CCCC[C@@H]2C(C)C)nn1	ZINC000329509978	404362077	/nfs/dbraw/zinc/36/20/77/404362077.db2.gz	JVJUSDKWYLQUSO-YYIAUSFCSA-N	0	3	322.453	2.169	10	0		DEAEHN
C[C@H](c1ccccc1)N1CCC(NC(=O)N(C)CCCO)CC1	ZINC000370242509	404380031	/nfs/dbraw/zinc/38/00/31/404380031.db2.gz	SBUZFEAIJSBKDU-OAHLLOKOSA-N	0	3	319.449	2.236	10	0		DEAEHN
CCOC(=O)[C@H]1CN([C@@H](C)c2cccc(F)c2)CC12COC2	ZINC000451140294	404877554	/nfs/dbraw/zinc/87/75/54/404877554.db2.gz	TYTWANYZECUOLW-SWLSCSKDSA-N	0	3	307.365	2.398	10	0		DEAEHN
CCc1noc([C@]2(O)CCN(Cc3ccc4occc4c3)C2)n1	ZINC000377836097	404847272	/nfs/dbraw/zinc/84/72/72/404847272.db2.gz	YVOISFWCLDEXRY-KRWDZBQOSA-N	0	3	313.357	2.472	10	0		DEAEHN
COCCOC[C@@H]1CCN(Cc2ccc(-c3cc[nH]n3)o2)C1	ZINC000435135386	404959468	/nfs/dbraw/zinc/95/94/68/404959468.db2.gz	PBQMCAFEZAPGHZ-CYBMUJFWSA-N	0	3	305.378	2.155	10	0		DEAEHN
C/C(=C/c1ccccc1)CN1CCN(CCC(=O)N(C)C)CC1	ZINC000353970739	404977999	/nfs/dbraw/zinc/97/79/99/404977999.db2.gz	FGCUTFQPDILLHN-ICFOKQHNSA-N	0	3	315.461	2.186	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)c2c(F)cccc2Br)C1	ZINC000389945343	405043367	/nfs/dbraw/zinc/04/33/67/405043367.db2.gz	CSGVRSLHQNFTQB-SECBINFHSA-N	0	3	315.186	2.412	10	0		DEAEHN
CC(C)NC(=O)N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21	ZINC000404162386	405068504	/nfs/dbraw/zinc/06/85/04/405068504.db2.gz	YXMHIVQBHZMZDQ-DLBZAZTESA-N	0	3	317.433	2.080	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@@H](CC)COCC(F)(F)F	ZINC000452745960	405237222	/nfs/dbraw/zinc/23/72/22/405237222.db2.gz	ONWHFAUWROCZHQ-NWDGAFQWSA-N	0	3	310.360	2.335	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCc1csc([C@@H](C)OC)n1	ZINC000438411464	405245999	/nfs/dbraw/zinc/24/59/99/405245999.db2.gz	YRFZMHMISQHANB-YPMHNXCESA-N	0	3	311.451	2.341	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)N(C)[C@@H](C)C1CCN(C)CC1	ZINC000458815345	405604861	/nfs/dbraw/zinc/60/48/61/405604861.db2.gz	HZTSISOONMAYFF-LBPRGKRZSA-N	0	3	322.453	2.417	10	0		DEAEHN
CCN(CCN1CCCCCC1)C(=O)c1cn2cccnc2n1	ZINC000558028412	405640180	/nfs/dbraw/zinc/64/01/80/405640180.db2.gz	GYJUOZRWJBZQEL-UHFFFAOYSA-N	0	3	315.421	2.067	10	0		DEAEHN
NCc1ccc2c(c1)N(C(=O)COCc1ccccc1)CCO2	ZINC000638802562	405677896	/nfs/dbraw/zinc/67/78/96/405677896.db2.gz	SRVFWUFSPOZKHS-UHFFFAOYSA-N	0	3	312.369	2.088	10	0		DEAEHN
CCC(C)(C)CCNC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638867012	405728565	/nfs/dbraw/zinc/72/85/65/405728565.db2.gz	WSEQLTQTEAWIQF-MRXNPFEDSA-N	0	3	305.466	2.388	10	0		DEAEHN
CO[C@@H](C)[C@@H](C)NC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000584086341	405820375	/nfs/dbraw/zinc/82/03/75/405820375.db2.gz	FIEQKSAUIHBIPU-HLLBOEOZSA-N	0	3	319.449	2.374	10	0		DEAEHN
c1c(CNCCCc2ccc3c(c2)OCCO3)nc2ncccn12	ZINC000459440830	405905556	/nfs/dbraw/zinc/90/55/56/405905556.db2.gz	OIZREHZKNSGHEA-UHFFFAOYSA-N	0	3	324.384	2.223	10	0		DEAEHN
c1nc(CN[C@H](C2CCC2)[C@@H]2CCCO2)cc2c1OCCO2	ZINC000639388786	406076359	/nfs/dbraw/zinc/07/63/59/406076359.db2.gz	BGYUWWYWKXNUPE-WMLDXEAASA-N	0	3	304.390	2.290	10	0		DEAEHN
CCCCN(C)CCNCc1c(Br)cnn1C	ZINC000487290131	406221457	/nfs/dbraw/zinc/22/14/57/406221457.db2.gz	BLFVPHUMUBZSFX-UHFFFAOYSA-N	0	3	303.248	2.004	10	0		DEAEHN
c1c[nH]c(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)n1	ZINC000547147354	406390586	/nfs/dbraw/zinc/39/05/86/406390586.db2.gz	XEZCFKDDEUMJOO-ZDUSSCGKSA-N	0	3	310.361	2.234	10	0		DEAEHN
C[C@H](O)CCN(Cc1ccc(C(=O)NC2CC2)cc1)C1CC1	ZINC000570355127	406381263	/nfs/dbraw/zinc/38/12/63/406381263.db2.gz	IXPIDICKIYQGMR-ZDUSSCGKSA-N	0	3	302.418	2.314	10	0		DEAEHN
CC[C@H]1CCCCN1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637869913	406455155	/nfs/dbraw/zinc/45/51/55/406455155.db2.gz	ZWBNTWZGCLPNDC-DLBZAZTESA-N	0	3	303.450	2.237	10	0		DEAEHN
COc1cccc(NC(=O)[C@@H](N)CN(C)Cc2ccccc2)c1	ZINC000637870345	406455527	/nfs/dbraw/zinc/45/55/27/406455527.db2.gz	YUMDMSCOTZYFFC-KRWDZBQOSA-N	0	3	313.401	2.093	10	0		DEAEHN
CC[C@]1(C)CCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)C1	ZINC000638030815	406532725	/nfs/dbraw/zinc/53/27/25/406532725.db2.gz	LPFWPVRPNBUCDK-SJLPKXTDSA-N	0	3	303.450	2.094	10	0		DEAEHN
CC(=O)N1CCN(C[C@@H]2CCN(c3ccccc3)C2)[C@@H](C)C1	ZINC000638094319	406566965	/nfs/dbraw/zinc/56/69/65/406566965.db2.gz	RBVVSGLSMLLGFG-RDJZCZTQSA-N	0	3	301.434	2.066	10	0		DEAEHN
CC(C)C[C@H]1CCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)C1	ZINC000637992952	406513921	/nfs/dbraw/zinc/51/39/21/406513921.db2.gz	WIKGQGAJQYUMEJ-MSOLQXFVSA-N	0	3	317.477	2.340	10	0		DEAEHN
CC[C@H](C)C[C@@H](C)NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638002296	406517831	/nfs/dbraw/zinc/51/78/31/406517831.db2.gz	CRTHHPYPZCKSHL-ZMSDIMECSA-N	0	3	305.466	2.387	10	0		DEAEHN
CC[C@@H]1C[C@H](C)CN1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638006999	406520511	/nfs/dbraw/zinc/52/05/11/406520511.db2.gz	JYQDPKVVNOAYFV-USXIJHARSA-N	0	3	303.450	2.093	10	0		DEAEHN
C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)NC[C@H]1CCCN(C)C1	ZINC000527224758	406600029	/nfs/dbraw/zinc/60/00/29/406600029.db2.gz	AEJTVZNBCPVPBC-IJLUTSLNSA-N	0	3	307.360	2.311	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCCc1nc2ccccc2o1	ZINC000572692429	406718931	/nfs/dbraw/zinc/71/89/31/406718931.db2.gz	GMKPACZMEPQOEZ-CQSZACIVSA-N	0	3	301.390	2.361	10	0		DEAEHN
COC[C@]1(C(=O)Nc2cccc(Br)c2)CCCN1	ZINC000643614769	407017077	/nfs/dbraw/zinc/01/70/77/407017077.db2.gz	KPMVCYBAYQSLPJ-ZDUSSCGKSA-N	0	3	313.195	2.156	10	0		DEAEHN
CCNc1nc(NCc2cncs2)nc(N(CC)CC)n1	ZINC000128880873	196000338	/nfs/dbraw/zinc/00/03/38/196000338.db2.gz	XXJCODASKSXLGB-UHFFFAOYSA-N	0	3	307.427	2.218	10	0		DEAEHN
CN(CC[C@@H]1COCCN1)Cc1csc(Br)c1	ZINC000129417421	196046818	/nfs/dbraw/zinc/04/68/18/196046818.db2.gz	LMSNIAJKXRVNEC-LLVKDONJSA-N	0	3	319.268	2.321	10	0		DEAEHN
Cc1cscc1[C@H](NN)c1c(Cl)cnn1CCN(C)C	ZINC000129555980	196056621	/nfs/dbraw/zinc/05/66/21/196056621.db2.gz	JZKRHARHEYXBFZ-LBPRGKRZSA-N	0	3	313.858	2.021	10	0		DEAEHN
NCc1ccccc1CS(=O)(=O)NCCCCC(F)(F)F	ZINC000130554226	196090890	/nfs/dbraw/zinc/09/08/90/196090890.db2.gz	LKVSNGAWWSKZSV-UHFFFAOYSA-N	0	3	324.368	2.297	10	0		DEAEHN
CCN(C)C(=O)CCN1CC[C@@H](c2cc(OC)cc(OC)c2)C1	ZINC000130647709	196099250	/nfs/dbraw/zinc/09/92/50/196099250.db2.gz	QFRUQJUWBSOQIR-CQSZACIVSA-N	0	3	320.433	2.362	10	0		DEAEHN
CNCc1ccc(CS(=O)(=O)c2ccc(F)cc2F)o1	ZINC000130897338	196120353	/nfs/dbraw/zinc/12/03/53/196120353.db2.gz	FNWRXIQWCJJXHZ-UHFFFAOYSA-N	0	3	301.314	2.251	10	0		DEAEHN
CCN[C@@H](c1ncccc1F)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000131662111	196188664	/nfs/dbraw/zinc/18/86/64/196188664.db2.gz	WDINFXUSUMSTHA-MBNYWOFBSA-N	0	3	314.426	2.475	10	0		DEAEHN
NC1(c2nnc3c(Cl)cc(C(F)(F)F)cn32)CCOCC1	ZINC000131870102	196205830	/nfs/dbraw/zinc/20/58/30/196205830.db2.gz	QRYDZQUIUDRTIG-UHFFFAOYSA-N	0	3	320.702	2.366	10	0		DEAEHN
C[C@@H](C(=O)N1CCC(Cn2cccn2)CC1)N1[C@H](C)CC[C@@H]1C	ZINC000131961327	196214210	/nfs/dbraw/zinc/21/42/10/196214210.db2.gz	NVFPWTRHOYJCFV-XHSDSOJGSA-N	0	3	318.465	2.383	10	0		DEAEHN
CC[C@@H](NC(=O)c1ccccc1OCCN(C)C)[C@H]1CCCO1	ZINC000132342474	196247422	/nfs/dbraw/zinc/24/74/22/196247422.db2.gz	PSCXSALZZHKKQW-NVXWUHKLSA-N	0	3	320.433	2.314	10	0		DEAEHN
C[C@@H]1CNC[C@@H](COCc2cccc(Br)c2)O1	ZINC000132728992	196279107	/nfs/dbraw/zinc/27/91/07/196279107.db2.gz	IWOXMRKXQNWLGK-MFKMUULPSA-N	0	3	300.196	2.343	10	0		DEAEHN
COc1ccc(C2CC(NC[C@H]3CCCS3(=O)=O)C2)cc1	ZINC000133873399	196342335	/nfs/dbraw/zinc/34/23/35/196342335.db2.gz	KPEMIWYUTHVIQP-ZBCRRDGASA-N	0	3	309.431	2.108	10	0		DEAEHN
Cc1cc(CNC[C@@H]2CCCS2(=O)=O)c2ccccc2n1	ZINC000133958430	196349763	/nfs/dbraw/zinc/34/97/63/196349763.db2.gz	LUEOXKJIECROJD-AWEZNQCLSA-N	0	3	304.415	2.210	10	0		DEAEHN
O=C(CCN[C@@H]1CCc2cc(Cl)ccc21)N1CCOCC1	ZINC000135136338	196446674	/nfs/dbraw/zinc/44/66/74/196446674.db2.gz	QUQXHVRTKCXGMH-OAHLLOKOSA-N	0	3	308.809	2.166	10	0		DEAEHN
CC[C@@H]1CC[C@H](C)N1S(=O)(=O)c1ccsc1CNC	ZINC000136750538	196551449	/nfs/dbraw/zinc/55/14/49/196551449.db2.gz	ZEKGADAZYSTZFC-WDEREUQCSA-N	0	3	302.465	2.419	10	0		DEAEHN
CC[C@H](C)CS(=O)(=O)N1CCCC[C@H](N2CCCC2)C1	ZINC000113291155	287552332	/nfs/dbraw/zinc/55/23/32/287552332.db2.gz	WGVOFXCCBUZTKS-GJZGRUSLSA-N	0	3	302.484	2.313	10	0		DEAEHN
CCC(CC)NC(=O)[C@H](C)N1CCC(Cc2nccn2C)CC1	ZINC000105876266	424849224	/nfs/dbraw/zinc/84/92/24/424849224.db2.gz	LYNOYHUVBZCXJA-AWEZNQCLSA-N	0	3	320.481	2.368	10	0		DEAEHN
O[C@@H](CN1CCC[C@H](Cn2cncn2)C1)c1ccc(Cl)cc1	ZINC000105883992	424849699	/nfs/dbraw/zinc/84/96/99/424849699.db2.gz	AFNDGCGAWAQBAO-BBRMVZONSA-N	0	3	320.824	2.377	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Cc2cc(Cl)ccc2OC)C1	ZINC000194641859	424877854	/nfs/dbraw/zinc/87/78/54/424877854.db2.gz	ZMNVEWZKOODROQ-CQSZACIVSA-N	0	3	310.825	2.492	10	0		DEAEHN
Cc1nc(-c2c[nH]c(C(=O)N3CCN4CCC[C@H]4C3)c2)cs1	ZINC000195321640	424882112	/nfs/dbraw/zinc/88/21/12/424882112.db2.gz	MHPHHVQHTNJFFM-ZDUSSCGKSA-N	0	3	316.430	2.367	10	0		DEAEHN
O[C@@]1(CCNCc2cc(Br)ccc2F)CCOC1	ZINC000404223141	424926009	/nfs/dbraw/zinc/92/60/09/424926009.db2.gz	ZSUVOKSUBXDSKU-ZDUSSCGKSA-N	0	3	318.186	2.219	10	0		DEAEHN
CN(C(=O)c1nscc1Br)C1CCN(C)CC1	ZINC000404878051	424929498	/nfs/dbraw/zinc/92/94/98/424929498.db2.gz	XWFBOHIUOKCXRN-UHFFFAOYSA-N	0	3	318.240	2.072	10	0		DEAEHN
CC[C@H](C)n1nc(NC(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1C	ZINC000408113243	424933577	/nfs/dbraw/zinc/93/35/77/424933577.db2.gz	UKMHVDGNEANNAF-QEJZJMRPSA-N	0	3	319.453	2.863	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)Cc1ccccc1N	ZINC000309920464	424893965	/nfs/dbraw/zinc/89/39/65/424893965.db2.gz	VTJUAMFSWXXTLW-OAHLLOKOSA-N	0	3	311.429	2.448	10	0		DEAEHN
CCN1CCN(CCC(=O)N[C@H](C)c2ccc(C)c(F)c2)CC1	ZINC000088352691	267398786	/nfs/dbraw/zinc/39/87/86/267398786.db2.gz	VLHYHQYBQUMCDZ-OAHLLOKOSA-N	0	3	321.440	2.339	10	0		DEAEHN
CN1C[C@H](CNCc2cc(F)ccc2Br)CC1=O	ZINC000657695953	425387735	/nfs/dbraw/zinc/38/77/35/425387735.db2.gz	QWJQIILFORSJSA-VIFPVBQESA-N	0	3	315.186	2.156	10	0		DEAEHN
CNC(=O)[C@@H](NCc1ccc(-n2nc(C)cc2C)cc1)C(C)C	ZINC000183653205	267628700	/nfs/dbraw/zinc/62/87/00/267628700.db2.gz	YHJPFLVREHCCPU-KRWDZBQOSA-N	0	3	314.433	2.349	10	0		DEAEHN
CN(C(=O)[C@@H]1CSc2ccccc21)[C@H](CN)C(F)(F)F	ZINC000662980400	425771171	/nfs/dbraw/zinc/77/11/71/425771171.db2.gz	GXNNBLHPRQDXJU-MWLCHTKSSA-N	0	3	304.337	2.224	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)[C@@H]2CCOC[C@@H]2C)o1	ZINC000194690579	268554885	/nfs/dbraw/zinc/55/48/85/268554885.db2.gz	KARMMOCTBZSEOX-XJKSGUPXSA-N	0	3	308.422	2.151	10	0		DEAEHN
OC[C@@]1(NCc2ccc(-n3cncn3)cc2)CCc2ccccc21	ZINC000370803880	269083608	/nfs/dbraw/zinc/08/36/08/269083608.db2.gz	UTPLNTVBUIIWJU-IBGZPJMESA-N	0	3	320.396	2.191	10	0		DEAEHN
CC[C@H](C)C(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000397645419	269106623	/nfs/dbraw/zinc/10/66/23/269106623.db2.gz	UXIQVFXNRHKLRI-HNNXBMFYSA-N	0	3	304.434	2.176	10	0		DEAEHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)NCCOCC1CCC1	ZINC000515149450	269344953	/nfs/dbraw/zinc/34/49/53/269344953.db2.gz	SBRBUDWQIHANQD-CQSZACIVSA-N	0	3	311.470	2.175	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@H]1Cc2cc(F)ccc2O1	ZINC000076962945	275900423	/nfs/dbraw/zinc/90/04/23/275900423.db2.gz	AVPSVSYPAFWEOL-GOEBONIOSA-N	0	3	308.397	2.222	10	0		DEAEHN
CCC[C@@](C)(CO)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000086369833	276034855	/nfs/dbraw/zinc/03/48/55/276034855.db2.gz	IBGZOEXYOTZTEI-AEFFLSMTSA-N	0	3	321.465	2.010	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCC[C@H]1C[C@@H](C)O	ZINC000305212499	276141924	/nfs/dbraw/zinc/14/19/24/276141924.db2.gz	GLPNAVOSOWUSCO-WBVHZDCISA-N	0	3	304.434	2.270	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)[C@H]2COc3ccc(Cl)cc3C2)C1	ZINC000170858590	276873351	/nfs/dbraw/zinc/87/33/51/276873351.db2.gz	DQJGJVKASWPPOA-OCCSQVGLSA-N	0	3	308.809	2.054	10	0		DEAEHN
COC(=O)c1ccsc1N1CC[C@H](N[C@@H](C)C(C)C)C1=O	ZINC000174054923	277444850	/nfs/dbraw/zinc/44/48/50/277444850.db2.gz	WOJDHWVMZFALAP-JQWIXIFHSA-N	0	3	310.419	2.274	10	0		DEAEHN
CS[C@H](C)CNC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000122973244	278158795	/nfs/dbraw/zinc/15/87/95/278158795.db2.gz	WKTNGXCPWNJRTG-UKRRQHHQSA-N	0	3	309.479	2.210	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CCCO[C@H]1C	ZINC000253353936	278179587	/nfs/dbraw/zinc/17/95/87/278179587.db2.gz	XGKXYEMRBBIDPN-HLLBOEOZSA-N	0	3	304.434	2.438	10	0		DEAEHN
C[C@H]1CN(C(=O)C2(N)CCCC2)C[C@H](c2ccc(F)cc2)O1	ZINC000237719900	278395405	/nfs/dbraw/zinc/39/54/05/278395405.db2.gz	LMZPAWHWNQNEIL-SWLSCSKDSA-N	0	3	306.381	2.386	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCC[C@@H]1c1cnn(C)c1	ZINC000170896330	279123807	/nfs/dbraw/zinc/12/38/07/279123807.db2.gz	ZVTROSOTPRFTIW-HZPDHXFCSA-N	0	3	321.469	2.243	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCSCC[C@@H]1C	ZINC000191119672	279124909	/nfs/dbraw/zinc/12/49/09/279124909.db2.gz	QXEPDAZIGQOGKH-UONOGXRCSA-N	0	3	301.500	2.500	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@@H](Cc1ccccc1)N(C)C	ZINC000112881634	279129607	/nfs/dbraw/zinc/12/96/07/279129607.db2.gz	FUVZWEQIFNOUGK-QZTJIDSGSA-N	0	3	319.493	2.252	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)N1CCc2c(nc(C(C)C)n2C)C1	ZINC000112667194	279277568	/nfs/dbraw/zinc/27/75/68/279277568.db2.gz	RMTIPIRSJJQVJD-INIZCTEOSA-N	0	3	318.465	2.303	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)S(=O)(=O)CC1CCCCC1	ZINC000175393551	279301652	/nfs/dbraw/zinc/30/16/52/279301652.db2.gz	WILZATSXFJPSCL-OAHLLOKOSA-N	0	3	302.484	2.313	10	0		DEAEHN
O=C1[C@@H](N2CCN3CCC[C@@H]3C2)CCN1c1ccccc1Cl	ZINC000171930624	280313840	/nfs/dbraw/zinc/31/38/40/280313840.db2.gz	GBTWDLDCAIEKIH-CJNGLKHVSA-N	0	3	319.836	2.225	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN([C@H](C)C(=O)NCC(C)C)C2)n1	ZINC000249891744	281246090	/nfs/dbraw/zinc/24/60/90/281246090.db2.gz	QPNNKEXYTSZWRO-CVEARBPZSA-N	0	3	318.465	2.285	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc2c(c(Cl)c1)OCO2	ZINC000247081940	288311990	/nfs/dbraw/zinc/31/19/90/288311990.db2.gz	HWVXFQFXFUZTFP-PWSUYJOCSA-N	0	3	322.792	2.377	10	0		DEAEHN
CCC(C)(C)[C@@H]1CCCN1CC(=O)N1CCC[C@@H](NC(C)=O)C1	ZINC000246221353	282035232	/nfs/dbraw/zinc/03/52/32/282035232.db2.gz	DKXGRACBUQOOHA-CVEARBPZSA-N	0	3	323.481	2.014	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)[C@H]1CCCc2n[nH]cc21)c1ccccc1	ZINC000131937769	289188652	/nfs/dbraw/zinc/18/86/52/289188652.db2.gz	XAPYAXPQEQQBBH-WMLDXEAASA-N	0	3	312.417	2.249	10	0		DEAEHN
C[C@H](C(=O)N1C[C@H](C)C[C@@H](C)C1)N1CCCN(C2CC2)CC1	ZINC000172346191	289315588	/nfs/dbraw/zinc/31/55/88/289315588.db2.gz	RLPOOSGROQRZRC-BZUAXINKSA-N	0	3	307.482	2.050	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N[C@H]1CCC(=O)N(C)C1)CCCO2	ZINC000152355505	295272630	/nfs/dbraw/zinc/27/26/30/295272630.db2.gz	FZWKORHESFIAIQ-WFASDCNBSA-N	0	3	304.390	2.119	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N[C@H]1CCc3ncnn3C1)CCCO2	ZINC000180604086	295272873	/nfs/dbraw/zinc/27/28/73/295272873.db2.gz	WRUZMHUAFYMUIX-WFASDCNBSA-N	0	3	314.389	2.105	10	0		DEAEHN
C[C@H](C(=O)N1C[C@@]2(CCOC2)OC(C)(C)C1)N1[C@H](C)CC[C@@H]1C	ZINC000358234725	298100247	/nfs/dbraw/zinc/10/02/47/298100247.db2.gz	JCLJQADGTSZIBN-BASYENTBSA-N	0	3	324.465	2.044	10	0		DEAEHN
Cc1noc(C)c1CCNC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000107389071	302839877	/nfs/dbraw/zinc/83/98/77/302839877.db2.gz	ZRKACKBDCQCMHB-CQSZACIVSA-N	0	3	310.442	2.109	10	0		DEAEHN
CN1CCN(C(=O)c2cccc(CN3CCCC3)c2)CC1(C)C	ZINC000583394841	332384937	/nfs/dbraw/zinc/38/49/37/332384937.db2.gz	TULWXAFLMQYHDG-UHFFFAOYSA-N	0	3	315.461	2.449	10	0		DEAEHN
CCn1cc([C@H]2NC[C@@]23CCN(C(=O)OC(C)(C)C)C3)cn1	ZINC000536957656	337868555	/nfs/dbraw/zinc/86/85/55/337868555.db2.gz	CQDICSAWUQDISA-CZUORRHYSA-N	0	3	306.410	2.175	10	0		DEAEHN
CCN(C(=O)NC[C@@H]1CCCN1CCOC)C1CCCCC1	ZINC000111867794	519963375	/nfs/dbraw/zinc/96/33/75/519963375.db2.gz	RAZLIMYSOFFUOD-INIZCTEOSA-N	0	3	311.470	2.461	10	0		DEAEHN
COc1cc(C)c(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1OC	ZINC000247471491	522189187	/nfs/dbraw/zinc/18/91/87/522189187.db2.gz	VGYGNBJJQPAJKG-HIFRSBDPSA-N	0	3	320.433	2.471	10	0		DEAEHN
CC[C@H](COC)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1	ZINC000157255189	522259908	/nfs/dbraw/zinc/25/99/08/522259908.db2.gz	NNGSWJWKMPDMAG-IIAWOOMASA-N	0	3	307.438	2.210	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(CC(=O)N2CCC[C@H](C)C2)C1	ZINC000105896908	522600300	/nfs/dbraw/zinc/60/03/00/522600300.db2.gz	XOBWFMNUWIAWJA-HOTGVXAUSA-N	0	3	318.465	2.341	10	0		DEAEHN
COCCC1(CNC(=O)c2ccccc2OCCN(C)C)CC1	ZINC000129641268	523059280	/nfs/dbraw/zinc/05/92/80/523059280.db2.gz	AMPSCBWVYRDZKH-UHFFFAOYSA-N	0	3	320.433	2.174	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(C)Cc1ccc(F)cc1	ZINC000111866304	523832910	/nfs/dbraw/zinc/83/29/10/523832910.db2.gz	DKQJULVGZGTLHD-INIZCTEOSA-N	0	3	323.412	2.078	10	0		DEAEHN
CC(=O)c1cc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c(C)nc1C	ZINC000362761131	534804809	/nfs/dbraw/zinc/80/48/09/534804809.db2.gz	VPSXILKFKCHSMN-ABAIWWIYSA-N	0	3	317.433	2.456	10	0		DEAEHN
Cc1ccc(F)c(OCC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000158467774	524827487	/nfs/dbraw/zinc/82/74/87/524827487.db2.gz	ATHJNYNWIDWXBQ-ZIAGYGMSSA-N	0	3	308.397	2.454	10	0		DEAEHN
CSCC[C@H](N)C(=O)NCc1cccc(-c2ccccn2)c1	ZINC000157910290	525581839	/nfs/dbraw/zinc/58/18/39/525581839.db2.gz	DRFYVCBBKRIPOP-HNNXBMFYSA-N	0	3	315.442	2.445	10	0		DEAEHN
Cc1c(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cnn1C(C)(C)C	ZINC000246979873	525649739	/nfs/dbraw/zinc/64/97/39/525649739.db2.gz	GGNMHVRBIQCQPY-DOMZBBRYSA-N	0	3	306.454	2.405	10	0		DEAEHN
CC(=O)N1CC[C@H](CN(C)Cc2ccnn2-c2ccccc2)C1	ZINC000448330054	526662476	/nfs/dbraw/zinc/66/24/76/526662476.db2.gz	BYLJWQWRJXQZPY-MRXNPFEDSA-N	0	3	312.417	2.173	10	0		DEAEHN
CC(C)(C)[C@H]1OCC[C@@H]1CN[C@@H](C(N)=O)c1ccc(F)cc1	ZINC000189233159	526741443	/nfs/dbraw/zinc/74/14/43/526741443.db2.gz	MGYDCVHLOLZELN-YUELXQCFSA-N	0	3	308.397	2.393	10	0		DEAEHN
CC(C)Cn1ccnc1NC(=O)[C@@H]1CN(C)C[C@H]1C(F)(F)F	ZINC000299745970	528733710	/nfs/dbraw/zinc/73/37/10/528733710.db2.gz	UJISWNOPCJFAAX-GHMZBOCLSA-N	0	3	318.343	2.218	10	0		DEAEHN
CC(C)[C@H](NC(=O)CN1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000246710100	535082615	/nfs/dbraw/zinc/08/26/15/535082615.db2.gz	UJYMOIGSMDTESQ-HKUYNNGSSA-N	0	3	315.461	2.280	10	0		DEAEHN
CCCOc1nc(C)ccc1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000191350618	535292358	/nfs/dbraw/zinc/29/23/58/535292358.db2.gz	VMDATBGDUDPMEP-CQSZACIVSA-N	0	3	303.406	2.099	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N(C)CCN(C)C1CC1)C2	ZINC000372385181	535381883	/nfs/dbraw/zinc/38/18/83/535381883.db2.gz	GXKYHHIYLYWPSV-CYBMUJFWSA-N	0	3	318.465	2.191	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)N(C)CCN(C)C1CC1)CC2	ZINC000372385181	535381884	/nfs/dbraw/zinc/38/18/84/535381884.db2.gz	GXKYHHIYLYWPSV-CYBMUJFWSA-N	0	3	318.465	2.191	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N(C)C(=O)N[C@H]2CCCN(CC)C2)C1(C)C	ZINC000247079181	535391546	/nfs/dbraw/zinc/39/15/46/535391546.db2.gz	VIJNQHWPNOSAMW-RRFJBIMHSA-N	0	3	311.470	2.316	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)NCCOc1ccc(C(F)(F)F)cn1	ZINC000262305459	535526930	/nfs/dbraw/zinc/52/69/30/535526930.db2.gz	MDQHVSGRMRGUJB-CYBMUJFWSA-N	0	3	319.327	2.113	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)[C@H]1C[C@H]1c1cccc(OC)c1	ZINC000246285044	535567559	/nfs/dbraw/zinc/56/75/59/535567559.db2.gz	BDIQCMUXCOWRTH-PVAVHDDUSA-N	0	3	302.418	2.399	10	0		DEAEHN
CC[C@@H](C)Oc1cc(C)ccc1CNC(=O)C1(N)CCOCC1	ZINC000261890939	535620901	/nfs/dbraw/zinc/62/09/01/535620901.db2.gz	QLSWNPUFSLWAKK-CQSZACIVSA-N	0	3	320.433	2.296	10	0		DEAEHN
CCOc1ccc(NC(=O)[C@@H](C)N2CCN3CCC[C@H]3C2)cc1	ZINC000246275379	535746600	/nfs/dbraw/zinc/74/66/00/535746600.db2.gz	HKPAFACEAHXCML-ZBFHGGJFSA-N	0	3	317.433	2.192	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(-c3ccco3)on2)C1	ZINC000246538716	536471640	/nfs/dbraw/zinc/47/16/40/536471640.db2.gz	GIZROBYYAVGQCC-GXTWGEPZSA-N	0	3	315.373	2.491	10	0		DEAEHN
COC(=O)c1ccc(F)c(NC(=O)[C@@H]2NCCCC2(C)C)c1	ZINC000262394550	536719101	/nfs/dbraw/zinc/71/91/01/536719101.db2.gz	BQYKORXXGSNFGZ-ZDUSSCGKSA-N	0	3	308.353	2.329	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COc2cccc3[nH]ccc32)CC[C@H]1C	ZINC000251704499	536730093	/nfs/dbraw/zinc/73/00/93/536730093.db2.gz	KDLWMIYWDJLIIU-QWQRMKEZSA-N	0	3	318.417	2.264	10	0		DEAEHN
CCN1CC[C@H]1CNc1ccc(I)cn1	ZINC000712591946	792191678	/nfs/dbraw/zinc/19/16/78/792191678.db2.gz	OIHPYCRFDGXGOO-JTQLQIEISA-N	0	3	317.174	2.192	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)/C=C\c1ccc(F)cc1	ZINC000255069919	623371819	/nfs/dbraw/zinc/37/18/19/623371819.db2.gz	NABSMXJIBMPTNT-BSYHEUMXSA-N	0	3	314.426	2.446	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@H](C)N2CCc3ccccc32)C1	ZINC000250220040	635153570	/nfs/dbraw/zinc/15/35/70/635153570.db2.gz	ZALLULBHQJNPJD-GOEBONIOSA-N	0	3	301.434	2.038	10	0		DEAEHN
COc1ccccc1-c1cc(CNc2cc(CN)ncn2)on1	ZINC000067472683	637777203	/nfs/dbraw/zinc/77/72/03/637777203.db2.gz	MBQITBYHSCGVTG-UHFFFAOYSA-N	0	3	311.345	2.211	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N2CCC23CCN(C)CC3)c1C	ZINC000742187971	638042212	/nfs/dbraw/zinc/04/22/12/638042212.db2.gz	WJRLTRHMIXBAPO-UHFFFAOYSA-N	0	3	303.406	2.144	10	0		DEAEHN
Cc1ccc2c(c1)CC[C@H]2N[C@H]1CCN(C2CCOCC2)C1=O	ZINC000747816180	638480381	/nfs/dbraw/zinc/48/03/81/638480381.db2.gz	UUUPRFDYBYHUNF-MSOLQXFVSA-N	0	3	314.429	2.352	10	0		DEAEHN
COC(=O)/C(C)=C/CN(CCO)[C@H]1CCCc2ccccc21	ZINC000748815601	638594731	/nfs/dbraw/zinc/59/47/31/638594731.db2.gz	CBHRQVOVPIZUPP-SHRNQRGKSA-N	0	3	303.402	2.478	10	0		DEAEHN
CCN(C[C@H]1CCN(C/C=C(\C)C(=O)OC)C1)CC(F)(F)F	ZINC000748825830	638596327	/nfs/dbraw/zinc/59/63/27/638596327.db2.gz	ZHAFJWWACVXBKR-YQJFHSMKSA-N	0	3	322.371	2.312	10	0		DEAEHN
COCC(COC)OC(=O)c1cccc(CN2CCCC2)c1	ZINC000805895919	643746516	/nfs/dbraw/zinc/74/65/16/643746516.db2.gz	GYDMIYKTURMDEE-UHFFFAOYSA-N	0	3	307.390	2.101	10	0		DEAEHN
C=CCNC(=S)NCC(C)(C)N1CCc2ccccc2C1	ZINC000045711407	646522133	/nfs/dbraw/zinc/52/21/33/646522133.db2.gz	WTFAODNANSUIDM-UHFFFAOYSA-N	0	3	303.475	2.473	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)c2cc(C)cc(C)c2)C[C@@H]1C	ZINC000174782554	647346218	/nfs/dbraw/zinc/34/62/18/647346218.db2.gz	JBWJHKXRIXCOSJ-HKUYNNGSSA-N	0	3	320.477	2.379	10	0		DEAEHN
CC(C)=CC(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000112256158	651485167	/nfs/dbraw/zinc/48/51/67/651485167.db2.gz	WLXGAXRCKDLDGX-UHFFFAOYSA-N	0	3	315.417	2.417	10	0		DEAEHN
O=[N+]([O-])c1cccc(N2CCN([C@H]3CCCC[C@@H]3O)CC2)c1	ZINC000089885921	684027518	/nfs/dbraw/zinc/02/75/18/684027518.db2.gz	GWGZXOGMHFRPHM-HOTGVXAUSA-N	0	3	305.378	2.020	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(COC)cc1	ZINC000192566475	684453249	/nfs/dbraw/zinc/45/32/49/684453249.db2.gz	JBDBHOHEGWYXGE-MRXNPFEDSA-N	0	3	321.421	2.065	10	0		DEAEHN
CN1CC[C@H](NC(=O)C[C@@H]2CCCOC2)[C@H]1c1ccccc1	ZINC000249093205	685174321	/nfs/dbraw/zinc/17/43/21/685174321.db2.gz	LAJXNPDEQRCPGU-QILLFSRXSA-N	0	3	302.418	2.365	10	0		DEAEHN
Cc1nocc1CN1CC[C@@H](Oc2ccnc(CN(C)C)c2)C1	ZINC000886029121	691987188	/nfs/dbraw/zinc/98/71/88/691987188.db2.gz	QVJINKIKGRYHMO-QGZVFWFLSA-N	0	3	316.405	2.093	10	0		DEAEHN
CC[C@@H](N[C@H]1C[C@@H](O)[C@@H]1n1cccn1)c1ccc2c(c1)CCO2	ZINC000886096765	692002625	/nfs/dbraw/zinc/00/26/25/692002625.db2.gz	DUYXGKRYJRPROD-KYHPRHEASA-N	0	3	313.401	2.233	10	0		DEAEHN
C[C@](O)(CN1CCC[C@H](CCO)C1)C(F)(F)C(F)(F)F	ZINC000724041732	777228390	/nfs/dbraw/zinc/22/83/90/777228390.db2.gz	OLHCRSFGKOMWMR-ZJUUUORDSA-N	0	3	305.287	2.029	10	0		DEAEHN
C[C@H]1CC(CNCc2nc(Br)c[nH]2)C[C@H](C)O1	ZINC000724286390	777271692	/nfs/dbraw/zinc/27/16/92/777271692.db2.gz	DPYLHVRHDONAFA-IUCAKERBSA-N	0	3	302.216	2.465	10	0		DEAEHN
COC[C@@H](CNCc1cn(C)nc1Br)C(C)C	ZINC000721813831	779291974	/nfs/dbraw/zinc/29/19/74/779291974.db2.gz	LRCYGNFAOAOEHK-LLVKDONJSA-N	0	3	304.232	2.191	10	0		DEAEHN
C[C@@H]1C[C@H](CNCc2cn(C)nc2Br)[C@H](C)O1	ZINC000712499157	792190074	/nfs/dbraw/zinc/19/00/74/792190074.db2.gz	WHJFOYFZWHMAAX-KXUCPTDWSA-N	0	3	302.216	2.086	10	0		DEAEHN
COc1ccc(CNCC[C@H]2CCCS2(=O)=O)cc1Cl	ZINC000714367805	792311593	/nfs/dbraw/zinc/31/15/93/792311593.db2.gz	VSJTXGPEMFPXRS-GFCCVEGCSA-N	0	3	317.838	2.406	10	0		DEAEHN
C[C@@H]1C[C@H](NCc2ccnn2C)CN(C(=O)OC(C)(C)C)C1	ZINC000401709107	801845149	/nfs/dbraw/zinc/84/51/49/801845149.db2.gz	CTOYHHFNIHVQOO-OLZOCXBDSA-N	0	3	308.426	2.155	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@H]1C[C@@H](NCc2cncnc2)C12CCC2	ZINC000404634131	802025993	/nfs/dbraw/zinc/02/59/93/802025993.db2.gz	HKHSFWOURHNZKR-KGLIPLIRSA-N	0	3	318.421	2.402	10	0		DEAEHN
c1ccc2c(c1)OC[C@@H](CNCc1cccc3c1OCCO3)O2	ZINC000047495942	1078395463	/nfs/dbraw/zinc/39/54/63/1078395463.db2.gz	FXKLDODXNBAVGL-CQSZACIVSA-N	0	3	313.353	2.387	10	0		DEAEHN
Cc1csc(C)c1S(=O)(=O)N1CCNCCC1(C)C	ZINC000725073889	1078801362	/nfs/dbraw/zinc/80/13/62/1078801362.db2.gz	VXKYOZILZAFHBN-UHFFFAOYSA-N	0	3	302.465	2.128	10	0		DEAEHN
c1ccc(COCCNCc2cnc(N3CCCC3)nc2)cc1	ZINC000080244455	1080958478	/nfs/dbraw/zinc/95/84/78/1080958478.db2.gz	GSJAXIDBSLMOOS-UHFFFAOYSA-N	0	3	312.417	2.383	10	0		DEAEHN
CN(C)C[C@H](N)C(=O)Nc1ccccc1OCc1ccccc1	ZINC000702331168	1086424472	/nfs/dbraw/zinc/42/44/72/1086424472.db2.gz	XVOJKOAGMKBTER-HNNXBMFYSA-N	0	3	313.401	2.093	10	0		DEAEHN
COC[C@H](C)OC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000704448188	1086580207	/nfs/dbraw/zinc/58/02/07/1086580207.db2.gz	BVYKLBDYINBCJF-GOEBONIOSA-N	0	3	306.406	2.412	10	0		DEAEHN
CC[C@@H]1[C@@H](NCc2ccnn2C)CCN1C(=O)OC(C)(C)C	ZINC000704625327	1086586040	/nfs/dbraw/zinc/58/60/40/1086586040.db2.gz	XXESBBFSZNAWDK-UONOGXRCSA-N	0	3	308.426	2.298	10	0		DEAEHN
Brc1cc(CN[C@]23C[C@H]2COC3)cc2c1OCO2	ZINC000718064436	1087782546	/nfs/dbraw/zinc/78/25/46/1087782546.db2.gz	VNJHUPFPFDGJAB-ZANVPECISA-N	0	3	312.163	2.056	10	0		DEAEHN
Cc1noc([C@H]2CN(C[C@@H]3CCc4ccccc43)CCN2C)n1	ZINC000606442337	1088602337	/nfs/dbraw/zinc/60/23/37/1088602337.db2.gz	FSBTUSQUQVSORH-DOTOQJQBSA-N	0	3	312.417	2.397	10	0		DEAEHN
CCc1nn(C)cc1CN[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C	ZINC000700752566	1090731063	/nfs/dbraw/zinc/73/10/63/1090731063.db2.gz	SLIVSKUYMZZTOJ-SWLSCSKDSA-N	0	3	322.453	2.470	10	0		DEAEHN
CN(C)CCNC(=O)N[C@@H]1CCCOc2c(Cl)cccc21	ZINC000181078224	282104722	/nfs/dbraw/zinc/10/47/22/282104722.db2.gz	VJGBDYNHOKDICU-CYBMUJFWSA-N	0	3	311.813	2.415	10	0		DEAEHN
CCN[C@@H](CSCC(=O)OC)c1ccc(OC)cc1OC	ZINC000081793161	192323903	/nfs/dbraw/zinc/32/39/03/192323903.db2.gz	NGUJIGMVECKJFE-ZDUSSCGKSA-N	0	3	313.419	2.261	10	0		DEAEHN
CCOC(=O)CSC[C@H](NC)c1cc(OC)ccc1OC	ZINC000081795633	192324070	/nfs/dbraw/zinc/32/40/70/192324070.db2.gz	AOQCCSFAHXLAFG-ZDUSSCGKSA-N	0	3	313.419	2.261	10	0		DEAEHN
O=C1CCCC1S(=O)(=O)c1ccccc1Br	ZINC000081907568	192337742	/nfs/dbraw/zinc/33/77/42/192337742.db2.gz	NZOMYKZZAHAZDF-LLVKDONJSA-N	0	3	303.177	2.344	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@@H]1S(=O)(=O)c1ccccc1Cl	ZINC000081920549	192338896	/nfs/dbraw/zinc/33/88/96/192338896.db2.gz	DVSQGTKQZVIJDW-OCCSQVGLSA-N	0	3	317.838	2.271	10	0		DEAEHN
CCN(CC)CCN[C@@](C)(C(N)=O)c1ccc(F)cc1Cl	ZINC000078900701	185125127	/nfs/dbraw/zinc/12/51/27/185125127.db2.gz	KTVMZWZFOFJGIJ-OAHLLOKOSA-N	0	3	315.820	2.111	10	0		DEAEHN
CCCN[C@@H](C)[C@@H](C)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000081935171	192343375	/nfs/dbraw/zinc/34/33/75/192343375.db2.gz	UUXGNSZTZYKAKC-NWDGAFQWSA-N	0	3	313.419	2.008	10	0		DEAEHN
N[C@@H](c1cc(Cl)sc1Cl)[C@H]1CCS(=O)(=O)C1	ZINC000082998654	185210795	/nfs/dbraw/zinc/21/07/95/185210795.db2.gz	SGUFCVBSFXMDCE-YLWLKBPMSA-N	0	3	300.232	2.489	10	0		DEAEHN
O=c1[nH]ccnc1N1CCC[C@H](NCc2cccc3[nH]ccc32)C1	ZINC000328632208	231268745	/nfs/dbraw/zinc/26/87/45/231268745.db2.gz	LDQFLVPQELQYKF-AWEZNQCLSA-N	0	3	323.400	2.422	10	0		DEAEHN
CC(C)[C@H](N)CS(=O)(=O)c1ccccc1Br	ZINC000087539923	185228160	/nfs/dbraw/zinc/22/81/60/185228160.db2.gz	PFKVKHMCPQFQPF-SNVBAGLBSA-N	0	3	306.225	2.206	10	0		DEAEHN
NN=c1nccc(NCc2ccc(Br)s2)[nH]1	ZINC000087880150	185234350	/nfs/dbraw/zinc/23/43/50/185234350.db2.gz	ZSYACJQXJHZNQH-UHFFFAOYSA-N	0	3	300.185	2.198	10	0		DEAEHN
Cc1ccnc(Cl)c1NC(=O)[C@@H](N)Cc1ccc(O)cc1	ZINC000088189074	185241189	/nfs/dbraw/zinc/24/11/89/185241189.db2.gz	GNJKYPILQVTUQA-LBPRGKRZSA-N	0	3	305.765	2.258	10	0		DEAEHN
N[C@H]1CCN(c2c3nsnc3c(Cl)cc2Cl)C1=O	ZINC000088120632	185240034	/nfs/dbraw/zinc/24/00/34/185240034.db2.gz	SGEYOVNGTSOUIE-LURJTMIESA-N	0	3	303.174	2.062	10	0		DEAEHN
CC[C@@H](CN)S(=O)(=O)Nc1ccc(F)c(C(F)(F)F)c1	ZINC000088472913	185252431	/nfs/dbraw/zinc/25/24/31/185252431.db2.gz	HZFNVMMCUBUORN-QMMMGPOBSA-N	0	3	314.304	2.324	10	0		DEAEHN
Cc1ccc(CN)cc1S(=O)(=O)N(C)CCC(F)(F)F	ZINC000088419128	185249430	/nfs/dbraw/zinc/24/94/30/185249430.db2.gz	VYXLDRLPTNEOET-UHFFFAOYSA-N	0	3	310.341	2.027	10	0		DEAEHN
CC[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(S(=O)(=O)[N-]C)o2)C1	ZINC000088540923	185255631	/nfs/dbraw/zinc/25/56/31/185255631.db2.gz	PCAUOBYMZWBHIR-VXGBXAGGSA-N	0	3	300.424	2.246	10	0		DEAEHN
CCOC(=O)[C@@H]1CNCCN1[C@@H]1CCSc2ccccc21	ZINC000088658292	185261875	/nfs/dbraw/zinc/26/18/75/185261875.db2.gz	OCTVGCYMEIEBNV-KGLIPLIRSA-N	0	3	306.431	2.060	10	0		DEAEHN
CCC(C)(C)[C@H]1CC[C@H](N)[C@H](S(=O)(=O)CCCOC)C1	ZINC000081986381	192349762	/nfs/dbraw/zinc/34/97/62/192349762.db2.gz	LRHZHTUOBBUMSL-MELADBBJSA-N	0	3	305.484	2.370	10	0		DEAEHN
CC[C@@H](CS(=O)(=O)c1cccc(Br)c1)NC	ZINC000081982829	192350023	/nfs/dbraw/zinc/35/00/23/192350023.db2.gz	ULRBSCYOCUICFV-JTQLQIEISA-N	0	3	306.225	2.221	10	0		DEAEHN
N[C@@H](C[S@@](=O)c1ccccc1)c1ccc2c(c1)OCCO2	ZINC000082001209	192353243	/nfs/dbraw/zinc/35/32/43/192353243.db2.gz	KHSQXXOSPLWHSI-QKKBWIMNSA-N	0	3	303.383	2.265	10	0		DEAEHN
CN1CCO[C@H](CN)[C@@H]1c1cc(Cl)ccc1Br	ZINC000090250734	185288153	/nfs/dbraw/zinc/28/81/53/185288153.db2.gz	XSZMFIAPVHMZBN-NEPJUHHUSA-N	0	3	319.630	2.433	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1ccc2ccccc2c1	ZINC000090293218	185289811	/nfs/dbraw/zinc/28/98/11/185289811.db2.gz	RTSSNHVWWWZYSV-UHFFFAOYSA-N	0	3	304.415	2.212	10	0		DEAEHN
N[C@H]1COC[C@H]1C(=O)Nc1ccc(Br)cc1Cl	ZINC000090379212	185293706	/nfs/dbraw/zinc/29/37/06/185293706.db2.gz	IKFPSKSMKGYSNV-APPZFPTMSA-N	0	3	319.586	2.015	10	0		DEAEHN
N[C@H]1COC[C@@H]1C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000090379193	185293762	/nfs/dbraw/zinc/29/37/62/185293762.db2.gz	ZRDGCLNFWHXERL-XVKPBYJWSA-N	0	3	308.687	2.271	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)N(Cc1ccc(Cl)cc1)C1CC1	ZINC000090434944	185296062	/nfs/dbraw/zinc/29/60/62/185296062.db2.gz	BCLISUWPEZZWAG-CABCVRRESA-N	0	3	308.809	2.065	10	0		DEAEHN
C[C@@]1(C(=O)Nc2ccc(SC(F)F)cc2)COC[C@H]1N	ZINC000090585433	185305108	/nfs/dbraw/zinc/30/51/08/185305108.db2.gz	IXXBDEMFALRKIZ-ZWNOBZJWSA-N	0	3	302.346	2.304	10	0		DEAEHN
C[C@]1(C(=O)Nc2cccc(-c3nccs3)c2)COC[C@@H]1N	ZINC000090589982	185305492	/nfs/dbraw/zinc/30/54/92/185305492.db2.gz	GNVZRIPFQMFDHV-WFASDCNBSA-N	0	3	303.387	2.112	10	0		DEAEHN
C[C@]1(C(=O)Nc2ccc(Cl)c3ncccc23)COC[C@H]1N	ZINC000090588954	185305584	/nfs/dbraw/zinc/30/55/84/185305584.db2.gz	FMFDPSNHDSRVHH-DOMZBBRYSA-N	0	3	305.765	2.191	10	0		DEAEHN
CCN1C(=O)CCC[C@@H](N)[C@@H]1c1cncc(Br)c1	ZINC000166715599	197697914	/nfs/dbraw/zinc/69/79/14/197697914.db2.gz	LOLNFSQQOIMVKC-YPMHNXCESA-N	0	3	312.211	2.245	10	0		DEAEHN
C[C@]1(c2nc(Cc3ccc(F)cc3Cl)no2)COC[C@@H]1N	ZINC000090573787	185304323	/nfs/dbraw/zinc/30/43/23/185304323.db2.gz	MQGCAMZQXGNLPF-FZMZJTMJSA-N	0	3	311.744	2.068	10	0		DEAEHN
C[C@]1(c2nc(Cc3c(F)cccc3Cl)no2)COC[C@@H]1N	ZINC000090573782	185304445	/nfs/dbraw/zinc/30/44/45/185304445.db2.gz	YVBGWNFJFVYUKN-FZMZJTMJSA-N	0	3	311.744	2.068	10	0		DEAEHN
CN(C)C[C@@H]1CSCCCN1C(=O)c1ccc(F)cc1F	ZINC000090700056	185310584	/nfs/dbraw/zinc/31/05/84/185310584.db2.gz	JQNDKQMYLLEORQ-GFCCVEGCSA-N	0	3	314.401	2.474	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](NC1CCS(=O)(=O)CC1)CCC2	ZINC000092383593	185315222	/nfs/dbraw/zinc/31/52/22/185315222.db2.gz	RMWJWCOPDSOBKF-INIZCTEOSA-N	0	3	309.431	2.239	10	0		DEAEHN
CCN1CCN(c2cccc(NC(=O)[C@H]3CC[C@H](C)O3)c2)CC1	ZINC000184258644	282249916	/nfs/dbraw/zinc/24/99/16/282249916.db2.gz	IOISASWDBOEKRO-WMLDXEAASA-N	0	3	317.433	2.335	10	0		DEAEHN
CN(C[C@H]1CCCN1C)C(=O)c1ccc2nc(N)sc2c1	ZINC000092628651	185330546	/nfs/dbraw/zinc/33/05/46/185330546.db2.gz	RCJGAFKDVPCCMU-LLVKDONJSA-N	0	3	304.419	2.045	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2cnc3ccccn23)C12CCOCC2	ZINC000185663377	282264158	/nfs/dbraw/zinc/26/41/58/282264158.db2.gz	NKCGHIYWHBMHIR-HZPDHXFCSA-N	0	3	315.417	2.398	10	0		DEAEHN
Cc1cc(C)c(S(=O)(=O)NC2C(C)(C)C2(C)C)cc1CN	ZINC000092833239	185344929	/nfs/dbraw/zinc/34/49/29/185344929.db2.gz	RNTMGKDMJVPGJT-UHFFFAOYSA-N	0	3	310.463	2.475	10	0		DEAEHN
CCOc1oc(C(=O)N2CC[C@@H](N3CCCCC3)C2)nc1C	ZINC000330258092	231761570	/nfs/dbraw/zinc/76/15/70/231761570.db2.gz	MDVAYPODJVGPNU-CYBMUJFWSA-N	0	3	307.394	2.082	10	0		DEAEHN
CCN(CC(=O)OC(C)(C)C)C1CCN(CCSC)CC1	ZINC000190351762	282318811	/nfs/dbraw/zinc/31/88/11/282318811.db2.gz	JUHIPKCRBDVMDL-UHFFFAOYSA-N	0	3	316.511	2.477	10	0		DEAEHN
CN(C[C@H]1CC=CCC1)C(=O)NCCN1CCN(C)C(C)(C)C1	ZINC000440996742	529962624	/nfs/dbraw/zinc/96/26/24/529962624.db2.gz	ZJYZGNRUSRZMET-INIZCTEOSA-N	0	3	322.497	2.010	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccc(Br)cc1F	ZINC000194721502	530063685	/nfs/dbraw/zinc/06/36/85/530063685.db2.gz	YCRREYDLEOBWJZ-JTQLQIEISA-N	0	3	315.186	2.412	10	0		DEAEHN
CCOc1ccc([C@H](C)NC(=O)C[C@H]2CSCCN2)cc1	ZINC000091135313	539418167	/nfs/dbraw/zinc/41/81/67/539418167.db2.gz	BMTXKTMHANMIGM-JSGCOSHPSA-N	0	3	308.447	2.358	10	0		DEAEHN
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)COC1(C)CNC1	ZINC000098060428	539435885	/nfs/dbraw/zinc/43/58/85/539435885.db2.gz	NLTGRTKSYUPYTA-UHFFFAOYSA-N	0	3	317.216	2.330	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(C(C)C)nn1C	ZINC000245407906	282385596	/nfs/dbraw/zinc/38/55/96/282385596.db2.gz	DNFBFPVLJQOERT-KGLIPLIRSA-N	0	3	304.438	2.242	10	0		DEAEHN
CO[C@]1(C)C[C@H](NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)C1(C)C	ZINC000245481909	282391238	/nfs/dbraw/zinc/39/12/38/282391238.db2.gz	CVJNBOFXBANWPT-QDEZUTFSSA-N	0	3	311.470	2.314	10	0		DEAEHN
OCC[C@]1(CN[C@@H]2CCCOc3ccc(F)cc32)CCOC1	ZINC000125524147	539473449	/nfs/dbraw/zinc/47/34/49/539473449.db2.gz	TUJMKSAPJIGWNC-NVXWUHKLSA-N	0	3	309.381	2.418	10	0		DEAEHN
O=S(=O)(C1CCCCC1)N1CCCC[C@H]1CNC1CC1	ZINC000111720890	185631591	/nfs/dbraw/zinc/63/15/91/185631591.db2.gz	CLIJBELBKOLVEJ-AWEZNQCLSA-N	0	3	300.468	2.255	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)NC[C@H]1CCCN1CC	ZINC000159000547	539580092	/nfs/dbraw/zinc/58/00/92/539580092.db2.gz	LARCDFBIHITYKT-CYBMUJFWSA-N	0	3	310.467	2.201	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)c2coc(Br)c2)CN1C1CC1	ZINC000177185281	539629405	/nfs/dbraw/zinc/62/94/05/539629405.db2.gz	PYCPSSTWRRXZDF-WCBMZHEXSA-N	0	3	313.195	2.397	10	0		DEAEHN
CC(C)OC1CCC(NC(=O)N2CCN3CCC[C@@H]3C2)CC1	ZINC000179136716	539638856	/nfs/dbraw/zinc/63/88/56/539638856.db2.gz	HKEHFHVSGLIKNG-HWOWSKLDSA-N	0	3	309.454	2.212	10	0		DEAEHN
CN(CCNC1(C(N)=O)CCCCC1)Cc1ccc(F)cc1	ZINC000181768632	539653313	/nfs/dbraw/zinc/65/33/13/539653313.db2.gz	DLTFQMILATWCAR-UHFFFAOYSA-N	0	3	307.413	2.035	10	0		DEAEHN
C[C@@H](NCC(=O)NCCc1ccc(Cl)cc1)[C@H]1CCCO1	ZINC000183086007	539659854	/nfs/dbraw/zinc/65/98/54/539659854.db2.gz	BZRYMLYOFFBXPX-IUODEOHRSA-N	0	3	310.825	2.156	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)[C@H](C)N[C@H](C)[C@H]2CCCO2)cc1	ZINC000183224041	539660133	/nfs/dbraw/zinc/66/01/33/539660133.db2.gz	BHWHWLNAAIVXTN-BFQNTYOBSA-N	0	3	304.390	2.373	10	0		DEAEHN
CN1C[C@H](NCc2ccc(OC(F)(F)F)cc2)CCC1=O	ZINC000084062146	192398880	/nfs/dbraw/zinc/39/88/80/192398880.db2.gz	UXQTWIOUNVBKSF-LLVKDONJSA-N	0	3	302.296	2.296	10	0		DEAEHN
CCC[C@@H](C)N(C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138530291	186017728	/nfs/dbraw/zinc/01/77/28/186017728.db2.gz	HNNXRCDZNFLUTM-SECBINFHSA-N	0	3	306.378	2.233	10	0		DEAEHN
CCOc1cc2c(cc1CN1CCC[C@](O)(CO)CC1)CCC2	ZINC000072143651	191048882	/nfs/dbraw/zinc/04/88/82/191048882.db2.gz	BGQSIIXACYEPNN-LJQANCHMSA-N	0	3	319.445	2.283	10	0		DEAEHN
CC[C@@H]1CC[C@@H](C)N1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000139278014	186020889	/nfs/dbraw/zinc/02/08/89/186020889.db2.gz	LQEOBSLNRPHZJV-MWLCHTKSSA-N	0	3	318.389	2.375	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N2CC=C(C)CC2)c1	ZINC000139352416	186021519	/nfs/dbraw/zinc/02/15/19/186021519.db2.gz	AFLFSQJYXOVRSC-UHFFFAOYSA-N	0	3	316.373	2.025	10	0		DEAEHN
C[C@H](NC(=O)NC[C@@H]1CCCN1C)c1nc2ccccc2[nH]1	ZINC000139812193	186024032	/nfs/dbraw/zinc/02/40/32/186024032.db2.gz	KTZZONGPCUHEMS-RYUDHWBXSA-N	0	3	301.394	2.017	10	0		DEAEHN
CN(C)CCn1ncc(Cl)c1[C@@H](O)c1ccncc1Cl	ZINC000140156565	186025492	/nfs/dbraw/zinc/02/54/92/186025492.db2.gz	QECKNZXJFFRBJA-ZDUSSCGKSA-N	0	3	315.204	2.228	10	0		DEAEHN
CC(C)n1ncnc1C[C@@H](N)c1ncccc1Br	ZINC000140341765	186026426	/nfs/dbraw/zinc/02/64/26/186026426.db2.gz	UUAAKTIQDNJQRB-SNVBAGLBSA-N	0	3	310.199	2.259	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)Nc2cnn(CC3CC3)c2)C1	ZINC000246601482	539765481	/nfs/dbraw/zinc/76/54/81/539765481.db2.gz	ZNCXPJNEUHEROA-SWLSCSKDSA-N	0	3	305.426	2.143	10	0		DEAEHN
CCC(C)(C)N(C)[C@]1(CN)CCS(=O)(=O)c2ccccc21	ZINC000147657828	186040844	/nfs/dbraw/zinc/04/08/44/186040844.db2.gz	ROQSZTAPEQRHDY-INIZCTEOSA-N	0	3	310.463	2.138	10	0		DEAEHN
CN1CCCC[C@@H]1CN1C(=O)C2(CC2)N[C@H]1c1ccsc1	ZINC000144333803	186035053	/nfs/dbraw/zinc/03/50/53/186035053.db2.gz	VJFRSMUXSIAUEI-ZIAGYGMSSA-N	0	3	305.447	2.195	10	0		DEAEHN
CC(C)NCc1cc(S(=O)(=O)N(C)C2CCC2)ccc1F	ZINC000144664741	186035851	/nfs/dbraw/zinc/03/58/51/186035851.db2.gz	WGIYZGZIJLZZID-UHFFFAOYSA-N	0	3	314.426	2.497	10	0		DEAEHN
C[C@@H]1OCC[C@H]1NCc1cccc(NC(=O)C(F)(F)F)c1	ZINC000149414321	186049557	/nfs/dbraw/zinc/04/95/57/186049557.db2.gz	XXQWZROUCWRFKP-JOYOIKCWSA-N	0	3	302.296	2.454	10	0		DEAEHN
CC[C@@H]1CCCCCN1CC(=O)NC(=O)NCc1ccco1	ZINC000150745068	186062599	/nfs/dbraw/zinc/06/25/99/186062599.db2.gz	LFVCMXMWKHQLMJ-CYBMUJFWSA-N	0	3	307.394	2.260	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1cc(C)ccc1Br	ZINC000163973972	186144297	/nfs/dbraw/zinc/14/42/97/186144297.db2.gz	ZLXGPSPSZSANEH-NSHDSACASA-N	0	3	315.211	2.450	10	0		DEAEHN
Cc1ccc([C@H](CN)N2CCO[C@H](C)C2)c(Br)c1	ZINC000164056607	186146809	/nfs/dbraw/zinc/14/68/09/186146809.db2.gz	XXGXIONLRKKWJR-RISCZKNCSA-N	0	3	313.239	2.478	10	0		DEAEHN
Cn1ncc(Br)c1C(=O)[C@H]1CNCc2ccccc21	ZINC000164288882	186154988	/nfs/dbraw/zinc/15/49/88/186154988.db2.gz	IZMBONLLTMFMLG-NSHDSACASA-N	0	3	320.190	2.252	10	0		DEAEHN
C[C@H](C[S@](C)=O)NCc1ccc(Br)c(F)c1	ZINC000164321829	186155942	/nfs/dbraw/zinc/15/59/42/186155942.db2.gz	RLCZBHHEYUVWKA-VPTHRUTESA-N	0	3	308.216	2.445	10	0		DEAEHN
C[C@H](NC(=O)CN(C)[C@@]1(CO)CC[C@@H](C)C1)c1cccs1	ZINC000187992833	186240663	/nfs/dbraw/zinc/24/06/63/186240663.db2.gz	XKCMVZJFLXMTRZ-WWGRRREGSA-N	0	3	310.463	2.408	10	0		DEAEHN
COCCOc1ccc(NC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000171888736	198002404	/nfs/dbraw/zinc/00/24/04/198002404.db2.gz	YHXUXYYRBLWJPO-HNNXBMFYSA-N	0	3	319.405	2.024	10	0		DEAEHN
COc1ccc([C@H](C)NC(=O)N2CCN3CCC[C@@H]3C2)cc1F	ZINC000171899047	198004264	/nfs/dbraw/zinc/00/42/64/198004264.db2.gz	HSCLJJJCEPYQBM-GXTWGEPZSA-N	0	3	321.396	2.385	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)C[C@@H]2CCCc3ccccc32)CCO1	ZINC000172306679	198077414	/nfs/dbraw/zinc/07/74/14/198077414.db2.gz	NKXWYICRLONDDZ-IRXDYDNUSA-N	0	3	316.445	2.286	10	0		DEAEHN
COc1cc(CCNC(=O)N2CCN3CCC[C@H]3C2)ccc1C	ZINC000172661210	198133815	/nfs/dbraw/zinc/13/38/15/198133815.db2.gz	UFARNFSNJPQGIU-INIZCTEOSA-N	0	3	317.433	2.036	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cccc(C[S@](C)=O)c2)CCN1C	ZINC000172994305	198174655	/nfs/dbraw/zinc/17/46/55/198174655.db2.gz	NZZCBILOMCYMSD-DHZVRSILSA-N	0	3	322.474	2.120	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCCc2ccc(F)cc2)CCN1C	ZINC000173189852	198194066	/nfs/dbraw/zinc/19/40/66/198194066.db2.gz	JBDOOZUYFSGHAT-XJKSGUPXSA-N	0	3	307.413	2.492	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)c2cccs2)[C@H](C)C1	ZINC000173256414	198202560	/nfs/dbraw/zinc/20/25/60/198202560.db2.gz	JDDLEHWVQYDUIR-VXGBXAGGSA-N	0	3	302.465	2.099	10	0		DEAEHN
COc1ccccc1CCNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000173425746	198213887	/nfs/dbraw/zinc/21/38/87/198213887.db2.gz	RWSHTTBZGBBIDG-GDBMZVCRSA-N	0	3	319.449	2.362	10	0		DEAEHN
C[C@@H](CCc1cccc(F)c1)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000173522625	198223909	/nfs/dbraw/zinc/22/39/09/198223909.db2.gz	WSGJWZNLOFVSJF-WMLDXEAASA-N	0	3	322.424	2.183	10	0		DEAEHN
COC[C@H](C)C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000173706790	198243743	/nfs/dbraw/zinc/24/37/43/198243743.db2.gz	KLZRBAPXVUGWEI-RDJZCZTQSA-N	0	3	304.434	2.392	10	0		DEAEHN
COCc1cccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000173813569	198255559	/nfs/dbraw/zinc/25/55/59/198255559.db2.gz	PJEGUFAZTABUIY-RHSMWYFYSA-N	0	3	319.449	2.457	10	0		DEAEHN
Cc1ccccc1OCCNC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000174204470	198305694	/nfs/dbraw/zinc/30/56/94/198305694.db2.gz	MHCIZNFRGCMXOI-MRXNPFEDSA-N	0	3	315.417	2.030	10	0		DEAEHN
C[C@@H](Cc1ccccc1F)NC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000174252966	198310674	/nfs/dbraw/zinc/31/06/74/198310674.db2.gz	YVTUVGBKORIGOL-GOEBONIOSA-N	0	3	317.408	2.412	10	0		DEAEHN
O=C(c1ccccc1)N1CCC(NCc2ccc(CO)o2)CC1	ZINC000174251117	198310945	/nfs/dbraw/zinc/31/09/45/198310945.db2.gz	XXNJBUCTKIAQAC-UHFFFAOYSA-N	0	3	314.385	2.166	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000174513245	198344483	/nfs/dbraw/zinc/34/44/83/198344483.db2.gz	JJMCJYMCWQWQEM-MRXNPFEDSA-N	0	3	303.450	2.359	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)[C@@H]2CCCCN2Cc2ccccc2)C1	ZINC000174583487	198354800	/nfs/dbraw/zinc/35/48/00/198354800.db2.gz	FCKXKICYNHJOEE-ROUUACIJSA-N	0	3	315.461	2.204	10	0		DEAEHN
O=c1[nH]c2ccc(Cl)cc2c(=O)n1CCCN1CCCCC1	ZINC000073658369	191338051	/nfs/dbraw/zinc/33/80/51/191338051.db2.gz	DMABBNHYVKAANI-UHFFFAOYSA-N	0	3	321.808	2.219	10	0		DEAEHN
Cc1c(C(=O)N[C@H]2CC[C@H](N(C)C)C2)oc2c1C(=O)CCC2	ZINC000093988772	355690863	/nfs/dbraw/zinc/69/08/63/355690863.db2.gz	DRAONSMHVGHOJF-RYUDHWBXSA-N	0	3	304.390	2.320	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)N2CCO[C@H](c3cccs3)C2)C1	ZINC000120067777	355789846	/nfs/dbraw/zinc/78/98/46/355789846.db2.gz	KUVZJVIOQCEEQM-KBPBESRZSA-N	0	3	323.462	2.173	10	0		DEAEHN
C[C@@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)C(C)(C)C	ZINC000123122807	355803127	/nfs/dbraw/zinc/80/31/27/355803127.db2.gz	XCIXICXEUQJLHM-GFCCVEGCSA-N	0	3	305.422	2.238	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)CCCc2nc(C3CC3)no2)CCN1C	ZINC000127546718	355822676	/nfs/dbraw/zinc/82/26/76/355822676.db2.gz	SULTVRNJMCPGBI-GXTWGEPZSA-N	0	3	320.437	2.211	10	0		DEAEHN
CCN1CCC[C@@H](N[C@@H](C)c2ccccc2OCC(=O)OC)C1	ZINC000183391860	356170349	/nfs/dbraw/zinc/17/03/49/356170349.db2.gz	ZTWPGGCGSOVHDF-LSDHHAIUSA-N	0	3	320.433	2.373	10	0		DEAEHN
CCCN[C@@H](C)c1csc(N(CCOC)CCOC)n1	ZINC000080829455	192193778	/nfs/dbraw/zinc/19/37/78/192193778.db2.gz	WRBOAKYLXUJOHR-LBPRGKRZSA-N	0	3	301.456	2.303	10	0		DEAEHN
C[C@@H]1CCC[C@@](N)(C(=O)Nc2cc(C(N)=O)ccc2Cl)C1	ZINC000080913796	192200536	/nfs/dbraw/zinc/20/05/36/192200536.db2.gz	SLNXIHLMQYOUNL-PSLIRLAXSA-N	0	3	309.797	2.285	10	0		DEAEHN
C[C@@H]1CC[C@@](N)(c2ncc(I)cn2)C1	ZINC000306647140	356404956	/nfs/dbraw/zinc/40/49/56/356404956.db2.gz	PFBKFJTXSFDKFT-XCBNKYQSSA-N	0	3	303.147	2.055	10	0		DEAEHN
CC(C)C(=O)Nc1ccc(NC(=O)C[C@@H]2CSCCN2)cc1	ZINC000236825919	202028610	/nfs/dbraw/zinc/02/86/10/202028610.db2.gz	DKNNXIREGGDJQZ-CQSZACIVSA-N	0	3	321.446	2.315	10	0		DEAEHN
C[C@@H]1CO[C@@H](c2ccccc2)CN1C(=O)C1CCN(C)CC1	ZINC000081329982	192251400	/nfs/dbraw/zinc/25/14/00/192251400.db2.gz	KYGIWCHVVZYMBM-RHSMWYFYSA-N	0	3	302.418	2.317	10	0		DEAEHN
CCN1CCC[C@@H](Nc2ccc3nnc(C(F)(F)F)n3n2)C1	ZINC000319778477	356442590	/nfs/dbraw/zinc/44/25/90/356442590.db2.gz	RPFPYCOVKRKCPW-SECBINFHSA-N	0	3	314.315	2.039	10	0		DEAEHN
CCN[C@@H](C)c1cccc(S(=O)(=O)N[C@H](C)CCOC)c1	ZINC000081717780	192316702	/nfs/dbraw/zinc/31/67/02/192316702.db2.gz	GTHWBSLHFVSPNL-OLZOCXBDSA-N	0	3	314.451	2.060	10	0		DEAEHN
CC[C@@H](C)[C@H](N)C(=O)Nc1nc(Cc2ccccc2)ns1	ZINC000236991692	202111737	/nfs/dbraw/zinc/11/17/37/202111737.db2.gz	HRQHXTRBXSEJID-MFKMUULPSA-N	0	3	304.419	2.441	10	0		DEAEHN
CN(Cc1cccc(Br)c1)C[C@@H]1CN(C)CCO1	ZINC000404170550	356731408	/nfs/dbraw/zinc/73/14/08/356731408.db2.gz	NRPQAONHKCTZSS-AWEZNQCLSA-N	0	3	313.239	2.212	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2CCC[C@H]3CCCC[C@@H]32)c[nH]1	ZINC000088970788	192674465	/nfs/dbraw/zinc/67/44/65/192674465.db2.gz	BXHMIHGFUZCRGC-DOMZBBRYSA-N	0	3	311.451	2.077	10	0		DEAEHN
CCCNCc1cc(S(=O)(=O)NCC)ccc1OCCC	ZINC000088981844	192681595	/nfs/dbraw/zinc/68/15/95/192681595.db2.gz	AVIIOISJLWHAMT-UHFFFAOYSA-N	0	3	314.451	2.273	10	0		DEAEHN
CN(C)CCn1cc(NC(=O)c2cccc3c2ccn3C)cn1	ZINC000588857042	357430106	/nfs/dbraw/zinc/43/01/06/357430106.db2.gz	RJALPBVUJQURKD-UHFFFAOYSA-N	0	3	311.389	2.189	10	0		DEAEHN
Cn1cc(C(=O)N2CCN3CCC[C@@H]3C2)c(-c2ccccc2)n1	ZINC000179816779	199084510	/nfs/dbraw/zinc/08/45/10/199084510.db2.gz	RHSZUBLPGBFGFY-OAHLLOKOSA-N	0	3	310.401	2.007	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccccc1OC(F)(F)F	ZINC000180062761	199113199	/nfs/dbraw/zinc/11/31/99/199113199.db2.gz	JPYNGXPGSGLYPD-JTQLQIEISA-N	0	3	302.296	2.409	10	0		DEAEHN
CN1CC[C@@H](NC(=O)CC2CCOCC2)[C@@H]1c1ccccc1	ZINC000180160690	199125262	/nfs/dbraw/zinc/12/52/62/199125262.db2.gz	NKLXNNOBJQXNHL-AEFFLSMTSA-N	0	3	302.418	2.365	10	0		DEAEHN
COc1cccc(-c2nsc(NC(=O)[C@@H](N)C(C)C)n2)c1	ZINC000237338832	202236779	/nfs/dbraw/zinc/23/67/79/202236779.db2.gz	OYRTUNBKMJUEKA-NSHDSACASA-N	0	3	306.391	2.136	10	0		DEAEHN
COc1ccc(C[C@H](C)C(=O)N2CC[C@H](N(C)C)C2)cc1OC	ZINC000180703713	199198955	/nfs/dbraw/zinc/19/89/55/199198955.db2.gz	JTTGQGZAPDCNMF-ZFWWWQNUSA-N	0	3	320.433	2.045	10	0		DEAEHN
CN1CCN(CCCSc2ccc(C(F)(F)F)nn2)CC1	ZINC000186819463	200015889	/nfs/dbraw/zinc/01/58/89/200015889.db2.gz	ZSXADNUMWFKVRI-UHFFFAOYSA-N	0	3	320.384	2.225	10	0		DEAEHN
CC[C@@H](O)CN1CCN(Cc2ccc3nc(C)ccc3c2)CC1	ZINC000187248304	200083203	/nfs/dbraw/zinc/08/32/03/200083203.db2.gz	ZEPUHOXADHBUQF-GOSISDBHSA-N	0	3	313.445	2.432	10	0		DEAEHN
CC(=O)c1cc(NC(=O)N[C@@H]2CNCCC2(F)F)ccc1C	ZINC000519834282	283586192	/nfs/dbraw/zinc/58/61/92/283586192.db2.gz	JLMDYHYHTWICCS-CYBMUJFWSA-N	0	3	311.332	2.316	10	0		DEAEHN
CC[C@@H](CN1CCCC1)NC(=O)c1cc(-c2cccnc2)on1	ZINC000605372489	360962738	/nfs/dbraw/zinc/96/27/38/360962738.db2.gz	WUWPTMDJODLSNJ-AWEZNQCLSA-N	0	3	314.389	2.341	10	0		DEAEHN
CC1(C)Cc2cccc(CNCCc3nnc4n3CCC4)c2O1	ZINC000606469187	361012520	/nfs/dbraw/zinc/01/25/20/361012520.db2.gz	FGRJJOHCCBSCGN-UHFFFAOYSA-N	0	3	312.417	2.270	10	0		DEAEHN
O=C(Nc1ccc2nccn2c1)N1CCN(c2ccncc2)CC1	ZINC000606582736	361022855	/nfs/dbraw/zinc/02/28/55/361022855.db2.gz	BEMOCLSGYFULGP-UHFFFAOYSA-N	0	3	322.372	2.083	10	0		DEAEHN
COC[C@](C)(CO)NCc1cccc(C(=O)OC(C)(C)C)c1	ZINC000611498428	361613288	/nfs/dbraw/zinc/61/32/88/361613288.db2.gz	RMZAGQFTZZWODV-KRWDZBQOSA-N	0	3	309.406	2.129	10	0		DEAEHN
CCC[C@H](C(=O)N(C)C[C@H]1COc2ccccc2O1)N(C)C	ZINC000179186709	283758199	/nfs/dbraw/zinc/75/81/99/283758199.db2.gz	DWOQHWYUQSWKSL-UONOGXRCSA-N	0	3	306.406	2.015	10	0		DEAEHN
C=Cn1cc(CNC[C@H]2CCN2Cc2ccc(OC)cc2)cn1	ZINC000623641561	365114324	/nfs/dbraw/zinc/11/43/24/365114324.db2.gz	YHIANGFLLKEQJC-QGZVFWFLSA-N	0	3	312.417	2.356	10	0		DEAEHN
Cc1csc([C@@H](C)NCCC2(CS(C)(=O)=O)CC2)n1	ZINC000624010842	365252239	/nfs/dbraw/zinc/25/22/39/365252239.db2.gz	ZCSJZYFZFDTYDR-LLVKDONJSA-N	0	3	302.465	2.317	10	0		DEAEHN
CCS(=O)(=O)CCn1ncc(CNC(C)(C)C)c1C1CC1	ZINC000091339788	193043759	/nfs/dbraw/zinc/04/37/59/193043759.db2.gz	XOSXXAZRVRBHST-UHFFFAOYSA-N	0	3	313.467	2.083	10	0		DEAEHN
CO[C@@H](CN[C@@H](C)c1ccc(S(N)(=O)=O)cc1)C(C)(C)C	ZINC000091350122	193045117	/nfs/dbraw/zinc/04/51/17/193045117.db2.gz	OGBJXBGYILJCKG-FZMZJTMJSA-N	0	3	314.451	2.046	10	0		DEAEHN
Cc1cc([C@H](CN)N2CCOC[C@@H]2C)ccc1Br	ZINC000091470582	193060670	/nfs/dbraw/zinc/06/06/70/193060670.db2.gz	QVZKKFPGGYHWFG-FZMZJTMJSA-N	0	3	313.239	2.478	10	0		DEAEHN
CN[C@H](c1cc(Cl)ccc1OC)[C@H]1CN2CCC[C@@H]2CO1	ZINC000091721311	193096989	/nfs/dbraw/zinc/09/69/89/193096989.db2.gz	RDSJSWZEAKLZAZ-DAXOMENPSA-N	0	3	310.825	2.472	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@H]1O)c1ccccc1Br	ZINC000624235187	365343691	/nfs/dbraw/zinc/34/36/91/365343691.db2.gz	GECLJQDDDHKECW-TVYUQYBPSA-N	0	3	300.196	2.250	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H]2CC[C@H](C)[NH2+]C2)sc1Cl	ZINC000624405065	365411784	/nfs/dbraw/zinc/41/17/84/365411784.db2.gz	BEPQPXDKEFLUEA-DTWKUNHWSA-N	0	3	308.856	2.129	10	0		DEAEHN
COC[C@H](N)Cc1cn(-c2cc(Cl)ccc2Cl)nn1	ZINC000630600120	367750175	/nfs/dbraw/zinc/75/01/75/367750175.db2.gz	XKCSRBMSXMWFMC-SECBINFHSA-N	0	3	301.177	2.090	10	0		DEAEHN
CC(C)NCc1ccccc1S(=O)(=O)N1C[C@H](C)[C@@H](C)C1	ZINC000092113964	193161107	/nfs/dbraw/zinc/16/11/07/193161107.db2.gz	XSURBBPRMILURB-KBPBESRZSA-N	0	3	310.463	2.461	10	0		DEAEHN
c1c(CNC[C@@H]2C[C@H]2c2ccccc2)nnn1C[C@H]1CCOC1	ZINC000631144601	368043175	/nfs/dbraw/zinc/04/31/75/368043175.db2.gz	NWKOKQDUKWNBHK-HFTRVMKXSA-N	0	3	312.417	2.208	10	0		DEAEHN
Cn1nncc1CN[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000631207018	368078944	/nfs/dbraw/zinc/07/89/44/368078944.db2.gz	ZSVOOGQOIPSCKR-QGZVFWFLSA-N	0	3	313.449	2.350	10	0		DEAEHN
COc1ccc(CNCC[C@H](O)C(F)F)c(Cl)c1OC	ZINC000631217946	368084991	/nfs/dbraw/zinc/08/49/91/368084991.db2.gz	YJLSKQZBVUZILO-VIFPVBQESA-N	0	3	309.740	2.463	10	0		DEAEHN
O[C@H](CCNCc1cc(Cl)c2c(c1)OCCO2)C(F)F	ZINC000631219447	368086459	/nfs/dbraw/zinc/08/64/59/368086459.db2.gz	NSGAOJMOLFRLQM-SNVBAGLBSA-N	0	3	307.724	2.217	10	0		DEAEHN
CO[C@@]1(C)C[C@H](NCC(=O)Nc2ccc3c(c2)OCO3)C1(C)C	ZINC000451488790	243021661	/nfs/dbraw/zinc/02/16/61/243021661.db2.gz	NAUXMJBDRYHZPB-YOEHRIQHSA-N	0	3	320.389	2.147	10	0		DEAEHN
CC[C@H](C)N[C@H](CNC(=O)Cc1cn(C)nc1C)c1ccco1	ZINC000451676581	243296132	/nfs/dbraw/zinc/29/61/32/243296132.db2.gz	SSNMNEGJQCDPSS-SWLSCSKDSA-N	0	3	318.421	2.110	10	0		DEAEHN
COC[C@H]1CCCN(Cc2cc(OC)c3c(c2)OCCO3)C1	ZINC000093337584	193235173	/nfs/dbraw/zinc/23/51/73/193235173.db2.gz	RCFGVHAAEJKSIU-ZDUSSCGKSA-N	0	3	307.390	2.325	10	0		DEAEHN
CC(C)CN(CCN(C)C)c1ncc(N)cc1Br	ZINC000093432953	193250610	/nfs/dbraw/zinc/25/06/10/193250610.db2.gz	JIWYIZYFVADHRU-UHFFFAOYSA-N	0	3	315.259	2.450	10	0		DEAEHN
C[C@@H](C[C@H]1CCC[NH2+]1)Nc1ccc(F)c([N-]S(C)(=O)=O)c1	ZINC000093464391	193255897	/nfs/dbraw/zinc/25/58/97/193255897.db2.gz	LILCWTLGWZGFQY-WDEREUQCSA-N	0	3	315.414	2.140	10	0		DEAEHN
NC(=O)[C@@]1(N)CCC[C@H]1CCSc1ccc(F)c(F)c1	ZINC000093627219	193276652	/nfs/dbraw/zinc/27/66/52/193276652.db2.gz	OSKMJLQLSFGUIP-LKFCYVNXSA-N	0	3	300.374	2.430	10	0		DEAEHN
Fc1cc2[nH]c([C@@H]3CNCCO3)nc2cc1Br	ZINC000093728788	193297928	/nfs/dbraw/zinc/29/79/28/193297928.db2.gz	PSUZNWSHVBDEBM-JTQLQIEISA-N	0	3	300.131	2.125	10	0		DEAEHN
CN[C@H](c1ccc(C(F)(F)F)cc1)[C@H]1CN(C)CCN1C	ZINC000093894770	193325869	/nfs/dbraw/zinc/32/58/69/193325869.db2.gz	QBKZXIIGKNUKKO-ZIAGYGMSSA-N	0	3	301.356	2.212	10	0		DEAEHN
CC1(C)CCC[C@@H](CN2CCN(c3nccs3)CC2)[C@@H]1O	ZINC000094289136	193356076	/nfs/dbraw/zinc/35/60/76/193356076.db2.gz	NNLXYGUMCZTBJS-KBPBESRZSA-N	0	3	309.479	2.452	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1cccc(Cl)c1)N(C)CCS(C)(=O)=O	ZINC000094297251	193357231	/nfs/dbraw/zinc/35/72/31/193357231.db2.gz	RWVZWHUZVKZQCL-ZIAGYGMSSA-N	0	3	318.870	2.095	10	0		DEAEHN
N=C(N)c1ccc(C(F)(F)F)nc1OC[C@@H]1CCCCO1	ZINC000094336831	193361380	/nfs/dbraw/zinc/36/13/80/193361380.db2.gz	LMMYOJDRVORVJU-QMMMGPOBSA-N	0	3	303.284	2.332	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cccc(C(=O)OC(C)(C)C)c1	ZINC000094135134	193346628	/nfs/dbraw/zinc/34/66/28/193346628.db2.gz	DHRHDWHLQDHVNE-HNNXBMFYSA-N	0	3	318.417	2.466	10	0		DEAEHN
CN(C1CCC(C)(C)CC1)S(=O)(=O)C[C@H]1CCCCN1	ZINC000094859892	193403095	/nfs/dbraw/zinc/40/30/95/193403095.db2.gz	PXNSNCRTPADWHZ-CYBMUJFWSA-N	0	3	302.484	2.359	10	0		DEAEHN
COc1ncnc2c1[nH]c(=S)n2[C@H](CC(C)C)CN(C)C	ZINC000094738891	193394697	/nfs/dbraw/zinc/39/46/97/193394697.db2.gz	QIZMBNJQBKKKRK-SNVBAGLBSA-N	0	3	309.439	2.272	10	0		DEAEHN
CC1(C)CCN(S(=O)(=O)c2ccc(Cl)c(CN)c2)C1	ZINC000094814908	193399907	/nfs/dbraw/zinc/39/99/07/193399907.db2.gz	DZUPKAHNQVFDIJ-UHFFFAOYSA-N	0	3	302.827	2.219	10	0		DEAEHN
COc1ccc([C@H]2C[C@H]2C(=O)N(C)C2CCN(C)CC2)cc1	ZINC000096574842	193681154	/nfs/dbraw/zinc/68/11/54/193681154.db2.gz	KZNCSGASHXKSKH-IAGOWNOFSA-N	0	3	302.418	2.351	10	0		DEAEHN
O=C(Nc1ccc(-c2cc[nH]n2)cc1)N1CCN2CCC[C@@H]2C1	ZINC000265964235	205001810	/nfs/dbraw/zinc/00/18/10/205001810.db2.gz	UOGRYBVOULNGAX-OAHLLOKOSA-N	0	3	311.389	2.389	10	0		DEAEHN
CC[C@@H](C)NCc1cc(Br)ccc1OCC(N)=O	ZINC000020873074	182250706	/nfs/dbraw/zinc/25/07/06/182250706.db2.gz	XDXHBRBHFYDTBU-SECBINFHSA-N	0	3	315.211	2.201	10	0		DEAEHN
CCN1CCN(C[C@@H](N)c2cccc(C(F)(F)F)c2)CC1	ZINC000021518283	182277890	/nfs/dbraw/zinc/27/78/90/182277890.db2.gz	AUYSPNPUYSYYMX-CQSZACIVSA-N	0	3	301.356	2.343	10	0		DEAEHN
CCCC(CCC)(C(N)=S)C(=O)NCC1(N(C)C)CCC1	ZINC000097932875	193767404	/nfs/dbraw/zinc/76/74/04/193767404.db2.gz	MJOFPWUGZGMZSM-UHFFFAOYSA-N	0	3	313.511	2.460	10	0		DEAEHN
O[C@@H](CNCc1ccc(C2CCCC2)cc1)Cn1ccnn1	ZINC000459701992	248663831	/nfs/dbraw/zinc/66/38/31/248663831.db2.gz	FNKQQCJMIYSCPM-KRWDZBQOSA-N	0	3	300.406	2.086	10	0		DEAEHN
OC[C@@H](NC[C@H]1CCCO1)c1ccc(F)c(Br)c1	ZINC000038114785	182993317	/nfs/dbraw/zinc/99/33/17/182993317.db2.gz	NSLIKARTAXQBOZ-ZWNOBZJWSA-N	0	3	318.186	2.390	10	0		DEAEHN
CCCNCC(=O)Nc1sc2c(c1C(=O)OCC)CCC2	ZINC000038690732	183006531	/nfs/dbraw/zinc/00/65/31/183006531.db2.gz	LQNHUVWURDTGCF-UHFFFAOYSA-N	0	3	310.419	2.352	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2c3ncsc3ccc2Cl)C1	ZINC000040632733	183111615	/nfs/dbraw/zinc/11/16/15/183111615.db2.gz	JEDIJPLIOFRBRF-VXNVDRBHSA-N	0	3	311.794	2.265	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)NCCc1ccc(OC(F)F)cc1	ZINC000040832820	183139481	/nfs/dbraw/zinc/13/94/81/183139481.db2.gz	KYXSMQKXQYZKKA-GXFFZTMASA-N	0	3	300.349	2.320	10	0		DEAEHN
CC(C)[C@@H](N)C(=O)NCc1cc(Br)ccc1F	ZINC000041069515	183162625	/nfs/dbraw/zinc/16/26/25/183162625.db2.gz	VIQFOKAMOMTGMW-LLVKDONJSA-N	0	3	303.175	2.188	10	0		DEAEHN
CCOC(=O)COC[C@H](N)c1ccc(OC(F)(F)F)cc1	ZINC000041071902	183162894	/nfs/dbraw/zinc/16/28/94/183162894.db2.gz	MTTWKAKRNYSRNU-NSHDSACASA-N	0	3	307.268	2.165	10	0		DEAEHN
OC[C@@H](NC[C@@H]1CCCO1)c1ccc(Br)s1	ZINC000041703001	183218565	/nfs/dbraw/zinc/21/85/65/183218565.db2.gz	WVBWCCWHGDATHO-DTWKUNHWSA-N	0	3	306.225	2.313	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)NCCN2CCCC[C@H]2C)cc1F	ZINC000041664123	183214052	/nfs/dbraw/zinc/21/40/52/183214052.db2.gz	NSEGPYZPVTYMCI-CYBMUJFWSA-N	0	3	321.396	2.063	10	0		DEAEHN
COCCN([C@@H](CN)c1ccc(Br)o1)C1CC1	ZINC000042517941	183279684	/nfs/dbraw/zinc/27/96/84/183279684.db2.gz	WYQXFSHKPUZZSH-JTQLQIEISA-N	0	3	303.200	2.153	10	0		DEAEHN
Cc1cc(NS(=O)(=O)[C@H]2CCCNC2)c2ccccc2n1	ZINC000042341386	183256162	/nfs/dbraw/zinc/25/61/62/183256162.db2.gz	TYLXXVFJQYHLMV-LBPRGKRZSA-N	0	3	305.403	2.037	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccc(Cl)cc1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000042945271	183319886	/nfs/dbraw/zinc/31/98/86/183319886.db2.gz	YVUFUAKSUZBBDL-KCPJHIHWSA-N	0	3	309.841	2.281	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)cc1)N1CCC[C@@H]1C(=O)NC	ZINC000042946420	183320533	/nfs/dbraw/zinc/32/05/33/183320533.db2.gz	TYUACKBSMNSQOG-KFWWJZLASA-N	0	3	309.841	2.329	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccc(Cl)cc1)N(CC(N)=O)C1CCCC1	ZINC000042946603	183320931	/nfs/dbraw/zinc/32/09/31/183320931.db2.gz	WRUJCHVBHJWURL-BZNIZROVSA-N	0	3	309.841	2.458	10	0		DEAEHN
C[C@H](N)[C@H](c1cccs1)N1CCN(c2nccs2)CC1	ZINC000043102885	183338250	/nfs/dbraw/zinc/33/82/50/183338250.db2.gz	MQXYXONKZSXHLG-WCQYABFASA-N	0	3	308.476	2.415	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)s1)N1CCC[C@@H]1C(N)=O	ZINC000043252235	183346633	/nfs/dbraw/zinc/34/66/33/183346633.db2.gz	PCPVIGAHYJYSNN-YGOYTEALSA-N	0	3	301.843	2.130	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)s1)N1CCS(=O)CC1	ZINC000043253572	183348366	/nfs/dbraw/zinc/34/83/66/183348366.db2.gz	GLSFXWAZRITGFY-BXKDBHETSA-N	0	3	306.884	2.244	10	0		DEAEHN
Cc1nc(C)n([C@H](CN)c2cc(Br)cs2)n1	ZINC000043288136	183351292	/nfs/dbraw/zinc/35/12/92/183351292.db2.gz	KLADZDQRRFODSE-SECBINFHSA-N	0	3	301.213	2.267	10	0		DEAEHN
COc1ccc2ccccc2c1[C@H](N)[C@@H]1CCS(=O)(=O)C1	ZINC000043300089	183351950	/nfs/dbraw/zinc/35/19/50/183351950.db2.gz	KBYFAIVAUSEYKZ-MLGOLLRUSA-N	0	3	305.399	2.283	10	0		DEAEHN
CCC[C@@H](C)NC(=O)[C@H](C)N(CCC(N)=S)CC(C)C	ZINC000043418468	183361013	/nfs/dbraw/zinc/36/10/13/183361013.db2.gz	MXJNLCRCPGXSKP-OLZOCXBDSA-N	0	3	301.500	2.314	10	0		DEAEHN
CCCN(CCN(C)C)CC(=O)Nc1ccc(N)cc1Cl	ZINC000045663068	183521780	/nfs/dbraw/zinc/52/17/80/183521780.db2.gz	YNLPEHITEOHOHN-UHFFFAOYSA-N	0	3	312.845	2.134	10	0		DEAEHN
CO[C@@H]1C[C@@H](CO)N(CCOc2cccc3ccccc32)C1	ZINC000284561630	218078550	/nfs/dbraw/zinc/07/85/50/218078550.db2.gz	ILCRAJHWDZCKHF-JKSUJKDBSA-N	0	3	301.386	2.300	10	0		DEAEHN
CCN(CC)[C@@H](C(=O)N1CC[C@@H](N(C)C)C1)c1ccccc1	ZINC000104898379	194051229	/nfs/dbraw/zinc/05/12/29/194051229.db2.gz	XZHYGNHESSDRKV-IAGOWNOFSA-N	0	3	303.450	2.232	10	0		DEAEHN
COCCN(CCN(C)C)C(=O)Nc1cccc([C@@H](C)OC)c1	ZINC000105032681	194065487	/nfs/dbraw/zinc/06/54/87/194065487.db2.gz	PIVRLKOFVWDAKC-CQSZACIVSA-N	0	3	323.437	2.436	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2nc3ccccc3n2C(F)F)CCO1	ZINC000105925799	194171047	/nfs/dbraw/zinc/17/10/47/194171047.db2.gz	IBYWGXLSJXFJHL-LBPRGKRZSA-N	0	3	324.375	2.194	10	0		DEAEHN
O=C(Nc1cccc(CN[C@@H]2CCCOC2)c1)C(F)(F)F	ZINC000109545920	194272913	/nfs/dbraw/zinc/27/29/13/194272913.db2.gz	AFPOAKWRFLVHBT-GFCCVEGCSA-N	0	3	302.296	2.456	10	0		DEAEHN
CCc1ccc(CN2CCN(C(C)(C)C(N)=S)CC2)s1	ZINC000109470937	194266780	/nfs/dbraw/zinc/26/67/80/194266780.db2.gz	PMKFLGHZNCNQOG-UHFFFAOYSA-N	0	3	311.520	2.493	10	0		DEAEHN
CC[C@@H](C(N)=S)N1CCN(Cc2cccc(F)c2F)CC1	ZINC000109469381	194267486	/nfs/dbraw/zinc/26/74/86/194267486.db2.gz	FKMXAXWSWYXBNR-ZDUSSCGKSA-N	0	3	313.417	2.147	10	0		DEAEHN
CCCNc1nc(N(C)C)nc(N2CCSC(C)(C)C2)n1	ZINC000159348572	197346778	/nfs/dbraw/zinc/34/67/78/197346778.db2.gz	LEHWRTVMBOYQIW-UHFFFAOYSA-N	0	3	310.471	2.091	10	0		DEAEHN
C[C@H](N)c1cc(Br)ccc1O[C@H]1CCOC1=O	ZINC000052066534	183849463	/nfs/dbraw/zinc/84/94/63/183849463.db2.gz	OJDDSGFRAVAKNQ-CPCISQLKSA-N	0	3	300.152	2.163	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1ccc(F)c(F)c1	ZINC000110084923	194308781	/nfs/dbraw/zinc/30/87/81/194308781.db2.gz	MDTHVKCQTCCEDG-LBPRGKRZSA-N	0	3	313.348	2.197	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(C)cc1F	ZINC000110085719	194309167	/nfs/dbraw/zinc/30/91/67/194309167.db2.gz	WZRXKTHUYLLWTM-CYBMUJFWSA-N	0	3	309.385	2.366	10	0		DEAEHN
Cc1cc(Cl)ccc1S(=O)(=O)N(C)[C@@H]1CCCNC1	ZINC000110928068	194370153	/nfs/dbraw/zinc/37/01/53/194370153.db2.gz	HRYVVAHCYXZCCD-GFCCVEGCSA-N	0	3	302.827	2.021	10	0		DEAEHN
CCCN([C@@H]1CCCNC1)S(=O)(=O)c1ccc(C)c(F)c1	ZINC000110942458	194371759	/nfs/dbraw/zinc/37/17/59/194371759.db2.gz	ZKEGMAPEYNDLPK-CYBMUJFWSA-N	0	3	314.426	2.287	10	0		DEAEHN
CCNCc1c(N(C)C[C@H]2CCCOC2)nc2sccn12	ZINC000111166672	194397369	/nfs/dbraw/zinc/39/73/69/194397369.db2.gz	SDCXUTQKYIJWJW-GFCCVEGCSA-N	0	3	308.451	2.368	10	0		DEAEHN
CCN[C@](C)(C[C@@H](C)N(C)CCOC(C)C)C(=O)OCC	ZINC000157527651	197194337	/nfs/dbraw/zinc/19/43/37/197194337.db2.gz	JSCLCPAMERVPPO-GDBMZVCRSA-N	0	3	302.459	2.053	10	0		DEAEHN
COC(=O)c1sccc1NC(=O)[C@@H](CN)c1ccccc1	ZINC000061612679	184178750	/nfs/dbraw/zinc/17/87/50/184178750.db2.gz	SREKSCSCXUZKHD-NSHDSACASA-N	0	3	304.371	2.216	10	0		DEAEHN
COc1cc(Cl)c([C@@H](N)C[C@H](C)CC(N)=O)cc1OC	ZINC000061830331	184188977	/nfs/dbraw/zinc/18/89/77/184188977.db2.gz	JHZKEFQVHJHABF-KWQFWETISA-N	0	3	300.786	2.259	10	0		DEAEHN
CCNCCS(=O)(=O)N(C)[C@H](C)c1ccc(Cl)cc1	ZINC000062010848	184200984	/nfs/dbraw/zinc/20/09/84/184200984.db2.gz	CABZJFFKJKNFMU-LLVKDONJSA-N	0	3	304.843	2.272	10	0		DEAEHN
CC(C)N1C(=O)CC[C@H](N)[C@@H]1c1ccc(Br)o1	ZINC000062211600	184221605	/nfs/dbraw/zinc/22/16/05/184221605.db2.gz	LXJQOPFMWPHTAJ-QPUJVOFHSA-N	0	3	301.184	2.441	10	0		DEAEHN
CC(C)N[C@@H](CCOc1ccccc1C(F)(F)F)C(N)=O	ZINC000062546967	184242280	/nfs/dbraw/zinc/24/22/80/184242280.db2.gz	AKXWIXGAEYFWTQ-NSHDSACASA-N	0	3	304.312	2.326	10	0		DEAEHN
CCC(=O)N1CCN(C2(c3ccccc3)CCN(C)CC2)CC1	ZINC000062554775	184242404	/nfs/dbraw/zinc/24/24/04/184242404.db2.gz	OIMQNCGJPZKWEG-UHFFFAOYSA-N	0	3	315.461	2.162	10	0		DEAEHN
CCOC(=O)[C@H](C)Oc1ccc(Cl)cc1CNCCOC	ZINC000062731121	184251501	/nfs/dbraw/zinc/25/15/01/184251501.db2.gz	BCIBVADGXANBRI-NSHDSACASA-N	0	3	315.797	2.406	10	0		DEAEHN
CN[C@H](C)c1ccc(F)cc1OCC(=O)NCC(F)(F)F	ZINC000062746171	184251853	/nfs/dbraw/zinc/25/18/53/184251853.db2.gz	ZZGBLEZTCMRPRN-MRVPVSSYSA-N	0	3	308.275	2.163	10	0		DEAEHN
Cc1ccc(F)c(S(=O)(=O)[N-][C@@H]2CCCCC[C@H]2[NH3+])c1	ZINC000063213460	184278446	/nfs/dbraw/zinc/27/84/46/184278446.db2.gz	VAIOYIGRYXMMTH-CHWSQXEVSA-N	0	3	300.399	2.072	10	0		DEAEHN
CCCNc1ccc(Cl)c(C(=O)N2CC[C@H](N(C)C)C2)n1	ZINC000062984766	184264793	/nfs/dbraw/zinc/26/47/93/184264793.db2.gz	VMONGLIDTRGKGK-NSHDSACASA-N	0	3	310.829	2.333	10	0		DEAEHN
Cc1cc([C@@H](CN)N(C)[C@@H]2CCOC2)ccc1Br	ZINC000158668630	197292672	/nfs/dbraw/zinc/29/26/72/197292672.db2.gz	YLBLCRCKOTTXAM-TZMCWYRMSA-N	0	3	313.239	2.478	10	0		DEAEHN
CN([C@@H](CN)c1ccc(F)c(Br)c1)[C@@H]1CCOC1	ZINC000158684032	197293561	/nfs/dbraw/zinc/29/35/61/197293561.db2.gz	CHLGNTOJOJRAMQ-MFKMUULPSA-N	0	3	317.202	2.309	10	0		DEAEHN
C[C@H]1c2ccccc2O[C@@H]1C(=O)N(C)CC1(N(C)C)CCC1	ZINC000188003023	207369708	/nfs/dbraw/zinc/36/97/08/207369708.db2.gz	VVKIHWQIBZVLET-BBRMVZONSA-N	0	3	302.418	2.494	10	0		DEAEHN
CCOC(=O)[C@@]1(NCCN(C)C)CCC[C@H](C(F)(F)F)C1	ZINC000069385616	184511495	/nfs/dbraw/zinc/51/14/95/184511495.db2.gz	ZBGAFCFVTVVFSK-WCQYABFASA-N	0	3	310.360	2.192	10	0		DEAEHN
Cc1cc(CCNCc2ccccc2N2CCOCC2)on1	ZINC000556847527	291847604	/nfs/dbraw/zinc/84/76/04/291847604.db2.gz	RXXDVWHDQHZMKJ-UHFFFAOYSA-N	0	3	301.390	2.152	10	0		DEAEHN
CCOc1ccc(Cl)cc1NC(=O)[C@@H](N)CCCOC	ZINC000159276049	197342137	/nfs/dbraw/zinc/34/21/37/197342137.db2.gz	WIBMSCLIEGVYKE-NSHDSACASA-N	0	3	300.786	2.431	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000159101877	197327950	/nfs/dbraw/zinc/32/79/50/197327950.db2.gz	XTKXWUHCFCYOIP-NSHDSACASA-N	0	3	306.284	2.278	10	0		DEAEHN
COc1cc2c(cc1[C@H](CN)N1CCSCC1)O[C@@H](C)C2	ZINC000159054083	197322244	/nfs/dbraw/zinc/32/22/44/197322244.db2.gz	ZNNPURILVWNACL-FZMZJTMJSA-N	0	3	308.447	2.067	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc(CN)c1F	ZINC000159055782	197322255	/nfs/dbraw/zinc/32/22/55/197322255.db2.gz	DPVOVKQQVMAVLZ-GHMZBOCLSA-N	0	3	314.426	2.259	10	0		DEAEHN
CC[C@H](C[NH3+])CC(=O)Nc1cc(Br)ccc1[O-]	ZINC000158977056	197316274	/nfs/dbraw/zinc/31/62/74/197316274.db2.gz	JWKXRRTWSRWDNQ-QMMMGPOBSA-N	0	3	301.184	2.468	10	0		DEAEHN
N[C@@H](CS(=O)(=O)c1c(Cl)cccc1Cl)[C@@H]1CCOC1	ZINC000158809627	197303008	/nfs/dbraw/zinc/30/30/08/197303008.db2.gz	ZPTPRYGDTUQWAO-KCJUWKMLSA-N	0	3	324.229	2.131	10	0		DEAEHN
C[C@H]1C[C@@H](Nc2nc(Cl)nc(N3CCCC3)n2)CCN1C	ZINC000158605954	197287840	/nfs/dbraw/zinc/28/78/40/197287840.db2.gz	OMPZOUNAKMGZEN-QWRGUYRKSA-N	0	3	310.833	2.020	10	0		DEAEHN
CN1CC[C@H](n2c(N)nc3cc(F)c(Br)cc32)C1	ZINC000158385619	197267282	/nfs/dbraw/zinc/26/72/82/197267282.db2.gz	ORXYSKVZJVWMKX-ZETCQYMHSA-N	0	3	313.174	2.397	10	0		DEAEHN
COCCNCc1cnc(N2C[C@@H](C)S[C@H](C)C2)c(C)c1	ZINC000158278189	197258753	/nfs/dbraw/zinc/25/87/53/197258753.db2.gz	JISRCAWPMDIGDL-ZIAGYGMSSA-N	0	3	309.479	2.456	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC[C@H](CCC(=O)OCC)C1)N(C)C	ZINC000120304739	195138960	/nfs/dbraw/zinc/13/89/60/195138960.db2.gz	OCVBSJPWQUKXHL-HUUCEWRRSA-N	0	3	312.454	2.299	10	0		DEAEHN
CN[C@H](Cc1cccc(C(F)(F)F)c1)[C@H](C)S(C)(=O)=O	ZINC000157711172	197209932	/nfs/dbraw/zinc/20/99/32/197209932.db2.gz	CITWIAHCFFXVBC-JOYOIKCWSA-N	0	3	309.353	2.269	10	0		DEAEHN
CN[C@@H](Cc1cccc(C(F)(F)F)c1)[C@@H](C)S(C)(=O)=O	ZINC000157711609	197209580	/nfs/dbraw/zinc/20/95/80/197209580.db2.gz	CITWIAHCFFXVBC-SKDRFNHKSA-N	0	3	309.353	2.269	10	0		DEAEHN
C[C@@](F)(Cc1ccc(Br)cn1)C[C@H]1COCCN1	ZINC000157601838	197200938	/nfs/dbraw/zinc/20/09/38/197200938.db2.gz	JNTLVLWCHUDFRX-QWHCGFSZSA-N	0	3	317.202	2.493	10	0		DEAEHN
CNc1nc(NC[C@@H]2CCCCS2)nc(N2CCCC2)n1	ZINC000157660726	197205252	/nfs/dbraw/zinc/20/52/52/197205252.db2.gz	RLZMFXZBJASCQR-NSHDSACASA-N	0	3	308.455	2.211	10	0		DEAEHN
CC[C@H](C(=O)N[C@H](C)c1ccccc1-n1cccn1)N(C)C	ZINC000157469274	197189674	/nfs/dbraw/zinc/18/96/74/197189674.db2.gz	RUJUVMUXEHDGQO-UKRRQHHQSA-N	0	3	300.406	2.390	10	0		DEAEHN
CN[C@H](C)c1cccc(S(=O)(=O)N(C)CCOC(C)C)c1	ZINC000157292872	197177077	/nfs/dbraw/zinc/17/70/77/197177077.db2.gz	BDNULORWRUEKIM-CYBMUJFWSA-N	0	3	314.451	2.013	10	0		DEAEHN
C/C(=C\c1c(Br)c(C)nn1C)C[C@H]1COCCN1	ZINC000157354283	197181508	/nfs/dbraw/zinc/18/15/08/197181508.db2.gz	HOUPPYNUBBMIEG-DJYGCBNOSA-N	0	3	314.227	2.273	10	0		DEAEHN
Cc1ccc2ncc(CN3CCC[C@H](Cn4cncn4)C3)n2c1	ZINC000156676397	197131773	/nfs/dbraw/zinc/13/17/73/197131773.db2.gz	YJBQYHDFMMSUIY-HNNXBMFYSA-N	0	3	310.405	2.146	10	0		DEAEHN
Cc1cc(N(C)CCc2ccncc2)c(C(N)=S)c(C)n1	ZINC000156629343	197128525	/nfs/dbraw/zinc/12/85/25/197128525.db2.gz	CVYZKCAOCXXGPR-UHFFFAOYSA-N	0	3	300.431	2.407	10	0		DEAEHN
C[C@H](Nc1nc(N)nc(N2CCCCC2)n1)c1nccs1	ZINC000156150284	197089671	/nfs/dbraw/zinc/08/96/71/197089671.db2.gz	DFRBWWMVNGJHNG-VIFPVBQESA-N	0	3	305.411	2.074	10	0		DEAEHN
Cc1ccccc1[S@](=O)CC(=O)Nc1ccccc1CN	ZINC000156011819	197079799	/nfs/dbraw/zinc/07/97/99/197079799.db2.gz	RSCXWZNVYWWOEJ-NRFANRHFSA-N	0	3	302.399	2.200	10	0		DEAEHN
O=C(N[C@H]1CCCC[C@@]12CNCCO2)OCc1ccccc1	ZINC000396427138	257103010	/nfs/dbraw/zinc/10/30/10/257103010.db2.gz	OCQRLRHSPWYLJG-DOTOQJQBSA-N	0	3	304.390	2.214	10	0		DEAEHN
O=C(CNC1(C2CC2)CC1)NCCc1cccc2cccnc21	ZINC000544414957	285348691	/nfs/dbraw/zinc/34/86/91/285348691.db2.gz	MAQKIASYHGCFCU-UHFFFAOYSA-N	0	3	309.413	2.426	10	0		DEAEHN
C[C@H](CN1CCCC1)N1C(=O)C2(CC2)N[C@H]1c1cccs1	ZINC000121955304	195380996	/nfs/dbraw/zinc/38/09/96/195380996.db2.gz	BRECEUSTWUKIRJ-TZMCWYRMSA-N	0	3	305.447	2.195	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2ccsc2)N(CC2CCN(C)CC2)C1=O	ZINC000122021363	195390619	/nfs/dbraw/zinc/39/06/19/195390619.db2.gz	JECWMPIWDILXGM-LSDHHAIUSA-N	0	3	307.463	2.299	10	0		DEAEHN
CSCC[C@H](C)N(C)CC(=O)N1CCO[C@H]2CCCC[C@@H]21	ZINC000126271235	195825471	/nfs/dbraw/zinc/82/54/71/195825471.db2.gz	VJNAMUKEIJLYDC-KKUMJFAQSA-N	0	3	314.495	2.230	10	0		DEAEHN
CCNCc1cc(OCC(=O)OC)ccc1Br	ZINC000128238777	195948207	/nfs/dbraw/zinc/94/82/07/195948207.db2.gz	LOLHUQQLUNMNCC-UHFFFAOYSA-N	0	3	302.168	2.110	10	0		DEAEHN
CC(C)NC(=O)[C@H](C)Oc1ccc(Br)c(CN)c1	ZINC000128048734	195931770	/nfs/dbraw/zinc/93/17/70/195931770.db2.gz	VZRDCVFLSLQCEU-VIFPVBQESA-N	0	3	315.211	2.200	10	0		DEAEHN
CC(C)c1ccc(/C=C/CC(=O)NC[C@@]2(O)CCN(C)C2)cc1	ZINC000358068363	133118967	/nfs/dbraw/zinc/11/89/67/133118967.db2.gz	QZPPEVAKCRLTMK-PXPVJAHISA-N	0	3	316.445	2.396	10	0		DEAEHN
C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)NCCNc1ccncc1	ZINC000361915046	133199358	/nfs/dbraw/zinc/19/93/58/133199358.db2.gz	GZVZVUZOZDAWOM-HIFRSBDPSA-N	0	3	304.438	2.429	10	0		DEAEHN
C[C@@H]1CCOCCN1C[C@@H](O)COCc1ccccc1Cl	ZINC000362232002	133218453	/nfs/dbraw/zinc/21/84/53/133218453.db2.gz	ANUOXYPMOYFCGU-UKRRQHHQSA-N	0	3	313.825	2.328	10	0		DEAEHN
O=C1[C@H](NC2CC(c3ccccn3)C2)CCN1CC(F)(F)F	ZINC000377624347	133338146	/nfs/dbraw/zinc/33/81/46/133338146.db2.gz	LBPIOBKFIWAMQB-GCZXYKMCSA-N	0	3	313.323	2.080	10	0		DEAEHN
O[C@@]1(C2CC2)CCN(Cc2cnn(Cc3ccc(F)cc3)c2)C1	ZINC000373271141	133384744	/nfs/dbraw/zinc/38/47/44/133384744.db2.gz	PEFUFXOVSPONPL-SFHVURJKSA-N	0	3	315.392	2.417	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccc(O[C@H]3CCOC3)cc2)C1	ZINC000329868642	404477765	/nfs/dbraw/zinc/47/77/65/404477765.db2.gz	XRKAIYGWIJVIAQ-WBVHZDCISA-N	0	3	318.417	2.068	10	0		DEAEHN
O=S(=O)([N-]Cc1ccc2c(c1)C[NH2+]C2)c1cc(F)cc(F)c1	ZINC000189212920	145023775	/nfs/dbraw/zinc/02/37/75/145023775.db2.gz	NEVHJFAPXMISFM-UHFFFAOYSA-N	0	3	324.352	2.047	10	0		DEAEHN
Cc1nn(C)cc1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000189867336	145035606	/nfs/dbraw/zinc/03/56/06/145035606.db2.gz	LNBFQVBMVOYFTL-GDBMZVCRSA-N	0	3	313.405	2.295	10	0		DEAEHN
C[C@H]1CC[C@@H](CN2CCCN(Cc3noc(C4CC4)n3)CC2)O1	ZINC000190525312	145043817	/nfs/dbraw/zinc/04/38/17/145043817.db2.gz	TXHVSGALOYFZHP-ZFWWWQNUSA-N	0	3	320.437	2.022	10	0		DEAEHN
Fc1cccc(Br)c1CNCCCn1ccnn1	ZINC000192716278	145077833	/nfs/dbraw/zinc/07/78/33/145077833.db2.gz	LVGHNNYOYBGBPQ-UHFFFAOYSA-N	0	3	313.174	2.360	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC(c3ccncc3)CC2)C1	ZINC000192344616	145072793	/nfs/dbraw/zinc/07/27/93/145072793.db2.gz	DYQIEPNSGUUVJX-KRWDZBQOSA-N	0	3	316.449	2.455	10	0		DEAEHN
O=C(N[C@@H]1CCCC[C@@H]1n1cccn1)C1CCN(C2CC2)CC1	ZINC000192670397	145077278	/nfs/dbraw/zinc/07/72/78/145077278.db2.gz	QILWRXGJPZGXQR-SJORKVTESA-N	0	3	316.449	2.357	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NCCCN2CCCC2=O)c1	ZINC000193478350	145086734	/nfs/dbraw/zinc/08/67/34/145086734.db2.gz	PXZVRUCWOSILPQ-ZDUSSCGKSA-N	0	3	306.406	2.367	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)C(=O)c2ccc(Cl)cc2)C1	ZINC000246212045	145094729	/nfs/dbraw/zinc/09/47/29/145094729.db2.gz	KIRZFUGQQBFIPC-SMDDNHRTSA-N	0	3	308.809	2.368	10	0		DEAEHN
O[C@H](CN1CCC[C@@H](Cn2cncn2)C1)c1ccc(Cl)cc1	ZINC000246307536	145097666	/nfs/dbraw/zinc/09/76/66/145097666.db2.gz	AFNDGCGAWAQBAO-CZUORRHYSA-N	0	3	320.824	2.377	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)[C@@H](C)N1CCN2CCC[C@H]2C1	ZINC000246309973	145098199	/nfs/dbraw/zinc/09/81/99/145098199.db2.gz	AHRDPCPOTLJSRJ-CVEARBPZSA-N	0	3	301.434	2.410	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NC[C@H]2CCCO[C@@H]2C(C)(C)C)C1	ZINC000246301805	145098286	/nfs/dbraw/zinc/09/82/86/145098286.db2.gz	FICXVLWVRQCNCM-KFWWJZLASA-N	0	3	311.470	2.173	10	0		DEAEHN
O=C(CN1CCN2CCC[C@H]2C1)N[C@H](c1ccccc1)C1CC1	ZINC000246389096	145101315	/nfs/dbraw/zinc/10/13/15/145101315.db2.gz	PCVNFSGQSUILJY-PKOBYXMFSA-N	0	3	313.445	2.034	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(-n3cccn3)cc2)C1	ZINC000246424371	145102460	/nfs/dbraw/zinc/10/24/60/145102460.db2.gz	ARNCWOWBZVZXLE-WMZOPIPTSA-N	0	3	324.428	2.429	10	0		DEAEHN
COc1cc(F)c(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1OC	ZINC000246576624	145107302	/nfs/dbraw/zinc/10/73/02/145107302.db2.gz	SFIFNDUDTWLKIF-NEPJUHHUSA-N	0	3	322.380	2.152	10	0		DEAEHN
C[C@@H](CN1CC[C@@H](Cc2ccc(F)cc2)C1)CS(C)(=O)=O	ZINC000246577533	145107656	/nfs/dbraw/zinc/10/76/56/145107656.db2.gz	OJDQNQVCWYIOIO-ZFWWWQNUSA-N	0	3	313.438	2.371	10	0		DEAEHN
C[C@@H]1CN(C[C@@H](O)c2cccc(Cl)c2)C[C@@H]1N1CCOCC1	ZINC000246580488	145107705	/nfs/dbraw/zinc/10/77/05/145107705.db2.gz	WBWZPDRFBOHUJV-XOKHGSTOSA-N	0	3	324.852	2.026	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCN2CCC[C@H]2C1)Oc1ccccc1F	ZINC000247176369	145127986	/nfs/dbraw/zinc/12/79/86/145127986.db2.gz	RMMJKWWWSLUMEF-KBPBESRZSA-N	0	3	321.396	2.083	10	0		DEAEHN
C[C@H](C(=O)Nc1ccc(F)cc1F)N1CCN2CCC[C@H]2C1	ZINC000247227271	145129320	/nfs/dbraw/zinc/12/93/20/145129320.db2.gz	QZVSKRYDEWEFGC-YPMHNXCESA-N	0	3	309.360	2.072	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1c[nH]nc1-c1ccccc1	ZINC000247246638	145131062	/nfs/dbraw/zinc/13/10/62/145131062.db2.gz	YMPOOPJRCSOFFJ-HIFRSBDPSA-N	0	3	310.401	2.385	10	0		DEAEHN
CC(C)OC[C@H](O)CN1CCC[C@H]1C[C@@H](O)c1cccs1	ZINC000247281541	145131719	/nfs/dbraw/zinc/13/17/19/145131719.db2.gz	XKMUMBJRMKHNGA-RRFJBIMHSA-N	0	3	313.463	2.422	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)N(C)[C@H]2CCCN(C)C2)c1	ZINC000247318432	145133131	/nfs/dbraw/zinc/13/31/31/145133131.db2.gz	HXBVHSTYPKDPKY-XIRDDKMYSA-N	0	3	302.418	2.351	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)CSC[C@H]2CCCCO2)CCN1C	ZINC000247442020	145137363	/nfs/dbraw/zinc/13/73/63/145137363.db2.gz	PNPONEWIJXXZAI-RBSFLKMASA-N	0	3	314.495	2.230	10	0		DEAEHN
Cc1cccc(CS(=O)(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c1	ZINC000247537471	145140139	/nfs/dbraw/zinc/14/01/39/145140139.db2.gz	PTDAOCHPPHTERL-IAGOWNOFSA-N	0	3	322.474	2.241	10	0		DEAEHN
Cc1cc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)nn1C(C)(C)C	ZINC000247556763	145140774	/nfs/dbraw/zinc/14/07/74/145140774.db2.gz	ZSYONWJUBJOWPS-KGLIPLIRSA-N	0	3	304.438	2.255	10	0		DEAEHN
Cc1ccc(OC[C@@H](O)CN2CCN3CCCC[C@H]3C2)c(C)c1	ZINC000248330915	145151417	/nfs/dbraw/zinc/15/14/17/145151417.db2.gz	DSNCTBSWERTCTO-ROUUACIJSA-N	0	3	318.461	2.213	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCc1cccnc1	ZINC000248389125	145152517	/nfs/dbraw/zinc/15/25/17/145152517.db2.gz	GEZQCFLHFARIPX-CRAIPNDOSA-N	0	3	324.428	2.401	10	0		DEAEHN
C[C@@H]1C[C@H](C(=O)NC[C@@H](O)CN2CCCCC2)CC(C)(C)C1	ZINC000248409751	145153417	/nfs/dbraw/zinc/15/34/17/145153417.db2.gz	GFQMFTQJKJKHEG-OWCLPIDISA-N	0	3	310.482	2.412	10	0		DEAEHN
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1C[C@H]1C1CCCCC1	ZINC000248683456	145163905	/nfs/dbraw/zinc/16/39/05/145163905.db2.gz	GKKRTRQPGWBCHM-BPQIPLTHSA-N	0	3	321.509	2.345	10	0		DEAEHN
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1C[C@@H](O)CCc1ccccc1	ZINC000248809598	145168533	/nfs/dbraw/zinc/16/85/33/145168533.db2.gz	HKZLVUAIWHVJBY-FJIDUMEYSA-N	0	3	317.429	2.254	10	0		DEAEHN
CCOC1CC(CCNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)C1	ZINC000248862933	145170771	/nfs/dbraw/zinc/17/07/71/145170771.db2.gz	BKMIGLBZIISAKM-UIDBIOKJSA-N	0	3	311.470	2.316	10	0		DEAEHN
CCCCNC(=O)[C@H](C)N1CC[C@@H](CNc2ccccn2)C1	ZINC000249858690	145190906	/nfs/dbraw/zinc/19/09/06/145190906.db2.gz	FCUKZMQSGUBTEO-GJZGRUSLSA-N	0	3	304.438	2.120	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@@H](C)N1CC[C@@H](CNc2ccccn2)C1	ZINC000249805998	145191102	/nfs/dbraw/zinc/19/11/02/145191102.db2.gz	BFPAPIHJEYMPMR-ZNMIVQPWSA-N	0	3	304.438	2.119	10	0		DEAEHN
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)N1CCN2CCC[C@H]2C1	ZINC000249824332	145191469	/nfs/dbraw/zinc/19/14/69/145191469.db2.gz	JEVGLKVLJLCFQO-NEPJUHHUSA-N	0	3	310.344	2.039	10	0		DEAEHN
CCCCNC(=O)[C@@H](C)N1CC[C@@H](CNc2ccccn2)C1	ZINC000249858688	145191491	/nfs/dbraw/zinc/19/14/91/145191491.db2.gz	FCUKZMQSGUBTEO-CABCVRRESA-N	0	3	304.438	2.120	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COCc2ccccc2F)CC[C@H]1C	ZINC000251602773	145195078	/nfs/dbraw/zinc/19/50/78/145195078.db2.gz	FVWAKVPPKJNRKK-FRFSOERESA-N	0	3	311.397	2.060	10	0		DEAEHN
COC(=O)C(C)(C)CCN1CCNC[C@H]1c1ccccc1OC	ZINC000261650471	145213753	/nfs/dbraw/zinc/21/37/53/145213753.db2.gz	BBYSCBDUNHEDCK-HNNXBMFYSA-N	0	3	320.433	2.231	10	0		DEAEHN
CO[C@@H](C)c1nc(CN2CCNC[C@@H]2c2cccnc2)cs1	ZINC000261868314	145235482	/nfs/dbraw/zinc/23/54/82/145235482.db2.gz	XBDLHQMQAKXSRD-SWLSCSKDSA-N	0	3	318.446	2.392	10	0		DEAEHN
CC(=O)Nc1cccc(N[C@@H]2CCC[C@@H]2[C@H]2COCCN2)c1	ZINC000261952218	145246521	/nfs/dbraw/zinc/24/65/21/145246521.db2.gz	OLOHDWZWYPDLIA-GVDBMIGSSA-N	0	3	303.406	2.214	10	0		DEAEHN
c1sc(CN[C@@H]2CCC[C@@H]2[C@@H]2COCCN2)nc1C1CC1	ZINC000261995513	145251538	/nfs/dbraw/zinc/25/15/38/145251538.db2.gz	TZCUMPKSJBHTDZ-MJBXVCDLSA-N	0	3	307.463	2.267	10	0		DEAEHN
C[C@H](NC(=O)C[C@H]1CNCCO1)c1ccc(C(F)(F)F)cc1	ZINC000262113581	145263260	/nfs/dbraw/zinc/26/32/60/145263260.db2.gz	JYIAJEDUIIBZRY-GWCFXTLKSA-N	0	3	316.323	2.261	10	0		DEAEHN
c1cnn(-c2ccc(CN3CCNC[C@H]3c3cccnc3)cc2)c1	ZINC000262232524	145270770	/nfs/dbraw/zinc/27/07/70/145270770.db2.gz	OCXDOJYMWOVYLW-IBGZPJMESA-N	0	3	319.412	2.414	10	0		DEAEHN
NC1(C(=O)N2CCC[C@H](c3noc(C4CC4)n3)C2)CCCCC1	ZINC000262475753	145286682	/nfs/dbraw/zinc/28/66/82/145286682.db2.gz	PNNNEOVDYZRKAR-ZDUSSCGKSA-N	0	3	318.421	2.315	10	0		DEAEHN
CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)[C@H](N)CCSC	ZINC000262533777	145290471	/nfs/dbraw/zinc/29/04/71/145290471.db2.gz	IZEMRRYVZWDNCW-HONMWMINSA-N	0	3	314.426	2.098	10	0		DEAEHN
Cc1ccc(C(C)(C)c2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263169251	145331479	/nfs/dbraw/zinc/33/14/79/145331479.db2.gz	FNYMMRQFANEVKQ-AWEZNQCLSA-N	0	3	300.406	2.280	10	0		DEAEHN
Cc1cc(C)c(OCc2nc([C@H]3CNCCN3C)no2)c(C)c1	ZINC000263176511	145332760	/nfs/dbraw/zinc/33/27/60/145332760.db2.gz	GGGBMSYKGHHAMN-CQSZACIVSA-N	0	3	316.405	2.150	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2csc(-c3ccoc3)n2)n1	ZINC000263190905	145334132	/nfs/dbraw/zinc/33/41/32/145334132.db2.gz	HXOQEXWVUQRZSA-LLVKDONJSA-N	0	3	317.374	2.029	10	0		DEAEHN
CC(=O)CCC(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000309812877	145350606	/nfs/dbraw/zinc/35/06/06/145350606.db2.gz	XBMHPRCTAJRZST-FGTMMUONSA-N	0	3	314.429	2.382	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NCc1c(Br)cnn1C	ZINC000336793069	145397656	/nfs/dbraw/zinc/39/76/56/145397656.db2.gz	VHSIRHBVCNVHAK-LLVKDONJSA-N	0	3	317.275	2.249	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@@H]1CCO[C@@H](C2CC2)C1	ZINC000291703144	404486045	/nfs/dbraw/zinc/48/60/45/404486045.db2.gz	KIGZHONNIOJXQA-SJLPKXTDSA-N	0	3	312.417	2.374	10	0		DEAEHN
COC(=O)[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)C1CC1	ZINC000358834001	147215974	/nfs/dbraw/zinc/21/59/74/147215974.db2.gz	OIBPDBZXMFWHSD-KRWDZBQOSA-N	0	3	320.408	2.331	10	0		DEAEHN
Cc1ccc(CCC(=O)N2CCCN([C@@H](C)CO)CC2)c(C)c1	ZINC000375500439	148379963	/nfs/dbraw/zinc/37/99/63/148379963.db2.gz	YLIZCTYNQHRLTR-KRWDZBQOSA-N	0	3	318.461	2.151	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cc(F)cc3nc[nH]c32)CCN1C	ZINC000127634653	401743404	/nfs/dbraw/zinc/74/34/04/401743404.db2.gz	NYMRPTFDUUZBKS-PWSUYJOCSA-N	0	3	304.369	2.257	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)NCCc2cc(F)ccc2F)CN1C1CC1	ZINC000126444433	401694244	/nfs/dbraw/zinc/69/42/44/401694244.db2.gz	LIXQQTXPICYXTH-RISCZKNCSA-N	0	3	323.387	2.432	10	0		DEAEHN
CNc1cc(N2CCC[C@H]2CN[C@@H](C)c2ccncc2)ncn1	ZINC000111227151	401701411	/nfs/dbraw/zinc/70/14/11/401701411.db2.gz	NBPAKKRERLVBBF-ZFWWWQNUSA-N	0	3	312.421	2.233	10	0		DEAEHN
CC(C)N1CCN(c2ccc(C(=O)N[C@@H]3C[C@@H]3C)cc2)CC1	ZINC000072094589	401703536	/nfs/dbraw/zinc/70/35/36/401703536.db2.gz	WYPZUWOKMSEQFQ-WMLDXEAASA-N	0	3	301.434	2.355	10	0		DEAEHN
Cc1ccc(OCC(=O)N2C[C@H]3CCCN3C[C@@H]2C)c(C)c1	ZINC000113232001	401771475	/nfs/dbraw/zinc/77/14/75/401771475.db2.gz	JUYCSCGXXLMNFU-JKSUJKDBSA-N	0	3	302.418	2.377	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(-c2ccccc2)n[nH]1	ZINC000113233414	401772250	/nfs/dbraw/zinc/77/22/50/401772250.db2.gz	SAGRMXFEEAITBB-UKRRQHHQSA-N	0	3	310.401	2.385	10	0		DEAEHN
C[C@H]1C[C@H]1NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000075977736	401775885	/nfs/dbraw/zinc/77/58/85/401775885.db2.gz	JCZGTTGCONOIKO-WMLDXEAASA-N	0	3	301.434	2.401	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000113305293	401775887	/nfs/dbraw/zinc/77/58/87/401775887.db2.gz	LNWJQFNZJUEBIU-DGCLKSJQSA-N	0	3	314.838	2.197	10	0		DEAEHN
CCc1nn(C)c(CC)c1CN1CC[C@@H](c2cnn(C)c2)C1	ZINC000128558348	401782753	/nfs/dbraw/zinc/78/27/53/401782753.db2.gz	PTBYRDYTSBZBSE-CYBMUJFWSA-N	0	3	301.438	2.268	10	0		DEAEHN
CC(C)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000115158136	401819865	/nfs/dbraw/zinc/81/98/65/401819865.db2.gz	XAHMLEBKPYMODB-KRWDZBQOSA-N	0	3	304.434	2.204	10	0		DEAEHN
CC(C)(CNC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccncc1	ZINC000130266236	401824879	/nfs/dbraw/zinc/82/48/79/401824879.db2.gz	GUIVWLFZQOGYNS-MRXNPFEDSA-N	0	3	314.433	2.015	10	0		DEAEHN
CCN(C)C(=O)CCN1CCC[C@@H]1c1ccc2c(c1)OCO2	ZINC000130322896	401826880	/nfs/dbraw/zinc/82/68/80/401826880.db2.gz	XPTQBWUKHJKSMW-CQSZACIVSA-N	0	3	304.390	2.421	10	0		DEAEHN
Cc1ccc(NC(=O)N[C@H](C)[C@H](C)CO)c(OCCN(C)C)c1	ZINC000077722779	401827176	/nfs/dbraw/zinc/82/71/76/401827176.db2.gz	NIHPOIDGJCHVIB-ZIAGYGMSSA-N	0	3	323.437	2.074	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H]1COc2ccccc2C1	ZINC000077729992	401827871	/nfs/dbraw/zinc/82/78/71/401827871.db2.gz	UISSMDHSUFKBJB-HOTGVXAUSA-N	0	3	304.434	2.330	10	0		DEAEHN
COc1cccc(N2CCC[C@H](NC(=O)CN(C)C(C)C)C2)c1	ZINC000117270136	401871293	/nfs/dbraw/zinc/87/12/93/401871293.db2.gz	WWCBDOOTIZECDA-HNNXBMFYSA-N	0	3	319.449	2.120	10	0		DEAEHN
COCCN(C)CCCNC(=O)N1CCC[C@H]1c1ccco1	ZINC000116532527	401854216	/nfs/dbraw/zinc/85/42/16/401854216.db2.gz	YCFWPHNLXLUVAU-AWEZNQCLSA-N	0	3	309.410	2.094	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc([S@@](C)=O)cc1	ZINC000078615037	401858398	/nfs/dbraw/zinc/85/83/98/401858398.db2.gz	BFSBZIWQAMLUFI-QKKBWIMNSA-N	0	3	310.463	2.130	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@H](CN(C)C)C1)c1ccccc1	ZINC000116786492	401859476	/nfs/dbraw/zinc/85/94/76/401859476.db2.gz	YTHBFBSBSXNGAC-IAGOWNOFSA-N	0	3	304.434	2.359	10	0		DEAEHN
C[C@H](CC(=O)N1CCO[C@H](CN(C)C)C1)c1cccc(F)c1	ZINC000116797051	401860010	/nfs/dbraw/zinc/86/00/10/401860010.db2.gz	UVDRMOPECBOVLU-CZUORRHYSA-N	0	3	308.397	2.108	10	0		DEAEHN
CCCc1cc(C(=O)N[C@@H](CN(C)C)c2ccccc2)[nH]n1	ZINC000030027784	401861191	/nfs/dbraw/zinc/86/11/91/401861191.db2.gz	WQTLZSXJUXVVRX-INIZCTEOSA-N	0	3	300.406	2.395	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1ccc(OC)c(C)c1	ZINC000030375370	401862831	/nfs/dbraw/zinc/86/28/31/401862831.db2.gz	OSARNDDXGZEUFY-CYBMUJFWSA-N	0	3	314.451	2.012	10	0		DEAEHN
Cc1c(C(=O)N(C)CCN(C)C)cnn1-c1ccccc1Cl	ZINC000080390434	401889917	/nfs/dbraw/zinc/88/99/17/401889917.db2.gz	NRZOHDHVMIAJDW-UHFFFAOYSA-N	0	3	320.824	2.468	10	0		DEAEHN
Cc1ccc(F)c(S(=O)(=O)[N-]CC2([NH3+])CCCCCC2)c1	ZINC000036266777	401903774	/nfs/dbraw/zinc/90/37/74/401903774.db2.gz	AOFYAWCFHNPSHB-UHFFFAOYSA-N	0	3	314.426	2.464	10	0		DEAEHN
O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)[C@@H]1C[C@@H](O)CN1	ZINC000036720537	401907254	/nfs/dbraw/zinc/90/72/54/401907254.db2.gz	UENRKFXTROXAJT-XCBNKYQSSA-N	0	3	308.687	2.020	10	0		DEAEHN
C[C@H](CCc1ccc(OC(F)F)cc1)NCCS(C)(=O)=O	ZINC000037740493	401917057	/nfs/dbraw/zinc/91/70/57/401917057.db2.gz	YSPZUYYOJFVPCK-LLVKDONJSA-N	0	3	321.389	2.243	10	0		DEAEHN
CN(C)CCn1c2cc(NC(=O)[C@@H]3CC3(C)C)ccc2oc1=O	ZINC000119583719	401960234	/nfs/dbraw/zinc/96/02/34/401960234.db2.gz	MTUCMJVOFMWKPU-LBPRGKRZSA-N	0	3	317.389	2.141	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1	ZINC000119955136	401972677	/nfs/dbraw/zinc/97/26/77/401972677.db2.gz	DFVWVZZRVYSAOJ-STQMWFEESA-N	0	3	322.478	2.342	10	0		DEAEHN
CCOc1ccccc1OCC(=O)NCCN1CCCC[C@H]1C	ZINC000046859337	401974227	/nfs/dbraw/zinc/97/42/27/401974227.db2.gz	JSDGBGMABOMQHG-OAHLLOKOSA-N	0	3	320.433	2.455	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(C(=O)CN2CCC(C)CC2)C1	ZINC000136813894	401974221	/nfs/dbraw/zinc/97/42/21/401974221.db2.gz	GJPYWWXKNDWPIB-MRXNPFEDSA-N	0	3	318.465	2.341	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C)N(C)C	ZINC000137056045	401977870	/nfs/dbraw/zinc/97/78/70/401977870.db2.gz	FEMQWDFHZIAPPO-HOTGVXAUSA-N	0	3	309.429	2.275	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H]1CCN(C)c2ccccc21)N(C)C	ZINC000137717154	401985180	/nfs/dbraw/zinc/98/51/80/401985180.db2.gz	FECJXLLRYQLVAX-YOEHRIQHSA-N	0	3	303.450	2.457	10	0		DEAEHN
CN(C)CCNC(=O)c1c[nH]c2cccc(Br)c12	ZINC000090988637	401989729	/nfs/dbraw/zinc/98/97/29/401989729.db2.gz	UELHPQPNUDZJFI-UHFFFAOYSA-N	0	3	310.195	2.222	10	0		DEAEHN
COCCN1CCC[C@H]1CN[C@H](C)c1nc2ccccc2n1C	ZINC000091318956	401996273	/nfs/dbraw/zinc/99/62/73/401996273.db2.gz	MVIZEKFTCVPOCF-CABCVRRESA-N	0	3	316.449	2.335	10	0		DEAEHN
Cc1nn(C)c(CNC[C@@H]2CCCC[C@@H]2O)c1Br	ZINC000089233361	401940156	/nfs/dbraw/zinc/94/01/56/401940156.db2.gz	JSHSEUIYKBINMF-JQWIXIFHSA-N	0	3	316.243	2.132	10	0		DEAEHN
COC(=O)[C@H]1C[C@@H](c2ccccc2)CN(Cc2cnn(C)c2)C1	ZINC000135457749	401940411	/nfs/dbraw/zinc/94/04/11/401940411.db2.gz	RBBFZGSUGVVROE-SJORKVTESA-N	0	3	313.401	2.199	10	0		DEAEHN
COc1cccc(C(=O)N2CCC[C@H]([NH+]3CCCC3)CC2)c1[O-]	ZINC000150808679	401996680	/nfs/dbraw/zinc/99/66/80/401996680.db2.gz	JAGMOIBTCKPCHI-AWEZNQCLSA-N	0	3	318.417	2.491	10	0		DEAEHN
NC[C@@H](N)c1cc(Br)c(Br)s1	ZINC000044470147	401943654	/nfs/dbraw/zinc/94/36/54/401943654.db2.gz	HLKUIHXLGJILOK-SCSAIBSYSA-N	0	3	300.019	2.232	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H](C)Oc1cccc(OC)c1)N(C)C	ZINC000121193919	402019426	/nfs/dbraw/zinc/01/94/26/402019426.db2.gz	MEYKZTWDOJDOCB-CZUORRHYSA-N	0	3	308.422	2.309	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)NCc1cccc2c1OCO2	ZINC000052524769	402043537	/nfs/dbraw/zinc/04/35/37/402043537.db2.gz	NPFXBHHVLXREOG-ZDUSSCGKSA-N	0	3	319.405	2.089	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2cccc(COC)c2)C1	ZINC000052525454	402043972	/nfs/dbraw/zinc/04/39/72/402043972.db2.gz	UJRAMGVAVDDSHE-MRXNPFEDSA-N	0	3	305.422	2.117	10	0		DEAEHN
CSc1ccc(O[C@H](C)C(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000151601546	402045831	/nfs/dbraw/zinc/04/58/31/402045831.db2.gz	CEZCGSIKLQPWIH-OLZOCXBDSA-N	0	3	308.447	2.338	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2CC(c3ccccc3)=NO2)CCN1C	ZINC000122774562	402094155	/nfs/dbraw/zinc/09/41/55/402094155.db2.gz	KGIPZQHUSPTEAO-KMFMINBZSA-N	0	3	315.417	2.121	10	0		DEAEHN
Cc1cc(F)cc(NC(=O)NC[C@@H](O)CN2CCCCC2)c1	ZINC000152766235	402107633	/nfs/dbraw/zinc/10/76/33/402107633.db2.gz	YOMROGRVUWCWFQ-OAHLLOKOSA-N	0	3	309.385	2.102	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2Cc3cc(F)ccc3O2)CCN1C	ZINC000123466771	402129167	/nfs/dbraw/zinc/12/91/67/402129167.db2.gz	NNOVPMODMPDZPV-XFJVYGCCSA-N	0	3	306.381	2.070	10	0		DEAEHN
CCOc1ccc(OCC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1	ZINC000123681340	402141452	/nfs/dbraw/zinc/14/14/52/402141452.db2.gz	YTQOCHDSQPPNFH-CABCVRRESA-N	0	3	320.433	2.405	10	0		DEAEHN
CCCN(C)[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000123554225	402134100	/nfs/dbraw/zinc/13/41/00/402134100.db2.gz	IVNTTZAYVMZKIA-NVXWUHKLSA-N	0	3	303.450	2.107	10	0		DEAEHN
Cn1ccnc1C[C@@H]1CCCN(CC(=O)Nc2ccccc2)C1	ZINC000123649187	402139888	/nfs/dbraw/zinc/13/98/88/402139888.db2.gz	ZZPYPXFVQISRMI-HNNXBMFYSA-N	0	3	312.417	2.313	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1C	ZINC000123673236	402140755	/nfs/dbraw/zinc/14/07/55/402140755.db2.gz	FSNDEOQXYLAUMP-QMTHXVAHSA-N	0	3	305.422	2.389	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCc1ccc2c(c1)OCO2	ZINC000123340915	402122631	/nfs/dbraw/zinc/12/26/31/402122631.db2.gz	DDIKKLAAYFDRLZ-AWEZNQCLSA-N	0	3	321.421	2.191	10	0		DEAEHN
C[C@@H](NC[C@H](C)N1CCOCC1)c1cc(F)c(F)c(F)c1	ZINC000123359982	402123812	/nfs/dbraw/zinc/12/38/12/402123812.db2.gz	IAKAHRJMYDSNNC-WDEREUQCSA-N	0	3	302.340	2.475	10	0		DEAEHN
Cc1cc(=O)[nH]cc1C(=O)N(CCN(C)C)CC1CCCCC1	ZINC000123811042	402147817	/nfs/dbraw/zinc/14/78/17/402147817.db2.gz	GKECLDFCFOEYBJ-UHFFFAOYSA-N	0	3	319.449	2.267	10	0		DEAEHN
COC[C@@H](C)C(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000103433020	402188055	/nfs/dbraw/zinc/18/80/55/402188055.db2.gz	YBRYMRXRNQGFER-ZIAGYGMSSA-N	0	3	310.463	2.359	10	0		DEAEHN
Cc1ccc([C@@H]2CCCCN2CCCN2C(=O)CNC2=O)o1	ZINC000124622395	402188534	/nfs/dbraw/zinc/18/85/34/402188534.db2.gz	CMRCCGITEHOIMK-ZDUSSCGKSA-N	0	3	305.378	2.057	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)N1CCN2CCCC[C@@H]2C1	ZINC000154105088	402193174	/nfs/dbraw/zinc/19/31/74/402193174.db2.gz	NUWNZLIYHIQAJI-DLBZAZTESA-N	0	3	322.497	2.131	10	0		DEAEHN
COc1cccc2c(N3CCO[C@H](CN(C)C)C3)cc(C)nc12	ZINC000124919388	402203939	/nfs/dbraw/zinc/20/39/39/402203939.db2.gz	GUUCFLBTHXELNV-CQSZACIVSA-N	0	3	315.417	2.319	10	0		DEAEHN
CCc1ccc(C(=O)CCC(=O)NC[C@H]2CCN(C)C2)cc1	ZINC000104188465	402200125	/nfs/dbraw/zinc/20/01/25/402200125.db2.gz	PQXSDJDQBMEZGX-OAHLLOKOSA-N	0	3	302.418	2.280	10	0		DEAEHN
COc1cc([C@H](C)N[C@H](C)CN2CCN(C)CC2)ccc1F	ZINC000153675577	402161775	/nfs/dbraw/zinc/16/17/75/402161775.db2.gz	SKVQGRUACBIWCS-KGLIPLIRSA-N	0	3	309.429	2.121	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000106458431	402213848	/nfs/dbraw/zinc/21/38/48/402213848.db2.gz	YUCFDCOSKSMKLR-SJLPKXTDSA-N	0	3	317.477	2.007	10	0		DEAEHN
CC[C@H](C(=O)N[C@@H](C)c1cccc(-n2ccnc2)c1)N(C)C	ZINC000125366659	402228401	/nfs/dbraw/zinc/22/84/01/402228401.db2.gz	VOQDMVIAMOGQHU-XJKSGUPXSA-N	0	3	300.406	2.390	10	0		DEAEHN
C[C@@H]1CN(CC2CCN(C(=O)C3=COCCC3)CC2)C[C@@H](C)O1	ZINC000107586593	402236003	/nfs/dbraw/zinc/23/60/03/402236003.db2.gz	WABIYFXKCPOAGX-HUUCEWRRSA-N	0	3	322.449	2.029	10	0		DEAEHN
COc1ccc([C@@H](C)NC[C@@]2(CCO)CCOC2)c(OC)c1	ZINC000125744837	402248038	/nfs/dbraw/zinc/24/80/38/402248038.db2.gz	QZWWYKYEMFTUQK-CXAGYDPISA-N	0	3	309.406	2.144	10	0		DEAEHN
CCN1CC[C@H](N(C)C(=O)[C@H]2C[C@@H](C(C)=O)C2(C)C)[C@H](C)C1	ZINC000154335691	402206615	/nfs/dbraw/zinc/20/66/15/402206615.db2.gz	RWLQURBLOQPZOE-BVUBDWEXSA-N	0	3	308.466	2.426	10	0		DEAEHN
CNC(=O)[C@@H](NCc1ccc(Br)s1)C(C)C	ZINC000125027752	402209457	/nfs/dbraw/zinc/20/94/57/402209457.db2.gz	JRQYHQCHTZDKAC-JTQLQIEISA-N	0	3	305.241	2.371	10	0		DEAEHN
CC1(C)C[C@H]1C(=O)NCc1ccccc1CN1CCC[C@@H]1CO	ZINC000125061851	402211414	/nfs/dbraw/zinc/21/14/14/402211414.db2.gz	QNCOZDSNWFCUCD-SJORKVTESA-N	0	3	316.445	2.306	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCc1cccc(O)c1	ZINC000176308383	402298392	/nfs/dbraw/zinc/29/83/92/402298392.db2.gz	HHBXJIDYEVMFHM-OAHLLOKOSA-N	0	3	305.422	2.060	10	0		DEAEHN
Cc1ccc([O-])c(C[NH2+]CC[C@H](C)NC(=O)OC(C)(C)C)n1	ZINC000222079351	402305459	/nfs/dbraw/zinc/30/54/59/402305459.db2.gz	ZBQNPJITWDFFKC-LBPRGKRZSA-N	0	3	309.410	2.489	10	0		DEAEHN
CC(C)[C@@](C)(O)CN1CCCN(C(=O)c2ccccc2)CC1	ZINC000184955755	402312360	/nfs/dbraw/zinc/31/23/60/402312360.db2.gz	JFRJMSKSHYWSEB-SFHVURJKSA-N	0	3	304.434	2.242	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)C/C=C/c1cccc(F)c1	ZINC000176494494	402314488	/nfs/dbraw/zinc/31/44/88/402314488.db2.gz	QLHVRGCHABGJNQ-ZNNBYXKUSA-N	0	3	320.408	2.456	10	0		DEAEHN
CC(C)c1nnc(CCC(=O)NCCN2CCCC[C@@H]2C)o1	ZINC000176558905	402319685	/nfs/dbraw/zinc/31/96/85/402319685.db2.gz	VCYPHTAIVMYNIP-ZDUSSCGKSA-N	0	3	308.426	2.116	10	0		DEAEHN
CC[C@@H](CNC(=O)N1CC[C@@H](N(C)C)C1)Oc1cccc(C)c1	ZINC000176841416	402342319	/nfs/dbraw/zinc/34/23/19/402342319.db2.gz	DMJRWWCCRCLJGH-CVEARBPZSA-N	0	3	319.449	2.498	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CNC(=O)CC1CCCCC1	ZINC000177002677	402358209	/nfs/dbraw/zinc/35/82/09/402358209.db2.gz	BXBISOOYHRMKPZ-INIZCTEOSA-N	0	3	323.481	2.016	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CNC(=O)CC1CCCCC1	ZINC000177001775	402358259	/nfs/dbraw/zinc/35/82/59/402358259.db2.gz	BXBISOOYHRMKPZ-MRXNPFEDSA-N	0	3	323.481	2.016	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CCc1nc(C(C)(C)C)no1	ZINC000177031429	402361842	/nfs/dbraw/zinc/36/18/42/402361842.db2.gz	QDRGVKFRHRMDSZ-CYBMUJFWSA-N	0	3	322.453	2.242	10	0		DEAEHN
CNc1cc(N2CCC[C@H]2CN[C@@H](C)c2ccccn2)ncn1	ZINC000177125783	402372410	/nfs/dbraw/zinc/37/24/10/402372410.db2.gz	ZFUIQSGNJRGQSW-KBPBESRZSA-N	0	3	312.421	2.233	10	0		DEAEHN
COCc1ccc(C(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)o1	ZINC000176693989	402328903	/nfs/dbraw/zinc/32/89/03/402328903.db2.gz	WBAXVYTYXVUBCI-KBPBESRZSA-N	0	3	324.421	2.045	10	0		DEAEHN
CC(C)O[C@H]1C[C@H](NCc2cccnc2-n2cncn2)C1(C)C	ZINC000185198577	402333424	/nfs/dbraw/zinc/33/34/24/402333424.db2.gz	CKMWMUDBVBYYHM-GJZGRUSLSA-N	0	3	315.421	2.344	10	0		DEAEHN
COc1cc(C[NH2+]CCC[C@H](C)O)cc(Br)c1[O-]	ZINC000227954706	402334799	/nfs/dbraw/zinc/33/47/99/402334799.db2.gz	LRZASHZSRGGXMW-VIFPVBQESA-N	0	3	318.211	2.414	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1cccc(COC)c1	ZINC000177396694	402398042	/nfs/dbraw/zinc/39/80/42/402398042.db2.gz	LBGGSJXFBSJIHV-KRWDZBQOSA-N	0	3	319.449	2.459	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cc(OC)c(OC)cc2F)C1	ZINC000177409094	402399431	/nfs/dbraw/zinc/39/94/31/402399431.db2.gz	LQEWFVTWWKBQQO-NSHDSACASA-N	0	3	310.369	2.057	10	0		DEAEHN
C[C@H](NC(=O)[C@@H](N)C(C)(C)C)c1ccccc1-n1cccn1	ZINC000237429822	402408501	/nfs/dbraw/zinc/40/85/01/402408501.db2.gz	DWQPYWRRQTWZEG-SWLSCSKDSA-N	0	3	300.406	2.423	10	0		DEAEHN
N[C@H](CC(=O)NC[C@@H]1COc2ccccc2O1)c1ccccc1	ZINC000237858469	402423098	/nfs/dbraw/zinc/42/30/98/402423098.db2.gz	MBEQPOALTHHUBO-HUUCEWRRSA-N	0	3	312.369	2.033	10	0		DEAEHN
Cc1nc(-c2ccccc2)ncc1C(=O)N1CC[C@H](N(C)C)C1	ZINC000162600428	402425476	/nfs/dbraw/zinc/42/54/76/402425476.db2.gz	UYXLSIPFUOHXSP-HNNXBMFYSA-N	0	3	310.401	2.228	10	0		DEAEHN
N[C@@H](Cc1ccccc1)C(=O)N1CCO[C@H](c2cccs2)C1	ZINC000238075707	402436558	/nfs/dbraw/zinc/43/65/58/402436558.db2.gz	QYVMOCBBCPOGSQ-GJZGRUSLSA-N	0	3	316.426	2.218	10	0		DEAEHN
COc1cc(F)c(NC(=O)N2CCN3CCC[C@H]3C2)cc1F	ZINC000177355752	402394404	/nfs/dbraw/zinc/39/44/04/402394404.db2.gz	MPIWTWDYDRJKKA-JTQLQIEISA-N	0	3	311.332	2.285	10	0		DEAEHN
COCCOc1ccc(CN2CCS[C@H]3COCC[C@H]32)cc1	ZINC000246122757	402511788	/nfs/dbraw/zinc/51/17/88/402511788.db2.gz	KKSALMINTMAXJP-SJORKVTESA-N	0	3	323.458	2.418	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NC1Cc2ccccc2C1	ZINC000186694410	402456359	/nfs/dbraw/zinc/45/63/59/402456359.db2.gz	FHCXKRNOYLRDFN-KRWDZBQOSA-N	0	3	301.434	2.280	10	0		DEAEHN
CC[C@@H]1CN(CCNS(C)(=O)=O)CC[C@H]1c1ccccc1	ZINC000245410447	402457550	/nfs/dbraw/zinc/45/75/50/402457550.db2.gz	RBERKAMGHLFWLM-GDBMZVCRSA-N	0	3	310.463	2.051	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@H](c1ccccc1)N(C)C	ZINC000245426331	402459352	/nfs/dbraw/zinc/45/93/52/402459352.db2.gz	FYYBZYIOKPSCNK-SJORKVTESA-N	0	3	303.450	2.232	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C[C@H]1c2ccccc2NC1=O	ZINC000245428836	402459727	/nfs/dbraw/zinc/45/97/27/402459727.db2.gz	JOGVCEWJAIKGFZ-HIFRSBDPSA-N	0	3	315.417	2.055	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c1	ZINC000245455063	402462016	/nfs/dbraw/zinc/46/20/16/402462016.db2.gz	SJFRDAOLIFJCEO-FZCLSBEQSA-N	0	3	314.429	2.494	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@H](COC)c1ccco1	ZINC000245463358	402463188	/nfs/dbraw/zinc/46/31/88/402463188.db2.gz	HEAIIMPCXZJNKM-UONOGXRCSA-N	0	3	309.410	2.093	10	0		DEAEHN
COc1cccc([C@@H](C)N[C@@H](C(=O)N2CCOCC2)C(C)C)c1	ZINC000164898198	402470246	/nfs/dbraw/zinc/47/02/46/402470246.db2.gz	HMSSADFNGIQTHI-RHSMWYFYSA-N	0	3	320.433	2.229	10	0		DEAEHN
CC(C)COC(=O)N1CCCN(C[C@@](C)(O)C(C)C)CC1	ZINC000186915996	402471110	/nfs/dbraw/zinc/47/11/10/402471110.db2.gz	GJQYAPKIIYUHIA-MRXNPFEDSA-N	0	3	300.443	2.194	10	0		DEAEHN
COc1ccc2nc(CN3CCO[C@H](CN(C)C)C3)sc2c1	ZINC000186991104	402476774	/nfs/dbraw/zinc/47/67/74/402476774.db2.gz	WNCOFQFXDCAVAX-CYBMUJFWSA-N	0	3	321.446	2.067	10	0		DEAEHN
Cc1c(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cnn1CC(C)C	ZINC000245703493	402480856	/nfs/dbraw/zinc/48/08/56/402480856.db2.gz	CTQGWRYOOPHXTI-ZFWWWQNUSA-N	0	3	306.454	2.402	10	0		DEAEHN
C[C@@H]1CN(C[C@H]2CCCN(S(C)(=O)=O)C2)[C@H]1c1ccccc1	ZINC000246154892	402513129	/nfs/dbraw/zinc/51/31/29/402513129.db2.gz	DHVZQEXMQKEUKB-BFYDXBDKSA-N	0	3	322.474	2.351	10	0		DEAEHN
CC[C@]1(C)C[C@H]1C(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000246151558	402513306	/nfs/dbraw/zinc/51/33/06/402513306.db2.gz	ZNXXKNYRBNFGCR-SOLBZPMBSA-N	0	3	307.482	2.051	10	0		DEAEHN
O=S(=O)(CC1CCCC1)N1CCCC[C@@H](N2CCCC2)C1	ZINC000178335642	402486506	/nfs/dbraw/zinc/48/65/06/402486506.db2.gz	UFWJSFXMIKUCII-MRXNPFEDSA-N	0	3	314.495	2.457	10	0		DEAEHN
CCCC(=O)N[C@@H]1CCCN([C@H]2Cc3ccccc3[C@@H]2O)C1	ZINC000245859414	402492054	/nfs/dbraw/zinc/49/20/54/402492054.db2.gz	OKJIMKRQQZYDPO-HFTRVMKXSA-N	0	3	302.418	2.025	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1csc([C@@H]2CCCO2)n1	ZINC000245881127	402493873	/nfs/dbraw/zinc/49/38/73/402493873.db2.gz	IARLFILKQYDICR-DYEKYZERSA-N	0	3	321.446	2.303	10	0		DEAEHN
CN(C)CCn1ccc(NCc2c[nH]c(-c3ccccc3)n2)n1	ZINC000178420407	402496643	/nfs/dbraw/zinc/49/66/43/402496643.db2.gz	DZZKLQFAJAULHG-UHFFFAOYSA-N	0	3	310.405	2.447	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCc2ccccc2F)C1	ZINC000245948771	402499583	/nfs/dbraw/zinc/49/95/83/402499583.db2.gz	SGCHPVBUAXPXAH-GOEBONIOSA-N	0	3	305.397	2.451	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCCc2ccccc2)C1	ZINC000245954695	402500184	/nfs/dbraw/zinc/50/01/84/402500184.db2.gz	TULBZDPYSYUYMJ-DLBZAZTESA-N	0	3	301.434	2.355	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N1CC[C@@H](N2CCCC2)C1	ZINC000187476385	402502344	/nfs/dbraw/zinc/50/23/44/402502344.db2.gz	CCKVIUMLLUCFPN-UONOGXRCSA-N	0	3	318.421	2.031	10	0		DEAEHN
O=C([C@@H]1C[C@H]1c1ccc(F)c(F)c1)N1CCN2CCC[C@H]2C1	ZINC000246027802	402504441	/nfs/dbraw/zinc/50/44/41/402504441.db2.gz	NMHZQBXHURNWSS-MELADBBJSA-N	0	3	306.356	2.375	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)Cc1ccccc1	ZINC000246047399	402505276	/nfs/dbraw/zinc/50/52/76/402505276.db2.gz	BYDXWZPKAGOZCW-CVEARBPZSA-N	0	3	308.447	2.075	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)c2ccccc2F)[C@@H](C)C1	ZINC000246048131	402505550	/nfs/dbraw/zinc/50/55/50/402505550.db2.gz	CCIZOMYJUGENNI-GXTWGEPZSA-N	0	3	314.426	2.177	10	0		DEAEHN
CN(Cc1cn(C)nc1-c1ccncc1)C[C@@H]1CCCC[C@H]1O	ZINC000246055970	402506120	/nfs/dbraw/zinc/50/61/20/402506120.db2.gz	YSCMWXDLXAQQKW-DOTOQJQBSA-N	0	3	314.433	2.465	10	0		DEAEHN
C[C@H]1CN(CCOc2cccc3ccccc32)CCN1CCO	ZINC000187712004	402509517	/nfs/dbraw/zinc/50/95/17/402509517.db2.gz	JBAHETXCJZNBJT-INIZCTEOSA-N	0	3	314.429	2.217	10	0		DEAEHN
O=C([C@H]1CCCCN1)N1CCC(Nc2ccccc2F)CC1	ZINC000178810413	402542758	/nfs/dbraw/zinc/54/27/58/402542758.db2.gz	GVXMIVPATSIDBC-MRXNPFEDSA-N	0	3	305.397	2.371	10	0		DEAEHN
CC(C)Oc1ccc(CN2CCN(C[C@@H](C)O)[C@H](C)C2)cc1	ZINC000170936598	402543266	/nfs/dbraw/zinc/54/32/66/402543266.db2.gz	PMXMJJXZFFMKML-HZPDHXFCSA-N	0	3	306.450	2.361	10	0		DEAEHN
CC(C)c1ccc([C@@H](C)NC(=O)NC[C@](C)(O)CN(C)C)cc1	ZINC000178920614	402555607	/nfs/dbraw/zinc/55/56/07/402555607.db2.gz	RIVMTPVXSKRFGZ-KDOFPFPSSA-N	0	3	321.465	2.483	10	0		DEAEHN
COC(=O)Nc1cc(NC(=O)N2CC[C@H](N(C)C)C2)ccc1F	ZINC000171084569	402555763	/nfs/dbraw/zinc/55/57/63/402555763.db2.gz	IUSPZEZZBJGSKS-NSHDSACASA-N	0	3	324.356	2.172	10	0		DEAEHN
CCOC(=O)C1CCN(C(=O)CN[C@H](C)c2cccs2)CC1	ZINC000171111045	402558785	/nfs/dbraw/zinc/55/87/85/402558785.db2.gz	NRNJDOFMSDBLOL-GFCCVEGCSA-N	0	3	324.446	2.200	10	0		DEAEHN
Clc1cc(CCNCc2cncnc2)cc2c1OCCO2	ZINC000171131653	402560365	/nfs/dbraw/zinc/56/03/65/402560365.db2.gz	DFQWRRXBEMLHNZ-UHFFFAOYSA-N	0	3	305.765	2.234	10	0		DEAEHN
COc1ccc(SCC(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1	ZINC000247313567	402563579	/nfs/dbraw/zinc/56/35/79/402563579.db2.gz	OESOVVQAXFSGEN-KBPBESRZSA-N	0	3	320.458	2.482	10	0		DEAEHN
CC(C)C[C@@H]1COCCN1C(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000247367952	402565001	/nfs/dbraw/zinc/56/50/01/402565001.db2.gz	OYRBBKGFMXCLMH-BZUAXINKSA-N	0	3	311.470	2.172	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2cc(Br)c[nH]2)C1	ZINC000247508236	402570287	/nfs/dbraw/zinc/57/02/87/402570287.db2.gz	YDZNXITUJVPSNH-JOYOIKCWSA-N	0	3	314.227	2.236	10	0		DEAEHN
O=C(c1cnn2c1CCCC2)N1CCCN(C2CCCC2)CC1	ZINC000179088381	402571836	/nfs/dbraw/zinc/57/18/36/402571836.db2.gz	ORLKTAWOGOPMQQ-UHFFFAOYSA-N	0	3	316.449	2.310	10	0		DEAEHN
CN(C[C@H](O)COc1ccc(C(C)(C)C)cc1)CC1(CO)CC1	ZINC000190041447	402572674	/nfs/dbraw/zinc/57/26/74/402572674.db2.gz	PKGYLGLQKHIMMQ-INIZCTEOSA-N	0	3	321.461	2.428	10	0		DEAEHN
Cc1cnc(CCN(C)C(=O)NCCN2CCC[C@@H](C)C2)s1	ZINC000179141886	402575930	/nfs/dbraw/zinc/57/59/30/402575930.db2.gz	NROCADMFOYFXAE-CYBMUJFWSA-N	0	3	324.494	2.367	10	0		DEAEHN
Cc1cccc(OC[C@@H](C)NC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000170833313	402531113	/nfs/dbraw/zinc/53/11/13/402531113.db2.gz	BHCWOQQNURXXAT-HUUCEWRRSA-N	0	3	305.422	2.108	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCC(C)(C)c2ccccc2F)C1	ZINC000170836051	402531571	/nfs/dbraw/zinc/53/15/71/402531571.db2.gz	IDBWMSHGVFTETJ-CYBMUJFWSA-N	0	3	307.413	2.449	10	0		DEAEHN
CCCN(CC)c1ccc(C(=O)N2CCN3CCC[C@@H]3C2)cn1	ZINC000171279153	402574054	/nfs/dbraw/zinc/57/40/54/402574054.db2.gz	XTOCRWMAPDWDBJ-MRXNPFEDSA-N	0	3	316.449	2.238	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)C[C@H]2CCOc3ccccc32)C1	ZINC000246657842	402539634	/nfs/dbraw/zinc/53/96/34/402539634.db2.gz	GLFUBRKGYUXASX-LSDHHAIUSA-N	0	3	302.418	2.401	10	0		DEAEHN
CCN(CC(=O)NC(C)(C)C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000179552913	402594208	/nfs/dbraw/zinc/59/42/08/402594208.db2.gz	GEHSUIUSKYNYHK-KRWDZBQOSA-N	0	3	317.477	2.498	10	0		DEAEHN
CCc1nsc(N2CC[C@@H](CN(C)Cc3cccnc3)C2)n1	ZINC000190451394	402602366	/nfs/dbraw/zinc/60/23/66/402602366.db2.gz	JMOZLLKOYUWQJT-AWEZNQCLSA-N	0	3	317.462	2.454	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccoc1Br	ZINC000248765413	402607772	/nfs/dbraw/zinc/60/77/72/402607772.db2.gz	KRBRPFHDVPZLDG-UWVGGRQHSA-N	0	3	313.195	2.351	10	0		DEAEHN
CSCCC(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190584124	402611490	/nfs/dbraw/zinc/61/14/90/402611490.db2.gz	RMASFFLLHOJIMY-OAHLLOKOSA-N	0	3	307.463	2.115	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CCCc3cccnc32)CCN1C	ZINC000248890630	402613475	/nfs/dbraw/zinc/61/34/75/402613475.db2.gz	WDAUDRHNOZRJGQ-KBMXLJTQSA-N	0	3	301.434	2.443	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)COC(C)(C)C)C1	ZINC000190658515	402616749	/nfs/dbraw/zinc/61/67/49/402616749.db2.gz	REMBNTJDGOOAHM-INIZCTEOSA-N	0	3	319.449	2.177	10	0		DEAEHN
COC(=O)[C@H]1C[C@@H](c2ccccc2)CN(Cc2ccnn2C)C1	ZINC000180719834	402624655	/nfs/dbraw/zinc/62/46/55/402624655.db2.gz	TYRXHTMOUCGKOM-CVEARBPZSA-N	0	3	313.401	2.199	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)N[C@H](C)c1ccncc1OC	ZINC000249281713	402624773	/nfs/dbraw/zinc/62/47/73/402624773.db2.gz	NRDVTDWZCYHWEL-KGLIPLIRSA-N	0	3	320.437	2.325	10	0		DEAEHN
C[C@@H](c1ccccc1)N1CC[C@@H](NCc2cc(C(N)=O)co2)C1	ZINC000249434138	402629592	/nfs/dbraw/zinc/62/95/92/402629592.db2.gz	IACABQHFYRYDID-XJKSGUPXSA-N	0	3	313.401	2.304	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H]1COC2(CCC(C)CC2)O1)N(C)C	ZINC000180871452	402628920	/nfs/dbraw/zinc/62/89/20/402628920.db2.gz	KYJSIJLLIJMJCD-KRIMKBQASA-N	0	3	312.454	2.155	10	0		DEAEHN
CC[C@@H](CNC(=O)N1CCO[C@@H](CN(C)C)C1)c1ccccc1	ZINC000172116842	402640643	/nfs/dbraw/zinc/64/06/43/402640643.db2.gz	QHMAVLMIYYZMDA-RDJZCZTQSA-N	0	3	319.449	2.152	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H](OC)c2ccccc2)C1	ZINC000249773345	402641655	/nfs/dbraw/zinc/64/16/55/402641655.db2.gz	UXMUHMBIUWLBOW-JKSUJKDBSA-N	0	3	305.422	2.158	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H](CN(C)C)c2ccccc2)C1	ZINC000249774245	402641970	/nfs/dbraw/zinc/64/19/70/402641970.db2.gz	VOUBRMHTYLJLEH-IAGOWNOFSA-N	0	3	318.465	2.073	10	0		DEAEHN
COc1ccc(F)c(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1OC	ZINC000191160276	402646935	/nfs/dbraw/zinc/64/69/35/402646935.db2.gz	GBKCAAFWAFWNJV-NEPJUHHUSA-N	0	3	324.396	2.398	10	0		DEAEHN
COc1ccc(NC(=O)[C@@H](C)N2CCCN(C3CC3)CC2)cc1	ZINC000172345966	402651402	/nfs/dbraw/zinc/65/14/02/402651402.db2.gz	BOWAGLYQBVJSFZ-CQSZACIVSA-N	0	3	317.433	2.192	10	0		DEAEHN
NC1(C(=O)NCCC23CC4CC(CC(C4)C2)C3)CCOCC1	ZINC000261792228	402717601	/nfs/dbraw/zinc/71/76/01/402717601.db2.gz	IEQJJPNDYUWUCN-UHFFFAOYSA-N	0	3	306.450	2.217	10	0		DEAEHN
CO[C@@H]1CCCN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)C1	ZINC000252801351	402661324	/nfs/dbraw/zinc/66/13/24/402661324.db2.gz	CPQNHWNWWYADNV-IKGGRYGDSA-N	0	3	317.433	2.252	10	0		DEAEHN
CCc1cc(NC(=O)N2CCO[C@@H](CN(C)C)C2)ccc1C	ZINC000182001263	402663721	/nfs/dbraw/zinc/66/37/21/402663721.db2.gz	NAYBQDBIERTBRW-INIZCTEOSA-N	0	3	305.422	2.352	10	0		DEAEHN
Cc1c([C@H](C)N[C@H]2CCc3ncnn3C2)cnn1C(C)(C)C	ZINC000191357435	402663811	/nfs/dbraw/zinc/66/38/11/402663811.db2.gz	UPFGKPBMESKABJ-AAEUAGOBSA-N	0	3	302.426	2.204	10	0		DEAEHN
COc1cccc(F)c1[C@H](C)NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000173915399	402718916	/nfs/dbraw/zinc/71/89/16/402718916.db2.gz	AFUHQCVHXBPHEJ-NWDGAFQWSA-N	0	3	309.385	2.241	10	0		DEAEHN
Cc1noc(C)c1C[C@@H](C)NC(=O)N1CCCN(C2CC2)CC1	ZINC000172613457	402666268	/nfs/dbraw/zinc/66/62/68/402666268.db2.gz	QSCKQTYWXCTUDI-GFCCVEGCSA-N	0	3	320.437	2.102	10	0		DEAEHN
O=C(NCCN1CCCCC1)c1cnn(CCC(F)(F)F)c1	ZINC000182200505	402671509	/nfs/dbraw/zinc/67/15/09/402671509.db2.gz	KORQTAUXDZUSQN-UHFFFAOYSA-N	0	3	318.343	2.051	10	0		DEAEHN
CN(C)[C@H]1CCCN(C(=O)c2cnc(-c3ccncc3)s2)C1	ZINC000172894692	402679408	/nfs/dbraw/zinc/67/94/08/402679408.db2.gz	MZNSZGKMGYPNHS-ZDUSSCGKSA-N	0	3	316.430	2.371	10	0		DEAEHN
CN(C)[C@H]1CCCN(C(=O)c2cnn(CCC(F)(F)F)c2)C1	ZINC000182380886	402685010	/nfs/dbraw/zinc/68/50/10/402685010.db2.gz	TZRSJIQWRCYNMQ-LBPRGKRZSA-N	0	3	318.343	2.002	10	0		DEAEHN
CCC[C@H](N)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1	ZINC000262506636	402726696	/nfs/dbraw/zinc/72/66/96/402726696.db2.gz	AFFXPNUJFXILTI-ZNMIVQPWSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000262580096	402727829	/nfs/dbraw/zinc/72/78/29/402727829.db2.gz	QEZNCKQEDGKFAH-AQUOVQTQSA-N	0	3	302.777	2.002	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](Cc1ccccc1)CN(C)C)c1cccnc1	ZINC000174171077	402730056	/nfs/dbraw/zinc/73/00/56/402730056.db2.gz	OHESIYXNOXXJKO-YJBOKZPZSA-N	0	3	311.429	2.474	10	0		DEAEHN
Cc1cc(-c2nc([C@@H]3CNCCN3C)no2)c(Cl)cc1F	ZINC000263235363	402748566	/nfs/dbraw/zinc/74/85/66/402748566.db2.gz	NZGUSYGOFYSARA-LBPRGKRZSA-N	0	3	310.760	2.414	10	0		DEAEHN
Cc1c(Cl)cccc1OCc1nc([C@H]2CNCCN2C)no1	ZINC000263277621	402753199	/nfs/dbraw/zinc/75/31/99/402753199.db2.gz	TVTXLJDRXMFXML-GFCCVEGCSA-N	0	3	322.796	2.187	10	0		DEAEHN
CC(C)COc1ccc(-c2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263306176	402757084	/nfs/dbraw/zinc/75/70/84/402757084.db2.gz	XYNOFKAVNWWHEH-OAHLLOKOSA-N	0	3	316.405	2.348	10	0		DEAEHN
CC[C@@H]1C[C@@H](C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CCO1	ZINC000183336524	402758197	/nfs/dbraw/zinc/75/81/97/402758197.db2.gz	NQMLFSCCIGCSNR-OKZBNKHCSA-N	0	3	318.461	2.481	10	0		DEAEHN
COC(=O)c1coc(C(=O)N[C@H](C)CN2C[C@@H](C)C[C@H](C)C2)c1	ZINC000183450005	402768794	/nfs/dbraw/zinc/76/87/94/402768794.db2.gz	FZNQTRHVDSHFKI-RWMBFGLXSA-N	0	3	322.405	2.162	10	0		DEAEHN
Cc1noc2ncc(C(=O)N[C@H](CC(C)C)CN(C)C)cc12	ZINC000193269383	402769328	/nfs/dbraw/zinc/76/93/28/402769328.db2.gz	FQZLBEXCFMVQFF-CYBMUJFWSA-N	0	3	304.394	2.237	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(OC)cc1OC	ZINC000174993801	402769877	/nfs/dbraw/zinc/76/98/77/402769877.db2.gz	HBAMQGQWYCNSKI-UONOGXRCSA-N	0	3	318.417	2.403	10	0		DEAEHN
Cc1ccccc1[C@@H](CN1CCOCC1)N[C@H]1CCCOC1	ZINC000183563432	402776186	/nfs/dbraw/zinc/77/61/86/402776186.db2.gz	LTIOEUVJPIHBSC-FUHWJXTLSA-N	0	3	304.434	2.137	10	0		DEAEHN
C[C@H]1CC[C@H](C)N(CC(=O)N2CCN(Cc3ccco3)CC2)C1	ZINC000174013773	402723544	/nfs/dbraw/zinc/72/35/44/402723544.db2.gz	UQSFVIZOCHBGCN-HOTGVXAUSA-N	0	3	319.449	2.044	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc3c(c2)OCCO3)C1	ZINC000194310684	402791502	/nfs/dbraw/zinc/79/15/02/402791502.db2.gz	KUDFKWCDUVCCLX-CYBMUJFWSA-N	0	3	305.378	2.064	10	0		DEAEHN
CCC[C@@H](C(=O)N1CC[C@](C(=O)OCC)(C(C)C)C1)N(C)C	ZINC000194325120	402792073	/nfs/dbraw/zinc/79/20/73/402792073.db2.gz	NGVRSSIEFYHYTH-WMLDXEAASA-N	0	3	312.454	2.155	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cccc(NC(C)=O)c2)C1	ZINC000194326946	402792282	/nfs/dbraw/zinc/79/22/82/402792282.db2.gz	XQGLEBMYCLTMCZ-OAHLLOKOSA-N	0	3	304.394	2.251	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc(F)c(NC(C)=O)c2)C1	ZINC000194331947	402792621	/nfs/dbraw/zinc/79/26/21/402792621.db2.gz	RZBFHPBZKFXKID-CYBMUJFWSA-N	0	3	322.384	2.390	10	0		DEAEHN
C[C@H]1COCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccc(F)cc1	ZINC000194353640	402793221	/nfs/dbraw/zinc/79/32/21/402793221.db2.gz	KIRTZJLIIVNYJU-YOEHRIQHSA-N	0	3	322.424	2.389	10	0		DEAEHN
COC(=O)COc1ccccc1[C@H](C)NCCn1cc(C)cn1	ZINC000183738078	402793722	/nfs/dbraw/zinc/79/37/22/402793722.db2.gz	QBZFVOPQRCUOIG-AWEZNQCLSA-N	0	3	317.389	2.094	10	0		DEAEHN
COC[C@H](NC(=O)N[C@@H](CC(C)C)CN(C)C)c1ccco1	ZINC000175315259	402796392	/nfs/dbraw/zinc/79/63/92/402796392.db2.gz	RHPHKZBFIXFMOA-KBPBESRZSA-N	0	3	311.426	2.243	10	0		DEAEHN
Cc1cc(C(=O)NC[C@@H]2CCCN2C)c2c(n1)onc2C(C)C	ZINC000194450520	402797870	/nfs/dbraw/zinc/79/78/70/402797870.db2.gz	VJZMBCPGJQJPNK-LBPRGKRZSA-N	0	3	316.405	2.479	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)N(CCN(C)C)Cc1cccs1	ZINC000194628063	402806169	/nfs/dbraw/zinc/80/61/69/402806169.db2.gz	MVYONTVEXGPDJH-UKRRQHHQSA-N	0	3	310.463	2.311	10	0		DEAEHN
CC(C)NC(=O)Nc1cccc(C(=O)NC[C@@H]2CCCN2C)c1	ZINC000194700393	402811287	/nfs/dbraw/zinc/81/12/87/402811287.db2.gz	SKSFANSMFHIKQS-HNNXBMFYSA-N	0	3	318.421	2.041	10	0		DEAEHN
CCOc1ccc(CN2C[C@@H](C)[C@H](N3CCOCC3)C2)cc1	ZINC000175587186	402819352	/nfs/dbraw/zinc/81/93/52/402819352.db2.gz	HWTLZPIRDKAXNH-CRAIPNDOSA-N	0	3	304.434	2.238	10	0		DEAEHN
C[C@@H]1CN(CCC2CCN(C(=O)NC3CC3)CC2)C[C@@H](C)O1	ZINC000175621160	402822366	/nfs/dbraw/zinc/82/23/66/402822366.db2.gz	UIBFNHLMRBVQFS-ZIAGYGMSSA-N	0	3	309.454	2.070	10	0		DEAEHN
Cc1nc(CCCC(=O)N2CCCN(C3CC3)CC2)cs1	ZINC000175950219	402844057	/nfs/dbraw/zinc/84/40/57/402844057.db2.gz	ZRYITDMJIZAEJE-UHFFFAOYSA-N	0	3	307.463	2.471	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCc3cc(OC)ccc32)C1	ZINC000195154300	402834188	/nfs/dbraw/zinc/83/41/88/402834188.db2.gz	FKKBJOJRIZDOCT-CQSZACIVSA-N	0	3	303.406	2.252	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc(OC)c(OC(F)F)c1	ZINC000175855668	402838668	/nfs/dbraw/zinc/83/86/68/402838668.db2.gz	NXPBYAMZYSZRCM-HNNXBMFYSA-N	0	3	319.348	2.174	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NC[C@@H](CO)c1ccccc1	ZINC000175865418	402839145	/nfs/dbraw/zinc/83/91/45/402839145.db2.gz	DMSRKDHDCPPPRO-IRXDYDNUSA-N	0	3	321.465	2.038	10	0		DEAEHN
CC(C)(Oc1ccc(F)cc1)C(=O)N1CCN2CCC[C@H]2C1	ZINC000195316980	402841354	/nfs/dbraw/zinc/84/13/54/402841354.db2.gz	FMCOCFBSAFSWDU-AWEZNQCLSA-N	0	3	306.381	2.290	10	0		DEAEHN
CC(C)(C)S(=O)(=O)CCN[C@@H]1[C@H]2CCO[C@H]2C12CCCC2	ZINC000194099526	402784073	/nfs/dbraw/zinc/78/40/73/402784073.db2.gz	XRGQRXGACPELQJ-MGPQQGTHSA-N	0	3	315.479	2.137	10	0		DEAEHN
C[C@H](CN1CCN(C)CC1)Nc1ncnc2cc(Cl)ccc21	ZINC000264422548	402877184	/nfs/dbraw/zinc/87/71/84/402877184.db2.gz	RJALRMAVWFVDHK-GFCCVEGCSA-N	0	3	319.840	2.331	10	0		DEAEHN
CC[C@@H]1CN(c2ncnc3ccc(C)cc32)CCN1C[C@@H](C)O	ZINC000266369187	402968743	/nfs/dbraw/zinc/96/87/43/402968743.db2.gz	LJRBNSKVMYYSOJ-HUUCEWRRSA-N	0	3	314.433	2.220	10	0		DEAEHN
CN(Cc1nccs1)[C@@H]1CC12CCN(Cc1cc[nH]n1)CC2	ZINC000275556382	403105680	/nfs/dbraw/zinc/10/56/80/403105680.db2.gz	GGISCCCSONLXIC-CQSZACIVSA-N	0	3	317.462	2.353	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@H]1NCc1cc(F)cc(Br)c1	ZINC000282389876	403149121	/nfs/dbraw/zinc/14/91/21/403149121.db2.gz	OXAUHYSSTLHMFQ-PRHODGIISA-N	0	3	315.186	2.345	10	0		DEAEHN
Cc1nc2cccc(C(=O)N(C)[C@@H]3CCN(C)[C@@H](C)C3)c2[nH]1	ZINC000283824725	403226657	/nfs/dbraw/zinc/22/66/57/403226657.db2.gz	FMVHJQXYOAHWLN-WCQYABFASA-N	0	3	300.406	2.426	10	0		DEAEHN
C[C@@H]1OCC[C@]1(C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000332880131	403630281	/nfs/dbraw/zinc/63/02/81/403630281.db2.gz	VFTQUMIORGKXPW-MBGYTDRXSA-N	0	3	317.433	2.299	10	0		DEAEHN
c1cc2c(s1)CN(CCc1nnnn1-c1ccccc1)CC2	ZINC000341012153	403735009	/nfs/dbraw/zinc/73/50/09/403735009.db2.gz	MDUITFPGOGWQAN-UHFFFAOYSA-N	0	3	311.414	2.325	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@@H]2CN1C[C@H](O)COCc1ccccc1	ZINC000303080317	403747012	/nfs/dbraw/zinc/74/70/12/403747012.db2.gz	MKNIMTXDOGQCET-QRQLOZEOSA-N	0	3	318.461	2.123	10	0		DEAEHN
CC(=O)[C@](C)(O)CN1CCC(Oc2cc(C)ccc2C)CC1	ZINC000347748716	403843130	/nfs/dbraw/zinc/84/31/30/403843130.db2.gz	MLLLVOATPGXZRV-GOSISDBHSA-N	0	3	305.418	2.487	10	0		DEAEHN
Cc1ccn2c(c1)nnc2NC(=O)C1CN(C2CCCCC2)C1	ZINC000333960199	403907610	/nfs/dbraw/zinc/90/76/10/403907610.db2.gz	KTXJHPFJEXRMRV-UHFFFAOYSA-N	0	3	313.405	2.241	10	0		DEAEHN
O[C@@H](CCNCc1ccc(Br)o1)C(F)(F)F	ZINC000336669325	403911955	/nfs/dbraw/zinc/91/19/55/403911955.db2.gz	GXKWGIWKSBLYOX-ZETCQYMHSA-N	0	3	302.090	2.445	10	0		DEAEHN
Cc1c[nH]nc1CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C	ZINC000289464046	403975381	/nfs/dbraw/zinc/97/53/81/403975381.db2.gz	IJMBBDBVNJTCJZ-QWHCGFSZSA-N	0	3	308.426	2.453	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)CCN(C(=O)c2ncccc2N)C1	ZINC000323645331	404093153	/nfs/dbraw/zinc/09/31/53/404093153.db2.gz	SRGDNDLNJUTHKG-HNNXBMFYSA-N	0	3	324.428	2.258	10	0		DEAEHN
CCN1CCCN(c2nnc(-c3cc(C)oc3C)n2C)CC1	ZINC000290536258	404209148	/nfs/dbraw/zinc/20/91/48/404209148.db2.gz	USJPQNQHQGKBCI-UHFFFAOYSA-N	0	3	303.410	2.224	10	0		DEAEHN
c1cnc2c(c1)nccc2N1CCC(CN2CCOCC2)CC1	ZINC000338651218	404461817	/nfs/dbraw/zinc/46/18/17/404461817.db2.gz	VROIZTWHCLIXGK-UHFFFAOYSA-N	0	3	312.417	2.178	10	0		DEAEHN
CC[C@H](C)N(C)CCNC(=O)C(=O)N1CCC2(C1)CCCCC2	ZINC000359277796	404788845	/nfs/dbraw/zinc/78/88/45/404788845.db2.gz	SPRDWURYWSKPGD-HNNXBMFYSA-N	0	3	323.481	2.016	10	0		DEAEHN
c1ccc(OCC2CC2)c(CNCCN2C[C@H]3CC[C@@H](C2)O3)c1	ZINC000451224597	404907627	/nfs/dbraw/zinc/90/76/27/404907627.db2.gz	ZCFHLIDAZHOJNV-HDICACEKSA-N	0	3	316.445	2.428	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)[C@@H](C)N[C@@H]2CCOC2(C)C)cc1	ZINC000451238816	404915439	/nfs/dbraw/zinc/91/54/39/404915439.db2.gz	FAQGVOQRLFCCMM-IAQYHMDHSA-N	0	3	304.390	2.373	10	0		DEAEHN
CCN1CC[C@H](NC(=O)c2cc(Br)ccc2F)C1	ZINC000389989317	405043081	/nfs/dbraw/zinc/04/30/81/405043081.db2.gz	MVLPXVQNIVENHS-JTQLQIEISA-N	0	3	315.186	2.412	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@H](CC)COCC(F)(F)F	ZINC000452745962	405237069	/nfs/dbraw/zinc/23/70/69/405237069.db2.gz	ONWHFAUWROCZHQ-VXGBXAGGSA-N	0	3	310.360	2.335	10	0		DEAEHN
CC=CC[C@@H]1NC(=O)N(c2cccc(OCCN(C)C)c2)C1=O	ZINC000445912731	405362619	/nfs/dbraw/zinc/36/26/19/405362619.db2.gz	KWPBLQJVTRISIH-XVWMLYKFSA-N	0	3	317.389	2.018	10	0		DEAEHN
c1ccc(N2CCN(CCCN3CC[C@]34CCOC4)CC2)cc1	ZINC000421018699	405431662	/nfs/dbraw/zinc/43/16/62/405431662.db2.gz	LNVSVJSYRHAXDX-LJQANCHMSA-N	0	3	315.461	2.064	10	0		DEAEHN
c1c2cccnc2oc1CN1CCC[C@H]1CN1CCOCC1	ZINC000449013591	405498004	/nfs/dbraw/zinc/49/80/04/405498004.db2.gz	DISVHFABPPUWKX-HNNXBMFYSA-N	0	3	301.390	2.124	10	0		DEAEHN
CC(C)(CN1CCCC1)NC(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000457060871	405675169	/nfs/dbraw/zinc/67/51/69/405675169.db2.gz	YDCDXCQLLQBZLB-UHFFFAOYSA-N	0	3	314.429	2.349	10	0		DEAEHN
CC(=O)c1ccc(CC(=O)N2CCOc3ccc(CN)cc32)cc1	ZINC000638806464	405681658	/nfs/dbraw/zinc/68/16/58/405681658.db2.gz	ZAAVBHZBVPIMKJ-UHFFFAOYSA-N	0	3	324.380	2.316	10	0		DEAEHN
CC[C@@](C)(NC(=O)[C@H](N)CN(C)Cc1ccccc1)C1CC1	ZINC000638858133	405720731	/nfs/dbraw/zinc/72/07/31/405720731.db2.gz	LQRUNFSHGNDQCV-SJLPKXTDSA-N	0	3	303.450	2.141	10	0		DEAEHN
O[C@]1(c2cnn[n-]2)CCC[N@H+](CCc2ccc3ccccc3c2)C1	ZINC000583617889	405776643	/nfs/dbraw/zinc/77/66/43/405776643.db2.gz	GLGPGDBSZDINFK-LJQANCHMSA-N	0	3	322.412	2.484	10	0		DEAEHN
O[C@]1(c2cnn[n-]2)CCC[N@@H+](CCc2ccc3ccccc3c2)C1	ZINC000583617889	405776649	/nfs/dbraw/zinc/77/66/49/405776649.db2.gz	GLGPGDBSZDINFK-LJQANCHMSA-N	0	3	322.412	2.484	10	0		DEAEHN
CN1C(=O)C[C@@H](Nc2ccnc3ccccc32)[C@@H]1c1cccnc1	ZINC000583617887	405776830	/nfs/dbraw/zinc/77/68/30/405776830.db2.gz	FQZCPRHPLQTBEK-MJGOQNOKSA-N	0	3	318.380	2.436	10	0		DEAEHN
c1ccc(N2CC[C@@H](CN3CCO[C@]4(CCCOC4)C3)C2)cc1	ZINC000639157393	405933028	/nfs/dbraw/zinc/93/30/28/405933028.db2.gz	NDTFHEPRWOPFQL-PKOBYXMFSA-N	0	3	316.445	2.394	10	0		DEAEHN
CC(C)[C@H](NCc1nnc(C2CC2)n1C)C1(CO)CCCC1	ZINC000459548832	405950661	/nfs/dbraw/zinc/95/06/61/405950661.db2.gz	YJSULDXUXURNND-HNNXBMFYSA-N	0	3	306.454	2.359	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N(C)[C@H]2CCN(C)C[C@H]2C)c1	ZINC000457590298	405910527	/nfs/dbraw/zinc/91/05/27/405910527.db2.gz	FFRVYNLOPLTGMR-CJNGLKHVSA-N	0	3	318.417	2.194	10	0		DEAEHN
CC1(C)CN(C[C@@H](O)COC[C@@H]2CCCO2)Cc2ccccc21	ZINC000534668170	406193955	/nfs/dbraw/zinc/19/39/55/406193955.db2.gz	MLTDSDIZVCZMCX-SJORKVTESA-N	0	3	319.445	2.336	10	0		DEAEHN
CC[C@@H](C[C@H](C)CO)NCc1c(Br)cnn1C	ZINC000487302733	406222855	/nfs/dbraw/zinc/22/28/55/406222855.db2.gz	RFJQCTQAPDGNFK-UWVGGRQHSA-N	0	3	304.232	2.069	10	0		DEAEHN
CO[C@@H]1CCC[C@@H]1CNCc1c(Br)cnn1C	ZINC000487552137	406244862	/nfs/dbraw/zinc/24/48/62/406244862.db2.gz	WRSDMRCVAPPKRB-BXKDBHETSA-N	0	3	302.216	2.087	10	0		DEAEHN
CCCN(Cc1ccc(C)cc1)C(=O)CN1CC[C@@H](CO)[C@@H]1C	ZINC000488800144	406350332	/nfs/dbraw/zinc/35/03/32/406350332.db2.gz	DVRFNOWQBCUPFR-WMZOPIPTSA-N	0	3	318.461	2.436	10	0		DEAEHN
COc1cc(C)cc(NC(=O)NCCOCCN(C)C)c1C	ZINC000489722946	406427314	/nfs/dbraw/zinc/42/73/14/406427314.db2.gz	RXROEQWFLXFPNQ-UHFFFAOYSA-N	0	3	309.410	2.012	10	0		DEAEHN
c1c(CN2CCN(CCC[C@@H]3CCO3)CC2)nc2ccccn12	ZINC000637878129	406458740	/nfs/dbraw/zinc/45/87/40/406458740.db2.gz	DKONLWIBSTWXAK-QGZVFWFLSA-N	0	3	314.433	2.021	10	0		DEAEHN
Cc1nnc(N2CCN(CC3CC3)CC2)n1Cc1ccccc1	ZINC000549126953	406577018	/nfs/dbraw/zinc/57/70/18/406577018.db2.gz	CNWDWFOIBPSODU-UHFFFAOYSA-N	0	3	311.433	2.167	10	0		DEAEHN
Cc1cc(CCN[C@@H](C)c2ccc3c(c2)OCC(=O)N3)on1	ZINC000552098548	406682620	/nfs/dbraw/zinc/68/26/20/406682620.db2.gz	HAAWKGTYPWIJFD-NSHDSACASA-N	0	3	301.346	2.207	10	0		DEAEHN
CC(=O)N1C[C@@H]2CCC[C@H](N[C@@H](C)c3cnc(C)cn3)[C@@H]2C1	ZINC000555625264	406849254	/nfs/dbraw/zinc/84/92/54/406849254.db2.gz	DJHMVUCRBCMMCQ-HNKHHVNMSA-N	0	3	302.422	2.083	10	0		DEAEHN
CC(=O)N1C[C@@H]2CCC[C@H](N[C@@H](C)c3cnc(C)cn3)[C@H]2C1	ZINC000555625266	406849289	/nfs/dbraw/zinc/84/92/89/406849289.db2.gz	DJHMVUCRBCMMCQ-TUUVXOQKSA-N	0	3	302.422	2.083	10	0		DEAEHN
CCOc1cc(C)ccc1CNC(=O)N1CC[C@H](N(C)C)C1	ZINC000129152680	196023990	/nfs/dbraw/zinc/02/39/90/196023990.db2.gz	IFVSSGJDCXVISP-HNNXBMFYSA-N	0	3	305.422	2.239	10	0		DEAEHN
NCc1cc(-c2nnc3ccc(Br)cn32)ccn1	ZINC000129690619	196068753	/nfs/dbraw/zinc/06/87/53/196068753.db2.gz	OCBCMKXFOZDWFU-UHFFFAOYSA-N	0	3	304.151	2.013	10	0		DEAEHN
COc1ccc(C(N)=S)c(N2CCN3CCCC[C@@H]3C2)c1	ZINC000130666110	196099377	/nfs/dbraw/zinc/09/93/77/196099377.db2.gz	IOAJLKCNYLOEGJ-GFCCVEGCSA-N	0	3	305.447	2.004	10	0		DEAEHN
CS(=O)(=O)CCC[C@H](N)c1cc2c(s1)CCSC2	ZINC000131151007	196144299	/nfs/dbraw/zinc/14/42/99/196144299.db2.gz	QSFQOSTUHOQDLJ-JTQLQIEISA-N	0	3	305.490	2.362	10	0		DEAEHN
CCO[C@H](C)CNS(=O)(=O)c1cccc([C@H](CC)NC)c1	ZINC000131227988	196151749	/nfs/dbraw/zinc/15/17/49/196151749.db2.gz	BKWUTQTWKNTELO-DOMZBBRYSA-N	0	3	314.451	2.060	10	0		DEAEHN
CCCN[C@H](Cc1cccc(F)c1F)[C@H](C)S(C)(=O)=O	ZINC000131486247	196173173	/nfs/dbraw/zinc/17/31/73/196173173.db2.gz	JOQGTAAHTHTIHB-GXFFZTMASA-N	0	3	305.390	2.309	10	0		DEAEHN
C[C@H](NCCNC(=O)N(C)C)c1cccc(Br)c1	ZINC000132092152	196225458	/nfs/dbraw/zinc/22/54/58/196225458.db2.gz	RGRDISGQZHPUIS-JTQLQIEISA-N	0	3	314.227	2.371	10	0		DEAEHN
CCN[C@H](c1ccnc(C)n1)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000132429563	196254935	/nfs/dbraw/zinc/25/49/35/196254935.db2.gz	WIBYFNWVUQFFHN-IPYPFGDCSA-N	0	3	311.451	2.039	10	0		DEAEHN
O=C(C[C@H]1CSCCN1)N1CCC[C@H]1Cc1cccc(F)c1	ZINC000132580923	196267193	/nfs/dbraw/zinc/26/71/93/196267193.db2.gz	WJQHRHRWXPNKGG-HOTGVXAUSA-N	0	3	322.449	2.454	10	0		DEAEHN
C[C@H]1CNC[C@H](COCc2ccccc2Br)O1	ZINC000132651970	196273376	/nfs/dbraw/zinc/27/33/76/196273376.db2.gz	ONRYMLJRROIMAD-CMPLNLGQSA-N	0	3	300.196	2.343	10	0		DEAEHN
CCOC(=O)c1csc(N2CC[C@H](N3CCCCC3)C2)n1	ZINC000133141446	196314806	/nfs/dbraw/zinc/31/48/06/196314806.db2.gz	NRFUEHVRKYDQQS-LBPRGKRZSA-N	0	3	309.435	2.384	10	0		DEAEHN
CC[C@H](CSC)NS(=O)(=O)c1cccc([C@H](C)N)c1	ZINC000133233731	196323765	/nfs/dbraw/zinc/32/37/65/196323765.db2.gz	XDPPHTBLPOZZPH-CMPLNLGQSA-N	0	3	302.465	2.126	10	0		DEAEHN
CC[C@H](C(=O)N1CC[C@@H](c2cc(OC)cc(OC)c2)C1)N(C)C	ZINC000133823141	196338907	/nfs/dbraw/zinc/33/89/07/196338907.db2.gz	PPAMIYXMMYHEID-CXAGYDPISA-N	0	3	320.433	2.360	10	0		DEAEHN
CCCN[C@H](CS(=O)(=O)CCOC)c1cc(C)cc(C)c1	ZINC000133959309	196349929	/nfs/dbraw/zinc/34/99/29/196349929.db2.gz	ZTUVQESJFRWVOM-MRXNPFEDSA-N	0	3	313.463	2.405	10	0		DEAEHN
CC[C@](C)(C(=O)c1c(Cl)cnn1CCN(C)C)N(C)C	ZINC000134100714	196361647	/nfs/dbraw/zinc/36/16/47/196361647.db2.gz	CWZVDHFIFNXXCI-CQSZACIVSA-N	0	3	300.834	2.011	10	0		DEAEHN
CCCN[C@@H](Cc1ccc(Cl)cc1F)CS(C)(=O)=O	ZINC000134208988	196370683	/nfs/dbraw/zinc/37/06/83/196370683.db2.gz	RBVAIEGLWLEXDE-LBPRGKRZSA-N	0	3	307.818	2.434	10	0		DEAEHN
CCN[C@H](Cc1ccc(Cl)cc1F)[C@H](C)S(C)(=O)=O	ZINC000134214368	196371288	/nfs/dbraw/zinc/37/12/88/196371288.db2.gz	JUNGLHZLKAIRTN-TVQRCGJNSA-N	0	3	307.818	2.433	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)Nc2c(C)cccc2C)c1	ZINC000105881493	424849723	/nfs/dbraw/zinc/84/97/23/424849723.db2.gz	UKURSBFBWMONIQ-OAHLLOKOSA-N	0	3	300.406	2.425	10	0		DEAEHN
Cn1cc(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)cn1	ZINC000153798435	424859804	/nfs/dbraw/zinc/85/98/04/424859804.db2.gz	YNJDFPAKPLPJPK-SFHVURJKSA-N	0	3	312.417	2.205	10	0		DEAEHN
N#Cc1cnnc(NC[C@@H]2CCCCN2Cc2ccccc2)c1	ZINC000396979815	424921442	/nfs/dbraw/zinc/92/14/42/424921442.db2.gz	IOZOYHPNGYYTGX-KRWDZBQOSA-N	0	3	307.401	2.815	10	0		DEAEHN
O[C@@H]1C[C@H]2CN(Cc3ccc(Cl)c(Cl)c3)CCN2C1	ZINC000405329059	424931251	/nfs/dbraw/zinc/93/12/51/424931251.db2.gz	VVIJQSWNMLVIDH-NWDGAFQWSA-N	0	3	301.217	2.244	10	0		DEAEHN
CN(C)CCn1cc(Nc2ccnc(-c3ccccc3)n2)cn1	ZINC000591018033	424999896	/nfs/dbraw/zinc/99/98/96/424999896.db2.gz	VGWBDMPRQMFLPU-UHFFFAOYSA-N	0	3	308.389	2.645	10	0		DEAEHN
CN(C)CC(C)(C)NC(=O)Nc1cc(C2(C)CCCC2)on1	ZINC000455296787	425096968	/nfs/dbraw/zinc/09/69/68/425096968.db2.gz	CZCPODSWSVGECS-UHFFFAOYSA-N	0	3	308.426	2.968	10	0		DEAEHN
CCc1cc(NC(=O)C(=O)NCCN(C)[C@@H](C)CC)ccc1C	ZINC000180598795	267601904	/nfs/dbraw/zinc/60/19/04/267601904.db2.gz	VOUCEKAFLVMRJY-AWEZNQCLSA-N	0	3	319.449	2.342	10	0		DEAEHN
CCCC[C@@H](CC)CNC(=O)NC[C@H](O)CN1CCCCC1	ZINC000192803947	267744840	/nfs/dbraw/zinc/74/48/40/267744840.db2.gz	ZFLUPXFLMJVLKC-CVEARBPZSA-N	0	3	313.486	2.349	10	0		DEAEHN
CCN1CC[C@H](NC(=O)c2cccc(Br)c2F)C1	ZINC000390015308	269097315	/nfs/dbraw/zinc/09/73/15/269097315.db2.gz	UQEMPCUBVKGEGY-VIFPVBQESA-N	0	3	315.186	2.412	10	0		DEAEHN
CC(C)[C@@](C)(O)CN1CCC(n2c3ccccc3[nH]c2=O)CC1	ZINC000184940118	273551217	/nfs/dbraw/zinc/55/12/17/273551217.db2.gz	GERYCXRNALHNLC-SFHVURJKSA-N	0	3	317.433	2.374	10	0		DEAEHN
COCCN1CCCN([C@H](C)CCc2ccccc2)CC1=O	ZINC000190799167	274026712	/nfs/dbraw/zinc/02/67/12/274026712.db2.gz	VSVCFHDHWRKZIH-MRXNPFEDSA-N	0	3	304.434	2.188	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)Nc2ccccc2Cl)c1	ZINC000105881392	274830328	/nfs/dbraw/zinc/83/03/28/274830328.db2.gz	XPLDTXMGXHFKDV-GFCCVEGCSA-N	0	3	306.797	2.462	10	0		DEAEHN
O=C([C@H]1CCCn2ccnc21)N1CCCN(C2CCCC2)CC1	ZINC000081795642	275008421	/nfs/dbraw/zinc/00/84/21/275008421.db2.gz	LUDPEEUTIXHMMS-INIZCTEOSA-N	0	3	316.449	2.237	10	0		DEAEHN
O[C@@H](CN1CCC[C@H](n2cncn2)C1)c1ccc(Cl)cc1	ZINC000171618745	275051331	/nfs/dbraw/zinc/05/13/31/275051331.db2.gz	DIUJGIYUAMKCIT-GJZGRUSLSA-N	0	3	306.797	2.302	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2ccc3c(c2)CC(C)(C)O3)CCO1	ZINC000128119526	276766589	/nfs/dbraw/zinc/76/65/89/276766589.db2.gz	YXLPWMRXXZMKHY-MRXNPFEDSA-N	0	3	304.434	2.163	10	0		DEAEHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)[C@H]1CCCc2n[nH]cc21	ZINC000246641221	278258307	/nfs/dbraw/zinc/25/83/07/278258307.db2.gz	ULTAHWAQDVDHET-RDBSUJKOSA-N	0	3	304.438	2.066	10	0		DEAEHN
C[C@@H](N[C@H]1CCC(=O)N(C)C1)c1ccc2c(c1)OCCCO2	ZINC000132990498	278380762	/nfs/dbraw/zinc/38/07/62/278380762.db2.gz	YRKZEUYXURBFRN-OCCSQVGLSA-N	0	3	304.390	2.119	10	0		DEAEHN
C[C@@H]1[C@H](C)NCCN1C(=O)C1=Cc2cc(Cl)ccc2OC1	ZINC000262899374	279104622	/nfs/dbraw/zinc/10/46/22/279104622.db2.gz	XMVBMYSYJZEQLN-WDEREUQCSA-N	0	3	306.793	2.325	10	0		DEAEHN
C[C@@](C[NH3+])([N-]S(=O)(=O)c1cc(Cl)ccc1Cl)C1CC1	ZINC000130335546	279149043	/nfs/dbraw/zinc/14/90/43/279149043.db2.gz	JPDFGLIVHYSIDF-LBPRGKRZSA-N	0	3	323.245	2.399	10	0		DEAEHN
CCN1CCCN(C(=O)c2ccc3c(c2)NC(=O)C3(C)C)CC1	ZINC000294126233	279289756	/nfs/dbraw/zinc/28/97/56/279289756.db2.gz	PIUAFGSBARCPAK-UHFFFAOYSA-N	0	3	315.417	2.084	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCOC[C@@H]2c2ccc(C)o2)C1	ZINC000117037466	279319149	/nfs/dbraw/zinc/31/91/49/279319149.db2.gz	ULNSNXMAGZRBLF-LSDHHAIUSA-N	0	3	321.421	2.155	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)N([C@@H](C)C1CC1)C1CC1	ZINC000177697593	279327094	/nfs/dbraw/zinc/32/70/94/279327094.db2.gz	ROODHZIUXKTSGE-YOEHRIQHSA-N	0	3	307.482	2.192	10	0		DEAEHN
CC[C@@H]1CN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CCO1	ZINC000245681490	280363030	/nfs/dbraw/zinc/36/30/30/280363030.db2.gz	VJQGXCFAPMPSKQ-IKGGRYGDSA-N	0	3	317.433	2.252	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000247496113	288307797	/nfs/dbraw/zinc/30/77/97/288307797.db2.gz	UQNYMMQLXAHDFE-JDOFQRQTSA-N	0	3	304.434	2.077	10	0		DEAEHN
CCc1noc(CC)c1CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000132967968	282004233	/nfs/dbraw/zinc/00/42/33/282004233.db2.gz	GLCWCLLBBMGVEU-OLZOCXBDSA-N	0	3	322.453	2.424	10	0		DEAEHN
CNC(=O)NC(=O)[C@@H](C)N[C@H](C)c1ccc(C(C)(C)C)cc1	ZINC000056194651	290492913	/nfs/dbraw/zinc/49/29/13/290492913.db2.gz	QDUDWKXYAXRQKY-VXGBXAGGSA-N	0	3	305.422	2.479	10	0		DEAEHN
N[C@H](C(=O)NCC12CC3CC(CC(C3)C1)C2)C1CCOCC1	ZINC000261887422	295328667	/nfs/dbraw/zinc/32/86/67/295328667.db2.gz	VDXOSBHOMLYCPO-IEKYFPHUSA-N	0	3	306.450	2.073	10	0		DEAEHN
c1ccc(-n2nnnc2CCN2CC[C@H](c3ccncc3)C2)cc1	ZINC000574925403	326201803	/nfs/dbraw/zinc/20/18/03/326201803.db2.gz	ZTZMOCVTGWZSBP-INIZCTEOSA-N	0	3	320.400	2.089	10	0		DEAEHN
COC[C@H](C)CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	ZINC000188231770	333039616	/nfs/dbraw/zinc/03/96/16/333039616.db2.gz	XSLGRNHPQHHHGD-QMTHXVAHSA-N	0	3	314.788	2.457	10	0		DEAEHN
CC(=O)[C@](C)(O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000582587056	337110189	/nfs/dbraw/zinc/11/01/89/337110189.db2.gz	UPVCVXHKDJHFET-QGZVFWFLSA-N	0	3	301.390	2.082	10	0		DEAEHN
C/C=C/C=C/COC[C@@H](O)CNCCOc1ccccc1OC	ZINC000584627796	337376119	/nfs/dbraw/zinc/37/61/19/337376119.db2.gz	CWVMUVPLVDOCNW-UHMLGTDTSA-N	0	3	321.417	2.173	10	0		DEAEHN
CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@@H]1CCCOC1	ZINC000171614375	500612327	/nfs/dbraw/zinc/61/23/27/500612327.db2.gz	VRHYFYAQAXWHRR-MRXNPFEDSA-N	0	3	323.412	2.078	10	0		DEAEHN
CCCNCc1csc(N(CCCOC)CCOC)n1	ZINC000079945416	517589424	/nfs/dbraw/zinc/58/94/24/517589424.db2.gz	GPSUROJWFLBERE-UHFFFAOYSA-N	0	3	301.456	2.132	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC(n2ccnc2)CC1	ZINC000103307202	519775130	/nfs/dbraw/zinc/77/51/30/519775130.db2.gz	YPPYBDZCORBIQF-HNNXBMFYSA-N	0	3	321.469	2.206	10	0		DEAEHN
CCCN(Cc1cc(=O)n2ccccc2n1)C[C@@H]1CCCCO1	ZINC000106866350	521681435	/nfs/dbraw/zinc/68/14/35/521681435.db2.gz	GSLDVTHITGPTQV-INIZCTEOSA-N	0	3	315.417	2.476	10	0		DEAEHN
CCc1noc(C)c1NC(=O)N1CCC(N2CC=CC2)CC1	ZINC000156692660	522860870	/nfs/dbraw/zinc/86/08/70/522860870.db2.gz	FPYADWXIHLGCSF-UHFFFAOYSA-N	0	3	304.394	2.414	10	0		DEAEHN
Cc1c(C(=O)N2CC[C@H](N(C)C)C2)cnn1Cc1ccccc1	ZINC000170866189	525591967	/nfs/dbraw/zinc/59/19/67/525591967.db2.gz	NNGNTTCCVOTDBN-INIZCTEOSA-N	0	3	312.417	2.016	10	0		DEAEHN
CC(=O)c1cccc(OCC(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000247507183	534893826	/nfs/dbraw/zinc/89/38/26/534893826.db2.gz	YBUSDHHVQCZTEV-CXAGYDPISA-N	0	3	318.417	2.113	10	0		DEAEHN
C/C=C/C[C@H](NC(=O)[C@H](C)N1[C@H](C)CC[C@@H]1C)C(=O)OCC	ZINC000444309628	526294804	/nfs/dbraw/zinc/29/48/04/526294804.db2.gz	AQZXKOYQBULULT-GHJCOAFMSA-N	0	3	310.438	2.262	10	0		DEAEHN
CCN(CCNS(=O)(=O)c1ccc(F)cc1C)C(C)C	ZINC000444162376	528511956	/nfs/dbraw/zinc/51/19/56/528511956.db2.gz	AFDOUNJFJDZDKJ-UHFFFAOYSA-N	0	3	302.415	2.143	10	0		DEAEHN
CC(C)[C@H]1C[C@H](NCc2cccc(N3CCOCC3)n2)CCO1	ZINC000359101408	535265051	/nfs/dbraw/zinc/26/50/51/535265051.db2.gz	IDNGALDXFPBPNC-NVXWUHKLSA-N	0	3	319.449	2.211	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H]2CCCC23CCOCC3)C1	ZINC000332702900	535532434	/nfs/dbraw/zinc/53/24/34/535532434.db2.gz	UDHGLTBZRNPWDR-HUUCEWRRSA-N	0	3	309.454	2.119	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@](C)(CO)C2CCCCC2)C1	ZINC000120201994	535575938	/nfs/dbraw/zinc/57/59/38/535575938.db2.gz	ANIVHSATGJOUDB-RDJZCZTQSA-N	0	3	311.470	2.101	10	0		DEAEHN
CC[C@H](NC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C)c1nccs1	ZINC000262433869	535857245	/nfs/dbraw/zinc/85/72/45/535857245.db2.gz	GCAYZPXWAXGODV-KZTGVZKYSA-N	0	3	323.462	2.243	10	0		DEAEHN
CCc1cccc(NC(=O)CN2CCNC[C@@H]2c2cccnc2)c1	ZINC000261778657	535898351	/nfs/dbraw/zinc/89/83/51/535898351.db2.gz	PJHCEHAGOWNWTP-GOSISDBHSA-N	0	3	324.428	2.229	10	0		DEAEHN
CCc1cc(NC(=O)N2CCO[C@H](CN(C)C)C2)ccc1C	ZINC000182001240	536150706	/nfs/dbraw/zinc/15/07/06/536150706.db2.gz	NAYBQDBIERTBRW-MRXNPFEDSA-N	0	3	305.422	2.352	10	0		DEAEHN
CNC(=O)Cc1nc(CN2C[C@H](C)[C@@H]3CCCC[C@@H]32)cs1	ZINC000248444269	536302658	/nfs/dbraw/zinc/30/26/58/536302658.db2.gz	WBBBOVGJJKSHEL-UBHSHLNASA-N	0	3	307.463	2.442	10	0		DEAEHN
CN(CCOCCO)CCOc1c(Cl)cccc1Cl	ZINC000336809126	536397017	/nfs/dbraw/zinc/39/70/17/536397017.db2.gz	UFRSFORRKDUCJH-UHFFFAOYSA-N	0	3	308.205	2.313	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccn(-c3ccccc3)n2)C1	ZINC000247307352	536472833	/nfs/dbraw/zinc/47/28/33/536472833.db2.gz	QGUQNYKASSLUFD-MAUKXSAKSA-N	0	3	324.428	2.429	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COCc2ccccc2F)CC[C@H]1C	ZINC000251602780	536729970	/nfs/dbraw/zinc/72/99/70/536729970.db2.gz	FVWAKVPPKJNRKK-UKPHBRMFSA-N	0	3	311.397	2.060	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC[C@@H]1CCC[C@H](C)C1	ZINC000247476465	536859297	/nfs/dbraw/zinc/85/92/97/536859297.db2.gz	IGSOPNNQOUZNKG-ARFHVFGLSA-N	0	3	311.470	2.223	10	0		DEAEHN
COCC[C@@H](N)C(=O)Nc1cccc(-c2csc(C)n2)c1	ZINC000052792343	625104478	/nfs/dbraw/zinc/10/44/78/625104478.db2.gz	BUNHGJJBUQQWEH-CYBMUJFWSA-N	0	3	305.403	2.421	10	0		DEAEHN
COCC[C@H](N)C(=O)N[C@H]1CCSc2ccc(Cl)cc21	ZINC000052792483	625105081	/nfs/dbraw/zinc/10/50/81/625105081.db2.gz	YXFTWQSVQAUVPM-RYUDHWBXSA-N	0	3	314.838	2.357	10	0		DEAEHN
C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NNc2ccncc2)cc1	ZINC000180439876	625186062	/nfs/dbraw/zinc/18/60/62/625186062.db2.gz	GDIQULSTKLBXIO-ABAIWWIYSA-N	0	3	310.357	2.433	10	0		DEAEHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@H]2CCCO[C@H]2C)c1	ZINC000248965756	634460323	/nfs/dbraw/zinc/46/03/23/634460323.db2.gz	HMCBKDFUYDOSDT-AEGPPILISA-N	0	3	300.358	2.458	10	0		DEAEHN
CCCCCCN(C)CC(=O)N1CCC[C@H]1C(=O)OC(C)C	ZINC000736274112	633589078	/nfs/dbraw/zinc/58/90/78/633589078.db2.gz	QAVLHQLCBBEPOV-HNNXBMFYSA-N	0	3	312.454	2.441	10	0		DEAEHN
COC(=O)/C(C)=C\CN(CCCO)[C@H]1CCc2ccccc21	ZINC000748818222	638595633	/nfs/dbraw/zinc/59/56/33/638595633.db2.gz	SDLXKKGCSCYGNJ-QXSWTLKVSA-N	0	3	303.402	2.478	10	0		DEAEHN
CCN(C[C@@H]1CCN(C/C=C(/C)C(=O)OC)C1)CC(F)(F)F	ZINC000748825826	638596655	/nfs/dbraw/zinc/59/66/55/638596655.db2.gz	ZHAFJWWACVXBKR-XLVZXTRVSA-N	0	3	322.371	2.312	10	0		DEAEHN
COCC1(O)CCN(Cc2ccc([Si](C)(C)C)cc2)CC1	ZINC000801936037	645464921	/nfs/dbraw/zinc/46/49/21/645464921.db2.gz	ICUALTTXPJGLBY-UHFFFAOYSA-N	0	3	307.510	2.205	10	0		DEAEHN
Cn1ccc(CN[C@H]2CCC[C@@H]2CNC(=O)OC(C)(C)C)n1	ZINC000230685110	646743526	/nfs/dbraw/zinc/74/35/26/646743526.db2.gz	PMFIAXJMVPDVQC-OCCSQVGLSA-N	0	3	308.426	2.203	10	0		DEAEHN
COC(=O)[C@@H]1CCCN(Cn2cnc3cc(C)c(C)cc32)C1	ZINC000151641566	646989618	/nfs/dbraw/zinc/98/96/18/646989618.db2.gz	RPIHIYXUOQVKTH-CQSZACIVSA-N	0	3	301.390	2.496	10	0		DEAEHN
COc1ccc(-c2nc(CONC(=N)COC(C)C)no2)cc1	ZINC000731445461	647480064	/nfs/dbraw/zinc/48/00/64/647480064.db2.gz	XBGJATSMVUEEFF-UHFFFAOYSA-N	0	3	320.349	2.169	10	0		DEAEHN
COCCN1CCC[C@@H](NC(=O)/C=C(\C)c2cccc(F)c2)C1	ZINC000732080107	647539659	/nfs/dbraw/zinc/53/96/59/647539659.db2.gz	VVQXGRKGCXHNIF-GWKQRERASA-N	0	3	320.408	2.456	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)S(=O)(=O)/C=C/c1ccccc1	ZINC000175393695	648346851	/nfs/dbraw/zinc/34/68/51/648346851.db2.gz	WNOISYXHFRIEGF-SICOMBFOSA-N	0	3	308.447	2.403	10	0		DEAEHN
CN(Cc1ccccc1)C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000261539079	648375752	/nfs/dbraw/zinc/37/57/52/648375752.db2.gz	BMKGOUINTDQBQJ-RVKKMQEKSA-N	0	3	302.418	2.178	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NNc2ccncc2)c1	ZINC000180517541	648497503	/nfs/dbraw/zinc/49/75/03/648497503.db2.gz	XRXRHQCEMXPWIW-IAQYHMDHSA-N	0	3	310.357	2.433	10	0		DEAEHN
CN(C[C@H]1CCCN(C)C1)S(=O)(=O)/C=C/c1ccccc1	ZINC000115586019	652174633	/nfs/dbraw/zinc/17/46/33/652174633.db2.gz	FQSPPJWNSAZXAJ-TYZQSYOASA-N	0	3	308.447	2.261	10	0		DEAEHN
[O-]c1ccc(Cl)c(F)c1C[NH2+]C[C@H](O)CN1CCCCC1	ZINC000190855373	684415703	/nfs/dbraw/zinc/41/57/03/684415703.db2.gz	ZHAHNAFWGKCXAJ-NSHDSACASA-N	0	3	316.804	2.121	10	0		DEAEHN
CC1(CNCc2ccc(OC[C@@H]3CCCO3)cc2)OCCCO1	ZINC000192248482	684445631	/nfs/dbraw/zinc/44/56/31/684445631.db2.gz	UWSHRSQYOYXBKR-KRWDZBQOSA-N	0	3	321.417	2.487	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)[C@H]1CSCCS1)c1ccccc1	ZINC000192933731	684460862	/nfs/dbraw/zinc/46/08/62/684460862.db2.gz	WTIKUIIEKXZBBP-ZIAGYGMSSA-N	0	3	310.488	2.254	10	0		DEAEHN
Cn1ccnc1CNC1CCC(NC(=O)OC(C)(C)C)CC1	ZINC000219217113	685105842	/nfs/dbraw/zinc/10/58/42/685105842.db2.gz	DWASJXXLNJSWJD-UHFFFAOYSA-N	0	3	308.426	2.346	10	0		DEAEHN
COC[C@H]1CCCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724109841	777242746	/nfs/dbraw/zinc/24/27/46/777242746.db2.gz	ADGPJXCOVYYKPJ-VHSXEESVSA-N	0	3	305.287	2.293	10	0		DEAEHN
Brc1cc(CNC[C@H]2C[C@@H]3COC[C@@H]3O2)cs1	ZINC000724651936	777433309	/nfs/dbraw/zinc/43/33/09/777433309.db2.gz	BZTBWPRRLMKFBY-MXWKQRLJSA-N	0	3	318.236	2.404	10	0		DEAEHN
Cn1cc(CN[C@@H](CCO)C2CCCC2)c(Br)n1	ZINC000725115015	777587400	/nfs/dbraw/zinc/58/74/00/777587400.db2.gz	VLEMPVFKZFXQLA-LBPRGKRZSA-N	0	3	316.243	2.213	10	0		DEAEHN
CC(C)=CC(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000397638912	790207748	/nfs/dbraw/zinc/20/77/48/790207748.db2.gz	REDVXZOPDPXZDC-UHFFFAOYSA-N	0	3	302.418	2.096	10	0		DEAEHN
Cn1cc(CNCCCOC(C)(C)C)c(Br)n1	ZINC000712452631	792189248	/nfs/dbraw/zinc/18/92/48/792189248.db2.gz	ZJYYMWRHDISKNL-UHFFFAOYSA-N	0	3	304.232	2.477	10	0		DEAEHN
CCc1ccc(S(=O)(=O)N2CCNCCC2(C)C)s1	ZINC000712508027	792191759	/nfs/dbraw/zinc/19/17/59/792191759.db2.gz	WKGXMLPCOSZLHH-UHFFFAOYSA-N	0	3	302.465	2.073	10	0		DEAEHN
[NH3+][C@@H]1C[C@H]2C[C@@]2(C(=O)Nc2cc(Br)ccc2[O-])C1	ZINC000713200048	792216673	/nfs/dbraw/zinc/21/66/73/792216673.db2.gz	PBLVAFUYECLRIZ-WIMUKIRHSA-N	0	3	311.179	2.221	10	0		DEAEHN
NC(=O)C1CC(NCc2cc(Cl)ccc2OC(F)F)C1	ZINC000716787965	793007382	/nfs/dbraw/zinc/00/73/82/793007382.db2.gz	CXAPVEICCRCTNR-UHFFFAOYSA-N	0	3	304.724	2.295	10	0		DEAEHN
C[C@@H]1C[C@@H](NCc2cncn2C)CN(C(=O)OC(C)(C)C)C1	ZINC000401765051	801849577	/nfs/dbraw/zinc/84/95/77/801849577.db2.gz	XWJMNPSFQVRXIC-CHWSQXEVSA-N	0	3	308.426	2.155	10	0		DEAEHN
C/C=C(/C)C(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000080469279	1082267400	/nfs/dbraw/zinc/26/74/00/1082267400.db2.gz	SEOBWCFHYSCQSM-YPEHOIGNSA-N	0	3	315.461	2.277	10	0		DEAEHN
C[C@@H](Cc1ccccn1)N[C@H]1CON(C(=O)OC(C)(C)C)C1	ZINC000703316062	1086493607	/nfs/dbraw/zinc/49/36/07/1086493607.db2.gz	XEPNHBOVQCESKS-GXTWGEPZSA-N	0	3	307.394	2.153	10	0		DEAEHN
COC[C@H](C)OC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C	ZINC000704490100	1086583506	/nfs/dbraw/zinc/58/35/06/1086583506.db2.gz	QBYSEAFXEYRBCO-SQWLQELKSA-N	0	3	306.406	2.411	10	0		DEAEHN
CCn1cc(Br)cc1C(=O)N[C@@H]1CCN(C)[C@@H]1C	ZINC000719383949	1089077807	/nfs/dbraw/zinc/07/78/07/1089077807.db2.gz	AMSBSUANHLGKIO-MWLCHTKSSA-N	0	3	314.227	2.093	10	0		DEAEHN
CCN[C@@H](CSCC(=O)OC)c1ccc(OC)c(OC)c1	ZINC000081793988	192324956	/nfs/dbraw/zinc/32/49/56/192324956.db2.gz	SFCVQARMFPIUMS-LBPRGKRZSA-N	0	3	313.419	2.261	10	0		DEAEHN
CN[C@H]1c2ccc(OC)cc2CC[C@@H]1Sc1nncn1C	ZINC000081867077	192332612	/nfs/dbraw/zinc/33/26/12/192332612.db2.gz	LGPYSURRWQUSSQ-KBPBESRZSA-N	0	3	304.419	2.191	10	0		DEAEHN
Cn1c(SC[C@@H](N)c2ccc3ccccc3c2)n[nH]c1=O	ZINC000081881905	192334191	/nfs/dbraw/zinc/33/41/91/192334191.db2.gz	CTTDXNCBFSQUNC-CYBMUJFWSA-N	0	3	300.387	2.054	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)NCc2ccn(C3CCCC3)n2)C1	ZINC000151474002	282117693	/nfs/dbraw/zinc/11/76/93/282117693.db2.gz	VKGRQYZCBWYXKS-AWEZNQCLSA-N	0	3	319.453	2.139	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2cc3c(s2)CCCCC3)CCO1	ZINC000116786299	282126731	/nfs/dbraw/zinc/12/67/31/282126731.db2.gz	BSXIRHBHULBJKW-CQSZACIVSA-N	0	3	322.474	2.420	10	0		DEAEHN
CCc1ccc(CNC)cc1S(=O)(=O)N1CC[C@H](CC)C1	ZINC000163563455	197639238	/nfs/dbraw/zinc/63/92/38/197639238.db2.gz	ZYRNRSLSYLDLOA-ZDUSSCGKSA-N	0	3	310.463	2.389	10	0		DEAEHN
N[C@H](c1ccc(F)c(C(F)(F)F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000163810796	197650904	/nfs/dbraw/zinc/65/09/04/197650904.db2.gz	OSBDGHGXSQDCIE-GZMMTYOYSA-N	0	3	311.300	2.279	10	0		DEAEHN
CCCNCc1sc(CS(C)(=O)=O)nc1C(C)(C)C	ZINC000082439817	185182775	/nfs/dbraw/zinc/18/27/75/185182775.db2.gz	HGGXZXXFFZTIPH-UHFFFAOYSA-N	0	3	304.481	2.485	10	0		DEAEHN
CC[C@]1(CO)CCCN1CC(=O)N1CCC[C@H](C(F)(F)F)C1	ZINC000189649451	529431144	/nfs/dbraw/zinc/43/11/44/529431144.db2.gz	WTUJWTALHAQUKV-GXTWGEPZSA-N	0	3	322.371	2.024	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000170826745	282180501	/nfs/dbraw/zinc/18/05/01/282180501.db2.gz	VCMGRPNZBSMJFR-STQMWFEESA-N	0	3	321.421	2.110	10	0		DEAEHN
CCOC(=O)CCN1CC[C@@H](c2cc(OC)cc(OC)c2)C1	ZINC000083402938	185222260	/nfs/dbraw/zinc/22/22/60/185222260.db2.gz	SVLAOOOIWBWSOA-CYBMUJFWSA-N	0	3	307.390	2.446	10	0		DEAEHN
CNCc1cnn(Cc2cc(OC)ccc2Br)c1	ZINC000087797474	185232206	/nfs/dbraw/zinc/23/22/06/185232206.db2.gz	ODBOQRYCWZUCHB-UHFFFAOYSA-N	0	3	310.195	2.422	10	0		DEAEHN
CC[C@H](N)CS(=O)(=O)Cc1sccc1Br	ZINC000088075218	185238771	/nfs/dbraw/zinc/23/87/71/185238771.db2.gz	SZVUSAYLNFHGGG-ZETCQYMHSA-N	0	3	312.254	2.163	10	0		DEAEHN
O=S1(=O)CC[C@H](N[C@@H]2CCCc3c4ccccc4[nH]c32)C1	ZINC000087816049	185232636	/nfs/dbraw/zinc/23/26/36/185232636.db2.gz	TXTBAHVOFPRVIL-XHDPSFHLSA-N	0	3	304.415	2.322	10	0		DEAEHN
CN(C(=O)c1ccc2nc(N)sc2c1)[C@H]1CCCN(C)C1	ZINC000087847630	185233510	/nfs/dbraw/zinc/23/35/10/185233510.db2.gz	PIBBJUULWZKQDL-NSHDSACASA-N	0	3	304.419	2.045	10	0		DEAEHN
COc1ccccc1C[C@H](C)N(C)C(=O)[C@@H](N)CCSC	ZINC000088200070	185241737	/nfs/dbraw/zinc/24/17/37/185241737.db2.gz	MJFDGZBSFOINHH-JSGCOSHPSA-N	0	3	310.463	2.165	10	0		DEAEHN
CCO[C@H](CN)CS(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000088315629	185245267	/nfs/dbraw/zinc/24/52/67/185245267.db2.gz	GWXIXRYNBVBWGR-MRVPVSSYSA-N	0	3	312.218	2.131	10	0		DEAEHN
CC[C@@H](CN)S(=O)(=O)Nc1ccc(N2CCCCC2)cc1	ZINC000088474046	185252130	/nfs/dbraw/zinc/25/21/30/185252130.db2.gz	GIEWKYNGAVAZDI-HNNXBMFYSA-N	0	3	311.451	2.156	10	0		DEAEHN
C[C@@H](CN)S(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000088472084	185252362	/nfs/dbraw/zinc/25/23/62/185252362.db2.gz	UOEYRELWLFSHNH-NSHDSACASA-N	0	3	302.399	2.347	10	0		DEAEHN
COC(=O)[C@@](C)(N)CCCCN1CCC[C@H](C(F)(F)F)C1	ZINC000088435182	185250091	/nfs/dbraw/zinc/25/00/91/185250091.db2.gz	VNKCMPSHTDTLIG-AAEUAGOBSA-N	0	3	310.360	2.321	10	0		DEAEHN
CCOC(=O)[C@@](C)(N)CCCN1CCC[C@H](C(F)(F)F)C1	ZINC000088435289	185250314	/nfs/dbraw/zinc/25/03/14/185250314.db2.gz	HTULHEIHQIXLOT-AAEUAGOBSA-N	0	3	310.360	2.321	10	0		DEAEHN
C[C@@H]1CCN(S(=O)(=O)c2ccc(CNC(C)(C)C)o2)C1	ZINC000088544034	185256697	/nfs/dbraw/zinc/25/66/97/185256697.db2.gz	MAXNOVTYICIYES-LLVKDONJSA-N	0	3	300.424	2.198	10	0		DEAEHN
C[C@@H](N)c1cc(Br)ccc1OCc1ncnn1C	ZINC000088571759	185258264	/nfs/dbraw/zinc/25/82/64/185258264.db2.gz	FNYNOVXKWLMSOM-MRVPVSSYSA-N	0	3	311.183	2.176	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1sc2ncccc2c1N	ZINC000088643238	185261201	/nfs/dbraw/zinc/26/12/01/185261201.db2.gz	IVFHVQDUMURRME-JTQLQIEISA-N	0	3	304.419	2.045	10	0		DEAEHN
Cc1ccccc1S(=O)(=O)N1CCCC[C@@H]1CNC1CC1	ZINC000088716903	185263076	/nfs/dbraw/zinc/26/30/76/185263076.db2.gz	MWHBTUPKBMJIOY-OAHLLOKOSA-N	0	3	308.447	2.290	10	0		DEAEHN
CCN(C1CNC1)S(=O)(=O)c1c(C)c(C)c(C)c(C)c1C	ZINC000090291400	185289697	/nfs/dbraw/zinc/28/96/97/185289697.db2.gz	ZHCJBPJXTBMQLB-UHFFFAOYSA-N	0	3	310.463	2.211	10	0		DEAEHN
N[C@@H]1COC[C@H]1c1nc(CSc2ccc(Cl)cc2)no1	ZINC000090365063	185292792	/nfs/dbraw/zinc/29/27/92/185292792.db2.gz	CTEPPMZYCDNDTI-GHMZBOCLSA-N	0	3	311.794	2.456	10	0		DEAEHN
N[C@@H]1COC[C@H]1C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000090379194	185293422	/nfs/dbraw/zinc/29/34/22/185293422.db2.gz	ZRDGCLNFWHXERL-GMSGAONNSA-N	0	3	308.687	2.271	10	0		DEAEHN
N[C@@H]1COC[C@@H]1C(=O)Nc1c(Cl)cccc1C(F)(F)F	ZINC000090379135	185293455	/nfs/dbraw/zinc/29/34/55/185293455.db2.gz	VIFNGSBSLBGZCI-IMTBSYHQSA-N	0	3	308.687	2.271	10	0		DEAEHN
N[C@@H]1COC[C@@H]1C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000090379195	185293533	/nfs/dbraw/zinc/29/35/33/185293533.db2.gz	ZRDGCLNFWHXERL-OIBJUYFYSA-N	0	3	308.687	2.271	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1nc2ccc(Cl)cc2s1	ZINC000090431483	185295899	/nfs/dbraw/zinc/29/58/99/185295899.db2.gz	NEPZJJLRRDBYFM-SCZZXKLOSA-N	0	3	311.794	2.123	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1ccccc1SC(F)F	ZINC000090431542	185295969	/nfs/dbraw/zinc/29/59/69/185295969.db2.gz	WDXFWDIPHDYRFZ-PSASIEDQSA-N	0	3	302.346	2.174	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)N1CCC[C@@H]1c1ccccc1Cl	ZINC000090435337	185296086	/nfs/dbraw/zinc/29/60/86/185296086.db2.gz	RULBMYYOUKSIIR-NWANDNLSSA-N	0	3	308.809	2.238	10	0		DEAEHN
Cc1cc(Br)ccc1NC(=O)[C@]1(C)COC[C@@H]1N	ZINC000090580355	185305018	/nfs/dbraw/zinc/30/50/18/185305018.db2.gz	SUWDLYOSKDVZDN-WCQYABFASA-N	0	3	313.195	2.060	10	0		DEAEHN
C[C@@]1(c2nnc3c(Cl)cc(C(F)(F)F)cn32)COC[C@H]1N	ZINC000090573057	185304304	/nfs/dbraw/zinc/30/43/04/185304304.db2.gz	SXZCFRIPFSVOCX-LDYMZIIASA-N	0	3	320.702	2.017	10	0		DEAEHN
COc1ccc(C(=O)N2CCCSC[C@H]2CN(C)C)cc1	ZINC000090699820	185310385	/nfs/dbraw/zinc/31/03/85/185310385.db2.gz	WGOUTKKINDBPSN-CQSZACIVSA-N	0	3	308.447	2.205	10	0		DEAEHN
O=C(c1ccccn1)N1CCCSC[C@H]1CN1CCCC1	ZINC000090700857	185310600	/nfs/dbraw/zinc/31/06/00/185310600.db2.gz	XGPDIKUZOFIWEA-CQSZACIVSA-N	0	3	305.447	2.125	10	0		DEAEHN
Cc1cccc(CC(=O)N2CCCSC[C@H]2CN(C)C)c1	ZINC000090699967	185310623	/nfs/dbraw/zinc/31/06/23/185310623.db2.gz	JHUZJNUMXVOFMG-MRXNPFEDSA-N	0	3	306.475	2.433	10	0		DEAEHN
C[NH2+][C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccnc(C)c2)cc1	ZINC000092364741	185314032	/nfs/dbraw/zinc/31/40/32/185314032.db2.gz	AVEVVPAEFCCAMR-LBPRGKRZSA-N	0	3	305.403	2.471	10	0		DEAEHN
CCCc1nnsc1C(=O)Nc1cccc2c1CNCC2	ZINC000167369235	197708176	/nfs/dbraw/zinc/70/81/76/197708176.db2.gz	IHNJDXNHBFMQJY-UHFFFAOYSA-N	0	3	302.403	2.389	10	0		DEAEHN
Cc1cc(CN[C@H]2CN(C(C)C)C[C@@H]2C)ccc1S(C)(=O)=O	ZINC000095413095	185358013	/nfs/dbraw/zinc/35/80/13/185358013.db2.gz	BYVQXGCEJBHBSS-HOCLYGCPSA-N	0	3	324.490	2.217	10	0		DEAEHN
CCC(CC)[C@H](O)CNC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000111826633	282280054	/nfs/dbraw/zinc/28/00/54/282280054.db2.gz	WUHVVOFGORXEPP-HUUCEWRRSA-N	0	3	301.475	2.059	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000181551853	199316236	/nfs/dbraw/zinc/31/62/36/199316236.db2.gz	OWVPIHHAWMTOKQ-YOEHRIQHSA-N	0	3	319.449	2.097	10	0		DEAEHN
C[C@@H]1CC[C@@](CO)(N(C)CC(=O)NCc2cccc(Cl)c2)C1	ZINC000187903835	282294433	/nfs/dbraw/zinc/29/44/33/282294433.db2.gz	GRHUFKMHJSWFHI-CXAGYDPISA-N	0	3	324.852	2.439	10	0		DEAEHN
COc1cc(C[NH2+]CC2(CO)CC2)cc(Br)c1[O-]	ZINC000118906979	539442527	/nfs/dbraw/zinc/44/25/27/539442527.db2.gz	MXIXUFPOVXOBFC-UHFFFAOYSA-N	0	3	316.195	2.025	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@H](C)Cc1c(C)nn(C)c1C	ZINC000245433267	282387751	/nfs/dbraw/zinc/38/77/51/282387751.db2.gz	PPSCZMYYISXHFA-CJNGLKHVSA-N	0	3	320.481	2.158	10	0		DEAEHN
CN(Cc1ccc(OC(F)(F)F)cc1)C[C@@H]1CNCCO1	ZINC000125492384	539472939	/nfs/dbraw/zinc/47/29/39/539472939.db2.gz	UCIAPVDKOUECEF-ZDUSSCGKSA-N	0	3	304.312	2.005	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](NC[C@]1(CCO)CCOC1)CCCO2	ZINC000125477647	539472613	/nfs/dbraw/zinc/47/26/13/539472613.db2.gz	CYCPGQZTZYDUFY-WMZOPIPTSA-N	0	3	321.417	2.288	10	0		DEAEHN
CCN1C(=O)C[C@H](N)[C@H]1c1cc(Br)ccc1F	ZINC000070293217	190878281	/nfs/dbraw/zinc/87/82/81/190878281.db2.gz	NFLUMIUECCAVHL-CMPLNLGQSA-N	0	3	301.159	2.209	10	0		DEAEHN
Cc1cc(N2CCC[C@@H](NCc3ccc(C)s3)C2=O)n(C)n1	ZINC000080526678	192165130	/nfs/dbraw/zinc/16/51/30/192165130.db2.gz	QCVUGCAKCVUGEI-CQSZACIVSA-N	0	3	318.446	2.384	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(Br)c[nH]1	ZINC000083550449	192372416	/nfs/dbraw/zinc/37/24/16/192372416.db2.gz	RNMMSMJOTSEJAI-GXSJLCMTSA-N	0	3	312.211	2.086	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cncc(Br)c1	ZINC000083550528	192372431	/nfs/dbraw/zinc/37/24/31/192372431.db2.gz	DJSIFRIPTUMFCY-ZWNOBZJWSA-N	0	3	324.222	2.153	10	0		DEAEHN
CC[C@H]1CN(Cc2cccc(OC)c2F)CCN1C[C@@H](C)O	ZINC000192950787	539710526	/nfs/dbraw/zinc/71/05/26/539710526.db2.gz	XQSIPOWJYXZJBV-HIFRSBDPSA-N	0	3	310.413	2.111	10	0		DEAEHN
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170827722	197831819	/nfs/dbraw/zinc/83/18/19/197831819.db2.gz	GKZLHZBKGBUCRO-UKRRQHHQSA-N	0	3	305.422	2.059	10	0		DEAEHN
Cc1c(C(=O)NCc2ccc(OCCN(C)C)cc2)ccn1C	ZINC000195209796	539720913	/nfs/dbraw/zinc/72/09/13/539720913.db2.gz	BUACBXYWDIEGDZ-UHFFFAOYSA-N	0	3	315.417	2.204	10	0		DEAEHN
Cc1sc(Br)cc1[C@@H](N)[C@H]1CCS(=O)(=O)C1	ZINC000084006097	192395764	/nfs/dbraw/zinc/39/57/64/192395764.db2.gz	UKWKGDRVTCVDFX-XVKPBYJWSA-N	0	3	324.265	2.254	10	0		DEAEHN
COc1cc2c(c(OC)c1)[C@@H](CN)N(Cc1nccs1)C2	ZINC000071683929	191007271	/nfs/dbraw/zinc/00/72/71/191007271.db2.gz	KISZJZCOEHMVQR-GFCCVEGCSA-N	0	3	305.403	2.176	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)Nc2cnn(C(C)(C)C)c2)C1	ZINC000245541809	539756864	/nfs/dbraw/zinc/75/68/64/539756864.db2.gz	QTMKZHRKHJWDNW-GXTWGEPZSA-N	0	3	307.442	2.488	10	0		DEAEHN
CC[C@@H](C)N(C)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138457507	186016953	/nfs/dbraw/zinc/01/69/53/186016953.db2.gz	NPPFSHGPCIDVBN-SECBINFHSA-N	0	3	306.378	2.103	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N(C)[C@@H](C)C2CC2)c1	ZINC000138517057	186017934	/nfs/dbraw/zinc/01/79/34/186017934.db2.gz	YBXDTLLALLITNX-VIFPVBQESA-N	0	3	318.389	2.103	10	0		DEAEHN
CS(=O)(=O)c1cccc2[nH]c(C3(N)CCCCCC3)nc21	ZINC000138156345	186014202	/nfs/dbraw/zinc/01/42/02/186014202.db2.gz	GWSQKKLBEGEAAC-UHFFFAOYSA-N	0	3	307.419	2.475	10	0		DEAEHN
CN[C@@H](Cc1cnccc1N)c1ncccc1Br	ZINC000140423367	186026897	/nfs/dbraw/zinc/02/68/97/186026897.db2.gz	LUBCLANXWWLJIA-LBPRGKRZSA-N	0	3	307.195	2.325	10	0		DEAEHN
CCCn1ncnc1C[C@@H](N)c1ncccc1Br	ZINC000140363924	186026957	/nfs/dbraw/zinc/02/69/57/186026957.db2.gz	QILVMKLAHXPJAW-SNVBAGLBSA-N	0	3	310.199	2.088	10	0		DEAEHN
Cc1ccc([C@H]2N[C@H](CC(C)C)C(=O)N2CCN(C)C)s1	ZINC000140032824	186025582	/nfs/dbraw/zinc/02/55/82/186025582.db2.gz	QOBTUIVOHDKCPI-HIFRSBDPSA-N	0	3	309.479	2.463	10	0		DEAEHN
Cc1ccc([C@H](O)c2c(Cl)cnn2CCN(C)C)c(C)n1	ZINC000140167255	186026215	/nfs/dbraw/zinc/02/62/15/186026215.db2.gz	RCAXQVQILZGYPR-HNNXBMFYSA-N	0	3	308.813	2.192	10	0		DEAEHN
COc1ccc(OC)c([C@H]2CCCN2CCCNC(C)=O)c1	ZINC000142791595	186032483	/nfs/dbraw/zinc/03/24/83/186032483.db2.gz	IUOIPTWCFODNPD-MRXNPFEDSA-N	0	3	306.406	2.367	10	0		DEAEHN
NC1(C(=O)NCc2cc(Br)ccc2F)CCC1	ZINC000148155519	186042845	/nfs/dbraw/zinc/04/28/45/186042845.db2.gz	XDXHJPZMUATTNQ-UHFFFAOYSA-N	0	3	301.159	2.086	10	0		DEAEHN
Nc1ccc(SC[C@@H]2CNCCO2)c(Br)c1	ZINC000148264912	186043787	/nfs/dbraw/zinc/04/37/87/186043787.db2.gz	ZEAQAXRDHLYFCL-VIFPVBQESA-N	0	3	303.225	2.112	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@@H](C)C(=O)N2CCN2CCCCC2)s1	ZINC000144040006	186033907	/nfs/dbraw/zinc/03/39/07/186033907.db2.gz	OAGDDYYCMQNGJC-DZGCQCFKSA-N	0	3	307.463	2.361	10	0		DEAEHN
O=C1[C@H](NC2CC2)CCN1Cc1sccc1Br	ZINC000148892295	186046290	/nfs/dbraw/zinc/04/62/90/186046290.db2.gz	WACRYOGISLJHHC-SNVBAGLBSA-N	0	3	315.236	2.364	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1C	ZINC000150805395	186067545	/nfs/dbraw/zinc/06/75/45/186067545.db2.gz	LVDNGDBLRHXQQI-GOEBONIOSA-N	0	3	317.433	2.087	10	0		DEAEHN
Cc1ccc(Br)c(NC(=O)[C@@]2(C)COC[C@H]2N)c1	ZINC000163966817	186144010	/nfs/dbraw/zinc/14/40/10/186144010.db2.gz	FMSDPADXUWQUGQ-YPMHNXCESA-N	0	3	313.195	2.060	10	0		DEAEHN
Cc1ccc(CNCCc2nncn2C)c(Br)c1	ZINC000164036599	186146397	/nfs/dbraw/zinc/14/63/97/186146397.db2.gz	XFVRUBAWTOWJQJ-UHFFFAOYSA-N	0	3	309.211	2.218	10	0		DEAEHN
C[C@@H](C(=O)Nc1cccc(CN)c1)[S@@](=O)c1ccccc1	ZINC000155907113	186122460	/nfs/dbraw/zinc/12/24/60/186122460.db2.gz	OXCHWMGOONADTG-QKVFXAPYSA-N	0	3	302.399	2.280	10	0		DEAEHN
CC(C(=O)N(C)Cc1ccccc1Br)=C1CNC1	ZINC000164145886	186150626	/nfs/dbraw/zinc/15/06/26/186150626.db2.gz	PSIXEPNPWBIGBU-UHFFFAOYSA-N	0	3	309.207	2.327	10	0		DEAEHN
CC(C)COc1ncccc1C(=O)N1CCN2CCC[C@H]2C1	ZINC000171480309	186166405	/nfs/dbraw/zinc/16/64/05/186166405.db2.gz	CVZITVWXVHIMMJ-AWEZNQCLSA-N	0	3	303.406	2.037	10	0		DEAEHN
CCN(C)[C@@H](C(=O)N1CCCN(C2CC2)CC1)c1ccccc1	ZINC000171480664	186166718	/nfs/dbraw/zinc/16/67/18/186166718.db2.gz	YVPUQXLFSCWYRA-GOSISDBHSA-N	0	3	315.461	2.376	10	0		DEAEHN
CC(C)c1csc(CNC(=O)N2CCN3CCC[C@@H]3C2)n1	ZINC000177908813	186202902	/nfs/dbraw/zinc/20/29/02/186202902.db2.gz	DRBFNAKXQUJLIN-GFCCVEGCSA-N	0	3	308.451	2.256	10	0		DEAEHN
O=C(NCc1ccc(F)c(Cl)c1)N1CCN2CCC[C@@H]2C1	ZINC000171906455	198006588	/nfs/dbraw/zinc/00/65/88/198006588.db2.gz	OHQSNBXOXMNOTH-GFCCVEGCSA-N	0	3	311.788	2.469	10	0		DEAEHN
COCc1csc(NC(=O)C2Oc3ccccc3O[C@H]2C)n1	ZINC000172152650	198048104	/nfs/dbraw/zinc/04/81/04/198048104.db2.gz	OZCURHAARLSBKI-ZANVPECISA-N	0	3	320.370	2.457	10	0		DEAEHN
C[C@H](C(=O)N1CCO[C@H](c2nccs2)C1)N1CCCCCC1	ZINC000173271719	198204205	/nfs/dbraw/zinc/20/42/05/198204205.db2.gz	VWIUVSLIZUPZPT-KGLIPLIRSA-N	0	3	323.462	2.308	10	0		DEAEHN
Cc1ccccc1NC(=O)CCN1CCC[C@@H](n2cncn2)C1	ZINC000173365622	198207807	/nfs/dbraw/zinc/20/78/07/198207807.db2.gz	FRHRQALAWKDYAU-OAHLLOKOSA-N	0	3	313.405	2.252	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCN(C)c2ccccc2)CCN1C	ZINC000173598746	198231725	/nfs/dbraw/zinc/23/17/25/198231725.db2.gz	STADQYKOLOOYPE-WBVHZDCISA-N	0	3	318.465	2.247	10	0		DEAEHN
Cc1cccc(O[C@@H](C)CNC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000173915642	198268427	/nfs/dbraw/zinc/26/84/27/198268427.db2.gz	QOYWOEYJRQWUBV-LSDHHAIUSA-N	0	3	305.422	2.108	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCOc2cccc(F)c2)CCN1C	ZINC000174046750	198285165	/nfs/dbraw/zinc/28/51/65/198285165.db2.gz	QKUKEUZEGNXCIF-HIFRSBDPSA-N	0	3	323.412	2.329	10	0		DEAEHN
Cc1ccc(O[C@@H](C)CNC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000174351730	198323674	/nfs/dbraw/zinc/32/36/74/198323674.db2.gz	IBDTVXHGSFTBIT-GJZGRUSLSA-N	0	3	305.422	2.156	10	0		DEAEHN
C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC2CCN(C)CC2)c1	ZINC000054147897	354454832	/nfs/dbraw/zinc/45/48/32/354454832.db2.gz	LZECXEYYWQUAEM-WBMJQRKESA-N	0	3	315.417	2.105	10	0		DEAEHN
CCCOc1ncccc1CNC(=O)N[C@H]1CCCN(CC)C1	ZINC000064767546	354672916	/nfs/dbraw/zinc/67/29/16/354672916.db2.gz	IZEHICXPPVXTIO-HNNXBMFYSA-N	0	3	320.437	2.154	10	0		DEAEHN
CN[C@H](C)C(=O)N1C[C@H](C)N(Cc2ccccc2)[C@@H](C)[C@H]1C	ZINC000404312539	540145253	/nfs/dbraw/zinc/14/52/53/540145253.db2.gz	MCWKTBQRNVSWPL-XUWVNRHRSA-N	0	3	303.450	2.104	10	0		DEAEHN
C[C@@H](NCCN1CCCS1(=O)=O)c1cccc(Cl)c1	ZINC000089519695	355535276	/nfs/dbraw/zinc/53/52/76/355535276.db2.gz	UFUGILDQFYSDRK-LLVKDONJSA-N	0	3	302.827	2.026	10	0		DEAEHN
Cc1ccc2nc(C(=O)NCCN3CCCC[C@H]3C)cn2c1	ZINC000097939162	355705660	/nfs/dbraw/zinc/70/56/60/355705660.db2.gz	XEDNDFKMQXHACP-CQSZACIVSA-N	0	3	300.406	2.247	10	0		DEAEHN
Cc1cccc(CNC(=O)NCc2cccc(CN(C)C)c2)n1	ZINC000123906828	355807191	/nfs/dbraw/zinc/80/71/91/355807191.db2.gz	JDRPMXVBXHCECT-UHFFFAOYSA-N	0	3	312.417	2.451	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000139475324	355877552	/nfs/dbraw/zinc/87/75/52/355877552.db2.gz	LWQLOPABEZLHLI-ZDUSSCGKSA-N	0	3	312.417	2.330	10	0		DEAEHN
O=C(CN[C@H]1CCCC[C@@H]1n1cccn1)NC1CCCCC1	ZINC000128166689	355827649	/nfs/dbraw/zinc/82/76/49/355827649.db2.gz	LPYHHBZIZFBWFU-HOTGVXAUSA-N	0	3	304.438	2.405	10	0		DEAEHN
C[C@]1(CN(Cc2ccccc2)Cc2ccccc2)NC(=O)NC1=O	ZINC000149755882	355919998	/nfs/dbraw/zinc/91/99/98/355919998.db2.gz	WNEOEWOGCKRZSL-LJQANCHMSA-N	0	3	323.396	2.287	10	0		DEAEHN
CNc1cc(N2CCC[C@@H]2CN[C@H](C)c2ccoc2)ncn1	ZINC000180572829	356053294	/nfs/dbraw/zinc/05/32/94/356053294.db2.gz	OUEDEORRBBDWRD-TZMCWYRMSA-N	0	3	301.394	2.431	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)NCC2CCC(C)(C)CC2)CCO1	ZINC000179604415	356029543	/nfs/dbraw/zinc/02/95/43/356029543.db2.gz	SCKGOVNSGKLXPQ-OAHLLOKOSA-N	0	3	311.470	2.175	10	0		DEAEHN
CCN(CC)C(=O)[C@@H]1CCCN1C[C@H](O)CCc1ccccc1	ZINC000182272947	356118139	/nfs/dbraw/zinc/11/81/39/356118139.db2.gz	LREGEHHJKJZUGF-MSOLQXFVSA-N	0	3	318.461	2.313	10	0		DEAEHN
Cc1csc(=O)n1CCN[C@@H](C)c1ccc2c(c1)OCO2	ZINC000182282091	356119333	/nfs/dbraw/zinc/11/93/33/356119333.db2.gz	PCHSCTUPEXFLLT-NSHDSACASA-N	0	3	306.387	2.298	10	0		DEAEHN
Cc1ccc(NC(=O)CN(CC(N)=S)C2CCCC2)cc1	ZINC000080223168	192014075	/nfs/dbraw/zinc/01/40/75/192014075.db2.gz	LYPJQZHGCHZCEA-UHFFFAOYSA-N	0	3	305.447	2.464	10	0		DEAEHN
C[C@H](CN[C@H](C)c1cccc(-n2cccn2)c1)CS(C)(=O)=O	ZINC000183594701	356176657	/nfs/dbraw/zinc/17/66/57/356176657.db2.gz	JMCKXVNBCFJCCL-ZIAGYGMSSA-N	0	3	321.446	2.204	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1n[nH]nc1-c1ccccc1	ZINC000194203583	356234789	/nfs/dbraw/zinc/23/47/89/356234789.db2.gz	CJODEMNZIMYIFG-CQSZACIVSA-N	0	3	313.405	2.028	10	0		DEAEHN
CN(CCCNC(=O)NC[C@@H]1CCCN1C)c1ccccc1F	ZINC000195132302	356249897	/nfs/dbraw/zinc/24/98/97/356249897.db2.gz	KEHNTYWNEQHWID-AWEZNQCLSA-N	0	3	322.428	2.045	10	0		DEAEHN
CC(C)(C)OCCNC[C@H](O)COc1ccccc1Cl	ZINC000308511315	356410433	/nfs/dbraw/zinc/41/04/33/356410433.db2.gz	ICHXSZSWDLGLKJ-LBPRGKRZSA-N	0	3	301.814	2.484	10	0		DEAEHN
NC[C@@H](c1c(Cl)cccc1Cl)N1CCn2cnnc2C1	ZINC000081533066	192285068	/nfs/dbraw/zinc/28/50/68/192285068.db2.gz	IMVRLMXDRUYVCG-NSHDSACASA-N	0	3	312.204	2.101	10	0		DEAEHN
CNC(=O)C(C)(C)CNCc1ccsc1Br	ZINC000389002719	356707264	/nfs/dbraw/zinc/70/72/64/356707264.db2.gz	ZRMJAIQVXVRYIP-UHFFFAOYSA-N	0	3	305.241	2.372	10	0		DEAEHN
Brc1cccc(CN2CC[C@@H]3OCCN[C@H]3C2)c1	ZINC000404040291	356730652	/nfs/dbraw/zinc/73/06/52/356730652.db2.gz	AUGHSUDASURWLE-KBPBESRZSA-N	0	3	311.223	2.012	10	0		DEAEHN
CN(Cc1cccc(Br)c1)C[C@H]1CN(C)CCO1	ZINC000404170562	356731751	/nfs/dbraw/zinc/73/17/51/356731751.db2.gz	NRPQAONHKCTZSS-CQSZACIVSA-N	0	3	313.239	2.212	10	0		DEAEHN
CCOCC[C@@H](O)CN1CCC[C@@H](CC(=O)OC(C)(C)C)C1	ZINC000578875897	356885433	/nfs/dbraw/zinc/88/54/33/356885433.db2.gz	BYHPZAKIBIHVHM-LSDHHAIUSA-N	0	3	315.454	2.218	10	0		DEAEHN
CC(C)NCc1cc(S(=O)(=O)N2CCC[C@@H]2C)ccc1F	ZINC000088972568	192676107	/nfs/dbraw/zinc/67/61/07/192676107.db2.gz	RXBJUXLIFCCNDB-LBPRGKRZSA-N	0	3	314.426	2.497	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H](C)c1ccc(-n2cncn2)cc1)N(C)C	ZINC000179334198	199017361	/nfs/dbraw/zinc/01/73/61/199017361.db2.gz	DSWZTXKXPVMMSM-BBRMVZONSA-N	0	3	315.421	2.175	10	0		DEAEHN
CN1CC[C@@H](NC(=O)COCC(F)(F)F)[C@@H]1c1ccccc1	ZINC000180189371	199128871	/nfs/dbraw/zinc/12/88/71/199128871.db2.gz	PHYXNWUAXOBZEK-OCCSQVGLSA-N	0	3	316.323	2.127	10	0		DEAEHN
Cc1nn(C)cc1[C@@H](C)N[C@H]1CCc2nnc(C(C)C)n2C1	ZINC000180501022	199168469	/nfs/dbraw/zinc/16/84/69/199168469.db2.gz	GUDSZHJXTBYUDY-YPMHNXCESA-N	0	3	302.426	2.109	10	0		DEAEHN
CC[C@@H](N[C@H]1CCc2nnc(C(C)C)n2C1)c1cnn(C)c1	ZINC000180508224	199169299	/nfs/dbraw/zinc/16/92/99/199169299.db2.gz	MLFOWRQBKFPXIR-UONOGXRCSA-N	0	3	302.426	2.191	10	0		DEAEHN
COc1ccc(C[C@@H](C)C(=O)N2CC[C@@H](N(C)C)C2)cc1OC	ZINC000180703769	199199323	/nfs/dbraw/zinc/19/93/23/199199323.db2.gz	JTTGQGZAPDCNMF-UKRRQHHQSA-N	0	3	320.433	2.045	10	0		DEAEHN
CCCCNC(=O)CN[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000180659361	199192784	/nfs/dbraw/zinc/19/27/84/199192784.db2.gz	GBIMTKFOAUNTEO-CQSZACIVSA-N	0	3	300.406	2.439	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN1CCC(CCC(=O)OC(C)(C)C)CC1	ZINC000595719414	358532538	/nfs/dbraw/zinc/53/25/38/358532538.db2.gz	UGUKMQIQSWFYHP-KRWDZBQOSA-N	0	3	313.438	2.160	10	0		DEAEHN
COc1cc(CN(C)C[C@@H]2CCCC[C@@H]2O)cc2c1OCCO2	ZINC000181094361	199251567	/nfs/dbraw/zinc/25/15/67/199251567.db2.gz	QUASEJRATYKPGH-GJZGRUSLSA-N	0	3	321.417	2.449	10	0		DEAEHN
CN(c1ccc(F)cc1)S(=O)(=O)c1cc(CN)ccc1F	ZINC000089014810	192700151	/nfs/dbraw/zinc/70/01/51/192700151.db2.gz	JGVHCZFTEARTEE-UHFFFAOYSA-N	0	3	312.341	2.249	10	0		DEAEHN
Cc1csc([C@H](C)CNC(=O)N2CCN3CCC[C@@H]3C2)n1	ZINC000186806355	200013981	/nfs/dbraw/zinc/01/39/81/200013981.db2.gz	QNZJRGLHJUZICK-DGCLKSJQSA-N	0	3	308.451	2.045	10	0		DEAEHN
Cc1nccnc1[C@H](C)NC1CCN(Cc2ccncc2)CC1	ZINC000187795960	200158555	/nfs/dbraw/zinc/15/85/55/200158555.db2.gz	DXBDMFAUKWNXHS-HNNXBMFYSA-N	0	3	311.433	2.495	10	0		DEAEHN
CN(C[C@H](O)COc1cccc2[nH]ccc21)C[C@@H]1CCCO1	ZINC000187816800	200160859	/nfs/dbraw/zinc/16/08/59/200160859.db2.gz	PVMMTQGREUXNML-KBPBESRZSA-N	0	3	304.390	2.018	10	0		DEAEHN
CCC[C@H](C(=O)N1C[C@@H](c2ccsc2)[C@H](CO)C1)N(C)C	ZINC000187690273	200144942	/nfs/dbraw/zinc/14/49/42/200144942.db2.gz	ZEQBVCSXCAYLPD-SOUVJXGZSA-N	0	3	310.463	2.013	10	0		DEAEHN
Cc1nccnc1[C@@H](C)NCCCNC(=O)c1cccs1	ZINC000188197185	200207773	/nfs/dbraw/zinc/20/77/73/200207773.db2.gz	QRJWKFIMWDPADR-LLVKDONJSA-N	0	3	304.419	2.317	10	0		DEAEHN
CCN1CC[C@@H](CNC(=O)C[C@@H](C)C(=O)c2ccccc2)C1	ZINC000602103551	360266405	/nfs/dbraw/zinc/26/64/05/360266405.db2.gz	FYVBTJGNTCLADZ-CABCVRRESA-N	0	3	302.418	2.354	10	0		DEAEHN
CCOc1cc2nccc(N3CC(CO)C3)c2cc1OCC	ZINC000192180103	200831886	/nfs/dbraw/zinc/83/18/86/200831886.db2.gz	LAIKVRCVIFQOLK-UHFFFAOYSA-N	0	3	302.374	2.461	10	0		DEAEHN
Cc1nn(C)c(C)c1NC(=O)NCCN1CCCC(C)(C)C1	ZINC000444948434	238363283	/nfs/dbraw/zinc/36/32/83/238363283.db2.gz	DHCCQHJJOROOOM-UHFFFAOYSA-N	0	3	307.442	2.280	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1C[C@@H](C)O[C@H](C(F)(F)F)C1	ZINC000608597726	361236232	/nfs/dbraw/zinc/23/62/32/361236232.db2.gz	AZSYQVVJLMFSEM-UTUOFQBUSA-N	0	3	308.344	2.039	10	0		DEAEHN
CC(=O)[C@H](C)CCCCC(=O)NC1CCN([C@@H]2CCOC2)CC1	ZINC000620012284	363932245	/nfs/dbraw/zinc/93/22/45/363932245.db2.gz	YIZYDMLQVXTBDG-RHSMWYFYSA-N	0	3	324.465	2.141	10	0		DEAEHN
NC[C@@H](NC(=O)c1cscc1C(F)(F)F)C(F)(F)F	ZINC000621668477	364498006	/nfs/dbraw/zinc/49/80/06/364498006.db2.gz	GHTVPCSQXYXGRZ-ZCFIWIBFSA-N	0	3	306.231	2.386	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2ccc3occc3c2)CC12COC2	ZINC000449356210	240388663	/nfs/dbraw/zinc/38/86/63/240388663.db2.gz	AZOVVEVFTRGFEB-OAHLLOKOSA-N	0	3	315.369	2.444	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2ccc(F)cc2C)CC12COC2	ZINC000449359114	240396430	/nfs/dbraw/zinc/39/64/30/240396430.db2.gz	GHZFAXOBDMLUHP-HNNXBMFYSA-N	0	3	307.365	2.146	10	0		DEAEHN
C=Cn1cc(CNC[C@@H]2CCN2Cc2ccc(OC)cc2)cn1	ZINC000623641560	365114128	/nfs/dbraw/zinc/11/41/28/365114128.db2.gz	YHIANGFLLKEQJC-KRWDZBQOSA-N	0	3	312.417	2.356	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)C[C@H](O)c1cccc(F)c1	ZINC000091229925	193024176	/nfs/dbraw/zinc/02/41/76/193024176.db2.gz	PIGGSQJIIUJAQZ-HOTGVXAUSA-N	0	3	310.413	2.342	10	0		DEAEHN
C[C@H](NC[C@H]1CN(C)CCO1)c1cccc(OC(F)F)c1	ZINC000091667720	193087729	/nfs/dbraw/zinc/08/77/29/193087729.db2.gz	HCWLWBCBGTVJJH-FZMZJTMJSA-N	0	3	300.349	2.269	10	0		DEAEHN
c1c(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)nnn1CC1CC1	ZINC000450605019	242010877	/nfs/dbraw/zinc/01/08/77/242010877.db2.gz	YDAHVZBHLBPXMF-MAUKXSAKSA-N	0	3	315.465	2.137	10	0		DEAEHN
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(Br)cc1	ZINC000450677597	242088167	/nfs/dbraw/zinc/08/81/67/242088167.db2.gz	RONPLPQGVDDKLP-TVQRCGJNSA-N	0	3	300.196	2.440	10	0		DEAEHN
CCNCc1cccc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)c1C	ZINC000092113416	193161060	/nfs/dbraw/zinc/16/10/60/193161060.db2.gz	GGBLQNTWWYXRAL-CHWSQXEVSA-N	0	3	310.463	2.381	10	0		DEAEHN
CCCNCc1cc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)c(C)o1	ZINC000092113408	193161600	/nfs/dbraw/zinc/16/16/00/193161600.db2.gz	USIACLILMWVPIR-RYUDHWBXSA-N	0	3	314.451	2.364	10	0		DEAEHN
CCCCCN(C)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115647	193163419	/nfs/dbraw/zinc/16/34/19/193163419.db2.gz	WDFMGXCCZOXZGA-UHFFFAOYSA-N	0	3	302.415	2.356	10	0		DEAEHN
C[C@@H]1CCC[C@@H](N(C)S(=O)(=O)c2ccc(CN)cc2F)C1	ZINC000092115914	193163881	/nfs/dbraw/zinc/16/38/81/193163881.db2.gz	CXZHYXCBNDTAMZ-DGCLKSJQSA-N	0	3	314.426	2.484	10	0		DEAEHN
CC[C@@H]1CCCN(S(=O)(=O)c2ccc(CN)cc2F)CC1	ZINC000092116234	193164318	/nfs/dbraw/zinc/16/43/18/193164318.db2.gz	NXYLWVFALKKOFK-GFCCVEGCSA-N	0	3	314.426	2.485	10	0		DEAEHN
CC(=O)N1CCC(CNCc2ccnn2CC2CCC2)CC1	ZINC000631065082	367998532	/nfs/dbraw/zinc/99/85/32/367998532.db2.gz	IMUOQLNDFCEWEM-UHFFFAOYSA-N	0	3	304.438	2.031	10	0		DEAEHN
c1c(CNC[C@@H]2CCc3ccccc32)nnn1C[C@H]1CCOC1	ZINC000631069105	367999370	/nfs/dbraw/zinc/99/93/70/367999370.db2.gz	MGIWYHWHOPHMJM-ZBFHGGJFSA-N	0	3	312.417	2.134	10	0		DEAEHN
c1c(CNC[C@@H]2CCC[C@H]2C2CC2)nnn1C[C@@H]1CCOC1	ZINC000631162431	368053427	/nfs/dbraw/zinc/05/34/27/368053427.db2.gz	VYOJPBQABWJAKS-QRTARXTBSA-N	0	3	304.438	2.231	10	0		DEAEHN
Brc1cccc(CNC2CN(c3ccncn3)C2)c1	ZINC000631259487	368108614	/nfs/dbraw/zinc/10/86/14/368108614.db2.gz	UFLSFRYMZVANLC-UHFFFAOYSA-N	0	3	319.206	2.218	10	0		DEAEHN
Cc1csc(NC(=O)CN[C@H](C(C)C)[C@H](CO)C(C)C)n1	ZINC000451600541	243183193	/nfs/dbraw/zinc/18/31/93/243183193.db2.gz	SDMUHQRJEZMXLA-TZMCWYRMSA-N	0	3	313.467	2.269	10	0		DEAEHN
Cc1ccc(F)c(S(=O)(=O)[N-]C2(C[NH3+])CCCCC2)c1	ZINC000631980525	368479948	/nfs/dbraw/zinc/47/99/48/368479948.db2.gz	AMGFTJSWZWLSGR-UHFFFAOYSA-N	0	3	300.399	2.074	10	0		DEAEHN
CCCn1cc(S(=O)(=O)N(CC)C[C@@H](C)CC)cc1CN	ZINC000093265942	193223149	/nfs/dbraw/zinc/22/31/49/193223149.db2.gz	XVWDLBNGLJVPNM-ZDUSSCGKSA-N	0	3	315.483	2.414	10	0		DEAEHN
COc1cc(CN2C[C@H]3CCC[C@@H](C2)C3O)cc2c1OCCO2	ZINC000093479713	193257271	/nfs/dbraw/zinc/25/72/71/193257271.db2.gz	HRXNHSIXDUWKKG-VMZNBEPHSA-N	0	3	319.401	2.059	10	0		DEAEHN
Cn1cc(CN2CC[C@@H]3OCCC[C@@H]3C2)c(-c2ccncc2)n1	ZINC000093507137	193261024	/nfs/dbraw/zinc/26/10/24/193261024.db2.gz	KYYAMFKBGXWXDA-WBVHZDCISA-N	0	3	312.417	2.483	10	0		DEAEHN
CS(=O)(=O)N1CCC[C@@H](CNCc2ccccc2Cl)C1	ZINC000093696106	193292256	/nfs/dbraw/zinc/29/22/56/193292256.db2.gz	MZVWKWPCMXIKLW-LBPRGKRZSA-N	0	3	316.854	2.101	10	0		DEAEHN
N[C@H](c1cscc1Br)[C@H]1CN2CCC[C@@H]2CO1	ZINC000093655047	193284652	/nfs/dbraw/zinc/28/46/52/193284652.db2.gz	JXKPGBWDPIMCRU-GGZOMVNGSA-N	0	3	317.252	2.374	10	0		DEAEHN
CCN[C@]1(C(=O)[O-])CC[C@@H]([N@H+](CCOC)C(CC)CC)C1	ZINC000093828206	193312991	/nfs/dbraw/zinc/31/29/91/193312991.db2.gz	WUFMGYKPQQEYHE-GDBMZVCRSA-N	0	3	300.443	2.109	10	0		DEAEHN
CCN[C@]1(C(=O)[O-])CC[C@@H]([N@@H+](CCOC)C(CC)CC)C1	ZINC000093828206	193312992	/nfs/dbraw/zinc/31/29/92/193312992.db2.gz	WUFMGYKPQQEYHE-GDBMZVCRSA-N	0	3	300.443	2.109	10	0		DEAEHN
CCN[C@@]1(C(N)=O)CC[C@H](Sc2nc3ccccc3o2)C1	ZINC000093850870	193318952	/nfs/dbraw/zinc/31/89/52/193318952.db2.gz	ARWSKPXZFKUNCV-BONVTDFDSA-N	0	3	305.403	2.306	10	0		DEAEHN
CCCN[C@@H]1CCCc2sc([C@@H]3CN(C)CCN3C)nc21	ZINC000093896269	193325382	/nfs/dbraw/zinc/32/53/82/193325382.db2.gz	PRMZQGUWIPVGMH-OLZOCXBDSA-N	0	3	308.495	2.438	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@H](C)Oc1c(F)cc(CN)cc1F	ZINC000094346197	193363558	/nfs/dbraw/zinc/36/35/58/193363558.db2.gz	QGSGSOPLEMABND-UWVGGRQHSA-N	0	3	300.349	2.496	10	0		DEAEHN
CCCCNC(=O)COc1c(F)cc(CNCC)cc1F	ZINC000094347041	193363757	/nfs/dbraw/zinc/36/37/57/193363757.db2.gz	RQFYAEMBKYOBGT-UHFFFAOYSA-N	0	3	300.349	2.369	10	0		DEAEHN
CNCc1cc(C)ccc1O[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094634522	193386521	/nfs/dbraw/zinc/38/65/21/193386521.db2.gz	VGEDMOJIUOFAKA-CABCVRRESA-N	0	3	311.447	2.449	10	0		DEAEHN
CC(C)C[C@H]1CN(CCS(C)(=O)=O)c2ccccc2CN1	ZINC000094420879	193368594	/nfs/dbraw/zinc/36/85/94/193368594.db2.gz	UUTOOOVQPDEJKF-HNNXBMFYSA-N	0	3	310.463	2.056	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cccc(C(F)(F)F)c2N)C1	ZINC000094599055	193383402	/nfs/dbraw/zinc/38/34/02/193383402.db2.gz	MUHBIMZTRHNWFU-VIFPVBQESA-N	0	3	301.312	2.064	10	0		DEAEHN
CCN(C)CCNC(=O)c1cccc(C(F)(F)F)c1NC	ZINC000094599009	193383492	/nfs/dbraw/zinc/38/34/92/193383492.db2.gz	YJYLDKFEHXRJMH-UHFFFAOYSA-N	0	3	303.328	2.429	10	0		DEAEHN
CN[C@@H](Cc1ncnn1C)c1cccc(C(F)(F)F)c1F	ZINC000094601262	193383591	/nfs/dbraw/zinc/38/35/91/193383591.db2.gz	QADMYQATSKAMCE-JTQLQIEISA-N	0	3	302.275	2.476	10	0		DEAEHN
CCN[C@@H](C)c1cc(F)c(C)cc1N(C)CCS(C)(=O)=O	ZINC000094767021	193396773	/nfs/dbraw/zinc/39/67/73/193396773.db2.gz	LNXXOLWVYSHWBQ-LBPRGKRZSA-N	0	3	316.442	2.285	10	0		DEAEHN
Cc1ccc2c(c1C)OC[C@H]2NC(=O)NCCN(C)C1CC1	ZINC000264916314	204266528	/nfs/dbraw/zinc/26/65/28/204266528.db2.gz	YCYNAINMXANKPJ-OAHLLOKOSA-N	0	3	303.406	2.130	10	0		DEAEHN
Cc1cc2cn[nH]c2c(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000266078193	205080374	/nfs/dbraw/zinc/08/03/74/205080374.db2.gz	MEGWBOWSHZIKEC-TZMCWYRMSA-N	0	3	300.406	2.426	10	0		DEAEHN
COc1cc([C@@H](C)N[C@@H](C)CN2CCN(C)CC2)ccc1F	ZINC000153675685	291574621	/nfs/dbraw/zinc/57/46/21/291574621.db2.gz	SKVQGRUACBIWCS-UONOGXRCSA-N	0	3	309.429	2.121	10	0		DEAEHN
NCc1cc(S(=O)(=O)Nc2c(F)cccc2F)ccc1F	ZINC000020189337	182195557	/nfs/dbraw/zinc/19/55/57/182195557.db2.gz	UOHZBZQBBDBYSY-UHFFFAOYSA-N	0	3	316.304	2.363	10	0		DEAEHN
CCN1CCN([C@H](CN)c2cc(Br)cs2)CC1	ZINC000020475240	182221440	/nfs/dbraw/zinc/22/14/40/182221440.db2.gz	REUNDJSNOGXMBO-LLVKDONJSA-N	0	3	318.284	2.148	10	0		DEAEHN
CCOC(=O)c1cccc([C@@H](N)CNC(=O)OC(C)(C)C)c1	ZINC000098089619	193784222	/nfs/dbraw/zinc/78/42/22/193784222.db2.gz	HLXXYJZQIKKWQI-ZDUSSCGKSA-N	0	3	308.378	2.388	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2ccccc2SC(F)F)C1	ZINC000040630043	183111015	/nfs/dbraw/zinc/11/10/15/183111015.db2.gz	LJDFRKVEAYARSX-WCBMZHEXSA-N	0	3	302.346	2.317	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2ccc(C)cc2Br)C1	ZINC000040629744	183111042	/nfs/dbraw/zinc/11/10/42/183111042.db2.gz	KLWSIRSZASJVAD-JOYOIKCWSA-N	0	3	313.195	2.073	10	0		DEAEHN
CC[NH+](CC)CCC[C@@H](C)[N-]S(=O)(=O)c1cc(N)cs1	ZINC000041067811	183161766	/nfs/dbraw/zinc/16/17/66/183161766.db2.gz	ALHRGEYJAPXKEP-LLVKDONJSA-N	0	3	319.496	2.119	10	0		DEAEHN
CCOC(=O)COC[C@@H](N)c1ccc(Br)cc1	ZINC000041071957	183163305	/nfs/dbraw/zinc/16/33/05/183163305.db2.gz	KTRRGLCZNCBKFQ-LLVKDONJSA-N	0	3	302.168	2.029	10	0		DEAEHN
CCN(CCOC)[C@H](CN)c1ccc(Br)s1	ZINC000042318063	183253060	/nfs/dbraw/zinc/25/30/60/183253060.db2.gz	PKDMXWZHTOHSIF-SECBINFHSA-N	0	3	307.257	2.479	10	0		DEAEHN
CCNCc1cccc(Br)c1OC[C@@H](C)C(N)=O	ZINC000042411669	183266263	/nfs/dbraw/zinc/26/62/63/183266263.db2.gz	ICTOBJOSMVYOFV-SECBINFHSA-N	0	3	315.211	2.059	10	0		DEAEHN
COC[C@H](C)N(C)[C@@H](CN)c1cc(Br)cs1	ZINC000042517763	183279591	/nfs/dbraw/zinc/27/95/91/183279591.db2.gz	KVZYMVOIIKBHTF-WPRPVWTQSA-N	0	3	307.257	2.477	10	0		DEAEHN
COCCN([C@@H](CN)c1cc(C)sc1C)[C@@H](C)COC	ZINC000042603122	183290641	/nfs/dbraw/zinc/29/06/41/183290641.db2.gz	MBGVWNQHAGTYBN-NHYWBVRUSA-N	0	3	300.468	2.348	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccc(Cl)cc1)N(CC(N)=O)C1CCCC1	ZINC000042946601	183320998	/nfs/dbraw/zinc/32/09/98/183320998.db2.gz	WRUJCHVBHJWURL-ZBEGNZNMSA-N	0	3	309.841	2.458	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(C)s1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043240625	183345967	/nfs/dbraw/zinc/34/59/67/183345967.db2.gz	NTLGGNCZQGRULR-NFAWXSAZSA-N	0	3	309.479	2.388	10	0		DEAEHN
COc1ccc2ccccc2c1[C@@H](N)[C@H]1CCS(=O)(=O)C1	ZINC000043300092	183352794	/nfs/dbraw/zinc/35/27/94/183352794.db2.gz	KBYFAIVAUSEYKZ-LRDDRELGSA-N	0	3	305.399	2.283	10	0		DEAEHN
C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000175852802	296280690	/nfs/dbraw/zinc/28/06/90/296280690.db2.gz	QWJSAEXKLRAQSH-RBSFLKMASA-N	0	3	311.470	2.173	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)Nc2cccc(Cl)c2)c1	ZINC000105881294	194155604	/nfs/dbraw/zinc/15/56/04/194155604.db2.gz	FNELSQIMUOCXKU-GFCCVEGCSA-N	0	3	306.797	2.462	10	0		DEAEHN
O[C@@H](COc1ccccc1)CN1CCC(Cn2cccn2)CC1	ZINC000105886737	194158186	/nfs/dbraw/zinc/15/81/86/194158186.db2.gz	UZHFVTYNUIWKKV-QGZVFWFLSA-N	0	3	315.417	2.035	10	0		DEAEHN
C[C@H](NS(=O)(=O)C[C@@H]1CCCCN1)c1ccccc1Cl	ZINC000049631478	183749064	/nfs/dbraw/zinc/74/90/64/183749064.db2.gz	MNAGPBWVIFIFJY-RYUDHWBXSA-N	0	3	316.854	2.463	10	0		DEAEHN
CN(C)[C@H]1CCN(c2nc(-c3ccccc3)c(CO)s2)C1	ZINC000110276168	194319280	/nfs/dbraw/zinc/31/92/80/194319280.db2.gz	PUIOXMIZQVVDSC-ZDUSSCGKSA-N	0	3	303.431	2.443	10	0		DEAEHN
CN1CCN([C@@H](CN)c2ccc(Br)o2)CC1(C)C	ZINC000110712193	194353470	/nfs/dbraw/zinc/35/34/70/194353470.db2.gz	YFYWVYFCOAWHGU-JTQLQIEISA-N	0	3	316.243	2.068	10	0		DEAEHN
CC[NH2+]Cc1ccc(S(=O)(=O)[N-]c2ccncc2C)cc1	ZINC000111043973	194386587	/nfs/dbraw/zinc/38/65/87/194386587.db2.gz	AIQFOMAISURSPV-UHFFFAOYSA-N	0	3	305.403	2.300	10	0		DEAEHN
CCOCCN(CC)S(=O)(=O)c1cccc([C@H](N)CC)c1	ZINC000111125605	194392757	/nfs/dbraw/zinc/39/27/57/194392757.db2.gz	RSSVSKOYWSFHCN-OAHLLOKOSA-N	0	3	314.451	2.144	10	0		DEAEHN
CN(CC(=O)Nc1cc(Cl)ccc1N)CC1CCOCC1	ZINC000111155645	194396199	/nfs/dbraw/zinc/39/61/99/194396199.db2.gz	KCCSAOAXFJZSGL-UHFFFAOYSA-N	0	3	311.813	2.219	10	0		DEAEHN
C[C@@H](NC(=O)CN1CCCN(C2CC2)CC1)c1ccccc1	ZINC000061040967	184160566	/nfs/dbraw/zinc/16/05/66/184160566.db2.gz	BLYBBDLDMQPFHO-OAHLLOKOSA-N	0	3	301.434	2.034	10	0		DEAEHN
CCN1CCC(N(C)c2nc(Cl)nc(OC(C)C)n2)CC1	ZINC000061540294	184173387	/nfs/dbraw/zinc/17/33/87/184173387.db2.gz	SJBRQEUUHFZOCD-UHFFFAOYSA-N	0	3	313.833	2.233	10	0		DEAEHN
COCCN[C@](C)(CO)c1ccc(F)c(Br)c1	ZINC000061689784	184182707	/nfs/dbraw/zinc/18/27/07/184182707.db2.gz	NJVBCTOGEINURT-GFCCVEGCSA-N	0	3	306.175	2.032	10	0		DEAEHN
Cc1ccc(S(=O)(=O)NCc2ccccc2CN)c(C)c1	ZINC000061841258	184189159	/nfs/dbraw/zinc/18/91/59/184189159.db2.gz	PVKSYDCRPBJPQL-UHFFFAOYSA-N	0	3	304.415	2.241	10	0		DEAEHN
NC[C@H](c1ccc(Br)s1)N1CCCOCC1	ZINC000061914233	184195317	/nfs/dbraw/zinc/19/53/17/184195317.db2.gz	PJJNYEMBUFONCC-SECBINFHSA-N	0	3	305.241	2.233	10	0		DEAEHN
Cc1cc(F)ccc1S(=O)(=O)N(C)c1cccc(CN)c1	ZINC000061950492	184198435	/nfs/dbraw/zinc/19/84/35/184198435.db2.gz	QXIDMUNHMIROPR-UHFFFAOYSA-N	0	3	308.378	2.418	10	0		DEAEHN
CC(C)CN1C(=O)C[C@@H](N)[C@@H]1c1ccc(Br)o1	ZINC000062209882	184220314	/nfs/dbraw/zinc/22/03/14/184220314.db2.gz	RAHUNXUMXRYVGE-PRHODGIISA-N	0	3	301.184	2.299	10	0		DEAEHN
COCCN1C(=O)C[C@@H](N)[C@@H]1c1ccc(Cl)cc1Cl	ZINC000062210254	184221031	/nfs/dbraw/zinc/22/10/31/184221031.db2.gz	SYVQMSYSVBMYKP-YPMHNXCESA-N	0	3	303.189	2.241	10	0		DEAEHN
CN[C@@H](CCSc1cccc(Br)c1)C(N)=O	ZINC000062604243	184244899	/nfs/dbraw/zinc/24/48/99/184244899.db2.gz	IXOXQBJTYOUDSJ-JTQLQIEISA-N	0	3	303.225	2.005	10	0		DEAEHN
CCOc1ccccc1CNC(=O)N1CCCN(C2CC2)CC1	ZINC000064226583	184293401	/nfs/dbraw/zinc/29/34/01/184293401.db2.gz	PFWVOFQMIGYOKD-UHFFFAOYSA-N	0	3	317.433	2.465	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1ccc(SC)cc1	ZINC000064595859	184301205	/nfs/dbraw/zinc/30/12/05/184301205.db2.gz	KXMUHTQYUDGMDQ-GFCCVEGCSA-N	0	3	316.492	2.417	10	0		DEAEHN
COCCCNCC(=O)Nc1cccc(NC(=O)C(C)(C)C)c1	ZINC000066068363	184386610	/nfs/dbraw/zinc/38/66/10/184386610.db2.gz	LHRUBHLLZHPDBH-UHFFFAOYSA-N	0	3	321.421	2.236	10	0		DEAEHN
COc1cc(CNCc2cccnc2-n2ccnc2)ccc1O	ZINC000192945886	207370658	/nfs/dbraw/zinc/37/06/58/207370658.db2.gz	RCHRGGLEJUQYHN-UHFFFAOYSA-N	0	3	310.357	2.271	10	0		DEAEHN
COc1ccc(C(=O)CCC(=O)N(C)CCCN(C)C)cc1	ZINC000539415659	285075975	/nfs/dbraw/zinc/07/59/75/285075975.db2.gz	GFTAZTYCFDLZKD-UHFFFAOYSA-N	0	3	306.406	2.068	10	0		DEAEHN
COC[C@@H](O)CN[C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000539726597	285085468	/nfs/dbraw/zinc/08/54/68/285085468.db2.gz	DRZDMIOLTGQWSR-PBHICJAKSA-N	0	3	316.401	2.319	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(CCN(C)C)C(C)C)s1	ZINC000159274982	197341104	/nfs/dbraw/zinc/34/11/04/197341104.db2.gz	FJOHQBYRZVRSAE-UHFFFAOYSA-N	0	3	312.483	2.230	10	0		DEAEHN
CCNCc1cccc(Cl)c1O[C@@H]1CCS(=O)(=O)C1	ZINC000159152667	197331550	/nfs/dbraw/zinc/33/15/50/197331550.db2.gz	YUIDJYQHFSGOBO-LLVKDONJSA-N	0	3	303.811	2.015	10	0		DEAEHN
CCN[C@H](Cc1cccnc1)c1c(Br)cnn1C	ZINC000159208274	197335971	/nfs/dbraw/zinc/33/59/71/197335971.db2.gz	RGKJNPLOKBVLKR-GFCCVEGCSA-N	0	3	309.211	2.471	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)CC(C)(C)C)cc(CN)c1F	ZINC000159102939	197327336	/nfs/dbraw/zinc/32/73/36/197327336.db2.gz	VPOBCHVTUXYZRC-UHFFFAOYSA-N	0	3	302.415	2.259	10	0		DEAEHN
CCCNCc1cc(S(=O)(=O)NC(C)C)cc(C)c1F	ZINC000159080311	197325935	/nfs/dbraw/zinc/32/59/35/197325935.db2.gz	XKKQANOQFOSRDN-UHFFFAOYSA-N	0	3	302.415	2.320	10	0		DEAEHN
CCN(CC)CCSc1nc(NC)nc(N(CC)CC)n1	ZINC000159026702	197320194	/nfs/dbraw/zinc/32/01/94/197320194.db2.gz	FBYTUEYEPKKYBH-UHFFFAOYSA-N	0	3	312.487	2.193	10	0		DEAEHN
N[C@H](c1ccc2c3c(cccc31)CC2)[C@@H]1CCS(=O)(=O)C1	ZINC000158780258	197301371	/nfs/dbraw/zinc/30/13/71/197301371.db2.gz	BJABGPNOWXBLKX-DYVFJYSZSA-N	0	3	301.411	2.373	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)c(C)s1	ZINC000158775546	197300190	/nfs/dbraw/zinc/30/01/90/197300190.db2.gz	XKGXRZHMQMPTDT-VXGBXAGGSA-N	0	3	314.476	2.197	10	0		DEAEHN
CCNCc1cccc(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)c1	ZINC000158762267	197299141	/nfs/dbraw/zinc/29/91/41/197299141.db2.gz	DZYUBMSJYLAWGI-GASCZTMLSA-N	0	3	308.447	2.217	10	0		DEAEHN
CCNCc1cccc(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)c1	ZINC000158762571	197298912	/nfs/dbraw/zinc/29/89/12/197298912.db2.gz	DZYUBMSJYLAWGI-GJZGRUSLSA-N	0	3	308.447	2.217	10	0		DEAEHN
CNCc1cccc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)c1C	ZINC000158743822	197298111	/nfs/dbraw/zinc/29/81/11/197298111.db2.gz	AZYJKDAFEGGGAN-HUUCEWRRSA-N	0	3	308.447	2.135	10	0		DEAEHN
COc1ccc(CNC2CCS(=O)CC2)c(Cl)c1OC	ZINC000157958751	197229994	/nfs/dbraw/zinc/22/99/94/197229994.db2.gz	ZNUDXRSYDBYDEN-UHFFFAOYSA-N	0	3	317.838	2.358	10	0		DEAEHN
CC(C)(C)[C@H](NC[C@@H](O)CN1CCOCC1)c1ccc(F)cc1	ZINC000157829497	197218744	/nfs/dbraw/zinc/21/87/44/197218744.db2.gz	PFEQOABGKSXIAS-IAGOWNOFSA-N	0	3	324.440	2.196	10	0		DEAEHN
CNc1nc(NC[C@]2(C)CCCS2)nc(N2CCCC2)n1	ZINC000157715552	197210038	/nfs/dbraw/zinc/21/00/38/197210038.db2.gz	DVJTXDSXQQCMMR-AWEZNQCLSA-N	0	3	308.455	2.211	10	0		DEAEHN
Cc1cnc(CCN(C)C[C@H](O)COc2ccccc2)s1	ZINC000157495204	197192337	/nfs/dbraw/zinc/19/23/37/197192337.db2.gz	IMVQZVJPEMRXFF-AWEZNQCLSA-N	0	3	306.431	2.366	10	0		DEAEHN
Cc1cccc(F)c1NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000157252643	197173128	/nfs/dbraw/zinc/17/31/28/197173128.db2.gz	ODWCFFSFHSKSIW-CYBMUJFWSA-N	0	3	323.412	2.165	10	0		DEAEHN
CCO[C@H]1C[C@](N)(C(=O)N(CC(F)(F)F)C2CC2)C1(C)C	ZINC000157137603	197165015	/nfs/dbraw/zinc/16/50/15/197165015.db2.gz	KWEXSKVLRJAIFF-GWCFXTLKSA-N	0	3	308.344	2.072	10	0		DEAEHN
COc1ccc2[nH]c(=S)n(C[C@@H](C)CN3CCCC3)c2n1	ZINC000157050566	197158002	/nfs/dbraw/zinc/15/80/02/197158002.db2.gz	ASBGSEPIGOOGSA-NSHDSACASA-N	0	3	306.435	2.461	10	0		DEAEHN
COc1cccc2sc(C(=O)N(C)CCN(C)C)c(N)c21	ZINC000156182867	197093052	/nfs/dbraw/zinc/09/30/52/197093052.db2.gz	FXSSLHYWBXYAOZ-UHFFFAOYSA-N	0	3	307.419	2.126	10	0		DEAEHN
CN(CC(=O)NC(=O)NCc1cccs1)C[C@@H]1CC=CCC1	ZINC000542247139	285214972	/nfs/dbraw/zinc/21/49/72/285214972.db2.gz	HHZZXVLJVWPXOT-CYBMUJFWSA-N	0	3	321.446	2.362	10	0		DEAEHN
CC1CCC(CN2CCN(c3ccc4nncn4n3)CC2)CC1	ZINC000120512193	195180951	/nfs/dbraw/zinc/18/09/51/195180951.db2.gz	KMPGROWKLOHVAK-UHFFFAOYSA-N	0	3	314.437	2.073	10	0		DEAEHN
CC[C@H]1CN(Cc2cc(F)c(F)c(F)c2)CCN1C[C@@H](C)O	ZINC000120728916	195225680	/nfs/dbraw/zinc/22/56/80/195225680.db2.gz	ONNXXNRQRCLLIG-YPMHNXCESA-N	0	3	316.367	2.381	10	0		DEAEHN
CC[C@H]1CN(Cc2ccccc2C(=O)OC)CCN1CCOC	ZINC000120907682	195261688	/nfs/dbraw/zinc/26/16/88/195261688.db2.gz	GGKVQUROYDUEQZ-INIZCTEOSA-N	0	3	320.433	2.016	10	0		DEAEHN
CC(C)NC(=O)[C@@H]1C[C@H]2CCN(CCc3ccccc3)C[C@@H]2O1	ZINC000253374893	257105546	/nfs/dbraw/zinc/10/55/46/257105546.db2.gz	NWEYDZJOTSJOBT-SQNIBIBYSA-N	0	3	316.445	2.233	10	0		DEAEHN
CC(C)N1CCO[C@H](CN2CCN(C[C@H]3CC=CCC3)CC2)C1	ZINC000121030172	195282850	/nfs/dbraw/zinc/28/28/50/195282850.db2.gz	QLUXXUBMRHXYLX-RBUKOAKNSA-N	0	3	321.509	2.070	10	0		DEAEHN
CC(C)N(C)CC(=O)N[C@@H](C)c1ccccc1-n1cccn1	ZINC000121657363	195325471	/nfs/dbraw/zinc/32/54/71/195325471.db2.gz	LXVVSZSZPMVTEA-AWEZNQCLSA-N	0	3	300.406	2.390	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C)cc1C	ZINC000121814463	195352518	/nfs/dbraw/zinc/35/25/18/195352518.db2.gz	RNOFRFBDCJGBQV-MRXNPFEDSA-N	0	3	319.449	2.334	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C)cc1C	ZINC000121814344	195352730	/nfs/dbraw/zinc/35/27/30/195352730.db2.gz	RNOFRFBDCJGBQV-INIZCTEOSA-N	0	3	319.449	2.334	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@@H](C)C(=O)N2CC2CCN(C)CC2)s1	ZINC000121981017	195385407	/nfs/dbraw/zinc/38/54/07/195385407.db2.gz	RCBGJNIICKPJJM-SWLSCSKDSA-N	0	3	307.463	2.217	10	0		DEAEHN
Cc1ccc([C@H]2N[C@H](C)C(=O)N2CC2CCN(C)CC2)s1	ZINC000121980757	195385437	/nfs/dbraw/zinc/38/54/37/195385437.db2.gz	RCBGJNIICKPJJM-DOMZBBRYSA-N	0	3	307.463	2.217	10	0		DEAEHN
CC1CCN(S(=O)(=O)c2cc(F)c(Cl)c(CN)c2)CC1	ZINC000122088780	195399397	/nfs/dbraw/zinc/39/93/97/195399397.db2.gz	CMFULXWZALTTEZ-UHFFFAOYSA-N	0	3	320.817	2.358	10	0		DEAEHN
CNCc1cc(Br)cnc1N(CCOC)C(C)C	ZINC000124298246	195625423	/nfs/dbraw/zinc/62/54/23/195625423.db2.gz	IYPLKPALTTZCKX-UHFFFAOYSA-N	0	3	316.243	2.425	10	0		DEAEHN
NCc1cc(F)ccc1NS(=O)(=O)CCc1ccccc1	ZINC000126135171	195812176	/nfs/dbraw/zinc/81/21/76/195812176.db2.gz	IQZLPULQRXRXPR-UHFFFAOYSA-N	0	3	308.378	2.269	10	0		DEAEHN
CC(C)OC[C@@H](O)COc1ccc(Br)c(CN)c1	ZINC000128032268	195931024	/nfs/dbraw/zinc/93/10/24/195931024.db2.gz	XEXGPCIGVKVBJR-LLVKDONJSA-N	0	3	318.211	2.073	10	0		DEAEHN
C[C@@H](CC(=O)N1CCN(C2CCCC2)CC1)c1cnn(C)c1	ZINC000411330813	533417285	/nfs/dbraw/zinc/41/72/85/533417285.db2.gz	XQZOUGRDHCSOPE-AWEZNQCLSA-N	0	3	304.438	2.001	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCO[C@@H](c3cccs3)C2)C1	ZINC000245974987	132574704	/nfs/dbraw/zinc/57/47/04/132574704.db2.gz	BMPNIOUUHAHZMO-ZIAGYGMSSA-N	0	3	323.462	2.315	10	0		DEAEHN
CCn1cc(CCN2CCC(C(=O)N3CCCCC3)CC2)cn1	ZINC000368465704	133274661	/nfs/dbraw/zinc/27/46/61/133274661.db2.gz	MNJCVIYZCLKPNO-UHFFFAOYSA-N	0	3	318.465	2.170	10	0		DEAEHN
c1c(CNCC2(N3CCOCC3)CC2)[nH]nc1-c1ccccc1	ZINC000564032638	292083501	/nfs/dbraw/zinc/08/35/01/292083501.db2.gz	PTRDDOWLOLSHAA-UHFFFAOYSA-N	0	3	312.417	2.031	10	0		DEAEHN
C[C@@H](NC(=O)c1cn2cccnc2n1)[C@@H](c1ccccc1)N(C)C	ZINC000548432755	285738043	/nfs/dbraw/zinc/73/80/43/285738043.db2.gz	XMOUUJGKVLTFOT-CJNGLKHVSA-N	0	3	323.400	2.151	10	0		DEAEHN
Cc1cc2cc(NC(=O)N3CCO[C@H](CN(C)C)C3)ccc2[nH]1	ZINC000181203810	144901339	/nfs/dbraw/zinc/90/13/39/144901339.db2.gz	VXMZHLRKDWTVFW-OAHLLOKOSA-N	0	3	316.405	2.271	10	0		DEAEHN
O=C([C@H]1C[C@H]1c1cc(F)ccc1F)N1CCN2CCC1CC2	ZINC000188617767	145014247	/nfs/dbraw/zinc/01/42/47/145014247.db2.gz	JIDIWHDOFOXGRI-ZFWWWQNUSA-N	0	3	306.356	2.375	10	0		DEAEHN
O=C(Nc1ccc2nc(-c3ccco3)[nH]c2c1)[C@H]1C[C@H](F)CN1	ZINC000188711098	145016186	/nfs/dbraw/zinc/01/61/86/145016186.db2.gz	LODRDLCPSFQPFP-TVQRCGJNSA-N	0	3	314.320	2.461	10	0		DEAEHN
CCc1nn(C)c(CC)c1CC(=O)NCCN1CCCC[C@@H]1C	ZINC000188730697	145016941	/nfs/dbraw/zinc/01/69/41/145016941.db2.gz	MRNJQRWAAGTVKX-AWEZNQCLSA-N	0	3	320.481	2.078	10	0		DEAEHN
CCc1nc(C2CCN([C@H](C)C(=O)NC(C)(C)CC)CC2)n[nH]1	ZINC000190683950	145046700	/nfs/dbraw/zinc/04/67/00/145046700.db2.gz	IGFZIHCJUKDVKN-GFCCVEGCSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCc1n[nH]c(C2CCN([C@H](C)C(=O)NC(C)(C)CC)CC2)n1	ZINC000190683950	145046702	/nfs/dbraw/zinc/04/67/02/145046702.db2.gz	IGFZIHCJUKDVKN-GFCCVEGCSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCc1nnc(C2CCN([C@H](C)C(=O)NC(C)(C)CC)CC2)[nH]1	ZINC000190683950	145046705	/nfs/dbraw/zinc/04/67/05/145046705.db2.gz	IGFZIHCJUKDVKN-GFCCVEGCSA-N	0	3	321.469	2.240	10	0		DEAEHN
Cn1ccnc1[C@@H](O)C1CCN(C[C@@H](O)CC2CCCC2)CC1	ZINC000190915173	145050069	/nfs/dbraw/zinc/05/00/69/145050069.db2.gz	KVUKAYONXNAZGV-IRXDYDNUSA-N	0	3	321.465	2.107	10	0		DEAEHN
Oc1ccc(N2CCN(C[C@H](O)C3CCCCC3)CC2)cc1	ZINC000191221648	145054689	/nfs/dbraw/zinc/05/46/89/145054689.db2.gz	ZHOKDNXCBJZNQB-SFHVURJKSA-N	0	3	304.434	2.455	10	0		DEAEHN
O[C@H](CN1CCC[C@H](c2nnc3n2CCC3)C1)C1CCCCC1	ZINC000191343555	145056902	/nfs/dbraw/zinc/05/69/02/145056902.db2.gz	DQVCGFQDYRNHIP-JKSUJKDBSA-N	0	3	318.465	2.345	10	0		DEAEHN
Cc1cc(-n2ccnc2)ccc1CN1CCC[C@@H]1C(=O)N(C)C	ZINC000191918222	145067248	/nfs/dbraw/zinc/06/72/48/145067248.db2.gz	IFKREVKQMZQDSD-QGZVFWFLSA-N	0	3	312.417	2.233	10	0		DEAEHN
Cc1csc([C@H]2CCCN(CCN3CCO[C@H](C)C3)C2)n1	ZINC000192728955	145077896	/nfs/dbraw/zinc/07/78/96/145077896.db2.gz	IQZDQZVADNONPR-CABCVRRESA-N	0	3	309.479	2.352	10	0		DEAEHN
COc1cccc(OCCN2CCS[C@@H]3COCC[C@H]32)c1	ZINC000246502196	145104854	/nfs/dbraw/zinc/10/48/54/145104854.db2.gz	BEOQLKLNOQRKDQ-HZPDHXFCSA-N	0	3	309.431	2.280	10	0		DEAEHN
CC[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1cccc(OC)c1[O-]	ZINC000246596740	145107962	/nfs/dbraw/zinc/10/79/62/145107962.db2.gz	PZFHDFORRJFSSI-STQMWFEESA-N	0	3	304.390	2.100	10	0		DEAEHN
CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cccc(OC)c1[O-]	ZINC000246596740	145107964	/nfs/dbraw/zinc/10/79/64/145107964.db2.gz	PZFHDFORRJFSSI-STQMWFEESA-N	0	3	304.390	2.100	10	0		DEAEHN
CCOc1ncccc1C(=O)N1C[C@@H]2CCCN2C[C@@H]1CC	ZINC000246668166	145110055	/nfs/dbraw/zinc/11/00/55/145110055.db2.gz	YENMVDIZYWOTIC-KBPBESRZSA-N	0	3	303.406	2.179	10	0		DEAEHN
Cn1cc([C@@H]2CCN([C@@H](C(=O)NC3CC3)c3ccccc3)C2)cn1	ZINC000246822370	145115847	/nfs/dbraw/zinc/11/58/47/145115847.db2.gz	CAJKHLSXGNXGPO-CRAIPNDOSA-N	0	3	324.428	2.229	10	0		DEAEHN
CC[C@@H]1CN(CCOc2cc(C)ccc2C)CCN1C[C@H](C)O	ZINC000246991605	145122614	/nfs/dbraw/zinc/12/26/14/145122614.db2.gz	BANJITCMRSCZSM-ZWKOTPCHSA-N	0	3	320.477	2.459	10	0		DEAEHN
Cc1c(Cl)cccc1NC(=O)CN1CCN2CCC[C@H]2C1	ZINC000247154191	145127710	/nfs/dbraw/zinc/12/77/10/145127710.db2.gz	LTZLXDFFERSUJE-ZDUSSCGKSA-N	0	3	307.825	2.367	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(-n2ccnc2)cc1	ZINC000247174218	145128371	/nfs/dbraw/zinc/12/83/71/145128371.db2.gz	KVBYBKMAWIVXNS-PBHICJAKSA-N	0	3	310.401	2.181	10	0		DEAEHN
Cc1ccc(NC(=O)[C@H](C)N2CCN3CCC[C@H]3C2)c(C)c1	ZINC000247392089	145136093	/nfs/dbraw/zinc/13/60/93/145136093.db2.gz	XEMWYTRKEYBVTM-HOTGVXAUSA-N	0	3	301.434	2.410	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN(C[C@@H](O)COC(C)(C)C)C2)n1	ZINC000247440099	145137033	/nfs/dbraw/zinc/13/70/33/145137033.db2.gz	XQUQOJNQFWHDFW-HZPDHXFCSA-N	0	3	321.465	2.300	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)CN1CC[C@]2(O)CCCC[C@H]2C1	ZINC000248039265	145147712	/nfs/dbraw/zinc/14/77/12/145147712.db2.gz	SLDXRWFXEAFVDS-LZLYRXPVSA-N	0	3	308.466	2.405	10	0		DEAEHN
C[C@H](N[C@@H]1CCN(Cc2ccccn2)C[C@H]1C)c1cnccn1	ZINC000248201105	145150384	/nfs/dbraw/zinc/15/03/84/145150384.db2.gz	YSNRKOGUUCXRPV-HLLBOEOZSA-N	0	3	311.433	2.433	10	0		DEAEHN
CCN(CCO)CCNC(=O)[C@@H]1C[C@H]1c1ccc(C(C)C)cc1	ZINC000248645333	145162709	/nfs/dbraw/zinc/16/27/09/145162709.db2.gz	QZFBBDPSFCLRLT-ZWKOTPCHSA-N	0	3	318.461	2.344	10	0		DEAEHN
Cc1cccnc1C(F)(F)C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000248738754	145165482	/nfs/dbraw/zinc/16/54/82/145165482.db2.gz	PIXJLJGPJXVFCF-CHWSQXEVSA-N	0	3	309.360	2.177	10	0		DEAEHN
Cc1cc(=O)[n-]c([C@@H](C)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C(C)C)n1	ZINC000248774911	145167538	/nfs/dbraw/zinc/16/75/38/145167538.db2.gz	UDUYOSRBZHTIEB-KFWWJZLASA-N	0	3	304.438	2.499	10	0		DEAEHN
Cc1cc(=O)[n-]c([C@@H](C)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)n1	ZINC000248774911	145167539	/nfs/dbraw/zinc/16/75/39/145167539.db2.gz	UDUYOSRBZHTIEB-KFWWJZLASA-N	0	3	304.438	2.499	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CCOC[C@@H]1C	ZINC000248881441	145171627	/nfs/dbraw/zinc/17/16/27/145171627.db2.gz	SKNYXJURVQGUAV-UXLLHSPISA-N	0	3	304.434	2.296	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CCCO[C@@H]1C	ZINC000249432347	145184532	/nfs/dbraw/zinc/18/45/32/145184532.db2.gz	IUWWAFIGIPZNKV-LMSBXDPUSA-N	0	3	316.445	2.438	10	0		DEAEHN
CC(C)C[C@H](CO)N(C)C(=O)N[C@@H](C)CN1CCC[C@@H](C)C1	ZINC000249486009	145185366	/nfs/dbraw/zinc/18/53/66/145185366.db2.gz	YGFIMBLTGUALJV-OWCLPIDISA-N	0	3	313.486	2.155	10	0		DEAEHN
O=C(Nc1ccccc1C(=O)NC1CC1)c1ccc2c(c1)CNC2	ZINC000261652155	145213450	/nfs/dbraw/zinc/21/34/50/145213450.db2.gz	JQKUMTVGJRQFLS-UHFFFAOYSA-N	0	3	321.380	2.434	10	0		DEAEHN
Cc1cccc2ncc(CN3CCNC[C@H]3c3cccnc3)n21	ZINC000261671324	145215667	/nfs/dbraw/zinc/21/56/67/145215667.db2.gz	GYAMGVUXZOKEMB-KRWDZBQOSA-N	0	3	307.401	2.184	10	0		DEAEHN
COC(=O)c1ccc(CN2CCNC[C@H]2c2cccnc2)cc1	ZINC000261781602	145226024	/nfs/dbraw/zinc/22/60/24/145226024.db2.gz	TZLCFSAPNQRXGD-KRWDZBQOSA-N	0	3	311.385	2.015	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)CN2CCNC[C@@H]2c2cccnc2)c1	ZINC000261874645	145236433	/nfs/dbraw/zinc/23/64/33/145236433.db2.gz	XUDQRNVUYFXHIX-GOSISDBHSA-N	0	3	324.428	2.283	10	0		DEAEHN
c1cc(N2CCCC2)ncc1N[C@@H]1CCC[C@@H]1[C@@H]1COCCN1	ZINC000261887945	145238091	/nfs/dbraw/zinc/23/80/91/145238091.db2.gz	GAZIXYUDMGELFW-BBWFWOEESA-N	0	3	316.449	2.251	10	0		DEAEHN
C[C@H]1CN(C(=O)C2(N)CCOCC2)CC[C@@H]1c1ccccc1	ZINC000261900764	145239276	/nfs/dbraw/zinc/23/92/76/145239276.db2.gz	RQWRESKDXQFPOG-HOCLYGCPSA-N	0	3	302.418	2.147	10	0		DEAEHN
NC1(C(=O)Nc2ccc3oc(C4CC4)nc3c2)CCOCC1	ZINC000262042996	145255805	/nfs/dbraw/zinc/25/58/05/145255805.db2.gz	CCCPOGRJQHEIBQ-UHFFFAOYSA-N	0	3	301.346	2.152	10	0		DEAEHN
C[C@H](NC(=O)C1(N)CCOCC1)c1ccc2c(c1)CCCC2	ZINC000262139086	145265593	/nfs/dbraw/zinc/26/55/93/145265593.db2.gz	MESQNVDGQAHBPE-ZDUSSCGKSA-N	0	3	302.418	2.251	10	0		DEAEHN
CC(C)C(=O)Nc1ccc(N[C@@H](C)C[C@@H]2COCCN2)cc1	ZINC000262298435	145274347	/nfs/dbraw/zinc/27/43/47/145274347.db2.gz	OFGKJVBPSJSZJU-XJKSGUPXSA-N	0	3	305.422	2.460	10	0		DEAEHN
C[C@@H]1CCC[C@H](CNC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)C1	ZINC000262506831	145288987	/nfs/dbraw/zinc/28/89/87/145288987.db2.gz	MMTTVHVUSDMAKQ-ZFHCCXERSA-N	0	3	308.466	2.461	10	0		DEAEHN
C[C@H](NC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C)c1ccccc1	ZINC000262587101	145295715	/nfs/dbraw/zinc/29/57/15/145295715.db2.gz	ZWJPMQRMFMRBNS-WLLUSJSYSA-N	0	3	302.418	2.396	10	0		DEAEHN
CSc1ccc(C)c(NC(=O)c2n[nH]c3c2CNCC3)c1	ZINC000262750470	145303415	/nfs/dbraw/zinc/30/34/15/145303415.db2.gz	BQDRTERKMHRZKY-UHFFFAOYSA-N	0	3	302.403	2.338	10	0		DEAEHN
C[C@@H]1C[NH2+]CC[C@H]1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000262769043	145304495	/nfs/dbraw/zinc/30/44/95/145304495.db2.gz	LREHCYXYCPHDIK-PSASIEDQSA-N	0	3	323.245	2.270	10	0		DEAEHN
CC(C)Cc1ccc(Cc2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263203183	145335959	/nfs/dbraw/zinc/33/59/59/145335959.db2.gz	JIUDNHSOWMYSQB-MRXNPFEDSA-N	0	3	314.433	2.435	10	0		DEAEHN
Cc1noc(C)c1[C@H](C)CNC(=O)N1CC[C@H]2CCN(C)C[C@H]21	ZINC000332829783	145389005	/nfs/dbraw/zinc/38/90/05/145389005.db2.gz	CSFYWXAFCONIEZ-KCPJHIHWSA-N	0	3	320.437	2.131	10	0		DEAEHN
CC(C)(C)c1cnc(NC(=O)NCCNc2ccncc2)s1	ZINC000551935944	285922259	/nfs/dbraw/zinc/92/22/59/285922259.db2.gz	BOGFZJSZTDDGJV-UHFFFAOYSA-N	0	3	319.434	2.491	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)N1CC(C)(CCOC)C1	ZINC000358758662	147197956	/nfs/dbraw/zinc/19/79/56/147197956.db2.gz	ADLWKBQIFVEVTP-OAHLLOKOSA-N	0	3	311.470	2.319	10	0		DEAEHN
CC[C@H](C(=O)N1CCN(CCN(C)C)CC1)c1ccc(F)cc1	ZINC000359293951	147301283	/nfs/dbraw/zinc/30/12/83/147301283.db2.gz	PHCLHYFKYBTQSV-KRWDZBQOSA-N	0	3	321.440	2.025	10	0		DEAEHN
c1[nH]nc2cc(CN3CCC(c4nnc5n4CCC5)CC3)ccc12	ZINC000371366050	148093647	/nfs/dbraw/zinc/09/36/47/148093647.db2.gz	IXEKYPUQXHRDJT-UHFFFAOYSA-N	0	3	322.416	2.480	10	0		DEAEHN
O=C(CN1CCCC12CCC2)NCCOc1cccc(F)c1	ZINC000373105258	148211158	/nfs/dbraw/zinc/21/11/58/148211158.db2.gz	WGJKHTUWGSDCFX-UHFFFAOYSA-N	0	3	306.381	2.339	10	0		DEAEHN
CCOC(=O)CCCCN1CC[C@@H](c2nc(C3CC3)no2)C1	ZINC000375446559	148373378	/nfs/dbraw/zinc/37/33/78/148373378.db2.gz	XNJLUUIXPHQGQP-CYBMUJFWSA-N	0	3	307.394	2.470	10	0		DEAEHN
Cc1nccn1CCCN1CC[C@H](c2nc(C3CC3)no2)C1	ZINC000375463572	148376305	/nfs/dbraw/zinc/37/63/05/148376305.db2.gz	CSASPTLROYXLDU-AWEZNQCLSA-N	0	3	301.394	2.332	10	0		DEAEHN
CCC1CCC(NC(=O)NC[C@@H](C)CN2CCN(C)CC2)CC1	ZINC000073782003	401721900	/nfs/dbraw/zinc/72/19/00/401721900.db2.gz	LPTNZAPDMZODBE-KLAILNCOSA-N	0	3	324.513	2.138	10	0		DEAEHN
C[C@@H](CNC(=O)N(C)C[C@H]1CCCO1)N(C)Cc1ccccc1	ZINC000111875824	401727240	/nfs/dbraw/zinc/72/72/40/401727240.db2.gz	DYWWVGHMCMHJDF-DOTOQJQBSA-N	0	3	319.449	2.327	10	0		DEAEHN
CC(C)COC1CCN(C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)CC1	ZINC000127323338	401729048	/nfs/dbraw/zinc/72/90/48/401729048.db2.gz	PCZLBUMIWYBKBY-LSDHHAIUSA-N	0	3	323.481	2.458	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CC[C@@H](CC(C)C)C1	ZINC000074167514	401731869	/nfs/dbraw/zinc/73/18/69/401731869.db2.gz	FCJFADNQCOKPOX-JKSUJKDBSA-N	0	3	311.470	2.175	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)C(=O)Nc2ccc(Cl)cc2)CCN1C	ZINC000127586446	401741150	/nfs/dbraw/zinc/74/11/50/401741150.db2.gz	WJMOLTKHDLYCAV-FZMZJTMJSA-N	0	3	323.824	2.220	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)C(=O)Nc2ccc(Cl)cc2)CCN1C	ZINC000127585981	401741311	/nfs/dbraw/zinc/74/13/11/401741311.db2.gz	WJMOLTKHDLYCAV-SMDDNHRTSA-N	0	3	323.824	2.220	10	0		DEAEHN
CNc1cc(N2CCC[C@@H]2CN[C@@H](C)c2ccncc2)ncn1	ZINC000111227155	401701337	/nfs/dbraw/zinc/70/13/37/401701337.db2.gz	NBPAKKRERLVBBF-DZGCQCFKSA-N	0	3	312.421	2.233	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc3c(c2)CCO3)CCN1CCOC	ZINC000111228137	401702421	/nfs/dbraw/zinc/70/24/21/401702421.db2.gz	OGUBKUGAZJLATN-KRWDZBQOSA-N	0	3	304.434	2.164	10	0		DEAEHN
COc1cc(OCc2ccccc2)c([C@@H](N)CO)cc1OC	ZINC000072199790	401703673	/nfs/dbraw/zinc/70/36/73/401703673.db2.gz	MHOFEXXFBOBIKO-AWEZNQCLSA-N	0	3	303.358	2.275	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@@H]1Cc2cc(F)ccc2O1	ZINC000076962943	401801840	/nfs/dbraw/zinc/80/18/40/401801840.db2.gz	AVPSVSYPAFWEOL-ZBFHGGJFSA-N	0	3	308.397	2.222	10	0		DEAEHN
CC(C)N(CC(=O)N1CCO[C@@H]2CCCC[C@@H]21)C1CCOCC1	ZINC000077323691	401809962	/nfs/dbraw/zinc/80/99/62/401809962.db2.gz	FXLNCGSRWBMUKN-DLBZAZTESA-N	0	3	324.465	2.046	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(C(C)(C)C)nn1C	ZINC000113224375	401770587	/nfs/dbraw/zinc/77/05/87/401770587.db2.gz	KORLIDCZRCFTLX-CHWSQXEVSA-N	0	3	304.438	2.026	10	0		DEAEHN
Cc1nn(-c2ccccc2)cc1C(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000113229912	401771207	/nfs/dbraw/zinc/77/12/07/401771207.db2.gz	DHMFGRKHINCNFR-YOEHRIQHSA-N	0	3	324.428	2.489	10	0		DEAEHN
Cc1noc2nc(C)cc(C(=O)N3C[C@@H]4CCCN4C[C@@H]3C)c12	ZINC000113233196	401771732	/nfs/dbraw/zinc/77/17/32/401771732.db2.gz	PNVQYXJGSBRLDI-AAEUAGOBSA-N	0	3	314.389	2.148	10	0		DEAEHN
COc1ccc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1OC	ZINC000113233604	401772125	/nfs/dbraw/zinc/77/21/25/401772125.db2.gz	WQZZDLXSTARDIC-TZMCWYRMSA-N	0	3	304.390	2.013	10	0		DEAEHN
COc1ccc(OC)c(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000113233818	401772573	/nfs/dbraw/zinc/77/25/73/401772573.db2.gz	MNLQKGUHHIFNOB-CHWSQXEVSA-N	0	3	304.390	2.013	10	0		DEAEHN
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)C1CCC1	ZINC000115157817	401819925	/nfs/dbraw/zinc/81/99/25/401819925.db2.gz	MLQRPOLUJQOQFS-SFHVURJKSA-N	0	3	316.445	2.348	10	0		DEAEHN
C[C@@H](CNC(=O)C(C)(C)c1cccs1)CN1CCN(C)CC1	ZINC000115383984	401826043	/nfs/dbraw/zinc/82/60/43/401826043.db2.gz	FFCIONTWNFCARD-AWEZNQCLSA-N	0	3	323.506	2.025	10	0		DEAEHN
CN1C[C@@H](NCc2ccccc2OC(F)(F)F)CCC1=O	ZINC000077900191	401836030	/nfs/dbraw/zinc/83/60/30/401836030.db2.gz	NYPSIIOCXGGIAO-NSHDSACASA-N	0	3	302.296	2.296	10	0		DEAEHN
Cn1cncc1CN[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000132700401	401871652	/nfs/dbraw/zinc/87/16/52/401871652.db2.gz	FYNNSICBOAAJEE-HZPDHXFCSA-N	0	3	306.360	2.233	10	0		DEAEHN
CC(C)N(C(=O)[C@H](C)N1CC[C@H](c2cnn(C)c2)C1)C(C)C	ZINC000116321613	401850133	/nfs/dbraw/zinc/85/01/33/401850133.db2.gz	FUJAWGSEMJCQHU-GJZGRUSLSA-N	0	3	306.454	2.243	10	0		DEAEHN
COc1c(C)cnc(CN2CC[C@H](c3cnn(C)c3)C2)c1C	ZINC000116322876	401850349	/nfs/dbraw/zinc/85/03/49/401850349.db2.gz	PTTBLIMIEVBECZ-AWEZNQCLSA-N	0	3	300.406	2.430	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1cccc(C[S@@](C)=O)c1	ZINC000078614826	401858425	/nfs/dbraw/zinc/85/84/25/401858425.db2.gz	IQWLWFQBHDTECD-ZHRRBRCNSA-N	0	3	324.490	2.271	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NCCc1cscn1)c1ccccc1	ZINC000131900787	401858760	/nfs/dbraw/zinc/85/87/60/401858760.db2.gz	ZJVVKXLITUNRHQ-OAHLLOKOSA-N	0	3	318.446	2.288	10	0		DEAEHN
CCCc1cc(C(=O)N[C@H](CN(C)C)c2ccccc2)[nH]n1	ZINC000030027785	401861074	/nfs/dbraw/zinc/86/10/74/401861074.db2.gz	WQTLZSXJUXVVRX-MRXNPFEDSA-N	0	3	300.406	2.395	10	0		DEAEHN
Cc1ccc([C@@H](C)NC(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000117036180	401867062	/nfs/dbraw/zinc/86/70/62/401867062.db2.gz	JTUCIAPJLLBRDU-ZBFHGGJFSA-N	0	3	305.422	2.028	10	0		DEAEHN
c1ccc(-c2noc(-c3ccnc(N4CCNCC4)c3)n2)cc1	ZINC000040351952	401925044	/nfs/dbraw/zinc/92/50/44/401925044.db2.gz	CWWRFKKWGKUENM-UHFFFAOYSA-N	0	3	307.357	2.208	10	0		DEAEHN
COc1cc(C[NH2+][C@@H]2CCO[C@@H]2C)cc(Br)c1[O-]	ZINC000135312043	401935340	/nfs/dbraw/zinc/93/53/40/401935340.db2.gz	SIDMTCYVGRJIFF-LDYMZIIASA-N	0	3	316.195	2.430	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)[C@@H]1CCCn2ccnc21	ZINC000080653671	401890676	/nfs/dbraw/zinc/89/06/76/401890676.db2.gz	VJZIBIRUODXUME-LSDHHAIUSA-N	0	3	304.438	2.141	10	0		DEAEHN
O=C1CCCN1C[C@@H](O)CNC(c1ccccc1)c1ccccc1	ZINC000033895811	401892353	/nfs/dbraw/zinc/89/23/53/401892353.db2.gz	NZWUBIVBYPPDDB-SFHVURJKSA-N	0	3	324.424	2.349	10	0		DEAEHN
CCCC(=O)OC[C@@H](O)CN(Cc1cccc(OC)c1)C1CC1	ZINC000036031012	401901387	/nfs/dbraw/zinc/90/13/87/401901387.db2.gz	NBDKODUBPGHYJN-INIZCTEOSA-N	0	3	321.417	2.364	10	0		DEAEHN
CC[C@H](c1ccc(Cl)cc1)N(C)CC(=O)N1CCNCC1	ZINC000038030933	401920597	/nfs/dbraw/zinc/92/05/97/401920597.db2.gz	YFDSSODRPMSNPT-OAHLLOKOSA-N	0	3	309.841	2.155	10	0		DEAEHN
CN(CCCN1CCN(C)CC1)C(=O)[C@H]1C[C@H]1C1CCCCC1	ZINC000119900442	401971005	/nfs/dbraw/zinc/97/10/05/401971005.db2.gz	YJDZKTNGSVZAFI-ROUUACIJSA-N	0	3	321.509	2.299	10	0		DEAEHN
Cn1ccnc1C[C@@H]1CCCN(CC(=O)NCCC(C)(C)C)C1	ZINC000090003975	401978923	/nfs/dbraw/zinc/97/89/23/401978923.db2.gz	IFYCTVPOQRXUFY-HNNXBMFYSA-N	0	3	320.481	2.227	10	0		DEAEHN
CC(C)(C)OC(=O)N1C[C@@H](c2nccc3[nH]ccc32)[C@H](N)C1	ZINC000089220766	401938885	/nfs/dbraw/zinc/93/88/85/401938885.db2.gz	VCNPCIVVKYWICT-VXGBXAGGSA-N	0	3	302.378	2.225	10	0		DEAEHN
Nc1c(Br)cc(Br)cc1[C@@H](N)CCO	ZINC000044233353	401940657	/nfs/dbraw/zinc/94/06/57/401940657.db2.gz	VNCQWTNKHVFWTC-QMMMGPOBSA-N	0	3	324.016	2.176	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cccc(Oc2cnccn2)c1	ZINC000135492607	401941963	/nfs/dbraw/zinc/94/19/63/401941963.db2.gz	PWVCJSNRAGZUKU-AWEZNQCLSA-N	0	3	312.373	2.093	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)Nc1cc(COC)ncn1	ZINC000093312195	402013918	/nfs/dbraw/zinc/01/39/18/402013918.db2.gz	SMQRFBYPBWTMBZ-CQSZACIVSA-N	0	3	321.425	2.009	10	0		DEAEHN
O[C@@H](CN1CC[C@@H](COCc2ccccc2)C1)C(F)(F)F	ZINC000121380658	402032072	/nfs/dbraw/zinc/03/20/72/402032072.db2.gz	HVQGVJNITXBJSQ-KGLIPLIRSA-N	0	3	303.324	2.448	10	0		DEAEHN
CCN1CC[C@H](N(C)C(=O)c2cc(C(C)=O)cn2C)[C@H](C)C1	ZINC000122346193	402074084	/nfs/dbraw/zinc/07/40/84/402074084.db2.gz	ZWHMWZNEVWNQBI-DOMZBBRYSA-N	0	3	305.422	2.030	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cccc(-n3cccn3)c2)CCN1C	ZINC000122666697	402089460	/nfs/dbraw/zinc/08/94/60/402089460.db2.gz	YCTOUVNCCWFDIH-GDBMZVCRSA-N	0	3	312.417	2.427	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCCOc2ccc(F)cc2)C1	ZINC000057632484	402096161	/nfs/dbraw/zinc/09/61/61/402096161.db2.gz	DLPGAZFNJHAVTL-HNNXBMFYSA-N	0	3	323.412	2.378	10	0		DEAEHN
C[C@@H](N[C@H]1CCC(=O)N(C)C1)c1cnn(Cc2ccccc2)c1	ZINC000152465141	402096680	/nfs/dbraw/zinc/09/66/80/402096680.db2.gz	LGZFTFVWHVRBKL-PBHICJAKSA-N	0	3	312.417	2.203	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccncc2Br)C1	ZINC000152822043	402110982	/nfs/dbraw/zinc/11/09/82/402110982.db2.gz	JWKLSRVFQLLVDR-SNVBAGLBSA-N	0	3	312.211	2.058	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cc3ccccc3oc2=O)CCN1C	ZINC000123178090	402114219	/nfs/dbraw/zinc/11/42/19/402114219.db2.gz	MVAKSTQFQXNIJE-OCCSQVGLSA-N	0	3	314.385	2.348	10	0		DEAEHN
CN(C)C[C@@](C)(O)CNC(=O)c1ccc(-c2ccc(F)cc2)o1	ZINC000152890930	402115254	/nfs/dbraw/zinc/11/52/54/402115254.db2.gz	KFZQTVLAUZKGRD-KRWDZBQOSA-N	0	3	320.364	2.128	10	0		DEAEHN
CCc1ccc([C@@H](CNC(=O)NC[C@H](O)C(C)C)N(C)C)cc1	ZINC000152947675	402118336	/nfs/dbraw/zinc/11/83/36/402118336.db2.gz	OMHCKGZPKJSZSG-SJORKVTESA-N	0	3	321.465	2.168	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)NC[C@@H](O)C(C)C)c1ccccc1	ZINC000152952176	402118477	/nfs/dbraw/zinc/11/84/77/402118477.db2.gz	RJSWKOJVCZBERV-DLBZAZTESA-N	0	3	321.465	2.386	10	0		DEAEHN
CSc1ccc(O[C@@H](C)C(=O)NC[C@@H]2CCCN2C)cc1	ZINC000151930544	402066368	/nfs/dbraw/zinc/06/63/68/402066368.db2.gz	NUIUFHLKWFEIJC-STQMWFEESA-N	0	3	308.447	2.386	10	0		DEAEHN
COc1cccc(Cl)c1CC(=O)NC[C@H](C)N(C)C1CC1	ZINC000153157577	402130303	/nfs/dbraw/zinc/13/03/03/402130303.db2.gz	PVCKGGSJOUCQDO-NSHDSACASA-N	0	3	310.825	2.490	10	0		DEAEHN
Cc1cccc(C(=O)NC[C@H](O)CN2CCCCC2)c1Cl	ZINC000123526234	402132530	/nfs/dbraw/zinc/13/25/30/402132530.db2.gz	HKHYCLDSDDJWOS-ZDUSSCGKSA-N	0	3	310.825	2.225	10	0		DEAEHN
Cn1ccnc1C[C@H]1CCCN(CC(=O)Nc2ccccc2)C1	ZINC000123649462	402139970	/nfs/dbraw/zinc/13/99/70/402139970.db2.gz	ZZPYPXFVQISRMI-OAHLLOKOSA-N	0	3	312.417	2.313	10	0		DEAEHN
O=C(CCN1CCC[C@@H](n2cncn2)C1)NCC1CCCCC1	ZINC000066874531	402145293	/nfs/dbraw/zinc/14/52/93/402145293.db2.gz	ZDZXLRXLJNSQDH-MRXNPFEDSA-N	0	3	319.453	2.002	10	0		DEAEHN
CCOC[C@H](NC(=O)N[C@H](CC(C)C)CN(C)C)C(C)C	ZINC000190125210	286167239	/nfs/dbraw/zinc/16/72/39/286167239.db2.gz	ZNXRTEODROWGAC-CABCVRRESA-N	0	3	301.475	2.323	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)c2ccc(N3CCOC3=O)cc2)c1	ZINC000123887918	402152291	/nfs/dbraw/zinc/15/22/91/402152291.db2.gz	SSQZAGRWJSVBCU-CQSZACIVSA-N	0	3	314.389	2.499	10	0		DEAEHN
COC[C@H](C)C(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000103388468	402186228	/nfs/dbraw/zinc/18/62/28/402186228.db2.gz	MGEXUCOHGRRUEH-AWEZNQCLSA-N	0	3	322.474	2.499	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)N[C@@H](Cc2ccccc2)C2CC2)C1	ZINC000154169363	402197002	/nfs/dbraw/zinc/19/70/02/402197002.db2.gz	FXTLHNAPFXKPBN-IRXDYDNUSA-N	0	3	301.434	2.353	10	0		DEAEHN
CCN(CCNC(=O)N(C)CCc1ccc(F)cc1)C1CC1	ZINC000102064704	402162495	/nfs/dbraw/zinc/16/24/95/402162495.db2.gz	AFRUWTUTHWZUJX-UHFFFAOYSA-N	0	3	307.413	2.494	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)ccc1F	ZINC000124071754	402162692	/nfs/dbraw/zinc/16/26/92/402162692.db2.gz	FQUZXSPGSPOQJD-SMDDNHRTSA-N	0	3	321.396	2.339	10	0		DEAEHN
CC1(c2ccccc2)CCN(C[C@H](O)CN2CCCC2=O)CC1	ZINC000153871910	402176396	/nfs/dbraw/zinc/17/63/96/402176396.db2.gz	IHZGEVLFWNXMLB-KRWDZBQOSA-N	0	3	316.445	2.023	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1cccc(C(=O)N(C)C)c1	ZINC000103074734	402177798	/nfs/dbraw/zinc/17/77/98/402177798.db2.gz	ZNFNWQMWTZUHGX-INIZCTEOSA-N	0	3	319.449	2.095	10	0		DEAEHN
COc1ccccc1C1CC(N[C@H]2CCCS(=O)(=O)C2)C1	ZINC000069140602	402214310	/nfs/dbraw/zinc/21/43/10/402214310.db2.gz	AMZAHVIFPFBUIP-MOKVOYLWSA-N	0	3	309.431	2.108	10	0		DEAEHN
C[NH+](C)C1CCN(C(=O)c2ccc3c(c2[O-])OC(C)(C)C3)CC1	ZINC000069627203	402235099	/nfs/dbraw/zinc/23/50/99/402235099.db2.gz	QOMRARDHZYKXBE-UHFFFAOYSA-N	0	3	318.417	2.272	10	0		DEAEHN
CCOc1ccc(CN2CCN(C[C@@H](C)O)[C@@H](CC)C2)cc1	ZINC000155083064	402244552	/nfs/dbraw/zinc/24/45/52/402244552.db2.gz	MMZAVUVIBXSHLP-WBVHZDCISA-N	0	3	306.450	2.362	10	0		DEAEHN
COc1ccc([C@H]2C[C@H](C)N(CCN3CCCC3=O)C2)cc1	ZINC000155257671	402250088	/nfs/dbraw/zinc/25/00/88/402250088.db2.gz	OZVKEUYTJIVQOW-HOCLYGCPSA-N	0	3	302.418	2.495	10	0		DEAEHN
CNC(=O)[C@H](NCc1cc(Br)cs1)C(C)C	ZINC000125024561	402209376	/nfs/dbraw/zinc/20/93/76/402209376.db2.gz	MWHDBNIUSFHIND-SNVBAGLBSA-N	0	3	305.241	2.371	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1cccc2[nH]ccc21	ZINC000110091943	402281112	/nfs/dbraw/zinc/28/11/12/402281112.db2.gz	AKAUREBEEQJXEF-ZDUSSCGKSA-N	0	3	316.405	2.400	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@H](C)N[C@H](C)CN1CCOCC1	ZINC000156744039	402287588	/nfs/dbraw/zinc/28/75/88/402287588.db2.gz	YHGUMSBUDQAYQY-KGLIPLIRSA-N	0	3	308.470	2.318	10	0		DEAEHN
CC1(C)CC[C@H](CN2CCC(c3ccnn3CCO)CC2)O1	ZINC000184669657	402290477	/nfs/dbraw/zinc/29/04/77/402290477.db2.gz	RSZXFFPNEIBHJE-OAHLLOKOSA-N	0	3	307.438	2.012	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)CCc2nc3c(cccc3C)[nH]2)C1	ZINC000176266989	402295641	/nfs/dbraw/zinc/29/56/41/402295641.db2.gz	CDOABUVCHHXKOE-AWEZNQCLSA-N	0	3	314.433	2.404	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)CCc2nc3cccc(C)c3[nH]2)C1	ZINC000176266989	402295643	/nfs/dbraw/zinc/29/56/43/402295643.db2.gz	CDOABUVCHHXKOE-AWEZNQCLSA-N	0	3	314.433	2.404	10	0		DEAEHN
C[C@@H](CCn1cccn1)N[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000158845171	402313350	/nfs/dbraw/zinc/31/33/50/402313350.db2.gz	KIBGTIHIMPESIE-DOTOQJQBSA-N	0	3	312.417	2.447	10	0		DEAEHN
CC(C)[C@](C)(O)CN1CCCN(C(=O)c2ccsc2)CC1	ZINC000184967474	402313772	/nfs/dbraw/zinc/31/37/72/402313772.db2.gz	FCRVQKIFRHRLHI-MRXNPFEDSA-N	0	3	310.463	2.303	10	0		DEAEHN
NC(=O)[C@@]1(O)CCCN(Cc2ccc(-c3ccccc3)cc2)C1	ZINC000225476367	402318385	/nfs/dbraw/zinc/31/83/85/402318385.db2.gz	WQSDNYCTBICZTB-LJQANCHMSA-N	0	3	310.397	2.166	10	0		DEAEHN
CC[C@H]1CN(Cc2cn3cc(C)ccc3n2)CCN1CCOC	ZINC000176917258	402349700	/nfs/dbraw/zinc/34/97/00/402349700.db2.gz	OMPRTBKOHQZAJY-KRWDZBQOSA-N	0	3	316.449	2.185	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cccc(OCCOC)c1	ZINC000176974508	402355933	/nfs/dbraw/zinc/35/59/33/402355933.db2.gz	QMAVAPPBKBJWTJ-INIZCTEOSA-N	0	3	320.433	2.268	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@H]1COc2ccccc2C1	ZINC000176988811	402357507	/nfs/dbraw/zinc/35/75/07/402357507.db2.gz	JSXAXTLWSOEVLA-CVEARBPZSA-N	0	3	302.418	2.180	10	0		DEAEHN
C[C@]1(CNC(=O)N[C@H]2CCOC2)CCCN1Cc1ccccc1	ZINC000344996473	404491205	/nfs/dbraw/zinc/49/12/05/404491205.db2.gz	CIEZBZLJQBEWNR-FUHWJXTLSA-N	0	3	317.433	2.129	10	0		DEAEHN
CCC[C@H]1CCCCN1C(=O)NC[C@@H]1CCCN1CCOC	ZINC000186139557	402404954	/nfs/dbraw/zinc/40/49/54/402404954.db2.gz	RBIXTBLTCQFEEY-HOTGVXAUSA-N	0	3	311.470	2.461	10	0		DEAEHN
C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)c1ccc2c(c1)OCO2	ZINC000237434155	402408446	/nfs/dbraw/zinc/40/84/46/402408446.db2.gz	IAYQATGLJLFUJW-WFASDCNBSA-N	0	3	312.369	2.163	10	0		DEAEHN
CCO[C@H]1C[C@H](NCc2cccc3c2OCO3)C12CCOCC2	ZINC000186265494	402416077	/nfs/dbraw/zinc/41/60/77/402416077.db2.gz	AZCDTJFPOBMSOD-HOTGVXAUSA-N	0	3	319.401	2.479	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC(c2cnn(CC)c2)CC1)N(C)C	ZINC000162439576	402420142	/nfs/dbraw/zinc/42/01/42/402420142.db2.gz	VAKNPFDFLOJVMP-MRXNPFEDSA-N	0	3	306.454	2.339	10	0		DEAEHN
O=C(Nc1cccc2ccccc21)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000177684434	402426769	/nfs/dbraw/zinc/42/67/69/402426769.db2.gz	CTBOAYHHQUKKDX-OAHLLOKOSA-N	0	3	323.396	2.085	10	0		DEAEHN
CCN(C(=O)N(C)C1CCN(CCn2cccn2)CC1)C(C)C	ZINC000162758770	402430997	/nfs/dbraw/zinc/43/09/97/402430997.db2.gz	HWNJPNKMKFWBKR-UHFFFAOYSA-N	0	3	321.469	2.130	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)N(C[C@H]1CCCO1)C1CCCC1	ZINC000238041317	402433951	/nfs/dbraw/zinc/43/39/51/402433951.db2.gz	FETUMKVSKGLOKZ-UKRRQHHQSA-N	0	3	312.479	2.032	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccc(-n2cccn2)cc1)N(C)C	ZINC000161572588	402392211	/nfs/dbraw/zinc/39/22/11/402392211.db2.gz	PCQXONIBPNOYJW-MRXNPFEDSA-N	0	3	300.406	2.219	10	0		DEAEHN
O=C(c1c[nH]nc1-c1ccsc1)N1CCN2CCC[C@@H]2C1	ZINC000186683039	402455252	/nfs/dbraw/zinc/45/52/52/402455252.db2.gz	ITAQSYWQJVWAHD-GFCCVEGCSA-N	0	3	302.403	2.058	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)/C=C/c1ccc(F)cc1	ZINC000245414727	402457746	/nfs/dbraw/zinc/45/77/46/402457746.db2.gz	DTFRMBFGODYURU-GPJUQDOMSA-N	0	3	324.421	2.295	10	0		DEAEHN
C[C@@H](c1ccccc1)[C@](C)(O)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000245428249	402459954	/nfs/dbraw/zinc/45/99/54/402459954.db2.gz	WYKKYLTWMLBLQB-GFIVTLFCSA-N	0	3	318.461	2.482	10	0		DEAEHN
CCN1CCN(CCCCNC(=O)NCCC2=CCCC2)CC1	ZINC000164181336	402460214	/nfs/dbraw/zinc/46/02/14/402460214.db2.gz	KXDHSDXOHNHSLP-UHFFFAOYSA-N	0	3	322.497	2.204	10	0		DEAEHN
COc1cccc([C@H]2C[C@@H]2C(=O)N(C)CCN(C)C2CC2)c1	ZINC000186724999	402460492	/nfs/dbraw/zinc/46/04/92/402460492.db2.gz	DOOGIKLTQZKMJB-SJORKVTESA-N	0	3	302.418	2.351	10	0		DEAEHN
CO[C@@H](C)c1nc(C)c(C(=O)N(C)CCN(C)C2CC2)s1	ZINC000186732408	402460790	/nfs/dbraw/zinc/46/07/90/402460790.db2.gz	NKBZQTFUUYKUAM-NSHDSACASA-N	0	3	311.451	2.325	10	0		DEAEHN
CN(C[C@H](O)COc1ccc2ccccc2c1)CC1(CO)CC1	ZINC000186805147	402465444	/nfs/dbraw/zinc/46/54/44/402465444.db2.gz	AIZDULVIINKDOJ-KRWDZBQOSA-N	0	3	315.413	2.284	10	0		DEAEHN
CCN(CC)c1ccc(CN[C@H](COC)C2CCOCC2)cn1	ZINC000187804412	402512389	/nfs/dbraw/zinc/51/23/89/402512389.db2.gz	LCWIRDBCCVZAOG-QGZVFWFLSA-N	0	3	321.465	2.459	10	0		DEAEHN
C[C@H]1CC[C@@H]([N-]S(=O)(=O)c2ccccc2C(F)(F)F)C[NH2+]1	ZINC000164748824	402468671	/nfs/dbraw/zinc/46/86/71/402468671.db2.gz	VPYQKNRKOLCUEJ-VHSXEESVSA-N	0	3	322.352	2.124	10	0		DEAEHN
COc1cccc([C@H](C)N[C@H](C(=O)N2CCOCC2)C(C)C)c1	ZINC000164897833	402470292	/nfs/dbraw/zinc/47/02/92/402470292.db2.gz	HMSSADFNGIQTHI-YOEHRIQHSA-N	0	3	320.433	2.229	10	0		DEAEHN
CCOCCN1CCN(CCCCn2ccnc2C)C[C@H]1C	ZINC000245576945	402472456	/nfs/dbraw/zinc/47/24/56/402472456.db2.gz	BFIVQIRVEMEMKJ-MRXNPFEDSA-N	0	3	308.470	2.014	10	0		DEAEHN
COc1ccc([C@H](C)NCCNC(=O)C(C)C)cc1NC(C)=O	ZINC000178225481	402473671	/nfs/dbraw/zinc/47/36/71/402473671.db2.gz	ZEPFKMRGISTLPO-LBPRGKRZSA-N	0	3	321.421	2.076	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCc2cccnc2)[C@H]1c1ccccc1	ZINC000245660330	402477142	/nfs/dbraw/zinc/47/71/42/402477142.db2.gz	PNGDXVXJMDTSOP-IAGOWNOFSA-N	0	3	310.401	2.326	10	0		DEAEHN
C[C@H](N[C@H]1CCCN(c2cnn(C)c2)C1)c1cncc(F)c1	ZINC000166603666	402485984	/nfs/dbraw/zinc/48/59/84/402485984.db2.gz	AWDGWYHIDIYZFH-WFASDCNBSA-N	0	3	303.385	2.274	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)N(C)C	ZINC000245785971	402487438	/nfs/dbraw/zinc/48/74/38/402487438.db2.gz	MWLIBKYMWRRTCP-BPQIPLTHSA-N	0	3	317.477	2.496	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N(C)CCc1ccncc1	ZINC000170682705	402513501	/nfs/dbraw/zinc/51/35/01/402513501.db2.gz	PJAGQBZDQWPCNA-INIZCTEOSA-N	0	3	306.454	2.242	10	0		DEAEHN
COCC[C@@](C)(O)CN[C@H](C)c1ccc(OC)c(NC(C)=O)c1	ZINC000178380759	402491935	/nfs/dbraw/zinc/49/19/35/402491935.db2.gz	DMZBSGQCKHOCJB-SJKOYZFVSA-N	0	3	324.421	2.092	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c(C)o1	ZINC000245865469	402492601	/nfs/dbraw/zinc/49/26/01/402492601.db2.gz	INDZBGWZQCXTJX-UONOGXRCSA-N	0	3	312.435	2.001	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cc(C(=O)OC)cs2)C1	ZINC000178436360	402498131	/nfs/dbraw/zinc/49/81/31/402498131.db2.gz	MVAIWJDBLXQOHB-NSHDSACASA-N	0	3	311.407	2.141	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCCc2ccccc2F)C1	ZINC000245959296	402500925	/nfs/dbraw/zinc/50/09/25/402500925.db2.gz	MJTQUAQIUWMDIZ-DOTOQJQBSA-N	0	3	319.424	2.494	10	0		DEAEHN
C[C@H](NC(=O)[C@]1(F)CCNC1)c1ccc(Br)cc1	ZINC000178462176	402501356	/nfs/dbraw/zinc/50/13/56/402501356.db2.gz	IHWCHHVHEBZHIZ-ZANVPECISA-N	0	3	315.186	2.328	10	0		DEAEHN
COc1ccc(CC[C@H](C)NCc2cc(C(N)=O)co2)cc1	ZINC000187715986	402509526	/nfs/dbraw/zinc/50/95/26/402509526.db2.gz	FAUHYZOANPBAHV-LBPRGKRZSA-N	0	3	302.374	2.498	10	0		DEAEHN
C[C@@H]1CN(C2CCN(Cc3cccnc3Cl)CC2)CCO1	ZINC000170928356	402542632	/nfs/dbraw/zinc/54/26/32/402542632.db2.gz	BLYQKBCQUKMXNC-CYBMUJFWSA-N	0	3	309.841	2.420	10	0		DEAEHN
CC(C)CO[C@@H]1CCN(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)C1	ZINC000246961972	402550585	/nfs/dbraw/zinc/55/05/85/402550585.db2.gz	CHXBIRVKUROCRI-ARFHVFGLSA-N	0	3	311.470	2.172	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2ccc3c(c2)CCCN3C)C1	ZINC000171082148	402556010	/nfs/dbraw/zinc/55/60/10/402556010.db2.gz	FTBJZHMWIYNRAD-HNNXBMFYSA-N	0	3	302.422	2.237	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)N(C)CCOc2ccccc2)C1	ZINC000247378770	402565529	/nfs/dbraw/zinc/56/55/29/402565529.db2.gz	PQTUYMRTJXHCFX-DOTOQJQBSA-N	0	3	319.449	2.436	10	0		DEAEHN
C[C@@H](N[C@H]1CCNC1=O)c1ccc(OCC(F)(F)F)cc1	ZINC000179065260	402570052	/nfs/dbraw/zinc/57/00/52/402570052.db2.gz	KEDOGCWISNZZHU-SKDRFNHKSA-N	0	3	302.296	2.167	10	0		DEAEHN
COc1cc(C)c(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1OC	ZINC000246182641	402516368	/nfs/dbraw/zinc/51/63/68/402516368.db2.gz	NEONEPKTUQWSSO-KGLIPLIRSA-N	0	3	318.417	2.321	10	0		DEAEHN
CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)[C@@H](C)C1	ZINC000246305091	402523966	/nfs/dbraw/zinc/52/39/66/402523966.db2.gz	ATIOBQUTIDCWIC-WFASDCNBSA-N	0	3	323.412	2.403	10	0		DEAEHN
CC[N@H+]1CC[C@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)[C@@H](C)C1	ZINC000246305091	402523968	/nfs/dbraw/zinc/52/39/68/402523968.db2.gz	ATIOBQUTIDCWIC-WFASDCNBSA-N	0	3	323.412	2.403	10	0		DEAEHN
Cc1ccc(SCCNC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170826696	402529691	/nfs/dbraw/zinc/52/96/91/402529691.db2.gz	MVHSMTCQAYUHBT-AWEZNQCLSA-N	0	3	307.463	2.433	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@H]2CCC[C@H](C(F)(F)F)C2)C1	ZINC000170827968	402529841	/nfs/dbraw/zinc/52/98/41/402529841.db2.gz	FOIDJCONTGAUDG-SDDRHHMPSA-N	0	3	307.360	2.453	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)C1	ZINC000170836505	402531445	/nfs/dbraw/zinc/53/14/45/402531445.db2.gz	DNVDNHDWFPVRNK-IKGGRYGDSA-N	0	3	317.433	2.252	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)C(=O)N2CCCC2(C)C)c1	ZINC000170848132	402532866	/nfs/dbraw/zinc/53/28/66/402532866.db2.gz	YKFQNKFRLPEZJG-UHFFFAOYSA-N	0	3	303.406	2.088	10	0		DEAEHN
Cc1cc(C(=O)CCC(=O)N2CC[C@H](N(C)C)C2)c(C)s1	ZINC000170860650	402533583	/nfs/dbraw/zinc/53/35/83/402533583.db2.gz	KBVBNCXZKACTAJ-ZDUSSCGKSA-N	0	3	308.447	2.490	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1[C@H](C)C[C@H]2CCCC[C@@H]21	ZINC000246494256	402533651	/nfs/dbraw/zinc/53/36/51/402533651.db2.gz	IOONHVGEYUVELJ-VQHPVUNQSA-N	0	3	323.481	2.460	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1ccc2nccn2c1)c1ccccc1	ZINC000170861656	402534096	/nfs/dbraw/zinc/53/40/96/402534096.db2.gz	DNMQEZGXKOARKT-MRXNPFEDSA-N	0	3	308.385	2.367	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COc2cc(C)cc(C)c2)CC[C@@H]1C	ZINC000189314085	402534160	/nfs/dbraw/zinc/53/41/60/402534160.db2.gz	HMEGIMIENHEYHW-LZLYRXPVSA-N	0	3	307.434	2.400	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cc(F)cc(Br)c2)C1	ZINC000170865956	402535029	/nfs/dbraw/zinc/53/50/29/402535029.db2.gz	DYHRTKUVRQHEEA-GFCCVEGCSA-N	0	3	315.186	2.364	10	0		DEAEHN
O=C(CCc1ccccc1O)N1CCN(C2CCCC2)CC1	ZINC000247956774	402578857	/nfs/dbraw/zinc/57/88/57/402578857.db2.gz	NSZCWZJTQVKAIE-UHFFFAOYSA-N	0	3	302.418	2.412	10	0		DEAEHN
OC[C@H]1C[C@H](O)CN1CCCSc1ccccc1Cl	ZINC000179180617	402578967	/nfs/dbraw/zinc/57/89/67/402578967.db2.gz	CHCSVLDOXPOPIZ-NEPJUHHUSA-N	0	3	301.839	2.250	10	0		DEAEHN
CC(C)[C@](C)(O)CNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248087861	402582037	/nfs/dbraw/zinc/58/20/37/402582037.db2.gz	SYCWEBSCRHZHSK-SOLBZPMBSA-N	0	3	319.449	2.138	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2ccc3c(c2)CCCC(=O)N3)C1	ZINC000171522981	402591045	/nfs/dbraw/zinc/59/10/45/402591045.db2.gz	KQMTYIQYQNDWOP-AWEZNQCLSA-N	0	3	316.405	2.129	10	0		DEAEHN
CCC[C@](C)(CO)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179477335	402591320	/nfs/dbraw/zinc/59/13/20/402591320.db2.gz	PWCVGEKHXHEHHK-LZLYRXPVSA-N	0	3	319.449	2.282	10	0		DEAEHN
Cc1nnc([C@H](C)N2CC[C@@H](CN(C)Cc3cccnc3)C2)o1	ZINC000248644838	402601092	/nfs/dbraw/zinc/60/10/92/402601092.db2.gz	FRKJWCGKMQHDQG-BBRMVZONSA-N	0	3	315.421	2.288	10	0		DEAEHN
O=C(N[C@@H]1CCCOC1)N1CCN(CC2CCCCC2)CC1	ZINC000171614139	402601489	/nfs/dbraw/zinc/60/14/89/402601489.db2.gz	SNTUBFNMZCEWQI-MRXNPFEDSA-N	0	3	309.454	2.073	10	0		DEAEHN
CN(CCN(C)[C@H]1CCN(c2c(F)cccc2F)C1=O)C1CC1	ZINC000248674640	402602867	/nfs/dbraw/zinc/60/28/67/402602867.db2.gz	CIMGSLWMOHIPAL-HNNXBMFYSA-N	0	3	323.387	2.096	10	0		DEAEHN
C[C@H]1CC(CC[N@@H+]2CCC[C@@]3(C2)NC(=O)[N-]C3=O)C[C@H](C)C1	ZINC000248682417	402603287	/nfs/dbraw/zinc/60/32/87/402603287.db2.gz	PUFQIBHDKAUZBS-XNJGSVPQSA-N	0	3	307.438	2.123	10	0		DEAEHN
C[C@H]1CC(CC[N@H+]2CCC[C@@]3(C2)NC(=O)[N-]C3=O)C[C@H](C)C1	ZINC000248682417	402603289	/nfs/dbraw/zinc/60/32/89/402603289.db2.gz	PUFQIBHDKAUZBS-XNJGSVPQSA-N	0	3	307.438	2.123	10	0		DEAEHN
CCOc1ccccc1NC(=O)[C@H](C)N1CCN2CCC[C@@H]2C1	ZINC000171640947	402605025	/nfs/dbraw/zinc/60/50/25/402605025.db2.gz	IXYVPZORBUVXKI-LSDHHAIUSA-N	0	3	317.433	2.192	10	0		DEAEHN
COc1cc(CN[C@H]2CCN(c3ncccc3F)C2)ccc1O	ZINC000180162876	402609119	/nfs/dbraw/zinc/60/91/19/402609119.db2.gz	NAINTNVTAWJVLE-ZDUSSCGKSA-N	0	3	317.364	2.303	10	0		DEAEHN
CC[C@H](C)OCC(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190620909	402614093	/nfs/dbraw/zinc/61/40/93/402614093.db2.gz	DRBKPWKLSLFEEB-RDJZCZTQSA-N	0	3	319.449	2.177	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)NC2C3CC4CC(C3)CC2C4)C1	ZINC000171747481	402617799	/nfs/dbraw/zinc/61/77/99/402617799.db2.gz	AJQYLOREMCHBLE-CNSOWSRNSA-N	0	3	305.466	2.452	10	0		DEAEHN
CC(C)CNC(=O)CN[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000180675781	402623269	/nfs/dbraw/zinc/62/32/69/402623269.db2.gz	KPFUBPWTHYRSGE-AWEZNQCLSA-N	0	3	300.406	2.295	10	0		DEAEHN
C[C@H]1CCCN(CCNC(=O)[C@H](Cc2ccccc2)N(C)C)C1	ZINC000247877054	402577381	/nfs/dbraw/zinc/57/73/81/402577381.db2.gz	YUCFDCOSKSMKLR-WMZOPIPTSA-N	0	3	317.477	2.007	10	0		DEAEHN
Cc1cccc(OC[C@H](C)NC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000171903843	402632409	/nfs/dbraw/zinc/63/24/09/402632409.db2.gz	WBNJXAGGYPYCOP-JKSUJKDBSA-N	0	3	317.433	2.252	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)CC(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)C1	ZINC000249606409	402636536	/nfs/dbraw/zinc/63/65/36/402636536.db2.gz	ZUEWPODXDNTQRO-HBPKQKSZSA-N	0	3	310.482	2.410	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@@H]2COc3ccc(Cl)cc3C2)C1	ZINC000249611628	402636900	/nfs/dbraw/zinc/63/69/00/402636900.db2.gz	MGPZWGRDSJOJSQ-DZGCQCFKSA-N	0	3	322.836	2.492	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NC[C@H]1CCCc2ccccc21	ZINC000249734183	402639458	/nfs/dbraw/zinc/63/94/58/402639458.db2.gz	CQPYFRLFGAJWMS-CVEARBPZSA-N	0	3	301.434	2.500	10	0		DEAEHN
Cc1ncc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c(C(C)C)n1	ZINC000172142841	402642124	/nfs/dbraw/zinc/64/21/24/402642124.db2.gz	VTLQVKDQNODLCM-JSGCOSHPSA-N	0	3	302.422	2.217	10	0		DEAEHN
CC1(CNC(=O)c2cccc(CN3CCCC3)c2)OCCCO1	ZINC000191107243	402642597	/nfs/dbraw/zinc/64/25/97/402642597.db2.gz	ODQZQPXJIUVPMD-UHFFFAOYSA-N	0	3	318.417	2.165	10	0		DEAEHN
CC(C)(C)OC(=O)CCCCN1CCC[C@H](n2cncn2)C1	ZINC000181853491	402658951	/nfs/dbraw/zinc/65/89/51/402658951.db2.gz	LMCBCYWBKDABBH-AWEZNQCLSA-N	0	3	308.426	2.427	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2ccc(OCC3CC3)cc2)CCO1	ZINC000191154138	402646481	/nfs/dbraw/zinc/64/64/81/402646481.db2.gz	HRHHKIJUNQROFR-SFHVURJKSA-N	0	3	304.434	2.238	10	0		DEAEHN
C[C@H](C(=O)Nc1cccc(F)c1)N1CCCN(C2CC2)CC1	ZINC000172347011	402651599	/nfs/dbraw/zinc/65/15/99/402651599.db2.gz	IMQQMMIBOUNQCR-CYBMUJFWSA-N	0	3	305.397	2.323	10	0		DEAEHN
CO[C@@H](C)CCC(=O)Nc1ccc(OC2CCN(C)CC2)nc1	ZINC000181781800	402657391	/nfs/dbraw/zinc/65/73/91/402657391.db2.gz	VVEMGQROWRMFGG-ZDUSSCGKSA-N	0	3	321.421	2.308	10	0		DEAEHN
COc1cc(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)ccc1O	ZINC000173709775	402709664	/nfs/dbraw/zinc/70/96/64/402709664.db2.gz	OMNGAZWLIWHDLV-JSGCOSHPSA-N	0	3	321.421	2.025	10	0		DEAEHN
COC(=O)c1ccccc1OCCN1CCCN(C2CC2)CC1	ZINC000182099806	402667199	/nfs/dbraw/zinc/66/71/99/402667199.db2.gz	ASHVGXBOELNONE-UHFFFAOYSA-N	0	3	318.417	2.022	10	0		DEAEHN
Cc1ccccc1OCCCN1CC[C@@H](N2CCOCC2)C1	ZINC000173929817	402719668	/nfs/dbraw/zinc/71/96/68/402719668.db2.gz	PIYOAFCBKUMYPX-QGZVFWFLSA-N	0	3	304.434	2.170	10	0		DEAEHN
C[C@H]1CN(CCC(=O)c2ccc(F)cc2)C[C@@H]1N1CCOCC1	ZINC000182421130	402689048	/nfs/dbraw/zinc/68/90/48/402689048.db2.gz	SIGOMSCWPBBEKQ-YOEHRIQHSA-N	0	3	320.408	2.051	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H](C)CN(C)Cc1ccccc1)N(C)C	ZINC000182533695	402697916	/nfs/dbraw/zinc/69/79/16/402697916.db2.gz	STMGEKXDADZKKP-NVXWUHKLSA-N	0	3	305.466	2.353	10	0		DEAEHN
CC(C)[C@H](C(=O)N1CCO[C@@H](CN(C)C)C1)c1ccccc1	ZINC000173522199	402700954	/nfs/dbraw/zinc/70/09/54/402700954.db2.gz	YLJWCLAGVLEHFV-IRXDYDNUSA-N	0	3	304.434	2.215	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)N1CCO[C@H](c2ccccc2)C1	ZINC000262566850	402727366	/nfs/dbraw/zinc/72/73/66/402727366.db2.gz	WVPBLMNSMWUIEE-HOTGVXAUSA-N	0	3	302.418	2.365	10	0		DEAEHN
COCc1csc(NC(=O)N(C)C[C@@H]2CCCN(C)C2)n1	ZINC000174393085	402739012	/nfs/dbraw/zinc/73/90/12/402739012.db2.gz	UXCXXCNPBQSSSL-LLVKDONJSA-N	0	3	312.439	2.095	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCCCOC2CCCC2)CCN1C	ZINC000174454869	402742494	/nfs/dbraw/zinc/74/24/94/402742494.db2.gz	UXQLQRWTRHDEBH-GJZGRUSLSA-N	0	3	311.470	2.460	10	0		DEAEHN
Cc1cc(-c2nc([C@H]3CNCCN3C)no2)c(Cl)cc1F	ZINC000263235360	402748582	/nfs/dbraw/zinc/74/85/82/402748582.db2.gz	NZGUSYGOFYSARA-GFCCVEGCSA-N	0	3	310.760	2.414	10	0		DEAEHN
COCCN(C)CCNC(=O)N1CCCC[C@@H]1c1ccc(C)o1	ZINC000174622982	402749204	/nfs/dbraw/zinc/74/92/04/402749204.db2.gz	AQJOOTMVSNETJI-OAHLLOKOSA-N	0	3	323.437	2.403	10	0		DEAEHN
CC[C@@H](OC1CCCCC1)c1nc([C@H]2CNCCN2C)no1	ZINC000263249303	402750052	/nfs/dbraw/zinc/75/00/52/402750052.db2.gz	PPXCJQSHASLFEK-ZIAGYGMSSA-N	0	3	308.426	2.446	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@]2(C)CCCc3ccccc32)n1	ZINC000263250911	402750682	/nfs/dbraw/zinc/75/06/82/402750682.db2.gz	PWFNIGLJPVNYIY-CRAIPNDOSA-N	0	3	312.417	2.288	10	0		DEAEHN
C[C@@H](Cc1cccc(F)c1)c1nc([C@H]2CNCCN2C)no1	ZINC000263283224	402754169	/nfs/dbraw/zinc/75/41/69/402754169.db2.gz	UPNFPPNUTDZQHV-SMDDNHRTSA-N	0	3	304.369	2.131	10	0		DEAEHN
COc1ccccc1[C@@H](O)CN[C@H](C)CC(=O)OC(C)(C)C	ZINC000183712177	402791076	/nfs/dbraw/zinc/79/10/76/402791076.db2.gz	GLTASKIAFNCOFF-OCCSQVGLSA-N	0	3	309.406	2.439	10	0		DEAEHN
CCN(CCO)CCNC(=O)[C@H](C)c1ccc(CC(C)C)cc1	ZINC000183953769	402808222	/nfs/dbraw/zinc/80/82/22/402808222.db2.gz	MCACRGIYCOBAPB-MRXNPFEDSA-N	0	3	320.477	2.419	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@H](C)OCc2cccc(OC)c2)C1	ZINC000194659246	402808470	/nfs/dbraw/zinc/80/84/70/402808470.db2.gz	LHJOURDINSRPDE-ZBFHGGJFSA-N	0	3	320.433	2.201	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)CCCc2nc(C(C)(C)C)no2)C1	ZINC000194658782	402808877	/nfs/dbraw/zinc/80/88/77/402808877.db2.gz	KXMDTLDEFNQGPQ-ZDUSSCGKSA-N	0	3	322.453	2.290	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cnn(-c2cccc(Cl)c2)c1	ZINC000194691874	402810416	/nfs/dbraw/zinc/81/04/16/402810416.db2.gz	MWSXEGYQVAPGRB-HNNXBMFYSA-N	0	3	318.808	2.350	10	0		DEAEHN
CCCN1CCN(Cc2ccc3c(c2)sc(=O)n3C)CC1	ZINC000194970197	402824546	/nfs/dbraw/zinc/82/45/46/402824546.db2.gz	ZWLXGRNGZBPKKA-UHFFFAOYSA-N	0	3	305.447	2.128	10	0		DEAEHN
COc1cc(CN[C@@H]2CCc3nnc(C(C)C)n3C2)ccc1O	ZINC000194977237	402824949	/nfs/dbraw/zinc/82/49/49/402824949.db2.gz	QSGHUAUBZFELJF-CYBMUJFWSA-N	0	3	316.405	2.220	10	0		DEAEHN
CCCC[C@@H](CCC)NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000175988691	402846270	/nfs/dbraw/zinc/84/62/70/402846270.db2.gz	YVGBOFGHORFNBC-HZPDHXFCSA-N	0	3	313.486	2.491	10	0		DEAEHN
CCCCn1cc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c(C)n1	ZINC000184524970	402848928	/nfs/dbraw/zinc/84/89/28/402848928.db2.gz	MPKLHNZKYIKBON-DZGCQCFKSA-N	0	3	304.438	2.300	10	0		DEAEHN
CCCCNC(=O)[C@@H](C)N1CC[C@H](CNc2cccc(C)n2)C1	ZINC000195516255	402849752	/nfs/dbraw/zinc/84/97/52/402849752.db2.gz	NTSGHNSMKFFUIM-HZPDHXFCSA-N	0	3	318.465	2.429	10	0		DEAEHN
O=C(Nc1ccn(-c2ccccc2)n1)N1CCN2CCC[C@H]2C1	ZINC000264735137	402892431	/nfs/dbraw/zinc/89/24/31/402892431.db2.gz	OJORRAVUFAALPG-HNNXBMFYSA-N	0	3	311.389	2.184	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N[C@H](C)C2=CCN(C)CC2)cc1	ZINC000280285479	402983834	/nfs/dbraw/zinc/98/38/34/402983834.db2.gz	PRUNHVWZJOAJDP-CYBMUJFWSA-N	0	3	315.417	2.050	10	0		DEAEHN
CCOC(=O)CCC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000268597106	403097719	/nfs/dbraw/zinc/09/77/19/403097719.db2.gz	UEZUZDLCJRVOES-INIZCTEOSA-N	0	3	318.417	2.063	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@H]1NCc1ccc(F)c(Br)c1	ZINC000282043168	403116373	/nfs/dbraw/zinc/11/63/73/403116373.db2.gz	AROPHZCZFDFPOX-QPUJVOFHSA-N	0	3	315.186	2.345	10	0		DEAEHN
Cn1ccnc(N2CCC[C@H](NC/C=C/c3ccccc3)C2)c1=O	ZINC000275728626	403119048	/nfs/dbraw/zinc/11/90/48/403119048.db2.gz	ZPLZLTIRSLDLOI-MPNRVQBSSA-N	0	3	324.428	2.052	10	0		DEAEHN
CN(Cc1ccccn1)[C@@H]1CCCN(Cc2cncn2C)CC1	ZINC000275837230	403127627	/nfs/dbraw/zinc/12/76/27/403127627.db2.gz	VTBRIQTULAHFSI-QGZVFWFLSA-N	0	3	313.449	2.302	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)C(=O)Nc1cscc1C	ZINC000276093157	403145406	/nfs/dbraw/zinc/14/54/06/403145406.db2.gz	FJTVQRADAKPABD-STQMWFEESA-N	0	3	321.446	2.080	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N2CC[C@H](N(C)C)C2)C12CCCC2	ZINC000173515784	286354666	/nfs/dbraw/zinc/35/46/66/286354666.db2.gz	WRDLWWKWPIGEDS-SOUVJXGZSA-N	0	3	309.454	2.070	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2ccc3[nH]ccc3c2)C1	ZINC000333065543	403658794	/nfs/dbraw/zinc/65/87/94/403658794.db2.gz	JJFPBYKQOXPBIB-MRXNPFEDSA-N	0	3	314.433	2.494	10	0		DEAEHN
COc1cc(OC)c2ncnc(N(C)[C@H]3CCCN(C)C3)c2c1	ZINC000302739779	403719356	/nfs/dbraw/zinc/71/93/56/403719356.db2.gz	QFNSSUDNVARSSY-LBPRGKRZSA-N	0	3	316.405	2.177	10	0		DEAEHN
CO[C@@H]1C[C@@H](CO)N(Cc2cccc(OC(F)(F)F)c2)C1	ZINC000343954006	403806065	/nfs/dbraw/zinc/80/60/65/403806065.db2.gz	LLRIUEFPBLHVPK-WCQYABFASA-N	0	3	305.296	2.167	10	0		DEAEHN
O=C(c1ccc2c(c1[O-])CCCC2)N1CCC2(CC[NH2+]2)CC1	ZINC000333760903	403849836	/nfs/dbraw/zinc/84/98/36/403849836.db2.gz	ALCDLYMEKRJFGP-UHFFFAOYSA-N	0	3	300.402	2.239	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCC[C@H]([C@H](C)O)C1	ZINC000305676077	403909454	/nfs/dbraw/zinc/90/94/54/403909454.db2.gz	ZYHGCCHTMRFKSZ-RDJZCZTQSA-N	0	3	304.434	2.128	10	0		DEAEHN
CC(C)n1cc2c(n1)C[C@@H](NC(=O)CC1CCN(C)CC1)CC2	ZINC000362928268	404008412	/nfs/dbraw/zinc/00/84/12/404008412.db2.gz	QFZGBLXAUJFDRN-INIZCTEOSA-N	0	3	318.465	2.169	10	0		DEAEHN
Cn1nccc1[C@@H]1OCC[C@H]1CN1CCCC[C@@H]1c1cn[nH]c1	ZINC000328998651	404194343	/nfs/dbraw/zinc/19/43/43/404194343.db2.gz	VCZFDEGVWYRVAI-YSVLISHTSA-N	0	3	315.421	2.448	10	0		DEAEHN
CC/C=C\CCN1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000342186396	404428861	/nfs/dbraw/zinc/42/88/61/404428861.db2.gz	INJBLHGWOKPQOF-JXCVUKRWSA-N	0	3	318.461	2.400	10	0		DEAEHN
Cc1noc([C@H]2CCN(Cc3c[nH]nc3-c3cccnc3)C2)n1	ZINC000344860715	404410813	/nfs/dbraw/zinc/41/08/13/404410813.db2.gz	CYFMIFLPQQOCNL-ZDUSSCGKSA-N	0	3	310.361	2.153	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNCC[C@@H]1CCCCO1	ZINC000291743976	404502645	/nfs/dbraw/zinc/50/26/45/404502645.db2.gz	PHDXXKSKJAOJHC-KRWDZBQOSA-N	0	3	300.406	2.375	10	0		DEAEHN
CO[C@@H](C)c1nc(C)c(-c2nc([C@H]3CC(=O)N(C)C3)no2)s1	ZINC000329748021	404439175	/nfs/dbraw/zinc/43/91/75/404439175.db2.gz	ZUAWINOIZMDPEH-IUCAKERBSA-N	0	3	322.390	2.155	10	0		DEAEHN
Cc1cnc([C@H](C)N2CCC[C@@H]2[C@H]2COCC[C@@]2(C)O)cn1	ZINC000330245918	404598969	/nfs/dbraw/zinc/59/89/69/404598969.db2.gz	KXMMOYBZBFUSLY-XOSAIJSUSA-N	0	3	305.422	2.098	10	0		DEAEHN
Cn1ccnc1[C@H](N[C@H]1CC[C@@H](C(=O)N2CCCC2)C1)C1CC1	ZINC000373894670	404629803	/nfs/dbraw/zinc/62/98/03/404629803.db2.gz	XYBNDQZLCLTYHD-OWCLPIDISA-N	0	3	316.449	2.252	10	0		DEAEHN
COCCOC1CCN(Cc2ccc(-c3cc[nH]n3)o2)CC1	ZINC000435125470	404958014	/nfs/dbraw/zinc/95/80/14/404958014.db2.gz	FGXKJBUMFPQSDC-UHFFFAOYSA-N	0	3	305.378	2.297	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@@H]1CCc2cn(C(C)C)nc2C1	ZINC000361456533	405082128	/nfs/dbraw/zinc/08/21/28/405082128.db2.gz	IDPQZKAXCQELFX-NVXWUHKLSA-N	0	3	318.465	2.312	10	0		DEAEHN
C[C@@H]1[C@H](C)N(C)CCN1C(=O)c1[nH]nc2ccc(Cl)cc21	ZINC000408022917	405092327	/nfs/dbraw/zinc/09/23/27/405092327.db2.gz	OYMSZKZIRJLNCZ-VHSXEESVSA-N	0	3	306.797	2.381	10	0		DEAEHN
Cn1nnc2cc(CN3CC[C@@H](C(C)(C)C)[C@H](O)C3)ccc21	ZINC000408198540	405136514	/nfs/dbraw/zinc/13/65/14/405136514.db2.gz	NHMZWAPSHPLXHM-CZUORRHYSA-N	0	3	302.422	2.197	10	0		DEAEHN
CC(C)CC(=O)N1CCC(CN2CCC[C@@](F)(CO)C2)CC1	ZINC000367865510	405177440	/nfs/dbraw/zinc/17/74/40/405177440.db2.gz	PEANIRFXHJACHF-KRWDZBQOSA-N	0	3	314.445	2.068	10	0		DEAEHN
CN1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3cc(F)ccc3F)C[C@@H]21	ZINC000453036290	405277662	/nfs/dbraw/zinc/27/76/62/405277662.db2.gz	NVZBGRJYHRCQSV-FTYZYXLQSA-N	0	3	306.356	2.231	10	0		DEAEHN
CCc1nc(C(C)(C)NC(=O)N[C@@H](C)CN2CCCCC2)no1	ZINC000442367375	405335843	/nfs/dbraw/zinc/33/58/43/405335843.db2.gz	UAFVSLWDXLNGEU-LBPRGKRZSA-N	0	3	323.441	2.041	10	0		DEAEHN
CN(C)C1(CNC(=O)N2CCN(c3ccccc3)CC2)CCC1	ZINC000445857375	405358783	/nfs/dbraw/zinc/35/87/83/405358783.db2.gz	MIXZTQJMZCYGLY-UHFFFAOYSA-N	0	3	316.449	2.003	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2cc(C)cc(C)c2)CC12COC2	ZINC000449365431	405527760	/nfs/dbraw/zinc/52/77/60/405527760.db2.gz	PMTGDJRAKOLOAG-MRXNPFEDSA-N	0	3	303.402	2.315	10	0		DEAEHN
C(N[C@@H]1CCCC[C@H]1[C@H]1CCOC1)c1nnc2n1CCCC2	ZINC000530439935	405803224	/nfs/dbraw/zinc/80/32/24/405803224.db2.gz	RSZFEGZXCXNGAN-SOUVJXGZSA-N	0	3	304.438	2.299	10	0		DEAEHN
COc1nsc(CNC[C@@H]2CC[C@H](O)C2)c1Br	ZINC000639096112	405878771	/nfs/dbraw/zinc/87/87/71/405878771.db2.gz	AOIYTGAAEPEHAB-SFYZADRCSA-N	0	3	321.240	2.165	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000530813701	405863952	/nfs/dbraw/zinc/86/39/52/405863952.db2.gz	AXRXJCONRZYNBS-APWZRJJASA-N	0	3	316.445	2.272	10	0		DEAEHN
O[C@@H](CNCc1cc(-c2ccccc2)cs1)Cn1ccnn1	ZINC000459704903	406011164	/nfs/dbraw/zinc/01/11/64/406011164.db2.gz	TZJAABAJVIBSIR-HNNXBMFYSA-N	0	3	314.414	2.157	10	0		DEAEHN
O=C(N[C@@H]1CCCC(F)(F)C1)N1CC[C@@H](N2CCCC2)C1	ZINC000531772282	406005204	/nfs/dbraw/zinc/00/52/04/406005204.db2.gz	CGFUPXPRTXAFCK-CHWSQXEVSA-N	0	3	301.381	2.444	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCCc1c[nH]c2ncccc12	ZINC000533100711	406121268	/nfs/dbraw/zinc/12/12/68/406121268.db2.gz	OXHLCPIAHGZDCP-OAHLLOKOSA-N	0	3	300.406	2.096	10	0		DEAEHN
COc1ccnc2c(NC(=O)NC[C@H]3CCCN3C)cccc12	ZINC000535770462	406236600	/nfs/dbraw/zinc/23/66/00/406236600.db2.gz	OETFQEYUCAOCKI-GFCCVEGCSA-N	0	3	314.389	2.459	10	0		DEAEHN
Cn1cc(CNCCOCC2CCC2)c(-c2cccnc2)n1	ZINC000569705584	406293077	/nfs/dbraw/zinc/29/30/77/406293077.db2.gz	VCKZAKPBXUDRPG-UHFFFAOYSA-N	0	3	300.406	2.388	10	0		DEAEHN
C[C@@H](N[C@@H]1CCC(=O)N(C)C1)c1cncc(Br)c1	ZINC000569121947	292392245	/nfs/dbraw/zinc/39/22/45/292392245.db2.gz	OLFPHGBGPUSXNG-BXKDBHETSA-N	0	3	312.211	2.116	10	0		DEAEHN
CC(C)C[C@@H]1CCCN1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637920003	406478510	/nfs/dbraw/zinc/47/85/10/406478510.db2.gz	KHGYWRYNEKQVEC-ROUUACIJSA-N	0	3	317.477	2.483	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)c2ccncn2)[C@@H]1c1cccs1	ZINC000548289481	406497561	/nfs/dbraw/zinc/49/75/61/406497561.db2.gz	XNQZOHBKCMECRG-IUODEOHRSA-N	0	3	316.430	2.351	10	0		DEAEHN
C[C@H](NC(=O)NC1(CCO)CCCCC1)C1=CCN(C)CC1	ZINC000571302119	406505339	/nfs/dbraw/zinc/50/53/39/406505339.db2.gz	LEESFHXNCTXUHM-AWEZNQCLSA-N	0	3	309.454	2.021	10	0		DEAEHN
c1ccc(N2CC[C@H](CN3CCO[C@@H]([C@H]4CCCO4)C3)C2)cc1	ZINC000638172367	406605509	/nfs/dbraw/zinc/60/55/09/406605509.db2.gz	ZWIFFFWYBWCQNY-BHIYHBOVSA-N	0	3	316.445	2.393	10	0		DEAEHN
C[C@@H]1CCCCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)C1	ZINC000638313510	406693341	/nfs/dbraw/zinc/69/33/41/406693341.db2.gz	XJGBCSKFEFTSTQ-WBVHZDCISA-N	0	3	303.450	2.094	10	0		DEAEHN
CCCN(CCN1CCCCC1)C(=O)c1cn2cccnc2n1	ZINC000553162505	406739759	/nfs/dbraw/zinc/73/97/59/406739759.db2.gz	YYMSUFVNQNXPDK-UHFFFAOYSA-N	0	3	315.421	2.067	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N1CC[C@@H]2CCCC[C@@H]21	ZINC000638370510	406730842	/nfs/dbraw/zinc/73/08/42/406730842.db2.gz	KVFCIMKACVHDLO-KSZLIROESA-N	0	3	315.461	2.237	10	0		DEAEHN
C[C@@H](CNC(=O)N1CC2(CCOCC2)c2ccccc21)N(C)C	ZINC000459048556	286859666	/nfs/dbraw/zinc/85/96/66/286859666.db2.gz	XUNBQPCLEBBSQQ-AWEZNQCLSA-N	0	3	317.433	2.215	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cccc(C)c1	ZINC000246246139	287231524	/nfs/dbraw/zinc/23/15/24/287231524.db2.gz	SDFIIZGZZWAKPF-CABCVRRESA-N	0	3	308.447	2.242	10	0		DEAEHN
O=C(CC1(N2CCOCC2)CCCC1)NCCc1ccsc1	ZINC000129223339	196030381	/nfs/dbraw/zinc/03/03/81/196030381.db2.gz	YDDVSZPGHOFYNJ-UHFFFAOYSA-N	0	3	322.474	2.442	10	0		DEAEHN
O=C(C1CCN(C[C@H]2CCCO2)CC1)N1CCc2ccccc21	ZINC000129389009	196044405	/nfs/dbraw/zinc/04/44/05/196044405.db2.gz	SMOIILYUIMABAX-QGZVFWFLSA-N	0	3	314.429	2.467	10	0		DEAEHN
CNc1nc(N(C)C)nc(N(Cc2cccs2)C(C)C)n1	ZINC000130654942	196099296	/nfs/dbraw/zinc/09/92/96/196099296.db2.gz	VDNGOTLUPYTWOR-UHFFFAOYSA-N	0	3	306.439	2.456	10	0		DEAEHN
CN[C@H](Cc1cc(C)nn1C)c1ccc(Br)cn1	ZINC000130801278	196110890	/nfs/dbraw/zinc/11/08/90/196110890.db2.gz	KGKQXKKJOZCJMS-CYBMUJFWSA-N	0	3	309.211	2.389	10	0		DEAEHN
C[C@H](CN1C(=O)C2(CC2)N[C@@H]1c1cccs1)N1CCCC1	ZINC000130797686	196111001	/nfs/dbraw/zinc/11/10/01/196111001.db2.gz	NLPYNHQJTCLXPL-OCCSQVGLSA-N	0	3	305.447	2.195	10	0		DEAEHN
CC(C)[C@](C)(C[NH3+])[N-]S(=O)(=O)c1ccc(F)cc1Cl	ZINC000131156928	196144893	/nfs/dbraw/zinc/14/48/93/196144893.db2.gz	TWZKWUUWNVYIAM-LBPRGKRZSA-N	0	3	308.806	2.131	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-]CC[C@H](C)SC)o1	ZINC000131611883	196184289	/nfs/dbraw/zinc/18/42/89/196184289.db2.gz	AXOTXRGXGSSGEO-NSHDSACASA-N	0	3	320.480	2.199	10	0		DEAEHN
CCCN[C@@H](CCCS(=O)(=O)CC)c1ncccc1F	ZINC000131732745	196194894	/nfs/dbraw/zinc/19/48/94/196194894.db2.gz	BFTSPAILCUKDPD-ZDUSSCGKSA-N	0	3	302.415	2.476	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)c1ccncc1F	ZINC000131795941	196200437	/nfs/dbraw/zinc/20/04/37/196200437.db2.gz	OKUCQXOAELBGHQ-AWEZNQCLSA-N	0	3	301.365	2.123	10	0		DEAEHN
Cn1cc(CN)c(NC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)n1	ZINC000131860567	196205020	/nfs/dbraw/zinc/20/50/20/196205020.db2.gz	FPJMBCLSXAJIQE-WCBMZHEXSA-N	0	3	304.316	2.186	10	0		DEAEHN
NC1(C(=O)Nc2ccccc2OC(F)(F)F)CCOCC1	ZINC000132063490	196223210	/nfs/dbraw/zinc/22/32/10/196223210.db2.gz	GLORISYIPDHEAK-UHFFFAOYSA-N	0	3	304.268	2.032	10	0		DEAEHN
CCCn1nc(C)c(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1C	ZINC000132179745	196233207	/nfs/dbraw/zinc/23/32/07/196233207.db2.gz	UJBDBCSHGZNPIC-DOMZBBRYSA-N	0	3	306.454	2.465	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1sc2cccnc2c1N	ZINC000132261323	196239902	/nfs/dbraw/zinc/23/99/02/196239902.db2.gz	IMIVMOKPVOEPHS-JTQLQIEISA-N	0	3	304.419	2.045	10	0		DEAEHN
C[C@H]1CNC[C@@H](COCc2cc(Br)ccc2F)O1	ZINC000132595928	196268952	/nfs/dbraw/zinc/26/89/52/196268952.db2.gz	WKEQBAVYNZEVMU-CABZTGNLSA-N	0	3	318.186	2.482	10	0		DEAEHN
CO[C@@H]1CC[C@@H]2OCCN(CCCCn3ccnc3C)[C@H]2C1	ZINC000132724111	196278183	/nfs/dbraw/zinc/27/81/83/196278183.db2.gz	GMFCJUCUVAVCGH-IKGGRYGDSA-N	0	3	307.438	2.240	10	0		DEAEHN
CC[C@@H](NCCNC(N)=O)c1cccc(Br)c1	ZINC000132745060	196280129	/nfs/dbraw/zinc/28/01/29/196280129.db2.gz	UTASHCMCZXGVGP-LLVKDONJSA-N	0	3	300.200	2.158	10	0		DEAEHN
CCCN[C@@H](Cc1cc(C)ccc1OC)[C@@H](C)S(C)(=O)=O	ZINC000133155598	196317121	/nfs/dbraw/zinc/31/71/21/196317121.db2.gz	XDPRCBMIBMWZLP-HIFRSBDPSA-N	0	3	313.463	2.347	10	0		DEAEHN
COC(=O)C[C@@H](NC(=O)[C@@]1(C)CCCCN1)c1cccs1	ZINC000133171373	196317885	/nfs/dbraw/zinc/31/78/85/196317885.db2.gz	USKMLPUUZOAYNO-IAQYHMDHSA-N	0	3	310.419	2.001	10	0		DEAEHN
COC(=O)C[C@H](NC(=O)[C@@]1(C)CCCCN1)c1cccs1	ZINC000133171025	196318199	/nfs/dbraw/zinc/31/81/99/196318199.db2.gz	USKMLPUUZOAYNO-XHDPSFHLSA-N	0	3	310.419	2.001	10	0		DEAEHN
COc1ccc(C[C@@]2(O)CCCN(C)C2)cc1Br	ZINC000134345749	196380735	/nfs/dbraw/zinc/38/07/35/196380735.db2.gz	SFBFPZFVXLSCED-AWEZNQCLSA-N	0	3	314.223	2.457	10	0		DEAEHN
CN1CCC[C@]2(CC(=O)NC(=O)[C@@H]2c2cccc(Cl)c2)C1	ZINC000134372786	196382454	/nfs/dbraw/zinc/38/24/54/196382454.db2.gz	OYMBNUYXJYCTJX-HOCLYGCPSA-N	0	3	306.793	2.182	10	0		DEAEHN
C[C@@](CN)(NS(=O)(=O)CC1CCCCC1)c1ccccc1	ZINC000134472750	196394497	/nfs/dbraw/zinc/39/44/97/196394497.db2.gz	RPMZTLKLOMYVHP-INIZCTEOSA-N	0	3	310.463	2.360	10	0		DEAEHN
CNC(=O)NC(=O)[C@H](C)N[C@H](C)c1ccc(C(C)(C)C)cc1	ZINC000056194647	424839254	/nfs/dbraw/zinc/83/92/54/424839254.db2.gz	QDUDWKXYAXRQKY-NEPJUHHUSA-N	0	3	305.422	2.479	10	0		DEAEHN
CCCc1cc(NCCN2CCCC[C@H]2C)n2ncnc2n1	ZINC000194269970	424875187	/nfs/dbraw/zinc/87/51/87/424875187.db2.gz	HDSKGJFJBGRNMW-CYBMUJFWSA-N	0	3	302.426	2.363	10	0		DEAEHN
c1ccc2c(c1)oc1c2ncnc1NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000363197130	424854806	/nfs/dbraw/zinc/85/48/06/424854806.db2.gz	HWTZBUIQVFSLFA-CHWSQXEVSA-N	0	3	324.384	2.651	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1)N(C)C	ZINC000154488244	424861655	/nfs/dbraw/zinc/86/16/55/424861655.db2.gz	HJOVRVSQCPHGIA-DJIMGWMZSA-N	0	3	306.450	2.388	10	0		DEAEHN
Cc1nc(C)c(F)c(NCC2(N3CCCCC3)CCOCC2)n1	ZINC000329676697	424905914	/nfs/dbraw/zinc/90/59/14/424905914.db2.gz	PRFDMLRCVPNDSX-UHFFFAOYSA-N	0	3	322.428	2.680	10	0		DEAEHN
CCn1ncnc1CNC[C@H]1CCCCN1Cc1ccccc1	ZINC000379650349	424907517	/nfs/dbraw/zinc/90/75/17/424907517.db2.gz	RNBJHHNAETZXLL-QGZVFWFLSA-N	0	3	313.449	2.442	10	0		DEAEHN
CCc1cc(NC(=O)C(=O)N2CCC[C@H](N(C)C)C2)ccc1C	ZINC000180614509	267602237	/nfs/dbraw/zinc/60/22/37/267602237.db2.gz	GIWILEJWSOMNEI-INIZCTEOSA-N	0	3	317.433	2.049	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cnn(Cc3ccccc3)c2)C1	ZINC000194640477	268553606	/nfs/dbraw/zinc/55/36/06/268553606.db2.gz	HCNLUXLGUZVGKK-KRWDZBQOSA-N	0	3	312.417	2.146	10	0		DEAEHN
Cc1ncc2n1CC[C@H](c1nc(C3(N)CCCCC3)no1)C2	ZINC000333615727	268963020	/nfs/dbraw/zinc/96/30/20/268963020.db2.gz	SQXXJLYQRHNTKS-LBPRGKRZSA-N	0	3	301.394	2.423	10	0		DEAEHN
CC(C)C[C@@H]1C(=O)NCCCN1C(=O)[C@H](C)N1[C@H](C)CC[C@H]1C	ZINC000334130744	269023013	/nfs/dbraw/zinc/02/30/13/269023013.db2.gz	UCLQSIAWSHUKOC-LVQVYYBASA-N	0	3	323.481	2.011	10	0		DEAEHN
CC(C)(C)C(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000397503600	269106726	/nfs/dbraw/zinc/10/67/26/269106726.db2.gz	BHRIKEADPMXARD-UHFFFAOYSA-N	0	3	304.434	2.176	10	0		DEAEHN
CN(C)C1(CNC(=O)c2csc(Br)c2)CC1	ZINC000397779269	269107753	/nfs/dbraw/zinc/10/77/53/269107753.db2.gz	CLLGUNADIPYSQX-UHFFFAOYSA-N	0	3	303.225	2.335	10	0		DEAEHN
CSC1(CNC(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000194915104	274174767	/nfs/dbraw/zinc/17/47/67/274174767.db2.gz	LDWLRAQVOZINKS-OAHLLOKOSA-N	0	3	321.490	2.354	10	0		DEAEHN
C[C@@H](CNC(=O)c1cnn2c1CCCC2)N1CCC[C@H](C)C1	ZINC000126954497	274224241	/nfs/dbraw/zinc/22/42/41/274224241.db2.gz	BSPRMLFNLZEDRM-KBPBESRZSA-N	0	3	304.438	2.070	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@@H]2CCO[C@@H]2C)c2ccc(F)cc2C1	ZINC000248689156	277010279	/nfs/dbraw/zinc/01/02/79/277010279.db2.gz	AEVRSZWYXBKLKU-LQAWEQHXSA-N	0	3	306.381	2.386	10	0		DEAEHN
CC(=O)[C@](C)(O)CN[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1	ZINC000451042817	277101311	/nfs/dbraw/zinc/10/13/11/277101311.db2.gz	DXOUHZZPFNVWGU-BZUAXINKSA-N	0	3	310.825	2.015	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(C(=O)Nc3ccccc3)C2)CC1	ZINC000174369923	277110712	/nfs/dbraw/zinc/11/07/12/277110712.db2.gz	BGWGHGVFLRUPOT-QGZVFWFLSA-N	0	3	316.449	2.320	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc3c2OCCO3)C1	ZINC000247329775	277181858	/nfs/dbraw/zinc/18/18/58/277181858.db2.gz	UTSFBQZFJFVWIV-ZFWWWQNUSA-N	0	3	316.401	2.014	10	0		DEAEHN
COc1cccc2c(N3C[C@@H]4OCCN(C)[C@H]4C3)cc(C)nc12	ZINC000301700993	278025019	/nfs/dbraw/zinc/02/50/19/278025019.db2.gz	FQZVJYRGVPTLFD-RDJZCZTQSA-N	0	3	313.401	2.071	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@H](N[C@@H]2CCOc3ccccc32)C1	ZINC000094635818	278116845	/nfs/dbraw/zinc/11/68/45/278116845.db2.gz	OAQWJVWYPBIUCP-GZBFAFLISA-N	0	3	309.431	2.456	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2)N(C)C	ZINC000119811257	278923021	/nfs/dbraw/zinc/92/30/21/278923021.db2.gz	NSCJWOXPAURUMH-IAQYHMDHSA-N	0	3	303.406	2.089	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)S(=O)(=O)CC1CCCCC1	ZINC000175393578	279327970	/nfs/dbraw/zinc/32/79/70/279327970.db2.gz	WILZATSXFJPSCL-HNNXBMFYSA-N	0	3	302.484	2.313	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCCC[C@@H]1c1cn[nH]c1	ZINC000183069288	279332570	/nfs/dbraw/zinc/33/25/70/279332570.db2.gz	OVMZPZMHYYVUNH-LSDHHAIUSA-N	0	3	305.426	2.131	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)N[C@@H](C2CCCC2)C(F)(F)F)C1	ZINC000127207626	289382974	/nfs/dbraw/zinc/38/29/74/289382974.db2.gz	ZJPKASHOLUVOPG-RYUDHWBXSA-N	0	3	307.360	2.453	10	0		DEAEHN
C[C@H](CN[C@@H](C)c1nc2c(s1)CCCC2)N1CCOCC1	ZINC000093371631	289690503	/nfs/dbraw/zinc/69/05/03/289690503.db2.gz	FIKPEJKMVQNTEO-OLZOCXBDSA-N	0	3	309.479	2.393	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cn(C)nc1C(C)(C)C	ZINC000245551376	297100376	/nfs/dbraw/zinc/10/03/76/297100376.db2.gz	BFKMRVNXJPJNGD-OLZOCXBDSA-N	0	3	304.438	2.026	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@H](C)C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000173256681	302743381	/nfs/dbraw/zinc/74/33/81/302743381.db2.gz	IVHPBQWSNVWDKE-XJKSGUPXSA-N	0	3	322.497	2.308	10	0		DEAEHN
Cn1nccc1[C@H]1[C@H](N[C@H]2CCC23CCC3)CC(=O)N1C1CC1	ZINC000329049829	303097969	/nfs/dbraw/zinc/09/79/69/303097969.db2.gz	WEFNUXJUVMGKAT-UKPHBRMFSA-N	0	3	314.433	2.147	10	0		DEAEHN
CCN(CCNC(=O)N1CC[C@@H](N(C)C)C1)c1ccccc1C	ZINC000170830188	325715511	/nfs/dbraw/zinc/71/55/11/325715511.db2.gz	ZZVOAXFKNJWNOL-MRXNPFEDSA-N	0	3	318.465	2.167	10	0		DEAEHN
Brc1cccc(OCCNCc2cncnc2)c1	ZINC000171132076	325718107	/nfs/dbraw/zinc/71/81/07/325718107.db2.gz	RTIPNBBTIDPULT-UHFFFAOYSA-N	0	3	308.179	2.408	10	0		DEAEHN
C[C@H](CN[C@@H](C)c1ccc(-n2cccn2)cc1)CS(C)(=O)=O	ZINC000180843955	333165390	/nfs/dbraw/zinc/16/53/90/333165390.db2.gz	NQOCZQJEYULOFD-KGLIPLIRSA-N	0	3	321.446	2.204	10	0		DEAEHN
COC[C@@H](C)CN1CCCN(C(=O)c2cccc(C)c2)CC1	ZINC000189640820	333191118	/nfs/dbraw/zinc/19/11/18/333191118.db2.gz	IKVANZUUXHPDEB-INIZCTEOSA-N	0	3	304.434	2.425	10	0		DEAEHN
Cc1noc(CCN[C@@H](C)c2ccc(Br)cn2)n1	ZINC000582898090	337212450	/nfs/dbraw/zinc/21/24/50/337212450.db2.gz	ZHRJQCRBBREGPS-QMMMGPOBSA-N	0	3	311.183	2.429	10	0		DEAEHN
CN1C[C@H](O)C[C@@H](C(O)(c2cccs2)c2cccs2)C1	ZINC000584631764	337377084	/nfs/dbraw/zinc/37/70/84/337377084.db2.gz	UAQNWQBJYFDZLR-VXGBXAGGSA-N	0	3	309.456	2.358	10	0		DEAEHN
O=C(NCCNc1ccncc1)C1(Cc2ccccc2F)CC1	ZINC000442620184	534344181	/nfs/dbraw/zinc/34/41/81/534344181.db2.gz	LFBAKLSIMWEVJH-UHFFFAOYSA-N	0	3	313.376	2.194	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)CSCc2ccncc2)C1	ZINC000158885871	519691058	/nfs/dbraw/zinc/69/10/58/519691058.db2.gz	DYFWKYDBSNUBCQ-HIFRSBDPSA-N	0	3	307.463	2.160	10	0		DEAEHN
CCOCCN1CCN(CCC(=O)Nc2ccccc2)C[C@@H]1C	ZINC000105903008	519919768	/nfs/dbraw/zinc/91/97/68/519919768.db2.gz	GSGRYRBLDBONEJ-INIZCTEOSA-N	0	3	319.449	2.058	10	0		DEAEHN
CCCCN(CCCC)C(=O)CN1C[C@@H](C(N)=O)CC[C@@H]1C	ZINC000103286320	520489535	/nfs/dbraw/zinc/48/95/35/520489535.db2.gz	WFWHHNDZRZAACY-GJZGRUSLSA-N	0	3	311.470	2.001	10	0		DEAEHN
CCN1CC[C@H]2OCCN(CCc3ccc(F)c(F)c3)[C@@H]2C1	ZINC000339385521	521722860	/nfs/dbraw/zinc/72/28/60/521722860.db2.gz	QLCLKJMTTJHKAC-IAGOWNOFSA-N	0	3	310.388	2.302	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NCCc1cccnc1)c1ccccc1	ZINC000119962919	521859474	/nfs/dbraw/zinc/85/94/74/521859474.db2.gz	PSTGTIFSKJYHQT-KRWDZBQOSA-N	0	3	312.417	2.226	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N2CC[C@@H](c3cnn(C)c3)C2)c1	ZINC000156560131	521911922	/nfs/dbraw/zinc/91/19/22/521911922.db2.gz	BQMOIQUSVGYPFW-MRXNPFEDSA-N	0	3	312.417	2.111	10	0		DEAEHN
COc1cc(C)ccc1CNC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000155830566	522259182	/nfs/dbraw/zinc/25/91/82/522259182.db2.gz	DCYCGTXAFDBMJA-INIZCTEOSA-N	0	3	315.417	2.159	10	0		DEAEHN
COCCC1(CNC(=O)N[C@H](CN(C)C)c2ccccc2)CC1	ZINC000131908186	523047213	/nfs/dbraw/zinc/04/72/13/523047213.db2.gz	QWMGOZKTNOKFCY-MRXNPFEDSA-N	0	3	319.449	2.405	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(C)Cc1cccc(F)c1	ZINC000111865404	523832100	/nfs/dbraw/zinc/83/21/00/523832100.db2.gz	OLCFRFYHJAQELA-INIZCTEOSA-N	0	3	323.412	2.078	10	0		DEAEHN
C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1ncncc1Cl	ZINC000247238223	524633036	/nfs/dbraw/zinc/63/30/36/524633036.db2.gz	ZTYYCLGWUXUVBU-UTUOFQBUSA-N	0	3	310.829	2.226	10	0		DEAEHN
Cc1nnc(CCCN2CC[C@H](n3cnc4c3CCCC4)C2)o1	ZINC000299741914	534865956	/nfs/dbraw/zinc/86/59/56/534865956.db2.gz	HSXKKPJJKYYMMC-AWEZNQCLSA-N	0	3	315.421	2.333	10	0		DEAEHN
Cc1ccc([C@H](C)CNC(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000162208907	525878305	/nfs/dbraw/zinc/87/83/05/525878305.db2.gz	PUEFPJCYNURSSO-NVXWUHKLSA-N	0	3	319.449	2.071	10	0		DEAEHN
CC(C)(C)c1nnsc1C(=O)NC[C@@H]1CCN(C2CC2)C1	ZINC000191952716	526898715	/nfs/dbraw/zinc/89/87/15/526898715.db2.gz	RURCFKDGKACSDM-JTQLQIEISA-N	0	3	308.451	2.050	10	0		DEAEHN
CCCCOC[C@H](O)CN(CC)C[C@@H]1COc2ccccc2O1	ZINC000195095073	528621109	/nfs/dbraw/zinc/62/11/09/528621109.db2.gz	AIENHRJEQPEMLI-HZPDHXFCSA-N	0	3	323.433	2.326	10	0		DEAEHN
CC(C)(C)n1cc(C(=O)N2CCCC[C@@H](N3CCCC3)C2)nn1	ZINC000191463773	534944955	/nfs/dbraw/zinc/94/49/55/534944955.db2.gz	IVYDMRSAFCLSLQ-CQSZACIVSA-N	0	3	319.453	2.124	10	0		DEAEHN
CC(C)N(Cc1cccc(Br)c1)C[C@@H](O)CO	ZINC000359671550	535095858	/nfs/dbraw/zinc/09/58/58/535095858.db2.gz	SCYWTOYJHLAWKU-CYBMUJFWSA-N	0	3	302.212	2.013	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@@H](C)N1CCC[C@H]1Cn1ccnc1C	ZINC000247223737	535645206	/nfs/dbraw/zinc/64/52/06/535645206.db2.gz	YTUHVZFATBMZEQ-LZWOXQAQSA-N	0	3	306.454	2.349	10	0		DEAEHN
CCN1CCN(CCC(=O)NCc2ccc(C3CC3)cc2)CC1	ZINC000191321918	535681315	/nfs/dbraw/zinc/68/13/15/535681315.db2.gz	NAZLNSLSTJGNMM-UHFFFAOYSA-N	0	3	315.461	2.208	10	0		DEAEHN
CCNC(=O)CCN1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)OC(C)(C)C	ZINC000249397994	535789638	/nfs/dbraw/zinc/78/96/38/535789638.db2.gz	BMIFDURBCUCIFD-ZNMIVQPWSA-N	0	3	324.465	2.487	10	0		DEAEHN
CN(C)Cc1ccc(-c2noc([C@H]3CC(F)(F)CN3)n2)cc1	ZINC000261897854	535994196	/nfs/dbraw/zinc/99/41/96/535994196.db2.gz	YHONQGJWKIIAMG-GFCCVEGCSA-N	0	3	308.332	2.468	10	0		DEAEHN
COc1cc(CN2CCNC[C@@H]2c2cccnc2)cc(OC)c1	ZINC000261783674	536761517	/nfs/dbraw/zinc/76/15/17/536761517.db2.gz	UFPXSVRCRZCSFR-GOSISDBHSA-N	0	3	313.401	2.245	10	0		DEAEHN
COc1ccc2c(c1NC(=O)N1CCN3CCC[C@@H]3C1)CCC2	ZINC000191333168	537022989	/nfs/dbraw/zinc/02/29/89/537022989.db2.gz	FBTDHFXQRLFXAT-CQSZACIVSA-N	0	3	315.417	2.496	10	0		DEAEHN
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@]2(C1)NCCc1nc[nH]c12	ZINC000724109155	563496595	/nfs/dbraw/zinc/49/65/95/563496595.db2.gz	FNAOGCHUOUCNIP-BZNIZROVSA-N	0	3	306.410	2.076	10	0		DEAEHN
COc1cc([C@H]2[C@H](N)CCN2C(=O)OC(C)(C)C)ccc1O	ZINC000536952609	563889773	/nfs/dbraw/zinc/88/97/73/563889773.db2.gz	DLNXXEBQTYULFU-RISCZKNCSA-N	0	3	308.378	2.410	10	0		DEAEHN
CCC[C@@H]1CC(=O)N(CN2CCC[C@@H]2Cn2ccnc2C)C1	ZINC000176083403	624622096	/nfs/dbraw/zinc/62/20/96/624622096.db2.gz	IBYGZNRGQYFWGE-HZPDHXFCSA-N	0	3	304.438	2.262	10	0		DEAEHN
CC(C)c1ccoc1-c1noc(CN2CCCC[C@H](N)C2=O)n1	ZINC000888078433	625058938	/nfs/dbraw/zinc/05/89/38/625058938.db2.gz	QQYSUGZWMBGUSH-LBPRGKRZSA-N	0	3	318.377	2.293	10	0		DEAEHN
CN(Cc1ccsc1)C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000228894763	636839210	/nfs/dbraw/zinc/83/92/10/636839210.db2.gz	ZSIHJDINZZTBLY-DVOMOZLQSA-N	0	3	308.447	2.239	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCC[C@](C)(O)c2ccccc2)C1	ZINC000187067992	636932252	/nfs/dbraw/zinc/93/22/52/636932252.db2.gz	HROFMMXHAASSPC-WMZOPIPTSA-N	0	3	319.449	2.068	10	0		DEAEHN
Cc1nonc1C(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1	ZINC000741606486	637997123	/nfs/dbraw/zinc/99/71/23/637997123.db2.gz	QFUCXPOOSLOFHC-BXUZGUMPSA-N	0	3	320.418	2.252	10	0		DEAEHN
CC(=O)N(C)C1CCN(C[C@@H](O)c2ccc(F)cc2C)CC1	ZINC000746662975	638366389	/nfs/dbraw/zinc/36/63/89/638366389.db2.gz	JKDBFECBKDKUKP-QGZVFWFLSA-N	0	3	308.397	2.110	10	0		DEAEHN
C[C@H]1CN(C[C@H](O)Cc2ccccc2C(F)(F)F)CCN1C	ZINC000751572817	639439394	/nfs/dbraw/zinc/43/93/94/639439394.db2.gz	CKSSGMAJVQOFHP-GXTWGEPZSA-N	0	3	316.367	2.245	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H](C)CC(=O)OCc1ccccc1)N(C)C	ZINC000121528105	650907112	/nfs/dbraw/zinc/90/71/12/650907112.db2.gz	GTKCIPUAUAQYRH-GOEBONIOSA-N	0	3	320.433	2.355	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NS(=O)(=O)/C=C/c2ccccc2)C1	ZINC000173886367	646782253	/nfs/dbraw/zinc/78/22/53/646782253.db2.gz	RLXDRJFAKYKGCQ-MVHLYKQMSA-N	0	3	308.447	2.305	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)c2cc(Cl)nc(N(C)C)c2)C1	ZINC000733130884	647889653	/nfs/dbraw/zinc/88/96/53/647889653.db2.gz	UCCQRRIQDCSXDA-GFCCVEGCSA-N	0	3	324.856	2.263	10	0		DEAEHN
CCNC(=O)NC(=O)CN[C@H](C)c1ccc(C(C)(C)C)cc1	ZINC000154374432	647993817	/nfs/dbraw/zinc/99/38/17/647993817.db2.gz	ULAVFYBDQGPDBT-GFCCVEGCSA-N	0	3	305.422	2.480	10	0		DEAEHN
CC#CCCCCOC(=O)C1CC[C@H](C(F)(F)F)NC1=O	ZINC000183956628	649209378	/nfs/dbraw/zinc/20/93/78/649209378.db2.gz	LKTCMSMPDHBGNJ-GHMZBOCLSA-N	0	3	305.296	2.180	10	0		DEAEHN
CCC[C@@H](N)c1cn(Cc2ncccc2Br)nn1	ZINC000394073987	685455351	/nfs/dbraw/zinc/45/53/51/685455351.db2.gz	WXBFJTUSEMNWQQ-SNVBAGLBSA-N	0	3	310.199	2.284	10	0		DEAEHN
O=C(NCCN1CCCCC1)N[C@H]1CCO[C@@H]1c1ccccc1	ZINC000083018761	683996121	/nfs/dbraw/zinc/99/61/21/683996121.db2.gz	OPSPMPPIGYUQDL-DLBZAZTESA-N	0	3	317.433	2.302	10	0		DEAEHN
Fc1ccc(SCc2noc(C[C@H]3CNCCO3)n2)cc1	ZINC000091295216	684036134	/nfs/dbraw/zinc/03/61/34/684036134.db2.gz	JEKPFMOEHSYOHI-NSHDSACASA-N	0	3	309.366	2.032	10	0		DEAEHN
CCOC(CN1CCC(C(=O)N[C@H](C)C(C)C)CC1)OCC	ZINC000124030159	684131167	/nfs/dbraw/zinc/13/11/67/684131167.db2.gz	RWNOWOVYBBIXNM-CQSZACIVSA-N	0	3	314.470	2.258	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@@H](C)N2CCc3ccccc32)C1	ZINC000195089849	685086521	/nfs/dbraw/zinc/08/65/21/685086521.db2.gz	ZALLULBHQJNPJD-GDBMZVCRSA-N	0	3	301.434	2.038	10	0		DEAEHN
CC(C)CN(CCN(C)C)C(=O)N[C@@H]1COc2ccccc21	ZINC000195198321	685090677	/nfs/dbraw/zinc/09/06/77/685090677.db2.gz	ZEONFPKQASLLIR-OAHLLOKOSA-N	0	3	305.422	2.349	10	0		DEAEHN
Cc1noc([C@@H]2CC[C@H](CNCc3cn(C(C)C)nc3C)O2)n1	ZINC000281390918	685217135	/nfs/dbraw/zinc/21/71/35/685217135.db2.gz	PAJINTJPCOCISP-CABCVRRESA-N	0	3	319.409	2.474	10	0		DEAEHN
C[C@](O)(CN1CC[C@@]2(CCOC2)C1)C(F)(F)C(F)(F)F	ZINC000724109854	777242699	/nfs/dbraw/zinc/24/26/99/777242699.db2.gz	PQPRKSLQWITOLJ-VHSXEESVSA-N	0	3	303.271	2.047	10	0		DEAEHN
CC(C)(C)OC(=O)N1C[C@@H](NCc2cncnc2)C(C)(C)C1	ZINC000721845498	780287019	/nfs/dbraw/zinc/28/70/19/780287019.db2.gz	GHIDPHQLNIVQBI-CYBMUJFWSA-N	0	3	306.410	2.212	10	0		DEAEHN
Cc1cnn(C)c1CN[C@@H]1CN(C(=O)OC(C)(C)C)CC1(C)C	ZINC000721856975	780391551	/nfs/dbraw/zinc/39/15/51/780391551.db2.gz	XASQAOBDFNFIIE-CQSZACIVSA-N	0	3	322.453	2.464	10	0		DEAEHN
CO[C@]1(CN[C@@H](C)c2cccc(Cl)c2)CCS(=O)(=O)C1	ZINC000721261835	781074550	/nfs/dbraw/zinc/07/45/50/781074550.db2.gz	SIDDKWWAUAJCFG-FZMZJTMJSA-N	0	3	317.838	2.194	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCn2c(C(C)C)nnc2[C@@H]1C	ZINC000439781425	781809138	/nfs/dbraw/zinc/80/91/38/781809138.db2.gz	MEWPNUKONKBJAR-UONOGXRCSA-N	0	3	319.453	2.179	10	0		DEAEHN
CN(CCOCC1CC1)C[C@](C)(O)C(F)(F)C(F)(F)F	ZINC000724112639	787350054	/nfs/dbraw/zinc/35/00/54/787350054.db2.gz	VQOOQFWNCYHWTO-JTQLQIEISA-N	0	3	305.287	2.293	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CCNCCC2(C)C)c(Cl)c1	ZINC000712513348	792191724	/nfs/dbraw/zinc/19/17/24/792191724.db2.gz	IWDKZCFFAOGBOY-UHFFFAOYSA-N	0	3	316.854	2.411	10	0		DEAEHN
Cc1ccc(Cl)cc1S(=O)(=O)N1CCNCCC1(C)C	ZINC000712516467	792192536	/nfs/dbraw/zinc/19/25/36/792192536.db2.gz	YXAGJSRPCNUCOZ-UHFFFAOYSA-N	0	3	316.854	2.411	10	0		DEAEHN
[NH3+]C1CC(C[N-]S(=O)(=O)c2c(Cl)cccc2Cl)C1	ZINC000715110574	792382864	/nfs/dbraw/zinc/38/28/64/792382864.db2.gz	RRODFVBRIFARQA-UHFFFAOYSA-N	0	3	309.218	2.009	10	0		DEAEHN
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C)c1cn(C)nn1	ZINC000715841127	792513443	/nfs/dbraw/zinc/51/34/43/792513443.db2.gz	ZDNYACMKGLTBBU-FRRDWIJNSA-N	0	3	323.441	2.111	10	0		DEAEHN
O[C@]1(CCNCc2cscc2Br)CCOC1	ZINC000404219484	802009634	/nfs/dbraw/zinc/00/96/34/802009634.db2.gz	RHUPUPZLDPFWSI-LLVKDONJSA-N	0	3	306.225	2.142	10	0		DEAEHN
NC(=O)C1(NCc2cc(Br)cs2)CCCC1	ZINC000081100104	1081042100	/nfs/dbraw/zinc/04/21/00/1081042100.db2.gz	ONAYAKLQOUTABN-UHFFFAOYSA-N	0	3	303.225	2.398	10	0		DEAEHN
CC[C@H]1C[C@@H](NCc2cn(C)nc2Br)CCO1	ZINC000720644801	1085809294	/nfs/dbraw/zinc/80/92/94/1085809294.db2.gz	GJQCRVRUQBPIJT-QWRGUYRKSA-N	0	3	302.216	2.230	10	0		DEAEHN
CN1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc(Br)c[nH]1	ZINC000720816620	1086168059	/nfs/dbraw/zinc/16/80/59/1086168059.db2.gz	OPWKYQCOMZFUGS-VXGBXAGGSA-N	0	3	312.211	2.086	10	0		DEAEHN
CN1CCC[C@@H]2[C@H]1CCN2C(=O)c1ccc(Br)nc1	ZINC000720831668	1086195141	/nfs/dbraw/zinc/19/51/41/1086195141.db2.gz	WMBJZICQTOLZGB-VXGBXAGGSA-N	0	3	324.222	2.153	10	0		DEAEHN
CC1(C)CNCCN1C(=O)/C=C\c1ccc(Br)o1	ZINC000700608475	1086321861	/nfs/dbraw/zinc/32/18/61/1086321861.db2.gz	IGHGGBQYKSFTNE-XQRVVYSFSA-N	0	3	313.195	2.266	10	0		DEAEHN
C[C@@H](CNC(=O)[C@H](N)CN(C)Cc1ccccc1)C(C)(C)C	ZINC000702358476	1086422967	/nfs/dbraw/zinc/42/29/67/1086422967.db2.gz	SALLJVAOXSRNPB-GOEBONIOSA-N	0	3	305.466	2.244	10	0		DEAEHN
COC1(OC)CC[C@H]1NC[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000710906660	1086690793	/nfs/dbraw/zinc/69/07/93/1086690793.db2.gz	PQRJQHOGMKGKIB-QWHCGFSZSA-N	0	3	314.426	2.127	10	0		DEAEHN
Cn1nccc1CN[C@]12CCC[C@@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000711638407	1087179113	/nfs/dbraw/zinc/17/91/13/1087179113.db2.gz	GCCWELJBAYPNNS-YOEHRIQHSA-N	0	3	320.437	2.442	10	0		DEAEHN
Cc1nc(CN[C@H]2CCN(C)[C@H]2C)sc1Br	ZINC000719602898	1089325012	/nfs/dbraw/zinc/32/50/12/1089325012.db2.gz	QFTYSZQTZZOKSN-IUCAKERBSA-N	0	3	304.257	2.396	10	0		DEAEHN
c1cc2cc(-c3nc([C@@H]4CN5CCC4CC5)no3)cnc2cn1	ZINC000350081273	1143031714	/nfs/dbraw/zinc/03/17/14/1143031714.db2.gz	YZZHHXBSCRLDKQ-CQSZACIVSA-N	0	3	307.357	2.489	10	0		DEAEHN
CCc1ccc([C@H](N)[C@@H](C)SCCS(C)(=O)=O)cc1	ZINC000081768190	192322090	/nfs/dbraw/zinc/32/20/90/192322090.db2.gz	ITQJMAVIFYQECK-BXUZGUMPSA-N	0	3	301.477	2.415	10	0		DEAEHN
CN[C@@H]1c2ccc(OC)cc2CC[C@@H]1Sc1nncn1C	ZINC000081867076	192333061	/nfs/dbraw/zinc/33/30/61/192333061.db2.gz	LGPYSURRWQUSSQ-UONOGXRCSA-N	0	3	304.419	2.191	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)CCc2ccccc2Cl)CCO1	ZINC000116794774	282123057	/nfs/dbraw/zinc/12/30/57/282123057.db2.gz	GBNSZRXBYJSMSO-CQSZACIVSA-N	0	3	310.825	2.062	10	0		DEAEHN
CC(C)(C)[C@@H]1CCN(S(=O)(=O)c2ccc(CN)cc2F)C1	ZINC000163500385	197634216	/nfs/dbraw/zinc/63/42/16/197634216.db2.gz	UAMRTPNJARCXJS-GFCCVEGCSA-N	0	3	314.426	2.341	10	0		DEAEHN
CN[C@@H]1CCC[C@H]1S(=O)(=O)c1ccccc1Br	ZINC000081931557	192341001	/nfs/dbraw/zinc/34/10/01/192341001.db2.gz	FDYRBQVYDURPOR-ZYHUDNBSSA-N	0	3	318.236	2.363	10	0		DEAEHN
COC(=O)[C@@](C)(NCCN(C)C)c1ccc(F)cc1Cl	ZINC000078901533	185126309	/nfs/dbraw/zinc/12/63/09/185126309.db2.gz	KVVUOKAFRBWZPT-AWEZNQCLSA-N	0	3	302.777	2.019	10	0		DEAEHN
CCC[C@H](CS(=O)(=O)c1ccc2c(c1)OCCO2)NCC	ZINC000081935418	192343435	/nfs/dbraw/zinc/34/34/35/192343435.db2.gz	XZLAZMLXCULLDT-GFCCVEGCSA-N	0	3	313.419	2.010	10	0		DEAEHN
CCN[C@H]1CCOC[C@@H]1S(=O)(=O)c1ccc(F)c(Cl)c1	ZINC000081946433	192345276	/nfs/dbraw/zinc/34/52/76/192345276.db2.gz	YIJANIVFGXWEOL-STQMWFEESA-N	0	3	321.801	2.020	10	0		DEAEHN
CC[C@H]1CCCN(S(=O)(=O)c2ccc(F)c(CN)c2)CC1	ZINC000079308582	185164220	/nfs/dbraw/zinc/16/42/20/185164220.db2.gz	JSLJBMARROGGLY-LBPRGKRZSA-N	0	3	314.426	2.485	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@H](C)Oc1cccc(CO)c1	ZINC000152912008	282157387	/nfs/dbraw/zinc/15/73/87/282157387.db2.gz	JRIGINWMMVBJQW-HOCLYGCPSA-N	0	3	322.449	2.039	10	0		DEAEHN
CN[C@H](c1ccc(Br)s1)[C@@H]1CCS(=O)(=O)C1	ZINC000082998702	185210800	/nfs/dbraw/zinc/21/08/00/185210800.db2.gz	UUDBVQDGSACLHK-XCBNKYQSSA-N	0	3	324.265	2.206	10	0		DEAEHN
COC(=O)CCCN1CC[C@@H](c2cc(OC)cc(OC)c2)C1	ZINC000083402867	185222222	/nfs/dbraw/zinc/22/22/22/185222222.db2.gz	AEZPVVBQFXTHAV-CYBMUJFWSA-N	0	3	307.390	2.446	10	0		DEAEHN
CC(C)[C@@H](C[NH3+])[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000087404836	185223980	/nfs/dbraw/zinc/22/39/80/185223980.db2.gz	YXMRXYTWTNXHHU-SECBINFHSA-N	0	3	311.234	2.255	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@H](C)C1CCCCC1	ZINC000173176520	282188363	/nfs/dbraw/zinc/18/83/63/282188363.db2.gz	PFIOVPABRRQVOW-GDBMZVCRSA-N	0	3	311.470	2.365	10	0		DEAEHN
COc1ccc([C@@H](CN)NC[C@@H]2CCCO2)c(Cl)c1OC	ZINC000087928373	185237677	/nfs/dbraw/zinc/23/76/77/185237677.db2.gz	KLWSVUSCUNMGSP-CMPLNLGQSA-N	0	3	314.813	2.126	10	0		DEAEHN
CC(C)(N)CS(=O)(=O)Cc1ccccc1Br	ZINC000088072230	185238818	/nfs/dbraw/zinc/23/88/18/185238818.db2.gz	WVHTXIIJQMJQEL-UHFFFAOYSA-N	0	3	306.225	2.101	10	0		DEAEHN
CC[C@H](N)CS(=O)(=O)Cc1cccc(Br)c1	ZINC000088075037	185238955	/nfs/dbraw/zinc/23/89/55/185238955.db2.gz	PKKGKTUSNKDIJZ-NSHDSACASA-N	0	3	306.225	2.101	10	0		DEAEHN
COc1ccc(CS(=O)(=O)c2ccc(C)cc2)cc1CN	ZINC000087833043	185232785	/nfs/dbraw/zinc/23/27/85/185232785.db2.gz	BTPDKPJPEALGSH-UHFFFAOYSA-N	0	3	305.399	2.436	10	0		DEAEHN
COc1ccc(CS(=O)(=O)c2ccccc2F)cc1CN	ZINC000087833045	185232836	/nfs/dbraw/zinc/23/28/36/185232836.db2.gz	HMUPNRJLMYDBRZ-UHFFFAOYSA-N	0	3	309.362	2.267	10	0		DEAEHN
CN[C@@H]1CCCN(c2c(F)cc(Br)cc2F)C1=O	ZINC000088172872	185240811	/nfs/dbraw/zinc/24/08/11/185240811.db2.gz	UWHBYFGQBFYGEM-SNVBAGLBSA-N	0	3	319.149	2.442	10	0		DEAEHN
O=S(=O)(Nc1c(Cl)cccc1Cl)[C@H]1CCCNC1	ZINC000088171778	185240908	/nfs/dbraw/zinc/24/09/08/185240908.db2.gz	ZQPUKCDPMRPNFI-QMMMGPOBSA-N	0	3	309.218	2.487	10	0		DEAEHN
Nc1ccc(=O)n(CCCN2CCC[C@@H](C(F)(F)F)C2)c1	ZINC000088416976	185249247	/nfs/dbraw/zinc/24/92/47/185249247.db2.gz	SLPPBJHHJDRIOD-LLVKDONJSA-N	0	3	303.328	2.095	10	0		DEAEHN
CCCNCc1ccc(S(=O)(=O)N(C)C[C@@H](C)CC)o1	ZINC000088543734	185256840	/nfs/dbraw/zinc/25/68/40/185256840.db2.gz	AYNXTKZOAKRIGP-LBPRGKRZSA-N	0	3	302.440	2.446	10	0		DEAEHN
CC[C@@H]1CCC[C@H]([NH2+]Cc2ccc(S(=O)(=O)[N-]C)o2)C1	ZINC000088540921	185255777	/nfs/dbraw/zinc/25/57/77/185255777.db2.gz	PCAUOBYMZWBHIR-NEPJUHHUSA-N	0	3	300.424	2.246	10	0		DEAEHN
CCCC[C@H](CC)C[NH2+]Cc1ccc(S(=O)(=O)[N-]C)o1	ZINC000088539922	185255903	/nfs/dbraw/zinc/25/59/03/185255903.db2.gz	VNLQJXVGZMQZAK-LBPRGKRZSA-N	0	3	302.440	2.494	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N[C@@H]2CCCC[C@H]2C)o1	ZINC000088542084	185256217	/nfs/dbraw/zinc/25/62/17/185256217.db2.gz	HTKTWBBMLBGTTA-DGCLKSJQSA-N	0	3	300.424	2.246	10	0		DEAEHN
CCN[C@@H](C)CS(=O)(=O)c1cccc(Br)c1	ZINC000081982730	192348946	/nfs/dbraw/zinc/34/89/46/192348946.db2.gz	SDZQMYNHBBNJAP-VIFPVBQESA-N	0	3	306.225	2.221	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N[C@H](C)C(CC)CC)o1	ZINC000088551036	185257653	/nfs/dbraw/zinc/25/76/53/185257653.db2.gz	DNFHXTIMYZALBX-LLVKDONJSA-N	0	3	302.440	2.492	10	0		DEAEHN
CN[C@@H]1c2ccccc2CCC[C@@H]1S(=O)(=O)CCCOC	ZINC000081985269	192349440	/nfs/dbraw/zinc/34/94/40/192349440.db2.gz	APWQVULISPAEGD-JKSUJKDBSA-N	0	3	311.447	2.103	10	0		DEAEHN
CCN[C@H]1c2ccccc2CC[C@H]1S(=O)(=O)CCCOC	ZINC000081986168	192349579	/nfs/dbraw/zinc/34/95/79/192349579.db2.gz	YRUUUTKNXHGDNM-CVEARBPZSA-N	0	3	311.447	2.103	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@H]1S(=O)(=O)Cc1ccccc1C	ZINC000081984809	192350013	/nfs/dbraw/zinc/35/00/13/192350013.db2.gz	ADBNXIQZGXONDS-HZPDHXFCSA-N	0	3	311.447	2.067	10	0		DEAEHN
CCC[C@H](C(=O)NCCOc1ccc(F)cc1F)N(C)C	ZINC000179232289	282219577	/nfs/dbraw/zinc/21/95/77/282219577.db2.gz	RTLZWLWRXTYXEN-CYBMUJFWSA-N	0	3	300.349	2.190	10	0		DEAEHN
CCC[C@H](C(=O)N1CCN(Cc2ccccc2C)CC1)N(C)C	ZINC000179238854	282220173	/nfs/dbraw/zinc/22/01/73/282220173.db2.gz	RAEOSDHBHRJAJI-GOSISDBHSA-N	0	3	317.477	2.370	10	0		DEAEHN
Cc1cc2ncc([C@H](C)NCC[C@H](C)[S@](C)=O)c(C)n2n1	ZINC000090517981	185299853	/nfs/dbraw/zinc/29/98/53/185299853.db2.gz	WZYQOMYFHDIPOA-QSRBQVKKSA-N	0	3	308.451	2.154	10	0		DEAEHN
N[C@H]1COC[C@H]1C(=O)Nc1ccc(C(F)(F)F)cc1Cl	ZINC000090380498	185293487	/nfs/dbraw/zinc/29/34/87/185293487.db2.gz	CMVABRZEWQCGQO-APPZFPTMSA-N	0	3	308.687	2.271	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1cc(C(F)(F)F)ccc1F	ZINC000090437620	185296207	/nfs/dbraw/zinc/29/62/07/185296207.db2.gz	QDLQYSWVAPQGDF-KCJUWKMLSA-N	0	3	306.259	2.017	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)[C@H]1COC[C@H]1NC	ZINC000090434241	185296384	/nfs/dbraw/zinc/29/63/84/185296384.db2.gz	OXBPVDPUTAQCON-WCQYABFASA-N	0	3	312.797	2.302	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1ccc(OC(F)F)c(Cl)c1	ZINC000090436573	185296427	/nfs/dbraw/zinc/29/64/27/185296427.db2.gz	SPRCFJLCMGKOEU-PSASIEDQSA-N	0	3	320.723	2.114	10	0		DEAEHN
CN(Cc1cccc(Cl)c1Cl)C(=O)[C@]1(C)COC[C@@H]1N	ZINC000090590397	185305637	/nfs/dbraw/zinc/30/56/37/185305637.db2.gz	PZBWAJLGHVLQKU-SMDDNHRTSA-N	0	3	317.216	2.316	10	0		DEAEHN
CC(C)N(Cc1cccc(Cl)c1)C(=O)[C@]1(C)COC[C@@H]1N	ZINC000090592326	185305826	/nfs/dbraw/zinc/30/58/26/185305826.db2.gz	DOIFDGDWDUDZHP-GOEBONIOSA-N	0	3	310.825	2.441	10	0		DEAEHN
C[C@]1(C(=O)NCCc2ccc(Cl)cc2Cl)COC[C@@H]1N	ZINC000090581426	185304887	/nfs/dbraw/zinc/30/48/87/185304887.db2.gz	NWVKHHIVDMNWJV-JSGCOSHPSA-N	0	3	317.216	2.016	10	0		DEAEHN
c1ccc2c(c1)CO[C@@]21CCN(CCOC2CCOCC2)C1	ZINC000625327271	365731891	/nfs/dbraw/zinc/73/18/91/365731891.db2.gz	BQTKTKHKDWNQHT-GOSISDBHSA-N	0	3	303.402	2.313	10	0		DEAEHN
CCc1nn(C)c(CC(=O)[C@H](N)[C@H](C)CC)c1Br	ZINC000167283595	197706234	/nfs/dbraw/zinc/70/62/34/197706234.db2.gz	DVVCHWODPKAGRI-AMIZOPFISA-N	0	3	316.243	2.230	10	0		DEAEHN
O=C(C1CCN(Cc2cnc[nH]2)CC1)N1CCc2ccccc21	ZINC000092533709	185324642	/nfs/dbraw/zinc/32/46/42/185324642.db2.gz	SUIOWYSOJXIPTC-UHFFFAOYSA-N	0	3	310.401	2.211	10	0		DEAEHN
Cc1nn(-c2ccccc2)c2nc(N3CCNCC3)cc(C)c12	ZINC000011567792	282242936	/nfs/dbraw/zinc/24/29/36/282242936.db2.gz	JXJJBZWBCSLJQW-UHFFFAOYSA-N	0	3	307.401	2.447	10	0		DEAEHN
CN(C)CCN1CCN(C[C@H]2CSc3ccccc32)CC1	ZINC000092663045	185332698	/nfs/dbraw/zinc/33/26/98/185332698.db2.gz	XGOFIAUBTHPPFT-HNNXBMFYSA-N	0	3	305.491	2.055	10	0		DEAEHN
CCc1ccc(NC(=O)NCCN(CC)CCO)cc1CC	ZINC000185473999	282263112	/nfs/dbraw/zinc/26/31/12/282263112.db2.gz	ULHZZRGGARRWSA-UHFFFAOYSA-N	0	3	307.438	2.247	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2ccc(CO)c(F)c2)C12CCOCC2	ZINC000186271128	282271202	/nfs/dbraw/zinc/27/12/02/282271202.db2.gz	RLBWPRKMADAWOD-IAGOWNOFSA-N	0	3	323.408	2.382	10	0		DEAEHN
COCCc1nc(C)c([C@@H](C)NCCn2cc(C)cn2)s1	ZINC000181437010	199296448	/nfs/dbraw/zinc/29/64/48/199296448.db2.gz	WKNBIYNACKQYSF-GFCCVEGCSA-N	0	3	308.451	2.496	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)NC1CCN(C2CC2)CC1	ZINC000079529083	539372404	/nfs/dbraw/zinc/37/24/04/539372404.db2.gz	ALJDPKMYDAWISC-UHFFFAOYSA-N	0	3	303.406	2.225	10	0		DEAEHN
CCN1CCN(CCCCNC(=O)NCCC2CCCC2)CC1	ZINC000193764888	282356181	/nfs/dbraw/zinc/35/61/81/282356181.db2.gz	XIZCNOROELTEAL-UHFFFAOYSA-N	0	3	324.513	2.284	10	0		DEAEHN
Cc1nn(C)c(CNCC[C@H]2CCCO2)c1Br	ZINC000089232038	539410788	/nfs/dbraw/zinc/41/07/88/539410788.db2.gz	HWDMJAGOYFLONW-SNVBAGLBSA-N	0	3	302.216	2.150	10	0		DEAEHN
CCc1cnc(CCNC(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)s1	ZINC000126316384	539477185	/nfs/dbraw/zinc/47/71/85/539477185.db2.gz	FJXXEGHZVGPUGF-RYUDHWBXSA-N	0	3	322.478	2.172	10	0		DEAEHN
C/C(=C\c1ccc(C)cc1)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000181977347	199370129	/nfs/dbraw/zinc/37/01/29/199370129.db2.gz	YEURYDLGNDYPMT-GSPCDJLXSA-N	0	3	302.418	2.187	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)NC2CCN(C3CC3)CC2)cc1	ZINC000279684042	215059973	/nfs/dbraw/zinc/05/99/73/215059973.db2.gz	HNFZRJPKXNYRKZ-UHFFFAOYSA-N	0	3	315.417	2.026	10	0		DEAEHN
CO[C@@H](C)c1nc(C)c(C(=O)NC[C@@H]2CCN(C3CC3)C2)s1	ZINC000176103002	539625987	/nfs/dbraw/zinc/62/59/87/539625987.db2.gz	SMKLHNXTUYDEFL-RYUDHWBXSA-N	0	3	323.462	2.373	10	0		DEAEHN
CC(C)OC1CCC(NC(=O)N2CCN3CCC[C@H]3C2)CC1	ZINC000179136731	539639085	/nfs/dbraw/zinc/63/90/85/539639085.db2.gz	HKEHFHVSGLIKNG-PCKAHOCUSA-N	0	3	309.454	2.212	10	0		DEAEHN
CCc1nn(C)cc1CN1CCC[C@@H](Cc2noc(C)n2)C1	ZINC000180000033	539643508	/nfs/dbraw/zinc/64/35/08/539643508.db2.gz	RHVXPZHJLUVCRU-ZDUSSCGKSA-N	0	3	303.410	2.129	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(Br)cc2F)C1	ZINC000071139974	190935805	/nfs/dbraw/zinc/93/58/05/190935805.db2.gz	ANOKMQKHGSDIFL-JTQLQIEISA-N	0	3	315.186	2.364	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)NCCC2CC2)C1	ZINC000190720599	539696205	/nfs/dbraw/zinc/69/62/05/539696205.db2.gz	PFCURXNOVOALMY-KRWDZBQOSA-N	0	3	316.449	2.345	10	0		DEAEHN
CCc1nnsc1C(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000192933767	539710408	/nfs/dbraw/zinc/71/04/08/539710408.db2.gz	BBXDJMPIHPNDIT-CYBMUJFWSA-N	0	3	304.419	2.133	10	0		DEAEHN
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CC[C@H](N(C)C)C1	ZINC000170827718	197831973	/nfs/dbraw/zinc/83/19/73/197831973.db2.gz	GKZLHZBKGBUCRO-HIFRSBDPSA-N	0	3	305.422	2.059	10	0		DEAEHN
Cc1sc(Br)cc1[C@H](N)[C@H]1CCS(=O)(=O)C1	ZINC000084006096	192395847	/nfs/dbraw/zinc/39/58/47/192395847.db2.gz	UKWKGDRVTCVDFX-OIBJUYFYSA-N	0	3	324.265	2.254	10	0		DEAEHN
COc1cc2c(c(OC)c1)[C@@H](CN)N(Cc1nc(C)cs1)C2	ZINC000071683947	191008435	/nfs/dbraw/zinc/00/84/35/191008435.db2.gz	MNCBQDZCHDVZQM-CYBMUJFWSA-N	0	3	319.430	2.484	10	0		DEAEHN
CC[C@@H](C)CN(C)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138469434	186017238	/nfs/dbraw/zinc/01/72/38/186017238.db2.gz	GIPDWIPJCKQYSX-SNVBAGLBSA-N	0	3	320.405	2.351	10	0		DEAEHN
CCNCc1cc(F)c(F)c(S(=O)(=O)N2CCC[C@@H]2C)c1	ZINC000138571912	186017770	/nfs/dbraw/zinc/01/77/70/186017770.db2.gz	KDKUUOQTYYZSST-JTQLQIEISA-N	0	3	318.389	2.247	10	0		DEAEHN
CC(C)[C@H]1CCN(S(=O)(=O)c2cc(CN)cc(F)c2F)C1	ZINC000139292841	186020591	/nfs/dbraw/zinc/02/05/91/186020591.db2.gz	SQSXTDVKWPGZIN-NSHDSACASA-N	0	3	318.389	2.090	10	0		DEAEHN
CC[C@@H]1N[C@H](c2ccc(C)s2)N(C2CCN(C)CC2)C1=O	ZINC000141226258	186029251	/nfs/dbraw/zinc/02/92/51/186029251.db2.gz	KKJKQLZNIJYCJU-ZFWWWQNUSA-N	0	3	307.463	2.360	10	0		DEAEHN
CC[C@H]1N[C@H](c2ccc(C)s2)N(C2CCN(C)CC2)C1=O	ZINC000141226065	186029345	/nfs/dbraw/zinc/02/93/45/186029345.db2.gz	KKJKQLZNIJYCJU-HIFRSBDPSA-N	0	3	307.463	2.360	10	0		DEAEHN
CC(C)[C@@H]1N[C@@H](c2cccs2)N(C2CCN(C)CC2)C1=O	ZINC000141216230	186029434	/nfs/dbraw/zinc/02/94/34/186029434.db2.gz	MVJSHPJQUVDKGF-LSDHHAIUSA-N	0	3	307.463	2.297	10	0		DEAEHN
NCc1ccccc1CC(=O)Nc1ccncc1Br	ZINC000147527998	186040122	/nfs/dbraw/zinc/04/01/22/186040122.db2.gz	ZFACGDORVWAIKZ-UHFFFAOYSA-N	0	3	320.190	2.484	10	0		DEAEHN
Nc1ccc(SC[C@H]2CNCCO2)c(Br)c1	ZINC000148265119	186044025	/nfs/dbraw/zinc/04/40/25/186044025.db2.gz	ZEAQAXRDHLYFCL-SECBINFHSA-N	0	3	303.225	2.112	10	0		DEAEHN
C[C@@H](O)C(C)(C)NCc1cccc(NC(=O)C(F)(F)F)c1	ZINC000144873943	186035760	/nfs/dbraw/zinc/03/57/60/186035760.db2.gz	JXXTXKLTATYWMJ-SECBINFHSA-N	0	3	304.312	2.436	10	0		DEAEHN
C[C@@H](O)C(C)(C)NCC(=O)Nc1ccc(Br)cc1	ZINC000144927663	186035859	/nfs/dbraw/zinc/03/58/59/186035859.db2.gz	SPNYNXIELCSDMK-SECBINFHSA-N	0	3	315.211	2.137	10	0		DEAEHN
Clc1cc(NC[C@H]2CN3CCC[C@@H]3CO2)c(Cl)nn1	ZINC000149302441	186049150	/nfs/dbraw/zinc/04/91/50/186049150.db2.gz	YDIAMEPHDLLPNG-BDAKNGLRSA-N	0	3	303.193	2.059	10	0		DEAEHN
O=C1C[C@@H](NC[C@H]2CCCS2)C(=O)N1C1CCCCCC1	ZINC000149831991	186053215	/nfs/dbraw/zinc/05/32/15/186053215.db2.gz	OIRIPVGWANOYJL-ZIAGYGMSSA-N	0	3	310.463	2.322	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000150788020	186065882	/nfs/dbraw/zinc/06/58/82/186065882.db2.gz	YMKZLNWPQTYKJB-HOCLYGCPSA-N	0	3	317.433	2.087	10	0		DEAEHN
CCCNc1nc(NCCCSC)nc(N2CCCC2)n1	ZINC000155809790	186114749	/nfs/dbraw/zinc/11/47/49/186114749.db2.gz	VIGQDAFLTYFBBR-UHFFFAOYSA-N	0	3	310.471	2.459	10	0		DEAEHN
CCNc1nc(NC[C@H](C)CSC)nc(N2CCCC2)n1	ZINC000155816030	186115332	/nfs/dbraw/zinc/11/53/32/186115332.db2.gz	ZPMIBESUGLLEHX-NSHDSACASA-N	0	3	310.471	2.315	10	0		DEAEHN
Cc1ccc([C@@H](CN)N2CCCOCC2)c(Br)c1	ZINC000164074477	186148074	/nfs/dbraw/zinc/14/80/74/186148074.db2.gz	DFHYDYZWLTUYRV-CQSZACIVSA-N	0	3	313.239	2.480	10	0		DEAEHN
COc1cc(CNC[C@H](C)[S@](C)=O)cc(Cl)c1OC	ZINC000159692352	186135656	/nfs/dbraw/zinc/13/56/56/186135656.db2.gz	SLNMNGBDUSLLQT-ZRNGKTOUSA-N	0	3	305.827	2.214	10	0		DEAEHN
CN[C@H](c1cccc2cnccc21)[C@@H]1CCCCS1(=O)=O	ZINC000164322582	186156197	/nfs/dbraw/zinc/15/61/97/186156197.db2.gz	PXVTUQPLQLNBHK-JKSUJKDBSA-N	0	3	304.415	2.463	10	0		DEAEHN
COC(=O)CNC(=O)CCN[C@@H](C)c1ccc(C(C)C)cc1	ZINC000171912673	198007195	/nfs/dbraw/zinc/00/71/95/198007195.db2.gz	JKEANIWHARZXCJ-ZDUSSCGKSA-N	0	3	306.406	2.140	10	0		DEAEHN
C[C@@H](N[C@@H](C)c1ccc2c(c1)CCCC2)C(=O)N1CCNC1=O	ZINC000072789114	191229176	/nfs/dbraw/zinc/22/91/76/191229176.db2.gz	KYHJSGQDUVBPQR-QWHCGFSZSA-N	0	3	315.417	2.156	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCCc2cccc(F)c2)CCN1C	ZINC000173541696	198225512	/nfs/dbraw/zinc/22/55/12/198225512.db2.gz	HOULPRGPKIUSMX-XJKSGUPXSA-N	0	3	307.413	2.492	10	0		DEAEHN
O=C(NCCCOc1ccccc1)N1CC[C@H](N2CC=CC2)C1	ZINC000173570659	198228725	/nfs/dbraw/zinc/22/87/25/198228725.db2.gz	DCYABIYENGXLMS-INIZCTEOSA-N	0	3	315.417	2.111	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCc2ccc3c(c2)OCO3)CCN1C	ZINC000173892012	198265080	/nfs/dbraw/zinc/26/50/80/198265080.db2.gz	WQXTWUVMHUCORK-JSGCOSHPSA-N	0	3	319.405	2.039	10	0		DEAEHN
C[C@H](Cc1cccs1)NC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000173899478	198265651	/nfs/dbraw/zinc/26/56/51/198265651.db2.gz	KOAJDLLGRDEKEN-ZIAGYGMSSA-N	0	3	305.447	2.335	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccccc1F	ZINC000173828555	198257416	/nfs/dbraw/zinc/25/74/16/198257416.db2.gz	FRLIHXSSWMKRSI-CHWSQXEVSA-N	0	3	312.410	2.073	10	0		DEAEHN
CC[C@@H](O)CN1CCN(CCCOc2c(C)cccc2C)CC1	ZINC000174079076	198289426	/nfs/dbraw/zinc/28/94/26/198289426.db2.gz	ACUPNOHNSAXKNZ-GOSISDBHSA-N	0	3	320.477	2.461	10	0		DEAEHN
C[C@@H](CCOc1ccccc1)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000174295809	198316582	/nfs/dbraw/zinc/31/65/82/198316582.db2.gz	USMARJMDVIBHDT-JKSUJKDBSA-N	0	3	302.418	2.398	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000174513259	198344807	/nfs/dbraw/zinc/34/48/07/198344807.db2.gz	JJMCJYMCWQWQEM-INIZCTEOSA-N	0	3	303.450	2.359	10	0		DEAEHN
Cc1cccc(N2CCN(CCC(=O)N[C@H]3C[C@H]3C)CC2)c1	ZINC000073327901	191305583	/nfs/dbraw/zinc/30/55/83/191305583.db2.gz	OEDREVSACVVDQN-WBVHZDCISA-N	0	3	301.434	2.032	10	0		DEAEHN
CC[NH+]1CCC(NC(=O)c2cc3c(cc2[O-])CCCC3)CC1	ZINC000068541347	354819230	/nfs/dbraw/zinc/81/92/30/354819230.db2.gz	CUQCAOQWDDBZBZ-UHFFFAOYSA-N	0	3	302.418	2.485	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N(CC(=O)NCCCN2CCCCCC2=O)C1	ZINC000076150156	355130329	/nfs/dbraw/zinc/13/03/29/355130329.db2.gz	RUUJALDWOTUIMR-HZPDHXFCSA-N	0	3	323.481	2.016	10	0		DEAEHN
NC[C@@H](NC(=O)c1cc(F)c(Cl)cc1F)C(F)(F)F	ZINC000401748460	540142672	/nfs/dbraw/zinc/14/26/72/540142672.db2.gz	WIVXNXABQNUFPZ-MRVPVSSYSA-N	0	3	302.630	2.238	10	0		DEAEHN
O=C1[C@H](N[C@H]2CCCc3sccc32)CCN1C1CCOCC1	ZINC000367412117	283113786	/nfs/dbraw/zinc/11/37/86/283113786.db2.gz	GJNWUIYIKVSTKM-LSDHHAIUSA-N	0	3	320.458	2.495	10	0		DEAEHN
CC1(C)O[C@H]2O[C@H](CN3CCC[C@H]3c3ccccc3)[C@@H](O)[C@H]2O1	ZINC000106385021	355722092	/nfs/dbraw/zinc/72/20/92/355722092.db2.gz	FXRSTNMDEDRDHF-MZBWOGCUSA-N	0	3	319.401	2.061	10	0		DEAEHN
CC(C)[C@H](NC(=O)NC[C@@H]1CCCN1C)c1nc(C2CC2)no1	ZINC000170812625	355994354	/nfs/dbraw/zinc/99/43/54/355994354.db2.gz	MWCLEZULBQLPGN-STQMWFEESA-N	0	3	321.425	2.038	10	0		DEAEHN
CC(C)Oc1cccc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)n1	ZINC000179085947	356014056	/nfs/dbraw/zinc/01/40/56/356014056.db2.gz	XMDKUOKXXWFTHS-UONOGXRCSA-N	0	3	303.406	2.178	10	0		DEAEHN
CC[C@@H]1COCCN1C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179468449	356026676	/nfs/dbraw/zinc/02/66/76/356026676.db2.gz	CQDUFDVWRIWYTH-BRWVUGGUSA-N	0	3	317.433	2.252	10	0		DEAEHN
O=C(CN1CCCC12CCC2)NC(=O)NCc1ccccc1	ZINC000373101582	283141183	/nfs/dbraw/zinc/14/11/83/283141183.db2.gz	WUYZSEVQTBQNNE-UHFFFAOYSA-N	0	3	301.390	2.031	10	0		DEAEHN
CNCc1ccnn1Cc1ccc(OC)c(Br)c1	ZINC000080082368	191999700	/nfs/dbraw/zinc/99/97/00/191999700.db2.gz	XYYVMGNSPCOMQP-UHFFFAOYSA-N	0	3	310.195	2.422	10	0		DEAEHN
COC[C@H](C)CN1CCN(Cc2cc(OC)ccc2OC)CC1	ZINC000189549620	356215898	/nfs/dbraw/zinc/21/58/98/356215898.db2.gz	CPWAVVRRDIGNTN-OAHLLOKOSA-N	0	3	322.449	2.104	10	0		DEAEHN
C[C@H](NCCCn1ccnn1)c1cnn(Cc2ccccc2)c1	ZINC000184266116	356189496	/nfs/dbraw/zinc/18/94/96/356189496.db2.gz	VFWNQMHIMBEMJN-HNNXBMFYSA-N	0	3	310.405	2.264	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCCNc2cccc(F)c2)C1	ZINC000184935391	356199577	/nfs/dbraw/zinc/19/95/77/356199577.db2.gz	JDECZTQWWWUNKW-INIZCTEOSA-N	0	3	322.428	2.411	10	0		DEAEHN
C[C@H](NCc1cc(=O)n2ccccc2n1)[C@H]1COc2ccccc21	ZINC000185620489	356208028	/nfs/dbraw/zinc/20/80/28/356208028.db2.gz	YGCGPOSJZZTGCU-XJKSGUPXSA-N	0	3	321.380	2.349	10	0		DEAEHN
NCc1ccc2ccc(F)c(I)c2n1	ZINC000300916701	356390314	/nfs/dbraw/zinc/39/03/14/356390314.db2.gz	VKIHFNDPJYXVPY-UHFFFAOYSA-N	0	3	302.090	2.437	10	0		DEAEHN
NCc1ccc(C(F)(F)F)c(I)n1	ZINC000307007077	356405932	/nfs/dbraw/zinc/40/59/32/356405932.db2.gz	GNNZPXHOLOBYAQ-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
c1cnc(N2CCC[C@H](NCc3cnc4ccccc4n3)C2)nc1	ZINC000324607562	356458219	/nfs/dbraw/zinc/45/82/19/356458219.db2.gz	JJCXNYYHPPNECL-AWEZNQCLSA-N	0	3	320.400	2.178	10	0		DEAEHN
CCC[C@H](N)C(=O)N[C@H](C)c1ccc(N2CCCC2=O)cc1	ZINC000236921061	202071555	/nfs/dbraw/zinc/07/15/55/202071555.db2.gz	VXCYOZBWSKJFQB-DOMZBBRYSA-N	0	3	303.406	2.118	10	0		DEAEHN
CN(C)CCn1cc(NC(=O)CNc2cccc(Cl)c2)cn1	ZINC000591078956	357671905	/nfs/dbraw/zinc/67/19/05/357671905.db2.gz	XWBZTCQEKDWQKD-UHFFFAOYSA-N	0	3	321.812	2.149	10	0		DEAEHN
CC(C)(CN1CCCC1)NCc1cccc(S(C)(=O)=O)c1	ZINC000449768592	283279875	/nfs/dbraw/zinc/27/98/75/283279875.db2.gz	GCEURQPDXMZKGO-UHFFFAOYSA-N	0	3	310.463	2.054	10	0		DEAEHN
COCCN1CCN(Cc2cnc(-c3ccccc3)[nH]2)C[C@@H]1C	ZINC000179509840	199047375	/nfs/dbraw/zinc/04/73/75/199047375.db2.gz	IQJZUVSFXZMCHA-HNNXBMFYSA-N	0	3	314.433	2.229	10	0		DEAEHN
Cn1cc(C(=O)N2CCN3CCC[C@H]3C2)c(-c2ccccc2)n1	ZINC000179816796	199084607	/nfs/dbraw/zinc/08/46/07/199084607.db2.gz	RHSZUBLPGBFGFY-HNNXBMFYSA-N	0	3	310.401	2.007	10	0		DEAEHN
COCCC[C@@H](C)[NH2+][C@H](CC(C)C)c1nc(-c2nc[n-]n2)no1	ZINC000179809958	199083658	/nfs/dbraw/zinc/08/36/58/199083658.db2.gz	AIIOABZRUHLABR-VXGBXAGGSA-N	0	3	322.413	2.347	10	0		DEAEHN
COCCC[C@@H](C)N[C@H](CC(C)C)c1nc(-c2nc[nH]n2)no1	ZINC000179809958	199083659	/nfs/dbraw/zinc/08/36/59/199083659.db2.gz	AIIOABZRUHLABR-VXGBXAGGSA-N	0	3	322.413	2.347	10	0		DEAEHN
C[C@@H]1CN(CC2=Cc3ccccc3OC2)C[C@@H]1N1CCOCC1	ZINC000180230496	199132819	/nfs/dbraw/zinc/13/28/19/199132819.db2.gz	RBLDZNUEKZXJEF-QAPCUYQASA-N	0	3	314.429	2.115	10	0		DEAEHN
Cc1cc(C(=O)N2CC[C@H](N(C)C)C2)nn1-c1ccc(F)cc1	ZINC000180253459	199136945	/nfs/dbraw/zinc/13/69/45/199136945.db2.gz	PQOQWFRFYWPCOU-HNNXBMFYSA-N	0	3	316.380	2.096	10	0		DEAEHN
COCCN1CC[C@@H](NC(=O)c2c[nH]c3cc(Cl)ccc23)C1	ZINC000593913539	358170022	/nfs/dbraw/zinc/17/00/22/358170022.db2.gz	VDYPJUJPVFILSF-GFCCVEGCSA-N	0	3	321.808	2.272	10	0		DEAEHN
Cc1nccn1-c1ccc([C@@H](C)NC[C@H]2CN(C)CCO2)cc1	ZINC000180490585	199166162	/nfs/dbraw/zinc/16/61/62/199166162.db2.gz	RJQNBVXBHLPOOF-KDOFPFPSSA-N	0	3	314.433	2.162	10	0		DEAEHN
Cc1cccc(CSCC(=O)N[C@H](CN)C(F)(F)F)c1	ZINC000594451979	358275645	/nfs/dbraw/zinc/27/56/45/358275645.db2.gz	VTUQYWQVCMACLV-LLVKDONJSA-N	0	3	306.353	2.234	10	0		DEAEHN
C[C@@H](CCCc1ccccc1)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000180862676	199220400	/nfs/dbraw/zinc/22/04/00/199220400.db2.gz	ZIYRQXBQVRNSHE-WMZOPIPTSA-N	0	3	318.461	2.434	10	0		DEAEHN
COc1c(C)ccc(NC(=O)N2CCO[C@H](CN(C)C)C2)c1C	ZINC000181161586	199258363	/nfs/dbraw/zinc/25/83/63/199258363.db2.gz	GOLODIGTTLIQOR-CQSZACIVSA-N	0	3	321.421	2.106	10	0		DEAEHN
CC1(C)CCN(S(=O)(=O)c2cc(CN)n(C3CC3)c2)CC1	ZINC000089027115	192706656	/nfs/dbraw/zinc/70/66/56/192706656.db2.gz	YSVGVAFCFGJNES-UHFFFAOYSA-N	0	3	311.451	2.092	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N(C)[C@H]1CCN(C)C[C@@H]1C	ZINC000187483157	200118592	/nfs/dbraw/zinc/11/85/92/200118592.db2.gz	HYWLNAKERHACBX-YDHLFZDLSA-N	0	3	320.437	2.133	10	0		DEAEHN
C[C@@H]1CC[C@@](CO)(N(C)CC(=O)N(C)Cc2ccc(F)cc2)C1	ZINC000187923865	200177275	/nfs/dbraw/zinc/17/72/75/200177275.db2.gz	FRTGOALJEYEQDQ-RDTXWAMCSA-N	0	3	322.424	2.267	10	0		DEAEHN
C[C@@H]1CC[C@@](CO)(N(C)CC(=O)N2CCc3ccccc3C2)C1	ZINC000187902899	200173937	/nfs/dbraw/zinc/17/39/37/200173937.db2.gz	HKSHTXJNCVOVGP-DNVCBOLYSA-N	0	3	316.445	2.054	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1C	ZINC000188646794	200280781	/nfs/dbraw/zinc/28/07/81/200280781.db2.gz	HICAZQLXUUOISK-SJCJKPOMSA-N	0	3	317.433	2.412	10	0		DEAEHN
CCOC[C@H](NCc1cnc(C(=O)OCC)s1)C(C)C	ZINC000602830163	360577919	/nfs/dbraw/zinc/57/79/19/360577919.db2.gz	LRSBDGGJCXTHMV-LBPRGKRZSA-N	0	3	300.424	2.471	10	0		DEAEHN
O[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3CN2Cc1cnc(-c2ccncc2)s1	ZINC000442967969	238095378	/nfs/dbraw/zinc/09/53/78/238095378.db2.gz	PXTQISDEEXZOBJ-FHXAZYNBSA-N	0	3	313.426	2.406	10	0		DEAEHN
C[C@@H](NC(=O)N(C)CCN1CCCC1)c1ccc2c(c1)OCO2	ZINC000602986284	360656569	/nfs/dbraw/zinc/65/65/69/360656569.db2.gz	PIHBPIDFTDJANO-CYBMUJFWSA-N	0	3	319.405	2.214	10	0		DEAEHN
Cc1nc(CN2CCN(CCSc3ccccc3)CC2)n[nH]1	ZINC000605422226	360968269	/nfs/dbraw/zinc/96/82/69/360968269.db2.gz	QNMMGACMADAWMP-UHFFFAOYSA-N	0	3	317.462	2.023	10	0		DEAEHN
CC1(CNCc2c[nH]nc2-c2ccccc2F)OCCCO1	ZINC000192252178	200843275	/nfs/dbraw/zinc/84/32/75/200843275.db2.gz	WKKCXIFWYDTMSV-UHFFFAOYSA-N	0	3	305.353	2.459	10	0		DEAEHN
C[C@H]1CCNC[C@H]1NS(=O)(=O)c1ccc2ccccc2c1	ZINC000193397723	201044783	/nfs/dbraw/zinc/04/47/83/201044783.db2.gz	YJWKLUJXARGNJH-BLLLJJGKSA-N	0	3	304.415	2.116	10	0		DEAEHN
Cc1nc(C)c(CNC[C@]2(O)CCN(Cc3ccccc3)C2)o1	ZINC000628219037	366771825	/nfs/dbraw/zinc/77/18/25/366771825.db2.gz	ZWVYHEBBJRJPTR-GOSISDBHSA-N	0	3	315.417	2.018	10	0		DEAEHN
CCc1nn(-c2ccccc2)c(CC)c1C(=O)NCCN(C)C	ZINC000006773027	181386278	/nfs/dbraw/zinc/38/62/78/181386278.db2.gz	VTCUPOLINMLZRE-UHFFFAOYSA-N	0	3	314.433	2.289	10	0		DEAEHN
C[C@@H](C1CC1)N(CC(F)(F)F)C(=O)C[C@H]1CSCCN1	ZINC000091135896	193000738	/nfs/dbraw/zinc/00/07/38/193000738.db2.gz	TYSOLLSDLVNOCH-ONGXEEELSA-N	0	3	310.385	2.271	10	0		DEAEHN
CCN1CCO[C@@H](CN)[C@@H]1c1ccc(Br)c(C)c1	ZINC000091475856	193061407	/nfs/dbraw/zinc/06/14/07/193061407.db2.gz	ZHNGJMWBZMZWNJ-KBPBESRZSA-N	0	3	313.239	2.478	10	0		DEAEHN
CC[C@@H](CN)S(=O)(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000091479123	193062266	/nfs/dbraw/zinc/06/22/66/193062266.db2.gz	UADCOQMKNHJCEW-JTQLQIEISA-N	0	3	310.341	2.493	10	0		DEAEHN
CN(c1nc(Cl)ncc1Br)C1CCN(C)CC1	ZINC000091658138	193086285	/nfs/dbraw/zinc/08/62/85/193086285.db2.gz	DUQXESQCUOQLSC-UHFFFAOYSA-N	0	3	319.634	2.423	10	0		DEAEHN
Cc1cccc(NC(=O)[C@H]2CCCN(CC3=CCCOC3)C2)n1	ZINC000091686444	193092004	/nfs/dbraw/zinc/09/20/04/193092004.db2.gz	JLPGCWXAXRZRJA-INIZCTEOSA-N	0	3	315.417	2.387	10	0		DEAEHN
C[C@H]1CN(C2CCN(Cc3cccc4c3OCO4)CC2)CCO1	ZINC000092079149	193154772	/nfs/dbraw/zinc/15/47/72/193154772.db2.gz	XTLAUFSNLZJYLS-AWEZNQCLSA-N	0	3	318.417	2.100	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2ccc(Cl)c(CN)c2)C[C@H]1C	ZINC000092113599	193161105	/nfs/dbraw/zinc/16/11/05/193161105.db2.gz	SQDSGFFIWYIDDH-AOOOYVTPSA-N	0	3	302.827	2.075	10	0		DEAEHN
Cc1oc(CNC(C)C)cc1S(=O)(=O)N1C[C@H](C)[C@H](C)C1	ZINC000092113498	193161727	/nfs/dbraw/zinc/16/17/27/193161727.db2.gz	OQGCUCQFXPRFKN-TXEJJXNPSA-N	0	3	314.451	2.363	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2cc(CN)ccc2Cl)C[C@H]1C	ZINC000092113466	193161837	/nfs/dbraw/zinc/16/18/37/193161837.db2.gz	JSHYZAAZYKZRBK-AOOOYVTPSA-N	0	3	302.827	2.075	10	0		DEAEHN
CC(C)NCc1ccc(S(=O)(=O)N2CCC[C@@H]2C)c(F)c1	ZINC000092115733	193163404	/nfs/dbraw/zinc/16/34/04/193163404.db2.gz	MVYLPPIQHKLUPV-LBPRGKRZSA-N	0	3	314.426	2.497	10	0		DEAEHN
C[NH2+]Cc1ccc(S(=O)(=O)[N-]C2(C)CCCC2)c(F)c1	ZINC000092116258	193163861	/nfs/dbraw/zinc/16/38/61/193163861.db2.gz	GHWALXYPPXJGMO-UHFFFAOYSA-N	0	3	300.399	2.156	10	0		DEAEHN
CC(C)[NH2+]Cc1ccc(S(=O)(=O)[N-][C@@H]2CC2(C)C)c(F)c1	ZINC000092116018	193163923	/nfs/dbraw/zinc/16/39/23/193163923.db2.gz	ATJAMVBPVIWJSH-CQSZACIVSA-N	0	3	314.426	2.401	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCC[C@@H]2C(C)C)c(F)c1	ZINC000092116284	193164594	/nfs/dbraw/zinc/16/45/94/193164594.db2.gz	HOOYWMIOMUKLKE-CQSZACIVSA-N	0	3	314.426	2.354	10	0		DEAEHN
OC[C@@H]1CN(C[C@@H](O)CC(F)(F)F)C[C@H]1c1ccsc1	ZINC000249292025	202794208	/nfs/dbraw/zinc/79/42/08/202794208.db2.gz	MLBHCSRYNGZJRI-SRVKXCTJSA-N	0	3	309.353	2.069	10	0		DEAEHN
c1cc(OCCN2CCOCC2)ccc1CN[C@@H]1CC12CC2	ZINC000631164201	368055503	/nfs/dbraw/zinc/05/55/03/368055503.db2.gz	YUFDQLJPQKQUHR-QGZVFWFLSA-N	0	3	302.418	2.040	10	0		DEAEHN
c1c(CN[C@@H]2CC[C@@H]3CCC[C@H]3C2)nnn1C[C@H]1CCOC1	ZINC000631080224	368006649	/nfs/dbraw/zinc/00/66/49/368006649.db2.gz	XXFASAQEVWGJGI-FXUDXRNXSA-N	0	3	304.438	2.373	10	0		DEAEHN
CO[C@@H]1[C@H](C)[C@@H](NCC(=O)Nc2ccc3c(c2)OCO3)C1(C)C	ZINC000451502441	243041491	/nfs/dbraw/zinc/04/14/91/243041491.db2.gz	PNUXXAMAXMINKR-UHNFBRDESA-N	0	3	320.389	2.003	10	0		DEAEHN
Cc1csc(NC(=O)CN[C@H](C(C)C)[C@@H](CO)C(C)C)n1	ZINC000451600538	243179960	/nfs/dbraw/zinc/17/99/60/243179960.db2.gz	SDMUHQRJEZMXLA-GXTWGEPZSA-N	0	3	313.467	2.269	10	0		DEAEHN
CN(CC(C)(C)O)[C@@H](CN)c1ccccc1Br	ZINC000092958156	193188599	/nfs/dbraw/zinc/18/85/99/193188599.db2.gz	LJCVOPIPDQFLEJ-LBPRGKRZSA-N	0	3	301.228	2.152	10	0		DEAEHN
C[S@](=O)Cc1cc(NC(=O)[C@H]2CCCCN2)ccc1Cl	ZINC000262483915	203305763	/nfs/dbraw/zinc/30/57/63/203305763.db2.gz	SYSKLFROWSSISX-XCLFUZPHSA-N	0	3	314.838	2.299	10	0		DEAEHN
CC[C@H](C)CN(CC)S(=O)(=O)c1ccc(CN)cc1F	ZINC000093265949	193222664	/nfs/dbraw/zinc/22/26/64/193222664.db2.gz	CYSNIJUMZDRSPE-NSHDSACASA-N	0	3	302.415	2.341	10	0		DEAEHN
C[C@@H](C[C@@H]1CCC[NH2+]1)Nc1ccc(F)c([N-]S(C)(=O)=O)c1	ZINC000093464389	193255849	/nfs/dbraw/zinc/25/58/49/193255849.db2.gz	LILCWTLGWZGFQY-QWRGUYRKSA-N	0	3	315.414	2.140	10	0		DEAEHN
CC[NH2+][C@@]1(C(=O)[O-])CCC[C@@H]1CCN(C)CCC(F)(F)F	ZINC000093596070	193270687	/nfs/dbraw/zinc/27/06/87/193270687.db2.gz	ATNXNSYUBZAUKN-YPMHNXCESA-N	0	3	310.360	2.494	10	0		DEAEHN
CC[C@H](CO)N1CCN(Cc2cccc3c2OC(C)(C)C3)CC1	ZINC000093739960	193297934	/nfs/dbraw/zinc/29/79/34/193297934.db2.gz	QEKHLQXJHHQZTA-QGZVFWFLSA-N	0	3	318.461	2.289	10	0		DEAEHN
NC(=O)[C@@]1(N)CCC[C@@H](Oc2ccccc2C(F)(F)F)C1	ZINC000093773816	193305092	/nfs/dbraw/zinc/30/50/92/193305092.db2.gz	RGTHJCFHKYZNIS-NOZJJQNGSA-N	0	3	302.296	2.210	10	0		DEAEHN
CN[C@]1(C(N)=O)CC[C@H](Oc2ccccc2C(F)(F)F)C1	ZINC000093836631	193314768	/nfs/dbraw/zinc/31/47/68/193314768.db2.gz	ZRSPGFPJAXFYPG-TVQRCGJNSA-N	0	3	302.296	2.080	10	0		DEAEHN
CC1(C)C([NH3+])C(C)(C)C1[N-]S(=O)(=O)c1cc(F)cc(F)c1	ZINC000094006570	193338814	/nfs/dbraw/zinc/33/88/14/193338814.db2.gz	VFNZZAHDZWIYMJ-UHFFFAOYSA-N	0	3	318.389	2.005	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(C(=O)NC3CCCCC3)C2)CC1	ZINC000093886168	193324279	/nfs/dbraw/zinc/32/42/79/193324279.db2.gz	MOPGPMSWDMMBLU-KRWDZBQOSA-N	0	3	322.497	2.131	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)cc1)N(C)CCS(C)(=O)=O	ZINC000094297102	193357187	/nfs/dbraw/zinc/35/71/87/193357187.db2.gz	YHXCGAPWAQZICU-UONOGXRCSA-N	0	3	318.870	2.095	10	0		DEAEHN
NCc1ccc(C(F)(F)F)nc1N1CCC[C@@H]1CCCO	ZINC000094334261	193360605	/nfs/dbraw/zinc/36/06/05/193360605.db2.gz	IRSWKKCXFJPPOI-LLVKDONJSA-N	0	3	303.328	2.300	10	0		DEAEHN
CN[C@H](c1cc(Br)ccc1F)[C@@H]1COCCO1	ZINC000094108714	193345363	/nfs/dbraw/zinc/34/53/63/193345363.db2.gz	WSOKDRLTDBBFHU-NWDGAFQWSA-N	0	3	304.159	2.264	10	0		DEAEHN
COCCNC[C@@](C)(O)c1cc(Br)ccc1F	ZINC000094109315	193345410	/nfs/dbraw/zinc/34/54/10/193345410.db2.gz	QQVSCTYWVCCLLW-GFCCVEGCSA-N	0	3	306.175	2.032	10	0		DEAEHN
CCOC(=O)c1c(NC(=O)[C@@](C)(N)CC)sc2c1CCC2	ZINC000094236933	193353392	/nfs/dbraw/zinc/35/33/92/193353392.db2.gz	UIVRDZNQMCGTIN-HNNXBMFYSA-N	0	3	310.419	2.479	10	0		DEAEHN
COc1ccc(CN)cc1CS(=O)(=O)c1cccc(F)c1	ZINC000094625144	193385528	/nfs/dbraw/zinc/38/55/28/193385528.db2.gz	FMPUCIBGOJTURS-UHFFFAOYSA-N	0	3	309.362	2.267	10	0		DEAEHN
CC(C)CNCc1ncnn1[C@H]1CCO[C@]2(CCSC2)C1	ZINC000094412857	193368405	/nfs/dbraw/zinc/36/84/05/193368405.db2.gz	UKNGFLRGWCTHFT-DZGCQCFKSA-N	0	3	310.467	2.251	10	0		DEAEHN
CN[C@H](c1ccc(Cl)c(Cl)c1)[C@H]1CN2CCN1CC2	ZINC000094508964	193375131	/nfs/dbraw/zinc/37/51/31/193375131.db2.gz	VIBCIXLMDJZSSP-ZIAGYGMSSA-N	0	3	300.233	2.254	10	0		DEAEHN
CN[C@H](Cc1cccnc1N)c1cncc(Br)c1	ZINC000094824134	193401489	/nfs/dbraw/zinc/40/14/89/193401489.db2.gz	OWRULCINTHNBOD-GFCCVEGCSA-N	0	3	307.195	2.325	10	0		DEAEHN
COc1ccc(F)c([N-]S(=O)(=O)c2ccccc2C[NH3+])c1	ZINC000094854694	193403055	/nfs/dbraw/zinc/40/30/55/193403055.db2.gz	QOGGHYDHFHEFDX-UHFFFAOYSA-N	0	3	310.350	2.094	10	0		DEAEHN
O=C(N[C@H]1CCCc2occc21)N1CC[C@H](N2CC=CC2)C1	ZINC000173950917	284189612	/nfs/dbraw/zinc/18/96/12/284189612.db2.gz	GXKBNEOWEVVYRG-ZFWWWQNUSA-N	0	3	301.390	2.313	10	0		DEAEHN
Cc1ccc2c(c1C)OC[C@@H]2NC(=O)NCCN(C)C1CC1	ZINC000264916313	204265948	/nfs/dbraw/zinc/26/59/48/204265948.db2.gz	YCYNAINMXANKPJ-HNNXBMFYSA-N	0	3	303.406	2.130	10	0		DEAEHN
COc1ccc(Cl)cc1C[C@@H](N)[C@H]1CCCCS1(=O)=O	ZINC000161950255	197531676	/nfs/dbraw/zinc/53/16/76/197531676.db2.gz	KHWKWQKMIAZPPR-TZMCWYRMSA-N	0	3	317.838	2.186	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCN([C@H](CN)c2cccs2)CC1	ZINC000020179232	182194612	/nfs/dbraw/zinc/19/46/12/182194612.db2.gz	QXEUWYLNHZBUBK-GFCCVEGCSA-N	0	3	311.451	2.301	10	0		DEAEHN
NCc1ccc(F)c(S(=O)(=O)N2CCc3ccccc32)c1	ZINC000020188946	182195455	/nfs/dbraw/zinc/19/54/55/182195455.db2.gz	HZQZOMOKHOFBHS-UHFFFAOYSA-N	0	3	306.362	2.036	10	0		DEAEHN
NC[C@@H](c1cccc(Br)c1)N1CCSCC1	ZINC000020257076	182200406	/nfs/dbraw/zinc/20/04/06/182200406.db2.gz	UFPDDMAOOUFVBJ-LBPRGKRZSA-N	0	3	301.253	2.498	10	0		DEAEHN
C[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)N1CCNCC1	ZINC000020269991	182201533	/nfs/dbraw/zinc/20/15/33/182201533.db2.gz	NLFJJTUFMQWXCM-SECBINFHSA-N	0	3	302.205	2.226	10	0		DEAEHN
CN[C@@H](c1c(Br)cnn1CCOC)C1CCC1	ZINC000159979443	197378279	/nfs/dbraw/zinc/37/82/79/197378279.db2.gz	BNQPAVGJTDHCTB-LLVKDONJSA-N	0	3	302.216	2.353	10	0		DEAEHN
Cc1ccc([C@H](CN)N2CCN(c3nccs3)CC2)cc1	ZINC000021046846	182263510	/nfs/dbraw/zinc/26/35/10/182263510.db2.gz	UDYPSSPFWUEXME-HNNXBMFYSA-N	0	3	302.447	2.274	10	0		DEAEHN
O=S(=O)(Nc1ccc(C(F)(F)F)cc1)[C@H]1CCCNC1	ZINC000021503466	182276076	/nfs/dbraw/zinc/27/60/76/182276076.db2.gz	MRJNJXKJLQJBRW-NSHDSACASA-N	0	3	308.325	2.199	10	0		DEAEHN
Cc1cc(C)c(NC[C@@H](O)CN(C)C)c(Br)c1	ZINC000159851149	197368719	/nfs/dbraw/zinc/36/87/19/197368719.db2.gz	PGSMCQCXLWNVIY-LLVKDONJSA-N	0	3	301.228	2.400	10	0		DEAEHN
Cc1nn(C)cc1CC(=O)Nc1ccc(CN(C)C)c(C)c1	ZINC000458273546	248243271	/nfs/dbraw/zinc/24/32/71/248243271.db2.gz	XBSYOAXXIBMVSQ-UHFFFAOYSA-N	0	3	300.406	2.280	10	0		DEAEHN
CC(C)(CNC(=O)NCCNc1ccncc1)C1=CCCC1	ZINC000459188875	248594281	/nfs/dbraw/zinc/59/42/81/248594281.db2.gz	YNVBUZTZBQFZIK-UHFFFAOYSA-N	0	3	302.422	2.351	10	0		DEAEHN
CNCc1nc2ccc(Cl)cc2n1CCCN1CCOCC1	ZINC000040406190	183062215	/nfs/dbraw/zinc/06/22/15/183062215.db2.gz	NVYRBYIPRKYAFC-UHFFFAOYSA-N	0	3	322.840	2.131	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2cccc(-c3nccs3)c2)C1	ZINC000040634300	183111578	/nfs/dbraw/zinc/11/15/78/183111578.db2.gz	DKNVUZNPSABYCJ-STQMWFEESA-N	0	3	303.387	2.126	10	0		DEAEHN
NC1(C(=O)NCc2cc(Br)ccc2F)CCCC1	ZINC000041069526	183162140	/nfs/dbraw/zinc/16/21/40/183162140.db2.gz	TYJIQTIQECVKSZ-UHFFFAOYSA-N	0	3	315.186	2.476	10	0		DEAEHN
C[C@@](N)(C(=O)NCc1cc(Br)ccc1F)C1CC1	ZINC000041069513	183162385	/nfs/dbraw/zinc/16/23/85/183162385.db2.gz	RVDCKHRAMRSUCO-ZDUSSCGKSA-N	0	3	315.186	2.332	10	0		DEAEHN
COC[C@H](C)N(C)[C@@H](CN)c1ccc(Br)s1	ZINC000042318787	183253404	/nfs/dbraw/zinc/25/34/04/183253404.db2.gz	APLXOOUCFFFUOZ-IUCAKERBSA-N	0	3	307.257	2.477	10	0		DEAEHN
CNCc1cccc(Br)c1OCc1nc(C)no1	ZINC000042411574	183265764	/nfs/dbraw/zinc/26/57/64/183265764.db2.gz	APDMSNMDUKUFHP-UHFFFAOYSA-N	0	3	312.167	2.439	10	0		DEAEHN
CCOC(=O)COc1c(Br)cccc1CNC	ZINC000042411636	183266045	/nfs/dbraw/zinc/26/60/45/183266045.db2.gz	NAAPMPUOIGUAEX-UHFFFAOYSA-N	0	3	302.168	2.110	10	0		DEAEHN
COCCN([C@H](C)COC)[C@@H](CN)c1ccc(Cl)cc1	ZINC000042606684	183290129	/nfs/dbraw/zinc/29/01/29/183290129.db2.gz	UCRCSDCKEOSDKB-DOMZBBRYSA-N	0	3	300.830	2.323	10	0		DEAEHN
COCCN([C@H](C)COC)[C@@H](CN)c1ccc(SC)cc1	ZINC000042606650	183290499	/nfs/dbraw/zinc/29/04/99/183290499.db2.gz	UQSAHDDHOBYCGA-CJNGLKHVSA-N	0	3	312.479	2.392	10	0		DEAEHN
COc1cc(OC)cc([C@H](CN)N(C)Cc2cscn2)c1	ZINC000042863625	183315031	/nfs/dbraw/zinc/31/50/31/183315031.db2.gz	LOTHVEMRCMIVCY-HNNXBMFYSA-N	0	3	307.419	2.292	10	0		DEAEHN
C[C@H](N)[C@H](c1ccc(Cl)cc1)N(CC(N)=O)C1CCCC1	ZINC000042946606	183320488	/nfs/dbraw/zinc/32/04/88/183320488.db2.gz	WRUJCHVBHJWURL-MEDUHNTESA-N	0	3	309.841	2.458	10	0		DEAEHN
CC[C@H](N)[C@@H](c1sccc1C)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043248008	183347147	/nfs/dbraw/zinc/34/71/47/183347147.db2.gz	CKTDYXVTKLAENH-MJBXVCDLSA-N	0	3	309.479	2.388	10	0		DEAEHN
CNC(=O)[C@@H]1CCCCN1[C@@H](CN)c1ccc(Cl)s1	ZINC000043253718	183347863	/nfs/dbraw/zinc/34/78/63/183347863.db2.gz	VRBFUOANAWNUTO-UWVGGRQHSA-N	0	3	301.843	2.002	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccc(Cl)s1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043252788	183348109	/nfs/dbraw/zinc/34/81/09/183348109.db2.gz	JIQRBIHCLCHNPY-GIPNMCIBSA-N	0	3	315.870	2.342	10	0		DEAEHN
CN[C@@H](c1ccc(OC(F)(F)F)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000043300607	183352007	/nfs/dbraw/zinc/35/20/07/183352007.db2.gz	XKYIMTOWHQBLNW-PWSUYJOCSA-N	0	3	323.336	2.280	10	0		DEAEHN
CC(C)CN(CCC(N)=S)CC(=O)Nc1ccccc1F	ZINC000043418583	183361286	/nfs/dbraw/zinc/36/12/86/183361286.db2.gz	SNULDGQXKHSVMK-UHFFFAOYSA-N	0	3	311.426	2.398	10	0		DEAEHN
COC[C@H](C)CNCc1ccc(I)o1	ZINC000045657577	183521603	/nfs/dbraw/zinc/52/16/03/183521603.db2.gz	UTOHNWSJKUMSFV-MRVPVSSYSA-N	0	3	309.147	2.256	10	0		DEAEHN
COc1ccc2c(c1)CCN2C(=O)NC[C@@H](C)N(C)C1CC1	ZINC000105265492	194089735	/nfs/dbraw/zinc/08/97/35/194089735.db2.gz	JELARCLCWQIZIF-GFCCVEGCSA-N	0	3	303.406	2.250	10	0		DEAEHN
CC[C@H]1CN(CCc2ccc(OC)cc2)CCN1C[C@@H](C)O	ZINC000105826296	194137342	/nfs/dbraw/zinc/13/73/42/194137342.db2.gz	NKGJYNLGUOBCMR-WBVHZDCISA-N	0	3	306.450	2.015	10	0		DEAEHN
CCOCCN1CCN(C[C@](C)(O)c2ccccc2)C[C@@H]1CC	ZINC000105838588	194144939	/nfs/dbraw/zinc/14/49/39/194144939.db2.gz	MXQSDVOPZYBRJH-OALUTQOASA-N	0	3	320.477	2.327	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)NC[C@@H](C)c2ccccc2)c1	ZINC000105881296	194156227	/nfs/dbraw/zinc/15/62/27/194156227.db2.gz	RKYRUBKPDPYUDK-CVEARBPZSA-N	0	3	314.433	2.090	10	0		DEAEHN
CC(C)NCc1ccccc1OCC(=O)NCC(F)(F)F	ZINC000049309564	183724726	/nfs/dbraw/zinc/72/47/26/183724726.db2.gz	RJCIPSWJUNPCEO-UHFFFAOYSA-N	0	3	304.312	2.242	10	0		DEAEHN
CC[C@H](C(N)=S)N1CCN(Cc2ccc(F)cc2F)CC1	ZINC000109469441	194267266	/nfs/dbraw/zinc/26/72/66/194267266.db2.gz	SBXVKWGVDCVFTK-CQSZACIVSA-N	0	3	313.417	2.147	10	0		DEAEHN
CC[C@H](C(N)=S)N1CCN(c2nc3ccccc3s2)CC1	ZINC000109471417	194267354	/nfs/dbraw/zinc/26/73/54/194267354.db2.gz	MCPUOAULOQSCFN-GFCCVEGCSA-N	0	3	320.487	2.483	10	0		DEAEHN
CC[C@H]1CN([C@@H](CN)c2ccc(Br)o2)CCN1C	ZINC000110711337	194353636	/nfs/dbraw/zinc/35/36/36/194353636.db2.gz	YVKPGXJWXBMSKY-QWRGUYRKSA-N	0	3	316.243	2.068	10	0		DEAEHN
Cc1n[nH]c(C)c1CCC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000111139391	194393936	/nfs/dbraw/zinc/39/39/36/194393936.db2.gz	AGGGVNHKUCLYHT-QGZVFWFLSA-N	0	3	314.433	2.378	10	0		DEAEHN
Cc1nnc(NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)s1	ZINC000056557090	184015699	/nfs/dbraw/zinc/01/56/99/184015699.db2.gz	YUQIAULXBGNUOB-ZDUSSCGKSA-N	0	3	319.434	2.141	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000057870062	184059729	/nfs/dbraw/zinc/05/97/29/184059729.db2.gz	DKAIBFDLCLFOPX-NWDGAFQWSA-N	0	3	307.360	2.455	10	0		DEAEHN
CCCN[C@H](Cc1cc(Cl)ccc1OC)CS(C)(=O)=O	ZINC000060706361	184154351	/nfs/dbraw/zinc/15/43/51/184154351.db2.gz	HDKNNUUIRCVJFE-CYBMUJFWSA-N	0	3	319.854	2.304	10	0		DEAEHN
[NH3+]Cc1ccccc1S(=O)(=O)[N-]c1cc(F)c(F)cc1F	ZINC000061094193	184161699	/nfs/dbraw/zinc/16/16/99/184161699.db2.gz	PUXJBKBFVLIHQI-UHFFFAOYSA-N	0	3	316.304	2.363	10	0		DEAEHN
CNC(C)(C)C(=O)Nc1ccccc1I	ZINC000061300342	184167645	/nfs/dbraw/zinc/16/76/45/184167645.db2.gz	HWSHSNOXXZQWAO-UHFFFAOYSA-N	0	3	318.158	2.228	10	0		DEAEHN
O=C(NCc1cc(F)cc(F)c1)N1CCCN(C2CC2)CC1	ZINC000061859948	184190083	/nfs/dbraw/zinc/19/00/83/184190083.db2.gz	ASERYMVYJJYWHY-UHFFFAOYSA-N	0	3	309.360	2.345	10	0		DEAEHN
Cc1ccc([C@@H](N)CN2CCN(CC(F)(F)F)CC2)cc1	ZINC000061941117	184197195	/nfs/dbraw/zinc/19/71/95/184197195.db2.gz	FCSAHLKJVXHVQF-AWEZNQCLSA-N	0	3	301.356	2.175	10	0		DEAEHN
CN1CC[C@@H](Nc2cccc(I)c2)C1	ZINC000061984928	184200108	/nfs/dbraw/zinc/20/01/08/184200108.db2.gz	LNTWWDUJSVIKKD-LLVKDONJSA-N	0	3	302.159	2.407	10	0		DEAEHN
OC[C@@]1(Nc2ccc(Br)cc2)CCN(C2CC2)C1	ZINC000061992152	184200129	/nfs/dbraw/zinc/20/01/29/184200129.db2.gz	XXPDBYQRTQSGBF-CQSZACIVSA-N	0	3	311.223	2.460	10	0		DEAEHN
COCCCN(C)[C@H](CN)c1ccc(Br)s1	ZINC000062029275	184202333	/nfs/dbraw/zinc/20/23/33/184202333.db2.gz	JKYJRFFUQDBJQT-SECBINFHSA-N	0	3	307.257	2.479	10	0		DEAEHN
CC(C)CN1C(=O)C[C@@H](N)[C@H]1c1ccc(Br)o1	ZINC000062209881	184219984	/nfs/dbraw/zinc/21/99/84/184219984.db2.gz	RAHUNXUMXRYVGE-PELKAZGASA-N	0	3	301.184	2.299	10	0		DEAEHN
CC(C)N1C(=O)CC[C@@H](N)[C@H]1c1ccc(Br)o1	ZINC000062211597	184221501	/nfs/dbraw/zinc/22/15/01/184221501.db2.gz	LXJQOPFMWPHTAJ-PELKAZGASA-N	0	3	301.184	2.441	10	0		DEAEHN
N[C@@H](CNC(=O)c1ccc(Br)o1)c1ccccc1	ZINC000062838060	184255662	/nfs/dbraw/zinc/25/56/62/184255662.db2.gz	UHPLVQCVMILGLW-JTQLQIEISA-N	0	3	309.163	2.472	10	0		DEAEHN
CN(C)[C@@H]1CCN(CC(=O)c2ccccc2Br)C1	ZINC000062966600	184262759	/nfs/dbraw/zinc/26/27/59/184262759.db2.gz	ABGXGWKGLQAVHW-LLVKDONJSA-N	0	3	311.223	2.268	10	0		DEAEHN
CN(C)[C@H]1CCN(CC(=O)c2cccc(Br)c2)C1	ZINC000062966613	184262893	/nfs/dbraw/zinc/26/28/93/184262893.db2.gz	GHTAPRDZSFCUGA-ZDUSSCGKSA-N	0	3	311.223	2.268	10	0		DEAEHN
CCCNc1ncc(C(=O)N2CC[C@H](N(C)C)C2)cc1Cl	ZINC000062984786	184264735	/nfs/dbraw/zinc/26/47/35/184264735.db2.gz	HKFLLRJGYHAPBV-LBPRGKRZSA-N	0	3	310.829	2.333	10	0		DEAEHN
CS(=O)(=O)c1ccc(S[C@H](CN)c2cccnc2)cc1	ZINC000063131265	184272271	/nfs/dbraw/zinc/27/22/71/184272271.db2.gz	UBAHIBRITBUALX-CQSZACIVSA-N	0	3	308.428	2.277	10	0		DEAEHN
CS(=O)(=O)c1ccc(S[C@@H](CN)c2ccncc2)cc1	ZINC000063131272	184272420	/nfs/dbraw/zinc/27/24/20/184272420.db2.gz	DOIKJVOJSVZNAH-AWEZNQCLSA-N	0	3	308.428	2.277	10	0		DEAEHN
[NH3+][C@H]1CCC[C@H]1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000063175785	184276611	/nfs/dbraw/zinc/27/66/11/184276611.db2.gz	KRUMIAREPSYOSA-DTWKUNHWSA-N	0	3	309.218	2.152	10	0		DEAEHN
CCn1nc(C)c(Cl)c1CNCCCCOCCOC	ZINC000159120005	197329335	/nfs/dbraw/zinc/32/93/35/197329335.db2.gz	KRHBFEQGTWYGEQ-UHFFFAOYSA-N	0	3	303.834	2.398	10	0		DEAEHN
CNCC(=O)Nc1ccc(C(=O)N[C@H](C)c2ccccc2)cc1	ZINC000066225877	184397716	/nfs/dbraw/zinc/39/77/16/184397716.db2.gz	HSMAJHVCTRIOQT-CYBMUJFWSA-N	0	3	311.385	2.336	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N(C)CC1(N(C)C)CCC1	ZINC000188003002	207369658	/nfs/dbraw/zinc/36/96/58/207369658.db2.gz	VVKIHWQIBZVLET-CJNGLKHVSA-N	0	3	302.418	2.494	10	0		DEAEHN
CCc1cc(NC(=O)N[C@@H](CN(C)C)c2ccccc2)n(C)n1	ZINC000116507982	194751680	/nfs/dbraw/zinc/75/16/80/194751680.db2.gz	GCOZXFQMUGJMPI-HNNXBMFYSA-N	0	3	315.421	2.407	10	0		DEAEHN
Cc1nn(C)c(CNC[C@@H](C)N2CCCC2)c1Br	ZINC000161252885	197479275	/nfs/dbraw/zinc/47/92/75/197479275.db2.gz	KLWGSHJXANQWCT-SNVBAGLBSA-N	0	3	315.259	2.065	10	0		DEAEHN
COCCC[C@@H](N)C(=O)N(C)[C@H](C)c1ccc(F)c(F)c1	ZINC000159308756	197343601	/nfs/dbraw/zinc/34/36/01/197343601.db2.gz	VFUVHTPYIMAFLX-QMTHXVAHSA-N	0	3	300.349	2.238	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2C[C@@H](C)CC[C@@H]2C)cc(CN)c1F	ZINC000159123563	197329222	/nfs/dbraw/zinc/32/92/22/197329222.db2.gz	MLXWINIGYZIPDA-JQWIXIFHSA-N	0	3	314.426	2.402	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(CC(C)C)C2CC2)cc(CN)c1F	ZINC000159099827	197327366	/nfs/dbraw/zinc/32/73/66/197327366.db2.gz	XKQZKUSAPAKWCD-UHFFFAOYSA-N	0	3	314.426	2.402	10	0		DEAEHN
CN([C@@H](CN)c1ccc(OC(F)(F)F)cc1)[C@@H]1CCOC1	ZINC000158689243	197294796	/nfs/dbraw/zinc/29/47/96/197294796.db2.gz	DMVOMAGKCZKBCI-YPMHNXCESA-N	0	3	304.312	2.306	10	0		DEAEHN
CCN(Cc1cccs1)[C@@H](CN)c1c(C)nn(C)c1OC	ZINC000158382936	197266953	/nfs/dbraw/zinc/26/69/53/197266953.db2.gz	IEZUDULYDVBXSC-ZDUSSCGKSA-N	0	3	308.451	2.321	10	0		DEAEHN
CC(C)[C@@H](O)CC(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000158301281	197261010	/nfs/dbraw/zinc/26/10/10/197261010.db2.gz	RCYASUZMHNWXOT-HOCLYGCPSA-N	0	3	324.490	2.483	10	0		DEAEHN
CC(C)CC[C@@H]1CCCCN1CC(=O)N1CCC[C@H](C(N)=O)C1	ZINC000158131725	197246817	/nfs/dbraw/zinc/24/68/17/197246817.db2.gz	DNNVCHIXIIRZLT-HOTGVXAUSA-N	0	3	323.481	2.001	10	0		DEAEHN
C[C@@H]1C[C@@H](Nc2nc3c(cc2C(N)=S)CCC3)CCN1C	ZINC000158059956	197240261	/nfs/dbraw/zinc/24/02/61/197240261.db2.gz	JOIJUUWXZILAMG-PWSUYJOCSA-N	0	3	304.463	2.099	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)C2(C(N)=S)CCCCCC2)CCN1C	ZINC000157999122	197234492	/nfs/dbraw/zinc/23/44/92/197234492.db2.gz	RANYRRVJPMRLML-STQMWFEESA-N	0	3	311.495	2.212	10	0		DEAEHN
Cc1ncc(CNC2CCS(=O)CC2)n1-c1ccccc1	ZINC000157978753	197232171	/nfs/dbraw/zinc/23/21/71/197232171.db2.gz	ZPJCODUWIOXQMC-UHFFFAOYSA-N	0	3	303.431	2.181	10	0		DEAEHN
CCNC(=O)NC(=O)CN[C@H](C)c1ccc(CC(C)C)cc1	ZINC000120300581	195139437	/nfs/dbraw/zinc/13/94/37/195139437.db2.gz	QAGVOTPNIURCHZ-CYBMUJFWSA-N	0	3	305.422	2.381	10	0		DEAEHN
CCNc1nc(NCC(C)(C)SC)nc(N2CCCC2)n1	ZINC000157558861	197198206	/nfs/dbraw/zinc/19/82/06/197198206.db2.gz	UWJZDOYOEUMPIA-UHFFFAOYSA-N	0	3	310.471	2.457	10	0		DEAEHN
Cc1cccc(F)c1NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000157252495	197173667	/nfs/dbraw/zinc/17/36/67/197173667.db2.gz	ODWCFFSFHSKSIW-ZDUSSCGKSA-N	0	3	323.412	2.165	10	0		DEAEHN
Cc1cc(Br)cn(CCNCc2cccnc2)c1=O	ZINC000156972814	197153230	/nfs/dbraw/zinc/15/32/30/197153230.db2.gz	CTWQWNMNNWJJSO-UHFFFAOYSA-N	0	3	322.206	2.104	10	0		DEAEHN
CC(C)N1CCCC[C@@H]1C(=O)N1CCC(c2cc[nH]n2)CC1	ZINC000156674588	197131803	/nfs/dbraw/zinc/13/18/03/197131803.db2.gz	FSRAJZGVBCGZIE-MRXNPFEDSA-N	0	3	304.438	2.379	10	0		DEAEHN
Cc1cc(N2CCO[C@H]3CCCC[C@@H]32)c(C(N)=S)c(C)n1	ZINC000156660543	197131481	/nfs/dbraw/zinc/13/14/81/197131481.db2.gz	DMKAGMSUNJNQFW-JSGCOSHPSA-N	0	3	305.447	2.480	10	0		DEAEHN
C[C@@H](CO)[C@@H](C)NCc1cc(Br)cc2c1OCC2	ZINC000156019351	197080810	/nfs/dbraw/zinc/08/08/10/197080810.db2.gz	OIOYUIDFALWOPL-VHSXEESVSA-N	0	3	314.223	2.491	10	0		DEAEHN
CCc1ncc(NC(=O)c2ccccc2OCCN(C)C)cn1	ZINC000155644443	197074548	/nfs/dbraw/zinc/07/45/48/197074548.db2.gz	ODYRYYVCLLZYKY-UHFFFAOYSA-N	0	3	314.389	2.232	10	0		DEAEHN
COC(=O)Nc1ccc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc1	ZINC000155520987	197062717	/nfs/dbraw/zinc/06/27/17/197062717.db2.gz	ISKKCTURWQPAAS-WFASDCNBSA-N	0	3	319.405	2.323	10	0		DEAEHN
CC(=O)Nc1ccccc1CN1CCC[C@H](Cn2cncn2)C1	ZINC000155226980	197034101	/nfs/dbraw/zinc/03/41/01/197034101.db2.gz	SRFFTCCEGDEPPH-HNNXBMFYSA-N	0	3	313.405	2.149	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(N(C)C)cc2F)CCN1C	ZINC000155087955	197020814	/nfs/dbraw/zinc/02/08/14/197020814.db2.gz	CXRPTPNSADYDGT-OCCSQVGLSA-N	0	3	307.413	2.446	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2ccc(N(C)C)cc2F)CCN1C	ZINC000155087837	197020630	/nfs/dbraw/zinc/02/06/30/197020630.db2.gz	CXRPTPNSADYDGT-GXTWGEPZSA-N	0	3	307.413	2.446	10	0		DEAEHN
COc1cccc(C(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)c1[O-]	ZINC000120810244	195241769	/nfs/dbraw/zinc/24/17/69/195241769.db2.gz	IOARVMMXLBVOSM-CYBMUJFWSA-N	0	3	306.406	2.251	10	0		DEAEHN
COc1cccc(C(=O)NC[C@H]2CCC[N@H+]2CC(C)C)c1[O-]	ZINC000120810244	195241770	/nfs/dbraw/zinc/24/17/70/195241770.db2.gz	IOARVMMXLBVOSM-CYBMUJFWSA-N	0	3	306.406	2.251	10	0		DEAEHN
Cc1noc([C@@H]2COC[C@@H]3CN(Cc4scnc4C)C[C@@H]32)n1	ZINC000248046908	257109995	/nfs/dbraw/zinc/10/99/95/257109995.db2.gz	VUEQVVOASNQDMX-RWMBFGLXSA-N	0	3	320.418	2.005	10	0		DEAEHN
Cc1nnc(C[C@@H]2C[C@@H]3CN(Cc4cccs4)C[C@@H]3O2)o1	ZINC000248009342	257112148	/nfs/dbraw/zinc/11/21/48/257112148.db2.gz	IPRYMYWOXMMCQX-DYEKYZERSA-N	0	3	305.403	2.272	10	0		DEAEHN
O=C(C[C@@H]1OC[C@@H]2CN(Cc3ccoc3)CC[C@H]12)NCC1CC1	ZINC000247765415	257118228	/nfs/dbraw/zinc/11/82/28/257118228.db2.gz	KILRMCFZXMKVGA-ULQDDVLXSA-N	0	3	318.417	2.033	10	0		DEAEHN
Cc1ccsc1CN1C[C@@H]2OC[C@@H](CN3CCCC3=O)[C@@H]2C1	ZINC000253599837	257104493	/nfs/dbraw/zinc/10/44/93/257104493.db2.gz	VHHTZTVGWSEESK-ILXRZTDVSA-N	0	3	320.458	2.126	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C)c1	ZINC000121822652	195355383	/nfs/dbraw/zinc/35/53/83/195355383.db2.gz	JKSKAVRRJRMWDJ-MRXNPFEDSA-N	0	3	319.449	2.334	10	0		DEAEHN
CCN[C@H]1CCCS(=O)(=O)c2cc3c(cc21)OCCCO3	ZINC000124441443	195641878	/nfs/dbraw/zinc/64/18/78/195641878.db2.gz	KHYJNRFYVFXALY-LBPRGKRZSA-N	0	3	311.403	2.066	10	0		DEAEHN
CCCn1cc(S(=O)(=O)NC[C@H](C)C(C)(C)C)cc1CN	ZINC000126125918	195812925	/nfs/dbraw/zinc/81/29/25/195812925.db2.gz	RMGVNYPPJHTCDV-LBPRGKRZSA-N	0	3	315.483	2.317	10	0		DEAEHN
COc1ccc(CNC(=O)CN2CCCC23CCC3)cc1OC	ZINC000444774881	533581817	/nfs/dbraw/zinc/58/18/17/533581817.db2.gz	KZOOWOCHCICXOA-UHFFFAOYSA-N	0	3	318.417	2.339	10	0		DEAEHN
Cc1ccc([C@H](C)N[C@H]2CCN(C3CCOCC3)C2=O)cc1	ZINC000358182584	133126679	/nfs/dbraw/zinc/12/66/79/133126679.db2.gz	CSXIIHJSWCEAPA-YOEHRIQHSA-N	0	3	302.418	2.426	10	0		DEAEHN
CCCN(CC)C[C@H](C)NC(=O)C(=O)c1cnn(C(C)(C)C)c1	ZINC000359747046	133142076	/nfs/dbraw/zinc/14/20/76/133142076.db2.gz	WROWRICRKVMPFL-ZDUSSCGKSA-N	0	3	322.453	2.057	10	0		DEAEHN
c1cn2c(cccc2CN2CCC(c3nnc4n3CCC4)CC2)n1	ZINC000362034862	133206768	/nfs/dbraw/zinc/20/67/68/133206768.db2.gz	CISDTAHRWBBHMT-UHFFFAOYSA-N	0	3	322.416	2.252	10	0		DEAEHN
CC(=O)c1cc(C(=O)N2CCC(N(C)C)CC2)c(C)nc1C	ZINC000362844769	133254832	/nfs/dbraw/zinc/25/48/32/133254832.db2.gz	XQJOSRRFTCIJRR-UHFFFAOYSA-N	0	3	303.406	2.067	10	0		DEAEHN
CN1CC=C(CNC(=O)Nc2cccc3c2OCCC3)CC1	ZINC000376852993	133310097	/nfs/dbraw/zinc/31/00/97/133310097.db2.gz	ZHFOMMAXPBUZJN-UHFFFAOYSA-N	0	3	301.390	2.395	10	0		DEAEHN
C[C@H](Cn1nnc(-c2ccc(Br)cc2)n1)N(C)C	ZINC000358853988	147218935	/nfs/dbraw/zinc/21/89/35/147218935.db2.gz	NVQGCUOJMGWFJJ-SECBINFHSA-N	0	3	310.199	2.053	10	0		DEAEHN
COC1(C[C@H](C)NC2CC([N@@H+](CC(=O)[O-])CC3CC3)C2)CCC1	ZINC000263524751	292125057	/nfs/dbraw/zinc/12/50/57/292125057.db2.gz	STNFKXAYXXSKRY-JEYLPNPQSA-N	0	3	324.465	2.251	10	0		DEAEHN
COC1(C[C@H](C)NC2CC([N@H+](CC(=O)[O-])CC3CC3)C2)CCC1	ZINC000263524751	292125058	/nfs/dbraw/zinc/12/50/58/292125058.db2.gz	STNFKXAYXXSKRY-JEYLPNPQSA-N	0	3	324.465	2.251	10	0		DEAEHN
CCc1onc(C)c1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1	ZINC000187772536	145003070	/nfs/dbraw/zinc/00/30/70/145003070.db2.gz	SBPPNXWYUBPJKN-BETUJISGSA-N	0	3	323.437	2.165	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1cc(F)cc2[nH]cnc21	ZINC000188739304	145016954	/nfs/dbraw/zinc/01/69/54/145016954.db2.gz	PZTFKHIPNZDERB-UHFFFAOYSA-N	0	3	310.332	2.235	10	0		DEAEHN
CCN1CCN([C@H](C)CNc2ncnc3c(C)csc32)CC1	ZINC000189973416	145036695	/nfs/dbraw/zinc/03/66/95/145036695.db2.gz	LRHWMABXEMTXJA-CYBMUJFWSA-N	0	3	319.478	2.438	10	0		DEAEHN
CC1(C)CN(CCC(=O)N2CCOCC2)CC[C@H]1C(F)(F)F	ZINC000190203501	145039110	/nfs/dbraw/zinc/03/91/10/145039110.db2.gz	FKWDGFLYBIZZCC-GFCCVEGCSA-N	0	3	322.371	2.146	10	0		DEAEHN
CCc1nc(C2CCN(C[C@H](O)c3ccccc3F)CC2)n[nH]1	ZINC000190694494	145046370	/nfs/dbraw/zinc/04/63/70/145046370.db2.gz	VCZDJCVVYXPPGS-HNNXBMFYSA-N	0	3	318.396	2.419	10	0		DEAEHN
CCc1n[nH]c(C2CCN(C[C@H](O)c3ccccc3F)CC2)n1	ZINC000190694494	145046372	/nfs/dbraw/zinc/04/63/72/145046372.db2.gz	VCZDJCVVYXPPGS-HNNXBMFYSA-N	0	3	318.396	2.419	10	0		DEAEHN
CCc1nnc(C2CCN(C[C@H](O)c3ccccc3F)CC2)[nH]1	ZINC000190694494	145046373	/nfs/dbraw/zinc/04/63/73/145046373.db2.gz	VCZDJCVVYXPPGS-HNNXBMFYSA-N	0	3	318.396	2.419	10	0		DEAEHN
CCCOc1nc(C)ccc1C(=O)NC[C@@H](C)N(C)C1CC1	ZINC000191149088	145053684	/nfs/dbraw/zinc/05/36/84/145053684.db2.gz	MPGFUALUNCYNRR-CYBMUJFWSA-N	0	3	305.422	2.391	10	0		DEAEHN
COc1cccc(CN(CCN(C)C)C(=O)CCSC)c1	ZINC000191949058	145068423	/nfs/dbraw/zinc/06/84/23/145068423.db2.gz	XEHWZFMMERRJAL-UHFFFAOYSA-N	0	3	310.463	2.339	10	0		DEAEHN
C[C@@H]1CN(CCN2CCC(Nc3ccccc3F)CC2)CCO1	ZINC000192770746	145078814	/nfs/dbraw/zinc/07/88/14/145078814.db2.gz	BHHSCVVQFNQXMR-OAHLLOKOSA-N	0	3	321.440	2.423	10	0		DEAEHN
C[C@H](NCC(=O)Nc1ccccc1OC(F)F)[C@@H]1CCCO1	ZINC000193130043	145083019	/nfs/dbraw/zinc/08/30/19/145083019.db2.gz	FWKCDHYPJGSYOS-JQWIXIFHSA-N	0	3	314.332	2.384	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2COc3ccccc32)CCN1C	ZINC000246199248	145094274	/nfs/dbraw/zinc/09/42/74/145094274.db2.gz	MXIHQTMFAKKIKS-NFAWXSAZSA-N	0	3	303.406	2.244	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)[C@H]1CSc2ccccc21	ZINC000246350674	145099636	/nfs/dbraw/zinc/09/96/36/145099636.db2.gz	JXHNVNBOTWQZEC-ZFWWWQNUSA-N	0	3	320.458	2.103	10	0		DEAEHN
COc1ccc(OCCN2CCS[C@@H]3COCC[C@H]32)cc1	ZINC000246720193	145112222	/nfs/dbraw/zinc/11/22/22/145112222.db2.gz	FSWIDOJHAZCCOY-HZPDHXFCSA-N	0	3	309.431	2.280	10	0		DEAEHN
COc1ccc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)cc1OC	ZINC000246770713	145114186	/nfs/dbraw/zinc/11/41/86/145114186.db2.gz	QKPGGFLCNILJBB-GJZGRUSLSA-N	0	3	318.417	2.260	10	0		DEAEHN
O[C@H](COc1ccccc1F)CN1CC[C@@H]2OCCC[C@H]2C1	ZINC000246808172	145115006	/nfs/dbraw/zinc/11/50/06/145115006.db2.gz	RVAZPVAWPLOHKK-DZKIICNBSA-N	0	3	309.381	2.066	10	0		DEAEHN
CC(C)N(C(=O)[C@@H](C)N1CC[C@@H](c2cnn(C)c2)C1)C(C)C	ZINC000246876475	145117951	/nfs/dbraw/zinc/11/79/51/145117951.db2.gz	FUJAWGSEMJCQHU-HUUCEWRRSA-N	0	3	306.454	2.243	10	0		DEAEHN
CC[C@@H]1CCC[C@H](NC(=O)NC[C@@H](O)CN2CCCCC2)C1	ZINC000246913952	145119372	/nfs/dbraw/zinc/11/93/72/145119372.db2.gz	CXYMLZSXKPHZAN-OWCLPIDISA-N	0	3	311.470	2.101	10	0		DEAEHN
Cc1cc(C)cc(OCCCN2CCN(C[C@H](C)O)[C@@H](C)C2)c1	ZINC000247214893	145129764	/nfs/dbraw/zinc/12/97/64/145129764.db2.gz	PYXGSKRNQVNDFM-ROUUACIJSA-N	0	3	320.477	2.459	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)COc1ccc(Cl)cc1	ZINC000247311628	145132658	/nfs/dbraw/zinc/13/26/58/145132658.db2.gz	OCFZSKLGRPSHEB-JSGCOSHPSA-N	0	3	308.809	2.414	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c(C)c1	ZINC000247335721	145133887	/nfs/dbraw/zinc/13/38/87/145133887.db2.gz	HGOBDIVBQLSJAF-JKSUJKDBSA-N	0	3	322.474	2.408	10	0		DEAEHN
C[C@H](O)CN1CCN(CCOc2ccc(Cl)cc2)C[C@@H]1C	ZINC000247387384	145135450	/nfs/dbraw/zinc/13/54/50/145135450.db2.gz	WSQMTBHAPRPDSU-KBPBESRZSA-N	0	3	312.841	2.106	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)C(=O)c2ccc3c(c2)CCC3)C1	ZINC000247483878	145138132	/nfs/dbraw/zinc/13/81/32/145138132.db2.gz	WIJYQGZUIZEYTJ-SUMWQHHRSA-N	0	3	314.429	2.203	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)[C@H]1CCCC[C@@H]1C	ZINC000247479492	145138631	/nfs/dbraw/zinc/13/86/31/145138631.db2.gz	JDHFWXZXARDCBB-XHSDSOJGSA-N	0	3	311.470	2.317	10	0		DEAEHN
O=C(N[C@@H]1C[C@@H]1c1cccc(F)c1)N1CCN2CCC[C@H]2C1	ZINC000247656031	145142725	/nfs/dbraw/zinc/14/27/25/145142725.db2.gz	YIHBZWSFUBBLFP-ARFHVFGLSA-N	0	3	303.381	2.171	10	0		DEAEHN
CC(C)Oc1ccc(CN2CCN(C[C@H](C)O)[C@@H](C)C2)cc1	ZINC000247772071	145144053	/nfs/dbraw/zinc/14/40/53/145144053.db2.gz	PMXMJJXZFFMKML-HOTGVXAUSA-N	0	3	306.450	2.361	10	0		DEAEHN
Cc1ccc(OC[C@H](O)CN2CC[C@@]3(O)CCCC[C@H]3C2)cc1	ZINC000247985991	145146210	/nfs/dbraw/zinc/14/62/10/145146210.db2.gz	IUNRXFXFYKHBFA-SCTDSRPQSA-N	0	3	319.445	2.362	10	0		DEAEHN
COC(=O)c1ccc(F)c(CN2CCN3CCCC[C@H]3C2)c1	ZINC000248404347	145153136	/nfs/dbraw/zinc/15/31/36/145153136.db2.gz	QBMNKZUANCVHEZ-HNNXBMFYSA-N	0	3	306.381	2.282	10	0		DEAEHN
C[C@H](NCC(=O)N[C@H](c1ccccc1)C1CC1)[C@@H]1CCCO1	ZINC000248597298	145161154	/nfs/dbraw/zinc/16/11/54/145161154.db2.gz	MTHKOMXLSMRGMF-QANKJYHBSA-N	0	3	302.418	2.411	10	0		DEAEHN
CC(C)OC(=O)C[C@H]1CCCN(C[C@@H](O)COC(C)(C)C)C1	ZINC000248626254	145162138	/nfs/dbraw/zinc/16/21/38/145162138.db2.gz	OCIWVUGEKBDIQV-HUUCEWRRSA-N	0	3	315.454	2.216	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@](C)(Cc1ccccc1)[C@H](C)O)N(C)C	ZINC000248853763	145170075	/nfs/dbraw/zinc/17/00/75/145170075.db2.gz	CVPCLDBAIPKEDZ-KVSKMBFKSA-N	0	3	320.477	2.463	10	0		DEAEHN
Cn1ccnc1C[C@@H]1CCCN(C[C@H]2CC3(CCC3)C(=O)O2)C1	ZINC000248877688	145171309	/nfs/dbraw/zinc/17/13/09/145171309.db2.gz	OLJWULHSMVFJMQ-LSDHHAIUSA-N	0	3	317.433	2.160	10	0		DEAEHN
C[C@@H](CNC(=O)[C@@H]1CCCO[C@H]1C)N(C)Cc1ccccc1	ZINC000251257367	145194138	/nfs/dbraw/zinc/19/41/38/145194138.db2.gz	YGRZZUYBNXEYAR-YQQAZPJKSA-N	0	3	304.434	2.438	10	0		DEAEHN
C[C@@H](CCc1ccccc1)NC(=O)N1CCN2CCC[C@H]2C1	ZINC000252442119	145199007	/nfs/dbraw/zinc/19/90/07/145199007.db2.gz	QKCIZOKMARHXRS-RDJZCZTQSA-N	0	3	301.434	2.497	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N1CC[C@H]2CC[C@@H](C1)N2C	ZINC000253203960	145201414	/nfs/dbraw/zinc/20/14/14/145201414.db2.gz	HNTLNTABPPVDTJ-CABCVRRESA-N	0	3	321.396	2.212	10	0		DEAEHN
Cc1ccc(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(=O)[nH]1	ZINC000253556119	145203237	/nfs/dbraw/zinc/20/32/37/145203237.db2.gz	JPFCHXYBOIJEFF-CVEARBPZSA-N	0	3	311.385	2.271	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)Nc1ccc2c(c1)CCO2	ZINC000261640005	145212125	/nfs/dbraw/zinc/21/21/25/145212125.db2.gz	DSYFXQHANLLIRE-JCKWVBRZSA-N	0	3	316.401	2.093	10	0		DEAEHN
C[C@H](C(=O)N1C[C@@H]2CCCCN2C[C@@H]1C)[C@H](N)c1ccccc1	ZINC000261737738	145222125	/nfs/dbraw/zinc/22/21/25/145222125.db2.gz	NQEHMCIDXFYYSS-LAQRGFTBSA-N	0	3	315.461	2.408	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000261862034	145234649	/nfs/dbraw/zinc/23/46/49/145234649.db2.gz	KKLNNVDSAHHAHM-INIZCTEOSA-N	0	3	319.424	2.253	10	0		DEAEHN
Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)C2(N)CCOCC2)C1	ZINC000261868181	145235394	/nfs/dbraw/zinc/23/53/94/145235394.db2.gz	NWWKGXSABSCRSC-GJZGRUSLSA-N	0	3	302.418	2.207	10	0		DEAEHN
N[C@@H](CC1CCCCC1)C(=O)NC[C@H]1COc2ccccc2O1	ZINC000261882775	145237401	/nfs/dbraw/zinc/23/74/01/145237401.db2.gz	MUOPOGYMKPLSDC-GJZGRUSLSA-N	0	3	318.417	2.240	10	0		DEAEHN
Cc1ccccc1CCNC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C	ZINC000261923200	145242713	/nfs/dbraw/zinc/24/27/13/145242713.db2.gz	RXUMEMPZMYVMEZ-TXPKVOOTSA-N	0	3	316.445	2.186	10	0		DEAEHN
CN(Cc1ccc(F)cc1)C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C	ZINC000261973999	145248223	/nfs/dbraw/zinc/24/82/23/145248223.db2.gz	ZJYWFYKKGDZVSU-IIDMSEBBSA-N	0	3	320.408	2.317	10	0		DEAEHN
CCC[C@](C)(N)C(=O)N1CCC[C@H](c2noc(C3CC3)n2)C1	ZINC000262324270	145276738	/nfs/dbraw/zinc/27/67/38/145276738.db2.gz	SMPFAHYJNRPERU-LRDDRELGSA-N	0	3	306.410	2.171	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC(=O)[C@@H]2C[C@H](C)CCN2)c1	ZINC000262490925	145287685	/nfs/dbraw/zinc/28/76/85/145287685.db2.gz	LAQFSFXDILFOAN-XUJVJEKNSA-N	0	3	306.406	2.269	10	0		DEAEHN
CC[C@@H](C)[C@H](N)C(=O)NCc1cc(OC)nc2ccccc12	ZINC000262708630	145301341	/nfs/dbraw/zinc/30/13/41/145301341.db2.gz	OEPHTRKCYGQBLK-BZNIZROVSA-N	0	3	301.390	2.233	10	0		DEAEHN
COc1ccccc1/C(C)=C/c1nc([C@@H]2CNCCN2C)no1	ZINC000263130999	145328034	/nfs/dbraw/zinc/32/80/34/145328034.db2.gz	BQUNEUUNXRMHQD-WONIAPNHSA-N	0	3	314.389	2.215	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(Cc2cccc3ccccc32)n1	ZINC000263182096	145333472	/nfs/dbraw/zinc/33/34/72/145333472.db2.gz	GWVUARBGIWFZKZ-INIZCTEOSA-N	0	3	308.385	2.390	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2ccc(OC(C)(C)C)cc2)n1	ZINC000263211755	145336433	/nfs/dbraw/zinc/33/64/33/145336433.db2.gz	KIOGRQBHVFDFJQ-AWEZNQCLSA-N	0	3	316.405	2.490	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(CCc2ccc(Cl)s2)n1	ZINC000263210063	145336708	/nfs/dbraw/zinc/33/67/08/145336708.db2.gz	KEJMYSGZWQNWMR-SNVBAGLBSA-N	0	3	312.826	2.146	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NCc1c(Br)cnn1C	ZINC000336793070	145397498	/nfs/dbraw/zinc/39/74/98/145397498.db2.gz	VHSIRHBVCNVHAK-NSHDSACASA-N	0	3	317.275	2.249	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@H](C)N2CCCC[C@@H]2C)C1	ZINC000358604979	147165367	/nfs/dbraw/zinc/16/53/67/147165367.db2.gz	MTGKRFHUYRZGQE-GJZGRUSLSA-N	0	3	311.470	2.317	10	0		DEAEHN
C[C@@H](CSc1n[nH]c(=O)n1CCc1ccccc1)N(C)C	ZINC000358850877	147219409	/nfs/dbraw/zinc/21/94/09/147219409.db2.gz	GYILAIOIVVRTLR-LBPRGKRZSA-N	0	3	306.435	2.269	10	0		DEAEHN
C[C@H](C(=O)NCc1ccc2cc[nH]c2n1)N1CCCCCC1	ZINC000359407017	147322476	/nfs/dbraw/zinc/32/24/76/147322476.db2.gz	BNVNPTNGXQVMOU-CYBMUJFWSA-N	0	3	300.406	2.444	10	0		DEAEHN
CC1=CCN(CCN[C@@H](C)c2ccc3c(c2)OCC(=O)N3)CC1	ZINC000565497285	292166137	/nfs/dbraw/zinc/16/61/37/292166137.db2.gz	PHHUCYGUCGYSDW-AWEZNQCLSA-N	0	3	315.417	2.320	10	0		DEAEHN
O=C(Nc1cccc2c1OCCC2)N1CC[C@H](N2CC=CC2)C1	ZINC000370537937	148028637	/nfs/dbraw/zinc/02/86/37/148028637.db2.gz	HYQMXERRJCLYQZ-HNNXBMFYSA-N	0	3	313.401	2.490	10	0		DEAEHN
O=C1C[C@@H](NCC2=CCCOC2)CN1c1ccccc1Cl	ZINC000370758117	148052580	/nfs/dbraw/zinc/05/25/80/148052580.db2.gz	RAUAJAIKBKZDHW-CYBMUJFWSA-N	0	3	306.793	2.382	10	0		DEAEHN
C/C(=C\c1ccc(C)cc1)C(=O)NC[C@@H]1CN2CCC[C@H]2CO1	ZINC000371500268	148110236	/nfs/dbraw/zinc/11/02/36/148110236.db2.gz	MKGSGZUYICKQOW-SVEZXWBTSA-N	0	3	314.429	2.378	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC[C@H](n3cc(C)cn3)C2)C1	ZINC000111836811	401725431	/nfs/dbraw/zinc/72/54/31/401725431.db2.gz	LBIMDHKDFNDUFF-CVEARBPZSA-N	0	3	319.453	2.022	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1c2ccccc2C[C@@H]1C	ZINC000111865946	401726191	/nfs/dbraw/zinc/72/61/91/401726191.db2.gz	XYQCVSQGDYWPOY-GOEBONIOSA-N	0	3	317.433	2.258	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N([C@@H](C)C1CC1)C1CC1	ZINC000074167316	401731748	/nfs/dbraw/zinc/73/17/48/401731748.db2.gz	MGKIAVDARJONTE-BBRMVZONSA-N	0	3	309.454	2.070	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cc(F)cc3nc[nH]c32)CCN1C	ZINC000127634285	401743184	/nfs/dbraw/zinc/74/31/84/401743184.db2.gz	NYMRPTFDUUZBKS-ZYHUDNBSSA-N	0	3	304.369	2.257	10	0		DEAEHN
Fc1cc(Br)ccc1CNCCCn1ccnn1	ZINC000126472438	401695704	/nfs/dbraw/zinc/69/57/04/401695704.db2.gz	MVERFKQQYBWVKY-UHFFFAOYSA-N	0	3	313.174	2.360	10	0		DEAEHN
CN[C@H](C(=O)N[C@@H](CC(C)C)C(=O)Nc1ccccc1)C(C)C	ZINC000002561158	401714800	/nfs/dbraw/zinc/71/48/00/401714800.db2.gz	JEHIFQTZKVQDNQ-HOTGVXAUSA-N	0	3	319.449	2.400	10	0		DEAEHN
C[C@H](CNC(=O)N1CCCN(C2CC2)CC1)Oc1ccccc1	ZINC000073230470	401716896	/nfs/dbraw/zinc/71/68/96/401716896.db2.gz	SQXVZDKIEOVRLD-OAHLLOKOSA-N	0	3	317.433	2.334	10	0		DEAEHN
CCC(C)(C)C(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000114415773	401798549	/nfs/dbraw/zinc/79/85/49/401798549.db2.gz	KYARDVIGEJHZGO-UHFFFAOYSA-N	0	3	318.465	2.228	10	0		DEAEHN
CN(C)Cc1ccc(N2CCN(C(=O)CC(C)(C)C)CC2)nc1	ZINC000114413833	401798676	/nfs/dbraw/zinc/79/86/76/401798676.db2.gz	SCYYSLQIEVAEEL-UHFFFAOYSA-N	0	3	318.465	2.228	10	0		DEAEHN
CN(C(=O)CN[C@@H]1CCCC[C@@H]1n1cccn1)c1nccs1	ZINC000127963267	401757646	/nfs/dbraw/zinc/75/76/46/401757646.db2.gz	SHINZWWXXKGVLU-OLZOCXBDSA-N	0	3	319.434	2.076	10	0		DEAEHN
O=C(CN[C@@H]1CCCC[C@@H]1n1cccn1)Nc1nccs1	ZINC000128041376	401760136	/nfs/dbraw/zinc/76/01/36/401760136.db2.gz	IEUVRKQSUAYHAK-NEPJUHHUSA-N	0	3	305.407	2.052	10	0		DEAEHN
CCc1cnc(CCNC(=O)NC[C@H]2CCCCN2CC)s1	ZINC000075811051	401769091	/nfs/dbraw/zinc/76/90/91/401769091.db2.gz	QVUNFHMGQXVNFO-CYBMUJFWSA-N	0	3	324.494	2.422	10	0		DEAEHN
COC(=O)Nc1cccc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000113229639	401772001	/nfs/dbraw/zinc/77/20/01/401772001.db2.gz	PTRFBGHOTHHAHQ-IUODEOHRSA-N	0	3	317.389	2.174	10	0		DEAEHN
CC1CCN(C(=O)CN[C@H]2CCCC[C@H]2n2cccn2)CC1	ZINC000128422285	401775862	/nfs/dbraw/zinc/77/58/62/401775862.db2.gz	JIUDFLLNFBUAKA-JKSUJKDBSA-N	0	3	304.438	2.215	10	0		DEAEHN
CCc1ccc([C@@H]2CCCCN2C(=O)C(C)S(C)(=O)=O)o1	ZINC000128557753	401782542	/nfs/dbraw/zinc/78/25/42/401782542.db2.gz	ZOQPWSQMEAGBOM-YPMHNXCESA-N	0	3	313.419	2.329	10	0		DEAEHN
COc1ccc(CC(=O)N[C@@H](CC(C)C)CN(C)C)cc1OC	ZINC000077730528	401827794	/nfs/dbraw/zinc/82/77/94/401827794.db2.gz	WFNPNGQUQGQTMS-HNNXBMFYSA-N	0	3	322.449	2.339	10	0		DEAEHN
CC(C)CC[C@](C)(O)CNC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000077776962	401830874	/nfs/dbraw/zinc/83/08/74/401830874.db2.gz	NTAIVTVQHJLVRP-WBVHZDCISA-N	0	3	315.502	2.449	10	0		DEAEHN
O=C(NCc1ccccc1CN1CCCCC1)N1CCOCC1	ZINC000027337218	401844569	/nfs/dbraw/zinc/84/45/69/401844569.db2.gz	JEUIFPQFYDLGAT-UHFFFAOYSA-N	0	3	317.433	2.214	10	0		DEAEHN
O=C(NC1CCN(CCn2ccnc2)CC1)C1CCCCC1	ZINC000131844728	401858036	/nfs/dbraw/zinc/85/80/36/401858036.db2.gz	LLLLZORVZGDOCC-UHFFFAOYSA-N	0	3	304.438	2.044	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2cc3c(s2)CCCC3)CCO1	ZINC000116796253	401859222	/nfs/dbraw/zinc/85/92/22/401859222.db2.gz	WNUURAHSLSHQTO-CYBMUJFWSA-N	0	3	308.447	2.030	10	0		DEAEHN
Cc1ccc(CCC(=O)N2CCO[C@H](CN(C)C)C2)c(C)c1	ZINC000116791935	401859474	/nfs/dbraw/zinc/85/94/74/401859474.db2.gz	GESGYSTURDCUIL-QGZVFWFLSA-N	0	3	304.434	2.025	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)N(C)CCOc2ccccc2)[C@@H](C)C1	ZINC000132390523	401866137	/nfs/dbraw/zinc/86/61/37/401866137.db2.gz	PQTUYMRTJXHCFX-RDJZCZTQSA-N	0	3	319.449	2.436	10	0		DEAEHN
Cc1cc(C)c(CNC(=O)N2CCO[C@H](CN(C)C)C2)c(C)c1	ZINC000117040562	401867973	/nfs/dbraw/zinc/86/79/73/401867973.db2.gz	PHDFKRQGJGAXNW-MRXNPFEDSA-N	0	3	319.449	2.084	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(=O)NCCCN2CCc3ccccc3C2)O1	ZINC000129961261	401813094	/nfs/dbraw/zinc/81/30/94/401813094.db2.gz	UKAYDBXVLHJPDW-PBHICJAKSA-N	0	3	302.418	2.119	10	0		DEAEHN
CCc1noc(CC)c1CC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000087192634	401929055	/nfs/dbraw/zinc/92/90/55/401929055.db2.gz	XMGPLOMPDARYCO-CYBMUJFWSA-N	0	3	309.454	2.434	10	0		DEAEHN
C[C@H](NC(=O)N[C@@H](Cc1ccccc1)CN(C)C)[C@H]1CCCO1	ZINC000079733357	401880666	/nfs/dbraw/zinc/88/06/66/401880666.db2.gz	DGYCHKRNQFTPTC-BHYGNILZSA-N	0	3	319.449	2.026	10	0		DEAEHN
C[C@@H](CCC(=O)N1CCO[C@@H](CN(C)C)C1)c1ccccc1	ZINC000133317041	401881961	/nfs/dbraw/zinc/88/19/61/401881961.db2.gz	JHKYUFGXXWPIJT-RDJZCZTQSA-N	0	3	304.434	2.359	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(F)c(C)c1	ZINC000118020009	401889247	/nfs/dbraw/zinc/88/92/47/401889247.db2.gz	PUMUJISCLKZLPV-CQSZACIVSA-N	0	3	309.385	2.366	10	0		DEAEHN
CO[C@H](C)c1cccc(NC(=O)N2CCO[C@H](CN(C)C)C2)c1	ZINC000118816194	401909852	/nfs/dbraw/zinc/90/98/52/401909852.db2.gz	PXVSYMRWRXQSQL-CZUORRHYSA-N	0	3	321.421	2.188	10	0		DEAEHN
COCCC1(CNC(=O)N[C@H](CC(C)C)CN(C)C)CCC1	ZINC000119845403	401968920	/nfs/dbraw/zinc/96/89/20/401968920.db2.gz	LKGKCBKYKBDYSP-OAHLLOKOSA-N	0	3	313.486	2.469	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)C(=O)Nc2ccccc2Cl)C1	ZINC000150778732	401995345	/nfs/dbraw/zinc/99/53/45/401995345.db2.gz	LTKDGQBBOFVCKP-RISCZKNCSA-N	0	3	323.824	2.123	10	0		DEAEHN
COC(=O)[C@H]1C[C@@H](c2ccccc2)CN(Cc2cncn2C)C1	ZINC000135465019	401940706	/nfs/dbraw/zinc/94/07/06/401940706.db2.gz	IZTUDPUKWSWPPB-CVEARBPZSA-N	0	3	313.401	2.199	10	0		DEAEHN
CCCN(CCN(CC)CC)S(=O)(=O)N1CCC[C@H](C)C1	ZINC000119391916	401947182	/nfs/dbraw/zinc/94/71/82/401947182.db2.gz	YRZKWTKOQDRTMU-HNNXBMFYSA-N	0	3	319.515	2.017	10	0		DEAEHN
O=S(=O)([C@@H]1CCN(CCCc2ccccc2)C1)N1CCCC1	ZINC000135661435	401950257	/nfs/dbraw/zinc/95/02/57/401950257.db2.gz	GLQFRYXENBXYMZ-QGZVFWFLSA-N	0	3	322.474	2.119	10	0		DEAEHN
C[C@H](CN[C@H](C)c1nc2c(s1)CCCC2)N1CCOCC1	ZINC000093371633	402014372	/nfs/dbraw/zinc/01/43/72/402014372.db2.gz	FIKPEJKMVQNTEO-CHWSQXEVSA-N	0	3	309.479	2.393	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@@H](CNCC(=O)c2ccc[nH]2)C1	ZINC000095083944	402024649	/nfs/dbraw/zinc/02/46/49/402024649.db2.gz	RIULAXQHBAQVIW-LBPRGKRZSA-N	0	3	307.394	2.044	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@H](Oc2cccnc2)C1)N1CCCCCC1	ZINC000151524543	402041654	/nfs/dbraw/zinc/04/16/54/402041654.db2.gz	WBFGLVOAWABVOM-WBVHZDCISA-N	0	3	317.433	2.326	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H](OC)c2ccccc2)C1	ZINC000052523340	402043648	/nfs/dbraw/zinc/04/36/48/402043648.db2.gz	UXMUHMBIUWLBOW-HOTGVXAUSA-N	0	3	305.422	2.158	10	0		DEAEHN
CC(C)C[C@H](CCO)CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000120861441	402004788	/nfs/dbraw/zinc/00/47/88/402004788.db2.gz	YOYNLUQJBYXUHU-PMPSAXMXSA-N	0	3	313.486	2.155	10	0		DEAEHN
Cc1nn(C)cc1CN1CCC(C(=O)N[C@@H](C)C(C)C)CC1	ZINC000092754567	402008038	/nfs/dbraw/zinc/00/80/38/402008038.db2.gz	XMEOGKXRVPMEOV-ZDUSSCGKSA-N	0	3	306.454	2.101	10	0		DEAEHN
COc1ccc(C(F)(F)C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1	ZINC000151819127	402058631	/nfs/dbraw/zinc/05/86/31/402058631.db2.gz	QKJMRCPBVZVWIB-GXTWGEPZSA-N	0	3	324.371	2.482	10	0		DEAEHN
NC(=O)[C@@H]1CCCN(Cc2cccc(OCC(F)(F)F)c2)C1	ZINC000122300774	402071405	/nfs/dbraw/zinc/07/14/05/402071405.db2.gz	ZOMWTFWJMSQLKA-GFCCVEGCSA-N	0	3	316.323	2.325	10	0		DEAEHN
CC(C)(C)OC[C@H](O)CN1CCC[C@H](c2nnc(C3CC3)[nH]2)C1	ZINC000152284972	402087014	/nfs/dbraw/zinc/08/70/14/402087014.db2.gz	CURAMFPEZCWRNM-UONOGXRCSA-N	0	3	322.453	2.038	10	0		DEAEHN
COCCOc1ccccc1C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000122758704	402093498	/nfs/dbraw/zinc/09/34/98/402093498.db2.gz	IPNMYASCMFJZLA-CABCVRRESA-N	0	3	320.433	2.267	10	0		DEAEHN
C[C@@H](CS(C)(=O)=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000152952622	402118933	/nfs/dbraw/zinc/11/89/33/402118933.db2.gz	KLXSUXMXNMNXMX-DOTOQJQBSA-N	0	3	324.490	2.064	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2Cc3cc(F)ccc3O2)CCN1C	ZINC000123467312	402129180	/nfs/dbraw/zinc/12/91/80/402129180.db2.gz	NNOVPMODMPDZPV-WPGHFRTFSA-N	0	3	306.381	2.070	10	0		DEAEHN
CC[C@@](C)(O)CN(C)C[C@@H](c1cccs1)N1CCOCC1	ZINC000123558325	402134228	/nfs/dbraw/zinc/13/42/28/402134228.db2.gz	FMDDEWRKSZWLRS-GOEBONIOSA-N	0	3	312.479	2.214	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC(c2nncn2C(C)C)CC1)N(C)C	ZINC000153412956	402143394	/nfs/dbraw/zinc/14/33/94/402143394.db2.gz	DXJBRGYDDIUQLN-OAHLLOKOSA-N	0	3	321.469	2.295	10	0		DEAEHN
CCC1(CC)[C@H](NC(=O)N2CC[C@H](N3CC=CC3)C2)C[C@H]1OC	ZINC000123740569	402144030	/nfs/dbraw/zinc/14/40/30/402144030.db2.gz	IEZJJMMVFQGHQN-ARFHVFGLSA-N	0	3	321.465	2.236	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cnc(-c3ccccc3)nc2)C1	ZINC000066921643	402146223	/nfs/dbraw/zinc/14/62/23/402146223.db2.gz	XTKQPRDYNWPGDE-MRXNPFEDSA-N	0	3	310.401	2.358	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)CSCC(F)(F)F	ZINC000153470960	402147623	/nfs/dbraw/zinc/14/76/23/402147623.db2.gz	XHLXYIOBSJRJQP-WDEREUQCSA-N	0	3	310.385	2.367	10	0		DEAEHN
Cc1cccc(CNC(=O)N2CCN(C3CCCC3)CC2)n1	ZINC000123905151	402153434	/nfs/dbraw/zinc/15/34/34/402153434.db2.gz	SCQQYERIBWHKJY-UHFFFAOYSA-N	0	3	302.422	2.160	10	0		DEAEHN
COc1cc([C@H](C)N[C@@H]2CCc3nc(C)nn3C2)ccc1F	ZINC000153528875	402151402	/nfs/dbraw/zinc/15/14/02/402151402.db2.gz	HGORAFGGDJLJBG-GXFFZTMASA-N	0	3	304.369	2.400	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1)N(C)C	ZINC000154088132	402191857	/nfs/dbraw/zinc/19/18/57/402191857.db2.gz	MWLIBKYMWRRTCP-CGTJXYLNSA-N	0	3	317.477	2.496	10	0		DEAEHN
O=C(NC[C@H]1CCCCN1Cc1ccccc1)N1CCOCC1	ZINC000067529146	402161533	/nfs/dbraw/zinc/16/15/33/402161533.db2.gz	ICIYIMLEBLRSRC-QGZVFWFLSA-N	0	3	317.433	2.083	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1Cc1nc(N)c2ccccc2n1	ZINC000154571165	402219081	/nfs/dbraw/zinc/21/90/81/402219081.db2.gz	OMDWDUAUYDDDTE-CQSZACIVSA-N	0	3	322.416	2.382	10	0		DEAEHN
CC[C@H](C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1)N(C)C	ZINC000125258476	402222088	/nfs/dbraw/zinc/22/20/88/402222088.db2.gz	XILYEFQGIKVGNL-RHSMWYFYSA-N	0	3	319.449	2.120	10	0		DEAEHN
CCn1cc(Br)cc1C(=O)N1CC[C@H](N(C)C)C1	ZINC000071140009	402270497	/nfs/dbraw/zinc/27/04/97/402270497.db2.gz	FZBZVFIGZLVGRL-NSHDSACASA-N	0	3	314.227	2.047	10	0		DEAEHN
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NC[C@@H](C)C(C)C	ZINC000176090686	402277584	/nfs/dbraw/zinc/27/75/84/402277584.db2.gz	JMPZKZLZNCOZSZ-CQSZACIVSA-N	0	3	319.449	2.403	10	0		DEAEHN
COC[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000176104836	402278920	/nfs/dbraw/zinc/27/89/20/402278920.db2.gz	APTHQVOFGMOXPT-UXLLHSPISA-N	0	3	304.434	2.438	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000176132632	402282187	/nfs/dbraw/zinc/28/21/87/402282187.db2.gz	CMZFKXHXKQWJLQ-INIZCTEOSA-N	0	3	324.428	2.470	10	0		DEAEHN
CN1CCC(C(=O)NCc2nc3ccccc3n2C2CC2)CC1	ZINC000185103887	402324901	/nfs/dbraw/zinc/32/49/01/402324901.db2.gz	LQSCGDYGBHWWEC-UHFFFAOYSA-N	0	3	312.417	2.329	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2cc(F)ccc2F)C1	ZINC000176257632	402294662	/nfs/dbraw/zinc/29/46/62/402294662.db2.gz	PQCSVLGTQXUYBK-AWEZNQCLSA-N	0	3	311.376	2.291	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000176263859	402295182	/nfs/dbraw/zinc/29/51/82/402295182.db2.gz	NCAMHGFEFYSKTJ-HOCLYGCPSA-N	0	3	319.449	2.449	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1ccc(C)c(C(N)=O)c1	ZINC000176339960	402301037	/nfs/dbraw/zinc/30/10/37/402301037.db2.gz	QLPGPBKHFFICOE-AWEZNQCLSA-N	0	3	318.421	2.042	10	0		DEAEHN
CCC[C@H](N)C(=O)N1CCC([C@H](O)c2ccc(F)cc2)CC1	ZINC000159288495	402320800	/nfs/dbraw/zinc/32/08/00/402320800.db2.gz	BGDGZGXIFMPOGF-JKSUJKDBSA-N	0	3	308.397	2.225	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1ccc(C)cc1C	ZINC000176894844	402347519	/nfs/dbraw/zinc/34/75/19/402347519.db2.gz	BJICERXQZOWZDD-HNNXBMFYSA-N	0	3	317.433	2.185	10	0		DEAEHN
COCCCOc1cccc(NC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000177144364	402375062	/nfs/dbraw/zinc/37/50/62/402375062.db2.gz	ALAMHMLJFJPPAM-HNNXBMFYSA-N	0	3	321.421	2.270	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCc1ccccc1F	ZINC000177298096	402388789	/nfs/dbraw/zinc/38/87/89/402388789.db2.gz	FVUBUWXIGTZMBH-OAHLLOKOSA-N	0	3	307.413	2.494	10	0		DEAEHN
C[C@H](N(C)CC(=O)NCCN1CCc2ccccc21)C1(C)CC1	ZINC000177231078	402383871	/nfs/dbraw/zinc/38/38/71/402383871.db2.gz	DREZVMZXAWOBPK-HNNXBMFYSA-N	0	3	315.461	2.286	10	0		DEAEHN
CC(C)(C)c1cccc(OCCCN2C[C@@H](O)C[C@@H]2CO)c1	ZINC000185137533	402327406	/nfs/dbraw/zinc/32/74/06/402327406.db2.gz	USEFCQRGBFDKJW-CVEARBPZSA-N	0	3	307.434	2.181	10	0		DEAEHN
Cc1ccc(C(=O)N2CCCC[C@@H](N3CCN(C)CC3)C2)cc1	ZINC000176673143	402327753	/nfs/dbraw/zinc/32/77/53/402327753.db2.gz	LWFRFVFYDPUDAT-GOSISDBHSA-N	0	3	315.461	2.237	10	0		DEAEHN
COC(=O)[C@](C)(O)CN[C@H](C)c1ccc(Br)cc1	ZINC000228641935	402339054	/nfs/dbraw/zinc/33/90/54/402339054.db2.gz	QIQFAJBSYNSQKS-NOZJJQNGSA-N	0	3	316.195	2.024	10	0		DEAEHN
COc1cccc(N2CCC[C@@H](NC(=O)C3(N)CCCC3)C2)c1	ZINC000237445956	402408496	/nfs/dbraw/zinc/40/84/96/402408496.db2.gz	YGBUAVHGEKCNMV-CQSZACIVSA-N	0	3	317.433	2.052	10	0		DEAEHN
O=S1(=O)CC[C@H](N[C@@H]2CCC[C@H]3OCC[C@@H]32)c2ccccc21	ZINC000186250973	402414984	/nfs/dbraw/zinc/41/49/84/402414984.db2.gz	YBTGMCUUEOMSST-DMRZNYOFSA-N	0	3	321.442	2.452	10	0		DEAEHN
CC(=O)Nc1nc(C(=O)N[C@@H](C)CN2CCCCCC2)cs1	ZINC000186299221	402418899	/nfs/dbraw/zinc/41/88/99/402418899.db2.gz	WWQCSHCBVLDSGI-NSHDSACASA-N	0	3	324.450	2.096	10	0		DEAEHN
CC[C@@H](NC(=O)N1CC[C@H](N2CCCC2)C1)c1nccs1	ZINC000162645438	402427056	/nfs/dbraw/zinc/42/70/56/402427056.db2.gz	HAUIKQZQJRHSJO-QWHCGFSZSA-N	0	3	308.451	2.474	10	0		DEAEHN
CCn1cc(C2CCN([C@H]3CCCN(C(C)C)C3=O)CC2)cn1	ZINC000177697982	402427994	/nfs/dbraw/zinc/42/79/94/402427994.db2.gz	LBYGWMUCSWIQER-KRWDZBQOSA-N	0	3	318.465	2.482	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H]1CCCN(Cc2ccccc2)C1)N(C)C	ZINC000161540426	402391168	/nfs/dbraw/zinc/39/11/68/402391168.db2.gz	QZPUQQBJZLHLGS-ZWKOTPCHSA-N	0	3	317.477	2.498	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C)C(=O)NCC1CCCCC1	ZINC000245474112	402464818	/nfs/dbraw/zinc/46/48/18/402464818.db2.gz	QPGHGUAIDSLMII-WBVHZDCISA-N	0	3	309.498	2.488	10	0		DEAEHN
Cc1ccc(N2CC[C@H](N(C)C[C@H]3CCCOC3)C2=O)cc1	ZINC000245499092	402466140	/nfs/dbraw/zinc/46/61/40/402466140.db2.gz	XLJUOKUFFWUIRW-WBVHZDCISA-N	0	3	302.418	2.459	10	0		DEAEHN
CO[C@@H]1CC[C@H]2OCCN(CCCCn3ccnc3C)[C@@H]2C1	ZINC000245570518	402471518	/nfs/dbraw/zinc/47/15/18/402471518.db2.gz	GMFCJUCUVAVCGH-BRWVUGGUSA-N	0	3	307.438	2.240	10	0		DEAEHN
COc1cc(CN2CCN3CCCC[C@H]3C2)cc2c1OCCO2	ZINC000245563200	402471717	/nfs/dbraw/zinc/47/17/17/402471717.db2.gz	PNGAPIQFQXOBFY-HNNXBMFYSA-N	0	3	318.417	2.137	10	0		DEAEHN
CC[C@H](COC)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245615579	402474561	/nfs/dbraw/zinc/47/45/61/402474561.db2.gz	CTRVCRWVZHMKIO-OAGGEKHMSA-N	0	3	305.422	2.156	10	0		DEAEHN
COC(C)(C)CNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245654186	402477332	/nfs/dbraw/zinc/47/73/32/402477332.db2.gz	NRIQKEAFDRHESM-CABCVRRESA-N	0	3	305.422	2.156	10	0		DEAEHN
Cc1cccc(O[C@H](C)CNC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000245665367	402477785	/nfs/dbraw/zinc/47/77/85/402477785.db2.gz	DSQSSRUKKTZDLD-CVEARBPZSA-N	0	3	317.433	2.252	10	0		DEAEHN
COC(=O)c1ccccc1CCN1C[C@H]2CCC[C@@H](C1)C2O	ZINC000187048618	402479650	/nfs/dbraw/zinc/47/96/50/402479650.db2.gz	QSQSCIUQOHHPMF-FKEKPDDDSA-N	0	3	303.402	2.109	10	0		DEAEHN
CC(C)(C)OC[C@H](O)CN1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1	ZINC000245703688	402480768	/nfs/dbraw/zinc/48/07/68/402480768.db2.gz	CURAMFPEZCWRNM-ZIAGYGMSSA-N	0	3	322.453	2.038	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N1CCCCCC1	ZINC000178295722	402481079	/nfs/dbraw/zinc/48/10/79/402481079.db2.gz	MJHFXNJSFUYPPP-INIZCTEOSA-N	0	3	304.438	2.059	10	0		DEAEHN
CC(C)CCn1cccc1CN1CCN(C[C@H](C)O)[C@@H](C)C1	ZINC000245786108	402488540	/nfs/dbraw/zinc/48/85/40/402488540.db2.gz	VFUDTDXKUXOYHA-IRXDYDNUSA-N	0	3	307.482	2.421	10	0		DEAEHN
CCOCCN1CCN(Cc2ccc(COC)cc2)C[C@H]1C	ZINC000245811886	402489803	/nfs/dbraw/zinc/48/98/03/402489803.db2.gz	ZKSIOAIXKJKQDO-MRXNPFEDSA-N	0	3	306.450	2.376	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc(OC(F)F)c(F)c1	ZINC000168472210	402496737	/nfs/dbraw/zinc/49/67/37/402496737.db2.gz	RJRPOMOWASRLQN-CQSZACIVSA-N	0	3	307.312	2.304	10	0		DEAEHN
C[C@H](NC(=O)N1CCC[C@@H]2CN(C)CC[C@H]21)c1ccncc1	ZINC000245976106	402501498	/nfs/dbraw/zinc/50/14/98/402501498.db2.gz	OSAIGCCNNHFGTQ-NUEKZKHPSA-N	0	3	302.422	2.268	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2nnc(-c3ccsc3)s2)C1	ZINC000171080663	402555825	/nfs/dbraw/zinc/55/58/25/402555825.db2.gz	KRXJBXTXBXFZTC-JTQLQIEISA-N	0	3	323.447	2.434	10	0		DEAEHN
COCCCOc1ccccc1NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000171080696	402555956	/nfs/dbraw/zinc/55/59/56/402555956.db2.gz	QWNRROJXKLFTFV-CQSZACIVSA-N	0	3	321.421	2.270	10	0		DEAEHN
CSCC[C@H](C)N(C)CC(=O)N1CCO[C@H]2CCCC[C@H]21	ZINC000247208142	402559961	/nfs/dbraw/zinc/55/99/61/402559961.db2.gz	VJNAMUKEIJLYDC-ZNMIVQPWSA-N	0	3	314.495	2.230	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1coc(Br)c1	ZINC000247234091	402560721	/nfs/dbraw/zinc/56/07/21/402560721.db2.gz	MTVMKWNLLXGJLW-ONGXEEELSA-N	0	3	313.195	2.351	10	0		DEAEHN
COc1ccc([O-])c(C(=O)N2CCC(C[NH+]3CCCC3)CC2)c1	ZINC000171138788	402561031	/nfs/dbraw/zinc/56/10/31/402561031.db2.gz	YLBFUWYCTVREHQ-UHFFFAOYSA-N	0	3	318.417	2.349	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)NC[C@@H]1CCCN1C)c1ccco1	ZINC000171192951	402565116	/nfs/dbraw/zinc/56/51/16/402565116.db2.gz	URNRDFNZJOIGCO-LSDHHAIUSA-N	0	3	322.453	2.056	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)CSCc1ccncc1	ZINC000247466926	402568199	/nfs/dbraw/zinc/56/81/99/402568199.db2.gz	RHLYGUPPSKGZHG-ZFWWWQNUSA-N	0	3	305.447	2.010	10	0		DEAEHN
CCOc1ccc(NC(=O)[C@@H](C)N2CCN3CCC[C@@H]3C2)cc1	ZINC000178635990	402520435	/nfs/dbraw/zinc/52/04/35/402520435.db2.gz	HKPAFACEAHXCML-GDBMZVCRSA-N	0	3	317.433	2.192	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)c(C)s1	ZINC000246251549	402520730	/nfs/dbraw/zinc/52/07/30/402520730.db2.gz	SPUVLASLFMNOOO-ZWNOBZJWSA-N	0	3	316.492	2.326	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@@H](C)NC(=O)CC(C)(C)C	ZINC000188619038	402521331	/nfs/dbraw/zinc/52/13/31/402521331.db2.gz	WTLFEOLSCXUVCQ-ZIAGYGMSSA-N	0	3	313.486	2.020	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCC[C@@H]3OCC[C@@H]32)CCN1C	ZINC000246370284	402527479	/nfs/dbraw/zinc/52/74/79/402527479.db2.gz	LLUOPPMHDVXFGV-QCODTGAPSA-N	0	3	309.454	2.068	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](C)c2nc(C(C)(C)C)no2)C1	ZINC000246402550	402529521	/nfs/dbraw/zinc/52/95/21/402529521.db2.gz	RQPDGBVJNMGUJL-NEPJUHHUSA-N	0	3	323.441	2.212	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)/C=C/c2nc3ccccc3s2)C1	ZINC000170861242	402534496	/nfs/dbraw/zinc/53/44/96/402534496.db2.gz	CZUXPKRRNQLOOU-GUOLPTJISA-N	0	3	301.415	2.472	10	0		DEAEHN
CC[C@H]1CN(Cc2cccc(COC)c2)CCN1CCOC	ZINC000179213005	402581611	/nfs/dbraw/zinc/58/16/11/402581611.db2.gz	DBVKGQMWGCRFPV-SFHVURJKSA-N	0	3	306.450	2.376	10	0		DEAEHN
CCOC(=O)[C@@H](c1ccccc1)N1CCN2CCCC[C@H]2C1	ZINC000248358073	402587428	/nfs/dbraw/zinc/58/74/28/402587428.db2.gz	QHRZDQKNJVLVBK-DLBZAZTESA-N	0	3	302.418	2.461	10	0		DEAEHN
Cn1c(CN2CCN3CCCC[C@H]3C2)nnc1-c1ccccc1	ZINC000248367487	402587776	/nfs/dbraw/zinc/58/77/76/402587776.db2.gz	UCQCSCOCPPHMGR-INIZCTEOSA-N	0	3	311.433	2.152	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc(C(=O)OC)c(C)c2)C1	ZINC000171520853	402591071	/nfs/dbraw/zinc/59/10/71/402591071.db2.gz	WWAIODSQACUGDI-AWEZNQCLSA-N	0	3	319.405	2.387	10	0		DEAEHN
Cc1n[nH]c(C)c1[C@H](C)CC(=O)N1CCCN(C2CC2)CC1	ZINC000179726109	402598905	/nfs/dbraw/zinc/59/89/05/402598905.db2.gz	QMUVXHGCBBXCON-GFCCVEGCSA-N	0	3	304.438	2.217	10	0		DEAEHN
C[C@H](C(=O)Nc1c(F)cccc1F)N1CCN2CCC[C@@H]2C1	ZINC000171639047	402604512	/nfs/dbraw/zinc/60/45/12/402604512.db2.gz	CRDLERLYOSLBCJ-VXGBXAGGSA-N	0	3	309.360	2.072	10	0		DEAEHN
Cc1ccc(F)cc1NC(=O)[C@@H](C)N1CCN2CCC[C@@H]2C1	ZINC000171640718	402605320	/nfs/dbraw/zinc/60/53/20/402605320.db2.gz	FGNWZSDOQKKGPE-UKRRQHHQSA-N	0	3	305.397	2.241	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cc3c(cc2C)OCO3)C1	ZINC000180088279	402606864	/nfs/dbraw/zinc/60/68/64/402606864.db2.gz	AYYHRDAEZBYMKK-LBPRGKRZSA-N	0	3	305.378	2.330	10	0		DEAEHN
CO[C@@H]1CC[C@H](NC(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000249028124	402618073	/nfs/dbraw/zinc/61/80/73/402618073.db2.gz	LGXHKOCNRJJQKB-GVDBMIGSSA-N	0	3	319.449	2.026	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)NC2C3CC4CC(C3)CC2C4)C1	ZINC000171747480	402618119	/nfs/dbraw/zinc/61/81/19/402618119.db2.gz	AJQYLOREMCHBLE-XXXXFFMBSA-N	0	3	305.466	2.452	10	0		DEAEHN
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)NCC2CCC2)C1	ZINC000190696458	402618933	/nfs/dbraw/zinc/61/89/33/402618933.db2.gz	SOWJMQODHLHUFU-QGZVFWFLSA-N	0	3	316.449	2.345	10	0		DEAEHN
COc1c(C)cc(CN(C)CCN2CCO[C@@H](C)C2)cc1C	ZINC000249259328	402624310	/nfs/dbraw/zinc/62/43/10/402624310.db2.gz	GSTKAQHCFOEGGG-INIZCTEOSA-N	0	3	306.450	2.465	10	0		DEAEHN
CC(C)n1ccc(CN2CCC(CN3CCOCC3)CC2)n1	ZINC000172013744	402637271	/nfs/dbraw/zinc/63/72/71/402637271.db2.gz	AQNWIARQSFNREV-UHFFFAOYSA-N	0	3	306.454	2.008	10	0		DEAEHN
CCCOc1ccc(NC(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000181289022	402639508	/nfs/dbraw/zinc/63/95/08/402639508.db2.gz	CUJLEXKJOZEOLP-MRXNPFEDSA-N	0	3	321.421	2.270	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H](C)Oc2ccccc2)C1	ZINC000172224081	402645661	/nfs/dbraw/zinc/64/56/61/402645661.db2.gz	IINSANSEVXQTOC-CABCVRRESA-N	0	3	305.422	2.237	10	0		DEAEHN
CCc1ccc(CCNC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000172472626	402658041	/nfs/dbraw/zinc/65/80/41/402658041.db2.gz	UQNHDGAKKYLYEW-QGZVFWFLSA-N	0	3	301.434	2.281	10	0		DEAEHN
C[C@@H](C(=O)NCc1ccccc1F)N1CCCN(C2CC2)CC1	ZINC000172346888	402651363	/nfs/dbraw/zinc/65/13/63/402651363.db2.gz	MIZRYNHOAGIPGC-AWEZNQCLSA-N	0	3	319.424	2.001	10	0		DEAEHN
C[C@H](C(=O)Nc1ccc(Cl)cn1)N1CCCN(C2CC2)CC1	ZINC000172347465	402651856	/nfs/dbraw/zinc/65/18/56/402651856.db2.gz	JNFIYAHWFQAYRF-GFCCVEGCSA-N	0	3	322.840	2.232	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc3c(c2)NC(=O)CC3)C1	ZINC000173763709	402711093	/nfs/dbraw/zinc/71/10/93/402711093.db2.gz	GJXPHWNGNQCTGR-AWEZNQCLSA-N	0	3	316.405	2.177	10	0		DEAEHN
CCC[C@H](C)CS(=O)(=O)N1C[C@@H]2CCCN2C[C@@H]1CC	ZINC000173830379	402714482	/nfs/dbraw/zinc/71/44/82/402714482.db2.gz	CIJCTMGIJARYBS-KKUMJFAQSA-N	0	3	302.484	2.311	10	0		DEAEHN
CN1C(=O)C[C@H](NCCn2cccn2)[C@@H]1c1ccc(Cl)cc1	ZINC000192151191	402714761	/nfs/dbraw/zinc/71/47/61/402714761.db2.gz	MSKMMKIUYDQVRC-HOCLYGCPSA-N	0	3	318.808	2.098	10	0		DEAEHN
CC(C)N1C[C@H](NS(=O)(=O)c2ccc3c(c2)CCC3)[C@@H](C)C1	ZINC000173886088	402717150	/nfs/dbraw/zinc/71/71/50/402717150.db2.gz	GXUQRUFYWJBJFY-GUYCJALGSA-N	0	3	322.474	2.182	10	0		DEAEHN
C[C@@H](CN[C@@H]1CCCOc2cc(F)ccc21)N1CCOCC1	ZINC000181929799	402661022	/nfs/dbraw/zinc/66/10/22/402661022.db2.gz	HHRSXRMVUMYOTK-XJKSGUPXSA-N	0	3	308.397	2.350	10	0		DEAEHN
CCOCCN1CCN(CCc2scnc2C)C[C@H]1CC	ZINC000172535596	402661533	/nfs/dbraw/zinc/66/15/33/402661533.db2.gz	WXSYNYUPVUANTP-OAHLLOKOSA-N	0	3	311.495	2.427	10	0		DEAEHN
CSC1(C(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)CC1	ZINC000253429925	402666563	/nfs/dbraw/zinc/66/65/63/402666563.db2.gz	WFPPHQAXDDOJEY-GJZGRUSLSA-N	0	3	319.474	2.428	10	0		DEAEHN
C[C@@H]1CN(CC2CCN(C(=O)C3=CCCCO3)CC2)C[C@H](C)O1	ZINC000172747562	402673207	/nfs/dbraw/zinc/67/32/07/402673207.db2.gz	NIJKIFCHXBOMFW-GASCZTMLSA-N	0	3	322.449	2.029	10	0		DEAEHN
CCc1cccc(OCCN2CC[C@@H](N3CCOCC3)C2)c1	ZINC000173929750	402719393	/nfs/dbraw/zinc/71/93/93/402719393.db2.gz	IAUNUZZLRBVRLN-QGZVFWFLSA-N	0	3	304.434	2.034	10	0		DEAEHN
CC[C@@H](CO)N1CCN(c2ccc3cc(OC)ccc3n2)CC1	ZINC000172784611	402675495	/nfs/dbraw/zinc/67/54/95/402675495.db2.gz	HLBIUBDNQDRIHV-HNNXBMFYSA-N	0	3	315.417	2.136	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N[C@H]1CCc3ncnn3C1)CCS2	ZINC000191529745	402676420	/nfs/dbraw/zinc/67/64/20/402676420.db2.gz	SXZXYVGGKAQBBR-SMDDNHRTSA-N	0	3	316.430	2.428	10	0		DEAEHN
COc1ccc(CN[C@@H]2CCC[C@@H]2[C@H]2COCCN2)c(F)c1	ZINC000261933509	402719595	/nfs/dbraw/zinc/71/95/95/402719595.db2.gz	LZVLFZCQKRHUGS-USXIJHARSA-N	0	3	308.397	2.081	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)Cc2cc(=O)oc3cc([O-])ccc23)CC[N@@H+]1C	ZINC000182396947	402686550	/nfs/dbraw/zinc/68/65/50/402686550.db2.gz	XLXWPRMSTACNLM-JSGCOSHPSA-N	0	3	316.401	2.413	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)Cc2cc(=O)oc3cc([O-])ccc23)CC[N@H+]1C	ZINC000182396947	402686553	/nfs/dbraw/zinc/68/65/53/402686553.db2.gz	XLXWPRMSTACNLM-JSGCOSHPSA-N	0	3	316.401	2.413	10	0		DEAEHN
C[C@H]1C[C@@H]([N@H+](C)Cc2cc(=O)oc3cc([O-])ccc23)CCN1C	ZINC000182396947	402686555	/nfs/dbraw/zinc/68/65/55/402686555.db2.gz	XLXWPRMSTACNLM-JSGCOSHPSA-N	0	3	316.401	2.413	10	0		DEAEHN
C[C@H]1C[C@@H]([N@@H+](C)Cc2cc(=O)oc3cc([O-])ccc23)CCN1C	ZINC000182396947	402686559	/nfs/dbraw/zinc/68/65/59/402686559.db2.gz	XLXWPRMSTACNLM-JSGCOSHPSA-N	0	3	316.401	2.413	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(C(=O)CC3CCCC3)C2)CC1	ZINC000173295071	402691146	/nfs/dbraw/zinc/69/11/46/402691146.db2.gz	MUDIIPSTJGJPHD-QGZVFWFLSA-N	0	3	307.482	2.195	10	0		DEAEHN
Cc1cccc(C)c1OCCN1CC[C@@H](N2CCOCC2)C1	ZINC000173944063	402720486	/nfs/dbraw/zinc/72/04/86/402720486.db2.gz	RRKKNVVJDDHTCB-QGZVFWFLSA-N	0	3	304.434	2.089	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@H](C)NC(=O)[C@H](C)N1CCCCCC1	ZINC000173490801	402699974	/nfs/dbraw/zinc/69/99/74/402699974.db2.gz	ADRYIRLHYNDJAT-BBRMVZONSA-N	0	3	320.481	2.349	10	0		DEAEHN
CC[C@H](O)CN1CCN(CCCOc2cc(C)cc(C)c2)CC1	ZINC000174089291	402726393	/nfs/dbraw/zinc/72/63/93/402726393.db2.gz	OTFVFYATIUFOQZ-SFHVURJKSA-N	0	3	320.477	2.461	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)NCc1cc2c(cc1OC)C[C@H](C)O2	ZINC000262575587	402727357	/nfs/dbraw/zinc/72/73/57/402727357.db2.gz	OFZWTACXENUMBS-XMZIXOGTSA-N	0	3	306.406	2.008	10	0		DEAEHN
CCOC(=O)CCCN1CCC[C@H]1CNC(=O)OC(C)(C)C	ZINC000174234798	402732766	/nfs/dbraw/zinc/73/27/66/402732766.db2.gz	JAFODGNVNGEASM-ZDUSSCGKSA-N	0	3	314.426	2.319	10	0		DEAEHN
C[C@H](NCC(=O)Nc1nc2ccccc2s1)[C@@H]1CCCO1	ZINC000183130432	402741667	/nfs/dbraw/zinc/74/16/67/402741667.db2.gz	IDQIBHXGGSPKMB-JQWIXIFHSA-N	0	3	305.403	2.392	10	0		DEAEHN
C[C@H]1CC(CC[N@@H+]2CCC[C@]3(C2)NC(=O)[N-]C3=O)C[C@H](C)C1	ZINC000192664713	402743423	/nfs/dbraw/zinc/74/34/23/402743423.db2.gz	PUFQIBHDKAUZBS-PBFPGSCMSA-N	0	3	307.438	2.123	10	0		DEAEHN
C[C@H]1CC(CC[N@H+]2CCC[C@]3(C2)NC(=O)[N-]C3=O)C[C@H](C)C1	ZINC000192664713	402743425	/nfs/dbraw/zinc/74/34/25/402743425.db2.gz	PUFQIBHDKAUZBS-PBFPGSCMSA-N	0	3	307.438	2.123	10	0		DEAEHN
CCCOc1cccc(CNC(=O)CN[C@@H](C)[C@H]2CCCO2)c1	ZINC000183222220	402748548	/nfs/dbraw/zinc/74/85/48/402748548.db2.gz	GKJFHSFWWKIBND-WMLDXEAASA-N	0	3	320.433	2.249	10	0		DEAEHN
Cc1cc(-c2nc([C@@H]3CNCCN3C)no2)c2ccccc2n1	ZINC000263245759	402749525	/nfs/dbraw/zinc/74/95/25/402749525.db2.gz	PGKUUJDHUQEQAD-HNNXBMFYSA-N	0	3	309.373	2.169	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(COc2ccc3ccccc3c2)n1	ZINC000263249381	402749984	/nfs/dbraw/zinc/74/99/84/402749984.db2.gz	PQZLHWVDNRLKJP-INIZCTEOSA-N	0	3	324.384	2.378	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCC(C(C)C)CC1	ZINC000174824246	402759148	/nfs/dbraw/zinc/75/91/48/402759148.db2.gz	SPILPQAPJWCLMC-MRXNPFEDSA-N	0	3	311.470	2.175	10	0		DEAEHN
Cc1ccc(CCNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cn1	ZINC000174843629	402759899	/nfs/dbraw/zinc/75/98/99/402759899.db2.gz	JDDIWWCUWYQTFC-GDBMZVCRSA-N	0	3	304.438	2.057	10	0		DEAEHN
C[C@@H](CNC(=O)N1CC[C@H](N2CC=CC2)C1)Oc1ccccc1	ZINC000174916070	402762702	/nfs/dbraw/zinc/76/27/02/402762702.db2.gz	AEKKXJYEWSFKIX-HOTGVXAUSA-N	0	3	315.417	2.110	10	0		DEAEHN
C[C@@H](C(=O)N1CC[C@@H](C(=O)OC(C)(C)C)C1)N1CCCCCC1	ZINC000174955337	402766256	/nfs/dbraw/zinc/76/62/56/402766256.db2.gz	YDYPXPKZLNYWSF-LSDHHAIUSA-N	0	3	324.465	2.441	10	0		DEAEHN
CC(C)c1noc2ncc(C(=O)NCCN3CCCC3)cc21	ZINC000193152272	402767283	/nfs/dbraw/zinc/76/72/83/402767283.db2.gz	UMCOQLDOGDTQHB-UHFFFAOYSA-N	0	3	302.378	2.172	10	0		DEAEHN
OCC[C@@]1(CNCc2cnc(-c3ccco3)s2)CCOC1	ZINC000193152388	402767610	/nfs/dbraw/zinc/76/76/10/402767610.db2.gz	GIBKRLDXQKUIAE-HNNXBMFYSA-N	0	3	308.403	2.282	10	0		DEAEHN
CCOc1ncccc1NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000175071794	402776478	/nfs/dbraw/zinc/77/64/78/402776478.db2.gz	BSEHYMNDTZAWBN-OLZOCXBDSA-N	0	3	306.410	2.427	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN([C@@H](C)C(=O)N(C)C(C)C)C2)n1	ZINC000175252823	402791382	/nfs/dbraw/zinc/79/13/82/402791382.db2.gz	PUXDFTZAGUYNFQ-JKSUJKDBSA-N	0	3	318.465	2.379	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCOc2cccc(C)c2)C1	ZINC000194311454	402791622	/nfs/dbraw/zinc/79/16/22/402791622.db2.gz	XYLSHMNVNDZUQK-HNNXBMFYSA-N	0	3	305.422	2.157	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccccc2-n2cccn2)C1	ZINC000194341327	402792599	/nfs/dbraw/zinc/79/25/99/402792599.db2.gz	LPDYDDZYBPIRTM-AWEZNQCLSA-N	0	3	313.405	2.478	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc(C(=O)OC)cc2)C1	ZINC000194340440	402792712	/nfs/dbraw/zinc/79/27/12/402792712.db2.gz	AJJBSQBUTKUQSS-CQSZACIVSA-N	0	3	305.378	2.079	10	0		DEAEHN
Cc1nccn1CCCCNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000175466356	402808970	/nfs/dbraw/zinc/80/89/70/402808970.db2.gz	FWBNNTQIMUKUAH-GDBMZVCRSA-N	0	3	321.469	2.096	10	0		DEAEHN
C[C@H](Cc1ccc(O)cc1)NC(=O)N1CCCN(C2CC2)CC1	ZINC000194673031	402809422	/nfs/dbraw/zinc/80/94/22/402809422.db2.gz	BSQLYAIALRJXQO-CQSZACIVSA-N	0	3	317.433	2.203	10	0		DEAEHN
C[C@@H](NC(=O)CN1CCCN(C2CC2)CC1)c1cccs1	ZINC000195341087	402843038	/nfs/dbraw/zinc/84/30/38/402843038.db2.gz	CCDZOQKJLMHSAH-CYBMUJFWSA-N	0	3	307.463	2.095	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(C1CC1)C1CCCC1	ZINC000175492564	402811483	/nfs/dbraw/zinc/81/14/83/402811483.db2.gz	JVKZVIRZFGIHLK-INIZCTEOSA-N	0	3	309.454	2.214	10	0		DEAEHN
CC[C@@H](CNC(=O)NC[C@@H]1CCCN1C)Oc1cccc(F)c1	ZINC000175598030	402820760	/nfs/dbraw/zinc/82/07/60/402820760.db2.gz	UBZRSDWFUNLHLY-GJZGRUSLSA-N	0	3	323.412	2.377	10	0		DEAEHN
CCc1noc2ncc(C(=O)N[C@H](CC(C)C)CN(C)C)cc12	ZINC000194920202	402822829	/nfs/dbraw/zinc/82/28/29/402822829.db2.gz	RSYQQRNXFWMNDO-CYBMUJFWSA-N	0	3	318.421	2.491	10	0		DEAEHN
CC[C@@H](C(=O)NC[C@H](O)CN1CCCCC1)c1ccc(F)cc1	ZINC000184217710	402827629	/nfs/dbraw/zinc/82/76/29/402827629.db2.gz	SKZAEZRLAKKRKW-DLBZAZTESA-N	0	3	322.424	2.282	10	0		DEAEHN
CCOC[C@H]1CCN(Cc2ccc3c(c2)sc(=O)n3C)C1	ZINC000195040021	402828076	/nfs/dbraw/zinc/82/80/76/402828076.db2.gz	HNQNKUAIRKBRLO-ZDUSSCGKSA-N	0	3	306.431	2.458	10	0		DEAEHN
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)CN(C)C(C)C	ZINC000184272728	402832170	/nfs/dbraw/zinc/83/21/70/402832170.db2.gz	AQMOVFBTKFLERS-MRXNPFEDSA-N	0	3	303.450	2.454	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N[C@@H]1COc2ccccc21	ZINC000195196798	402836112	/nfs/dbraw/zinc/83/61/12/402836112.db2.gz	NHBLXJNNXHHRDE-DZGCQCFKSA-N	0	3	305.422	2.396	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc(OC(F)(F)F)cc1	ZINC000175852160	402837983	/nfs/dbraw/zinc/83/79/83/402837983.db2.gz	PCIZEPBEAOYXAD-CYBMUJFWSA-N	0	3	307.312	2.462	10	0		DEAEHN
CC(C)[C@H](CNC(=O)N1CC[C@@H](N(C)C)C1)c1cccnc1	ZINC000175897846	402841077	/nfs/dbraw/zinc/84/10/77/402841077.db2.gz	MYPWHGKTWLTAAT-CVEARBPZSA-N	0	3	304.438	2.167	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@@H](C)Oc2ccc(F)c(F)c2)C1	ZINC000195309224	402841063	/nfs/dbraw/zinc/84/10/63/402841063.db2.gz	XPFYLDRFHHVWDF-VXGBXAGGSA-N	0	3	312.360	2.333	10	0		DEAEHN
CCc1cc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)oc1CC	ZINC000184398100	402841230	/nfs/dbraw/zinc/84/12/30/402841230.db2.gz	JHTIPTLVTRRYQB-AWEZNQCLSA-N	0	3	321.465	2.160	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCc1cccc2c1OCO2	ZINC000194152621	402786442	/nfs/dbraw/zinc/78/64/42/402786442.db2.gz	KYNAQYKEPDERHN-AWEZNQCLSA-N	0	3	321.421	2.191	10	0		DEAEHN
CCC[C@@H](C)CC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000176003842	402847118	/nfs/dbraw/zinc/84/71/18/402847118.db2.gz	KKJAMYVOKIQCLD-SJORKVTESA-N	0	3	309.498	2.441	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1NC(=O)CN1CCC(c2ccn[nH]2)CC1	ZINC000195506641	402848068	/nfs/dbraw/zinc/84/80/68/402848068.db2.gz	QBIJTPLEIUJUJX-HIFRSBDPSA-N	0	3	304.438	2.284	10	0		DEAEHN
CCC(C)(C)NC(=O)CN1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000195516171	402849810	/nfs/dbraw/zinc/84/98/10/402849810.db2.gz	ONPYGJPHAVJWRB-HNNXBMFYSA-N	0	3	318.465	2.429	10	0		DEAEHN
Cc1nc(C[C@H]2CCCN(CCC(=O)NC3CCCC3)C2)no1	ZINC000195518321	402850290	/nfs/dbraw/zinc/85/02/90/402850290.db2.gz	WXGQGSIFDCGGCH-CQSZACIVSA-N	0	3	320.437	2.081	10	0		DEAEHN
C[C@H](NCC1(O)CCOCC1)c1ccc(Br)cn1	ZINC000280191469	402973466	/nfs/dbraw/zinc/97/34/66/402973466.db2.gz	SFMBKNZCJQYOSJ-JTQLQIEISA-N	0	3	315.211	2.036	10	0		DEAEHN
CC(C)c1nn(C)cc1NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000280823200	403040386	/nfs/dbraw/zinc/04/03/86/403040386.db2.gz	UGSDYQQQHOICNJ-QWHCGFSZSA-N	0	3	307.442	2.490	10	0		DEAEHN
CC(=O)N(C[C@@H]1CCC[N@@H+]1Cc1nc(C)ccc1[O-])C1CC1	ZINC000275541580	403103975	/nfs/dbraw/zinc/10/39/75/403103975.db2.gz	FMOBBGMJSLIYNS-HNNXBMFYSA-N	0	3	303.406	2.071	10	0		DEAEHN
CC(=O)N(C[C@@H]1CCC[N@H+]1Cc1nc(C)ccc1[O-])C1CC1	ZINC000275541580	403103978	/nfs/dbraw/zinc/10/39/78/403103978.db2.gz	FMOBBGMJSLIYNS-HNNXBMFYSA-N	0	3	303.406	2.071	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1ccncc1Br	ZINC000268569975	403095332	/nfs/dbraw/zinc/09/53/32/403095332.db2.gz	BMOXRVOENKZQCV-JTQLQIEISA-N	0	3	312.211	2.010	10	0		DEAEHN
CC(C)(O)c1cn([C@@H]2CCCC[C@@H]2NCc2cccnc2)nn1	ZINC000276310713	403163206	/nfs/dbraw/zinc/16/32/06/403163206.db2.gz	MCRRBSDHSLHRSN-LSDHHAIUSA-N	0	3	315.421	2.174	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@@H]1NCc1sccc1Br	ZINC000282216292	403133206	/nfs/dbraw/zinc/13/32/06/403133206.db2.gz	DRRVARWJVQKOHF-CBAPKCEASA-N	0	3	303.225	2.267	10	0		DEAEHN
CC(=O)N(C[C@H]1CCCN1C[C@H](O)Cc1ccccc1)C1CC1	ZINC000276598380	403190252	/nfs/dbraw/zinc/19/02/52/403190252.db2.gz	VHMPSIYCEBJHRS-RTBURBONSA-N	0	3	316.445	2.065	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1N(C)C(=O)CN1CCC[C@@H](c2nc[nH]n2)C1	ZINC000333096405	403665416	/nfs/dbraw/zinc/66/54/16/403665416.db2.gz	UJNBSUXMJVRNSQ-KFWWJZLASA-N	0	3	319.453	2.021	10	0		DEAEHN
C[C@@H](C(=O)N(C)C1CCCCC1)N1CCC[C@@H](c2nc[nH]n2)C1	ZINC000333116546	403669348	/nfs/dbraw/zinc/66/93/48/403669348.db2.gz	YVKHXOOUHCCTNR-UONOGXRCSA-N	0	3	319.453	2.164	10	0		DEAEHN
COc1nc(C)nc(NCCCCN2C[C@@H](C)O[C@@H](C)C2)c1C	ZINC000301862612	403691611	/nfs/dbraw/zinc/69/16/11/403691611.db2.gz	CPYIRRXCVRTPIG-BETUJISGSA-N	0	3	322.453	2.403	10	0		DEAEHN
Fc1cc2c(c(F)c1F)[C@H](N[C@H]1CCc3nnnn3CC1)CC2	ZINC000333510889	403769557	/nfs/dbraw/zinc/76/95/57/403769557.db2.gz	JCRJMHDZJHNKOJ-GXSJLCMTSA-N	0	3	323.322	2.072	10	0		DEAEHN
c1nc2sc3c(c2c(N2CCN4CCC2CC4)n1)CCC3	ZINC000302761369	403721746	/nfs/dbraw/zinc/72/17/46/403721746.db2.gz	KEVWGVGSQUJSMU-UHFFFAOYSA-N	0	3	300.431	2.464	10	0		DEAEHN
O=C(NCC1(CO)CC2(CCC2)C1)[C@H]1CCCN1C1CCCC1	ZINC000333345407	403729840	/nfs/dbraw/zinc/72/98/40/403729840.db2.gz	UOCHWSVJPWMCLF-MRXNPFEDSA-N	0	3	320.477	2.452	10	0		DEAEHN
Cn1cc(CCCNCc2ccn(Cc3ccccc3)n2)cn1	ZINC000314169311	403993250	/nfs/dbraw/zinc/99/32/50/403993250.db2.gz	OQQNJKXLFCKXDR-UHFFFAOYSA-N	0	3	309.417	2.387	10	0		DEAEHN
CCNC(=O)N1CC[C@@H](NCc2cc3ccc(F)cc3[nH]2)C1	ZINC000362926089	404006682	/nfs/dbraw/zinc/00/66/82/404006682.db2.gz	XMGPLHCBHKWVAR-CYBMUJFWSA-N	0	3	304.369	2.200	10	0		DEAEHN
c1ccc(N2CCOCC2)c(CN2CCOCC3(CC3)C2)c1	ZINC000341558428	404033425	/nfs/dbraw/zinc/03/34/25/404033425.db2.gz	FCIMEFVPQZACPG-UHFFFAOYSA-N	0	3	302.418	2.136	10	0		DEAEHN
O=C(CC/C=C/c1ccccc1)NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000369566284	404144854	/nfs/dbraw/zinc/14/48/54/404144854.db2.gz	DFEIKOZASOMXPN-QLIIXQJQSA-N	0	3	314.429	2.459	10	0		DEAEHN
C([C@H]1CCOC1)N1CCN(C[C@@H]2CCOC2)CC12CCCCC2	ZINC000370086047	404329140	/nfs/dbraw/zinc/32/91/40/404329140.db2.gz	CXYJHCJMJCPBLD-ZWKOTPCHSA-N	0	3	322.493	2.380	10	0		DEAEHN
OCCN[C@@H](Cc1ccc(F)cc1)[C@@H]1COc2ccccc2O1	ZINC000366444586	404792401	/nfs/dbraw/zinc/79/24/01/404792401.db2.gz	RVLITGUENMARMJ-YJBOKZPZSA-N	0	3	317.360	2.159	10	0		DEAEHN
O=C(NC[C@H]1CN2CCC[C@H]2CO1)N1CCC2(C1)CCCCC2	ZINC000377877460	404849847	/nfs/dbraw/zinc/84/98/47/404849847.db2.gz	BRRBAYVIWCWJBL-HOTGVXAUSA-N	0	3	321.465	2.215	10	0		DEAEHN
CC[NH+]1CCC(CC[N-]S(=O)(=O)c2cc(C)cs2)CC1	ZINC000451243057	404916853	/nfs/dbraw/zinc/91/68/53/404916853.db2.gz	AVAHZSMJRSPTNX-UHFFFAOYSA-N	0	3	316.492	2.457	10	0		DEAEHN
C[C@H](NCc1c(Br)cnn1C)[C@@H]1CCCOC1	ZINC000388948005	405036798	/nfs/dbraw/zinc/03/67/98/405036798.db2.gz	HLCPIVOHUCLCEA-VHSXEESVSA-N	0	3	302.216	2.087	10	0		DEAEHN
C[C@H]1CCOCCN1C(=O)NC[C@@H](c1ccccc1)N(C)C	ZINC000378496471	404982758	/nfs/dbraw/zinc/98/27/58/404982758.db2.gz	KATPIPGZXMTNAP-HOCLYGCPSA-N	0	3	305.422	2.110	10	0		DEAEHN
CN(CC1CC1)C(=O)CN1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000361379327	405046816	/nfs/dbraw/zinc/04/68/16/405046816.db2.gz	USFOEQNRRUFAOF-BRWVUGGUSA-N	0	3	308.466	2.260	10	0		DEAEHN
Cn1nnc2cc(CN3CC[C@H](C(C)(C)C)[C@H](O)C3)ccc21	ZINC000408198541	405136280	/nfs/dbraw/zinc/13/62/80/405136280.db2.gz	NHMZWAPSHPLXHM-XJKSGUPXSA-N	0	3	302.422	2.197	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)CN[C@@]2(CO)C[C@@H](C)CC(C)(C)C2)C1	ZINC000408423501	405203216	/nfs/dbraw/zinc/20/32/16/405203216.db2.gz	PESMDPSCTNQYMY-VKJFTORMSA-N	0	3	310.482	2.412	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@@H]1C[C@H]1c1cc(F)ccc1F	ZINC000439042169	405263865	/nfs/dbraw/zinc/26/38/65/405263865.db2.gz	JUAHLCKECSCABA-DZGCQCFKSA-N	0	3	317.339	2.114	10	0		DEAEHN
CC1(C)CCCN1CCNC(=O)c1cc(-c2cccnc2)on1	ZINC000457078135	405683456	/nfs/dbraw/zinc/68/34/56/405683456.db2.gz	QLIGZHOJQBCACL-UHFFFAOYSA-N	0	3	314.389	2.341	10	0		DEAEHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)N[C@@H]1CCCC(F)(F)C1	ZINC000495036684	405802569	/nfs/dbraw/zinc/80/25/69/405802569.db2.gz	NVDZSMQUWBZHAY-WZRBSPASSA-N	0	3	301.381	2.346	10	0		DEAEHN
CCCCN(C)CCNC(=O)c1cc(C)cc(C(=O)OC)c1	ZINC000457569617	405900392	/nfs/dbraw/zinc/90/03/92/405900392.db2.gz	QVYUWBKYYALXDG-UHFFFAOYSA-N	0	3	306.406	2.243	10	0		DEAEHN
c1c(CN(CC2CC2)CC2CCC2)nnn1C[C@H]1CCOC1	ZINC000639129568	405908619	/nfs/dbraw/zinc/90/86/19/405908619.db2.gz	UUUUUJJKCBEVNO-MRXNPFEDSA-N	0	3	304.438	2.327	10	0		DEAEHN
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(-n2cccn2)c(F)c1	ZINC000451065449	406036533	/nfs/dbraw/zinc/03/65/33/406036533.db2.gz	AIZDFFOWGYVSHX-BDJLRTHQSA-N	0	3	305.353	2.002	10	0		DEAEHN
COc1cc(CN[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)on1	ZINC000639325385	406045213	/nfs/dbraw/zinc/04/52/13/406045213.db2.gz	WVEVVQGJWQIBBG-XJKSGUPXSA-N	0	3	301.390	2.293	10	0		DEAEHN
Brc1cnc2c(CN[C@@H]3[C@@H]4CCC[C@@H]43)cnn2c1	ZINC000639324828	406045511	/nfs/dbraw/zinc/04/55/11/406045511.db2.gz	MVMNIPOWZHVLSG-ZSBIGDGJSA-N	0	3	307.195	2.380	10	0		DEAEHN
CC(C)OC[C@H](O)CN1CCC[C@H](CC(=O)OC(C)(C)C)C1	ZINC000532124858	406048060	/nfs/dbraw/zinc/04/80/60/406048060.db2.gz	JERDMMJYYAVQTB-HUUCEWRRSA-N	0	3	315.454	2.216	10	0		DEAEHN
CN(Cc1ccncc1Br)[C@@H]1CN2CCC1CC2	ZINC000639392470	406078904	/nfs/dbraw/zinc/07/89/04/406078904.db2.gz	HMKFXOUJPVFLTF-CQSZACIVSA-N	0	3	310.239	2.370	10	0		DEAEHN
CC(=O)N(CC(=O)NCCN1CCCC[C@H]1C)c1ccccc1	ZINC000639528034	406131370	/nfs/dbraw/zinc/13/13/70/406131370.db2.gz	ZPRAQHNLZIMQSJ-OAHLLOKOSA-N	0	3	317.433	2.030	10	0		DEAEHN
COC[C@H](O)CN1CCC[C@@H](c2nc3ccccc3s2)C1	ZINC000534339107	406184268	/nfs/dbraw/zinc/18/42/68/406184268.db2.gz	FSLUXLNCMRMBHK-CHWSQXEVSA-N	0	3	306.431	2.483	10	0		DEAEHN
c1nc(C2CC2)ncc1CCNCc1cnc(N2CCCC2)nc1	ZINC000535190772	406215927	/nfs/dbraw/zinc/21/59/27/406215927.db2.gz	LWVZOZXFUFVZFM-UHFFFAOYSA-N	0	3	324.432	2.077	10	0		DEAEHN
CC(C)[C@H]1CCCN1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637920612	406478017	/nfs/dbraw/zinc/47/80/17/406478017.db2.gz	OGQWLDKVGBVGHR-IAGOWNOFSA-N	0	3	303.450	2.093	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)c2ccncn2)[C@H]1c1cccs1	ZINC000548289483	406497363	/nfs/dbraw/zinc/49/73/63/406497363.db2.gz	XNQZOHBKCMECRG-WFASDCNBSA-N	0	3	316.430	2.351	10	0		DEAEHN
C[C@@H]1CCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)[C@H](C)C1	ZINC000638404731	406752363	/nfs/dbraw/zinc/75/23/63/406752363.db2.gz	LJSUAUSXWXLDDL-BFYDXBDKSA-N	0	3	303.450	2.093	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NCCCC1CCC1	ZINC000638414468	406758797	/nfs/dbraw/zinc/75/87/97/406758797.db2.gz	GLBKOYWCNJUMRP-QGZVFWFLSA-N	0	3	303.450	2.142	10	0		DEAEHN
c1ccc(-n2nnnc2CCN2CCC[C@@H]2c2cccnc2)cc1	ZINC000554241639	406788440	/nfs/dbraw/zinc/78/84/40/406788440.db2.gz	OLYIPCLDOXCJJA-QGZVFWFLSA-N	0	3	320.400	2.437	10	0		DEAEHN
O=C(c1cc(Cl)ncc1Cl)N1CCN2CCC[C@H]2C1	ZINC000129157399	196025159	/nfs/dbraw/zinc/02/51/59/196025159.db2.gz	XHJHZWULMAMSOX-VIFPVBQESA-N	0	3	300.189	2.309	10	0		DEAEHN
Cc1cc(Br)cnc1NC(=O)[C@@H](N)CC(C)C	ZINC000129620845	196063530	/nfs/dbraw/zinc/06/35/30/196063530.db2.gz	LKTABLJGNGVBGZ-JTQLQIEISA-N	0	3	300.200	2.464	10	0		DEAEHN
CN(C)C[C@H](NC(=O)[C@H](N)c1cccs1)c1ccccc1	ZINC000130564645	196092079	/nfs/dbraw/zinc/09/20/79/196092079.db2.gz	UJEZUSXTBUCONO-DZGCQCFKSA-N	0	3	303.431	2.167	10	0		DEAEHN
CCc1nn(CCCS(=O)(=O)CC)c(CC)c1[C@@H](C)NC	ZINC000131038403	196134767	/nfs/dbraw/zinc/13/47/67/196134767.db2.gz	OHFMHLCWOIJNJY-GFCCVEGCSA-N	0	3	315.483	2.113	10	0		DEAEHN
CCN[C@@H](C)c1c(CC)nn([C@H]2CCS(=O)(=O)C2)c1CC	ZINC000131106535	196140548	/nfs/dbraw/zinc/14/05/48/196140548.db2.gz	SSFOZFNQEVSOCG-RYUDHWBXSA-N	0	3	313.467	2.038	10	0		DEAEHN
CCN[C@@H](CC)c1c(CC)nn(CCS(C)(=O)=O)c1CC	ZINC000131144849	196143301	/nfs/dbraw/zinc/14/33/01/196143301.db2.gz	ZZRUIUXMLBHNCI-LBPRGKRZSA-N	0	3	315.483	2.113	10	0		DEAEHN
COCCNC[C@](C)(O)c1ccc(Br)cc1F	ZINC000131193718	196148937	/nfs/dbraw/zinc/14/89/37/196148937.db2.gz	WFZAFEWBSYTIGK-LBPRGKRZSA-N	0	3	306.175	2.032	10	0		DEAEHN
Nc1nc(NCCCC(F)(F)F)nc(N2CCCCC2)n1	ZINC000131261001	196155215	/nfs/dbraw/zinc/15/52/15/196155215.db2.gz	BDIGBRFHUXCJEZ-UHFFFAOYSA-N	0	3	304.320	2.199	10	0		DEAEHN
N[C@@H]1COC[C@H]1C(=O)Nc1ccc(Cl)cc1Br	ZINC000131538435	196178035	/nfs/dbraw/zinc/17/80/35/196178035.db2.gz	PHBYXSCHOLJQNA-VXNVDRBHSA-N	0	3	319.586	2.015	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CC[C@H](C)[C@@H](C)C2)c(F)c1	ZINC000131760056	196196452	/nfs/dbraw/zinc/19/64/52/196196452.db2.gz	UPRPPHDRACHXJC-RYUDHWBXSA-N	0	3	314.426	2.212	10	0		DEAEHN
CCN[C@H](Cc1ccc(F)cc1C)C(C)(C)S(C)(=O)=O	ZINC000131933950	196211629	/nfs/dbraw/zinc/21/16/29/196211629.db2.gz	PQGCFQVEQYAKEA-CQSZACIVSA-N	0	3	301.427	2.478	10	0		DEAEHN
COC[C@H](C)C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000131971141	196215301	/nfs/dbraw/zinc/21/53/01/196215301.db2.gz	WOQPFLXNLAMQFV-HOTGVXAUSA-N	0	3	304.434	2.392	10	0		DEAEHN
COc1cc(Cl)cc(CNC(C)(C)C)c1OCCC(N)=O	ZINC000132111888	196227569	/nfs/dbraw/zinc/22/75/69/196227569.db2.gz	HMQOUIOFCNUFJK-UHFFFAOYSA-N	0	3	314.813	2.491	10	0		DEAEHN
NC1(C(=O)Nc2ccc(Cl)c3ncccc23)CCOCC1	ZINC000132136711	196229485	/nfs/dbraw/zinc/22/94/85/196229485.db2.gz	MFBHFVHHRHROFM-UHFFFAOYSA-N	0	3	305.765	2.335	10	0		DEAEHN
NC1(C(=O)N(Cc2ccc(Cl)cc2)C2CC2)CCOCC1	ZINC000132174481	196232676	/nfs/dbraw/zinc/23/26/76/196232676.db2.gz	BGMIZVXMCYONDU-UHFFFAOYSA-N	0	3	308.809	2.339	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ccc2[nH]cnc2c1	ZINC000132183667	196233287	/nfs/dbraw/zinc/23/32/87/196233287.db2.gz	JGYYHJDCQHTOFQ-MRXNPFEDSA-N	0	3	322.412	2.466	10	0		DEAEHN
C[C@@H](NCCNC(=O)N(C)C)c1ccc(Br)s1	ZINC000132350584	196248271	/nfs/dbraw/zinc/24/82/71/196248271.db2.gz	LPSPIKMRSHWKKN-MRVPVSSYSA-N	0	3	320.256	2.432	10	0		DEAEHN
C[C@H]1CNC[C@H](COCc2cc(Br)ccc2F)O1	ZINC000132595556	196268919	/nfs/dbraw/zinc/26/89/19/196268919.db2.gz	WKEQBAVYNZEVMU-JOYOIKCWSA-N	0	3	318.186	2.482	10	0		DEAEHN
CC[S@](=O)CCNCCOc1ccc(Br)cc1	ZINC000132781319	196283075	/nfs/dbraw/zinc/28/30/75/196283075.db2.gz	QAXAYYFGQQFOPB-QGZVFWFLSA-N	0	3	320.252	2.186	10	0		DEAEHN
CN[C@H](CC[C@@H]1CCCO1)c1c(Br)cnn1C	ZINC000133733215	196332651	/nfs/dbraw/zinc/33/26/51/196332651.db2.gz	FOBWGJIHQDHHHH-GXSJLCMTSA-N	0	3	302.216	2.402	10	0		DEAEHN
C[C@@](CN)(NS(=O)(=O)CCCC(F)(F)F)c1ccccc1	ZINC000134472140	196394318	/nfs/dbraw/zinc/39/43/18/196394318.db2.gz	JAIHVBQBAVHLIS-LBPRGKRZSA-N	0	3	324.368	2.122	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N[C@@](C)(CN)c2ccccc2)cc1	ZINC000134473827	196394603	/nfs/dbraw/zinc/39/46/03/196394603.db2.gz	VIYNUANQSPCAHR-INIZCTEOSA-N	0	3	304.415	2.147	10	0		DEAEHN
Cc1nnc([C@H](C)N2CC[C@H](CN(C)Cc3cccnc3)C2)o1	ZINC000195293669	225201589	/nfs/dbraw/zinc/20/15/89/225201589.db2.gz	FRKJWCGKMQHDQG-XJKSGUPXSA-N	0	3	315.421	2.288	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1	ZINC000105881207	424849423	/nfs/dbraw/zinc/84/94/23/424849423.db2.gz	CTZADLUNCCAMLM-LSDHHAIUSA-N	0	3	312.417	2.147	10	0		DEAEHN
CC1(C)CN(C[C@H](O)CCc2ccccc2)C[C@@]2(CCOC2)O1	ZINC000361528221	424844845	/nfs/dbraw/zinc/84/48/45/424844845.db2.gz	VKTPGIFCQMORPF-IEBWSBKVSA-N	0	3	319.445	2.250	10	0		DEAEHN
O=C(c1c[nH]nc1-c1ccc(F)cc1)N1CCN2CCC[C@@H]2C1	ZINC000195325231	424882451	/nfs/dbraw/zinc/88/24/51/424882451.db2.gz	OOACOXPYNCZJMP-CQSZACIVSA-N	0	3	314.364	2.136	10	0		DEAEHN
CN(Cc1cncc(Br)c1)[C@@H]1CN2CCC1CC2	ZINC000386371357	424911335	/nfs/dbraw/zinc/91/13/35/424911335.db2.gz	RRINUAMPVXNISD-CQSZACIVSA-N	0	3	310.239	2.370	10	0		DEAEHN
COc1ccc(C[C@@H](C)CN2CCCNC(=O)[C@H]2C)cc1F	ZINC000249000651	424886703	/nfs/dbraw/zinc/88/67/03/424886703.db2.gz	HKRBMZARSZXTMN-CHWSQXEVSA-N	0	3	308.397	2.223	10	0		DEAEHN
Cc1ccsc1CNC(=O)CN(C)[C@]1(CO)CC[C@@H](C)C1	ZINC000249564554	424887532	/nfs/dbraw/zinc/88/75/32/424887532.db2.gz	MSGDHNHHYRWZFN-MLGOLLRUSA-N	0	3	310.463	2.156	10	0		DEAEHN
Cc1nn(C)c2ncc(CN3CC[C@H](O)CC34CCC4)cc12	ZINC000333892722	269001382	/nfs/dbraw/zinc/00/13/82/269001382.db2.gz	XNKGZOSCLYGRGI-AWEZNQCLSA-N	0	3	300.406	2.156	10	0		DEAEHN
Cc1ccnc(NCC2(O)CCN(Cc3ccccc3)CC2)n1	ZINC000397605552	269106700	/nfs/dbraw/zinc/10/67/00/269106700.db2.gz	WVBJIMLYDLJHPA-UHFFFAOYSA-N	0	3	312.417	2.224	10	0		DEAEHN
COc1cccc2c(N3CCO[C@@H](CN(C)C)C3)cc(C)nc12	ZINC000124919640	274150025	/nfs/dbraw/zinc/15/00/25/274150025.db2.gz	GUUCFLBTHXELNV-AWEZNQCLSA-N	0	3	315.417	2.319	10	0		DEAEHN
O=C1NCCC[C@@H]1N[C@H]1CCc2cc(Br)ccc2C1	ZINC000104358118	275022943	/nfs/dbraw/zinc/02/29/43/275022943.db2.gz	SIUJPPZUZAVBMX-KBPBESRZSA-N	0	3	323.234	2.175	10	0		DEAEHN
c1cnc(N2CCN(C[C@H]3CCc4ccccc4C3)CC2)nc1	ZINC000359592881	275073507	/nfs/dbraw/zinc/07/35/07/275073507.db2.gz	ZSWYHUJYEWSXSG-INIZCTEOSA-N	0	3	308.429	2.404	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCN(c2cccc3c2CNCC3)CC1	ZINC000082792853	275825098	/nfs/dbraw/zinc/82/50/98/275825098.db2.gz	WFDJZTQNOUIKPB-UHFFFAOYSA-N	0	3	317.433	2.389	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC(Oc2ccc(C)cn2)CC1)N(C)C	ZINC000181563203	276268511	/nfs/dbraw/zinc/26/85/11/276268511.db2.gz	LMBUXLXUSQRNPG-INIZCTEOSA-N	0	3	319.449	2.490	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCCc3sccc32)CCO1	ZINC000136621918	276797797	/nfs/dbraw/zinc/79/77/97/276797797.db2.gz	HBUFQKFJUOQOCD-OCCSQVGLSA-N	0	3	323.462	2.098	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)N[C@@H]2CCOc3ccccc32)C1	ZINC000171582809	276828918	/nfs/dbraw/zinc/82/89/18/276828918.db2.gz	GKXPWZUXYFRYJX-UKRRQHHQSA-N	0	3	303.406	2.246	10	0		DEAEHN
CN1CC[C@H](NC(=O)NC[C@@H]2CCCOC2)[C@@H]1c1ccccc1	ZINC000179130340	277166970	/nfs/dbraw/zinc/16/69/70/277166970.db2.gz	VCGXVHBHVCZELA-XIRDDKMYSA-N	0	3	317.433	2.158	10	0		DEAEHN
CCOC[C@@H](NC(=O)N[C@@H](CC(C)C)CN(C)C)C(C)C	ZINC000190125197	279729313	/nfs/dbraw/zinc/72/93/13/279729313.db2.gz	ZNXRTEODROWGAC-LSDHHAIUSA-N	0	3	301.475	2.323	10	0		DEAEHN
Cc1c(NC(=O)N2C[C@@H]3CCN(C)[C@@H]3C2)cccc1N(C)C	ZINC000455073368	280244161	/nfs/dbraw/zinc/24/41/61/280244161.db2.gz	MJFZFYIIKZGEPL-XJKSGUPXSA-N	0	3	302.422	2.229	10	0		DEAEHN
CC[C@H](C(=O)NCC[C@@H]1COc2ccccc2O1)N(CC)CC	ZINC000361914979	280676337	/nfs/dbraw/zinc/67/63/37/280676337.db2.gz	GNDOUQPODHUWPS-HUUCEWRRSA-N	0	3	320.433	2.453	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN([C@@H](C)C(=O)NCC(C)C)C2)n1	ZINC000195516197	281246137	/nfs/dbraw/zinc/24/61/37/281246137.db2.gz	QPNNKEXYTSZWRO-HOTGVXAUSA-N	0	3	318.465	2.285	10	0		DEAEHN
C[C@H](NCCC(=O)N1CCOCC1)c1ccc(Cl)s1	ZINC000135133242	282062833	/nfs/dbraw/zinc/06/28/33/282062833.db2.gz	QGSANKVEDDCTMT-JTQLQIEISA-N	0	3	302.827	2.301	10	0		DEAEHN
C[C@@H]1OCCC[C@H]1C(=O)N1C[C@@H](N(C)C)Cc2ccccc21	ZINC000253276276	288869619	/nfs/dbraw/zinc/86/96/19/288869619.db2.gz	JSVZSLOPWSWHTG-CWRNSKLLSA-N	0	3	302.418	2.321	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@H]1C(=O)NC1CCN(C2CC2)CC1	ZINC000117748516	289086411	/nfs/dbraw/zinc/08/64/11/289086411.db2.gz	DRKHUOHUTAFTIJ-SJKOYZFVSA-N	0	3	300.402	2.294	10	0		DEAEHN
C[C@H](C(=O)N1c2ccccc2C[C@H]1C)N1CCN2CCC[C@H]2C1	ZINC000246591391	289328526	/nfs/dbraw/zinc/32/85/26/289328526.db2.gz	SYNKJSKGNXGTAR-INMHGKMJSA-N	0	3	313.445	2.133	10	0		DEAEHN
C[C@H](CN)C(=O)/N=c1/sccn1Cc1ccccc1Cl	ZINC000262479231	289527425	/nfs/dbraw/zinc/52/74/25/289527425.db2.gz	ZINBEMOKDFQDME-SBGIHMHXSA-N	0	3	309.822	2.273	10	0		DEAEHN
C[C@H](N)C(=O)Nc1nnc(C23CC4CC(CC(C4)C2)C3)s1	ZINC000132613956	289764841	/nfs/dbraw/zinc/76/48/41/289764841.db2.gz	GAMXUHXJFSKTDR-ITOAGHBLSA-N	0	3	306.435	2.292	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCC(C)(C)CCO)[C@@H]1c1ccccc1	ZINC000247977837	290139512	/nfs/dbraw/zinc/13/95/12/290139512.db2.gz	GUDWFADEPIGBNV-CVEARBPZSA-N	0	3	319.449	2.140	10	0		DEAEHN
Cc1csc(NC(=O)CN[C@H]2CCCC[C@@H]2n2cccn2)n1	ZINC000129106489	293041835	/nfs/dbraw/zinc/04/18/35/293041835.db2.gz	WPIXXQCZULNZCP-STQMWFEESA-N	0	3	319.434	2.360	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)N(C)[C@@H]2CCCN(C)C2)c1	ZINC000247318425	295317495	/nfs/dbraw/zinc/31/74/95/295317495.db2.gz	HXBVHSTYPKDPKY-PVAVHDDUSA-N	0	3	302.418	2.351	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)N1CCCC[C@@H]1c1nccs1	ZINC000133672666	295539236	/nfs/dbraw/zinc/53/92/36/295539236.db2.gz	SFKCUYCZRFWSEA-VXGBXAGGSA-N	0	3	311.476	2.292	10	0		DEAEHN
CSCC(=O)N[C@@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000193952717	295585993	/nfs/dbraw/zinc/58/59/93/295585993.db2.gz	RSWCJFCOROQDPT-CQSZACIVSA-N	0	3	320.458	2.454	10	0		DEAEHN
C[C@H](NC(=O)C1(N)CCOCC1)C12CC3CC(CC(C3)C1)C2	ZINC000262107348	299031101	/nfs/dbraw/zinc/03/11/01/299031101.db2.gz	JLBUVPHHMQKWRW-ORVZXPRGSA-N	0	3	306.450	2.215	10	0		DEAEHN
Cc1cc(C)n([C@@H](C)C(=O)N[C@H](CN(C)C)c2ccccc2)n1	ZINC000120257303	301246426	/nfs/dbraw/zinc/24/64/26/301246426.db2.gz	MBRKGYSREXVDFV-DOTOQJQBSA-N	0	3	314.433	2.480	10	0		DEAEHN
Cc1ccc([C@@H]2OCCC[C@H]2C(=O)N2CCCNCC2)cc1	ZINC000262484162	301770884	/nfs/dbraw/zinc/77/08/84/301770884.db2.gz	WGIJBHIWRUQAID-SJORKVTESA-N	0	3	302.418	2.285	10	0		DEAEHN
Cc1nc2n(n1)CCC[C@H]2N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2	ZINC000194111675	302678459	/nfs/dbraw/zinc/67/84/59/302678459.db2.gz	ZZDWNYZLTYTCLZ-KBUPBQIOSA-N	0	3	302.422	2.359	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1cc(Cl)c(OC)c(OC)c1	ZINC000175855691	325746216	/nfs/dbraw/zinc/74/62/16/325746216.db2.gz	LLJHONYMZVYTNN-OAHLLOKOSA-N	0	3	317.813	2.234	10	0		DEAEHN
C[C@H](NC(=O)Nc1nncs1)[C@@H](c1ccccc1)N(C)C	ZINC000185941332	332275090	/nfs/dbraw/zinc/27/50/90/332275090.db2.gz	BNKOWGYJZCOASR-JQWIXIFHSA-N	0	3	305.407	2.351	10	0		DEAEHN
Cc1nc(CC(C)C)oc1C(=O)N1CC[C@@H](N2CCCC2)C1	ZINC000190270633	336262116	/nfs/dbraw/zinc/26/21/16/336262116.db2.gz	MGOVYZWQUCZJIG-CQSZACIVSA-N	0	3	305.422	2.492	10	0		DEAEHN
CC/C=C/CCOC[C@H](O)CNCCOc1ccccc1OC	ZINC000584627944	337376256	/nfs/dbraw/zinc/37/62/56/337376256.db2.gz	XTAYPQWLULFLFP-DWTRPJMMSA-N	0	3	323.433	2.397	10	0		DEAEHN
C[C@H]1CC[C@](CO)(N(C)CC(=O)NCc2ccc(Cl)cc2)C1	ZINC000187954696	533771687	/nfs/dbraw/zinc/77/16/87/533771687.db2.gz	RVPKWBAXLPJOEN-GUYCJALGSA-N	0	3	324.852	2.439	10	0		DEAEHN
COc1cccc2c1CC[C@@H](NCc1cc(C(N)=O)co1)C2	ZINC000192448246	533862489	/nfs/dbraw/zinc/86/24/89/533862489.db2.gz	DVRGZZIEBDUNKE-CYBMUJFWSA-N	0	3	300.358	2.034	10	0		DEAEHN
C[C@H]1COCC[C@H]1C(=O)NCCCN1CCc2ccccc2C1	ZINC000193989722	534040995	/nfs/dbraw/zinc/04/09/95/534040995.db2.gz	FLCWRSQHHRGETE-MAUKXSAKSA-N	0	3	316.445	2.224	10	0		DEAEHN
CCC[C@H](C(=O)NCCN(C)Cc1ccc(F)cc1)N(C)C	ZINC000132352028	520978697	/nfs/dbraw/zinc/97/86/97/520978697.db2.gz	DYWGEDUIUJSNSU-MRXNPFEDSA-N	0	3	309.429	2.104	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)NC[C@H]1CCCN1CCOC	ZINC000111867809	521364297	/nfs/dbraw/zinc/36/42/97/521364297.db2.gz	KIGBMEZZYVCDDK-QGZVFWFLSA-N	0	3	319.449	2.329	10	0		DEAEHN
CCN1CC[C@H]2OCCN(CCc3ccc(F)c(F)c3)[C@H]2C1	ZINC000339385519	521722608	/nfs/dbraw/zinc/72/26/08/521722608.db2.gz	QLCLKJMTTJHKAC-DLBZAZTESA-N	0	3	310.388	2.302	10	0		DEAEHN
CCc1nc(CNC(=O)NCCN2CCC(C)CC2)cs1	ZINC000107736114	522332467	/nfs/dbraw/zinc/33/24/67/522332467.db2.gz	GXFHYYJZIGUDEN-UHFFFAOYSA-N	0	3	310.467	2.237	10	0		DEAEHN
CC[C@@H](COC)NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1	ZINC000157254732	522595367	/nfs/dbraw/zinc/59/53/67/522595367.db2.gz	NNGSWJWKMPDMAG-LZWOXQAQSA-N	0	3	307.438	2.210	10	0		DEAEHN
CC[C@H]1CN(CCOc2ccc(OC)cc2)CCN1CCOC	ZINC000105835868	523280514	/nfs/dbraw/zinc/28/05/14/523280514.db2.gz	QIUALYQYRDEYRI-INIZCTEOSA-N	0	3	322.449	2.117	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000247052428	524265949	/nfs/dbraw/zinc/26/59/49/524265949.db2.gz	OZPWEQMDPHXRSU-GJZGRUSLSA-N	0	3	317.433	2.183	10	0		DEAEHN
C[C@H]1C[C@@H]1NC(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000111599432	524847321	/nfs/dbraw/zinc/84/73/21/524847321.db2.gz	OSMNNRZUMINHGL-RDJZCZTQSA-N	0	3	301.434	2.113	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(C(=O)C1CCN(C)CC1)CC2	ZINC000374342137	534880448	/nfs/dbraw/zinc/88/04/48/534880448.db2.gz	RWYATBUZBOPNJR-UHFFFAOYSA-N	0	3	314.429	2.158	10	0		DEAEHN
Cc1cnn(CCN[C@H]2CCCN(c3ccccc3F)C2=O)c1	ZINC000162117354	526263667	/nfs/dbraw/zinc/26/36/67/526263667.db2.gz	LTRQLGMMNXKWGP-HNNXBMFYSA-N	0	3	316.380	2.116	10	0		DEAEHN
COC(=O)[C@@H]1CC12CCN(Cc1cccc3c1NCC3)CC2	ZINC000261927515	536461144	/nfs/dbraw/zinc/46/11/44/536461144.db2.gz	LBXPJQQRDYYQRY-HNNXBMFYSA-N	0	3	300.402	2.430	10	0		DEAEHN
CC(=O)c1ccccc1OCCN1C[C@@H]2CCCN2C[C@@H]1C	ZINC000247059037	534927624	/nfs/dbraw/zinc/92/76/24/534927624.db2.gz	HGDGBSHEGUKFJG-HOCLYGCPSA-N	0	3	302.418	2.437	10	0		DEAEHN
CCCN(CC)C[C@@H](C)NC(=O)C(=O)c1cnn(C(C)(C)C)c1	ZINC000359747044	535301095	/nfs/dbraw/zinc/30/10/95/535301095.db2.gz	WROWRICRKVMPFL-CYBMUJFWSA-N	0	3	322.453	2.057	10	0		DEAEHN
CCOc1ccccc1/C=C/c1nc([C@@H]2CNCCN2C)no1	ZINC000263158282	535485265	/nfs/dbraw/zinc/48/52/65/535485265.db2.gz	DPLOXZAIVPQMGX-VFNNOXKTSA-N	0	3	314.389	2.215	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc(OC)c(F)c2)CCN1C[C@H](C)O	ZINC000246925927	535864660	/nfs/dbraw/zinc/86/46/60/535864660.db2.gz	AOZAPRVCUUATBY-DZGCQCFKSA-N	0	3	310.413	2.111	10	0		DEAEHN
CCn1nnc(C)c1CNCCCc1ccc(OC)c(OC)c1	ZINC000449103369	535914668	/nfs/dbraw/zinc/91/46/68/535914668.db2.gz	PWGBHWZTHJZEPB-UHFFFAOYSA-N	0	3	318.421	2.346	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N[C@@H]2CCC[C@@H]3OCC[C@H]32)cc1	ZINC000246907759	535999060	/nfs/dbraw/zinc/99/90/60/535999060.db2.gz	FCXHLYQLBTZUCX-BBWFWOEESA-N	0	3	302.418	2.436	10	0		DEAEHN
CN1CCC(CC(=O)N2CCC(C(=O)OC(C)(C)C)CC2)CC1	ZINC000362855067	536335471	/nfs/dbraw/zinc/33/54/71/536335471.db2.gz	XYJAKZBJQZFZKR-UHFFFAOYSA-N	0	3	324.465	2.299	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)NC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12	ZINC000248589524	536365356	/nfs/dbraw/zinc/36/53/56/536365356.db2.gz	XWPQMWIPMODHRM-KSZLIROESA-N	0	3	313.445	2.308	10	0		DEAEHN
COc1cc(C[NH2+][C@@H](C)C[C@H](C)O)cc(Br)c1[O-]	ZINC000228072414	536805996	/nfs/dbraw/zinc/80/59/96/536805996.db2.gz	CDEPNDRAJFDWMU-IUCAKERBSA-N	0	3	318.211	2.412	10	0		DEAEHN
CCN1CCN([C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000685952294	568422157	/nfs/dbraw/zinc/42/21/57/568422157.db2.gz	DDRRFSIGISUUOZ-OAHLLOKOSA-N	0	3	311.470	2.414	10	0		DEAEHN
COCC[C@H](N)C(=O)N(C)Cc1ccc(Cl)c(Cl)c1	ZINC000052808269	625105711	/nfs/dbraw/zinc/10/57/11/625105711.db2.gz	YUMJNRNIKOXSPR-LBPRGKRZSA-N	0	3	305.205	2.316	10	0		DEAEHN
Cc1cc(C)cc([C@H](O)CN(C)CCN2C[C@@H](C)O[C@@H](C)C2)c1	ZINC000195303697	625786043	/nfs/dbraw/zinc/78/60/43/625786043.db2.gz	QWEBWZJYMXNMDZ-ZIFCJYIRSA-N	0	3	320.477	2.378	10	0		DEAEHN
CCCCNC(=O)[C@@H]1CC[C@H](C)N(C/C=C(\C)C(=O)OC)C1	ZINC000746503943	638350263	/nfs/dbraw/zinc/35/02/63/638350263.db2.gz	QEJLPONOQLJZBM-WMHHWXMBSA-N	0	3	310.438	2.123	10	0		DEAEHN
COc1cc(C[NH2+][C@H](C)[C@@H](C)O)cc(Br)c1[O-]	ZINC000342244795	639500725	/nfs/dbraw/zinc/50/07/25/639500725.db2.gz	YOMMXKSKSHHBHJ-HTQZYQBOSA-N	0	3	304.184	2.022	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@H](C)[C@H](O)c1ccc(C)cc1	ZINC000804483119	645779364	/nfs/dbraw/zinc/77/93/64/645779364.db2.gz	BMCRYDYJIKRZBB-OIISXLGYSA-N	0	3	304.434	2.408	10	0		DEAEHN
CC(C)(C)OC(=O)N(C[C@H](O)C1CC1)c1ccc(CN)nc1	ZINC000757132446	645927964	/nfs/dbraw/zinc/92/79/64/645927964.db2.gz	BFPCMVJYWBIVIJ-AWEZNQCLSA-N	0	3	307.394	2.053	10	0		DEAEHN
CN(C)c1cc(C(=O)NCCN2CCCCC2)cc(Cl)n1	ZINC000733130008	647889514	/nfs/dbraw/zinc/88/95/14/647889514.db2.gz	AGYIKYICFOZMJE-UHFFFAOYSA-N	0	3	310.829	2.017	10	0		DEAEHN
CN(C)C[C@H](NC(=O)/C=C/c1cncc(O)c1)c1ccccc1	ZINC000181836526	648761535	/nfs/dbraw/zinc/76/15/35/648761535.db2.gz	VJEMPFQQXLDYGQ-IJDCCNJMSA-N	0	3	311.385	2.220	10	0		DEAEHN
CC#CCCCCOC(=O)C1CC[C@@H](C(F)(F)F)NC1=O	ZINC000183956665	649209373	/nfs/dbraw/zinc/20/93/73/649209373.db2.gz	LKTCMSMPDHBGNJ-MNOVXSKESA-N	0	3	305.296	2.180	10	0		DEAEHN
CC(C)[C@H](N)c1cn(Cc2ncccc2Br)nn1	ZINC000381189388	685400474	/nfs/dbraw/zinc/40/04/74/685400474.db2.gz	WRIPEGNFOUEAIB-LBPRGKRZSA-N	0	3	310.199	2.140	10	0		DEAEHN
CN(C[C@H]1CCN(Cc2ccccc2)C1)c1ncc(C=O)cn1	ZINC000383150510	685406888	/nfs/dbraw/zinc/40/68/88/685406888.db2.gz	IJDVOHONVZYPSZ-MRXNPFEDSA-N	0	3	310.401	2.247	10	0		DEAEHN
O=[N+]([O-])c1cccc(N2CCN([C@@H]3CCCC[C@@H]3O)CC2)c1	ZINC000089885920	684027494	/nfs/dbraw/zinc/02/74/94/684027494.db2.gz	GWGZXOGMHFRPHM-CVEARBPZSA-N	0	3	305.378	2.020	10	0		DEAEHN
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)C2=CCCCO2)C1	ZINC000190655903	684410294	/nfs/dbraw/zinc/41/02/94/684410294.db2.gz	RQBQGPXFMLJSGC-MRXNPFEDSA-N	0	3	315.417	2.056	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CSCCS1	ZINC000245831895	685119391	/nfs/dbraw/zinc/11/93/91/685119391.db2.gz	BVSIGWQQUORYDN-DZGCQCFKSA-N	0	3	324.515	2.472	10	0		DEAEHN
CN(C)Cc1cc(O[C@@H]2CCN(Cc3cccn3C)C2)ccn1	ZINC000886041381	691990172	/nfs/dbraw/zinc/99/01/72/691990172.db2.gz	PKTPNNNGNVYMIQ-GOSISDBHSA-N	0	3	314.433	2.135	10	0		DEAEHN
Brc1ccccc1CNC[C@H]1C[C@@H]2COC[C@@H]2O1	ZINC000724636580	777418357	/nfs/dbraw/zinc/41/83/57/777418357.db2.gz	NIEMUFNJISYYGC-BZPMIXESSA-N	0	3	312.207	2.343	10	0		DEAEHN
C[C@@](O)(CN1CC[C@@H]2OCC[C@@H]2C1)C(F)(F)C(F)(F)F	ZINC000724688137	777462842	/nfs/dbraw/zinc/46/28/42/777462842.db2.gz	CKFPIQBUGYHXEQ-KXUCPTDWSA-N	0	3	303.271	2.046	10	0		DEAEHN
Cc1nn(C)cc1CN[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000721844839	780282739	/nfs/dbraw/zinc/28/27/39/780282739.db2.gz	DYKIKVCWOVWUTM-BXUZGUMPSA-N	0	3	308.426	2.074	10	0		DEAEHN
CO[C@]1(CN[C@H](C)c2cc(C)sc2C)CCS(=O)(=O)C1	ZINC000721258030	781016684	/nfs/dbraw/zinc/01/66/84/781016684.db2.gz	GGGSCMBVTQUCQV-RISCZKNCSA-N	0	3	317.476	2.219	10	0		DEAEHN
CCc1ccc(S(=O)(=O)N2CCNCCC23CCC3)s1	ZINC000713219406	792216481	/nfs/dbraw/zinc/21/64/81/792216481.db2.gz	ZBOZKWDFFZDOHU-UHFFFAOYSA-N	0	3	314.476	2.217	10	0		DEAEHN
CC[C@H](C)N1CCN(Cc2cn(C)nc2Br)CC1	ZINC000713826764	792261277	/nfs/dbraw/zinc/26/12/77/792261277.db2.gz	RBEBTOUXTNPREA-NSHDSACASA-N	0	3	315.259	2.099	10	0		DEAEHN
C[C@@]1(c2cccc(CNCc3cccs3)c2)NC(=O)NC1=O	ZINC000171130945	793712452	/nfs/dbraw/zinc/71/24/52/793712452.db2.gz	GVVFFQVQWYHSAY-INIZCTEOSA-N	0	3	315.398	2.093	10	0		DEAEHN
C[C@H]1C[C@H](NCc2ccnn2C)CN(C(=O)OC(C)(C)C)C1	ZINC000401709110	801845409	/nfs/dbraw/zinc/84/54/09/801845409.db2.gz	CTOYHHFNIHVQOO-STQMWFEESA-N	0	3	308.426	2.155	10	0		DEAEHN
CN1CCC[C@@H]2[C@@H]1CCN2C(=O)c1ccoc1Br	ZINC000720817244	1086168239	/nfs/dbraw/zinc/16/82/39/1086168239.db2.gz	RHUJXQFVHPBNTK-WDEREUQCSA-N	0	3	313.195	2.351	10	0		DEAEHN
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C)c1ccnn1C	ZINC000700736612	1086331636	/nfs/dbraw/zinc/33/16/36/1086331636.db2.gz	ARVXEOFYPNJVGV-RWMBFGLXSA-N	0	3	308.426	2.469	10	0		DEAEHN
CCn1cc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C)cn1	ZINC000700737546	1086333094	/nfs/dbraw/zinc/33/30/94/1086333094.db2.gz	OGQDLJZWBXRNBI-GXTWGEPZSA-N	0	3	308.426	2.391	10	0		DEAEHN
COC[C@H](C)OC(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000704469446	1086580827	/nfs/dbraw/zinc/58/08/27/1086580827.db2.gz	AOYUBXKMOXISDQ-YOEHRIQHSA-N	0	3	306.406	2.412	10	0		DEAEHN
CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@]2(NCc2c[nH]cn2)C1	ZINC000711352921	1087072754	/nfs/dbraw/zinc/07/27/54/1087072754.db2.gz	PYQGPYZYEOWQCS-LRDDRELGSA-N	0	3	306.410	2.289	10	0		DEAEHN
Cn1cc(CN[C@@]23CCC[C@@H]2N(C(=O)OC(C)(C)C)CC3)cn1	ZINC000711637536	1087179092	/nfs/dbraw/zinc/17/90/92/1087179092.db2.gz	ADXORLGWLCBGCV-WMLDXEAASA-N	0	3	320.437	2.442	10	0		DEAEHN
Brc1cnn(CCCNCc2nccn2C2CC2)c1	ZINC000711785472	1087202595	/nfs/dbraw/zinc/20/25/95/1087202595.db2.gz	QALAXQXADMBQMM-UHFFFAOYSA-N	0	3	324.226	2.357	10	0		DEAEHN
Cc1ccc(CN[C@H]2CCCNC2=O)c(C)c1Br	ZINC000719567575	1089304217	/nfs/dbraw/zinc/30/42/17/1089304217.db2.gz	YPCMBXWZKQGEFH-LBPRGKRZSA-N	0	3	311.223	2.434	10	0		DEAEHN
CC(C)CC[C@@H](N)C(=O)NCCOC(F)(F)C(F)(F)F	ZINC000720235414	1089536816	/nfs/dbraw/zinc/53/68/16/1089536816.db2.gz	PCLHFNAMLZWIPG-MRVPVSSYSA-N	0	3	306.275	2.038	10	0		DEAEHN
CN[C@@H](CSCCS(C)(=O)=O)c1ccc(C)cc1C	ZINC000081768416	192322551	/nfs/dbraw/zinc/32/25/51/192322551.db2.gz	VYOSLYHYQQVBMC-AWEZNQCLSA-N	0	3	301.477	2.342	10	0		DEAEHN
COc1ccc(CCCNC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000139773392	282101969	/nfs/dbraw/zinc/10/19/69/282101969.db2.gz	SHRSMNCNPQUHJZ-HNNXBMFYSA-N	0	3	305.422	2.021	10	0		DEAEHN
CCOC(=O)CSC[C@H](NC)c1ccc(OC)c(OC)c1	ZINC000081795516	192324775	/nfs/dbraw/zinc/32/47/75/192324775.db2.gz	CHCSEGQHHYPAJA-LBPRGKRZSA-N	0	3	313.419	2.261	10	0		DEAEHN
CN[C@@H](CSc1nnc(C)o1)c1ccc2c(c1)OCCO2	ZINC000081877816	192333105	/nfs/dbraw/zinc/33/31/05/192333105.db2.gz	RYTBPULLZZFQPA-NSHDSACASA-N	0	3	307.375	2.202	10	0		DEAEHN
N[C@@H]1CCCC[C@@H]1S(=O)(=O)c1ccccc1Br	ZINC000081932007	192340903	/nfs/dbraw/zinc/34/09/03/192340903.db2.gz	MBIBISLNBXKBIZ-PWSUYJOCSA-N	0	3	318.236	2.493	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)CC23CC4CC(CC(C4)C2)C3)CCO1	ZINC000116790302	282136881	/nfs/dbraw/zinc/13/68/81/282136881.db2.gz	YJLIQLBTHLNQCX-WCWCZOKXSA-N	0	3	320.477	2.382	10	0		DEAEHN
CCC[C@@H](N)[C@@H](CC)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000081935475	192342702	/nfs/dbraw/zinc/34/27/02/192342702.db2.gz	ZAZNDKOFLTVCRH-IUODEOHRSA-N	0	3	313.419	2.138	10	0		DEAEHN
CC[C@H]1CCCN(S(=O)(=O)Cc2ccccc2CN)CC1	ZINC000079308562	185164387	/nfs/dbraw/zinc/16/43/87/185164387.db2.gz	KMWFSEQKVLJDAW-AWEZNQCLSA-N	0	3	310.463	2.487	10	0		DEAEHN
CCC[C@@H]1CCCN(S(=O)(=O)C[C@@H]2CCCCN2)CC1	ZINC000079358294	185166967	/nfs/dbraw/zinc/16/69/67/185166967.db2.gz	BHSWKZHEKQXTLQ-CABCVRRESA-N	0	3	302.484	2.361	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H](C)Oc1cccc(CO)c1	ZINC000152911809	282156965	/nfs/dbraw/zinc/15/69/65/282156965.db2.gz	JRIGINWMMVBJQW-ZBFHGGJFSA-N	0	3	322.449	2.039	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(N3CCCCCC3)nc2)C1	ZINC000170867174	282180605	/nfs/dbraw/zinc/18/06/05/282180605.db2.gz	LLOTULXARDPHJK-INIZCTEOSA-N	0	3	316.449	2.238	10	0		DEAEHN
C[C@@H](CCCO)NCc1ccc(I)o1	ZINC000087358773	185222585	/nfs/dbraw/zinc/22/25/85/185222585.db2.gz	CXTIAZWXBJXSIU-QMMMGPOBSA-N	0	3	309.147	2.135	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCC2(C1)CCCCC2	ZINC000173173245	282188303	/nfs/dbraw/zinc/18/83/03/282188303.db2.gz	KPUQAOVOADQUFR-MRXNPFEDSA-N	0	3	323.481	2.463	10	0		DEAEHN
NC[C@@H](NC[C@@H]1CCCO1)c1cc(Br)ccc1F	ZINC000087928554	185237539	/nfs/dbraw/zinc/23/75/39/185237539.db2.gz	UVPYHUGRURNESN-GXFFZTMASA-N	0	3	317.202	2.357	10	0		DEAEHN
COc1ccc([C@@H](CN)NC[C@H]2CCCO2)c(Cl)c1OC	ZINC000087928375	185237571	/nfs/dbraw/zinc/23/75/71/185237571.db2.gz	KLWSVUSCUNMGSP-ZYHUDNBSSA-N	0	3	314.813	2.126	10	0		DEAEHN
COc1cc(C)c(Br)cc1[C@@H](N)[C@H]1COCCO1	ZINC000088078063	185239000	/nfs/dbraw/zinc/23/90/00/185239000.db2.gz	XYGGRDMZEWWWLS-CHWSQXEVSA-N	0	3	316.195	2.181	10	0		DEAEHN
CN[C@@H]1CCOC[C@H]1S(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000088312122	185245327	/nfs/dbraw/zinc/24/53/27/185245327.db2.gz	FWONNEGZAKHQRP-VXGBXAGGSA-N	0	3	324.229	2.144	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@@H](C)CC(C)C)o1	ZINC000088542282	185256464	/nfs/dbraw/zinc/25/64/64/185256464.db2.gz	LJBRIYBWSWWRMD-LBPRGKRZSA-N	0	3	302.440	2.492	10	0		DEAEHN
CCOC(=O)COC[C@H](N)c1cc(Br)sc1C	ZINC000088648310	185261619	/nfs/dbraw/zinc/26/16/19/185261619.db2.gz	GYBGIQWTRKMXOX-VIFPVBQESA-N	0	3	322.224	2.399	10	0		DEAEHN
CN[C@H]1c2ccccc2CCC[C@H]1S(=O)(=O)CCCOC	ZINC000081985278	192349401	/nfs/dbraw/zinc/34/94/01/192349401.db2.gz	APWQVULISPAEGD-CVEARBPZSA-N	0	3	311.447	2.103	10	0		DEAEHN
COc1cc(CN(CCC(=O)NC(C)C)C2CC2)ccc1O	ZINC000089971548	185272705	/nfs/dbraw/zinc/27/27/05/185272705.db2.gz	WOVPXOZAXMALCN-UHFFFAOYSA-N	0	3	306.406	2.280	10	0		DEAEHN
CC[C@H]([C@H](NC)c1ccccc1)S(=O)(=O)C1CCOCC1	ZINC000081989822	192350540	/nfs/dbraw/zinc/35/05/40/192350540.db2.gz	WANRGNCJJDLSAD-HZPDHXFCSA-N	0	3	311.447	2.320	10	0		DEAEHN
NC[C@H](c1cc(Cl)ccc1Br)N1CCOCC1	ZINC000090251417	185288074	/nfs/dbraw/zinc/28/80/74/185288074.db2.gz	LIQJLRALHGJIEE-GFCCVEGCSA-N	0	3	319.630	2.435	10	0		DEAEHN
CCc1nn(C)c(Cn2cc(CNC(C)(C)C)nn2)c1Cl	ZINC000090298176	185289882	/nfs/dbraw/zinc/28/98/82/185289882.db2.gz	WJUZIRBHZVAJLD-UHFFFAOYSA-N	0	3	310.833	2.164	10	0		DEAEHN
Cc1nn(C)c(Cl)c1COc1cc2c(cc1CN)OCO2	ZINC000166790166	197698915	/nfs/dbraw/zinc/69/89/15/197698915.db2.gz	OSPPUSZKOJGNSH-UHFFFAOYSA-N	0	3	309.753	2.148	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ncccc1C(F)(F)F	ZINC000092459005	185320068	/nfs/dbraw/zinc/32/00/68/185320068.db2.gz	UIMRMDIAFKPLPS-GHMZBOCLSA-N	0	3	313.323	2.409	10	0		DEAEHN
CN1CCC[C@@H](n2c(N)nc3cc(Br)cnc32)C1	ZINC000092575400	185326857	/nfs/dbraw/zinc/32/68/57/185326857.db2.gz	GYCLNUQPYSASEA-SECBINFHSA-N	0	3	310.199	2.043	10	0		DEAEHN
Cc1ccn2c(CN3CCC[C@@H](CCC(N)=O)C3)cnc2c1	ZINC000092660227	185332030	/nfs/dbraw/zinc/33/20/30/185332030.db2.gz	WMEGTCBDDZFMIW-AWEZNQCLSA-N	0	3	300.406	2.120	10	0		DEAEHN
CCCN(CCN(C)C)c1cc2c(cc1Cl)[C@@H](O)C(=O)N2	ZINC000092771409	185339249	/nfs/dbraw/zinc/33/92/49/185339249.db2.gz	HGKGKQNQOCMVOU-CQSZACIVSA-N	0	3	311.813	2.104	10	0		DEAEHN
CN[C@@H]1c2cc(OC)ccc2C[C@@H]1Sc1nnc(C)n1C	ZINC000092911771	185348456	/nfs/dbraw/zinc/34/84/56/185348456.db2.gz	UKEUKTBTKMRZCD-UONOGXRCSA-N	0	3	304.419	2.110	10	0		DEAEHN
CN(CC1CCN(C)CC1)C(=O)c1snnc1C(C)(C)C	ZINC000191955235	529865857	/nfs/dbraw/zinc/86/58/57/529865857.db2.gz	ATNFFFABSDYPRX-UHFFFAOYSA-N	0	3	310.467	2.249	10	0		DEAEHN
C[C@@H](c1ccccc1)N1CC[C@H](NCc2cc(C(N)=O)co2)C1	ZINC000189414785	282309266	/nfs/dbraw/zinc/30/92/66/282309266.db2.gz	IACABQHFYRYDID-BBRMVZONSA-N	0	3	313.401	2.304	10	0		DEAEHN
CN1CCC[C@@]2(CCN(c3ncnc4c3ncn4C3CC3)C2)C1	ZINC000292924491	530059804	/nfs/dbraw/zinc/05/98/04/530059804.db2.gz	YUPAEMDGJJDYDB-QGZVFWFLSA-N	0	3	312.421	2.083	10	0		DEAEHN
CC(C)[C@@H]([NH3+])CC(=O)Nc1cc(Br)ccc1[O-]	ZINC000136488554	539517954	/nfs/dbraw/zinc/51/79/54/539517954.db2.gz	JZPAMJJJVYELLF-VIFPVBQESA-N	0	3	301.184	2.467	10	0		DEAEHN
CC(=O)N(C)C1CCN(CCN(C)Cc2ccc(F)cc2)CC1	ZINC000181665185	539652919	/nfs/dbraw/zinc/65/29/19/539652919.db2.gz	VFGRWORHOIEWNG-UHFFFAOYSA-N	0	3	321.440	2.200	10	0		DEAEHN
CN[C@@H](C[S@@](=O)C1CCOCC1)c1cc(C)ccc1OC	ZINC000084054738	192397413	/nfs/dbraw/zinc/39/74/13/192397413.db2.gz	IVBDMLGNCIRDSG-BTYIYWSLSA-N	0	3	311.447	2.192	10	0		DEAEHN
COc1ccc(F)c2c1CN(Cc1c(C)nn(C)c1C)[C@H]2CN	ZINC000071683524	191006769	/nfs/dbraw/zinc/00/67/69/191006769.db2.gz	RKHDWFKYJJZQKP-HNNXBMFYSA-N	0	3	318.396	2.200	10	0		DEAEHN
CCCNCc1cc(F)c(F)c(S(=O)(=O)N(C)CC)c1	ZINC000138432995	186017152	/nfs/dbraw/zinc/01/71/52/186017152.db2.gz	IIQNUDJRNQPFCX-UHFFFAOYSA-N	0	3	306.378	2.105	10	0		DEAEHN
CC[C@@H]1CCCN1S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138574035	186017564	/nfs/dbraw/zinc/01/75/64/186017564.db2.gz	ZDDONFQGROKWEF-LLVKDONJSA-N	0	3	318.389	2.247	10	0		DEAEHN
CC(C)C[C@@H](C)N(C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138809534	186018940	/nfs/dbraw/zinc/01/89/40/186018940.db2.gz	JBKOUMMNDMRLKD-SNVBAGLBSA-N	0	3	320.405	2.479	10	0		DEAEHN
CN[C@@H](Cc1ccnc(N)c1)c1ccc(Br)cn1	ZINC000140201581	186026073	/nfs/dbraw/zinc/02/60/73/186026073.db2.gz	UZZKRLXANABLGY-LBPRGKRZSA-N	0	3	307.195	2.325	10	0		DEAEHN
CC(C)[C@@H](CN(C)C)N1C(=O)C2(CC2)N[C@H]1c1ccsc1	ZINC000145035139	186036348	/nfs/dbraw/zinc/03/63/48/186036348.db2.gz	FGMZJLZRFHTVOP-ZIAGYGMSSA-N	0	3	307.463	2.297	10	0		DEAEHN
CC(C)[C@H](CN(C)C)N1C(=O)C2(CC2)N[C@H]1c1ccsc1	ZINC000145035304	186036885	/nfs/dbraw/zinc/03/68/85/186036885.db2.gz	FGMZJLZRFHTVOP-UONOGXRCSA-N	0	3	307.463	2.297	10	0		DEAEHN
CN1CCN(C)[C@H](c2nc(-c3ccccc3)c(CN)s2)C1	ZINC000149411876	186049681	/nfs/dbraw/zinc/04/96/81/186049681.db2.gz	BFSRIZCQNCFYEA-ZDUSSCGKSA-N	0	3	302.447	2.187	10	0		DEAEHN
C[C@@H](c1ccccc1Cl)N(C)c1nc(N)nc(N(C)C)n1	ZINC000149581879	186051014	/nfs/dbraw/zinc/05/10/14/186051014.db2.gz	LVZZBOWUSQTRTM-VIFPVBQESA-N	0	3	306.801	2.371	10	0		DEAEHN
CN(Cc1ccc(Cl)cc1)C[C@@H](O)COC[C@H]1CCCO1	ZINC000250235918	539782839	/nfs/dbraw/zinc/78/28/39/539782839.db2.gz	OIEWNYYCCLVVEW-HZPDHXFCSA-N	0	3	313.825	2.328	10	0		DEAEHN
CN[C@@H]1CC(C)(C)Cc2nc([C@@H]3CCS(=O)(=O)C3)sc21	ZINC000150258740	186056192	/nfs/dbraw/zinc/05/61/92/186056192.db2.gz	DOVWKPQUHNUXDT-NXEZZACHSA-N	0	3	314.476	2.278	10	0		DEAEHN
COC(=O)c1[nH]c(C)c(C(=O)N[C@H](CC(C)C)CN(C)C)c1C	ZINC000155756663	186109869	/nfs/dbraw/zinc/10/98/69/186109869.db2.gz	FODUSZPFOACUED-CYBMUJFWSA-N	0	3	323.437	2.124	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@H]2CC[C@@H](C)O2)c(OCCN(C)C)c1	ZINC000155825876	186116007	/nfs/dbraw/zinc/11/60/07/186116007.db2.gz	ZVKJEYNVKNBILQ-HIFRSBDPSA-N	0	3	306.406	2.441	10	0		DEAEHN
CNCc1cc(Cl)cc(S(=O)(=O)NC2CC(C)C2)c1C	ZINC000163998146	186145655	/nfs/dbraw/zinc/14/56/55/186145655.db2.gz	SUCFDKIAEYAKGR-UHFFFAOYSA-N	0	3	316.854	2.445	10	0		DEAEHN
Cc1ccc([C@@H](CN)N2CCOC[C@@H]2C)c(Br)c1	ZINC000164064356	186147622	/nfs/dbraw/zinc/14/76/22/186147622.db2.gz	NPCSDJQECSRWTP-SMDDNHRTSA-N	0	3	313.239	2.478	10	0		DEAEHN
NCc1ccccc1NC(=O)C[S@](=O)c1ccccc1F	ZINC000155940911	186124350	/nfs/dbraw/zinc/12/43/50/186124350.db2.gz	RDKOVQQMJSXFHQ-OAQYLSRUSA-N	0	3	306.362	2.031	10	0		DEAEHN
COc1cc(CNC[C@@H](C)[S@@](C)=O)cc(Cl)c1OC	ZINC000159692731	186135867	/nfs/dbraw/zinc/13/58/67/186135867.db2.gz	SLNMNGBDUSLLQT-HOGDKLEQSA-N	0	3	305.827	2.214	10	0		DEAEHN
CCN1CCO[C@H](CN)[C@@H]1c1ccc(C)cc1Br	ZINC000164306649	186154971	/nfs/dbraw/zinc/15/49/71/186154971.db2.gz	NJEBUPNAIIAYQO-KGLIPLIRSA-N	0	3	313.239	2.478	10	0		DEAEHN
Cn1c2ccc(S(C)(=O)=O)cc2nc1[C@H]1CCCCCN1	ZINC000164371428	186157323	/nfs/dbraw/zinc/15/73/23/186157323.db2.gz	YATHURVPDVVYBL-GFCCVEGCSA-N	0	3	307.419	2.182	10	0		DEAEHN
CCN(CC)[C@H](C(=O)N1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000171471463	186165408	/nfs/dbraw/zinc/16/54/08/186165408.db2.gz	GMBARYSWMSLSII-MSOLQXFVSA-N	0	3	315.461	2.376	10	0		DEAEHN
CCC[C@H](C(=O)NCCc1nc2ccccc2n1CC)N(C)C	ZINC000179693321	186206996	/nfs/dbraw/zinc/20/69/96/186206996.db2.gz	UPHFXNPITDFZAY-MRXNPFEDSA-N	0	3	316.449	2.445	10	0		DEAEHN
CCC(=O)Nc1ccc(NC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000171889984	198002345	/nfs/dbraw/zinc/00/23/45/198002345.db2.gz	CXNSUSHQZHSZDS-HNNXBMFYSA-N	0	3	316.405	2.347	10	0		DEAEHN
CC1CCC(N(C(=O)CN2CCN3CCC[C@@H]3C2)C2CC2)CC1	ZINC000172192570	198055487	/nfs/dbraw/zinc/05/54/87/198055487.db2.gz	KWMBHTZRNJWQKL-LEOMRAHMSA-N	0	3	319.493	2.336	10	0		DEAEHN
Cc1ncsc1CCN1CCC(N(C)c2cccnn2)CC1	ZINC000172535461	198111642	/nfs/dbraw/zinc/11/16/42/198111642.db2.gz	QTHQFGMDNYJKCZ-UHFFFAOYSA-N	0	3	317.462	2.385	10	0		DEAEHN
COCCOc1ccc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000172617195	198124552	/nfs/dbraw/zinc/12/45/52/198124552.db2.gz	QNVHCVQVBHYKLC-GOEBONIOSA-N	0	3	320.433	2.267	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)c2ccccc2F)[C@H](C)C1	ZINC000173257604	198202612	/nfs/dbraw/zinc/20/26/12/198202612.db2.gz	CCIZOMYJUGENNI-TZMCWYRMSA-N	0	3	314.426	2.177	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)S(=O)(=O)Cc2ccccc2F)CCN1C	ZINC000173269525	198204621	/nfs/dbraw/zinc/20/46/21/198204621.db2.gz	KQVGHWDQZCBYKL-OCCSQVGLSA-N	0	3	314.426	2.070	10	0		DEAEHN
Cc1ccccc1NC(=O)CCN1CCC[C@H](n2cncn2)C1	ZINC000173365605	198206966	/nfs/dbraw/zinc/20/69/66/198206966.db2.gz	FRHRQALAWKDYAU-HNNXBMFYSA-N	0	3	313.405	2.252	10	0		DEAEHN
COC[C@H](C)C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000173518899	198223366	/nfs/dbraw/zinc/22/33/66/198223366.db2.gz	SZKPJXIMQXXGJR-JKSUJKDBSA-N	0	3	304.434	2.392	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)Cc1ccccc1	ZINC000173829505	198257572	/nfs/dbraw/zinc/25/75/72/198257572.db2.gz	BYDXWZPKAGOZCW-HZPDHXFCSA-N	0	3	308.447	2.075	10	0		DEAEHN
CCCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000174018597	198281143	/nfs/dbraw/zinc/28/11/43/198281143.db2.gz	RMXFDLPTMQNESN-QGZVFWFLSA-N	0	3	319.449	2.141	10	0		DEAEHN
CCOC(=O)C[C@@H](NC(=O)CN(CC)CC)c1ccccc1C	ZINC000174675186	198368684	/nfs/dbraw/zinc/36/86/84/198368684.db2.gz	PSMBLZVURLCNFK-MRXNPFEDSA-N	0	3	320.433	2.447	10	0		DEAEHN
CN1CCC(C(=O)Nc2nc(-c3ccccn3)cs2)CC1	ZINC000174716374	198373787	/nfs/dbraw/zinc/37/37/87/198373787.db2.gz	WMWOBZAFEYUHRF-UHFFFAOYSA-N	0	3	302.403	2.485	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCN(CC(C)C)CC1	ZINC000049969041	354364675	/nfs/dbraw/zinc/36/46/75/354364675.db2.gz	PARABOLFRWVOAD-UHFFFAOYSA-N	0	3	317.477	2.309	10	0		DEAEHN
CC(C)N1CC[C@@H](Nc2ccc3nnc(C(F)(F)F)n3n2)C1	ZINC000069000717	354843608	/nfs/dbraw/zinc/84/36/08/354843608.db2.gz	MBQKASZQRFJULX-SECBINFHSA-N	0	3	314.315	2.038	10	0		DEAEHN
C[C@H]1CC[C@H](C)N(CC(=O)NCCCN2CCCCCC2=O)C1	ZINC000076150155	355130311	/nfs/dbraw/zinc/13/03/11/355130311.db2.gz	RUUJALDWOTUIMR-HOTGVXAUSA-N	0	3	323.481	2.016	10	0		DEAEHN
CO[C@H](CNC(=O)N[C@@H](CC(C)C)CN(C)C)C(C)(C)C	ZINC000073722903	191347542	/nfs/dbraw/zinc/34/75/42/191347542.db2.gz	RZMFYWZTTFQTSF-UONOGXRCSA-N	0	3	301.475	2.323	10	0		DEAEHN
CN1CCC(CC(=O)Nc2ccccc2N2CCOCC2)CC1	ZINC000074921043	191388859	/nfs/dbraw/zinc/38/88/59/191388859.db2.gz	HNTKNCAULAWYDD-UHFFFAOYSA-N	0	3	317.433	2.194	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)N[C@H](C)[C@@H]2CCCO2)o1	ZINC000079620053	355322427	/nfs/dbraw/zinc/32/24/27/355322427.db2.gz	OUMGWUZITRMJJB-ZBFHGGJFSA-N	0	3	323.437	2.229	10	0		DEAEHN
C[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@H](CN)C(F)(F)F	ZINC000401705861	540141399	/nfs/dbraw/zinc/14/13/99/540141399.db2.gz	DNOWNKJARZZPHR-GMSGAONNSA-N	0	3	310.703	2.113	10	0		DEAEHN
C[C@H](Oc1cccc(Cl)c1)C(=O)N[C@H](CN)C(F)(F)F	ZINC000401705862	540141765	/nfs/dbraw/zinc/14/17/65/540141765.db2.gz	DNOWNKJARZZPHR-OIBJUYFYSA-N	0	3	310.703	2.113	10	0		DEAEHN
C[C@@H](CO)[C@@H](C)NCc1cc2c(c(Br)c1)OCO2	ZINC000077423434	191712743	/nfs/dbraw/zinc/71/27/43/191712743.db2.gz	BYNJJJNKVLQFRW-DTWKUNHWSA-N	0	3	316.195	2.284	10	0		DEAEHN
CC(C)c1nn(C)c(N2CCOCC2)c1CNC1CCCC1	ZINC000113311953	355758310	/nfs/dbraw/zinc/75/83/10/355758310.db2.gz	WBUWJBCVOBTQRE-UHFFFAOYSA-N	0	3	306.454	2.412	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)CCCc2nc(C3CC3)no2)CCN1C	ZINC000127546461	355822749	/nfs/dbraw/zinc/82/27/49/355822749.db2.gz	SULTVRNJMCPGBI-TZMCWYRMSA-N	0	3	320.437	2.211	10	0		DEAEHN
C[C@H](NCc1nnc(-c2ccccc2)n1C)C1CCOCC1	ZINC000179839665	356035288	/nfs/dbraw/zinc/03/52/88/356035288.db2.gz	FXHXGVQWRIAWQZ-ZDUSSCGKSA-N	0	3	300.406	2.387	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc3c(c2)N(C)CC3)C1	ZINC000180224393	356045269	/nfs/dbraw/zinc/04/52/69/356045269.db2.gz	QEIDNEZEVYDGPK-OAHLLOKOSA-N	0	3	302.422	2.285	10	0		DEAEHN
CNc1cc(N2CCC[C@H]2CN[C@@H](C)c2ccoc2)ncn1	ZINC000180572784	356053093	/nfs/dbraw/zinc/05/30/93/356053093.db2.gz	OUEDEORRBBDWRD-JSGCOSHPSA-N	0	3	301.394	2.431	10	0		DEAEHN
C[C@H](NC[C@@H](O)COC(C)(C)C)c1ccc(-n2ccnn2)cc1	ZINC000182051071	356107409	/nfs/dbraw/zinc/10/74/09/356107409.db2.gz	KWNDHCFXFFSNQL-XJKSGUPXSA-N	0	3	318.421	2.094	10	0		DEAEHN
O=C(N[C@@H]1CN2CCC1CC2)c1cc(Cl)cc2nc[nH]c21	ZINC000005491129	181249158	/nfs/dbraw/zinc/24/91/58/181249158.db2.gz	ZSVQUSFCJUITKQ-CYBMUJFWSA-N	0	3	304.781	2.040	10	0		DEAEHN
CC[C@](C)(CO)NCC(=O)Nc1ccccc1Br	ZINC000080108419	192001642	/nfs/dbraw/zinc/00/16/42/192001642.db2.gz	JNFUFIHAAOZJIR-CYBMUJFWSA-N	0	3	315.211	2.138	10	0		DEAEHN
C[C@H](NC(=O)N(C)CCN(C)C1CC1)c1ccc2c(c1)OCO2	ZINC000185104429	356201960	/nfs/dbraw/zinc/20/19/60/356201960.db2.gz	GFFHTKCBCZMISK-LBPRGKRZSA-N	0	3	319.405	2.212	10	0		DEAEHN
COc1ccc([C@](C)(O)[C@H]2CCCN2Cc2ccnn2C)cc1	ZINC000225546086	356276571	/nfs/dbraw/zinc/27/65/71/356276571.db2.gz	JXTZPCVZWCWXAV-MSOLQXFVSA-N	0	3	315.417	2.301	10	0		DEAEHN
NCc1cncc(OC(F)(F)F)c1I	ZINC000238572026	356304236	/nfs/dbraw/zinc/30/42/36/356304236.db2.gz	HWSTUKIOVFMPMP-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
COC[C@@H]1CCN([C@@H](CN)c2ccc(Br)cc2)C1	ZINC000081042128	192218565	/nfs/dbraw/zinc/21/85/65/192218565.db2.gz	VTLUUYDUTPMQIV-RISCZKNCSA-N	0	3	313.239	2.417	10	0		DEAEHN
COC[C@@H]1CCN([C@@H](CN)c2ccc(Br)s2)C1	ZINC000081041420	192218581	/nfs/dbraw/zinc/21/85/81/192218581.db2.gz	YPFIUCLKXLQXGG-ZJUUUORDSA-N	0	3	319.268	2.479	10	0		DEAEHN
COC[C@H]1CCN([C@@H](CN)c2cc3c(c(Cl)c2)OCO3)C1	ZINC000081049297	192219353	/nfs/dbraw/zinc/21/93/53/192219353.db2.gz	IDCPYOGHVYWEEL-GWCFXTLKSA-N	0	3	312.797	2.037	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCO[C@H]2[C@H]1NCc1ccccc1	ZINC000300227983	356390223	/nfs/dbraw/zinc/39/02/23/356390223.db2.gz	ZVXRDYBDPDMHIX-XUWVNRHRSA-N	0	3	318.417	2.457	10	0		DEAEHN
C[C@H](NCc1ccn(C)n1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000400499468	283157631	/nfs/dbraw/zinc/15/76/31/283157631.db2.gz	ICXWIJSDHBPEAF-STQMWFEESA-N	0	3	308.426	2.155	10	0		DEAEHN
CC1CCN(CCCc2noc([C@@H](N)C3CCOCC3)n2)CC1	ZINC000328630556	356463551	/nfs/dbraw/zinc/46/35/51/356463551.db2.gz	JNGSQNBFRMLBAL-INIZCTEOSA-N	0	3	322.453	2.161	10	0		DEAEHN
CC(=O)N(C[C@@H]1CCCN1Cc1ccnc(N(C)C)c1)C1CC1	ZINC000328635963	356465034	/nfs/dbraw/zinc/46/50/34/356465034.db2.gz	NVGLHALMZMKWHA-KRWDZBQOSA-N	0	3	316.449	2.123	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)N(C)c1cc(OC)c(OC)c(OC)c1	ZINC000236941443	202083246	/nfs/dbraw/zinc/08/32/46/202083246.db2.gz	LQGMRVUCOCVGMT-QMTHXVAHSA-N	0	3	310.394	2.049	10	0		DEAEHN
CC[C@H](C)[C@@H]([NH3+])C(=O)Nc1n[n-]c(-c2ccccc2Cl)n1	ZINC000236922891	202073268	/nfs/dbraw/zinc/07/32/68/202073268.db2.gz	CUPMPPWETHWXPS-GZMMTYOYSA-N	0	3	307.785	2.437	10	0		DEAEHN
COc1cc(CN2CC[C@H](CO)[C@@H]2C)ccc1OC(F)F	ZINC000386351326	356695849	/nfs/dbraw/zinc/69/58/49/356695849.db2.gz	YIYSAUXIRPHTPL-CMPLNLGQSA-N	0	3	301.333	2.499	10	0		DEAEHN
CC(=O)N1C[C@@H]2CCC[C@H](N[C@@H](C)c3nccnc3C)[C@@H]2C1	ZINC000579400819	356968779	/nfs/dbraw/zinc/96/87/79/356968779.db2.gz	ALDFCKCIURPGDH-HNKHHVNMSA-N	0	3	302.422	2.083	10	0		DEAEHN
Cc1noc(CCN[C@H](C)c2cncc(Br)c2)n1	ZINC000581083603	357128897	/nfs/dbraw/zinc/12/88/97/357128897.db2.gz	VNBPQWGGYKKEGD-MRVPVSSYSA-N	0	3	311.183	2.429	10	0		DEAEHN
CNCc1ccc(C)c(S(=O)(=O)NC(C2CC2)C2CC2)c1	ZINC000088999145	192689932	/nfs/dbraw/zinc/68/99/32/192689932.db2.gz	UMSYMGXOISDDSY-UHFFFAOYSA-N	0	3	308.447	2.181	10	0		DEAEHN
Cc1nn(C)c2ncc(CN3CCC[C@@H]3Cn3ccnc3)cc12	ZINC000179271566	199008040	/nfs/dbraw/zinc/00/80/40/199008040.db2.gz	RWWFHCINOZSBRE-OAHLLOKOSA-N	0	3	310.405	2.138	10	0		DEAEHN
Cc1ccc2c(c1)[C@H](NC(=O)NCCNc1ccncc1)CC2	ZINC000592550838	357901061	/nfs/dbraw/zinc/90/10/61/357901061.db2.gz	IHNUNRNMTOGHQG-QGZVFWFLSA-N	0	3	310.401	2.211	10	0		DEAEHN
Cc1cccc(NC(=O)NC[C@@H](O)CN2CCCCC2)c1F	ZINC000180001178	199104388	/nfs/dbraw/zinc/10/43/88/199104388.db2.gz	IDWXXJGPHWITPM-CYBMUJFWSA-N	0	3	309.385	2.102	10	0		DEAEHN
Cc1nn(C)cc1[C@H](C)N[C@H]1CCc2nnc(C(C)C)n2C1	ZINC000180501042	199167680	/nfs/dbraw/zinc/16/76/80/199167680.db2.gz	GUDSZHJXTBYUDY-AAEUAGOBSA-N	0	3	302.426	2.109	10	0		DEAEHN
C[C@H](CCCc1ccccc1)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000180862690	199219663	/nfs/dbraw/zinc/21/96/63/199219663.db2.gz	ZIYRQXBQVRNSHE-AEFFLSMTSA-N	0	3	318.461	2.434	10	0		DEAEHN
CCn1cc([C@H](C)N[C@@H]2CCCN(c3cccnn3)C2)cn1	ZINC000180934963	199230612	/nfs/dbraw/zinc/23/06/12/199230612.db2.gz	KSCIFZCHRKYPNC-DZGCQCFKSA-N	0	3	300.410	2.013	10	0		DEAEHN
CCOCc1cccc(NC(=O)N2CCO[C@@H](CN(C)C)C2)c1	ZINC000181195928	199263425	/nfs/dbraw/zinc/26/34/25/199263425.db2.gz	OUBKCFQGHPZFBJ-INIZCTEOSA-N	0	3	321.421	2.017	10	0		DEAEHN
CN(C[C@H](O)Cc1ccc(C(F)(F)F)cc1)CC1(CO)CC1	ZINC000186783827	200010446	/nfs/dbraw/zinc/01/04/46/200010446.db2.gz	LXVKUFOCZNRCJX-CQSZACIVSA-N	0	3	317.351	2.313	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H](C)N(C)CCN(C)C1CC1)c1ccccc1	ZINC000186788403	200010939	/nfs/dbraw/zinc/01/09/39/200010939.db2.gz	NGAQYVRAENAMQA-HUUCEWRRSA-N	0	3	303.450	2.278	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2cc(F)ccc2OC)C1	ZINC000187068434	200055460	/nfs/dbraw/zinc/05/54/60/200055460.db2.gz	KLHLLKGNHVFUSF-AWEZNQCLSA-N	0	3	309.385	2.118	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N(C)C[C@H]1CCCN(C)C1	ZINC000187909541	200174958	/nfs/dbraw/zinc/17/49/58/200174958.db2.gz	GTBFIGODVIGNAC-ZDUSSCGKSA-N	0	3	323.412	2.318	10	0		DEAEHN
CO[C@H]1CN(Cc2ccccc2OCC(=O)N(C)C)CC[C@@H]1C	ZINC000188328859	200228618	/nfs/dbraw/zinc/22/86/18/200228618.db2.gz	UWLRDJXDCIFIHM-YOEHRIQHSA-N	0	3	320.433	2.010	10	0		DEAEHN
Cn1cc(CNCCOCC2CCC2)c(-c2ccncc2)n1	ZINC000515568840	283489880	/nfs/dbraw/zinc/48/98/80/283489880.db2.gz	YPACPSZIVXASQL-UHFFFAOYSA-N	0	3	300.406	2.388	10	0		DEAEHN
COc1ccc(F)c(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1OC	ZINC000188568602	200267654	/nfs/dbraw/zinc/26/76/54/200267654.db2.gz	FEHOPYPHGAYUEM-AAEUAGOBSA-N	0	3	324.396	2.301	10	0		DEAEHN
COC(=O)COc1c(C)cc(CN(C)CC2(CO)CC2)cc1C	ZINC000188956792	200327172	/nfs/dbraw/zinc/32/71/72/200327172.db2.gz	JNNJMNCLBCAKSZ-UHFFFAOYSA-N	0	3	321.417	2.060	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)N3C[C@H]4CCCN4C[C@@H]3C)cc2c1	ZINC000189285386	200375887	/nfs/dbraw/zinc/37/58/87/200375887.db2.gz	ABLYZWGTSOULGU-GXTWGEPZSA-N	0	3	313.401	2.485	10	0		DEAEHN
O=C(CN1CCCC12CCC2)NC[C@H]1Cc2ccccc2O1	ZINC000444790935	238313595	/nfs/dbraw/zinc/31/35/95/238313595.db2.gz	LPKFAJGIYGLCKI-OAHLLOKOSA-N	0	3	300.402	2.125	10	0		DEAEHN
Cc1cc(CN(C)C[C@@H]2CCCN(C)[C@H]2c2cncn2C)on1	ZINC000671563624	540988550	/nfs/dbraw/zinc/98/85/50/540988550.db2.gz	XTQXYQAZKRNUJL-WMLDXEAASA-N	0	3	317.437	2.231	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2nc3cccnc3s2)CCN1C	ZINC000193958876	201153108	/nfs/dbraw/zinc/15/31/08/201153108.db2.gz	WQSNDJRXJXVPHF-QWRGUYRKSA-N	0	3	304.419	2.246	10	0		DEAEHN
COc1cc(CN2C[C@@H](C)[C@H](N3CCOCC3)C2)ccc1C	ZINC000194053341	201169803	/nfs/dbraw/zinc/16/98/03/201169803.db2.gz	NRTZRIPKAAOPHV-NVXWUHKLSA-N	0	3	304.434	2.156	10	0		DEAEHN
COC[C@H](N[C@H]1CCc2ncnn2C1)c1ccc(Cl)cc1	ZINC000194094681	201177068	/nfs/dbraw/zinc/17/70/68/201177068.db2.gz	VEBWEWBDZWCNLD-KBPBESRZSA-N	0	3	306.797	2.224	10	0		DEAEHN
O=C(NCc1ccc2ncccc2c1)N1CC[C@@H](N2CC=CC2)C1	ZINC000194595398	201259614	/nfs/dbraw/zinc/25/96/14/201259614.db2.gz	VLCXYNMRWUJHCA-QGZVFWFLSA-N	0	3	322.412	2.391	10	0		DEAEHN
C[C@@H](N)c1nc(C(=O)Nc2ccccc2CN(C)C)cs1	ZINC000090947645	192961324	/nfs/dbraw/zinc/96/13/24/192961324.db2.gz	YVVAHKJHWBBUOH-SNVBAGLBSA-N	0	3	304.419	2.477	10	0		DEAEHN
Cn1ccnc1[C@@H]1OCC[C@H]1NCc1cc2ccccc2[nH]c1=O	ZINC000623084493	364879476	/nfs/dbraw/zinc/87/94/76/364879476.db2.gz	FOMJMUWWUDVBMI-HZPDHXFCSA-N	0	3	324.384	2.294	10	0		DEAEHN
CN1C[C@H](CNCc2ccsc2Br)CC1=O	ZINC000623570726	365084126	/nfs/dbraw/zinc/08/41/26/365084126.db2.gz	BXVVTVOSDMCVLJ-QMMMGPOBSA-N	0	3	303.225	2.079	10	0		DEAEHN
c1c(CNC[C@@H]2CCN2C2CCCCC2)nnn1C1CCC1	ZINC000623615060	365100742	/nfs/dbraw/zinc/10/07/42/365100742.db2.gz	NTANQDJMPAWOLH-KRWDZBQOSA-N	0	3	303.454	2.500	10	0		DEAEHN
CCC[N@@H+]1CCC[C@H](N2CCSC[C@@H]2CC(=O)[O-])CC1	ZINC000091133579	193000044	/nfs/dbraw/zinc/00/00/44/193000044.db2.gz	JGAGUXDRYXZWID-KBPBESRZSA-N	0	3	300.468	2.143	10	0		DEAEHN
CCC[N@H+]1CCC[C@H](N2CCSC[C@@H]2CC(=O)[O-])CC1	ZINC000091133579	193000046	/nfs/dbraw/zinc/00/00/46/193000046.db2.gz	JGAGUXDRYXZWID-KBPBESRZSA-N	0	3	300.468	2.143	10	0		DEAEHN
CCCN1CCC[C@H]([N@@H+]2CCSC[C@@H]2CC(=O)[O-])CC1	ZINC000091133579	193000049	/nfs/dbraw/zinc/00/00/49/193000049.db2.gz	JGAGUXDRYXZWID-KBPBESRZSA-N	0	3	300.468	2.143	10	0		DEAEHN
CCCN1CCC[C@H]([N@H+]2CCSC[C@@H]2CC(=O)[O-])CC1	ZINC000091133579	193000051	/nfs/dbraw/zinc/00/00/51/193000051.db2.gz	JGAGUXDRYXZWID-KBPBESRZSA-N	0	3	300.468	2.143	10	0		DEAEHN
C[C@@H](C1CC1)N(CC(F)(F)F)C(=O)C[C@@H]1CSCCN1	ZINC000091135894	193001262	/nfs/dbraw/zinc/00/12/62/193001262.db2.gz	TYSOLLSDLVNOCH-GXSJLCMTSA-N	0	3	310.385	2.271	10	0		DEAEHN
CN1CCOC[C@@H]1CNCc1ccc(F)cc1Br	ZINC000623711413	365140367	/nfs/dbraw/zinc/14/03/67/365140367.db2.gz	DORMRJNSQJBMKI-LBPRGKRZSA-N	0	3	317.202	2.008	10	0		DEAEHN
CC[C@H](CN)S(=O)(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000091479126	193062446	/nfs/dbraw/zinc/06/24/46/193062446.db2.gz	UADCOQMKNHJCEW-SNVBAGLBSA-N	0	3	310.341	2.493	10	0		DEAEHN
O[C@@H]1COCC[C@@H]1N[C@@H]1CCc2ccc(Br)cc21	ZINC000624238333	365346452	/nfs/dbraw/zinc/34/64/52/365346452.db2.gz	PJKVOKKNYKGPLN-HZSPNIEDSA-N	0	3	312.207	2.176	10	0		DEAEHN
C[C@H](NC[C@@H]1CN(C)CCO1)c1ccccc1OC(F)F	ZINC000091667760	193088023	/nfs/dbraw/zinc/08/80/23/193088023.db2.gz	YQTQZUHQCYFOMT-NWDGAFQWSA-N	0	3	300.349	2.269	10	0		DEAEHN
CCCCCCNC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000091843184	193116395	/nfs/dbraw/zinc/11/63/95/193116395.db2.gz	GQDPJZBCCAOLGX-QGZVFWFLSA-N	0	3	324.513	2.378	10	0		DEAEHN
COC[C@@H](N)Cc1cn(Cc2ccc(Cl)cc2Cl)nn1	ZINC000630590826	367744872	/nfs/dbraw/zinc/74/48/72/367744872.db2.gz	OSQCRFATQXQOOX-NSHDSACASA-N	0	3	315.204	2.149	10	0		DEAEHN
CCNCc1sc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)cc1C	ZINC000092113398	193161195	/nfs/dbraw/zinc/16/11/95/193161195.db2.gz	HKTMERJABUGVOL-VXGBXAGGSA-N	0	3	316.492	2.443	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCCC2(C)C)c(F)c1	ZINC000092116148	193164266	/nfs/dbraw/zinc/16/42/66/193164266.db2.gz	DXQHOIKDEOWGEN-UHFFFAOYSA-N	0	3	314.426	2.498	10	0		DEAEHN
CCCC[C@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]C)cc1F	ZINC000092116056	193164321	/nfs/dbraw/zinc/16/43/21/193164321.db2.gz	PCPXYSFGCUHLNL-NSHDSACASA-N	0	3	302.415	2.402	10	0		DEAEHN
C[NH2+]Cc1ccc(S(=O)(=O)[N-]C[C@@H](C)C(C)C)c(F)c1	ZINC000092116249	193164586	/nfs/dbraw/zinc/16/45/86/193164586.db2.gz	FUHRYBLCOKJHFS-LLVKDONJSA-N	0	3	302.415	2.116	10	0		DEAEHN
C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN)cc2F)CC1	ZINC000092116174	193164649	/nfs/dbraw/zinc/16/46/49/193164649.db2.gz	TUSKGCGWEYDCOA-LLVKDONJSA-N	0	3	300.399	2.095	10	0		DEAEHN
c1c(CNC[C@@H]2CCC[C@@H]2C2CC2)nnn1C[C@@H]1CCOC1	ZINC000631162427	368053373	/nfs/dbraw/zinc/05/33/73/368053373.db2.gz	VYOJPBQABWJAKS-JLJPHGGASA-N	0	3	304.438	2.231	10	0		DEAEHN
c1ccc([C@@H](C[C@H]2CCOC2)NC2CN(c3ccncn3)C2)cc1	ZINC000631747330	368367098	/nfs/dbraw/zinc/36/70/98/368367098.db2.gz	FEKSICIEXTWAFL-CRAIPNDOSA-N	0	3	324.428	2.423	10	0		DEAEHN
COCC[C@H](NC[C@H](O)COC)c1cccc(C(F)(F)F)c1	ZINC000451695497	243314872	/nfs/dbraw/zinc/31/48/72/243314872.db2.gz	QGCDZGRMIQWRKK-KBPBESRZSA-N	0	3	321.339	2.380	10	0		DEAEHN
C[C@@H](C(N)=S)N1CCN(C[C@@H]2CSc3ccccc32)CC1	ZINC000092275969	193183900	/nfs/dbraw/zinc/18/39/00/193183900.db2.gz	PGDWAQYGVHFONO-QWHCGFSZSA-N	0	3	321.515	2.168	10	0		DEAEHN
CNCc1sc(N(CCOC)CCOC)nc1C(C)C	ZINC000093000109	193192785	/nfs/dbraw/zinc/19/27/85/193192785.db2.gz	MMQKXPHQWSLDOK-UHFFFAOYSA-N	0	3	301.456	2.085	10	0		DEAEHN
COc1ccc(CN2CCCC[C@H]2CN2CCOCC2)cc1O	ZINC000093011532	193194092	/nfs/dbraw/zinc/19/40/92/193194092.db2.gz	IZXZPDGCONEJES-INIZCTEOSA-N	0	3	320.433	2.088	10	0		DEAEHN
Cc1cccc(Oc2ccc(NC(=O)[C@@H]3C[C@@H](O)CN3)cc2)c1	ZINC000262557969	203329955	/nfs/dbraw/zinc/32/99/55/203329955.db2.gz	VLQIKYFWUYPBNL-PBHICJAKSA-N	0	3	312.369	2.449	10	0		DEAEHN
CCN[C@H](Cc1c(F)cccc1Cl)[C@H]1CN(C)CCN1C	ZINC000093895498	193325892	/nfs/dbraw/zinc/32/58/92/193325892.db2.gz	MZOSCTHQNVASSY-HZPDHXFCSA-N	0	3	313.848	2.246	10	0		DEAEHN
CCCN[C@@H](c1cc(Cl)cnc1N)[C@H]1CN(CC)CCO1	ZINC000093915259	193328420	/nfs/dbraw/zinc/32/84/20/193328420.db2.gz	XJACFGXMCJZDGD-KGLIPLIRSA-N	0	3	312.845	2.079	10	0		DEAEHN
CCNCc1cc(F)c(OCCC(=O)NC(C)C)c(F)c1	ZINC000094346784	193363823	/nfs/dbraw/zinc/36/38/23/193363823.db2.gz	QENVWYGMCLYGDH-UHFFFAOYSA-N	0	3	300.349	2.368	10	0		DEAEHN
CNCc1ccc(OCC(=O)Nc2ccccc2Cl)cn1	ZINC000094209073	193349429	/nfs/dbraw/zinc/34/94/29/193349429.db2.gz	DNVAVFVFUYJGRB-UHFFFAOYSA-N	0	3	305.765	2.472	10	0		DEAEHN
O=C(N[C@H]1CCCOc2ccccc21)N1CCN2CCC[C@H]2C1	ZINC000247508902	284179326	/nfs/dbraw/zinc/17/93/26/284179326.db2.gz	PDGDUVSXXDWPAP-HOCLYGCPSA-N	0	3	315.417	2.390	10	0		DEAEHN
CN(c1nc(Br)cn2ccnc12)[C@H]1CCCN(C)C1	ZINC000094490482	193373509	/nfs/dbraw/zinc/37/35/09/193373509.db2.gz	CKFSIXFSNOAFCJ-JTQLQIEISA-N	0	3	324.226	2.022	10	0		DEAEHN
CN[C@@H](c1ccc(Cl)c(Cl)c1)[C@@H]1CN2CCN1CC2	ZINC000094508961	193375731	/nfs/dbraw/zinc/37/57/31/193375731.db2.gz	VIBCIXLMDJZSSP-KBPBESRZSA-N	0	3	300.233	2.254	10	0		DEAEHN
COC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CCCOCC(F)(F)F	ZINC000248792086	284217226	/nfs/dbraw/zinc/21/72/26/284217226.db2.gz	DNRMXQIAUOTHKM-SRVKXCTJSA-N	0	3	309.328	2.229	10	0		DEAEHN
O=C(N[C@H]1CCOc2ccc(F)cc21)N1CCN2CCC[C@H]2C1	ZINC000247657963	284213710	/nfs/dbraw/zinc/21/37/10/284213710.db2.gz	YZEQHOMVXJTFHL-ZFWWWQNUSA-N	0	3	319.380	2.139	10	0		DEAEHN
COc1ccc(C[C@H](C)N[C@H]2C[C@@H]3CCCCN3C2=O)cc1	ZINC000453429538	245134804	/nfs/dbraw/zinc/13/48/04/245134804.db2.gz	IKAPJWWRKGZZNX-QRTARXTBSA-N	0	3	302.418	2.369	10	0		DEAEHN
c1nn(-c2ccccc2)nc1CN1CC[C@H](N2CCCCC2)C1	ZINC000264589169	204012857	/nfs/dbraw/zinc/01/28/57/204012857.db2.gz	LGMUVQWIMKEBEL-SFHVURJKSA-N	0	3	311.433	2.328	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@@H]1NCc1csc(Br)c1	ZINC000282536086	217070273	/nfs/dbraw/zinc/07/02/73/217070273.db2.gz	ZKUSNDVMRPYGCL-APPZFPTMSA-N	0	3	303.225	2.267	10	0		DEAEHN
COc1cc([C@@H](C)N[C@H](C)CN2CCN(C)CC2)ccc1F	ZINC000153675772	291574575	/nfs/dbraw/zinc/57/45/75/291574575.db2.gz	SKVQGRUACBIWCS-ZIAGYGMSSA-N	0	3	309.429	2.121	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCN([C@H](CN)c2ccccc2F)CC1	ZINC000020179243	182194502	/nfs/dbraw/zinc/19/45/02/182194502.db2.gz	VVVPUPXREMIWIY-OAHLLOKOSA-N	0	3	323.412	2.378	10	0		DEAEHN
COc1ccc([N-]S(=O)(=O)c2ccc(F)c(C[NH3+])c2)cc1	ZINC000020189284	182195685	/nfs/dbraw/zinc/19/56/85/182195685.db2.gz	UTRRVBXZWFFBPA-UHFFFAOYSA-N	0	3	310.350	2.094	10	0		DEAEHN
C[C@H]1CN([C@@H](CN)c2cc(Br)cs2)CCO1	ZINC000020475215	182221541	/nfs/dbraw/zinc/22/15/41/182221541.db2.gz	QJCJXRPSFSTLKR-WPRPVWTQSA-N	0	3	305.241	2.231	10	0		DEAEHN
O=C(Nc1c(Cl)cc(Cl)cc1Cl)[C@H]1C[C@H](O)CN1	ZINC000020505404	182226097	/nfs/dbraw/zinc/22/60/97/182226097.db2.gz	DYHXQBLYUDCING-IMTBSYHQSA-N	0	3	309.580	2.308	10	0		DEAEHN
O=C(CN1CCN(C2CCCC2)CC1)Nc1cc(F)cc(F)c1	ZINC000027120077	182463541	/nfs/dbraw/zinc/46/35/41/182463541.db2.gz	HTJILQGWTKXAFG-UHFFFAOYSA-N	0	3	323.387	2.464	10	0		DEAEHN
CC(C)[C@@H](CNC(=O)c1nnc(Cl)s1)N1CCCC1	ZINC000159856336	197369123	/nfs/dbraw/zinc/36/91/23/197369123.db2.gz	BTHIIPRAIGFAKE-SECBINFHSA-N	0	3	302.831	2.042	10	0		DEAEHN
O=C(NCCC1(CO)CC1)c1cccc(CN2CCCC2)c1	ZINC000456444211	247201703	/nfs/dbraw/zinc/20/17/03/247201703.db2.gz	ZHPJRPQIHLHHQZ-UHFFFAOYSA-N	0	3	302.418	2.175	10	0		DEAEHN
CC[C@@H](C)NCC(=O)Nc1sc2c(c1C(=O)OC)CCC2	ZINC000040415308	183063600	/nfs/dbraw/zinc/06/36/00/183063600.db2.gz	BXJAOWYTSNZRRY-SECBINFHSA-N	0	3	310.419	2.350	10	0		DEAEHN
Cc1ccc(NCCN2CCN(C)CC2)cc1Br	ZINC000041563164	183203183	/nfs/dbraw/zinc/20/31/83/183203183.db2.gz	IPSWLBOBOOSWRZ-UHFFFAOYSA-N	0	3	312.255	2.417	10	0		DEAEHN
OC[C@@H](NC[C@H]1CCCO1)c1ccc(Br)s1	ZINC000041703005	183218431	/nfs/dbraw/zinc/21/84/31/183218431.db2.gz	WVBWCCWHGDATHO-RKDXNWHRSA-N	0	3	306.225	2.313	10	0		DEAEHN
COCCN(C)[C@H](CN)c1ccc(F)c(Br)c1	ZINC000042458662	183272672	/nfs/dbraw/zinc/27/26/72/183272672.db2.gz	CQMAWCLENGAWTH-GFCCVEGCSA-N	0	3	305.191	2.166	10	0		DEAEHN
COCCN(C)[C@@H](CN)c1ccc(Br)cc1F	ZINC000042458534	183273161	/nfs/dbraw/zinc/27/31/61/183273161.db2.gz	PLWZQWRBDIRTKD-LBPRGKRZSA-N	0	3	305.191	2.166	10	0		DEAEHN
COCCN([C@@H](CN)c1ccc(Cl)cc1)[C@@H](C)COC	ZINC000042606683	183290731	/nfs/dbraw/zinc/29/07/31/183290731.db2.gz	UCRCSDCKEOSDKB-WFASDCNBSA-N	0	3	300.830	2.323	10	0		DEAEHN
CCN(C[C@@H](N)c1ccc2c(c1)OCCO2)CC(F)(F)F	ZINC000042747882	183304268	/nfs/dbraw/zinc/30/42/68/183304268.db2.gz	XXVFNPPHICGOPF-LLVKDONJSA-N	0	3	304.312	2.342	10	0		DEAEHN
COc1ccc([C@@H](CN)N(C)Cc2cscn2)cc1OC	ZINC000042863837	183315158	/nfs/dbraw/zinc/31/51/58/183315158.db2.gz	HPRUKHDAQGWVQQ-CYBMUJFWSA-N	0	3	307.419	2.292	10	0		DEAEHN
COc1ccc(OC)c([C@@H](CN)N(C)Cc2cscn2)c1	ZINC000042864450	183315355	/nfs/dbraw/zinc/31/53/55/183315355.db2.gz	ACNRPAWMDDQWIL-CQSZACIVSA-N	0	3	307.419	2.292	10	0		DEAEHN
Cn1cc([C@H](CN)Oc2ccc(Br)cc2F)cn1	ZINC000043235565	183345916	/nfs/dbraw/zinc/34/59/16/183345916.db2.gz	WBFWBAKGBCCOMU-LBPRGKRZSA-N	0	3	314.158	2.401	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)s1)N(CC)CC(=O)NC	ZINC000043252673	183346525	/nfs/dbraw/zinc/34/65/25/183346525.db2.gz	BIOURBQQMPPWSO-TVQRCGJNSA-N	0	3	303.859	2.248	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)s1)N(CC)CC(=O)NC	ZINC000043252671	183347160	/nfs/dbraw/zinc/34/71/60/183347160.db2.gz	BIOURBQQMPPWSO-RNCFNFMXSA-N	0	3	303.859	2.248	10	0		DEAEHN
C[C@H](N)[C@H](c1ccc(Cl)s1)N1CCCC[C@@H]1C(N)=O	ZINC000043253714	183347833	/nfs/dbraw/zinc/34/78/33/183347833.db2.gz	GPXUJZPRSXTTAS-YGOYTEALSA-N	0	3	301.843	2.130	10	0		DEAEHN
C[C@@H](N)[C@@H](c1cc(Br)cs1)N1CCC[C@@H]1CO	ZINC000043286381	183350882	/nfs/dbraw/zinc/35/08/82/183350882.db2.gz	UIPKCNWWYZFGEY-UISBYWKRSA-N	0	3	319.268	2.356	10	0		DEAEHN
N[C@@H](c1ccc(OC(F)(F)F)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000043300029	183352530	/nfs/dbraw/zinc/35/25/30/183352530.db2.gz	SVRHDCGOYUVTHM-KOLCDFICSA-N	0	3	309.309	2.020	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccco1)N1CCN(c2nccs2)CC1	ZINC000043334567	183355662	/nfs/dbraw/zinc/35/56/62/183355662.db2.gz	ORLQLYRPQCKOFA-GXTWGEPZSA-N	0	3	306.435	2.337	10	0		DEAEHN
CCOC(=O)[C@H](NCCN(C)C)c1ccc(Cl)c(F)c1	ZINC000043391161	183358953	/nfs/dbraw/zinc/35/89/53/183358953.db2.gz	ZJVNGXZZTDTQGC-CYBMUJFWSA-N	0	3	302.777	2.235	10	0		DEAEHN
CN[C@@H](CN(C)CC(F)(F)F)c1ccc(OC)cc1OC	ZINC000043900463	183389249	/nfs/dbraw/zinc/38/92/49/183389249.db2.gz	FLDOFWBUTFNVSK-LBPRGKRZSA-N	0	3	306.328	2.458	10	0		DEAEHN
C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000247364130	296277125	/nfs/dbraw/zinc/27/71/25/296277125.db2.gz	QWJSAEXKLRAQSH-ILXRZTDVSA-N	0	3	311.470	2.173	10	0		DEAEHN
CO[C@@H]1C[C@@H](CO)N(CCOc2ccccc2C(F)(F)F)C1	ZINC000284484837	218046436	/nfs/dbraw/zinc/04/64/36/218046436.db2.gz	CDBVQGXXUWCIRF-NWDGAFQWSA-N	0	3	319.323	2.166	10	0		DEAEHN
CCN(CC)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000105284110	194093635	/nfs/dbraw/zinc/09/36/35/194093635.db2.gz	JRNUFIYAQZOJNK-UHFFFAOYSA-N	0	3	319.449	2.195	10	0		DEAEHN
COc1cccc(N2C(=O)C[C@@H](NCCc3ccccc3)C2=O)c1	ZINC000105676187	194119141	/nfs/dbraw/zinc/11/91/41/194119141.db2.gz	AJKNFMNMBXZZAF-QGZVFWFLSA-N	0	3	324.380	2.159	10	0		DEAEHN
COCCN1CCN(CCCOc2ccc(F)cc2)C[C@@H]1C	ZINC000105832535	194140738	/nfs/dbraw/zinc/14/07/38/194140738.db2.gz	HQSLSMDSQRNGOZ-HNNXBMFYSA-N	0	3	310.413	2.247	10	0		DEAEHN
Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NCCNc1ccncc1	ZINC000534530109	284848912	/nfs/dbraw/zinc/84/89/12/284848912.db2.gz	MQBOXZYXJPUMBL-KGLIPLIRSA-N	0	3	301.415	2.205	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)cc1)N1CCNC(=O)C1(C)C	ZINC000110653197	194347021	/nfs/dbraw/zinc/34/70/21/194347021.db2.gz	UYJGPXDCKQIJAF-KBPBESRZSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccccc1Cl)N1CCNC(=O)C1(C)C	ZINC000110653922	194347400	/nfs/dbraw/zinc/34/74/00/194347400.db2.gz	APOAYFQFOOCHMP-KGLIPLIRSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC(C)Cc1ccc(S(=O)(=O)N(C)[C@@H]2CCCNC2)cc1	ZINC000110927745	194369893	/nfs/dbraw/zinc/36/98/93/194369893.db2.gz	FUKZDTIEEACAMD-OAHLLOKOSA-N	0	3	310.463	2.258	10	0		DEAEHN
CCCN([C@@H]1CCCNC1)S(=O)(=O)c1cc(F)cc(F)c1	ZINC000110942427	194371908	/nfs/dbraw/zinc/37/19/08/194371908.db2.gz	GNKNHUFPHVPKFW-CYBMUJFWSA-N	0	3	318.389	2.118	10	0		DEAEHN
CCN([C@H]1CCCNC1)S(=O)(=O)c1ccc(Cl)cc1C	ZINC000110941602	194372074	/nfs/dbraw/zinc/37/20/74/194372074.db2.gz	GYTRAOPWPJYFOP-ZDUSSCGKSA-N	0	3	316.854	2.411	10	0		DEAEHN
Cc1cc(NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)n(C)n1	ZINC000057205513	184029707	/nfs/dbraw/zinc/02/97/07/184029707.db2.gz	JPLIYRSOIGQSIR-HNNXBMFYSA-N	0	3	315.421	2.023	10	0		DEAEHN
CCN[C@@H](Cc1cccc(C(F)(F)F)c1)CS(C)(=O)=O	ZINC000060705867	184154458	/nfs/dbraw/zinc/15/44/58/184154458.db2.gz	WTXSWIRAHSDPHL-LBPRGKRZSA-N	0	3	309.353	2.271	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(N[C@H](CN(C)C)C(C)C)n1	ZINC000061539300	184173381	/nfs/dbraw/zinc/17/33/81/184173381.db2.gz	XXERVWZLCWEFOF-LLVKDONJSA-N	0	3	314.865	2.369	10	0		DEAEHN
CC[C@@H](Oc1ccc(Br)cc1[C@H](C)N)C(N)=O	ZINC000061676071	184181942	/nfs/dbraw/zinc/18/19/42/184181942.db2.gz	QQELFQFMCWRCSC-OIBJUYFYSA-N	0	3	301.184	2.112	10	0		DEAEHN
NCc1ccccc1CNC(=O)c1cncc(Br)c1	ZINC000061841025	184189441	/nfs/dbraw/zinc/18/94/41/184189441.db2.gz	WBLCRXBAUFTNSW-UHFFFAOYSA-N	0	3	320.190	2.233	10	0		DEAEHN
Cc1ccc([C@H]([C@@H](C)N)N2CCN(CC(F)(F)F)CC2)o1	ZINC000061940772	184197342	/nfs/dbraw/zinc/19/73/42/184197342.db2.gz	QMQORBULLIBWOP-YPMHNXCESA-N	0	3	305.344	2.156	10	0		DEAEHN
C[C@@](N)(CN1CCN(CC(F)(F)F)CC1)c1ccccc1	ZINC000061948062	184197845	/nfs/dbraw/zinc/19/78/45/184197845.db2.gz	XKIMTCGZGBHUKL-CQSZACIVSA-N	0	3	301.356	2.040	10	0		DEAEHN
C[C@H](c1ccccc1Cl)N(C)S(=O)(=O)[C@@H]1CCCNC1	ZINC000062027779	184201857	/nfs/dbraw/zinc/20/18/57/184201857.db2.gz	VAWGPPOZRWFEOB-VXGBXAGGSA-N	0	3	316.854	2.415	10	0		DEAEHN
COCCN1C(=O)CC[C@H](N)[C@H]1c1c(F)cccc1Cl	ZINC000062213716	184222285	/nfs/dbraw/zinc/22/22/85/184222285.db2.gz	GPFIHYJXOHVICC-FZMZJTMJSA-N	0	3	300.761	2.116	10	0		DEAEHN
NC[C@H](c1cccc(Br)c1)N1CCn2ccnc2C1	ZINC000062246230	184225230	/nfs/dbraw/zinc/22/52/30/184225230.db2.gz	RAKSRDCXTXYUGS-CYBMUJFWSA-N	0	3	321.222	2.161	10	0		DEAEHN
Cc1ccc(F)c(S(=O)(=O)[N-][C@H]2CCCCC[C@@H]2[NH3+])c1	ZINC000063213458	184278361	/nfs/dbraw/zinc/27/83/61/184278361.db2.gz	VAIOYIGRYXMMTH-STQMWFEESA-N	0	3	300.399	2.072	10	0		DEAEHN
[NH3+][C@H]1CCCCC[C@H]1[N-]S(=O)(=O)c1ccc(F)cc1Cl	ZINC000063213332	184278377	/nfs/dbraw/zinc/27/83/77/184278377.db2.gz	SLFPQXLHEASMNM-NWDGAFQWSA-N	0	3	320.817	2.417	10	0		DEAEHN
O=Cc1c(N2CC[C@@H](N3CCCCC3)C2)nc2sccn12	ZINC000062980982	184264498	/nfs/dbraw/zinc/26/44/98/184264498.db2.gz	WIPOOYHLSLAGJJ-GFCCVEGCSA-N	0	3	304.419	2.273	10	0		DEAEHN
COc1ccc(OCCCS(C)(=O)=O)c(CNC(C)C)c1	ZINC000063014294	184266426	/nfs/dbraw/zinc/26/64/26/184266426.db2.gz	DUJNYIFVSSUTJF-UHFFFAOYSA-N	0	3	315.435	2.007	10	0		DEAEHN
COc1cc([C@@H](N)CCCS(C)(=O)=O)cc(Cl)c1OC	ZINC000063017047	184267054	/nfs/dbraw/zinc/26/70/54/184267054.db2.gz	YBVOBWRFZUHNHY-NSHDSACASA-N	0	3	321.826	2.182	10	0		DEAEHN
CC[C@@H](C)NCC(=O)Nc1cccc(CCC(=O)N(C)C)c1	ZINC000066068228	184386347	/nfs/dbraw/zinc/38/63/47/184386347.db2.gz	WNYJAVFAAPRTIT-CYBMUJFWSA-N	0	3	305.422	2.034	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC[C@H](C)C(C)C)cc(CN)c1F	ZINC000159121946	197329748	/nfs/dbraw/zinc/32/97/48/197329748.db2.gz	ZGHGRQHWPBTYAW-NSHDSACASA-N	0	3	302.415	2.163	10	0		DEAEHN
CN(C)C(=O)c1ccc(NC(=O)CNC2CCCCC2)cc1	ZINC000066214660	184397458	/nfs/dbraw/zinc/39/74/58/184397458.db2.gz	FRGXITZYHIWVOA-UHFFFAOYSA-N	0	3	303.406	2.249	10	0		DEAEHN
C[C@@H]1SCCS[C@@H]1c1noc(-c2ccnc(CN)c2)n1	ZINC000161928906	197530337	/nfs/dbraw/zinc/53/03/37/197530337.db2.gz	WQYMLUJPJBEMQW-KWQFWETISA-N	0	3	308.432	2.500	10	0		DEAEHN
C[C@@H](NC[C@@H](O)COC[C@H]1CCCO1)c1ccc(F)cc1F	ZINC000538187402	285027146	/nfs/dbraw/zinc/02/71/46/285027146.db2.gz	GEVBQHHQHHLHFH-MRVWCRGKSA-N	0	3	315.360	2.172	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(C(=O)[C@@H](N)C(C)C)C2)c1	ZINC000119794626	195038264	/nfs/dbraw/zinc/03/82/64/195038264.db2.gz	ICVGWTUCJIPVGW-LRDDRELGSA-N	0	3	306.406	2.003	10	0		DEAEHN
CCNC(=O)N1CC[C@H](N[C@@H](C)c2ccc(C)cc2OC)C1	ZINC000540157910	285111432	/nfs/dbraw/zinc/11/14/32/285111432.db2.gz	OPACUKRYSOMCEQ-KBPBESRZSA-N	0	3	305.422	2.458	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1ccc(OC(F)F)c(F)c1	ZINC000159270215	197340852	/nfs/dbraw/zinc/34/08/52/197340852.db2.gz	MYMWGQFIXNVOET-SNVBAGLBSA-N	0	3	306.284	2.120	10	0		DEAEHN
CCCNC(=O)[C@H](CN)Cc1cc(F)cc(C(F)(F)F)c1	ZINC000159198221	197335222	/nfs/dbraw/zinc/33/52/22/197335222.db2.gz	NORCGTNJACRHER-JTQLQIEISA-N	0	3	306.303	2.488	10	0		DEAEHN
COCCC[C@H](N)C(=O)N[C@@H]1CCSc2ccc(F)cc21	ZINC000159172816	197333298	/nfs/dbraw/zinc/33/32/98/197333298.db2.gz	ZUEHSMOTPZJDLN-QWHCGFSZSA-N	0	3	312.410	2.233	10	0		DEAEHN
N[C@H](CS(=O)(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1CCOC1	ZINC000159121129	197329534	/nfs/dbraw/zinc/32/95/34/197329534.db2.gz	WRGAHRXXGAWHOL-PRHODGIISA-N	0	3	324.229	2.131	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCCC(C)(C)C2)cc(CN)c1F	ZINC000159119745	197329034	/nfs/dbraw/zinc/32/90/34/197329034.db2.gz	VIEJFLDQBLDCEV-UHFFFAOYSA-N	0	3	314.426	2.404	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)NC2CCC2)cc(C)c1F	ZINC000159105998	197327820	/nfs/dbraw/zinc/32/78/20/197327820.db2.gz	JXDYOMKWXASFQI-UHFFFAOYSA-N	0	3	300.399	2.074	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)[C@@H](C)C(C)C)cc(CN)c1F	ZINC000159071777	197324523	/nfs/dbraw/zinc/32/45/23/197324523.db2.gz	BPZIKCXTJXUMCB-NSHDSACASA-N	0	3	302.415	2.258	10	0		DEAEHN
COC[C@H](O)CN[C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000540323452	285115002	/nfs/dbraw/zinc/11/50/02/285115002.db2.gz	DRZDMIOLTGQWSR-RHSMWYFYSA-N	0	3	316.401	2.319	10	0		DEAEHN
CC[C@H]1CCC[NH2+][C@@H]1C[N-]S(=O)(=O)c1ccc(F)cc1F	ZINC000158998841	197318185	/nfs/dbraw/zinc/31/81/85/197318185.db2.gz	YNIPKEIWVQGVNJ-GXFFZTMASA-N	0	3	318.389	2.021	10	0		DEAEHN
CC(C)N[C@H]1CCN(c2c(F)c(F)c(F)c(F)c2F)C1=O	ZINC000159003154	197318278	/nfs/dbraw/zinc/31/82/78/197318278.db2.gz	KBNCOJXENMBLSK-LURJTMIESA-N	0	3	308.250	2.485	10	0		DEAEHN
O=C1[C@H](NC2CC2)CCN1c1c(F)c(F)c(F)c(F)c1F	ZINC000159002598	197318037	/nfs/dbraw/zinc/31/80/37/197318037.db2.gz	PZWGNDBVOIHIAE-ZCFIWIBFSA-N	0	3	306.234	2.239	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)N(C)C	ZINC000158990957	197317418	/nfs/dbraw/zinc/31/74/18/197317418.db2.gz	DTXCLPIVPHQDPC-ZWKOTPCHSA-N	0	3	317.477	2.498	10	0		DEAEHN
COc1ccc(C[C@H](N)c2c(Br)cnn2C)cc1	ZINC000158882883	197308326	/nfs/dbraw/zinc/30/83/26/197308326.db2.gz	MJQZLOHGHIIZNP-LBPRGKRZSA-N	0	3	310.195	2.434	10	0		DEAEHN
C[C@H]([C@@H](O)c1c(Br)cnn1CCN(C)C)C1CC1	ZINC000158856363	197306048	/nfs/dbraw/zinc/30/60/48/197306048.db2.gz	AURLOYXPMFCPMH-TVQRCGJNSA-N	0	3	316.243	2.287	10	0		DEAEHN
CN[C@@H](Cc1cc(OC)ccc1Br)c1cn[nH]n1	ZINC000158845885	197305610	/nfs/dbraw/zinc/30/56/10/197305610.db2.gz	JPBJJCJAYWSFSX-NSHDSACASA-N	0	3	311.183	2.079	10	0		DEAEHN
CCCN[C@H](CS(=O)(=O)c1ccccc1C)[C@H]1CCOC1	ZINC000158829511	197304905	/nfs/dbraw/zinc/30/49/05/197304905.db2.gz	WCKVQINBLONLTJ-LSDHHAIUSA-N	0	3	311.447	2.173	10	0		DEAEHN
O=C(NC[C@H](O)CN1CCCCC1)c1ccc(Cl)c(F)c1	ZINC000158692073	197295155	/nfs/dbraw/zinc/29/51/55/197295155.db2.gz	LSIVNBQVUAOCGE-LBPRGKRZSA-N	0	3	314.788	2.056	10	0		DEAEHN
N[C@@H](c1ccc2c3c(cccc31)CC2)[C@H]1CCS(=O)(=O)C1	ZINC000158780396	197300601	/nfs/dbraw/zinc/30/06/01/197300601.db2.gz	BJABGPNOWXBLKX-SUMWQHHRSA-N	0	3	301.411	2.373	10	0		DEAEHN
CC(C)(C)c1ccc(S(=O)(=O)C[C@H](N)[C@H]2CCOC2)cc1	ZINC000158771409	197300385	/nfs/dbraw/zinc/30/03/85/197300385.db2.gz	MCNIHVAMZNZRCR-WFASDCNBSA-N	0	3	311.447	2.122	10	0		DEAEHN
CCN[C@H](CS(=O)(=O)c1ccc(C)cc1C)[C@@H]1CCOC1	ZINC000158736998	197298178	/nfs/dbraw/zinc/29/81/78/197298178.db2.gz	IBFZFGFDTIWIEZ-HUUCEWRRSA-N	0	3	311.447	2.092	10	0		DEAEHN
CCN[C@H](C[C@H]1CCCO1)c1c(Br)cnn1C	ZINC000158657074	197291899	/nfs/dbraw/zinc/29/18/99/197291899.db2.gz	HXMSRDJNQPOQPE-MWLCHTKSSA-N	0	3	302.216	2.402	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)c2ccc3nc(N)sc3c2)CCN1C	ZINC000157825837	197218417	/nfs/dbraw/zinc/21/84/17/197218417.db2.gz	MQVQJNQEKFVCQO-MWLCHTKSSA-N	0	3	304.419	2.091	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)Cc1c[nH]c2ncccc12	ZINC000157123592	197163820	/nfs/dbraw/zinc/16/38/20/197163820.db2.gz	RBQXTQHJGQWJSK-CQSZACIVSA-N	0	3	302.422	2.198	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)C(=O)Nc2cccc(Cl)c2)CCN1C	ZINC000120623259	195203221	/nfs/dbraw/zinc/20/32/21/195203221.db2.gz	RKUQOEPSEALSLJ-SMDDNHRTSA-N	0	3	323.824	2.220	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCCc2cc3ccccc3o2)C1	ZINC000120737987	195227804	/nfs/dbraw/zinc/22/78/04/195227804.db2.gz	OMHGBGXJHVWZRK-AWEZNQCLSA-N	0	3	301.390	2.321	10	0		DEAEHN
CC(C)CCn1cccc1CN1CCN(C[C@@H](C)O)[C@@H](C)C1	ZINC000120676163	195214453	/nfs/dbraw/zinc/21/44/53/195214453.db2.gz	VFUDTDXKUXOYHA-DLBZAZTESA-N	0	3	307.482	2.421	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1C	ZINC000120721589	195224313	/nfs/dbraw/zinc/22/43/13/195224313.db2.gz	ZJMNGZFKOCQOBA-HIFRSBDPSA-N	0	3	317.433	2.183	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccccc2C(=O)OC)CCN1CCOC	ZINC000120907532	195261748	/nfs/dbraw/zinc/26/17/48/195261748.db2.gz	GGKVQUROYDUEQZ-MRXNPFEDSA-N	0	3	320.433	2.016	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N(C[C@H]1CCOC1)C1CC1	ZINC000121641546	195321635	/nfs/dbraw/zinc/32/16/35/195321635.db2.gz	GQLUEDDTYQSCSQ-CABCVRRESA-N	0	3	311.470	2.173	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(=O)NC2CCN(Cc3ccccc3)CC2)O1	ZINC000122021987	195389957	/nfs/dbraw/zinc/38/99/57/195389957.db2.gz	GWPBOVMLBYQMHB-PBHICJAKSA-N	0	3	302.418	2.335	10	0		DEAEHN
CNCc1cc(O[C@@H](C)C(=O)N(C)C)ccc1Br	ZINC000128110726	195936820	/nfs/dbraw/zinc/93/68/20/195936820.db2.gz	VQGOUNNLPPWXHW-VIFPVBQESA-N	0	3	315.211	2.024	10	0		DEAEHN
CCN1CC[C@@H](N(C)C(=O)c2cn(CCC(C)C)nn2)[C@H](C)C1	ZINC000122240427	132162789	/nfs/dbraw/zinc/16/27/89/132162789.db2.gz	TUYXTGATMSWZLO-GDBMZVCRSA-N	0	3	321.469	2.127	10	0		DEAEHN
C[C@@H]1OCC[C@H]1NC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000355848208	133052104	/nfs/dbraw/zinc/05/21/04/133052104.db2.gz	CMHVBOPIBQPZNY-WMLDXEAASA-N	0	3	302.418	2.192	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCc1ccc2cc[nH]c2n1	ZINC000357959278	133111992	/nfs/dbraw/zinc/11/19/92/133111992.db2.gz	PAGOOXJRDWRRHH-OAHLLOKOSA-N	0	3	317.437	2.338	10	0		DEAEHN
CCCN(CCN1CCCCC1)C(=O)NCCc1cc(C)no1	ZINC000358040198	133117587	/nfs/dbraw/zinc/11/75/87/133117587.db2.gz	VYTMAVUXPPZAFQ-UHFFFAOYSA-N	0	3	322.453	2.433	10	0		DEAEHN
Cc1cccc2c1CC[C@@H]2N[C@@H]1CCN(C2CCOCC2)C1=O	ZINC000358191859	133127353	/nfs/dbraw/zinc/12/73/53/133127353.db2.gz	PDLHMOPHUMYSBQ-ZWKOTPCHSA-N	0	3	314.429	2.352	10	0		DEAEHN
Cc1ccsc1[C@H](C)N[C@@H]1CCN(C2CCOCC2)C1=O	ZINC000358208575	133128649	/nfs/dbraw/zinc/12/86/49/133128649.db2.gz	WGFXKXSBFIMFMU-GXTWGEPZSA-N	0	3	308.447	2.487	10	0		DEAEHN
c1ccc2c(c1)CC[C@@H](CN1CCN(C[C@H]3CCOC3)CC1)C2	ZINC000359591334	133132531	/nfs/dbraw/zinc/13/25/31/133132531.db2.gz	WCBLOZHLBSGXPX-QZTJIDSGSA-N	0	3	314.473	2.446	10	0		DEAEHN
O=C(NC[C@@H](CO)C1CC1)c1ccc(CN2CCCCC2)cc1	ZINC000359823401	133147215	/nfs/dbraw/zinc/14/72/15/133147215.db2.gz	PBNDOTFVGXYXKX-SFHVURJKSA-N	0	3	316.445	2.421	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1ccc2cc[nH]c2n1	ZINC000360490919	133185304	/nfs/dbraw/zinc/18/53/04/133185304.db2.gz	LNGAQFMYIGJAJB-OAHLLOKOSA-N	0	3	315.421	2.189	10	0		DEAEHN
COC(=O)c1coc(C(=O)N[C@H](C)CN2C[C@H](C)C[C@@H](C)C2)c1	ZINC000183450022	292032735	/nfs/dbraw/zinc/03/27/35/292032735.db2.gz	FZNQTRHVDSHFKI-JHJVBQTASA-N	0	3	322.405	2.162	10	0		DEAEHN
COC(CN(CCCO)C[C@@H]1CCC2(CCCCC2)O1)OC	ZINC000191015614	292078810	/nfs/dbraw/zinc/07/88/10/292078810.db2.gz	LRVCGZAAXYYVEC-HNNXBMFYSA-N	0	3	315.454	2.172	10	0		DEAEHN
Cc1ccc(C)c(S(=O)(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000247029055	292087257	/nfs/dbraw/zinc/08/72/57/292087257.db2.gz	GGIHQRMQDBNPFR-CABCVRRESA-N	0	3	308.447	2.161	10	0		DEAEHN
Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000246087829	292087371	/nfs/dbraw/zinc/08/73/71/292087371.db2.gz	GHXZRRHBLGDMSA-HUUCEWRRSA-N	0	3	310.463	2.310	10	0		DEAEHN
O=C([C@H]1C[C@H]1c1cccc(Br)c1)N1CCCNCC1	ZINC000178362765	144857922	/nfs/dbraw/zinc/85/79/22/144857922.db2.gz	JOYZGSPRQKUPCW-KBPBESRZSA-N	0	3	323.234	2.375	10	0		DEAEHN
CCc1nn(C)c(CC)c1CC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000188041711	145006568	/nfs/dbraw/zinc/00/65/68/145006568.db2.gz	WIQCPWPNAUEKNS-ZIAGYGMSSA-N	0	3	320.481	2.029	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)c1[nH]nnc1-c1ccccc1	ZINC000189107878	145022549	/nfs/dbraw/zinc/02/25/49/145022549.db2.gz	VQFNEDWRVWMRNW-ZDUSSCGKSA-N	0	3	313.405	2.076	10	0		DEAEHN
Cn1ccnc(NC[C@]2(C)CCCN2Cc2ccccc2)c1=O	ZINC000189223077	145023768	/nfs/dbraw/zinc/02/37/68/145023768.db2.gz	UHEXEXJTSHFKRU-SFHVURJKSA-N	0	3	312.417	2.247	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC(Nc2nccs2)CC1)N(C)C	ZINC000190420517	145042267	/nfs/dbraw/zinc/04/22/67/145042267.db2.gz	YTNIXTULAABGDA-CYBMUJFWSA-N	0	3	310.467	2.276	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCSC[C@H](C)C1	ZINC000192344243	145072912	/nfs/dbraw/zinc/07/29/12/145072912.db2.gz	KOROKSJVFNFTLV-KGLIPLIRSA-N	0	3	301.500	2.357	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc(-n2ccnc2)cc1C	ZINC000192066279	145069977	/nfs/dbraw/zinc/06/99/77/145069977.db2.gz	DLPNJBNUBMVWPP-QGZVFWFLSA-N	0	3	303.406	2.058	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1C[C@@H]1CC2(CCC2)C(=O)O1	ZINC000192058463	145070403	/nfs/dbraw/zinc/07/04/03/145070403.db2.gz	GWTJAHIRULTFKD-GJZGRUSLSA-N	0	3	303.406	2.142	10	0		DEAEHN
CCC(CC)CS(=O)(=O)N1C[C@@H]2CCCN2C[C@@H]1CC	ZINC000246501660	145104784	/nfs/dbraw/zinc/10/47/84/145104784.db2.gz	XTHTVIMIFYHDNM-GJZGRUSLSA-N	0	3	302.484	2.311	10	0		DEAEHN
CCOc1ccc(OC[C@@H](O)CN2CCS[C@@H](C)C2)cc1	ZINC000246203904	145094910	/nfs/dbraw/zinc/09/49/10/145094910.db2.gz	YCYBRBXBDIPKNM-KBPBESRZSA-N	0	3	311.447	2.262	10	0		DEAEHN
C[C@H](C(=O)NC[C@@]1(O)CCc2ccccc21)N1[C@H](C)CC[C@@H]1C	ZINC000246518543	145105759	/nfs/dbraw/zinc/10/57/59/145105759.db2.gz	IURXOOJKROBWOE-GJRWTSMGSA-N	0	3	316.445	2.198	10	0		DEAEHN
O=C(CN1CC[C@H]2OCCC[C@H]2C1)N1CCc2sccc2C1	ZINC000246554183	145106256	/nfs/dbraw/zinc/10/62/56/145106256.db2.gz	GZMFKSZNLPLGAK-DZGCQCFKSA-N	0	3	320.458	2.134	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cnc2onc(C)c2c1	ZINC000246954613	145120104	/nfs/dbraw/zinc/12/01/04/145120104.db2.gz	MCRAFMGVPCHSBB-KBPBESRZSA-N	0	3	314.389	2.230	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1CCCS(=O)(=O)c1ccccc1	ZINC000246979153	145121941	/nfs/dbraw/zinc/12/19/41/145121941.db2.gz	DWMNQZNFMOWDNA-HOTGVXAUSA-N	0	3	322.474	2.019	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)C(=O)c1ccc(Cl)cc1	ZINC000247062903	145125323	/nfs/dbraw/zinc/12/53/23/145125323.db2.gz	HJHKSJOVUYHZJI-RISCZKNCSA-N	0	3	306.793	2.218	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)[C@H]1Cc2cc(F)ccc2O1	ZINC000247141186	145127303	/nfs/dbraw/zinc/12/73/03/145127303.db2.gz	XVJUPEMZKFCHLG-MLGOLLRUSA-N	0	3	306.381	2.120	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(C(C)(C)C)nn1C	ZINC000247166616	145128379	/nfs/dbraw/zinc/12/83/79/145128379.db2.gz	KORLIDCZRCFTLX-STQMWFEESA-N	0	3	304.438	2.026	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1CCCN1C[C@@H](O)COCC(C)C	ZINC000247218025	145129503	/nfs/dbraw/zinc/12/95/03/145129503.db2.gz	QHBSCIUALVPUOR-HZPDHXFCSA-N	0	3	309.454	2.207	10	0		DEAEHN
O=S1(=O)CC[C@H](N[C@@H]2CCO[C@@H](C3CC3)C2)c2ccccc21	ZINC000248546999	145158052	/nfs/dbraw/zinc/15/80/52/145158052.db2.gz	GAOOTMWSRJDSKK-VNQPRFMTSA-N	0	3	321.442	2.452	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(COC(C)(C)C)on1	ZINC000248558819	145158681	/nfs/dbraw/zinc/15/86/81/145158681.db2.gz	DQJDCMCXOONIDF-OLZOCXBDSA-N	0	3	321.421	2.298	10	0		DEAEHN
CN(CCN1CCC[C@@H](n2cncn2)C1)Cc1ccc(F)cc1	ZINC000248591806	145159868	/nfs/dbraw/zinc/15/98/68/145159868.db2.gz	ZUBUSFQNDHMYKR-QGZVFWFLSA-N	0	3	317.412	2.186	10	0		DEAEHN
O=C1NC(=O)[C@@]2(CCCN([C@H]3CCc4c3cccc4Cl)C2)N1	ZINC000248689591	145164330	/nfs/dbraw/zinc/16/43/30/145164330.db2.gz	XJYSJDUSVAFKKK-BBRMVZONSA-N	0	3	319.792	2.001	10	0		DEAEHN
COc1ccc(C)nc1NC(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000248763153	145167086	/nfs/dbraw/zinc/16/70/86/145167086.db2.gz	GSRAYOIPJDMMNK-DGCLKSJQSA-N	0	3	306.410	2.249	10	0		DEAEHN
CC(C)OCCNC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000248876710	145171680	/nfs/dbraw/zinc/17/16/80/145171680.db2.gz	RCXCMXJWDQUKKT-NVXWUHKLSA-N	0	3	319.449	2.231	10	0		DEAEHN
CO[C@@H]1CN(Cc2ccccc2N2CCOCC2)CC[C@H]1C	ZINC000249126533	145179841	/nfs/dbraw/zinc/17/98/41/145179841.db2.gz	CJYFHESYZPNIKO-CRAIPNDOSA-N	0	3	304.434	2.380	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(C[C@@H](O)CSC)C2)c1	ZINC000249487302	145185697	/nfs/dbraw/zinc/18/56/97/145185697.db2.gz	XFOTXZMXFYCKPJ-GXTWGEPZSA-N	0	3	311.447	2.217	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NC(=O)CN(CC)CC)[C@@H]1Oc1ccccc1	ZINC000251665869	145195347	/nfs/dbraw/zinc/19/53/47/145195347.db2.gz	LJKQOYKOZGJYBD-NUJGCVRESA-N	0	3	320.433	2.069	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COc2ccccc2Cl)CC[C@@H]1C	ZINC000251903580	145197342	/nfs/dbraw/zinc/19/73/42/145197342.db2.gz	RDSQIJBDQLDGSU-WOSRLPQWSA-N	0	3	313.825	2.437	10	0		DEAEHN
CO[C@@H]1CN(CCCN2C(=O)c3ccccc3C2=O)CC[C@@H]1C	ZINC000251913613	145197404	/nfs/dbraw/zinc/19/74/04/145197404.db2.gz	RXOABZFIGBJNNS-XJKSGUPXSA-N	0	3	316.401	2.030	10	0		DEAEHN
CN(Cc1cnc(N)s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000261546336	145206806	/nfs/dbraw/zinc/20/68/06/145206806.db2.gz	KVVBVYDUFQDIFD-AWEZNQCLSA-N	0	3	302.447	2.432	10	0		DEAEHN
N[C@H](C(=O)N1CC[C@H](c2ccc(Cl)cc2)C1)C1CCOCC1	ZINC000261794979	145227589	/nfs/dbraw/zinc/22/75/89/145227589.db2.gz	NUFVTUVMGZLURI-HOCLYGCPSA-N	0	3	322.836	2.410	10	0		DEAEHN
C[C@H]1CCCN1C(=O)CCN1CCNC[C@@H]1c1cccc(F)c1	ZINC000261829095	145231596	/nfs/dbraw/zinc/23/15/96/145231596.db2.gz	SUNKJJFFLQRJML-WMLDXEAASA-N	0	3	319.424	2.173	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)NCc1ccc(F)c(F)c1	ZINC000261878064	145237230	/nfs/dbraw/zinc/23/72/30/145237230.db2.gz	MEAJIYSNQHUMPH-KHIZAZIESA-N	0	3	324.371	2.114	10	0		DEAEHN
Cc1cccc(NC(=O)CN2C[C@@H](c3ccccc3)[C@H](N)C2)c1	ZINC000261893336	145238628	/nfs/dbraw/zinc/23/86/28/145238628.db2.gz	ZZOXDFIMLPZQHR-ZWKOTPCHSA-N	0	3	309.413	2.360	10	0		DEAEHN
N[C@@H](C(=O)Nc1ccc2nc(C3CC3)oc2c1)C1CCOCC1	ZINC000261909976	145240167	/nfs/dbraw/zinc/24/01/67/145240167.db2.gz	XLBKCITVYJJIRO-OAHLLOKOSA-N	0	3	315.373	2.398	10	0		DEAEHN
CC(C)C(=O)Nc1ccc(N[C@H](C)C[C@H]2COCCN2)cc1	ZINC000262298431	145274223	/nfs/dbraw/zinc/27/42/23/145274223.db2.gz	OFGKJVBPSJSZJU-CJNGLKHVSA-N	0	3	305.422	2.460	10	0		DEAEHN
COc1ccc(CNC(=O)[C@@H]2NCCCC2(C)C)cc1OC	ZINC000262489854	145287538	/nfs/dbraw/zinc/28/75/38/145287538.db2.gz	KWEFWRRNGJZKAD-HNNXBMFYSA-N	0	3	306.406	2.098	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)NCc1cccc(Cl)c1	ZINC000262537322	145291528	/nfs/dbraw/zinc/29/15/28/145291528.db2.gz	QMLSSGFYHNOWSA-CKEIUWERSA-N	0	3	322.836	2.489	10	0		DEAEHN
C[C@@H]1[C@H](C)NCCN1C(=O)c1ccn(-c2cccc(Cl)c2)n1	ZINC000262787907	145305311	/nfs/dbraw/zinc/30/53/11/145305311.db2.gz	MQABGMXTYMLVOK-NWDGAFQWSA-N	0	3	318.808	2.348	10	0		DEAEHN
CC(C)[C@H](C(=O)N1CCC[C@H](c2noc(C3CC3)n2)C1)N(C)C	ZINC000349570629	146386826	/nfs/dbraw/zinc/38/68/26/146386826.db2.gz	SWOVKRZNVOQIME-UONOGXRCSA-N	0	3	320.437	2.239	10	0		DEAEHN
CN1CCC(C)(CNC(=O)C(=O)c2ccc3c(c2)CCC3)CC1	ZINC000356981897	147015362	/nfs/dbraw/zinc/01/53/62/147015362.db2.gz	OCRJIWGGMXQEMR-UHFFFAOYSA-N	0	3	314.429	2.206	10	0		DEAEHN
Cc1scc(C(=O)Nc2ccc(=O)n(CCN(C)C)c2)c1C	ZINC000358469956	147140605	/nfs/dbraw/zinc/14/06/05/147140605.db2.gz	BCIAUAWLIPYGRV-UHFFFAOYSA-N	0	3	319.430	2.341	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@H]2CCCCN2C2CC2)C1	ZINC000359064889	147255789	/nfs/dbraw/zinc/25/57/89/147255789.db2.gz	XRLCJPKQUCPSKU-OAHLLOKOSA-N	0	3	309.454	2.071	10	0		DEAEHN
Cc1ccnc(C2CCN(Cc3ccc(C(N)=O)cc3)CC2)n1	ZINC000371833476	148145480	/nfs/dbraw/zinc/14/54/80/148145480.db2.gz	AFZPPMNFBGERQW-UHFFFAOYSA-N	0	3	310.401	2.264	10	0		DEAEHN
CC(C)(C)c1n[nH]cc1CNC[C@H]1CCC2(CCOCC2)[C@H]1O	ZINC000374707776	148280764	/nfs/dbraw/zinc/28/07/64/148280764.db2.gz	RHPWQBGQGIVZTD-CJNGLKHVSA-N	0	3	321.465	2.365	10	0		DEAEHN
CCOCCN(CC)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179468753	286078330	/nfs/dbraw/zinc/07/83/30/286078330.db2.gz	UXMFISPHGFOXOS-DLBZAZTESA-N	0	3	319.449	2.500	10	0		DEAEHN
C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000073896260	401723981	/nfs/dbraw/zinc/72/39/81/401723981.db2.gz	LLERNUWBHSHDTM-XJKSGUPXSA-N	0	3	315.417	2.107	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)NCC1CCC(C)CC1	ZINC000111839115	401726042	/nfs/dbraw/zinc/72/60/42/401726042.db2.gz	HWRRGTVPAHCQCX-GPANFISMSA-N	0	3	311.470	2.223	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cc(F)cc3nc[nH]c32)CCN1C	ZINC000127634511	401743682	/nfs/dbraw/zinc/74/36/82/401743682.db2.gz	NYMRPTFDUUZBKS-CMPLNLGQSA-N	0	3	304.369	2.257	10	0		DEAEHN
Cc1cnn(CCN[C@@H]2CCN(c3ccccc3Cl)C2=O)c1	ZINC000111229101	401701965	/nfs/dbraw/zinc/70/19/65/401701965.db2.gz	CBLFAXYQQBFHHC-CQSZACIVSA-N	0	3	318.808	2.240	10	0		DEAEHN
CC(C)N1CCN(c2ccc(C(=O)N[C@H]3C[C@@H]3C)cc2)CC1	ZINC000072094587	401703737	/nfs/dbraw/zinc/70/37/37/401703737.db2.gz	WYPZUWOKMSEQFQ-YOEHRIQHSA-N	0	3	301.434	2.355	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H]1Cc2cc(F)ccc2O1	ZINC000076962942	401801514	/nfs/dbraw/zinc/80/15/14/401801514.db2.gz	AVPSVSYPAFWEOL-HOCLYGCPSA-N	0	3	308.397	2.222	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N2CC[C@@H]3OCCC[C@H]3C2)c1	ZINC000128115928	401763604	/nfs/dbraw/zinc/76/36/04/401763604.db2.gz	GQOBSLZLOVUUFF-IRXDYDNUSA-N	0	3	302.418	2.389	10	0		DEAEHN
CCc1ccc(OCC(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1	ZINC000113229452	401771270	/nfs/dbraw/zinc/77/12/70/401771270.db2.gz	BVQXPIPHRBKFPW-GOEBONIOSA-N	0	3	302.418	2.323	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc2c(s1)CCOC2	ZINC000113231178	401771724	/nfs/dbraw/zinc/77/17/24/401771724.db2.gz	FOFZDCFQSQQFFS-WCQYABFASA-N	0	3	306.431	2.130	10	0		DEAEHN
COc1cc(CN2CC[C@@H](c3cnn(C)c3)C2)cc(OC)c1	ZINC000128435606	401776762	/nfs/dbraw/zinc/77/67/62/401776762.db2.gz	PMFGUNYEGNBYHQ-CQSZACIVSA-N	0	3	301.390	2.427	10	0		DEAEHN
Cc1cc(C)n2c(CN3CC[C@H](c4cnn(C)c4)C3)cnc2n1	ZINC000128451054	401777125	/nfs/dbraw/zinc/77/71/25/401777125.db2.gz	HKLZIFHRBRROIP-AWEZNQCLSA-N	0	3	310.405	2.069	10	0		DEAEHN
CNC(=O)c1cccc(CN2CC[C@@H](CNc3ccccn3)C2)c1	ZINC000113931394	401787352	/nfs/dbraw/zinc/78/73/52/401787352.db2.gz	ZYKOFGZCHXTGGY-INIZCTEOSA-N	0	3	324.428	2.375	10	0		DEAEHN
C[C@H](CNC(=O)C(C)(C)c1cccs1)CN1CCN(C)CC1	ZINC000115383986	401826137	/nfs/dbraw/zinc/82/61/37/401826137.db2.gz	FFCIONTWNFCARD-CQSZACIVSA-N	0	3	323.506	2.025	10	0		DEAEHN
CCOC(=O)CCCCN1CCC[C@H](Cc2noc(C)n2)C1	ZINC000132711523	401872451	/nfs/dbraw/zinc/87/24/51/401872451.db2.gz	PBLYHWZUJGOWAZ-CQSZACIVSA-N	0	3	309.410	2.366	10	0		DEAEHN
COCCN(C)CCCNC(=O)c1cc2c(cc(F)cc2C)[nH]1	ZINC000116726803	401857663	/nfs/dbraw/zinc/85/76/63/401857663.db2.gz	RNZNTFAGBACQBD-UHFFFAOYSA-N	0	3	321.396	2.314	10	0		DEAEHN
C[C@H]1CCc2c(C(=O)N3CCO[C@@H](CN(C)C)C3)csc2C1	ZINC000116791787	401859258	/nfs/dbraw/zinc/85/92/58/401859258.db2.gz	APGMEYVXJXDXMM-STQMWFEESA-N	0	3	322.474	2.276	10	0		DEAEHN
CCc1ccc([C@@H](C)NC(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000117025574	401866996	/nfs/dbraw/zinc/86/69/96/401866996.db2.gz	GXFWSJBEJASHOC-PBHICJAKSA-N	0	3	319.449	2.282	10	0		DEAEHN
CCc1ccc([C@H](C)NC(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000117025571	401867252	/nfs/dbraw/zinc/86/72/52/401867252.db2.gz	GXFWSJBEJASHOC-WMLDXEAASA-N	0	3	319.449	2.282	10	0		DEAEHN
CCC1CCC(CNC(=O)N2CCO[C@H](CN(C)C)C2)CC1	ZINC000117039611	401867761	/nfs/dbraw/zinc/86/77/61/401867761.db2.gz	GCDRGMVVCAJASC-UYSNPLJNSA-N	0	3	311.470	2.175	10	0		DEAEHN
CC(C)N(CC(=O)N1CCc2ccccc2C1)C1CCOCC1	ZINC000077357008	401812141	/nfs/dbraw/zinc/81/21/41/401812141.db2.gz	UFFBAJJUSGBZDM-UHFFFAOYSA-N	0	3	316.445	2.461	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)NCCN1CCCC[C@@H]1C	ZINC000080564225	401890424	/nfs/dbraw/zinc/89/04/24/401890424.db2.gz	DUUARLIXEVFPBG-HNNXBMFYSA-N	0	3	321.469	2.213	10	0		DEAEHN
CN(C)CCN(Cc1cccs1)C(=O)N[C@H]1CCCOC1	ZINC000084438077	401905416	/nfs/dbraw/zinc/90/54/16/401905416.db2.gz	HFPXXOLBQYGURM-ZDUSSCGKSA-N	0	3	311.451	2.000	10	0		DEAEHN
O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)[C@H]1C[C@@H](O)CN1	ZINC000036720539	401907098	/nfs/dbraw/zinc/90/70/98/401907098.db2.gz	UENRKFXTROXAJT-GMSGAONNSA-N	0	3	308.687	2.020	10	0		DEAEHN
Cn1c(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)nnc1C1CC1	ZINC000134881730	401918276	/nfs/dbraw/zinc/91/82/76/401918276.db2.gz	JMBZWOCHIFLMMB-ZBFHGGJFSA-N	0	3	315.465	2.141	10	0		DEAEHN
O=C(c1nc(Cl)ccc1Cl)N1CCN2CCC[C@H]2C1	ZINC000038107478	401922441	/nfs/dbraw/zinc/92/24/41/401922441.db2.gz	NCSUTGPCMPOUNC-VIFPVBQESA-N	0	3	300.189	2.309	10	0		DEAEHN
COc1cccc(CN2CCCC[C@@H](N3CCN(C)CC3)C2)c1	ZINC000136067147	401959084	/nfs/dbraw/zinc/95/90/84/401959084.db2.gz	RUBRCIYFCJSXCC-GOSISDBHSA-N	0	3	317.477	2.297	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)NC[C@@H](C)N(C)C1CC1	ZINC000119867200	401969659	/nfs/dbraw/zinc/96/96/59/401969659.db2.gz	NAJLGMCLJVSYIT-GFCCVEGCSA-N	0	3	310.467	2.200	10	0		DEAEHN
COC(CN1CCC(CN2CCc3ccccc32)CC1)OC	ZINC000136764915	401973884	/nfs/dbraw/zinc/97/38/84/401973884.db2.gz	XLQZHGHLQYBXPH-UHFFFAOYSA-N	0	3	304.434	2.380	10	0		DEAEHN
CCNC(=O)N1CC[C@@H](N[C@H](C)c2ccc(F)c(OC)c2)C1	ZINC000090410229	401982175	/nfs/dbraw/zinc/98/21/75/401982175.db2.gz	LXPNATOZXSBEBN-DGCLKSJQSA-N	0	3	309.385	2.289	10	0		DEAEHN
NC(=O)c1ccc([C@H]2COCCN(Cc3ccccc3)C2)cc1	ZINC000141251514	401990130	/nfs/dbraw/zinc/99/01/30/401990130.db2.gz	XOKQKFUAUVSXMA-GOSISDBHSA-N	0	3	310.397	2.402	10	0		DEAEHN
COc1ccc([C@@H](C)NC(=O)NC2CCN(C)CC2)cc1F	ZINC000047885614	401990263	/nfs/dbraw/zinc/99/02/63/401990263.db2.gz	CHHCIYLANZKZKK-LLVKDONJSA-N	0	3	309.385	2.289	10	0		DEAEHN
CSc1ccccc1NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000043317526	401938562	/nfs/dbraw/zinc/93/85/62/401938562.db2.gz	MDKIRHUIHDYNIU-CYBMUJFWSA-N	0	3	323.462	2.377	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)C(C)(C)c2cccc(Cl)c2)CCO1	ZINC000135547837	401944321	/nfs/dbraw/zinc/94/43/21/401944321.db2.gz	ZFSQZPSVUSULBB-HNNXBMFYSA-N	0	3	324.852	2.407	10	0		DEAEHN
CCC[C@@H](O)C[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000135561898	401945782	/nfs/dbraw/zinc/94/57/82/401945782.db2.gz	AEJMMHOKMLVLQF-SNVBAGLBSA-N	0	3	318.211	2.414	10	0		DEAEHN
COc1ccc([C@H]2C[C@@H](C)N(CC(=O)N3CCCC3)C2)cc1	ZINC000151043255	402012494	/nfs/dbraw/zinc/01/24/94/402012494.db2.gz	HLIHSXXAUKRLAT-ZBFHGGJFSA-N	0	3	302.418	2.495	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc(C(N)=S)cc1	ZINC000049560026	402019259	/nfs/dbraw/zinc/01/92/59/402019259.db2.gz	GCNMCHMWBXNJFK-AWEZNQCLSA-N	0	3	307.463	2.027	10	0		DEAEHN
Cc1ccc([C@H]2CN(C(=O)NC[C@H](C)N(C)C3CC3)CCO2)o1	ZINC000121313705	402027525	/nfs/dbraw/zinc/02/75/25/402027525.db2.gz	ZTXNNRIVCYWSRI-BLLLJJGKSA-N	0	3	321.421	2.154	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2ccn(C3CCCC3)n2)C1	ZINC000151450125	402036847	/nfs/dbraw/zinc/03/68/47/402036847.db2.gz	LFPPKLGBFLYWOI-OAHLLOKOSA-N	0	3	319.453	2.282	10	0		DEAEHN
CCOc1ccc(NC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cn1	ZINC000151451532	402037552	/nfs/dbraw/zinc/03/75/52/402037552.db2.gz	DSVPLXQMWHQNEG-KGLIPLIRSA-N	0	3	304.394	2.181	10	0		DEAEHN
CCN(CC)C(=O)C[C@@H](C)NCc1cccnc1-n1ccnc1	ZINC000151533178	402042326	/nfs/dbraw/zinc/04/23/26/402042326.db2.gz	QATRHDOFGOCTAL-CQSZACIVSA-N	0	3	315.421	2.004	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N(CCO)Cc1ccccc1	ZINC000121669377	402048133	/nfs/dbraw/zinc/04/81/33/402048133.db2.gz	YMBOKAOFLPKRMA-QGZVFWFLSA-N	0	3	321.465	2.167	10	0		DEAEHN
Cc1ccn(-c2ccccc2CNC(=O)CN(C)C(C)C)n1	ZINC000151973722	402069046	/nfs/dbraw/zinc/06/90/46/402069046.db2.gz	FARXGQJEYLHLEX-UHFFFAOYSA-N	0	3	300.406	2.137	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N[C@@H]1CCC(=O)N(C)C1)CCCO2	ZINC000152355432	402091695	/nfs/dbraw/zinc/09/16/95/402091695.db2.gz	FZWKORHESFIAIQ-DOMZBBRYSA-N	0	3	304.390	2.119	10	0		DEAEHN
O[C@H](COc1ccc(Cl)cc1)CN1CCCN(C2CC2)CC1	ZINC000061041160	402106795	/nfs/dbraw/zinc/10/67/95/402106795.db2.gz	ZMIHXEDCNSMWHN-INIZCTEOSA-N	0	3	324.852	2.250	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2CCCN2c2nccs2)CCN1C	ZINC000123046721	402107719	/nfs/dbraw/zinc/10/77/19/402107719.db2.gz	ADLUKWCEWRJZFF-RDBSUJKOSA-N	0	3	322.478	2.053	10	0		DEAEHN
CCN(CCNC(=O)N1CCO[C@@H](c2ccsc2)C1)C1CC1	ZINC000123803010	402146829	/nfs/dbraw/zinc/14/68/29/402146829.db2.gz	CUKCNLDMWAYBPU-OAHLLOKOSA-N	0	3	323.462	2.315	10	0		DEAEHN
CC(C)CCOc1ccc([C@H](C)N[C@@H](C)C(=O)NC(N)=O)cc1	ZINC000101583033	402150180	/nfs/dbraw/zinc/15/01/80/402150180.db2.gz	QDJPQSCTPWAKDG-STQMWFEESA-N	0	3	321.421	2.346	10	0		DEAEHN
C[C@@H]1CCN(C(=O)[C@@H]2CCCc3[nH]ncc32)C[C@H]1n1ccnc1	ZINC000124457533	402181025	/nfs/dbraw/zinc/18/10/25/402181025.db2.gz	IAFKVIBSFORLFK-XJKCOSOUSA-N	0	3	313.405	2.136	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1cc(F)cc2[nH]cnc21	ZINC000068224333	402188321	/nfs/dbraw/zinc/18/83/21/402188321.db2.gz	WWKICZJRZQNOEJ-GFCCVEGCSA-N	0	3	306.385	2.408	10	0		DEAEHN
Cc1ccn2ncc(C(=O)NCc3ccccc3CN(C)C)c2n1	ZINC000068719134	402204038	/nfs/dbraw/zinc/20/40/38/402204038.db2.gz	BFRAZWRMWVJMOE-UHFFFAOYSA-N	0	3	323.400	2.029	10	0		DEAEHN
Cc1csc(=O)n1CCN[C@@H](C)c1ccc2c(c1)OCCO2	ZINC000102682305	402170227	/nfs/dbraw/zinc/17/02/27/402170227.db2.gz	DVIGSIQKMPTSKJ-LBPRGKRZSA-N	0	3	320.414	2.340	10	0		DEAEHN
C[C@H](NC(=O)N(C)CCN(C)C)c1ccccc1-n1cccn1	ZINC000154532468	402217094	/nfs/dbraw/zinc/21/70/94/402217094.db2.gz	QPSWEQNSUQMHKB-AWEZNQCLSA-N	0	3	315.421	2.136	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1c[nH]nc1-c1ccccc1F	ZINC000154606385	402221268	/nfs/dbraw/zinc/22/12/68/402221268.db2.gz	IPZNVJLYLFHARY-NSHDSACASA-N	0	3	302.353	2.040	10	0		DEAEHN
COc1ccc2nc(N3CCO[C@@H](CN(C)C)C3)ccc2c1	ZINC000108951925	402265019	/nfs/dbraw/zinc/26/50/19/402265019.db2.gz	WYAMYKDXTUNKDA-HNNXBMFYSA-N	0	3	301.390	2.010	10	0		DEAEHN
COc1cccc(CCCNC(=O)C2(N)Cc3ccccc3C2)c1	ZINC000155456065	402257717	/nfs/dbraw/zinc/25/77/17/402257717.db2.gz	PITQVDRBPJOVGW-UHFFFAOYSA-N	0	3	324.424	2.240	10	0		DEAEHN
Cc1ccc(C)c(-c2cc3c(N4CCNCC4)nccn3n2)c1	ZINC000070459158	402261628	/nfs/dbraw/zinc/26/16/28/402261628.db2.gz	YVPTVFXPQRHEFM-UHFFFAOYSA-N	0	3	307.401	2.423	10	0		DEAEHN
Cc1c(-c2cc(CN3CCN4CCCC[C@@H]4C3)on2)cnn1C	ZINC000184663520	402289491	/nfs/dbraw/zinc/28/94/91/402289491.db2.gz	MBIILBGBGCPDGG-CQSZACIVSA-N	0	3	315.421	2.054	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)C1CCCC1	ZINC000184670006	402290092	/nfs/dbraw/zinc/29/00/92/402290092.db2.gz	KTKXDSHAHUYREM-CYBMUJFWSA-N	0	3	317.433	2.495	10	0		DEAEHN
Cc1cccc2[nH]c(CCC(=O)N3CCN4CCC[C@H]4C3)nc21	ZINC000176281905	402296783	/nfs/dbraw/zinc/29/67/83/402296783.db2.gz	PCIPYQVOQKYWJY-AWEZNQCLSA-N	0	3	312.417	2.111	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCc1cccc(O)c1	ZINC000176308402	402298376	/nfs/dbraw/zinc/29/83/76/402298376.db2.gz	HHBXJIDYEVMFHM-HNNXBMFYSA-N	0	3	305.422	2.060	10	0		DEAEHN
CC(C)c1ccc(NC(=O)CN[C@H]2CCCC[C@H]2C(N)=O)cc1	ZINC000184810080	402301139	/nfs/dbraw/zinc/30/11/39/402301139.db2.gz	OJMRKVOYOTUNGR-CVEARBPZSA-N	0	3	317.433	2.382	10	0		DEAEHN
CSCc1ccccc1NC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000184824693	402301916	/nfs/dbraw/zinc/30/19/16/402301916.db2.gz	JNUBNRZEHATGEM-CQSZACIVSA-N	0	3	323.462	2.344	10	0		DEAEHN
Cc1nccn1CCCN(C)Cc1cc(-c2cnn(C)c2)no1	ZINC000185040505	402319531	/nfs/dbraw/zinc/31/95/31/402319531.db2.gz	GPPUMVKBPCVJCA-UHFFFAOYSA-N	0	3	314.393	2.102	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc(N2CCCC2)nc1	ZINC000176982440	402356734	/nfs/dbraw/zinc/35/67/34/402356734.db2.gz	XYMHEUCPWKQDIU-INIZCTEOSA-N	0	3	316.449	2.238	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CSCc1cccnc1	ZINC000177011147	402359411	/nfs/dbraw/zinc/35/94/11/402359411.db2.gz	YHWZRAKTWQLDDB-HNNXBMFYSA-N	0	3	307.463	2.258	10	0		DEAEHN
Cc1oc2ccccc2c1C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000185592167	402363532	/nfs/dbraw/zinc/36/35/32/402363532.db2.gz	SYOZUJQBEBUOGX-ZDUSSCGKSA-N	0	3	302.374	2.144	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCN([C@@H](C)c2nccs2)CC1)N(C)C	ZINC000185760608	402374864	/nfs/dbraw/zinc/37/48/64/402374864.db2.gz	MCQOUTDYFFJQAW-KBPBESRZSA-N	0	3	324.494	2.079	10	0		DEAEHN
CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N1CC[C@@](C)(O)C1	ZINC000177989087	402449433	/nfs/dbraw/zinc/44/94/33/402449433.db2.gz	JHJOBOWAYHDRJL-MAUKXSAKSA-N	0	3	304.434	2.269	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCCOC1CCCC1	ZINC000177450645	402404020	/nfs/dbraw/zinc/40/40/20/402404020.db2.gz	NFHDERUGNCNRKV-HNNXBMFYSA-N	0	3	311.470	2.461	10	0		DEAEHN
Cn1ccnc1CC1CCN(CCNC(=O)OC(C)(C)C)CC1	ZINC000177502875	402409981	/nfs/dbraw/zinc/40/99/81/402409981.db2.gz	HTTOPUPSOXSGHF-UHFFFAOYSA-N	0	3	322.453	2.199	10	0		DEAEHN
Cc1ccc(C[C@@H](C)N(C)C(=O)C[C@@H]2CSCCN2)cc1	ZINC000237507747	402410842	/nfs/dbraw/zinc/41/08/42/402410842.db2.gz	JUCOHSBKDAHICH-GDBMZVCRSA-N	0	3	306.475	2.480	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)NCCc1ccc(Cl)nc1	ZINC000177669114	402424983	/nfs/dbraw/zinc/42/49/83/402424983.db2.gz	YQVLWEMKMFENIN-ZDUSSCGKSA-N	0	3	324.856	2.451	10	0		DEAEHN
COCCOc1ccccc1CN1CCC(C(=O)N(C)C)CC1	ZINC000162618830	402426122	/nfs/dbraw/zinc/42/61/22/402426122.db2.gz	ARYFCUYACUXMNY-UHFFFAOYSA-N	0	3	320.433	2.012	10	0		DEAEHN
CC[C@@H](CO)N1CCN(CCSCc2ccccc2)CC1	ZINC000186421614	402430067	/nfs/dbraw/zinc/43/00/67/402430067.db2.gz	RRMUUGQTTBOXAG-KRWDZBQOSA-N	0	3	308.491	2.308	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N2CCC[C@@H]2Cn2ccnc2)c1	ZINC000177804061	402437800	/nfs/dbraw/zinc/43/78/00/402437800.db2.gz	BBWBQEZJRQNPDV-QGZVFWFLSA-N	0	3	312.417	2.250	10	0		DEAEHN
C[C@@H](NCC[C@@H]1CCCO1)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000177844886	402440679	/nfs/dbraw/zinc/44/06/79/402440679.db2.gz	CJMNYDADEDEDCV-YPMHNXCESA-N	0	3	315.410	2.449	10	0		DEAEHN
C[C@H](NC(=O)N1CCC[C@H](N(C)C)C1)[C@H]1COc2ccccc21	ZINC000163569590	402452893	/nfs/dbraw/zinc/45/28/93/402452893.db2.gz	VZOHDIOPKZXRMI-OFQRWUPVSA-N	0	3	317.433	2.287	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)[C@H]1CCCn2ccnc21	ZINC000245426746	402459611	/nfs/dbraw/zinc/45/96/11/402459611.db2.gz	VJZIBIRUODXUME-CABCVRRESA-N	0	3	304.438	2.141	10	0		DEAEHN
Cc1ccc(CN2CCC(N3CCO[C@@H](C)C3)CC2)c(C)n1	ZINC000186727222	402460402	/nfs/dbraw/zinc/46/04/02/402460402.db2.gz	MEOYNEWXKJOCJD-HNNXBMFYSA-N	0	3	303.450	2.384	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)N[C@@H]1CCCC[C@@H]1C	ZINC000245458712	402462798	/nfs/dbraw/zinc/46/27/98/402462798.db2.gz	CZXFOYCTTSIBAQ-YLFCFFPRSA-N	0	3	309.498	2.486	10	0		DEAEHN
CN(C[C@@H](O)COc1ccc2ccccc2c1)CC1(CO)CC1	ZINC000186805165	402465790	/nfs/dbraw/zinc/46/57/90/402465790.db2.gz	AIZDULVIINKDOJ-QGZVFWFLSA-N	0	3	315.413	2.284	10	0		DEAEHN
O=C(Cc1ccc(O)cc1Cl)N1CCCN(C2CC2)CC1	ZINC000178217936	402472279	/nfs/dbraw/zinc/47/22/79/402472279.db2.gz	PUBGRMGFEXCYDC-UHFFFAOYSA-N	0	3	308.809	2.285	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCCCCCCO)[C@H]1c1ccccc1	ZINC000245640050	402475917	/nfs/dbraw/zinc/47/59/17/402475917.db2.gz	DCQSMHCGTTXXJV-DLBZAZTESA-N	0	3	319.449	2.284	10	0		DEAEHN
CC[C@@H]1CN(C/C=C/c2ccccc2OC)CCN1C[C@H](C)O	ZINC000245688502	402479465	/nfs/dbraw/zinc/47/94/65/402479465.db2.gz	BBAASKIBXDFEQK-QJWRSFSASA-N	0	3	318.461	2.485	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N(CC(C)C)C1CC1	ZINC000178294967	402481006	/nfs/dbraw/zinc/48/10/06/402481006.db2.gz	CEKKVCHIVDERSU-KRWDZBQOSA-N	0	3	318.465	2.303	10	0		DEAEHN
C[C@H]1C[C@H](CCN2CC[C@H](NS(C)(=O)=O)C2)C[C@@H](C)C1	ZINC000246151799	402513186	/nfs/dbraw/zinc/51/31/86/402513186.db2.gz	CFDFVZWUYLKQIA-YJNKXOJESA-N	0	3	302.484	2.072	10	0		DEAEHN
CCCCCCNC(=O)CN1CCC[C@H]1Cn1ccnc1C	ZINC000178312931	402484275	/nfs/dbraw/zinc/48/42/75/402484275.db2.gz	ULKLXVSRNHIQRP-INIZCTEOSA-N	0	3	306.454	2.352	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)CC(=O)N2CCc3sccc3C2)C1	ZINC000187944445	402513629	/nfs/dbraw/zinc/51/36/29/402513629.db2.gz	XEIWJGKEVGCXLD-DYVFJYSZSA-N	0	3	322.474	2.116	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@H](C)c1ccncc1	ZINC000245873227	402493434	/nfs/dbraw/zinc/49/34/34/402493434.db2.gz	HCROUIZMTFEJJY-BMFZPTHFSA-N	0	3	302.422	2.411	10	0		DEAEHN
CC(C)(C)OC[C@H](O)CN(CCc1ccccc1)[C@H]1CCOC1	ZINC000245873440	402493494	/nfs/dbraw/zinc/49/34/94/402493494.db2.gz	HKJSXDZZHVZCEK-ZWKOTPCHSA-N	0	3	321.461	2.496	10	0		DEAEHN
COc1ccc(C(F)(F)C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1	ZINC000245889577	402494552	/nfs/dbraw/zinc/49/45/52/402494552.db2.gz	JFGKCKRYCXREDO-KGLIPLIRSA-N	0	3	324.371	2.482	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)[C@H](O)C1CCCCC1	ZINC000187385262	402497546	/nfs/dbraw/zinc/49/75/46/402497546.db2.gz	IWAPLJOYNIGNDG-ZWKOTPCHSA-N	0	3	318.461	2.217	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](N[C@H](C)CS(=O)(=O)c2ccccc2)C1	ZINC000245921903	402497906	/nfs/dbraw/zinc/49/79/06/402497906.db2.gz	YAMUUOOIEFKCSK-INMHGKMJSA-N	0	3	324.490	2.167	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C[C@H](C)c1c(C)n[nH]c1C	ZINC000245926026	402498276	/nfs/dbraw/zinc/49/82/76/402498276.db2.gz	XNPYPCQIDWGMLU-SWLSCSKDSA-N	0	3	306.454	2.463	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NOCc2ccccc2)C1	ZINC000245933322	402498949	/nfs/dbraw/zinc/49/89/49/402498949.db2.gz	IOCJQRBUSGCCBU-JKSUJKDBSA-N	0	3	303.406	2.244	10	0		DEAEHN
CC(C)Oc1cccc(C(=O)NCCN2CCCC[C@H]2C)n1	ZINC000169013091	402499585	/nfs/dbraw/zinc/49/95/85/402499585.db2.gz	IPTDMQQHEMUITD-CQSZACIVSA-N	0	3	305.422	2.473	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000187501497	402503381	/nfs/dbraw/zinc/50/33/81/402503381.db2.gz	FZHQXEPTKDSTFH-MELADBBJSA-N	0	3	320.437	2.275	10	0		DEAEHN
CCOc1ccc(CN2C[C@@H](C)[C@@H](N3CCOCC3)C2)cc1	ZINC000246097119	402508971	/nfs/dbraw/zinc/50/89/71/402508971.db2.gz	HWTLZPIRDKAXNH-QAPCUYQASA-N	0	3	304.434	2.238	10	0		DEAEHN
O=C(NC[C@@H]1CCCCN1Cc1ccccc1)N[C@H]1CCOC1	ZINC000246902347	402549302	/nfs/dbraw/zinc/54/93/02/402549302.db2.gz	XSBQIWFSQRIXKK-IRXDYDNUSA-N	0	3	317.433	2.129	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@](C)(O)[C@H](C)c2ccccc2)C1	ZINC000246966273	402551838	/nfs/dbraw/zinc/55/18/38/402551838.db2.gz	FYFNSAXNCOBRNI-IIHSZXCVSA-N	0	3	318.461	2.386	10	0		DEAEHN
CC(C)c1ccc([C@H](C)NC(=O)NC[C@@](C)(O)CN(C)C)cc1	ZINC000178920650	402555675	/nfs/dbraw/zinc/55/56/75/402555675.db2.gz	RIVMTPVXSKRFGZ-KBXCAEBGSA-N	0	3	321.465	2.483	10	0		DEAEHN
CC[C@@H]1CN(CCOc2c(C)cccc2C)CCN1C[C@H](C)O	ZINC000247141887	402558284	/nfs/dbraw/zinc/55/82/84/402558284.db2.gz	LCICMSVQOPPRNS-ZWKOTPCHSA-N	0	3	320.477	2.459	10	0		DEAEHN
CC[C@H]1CN(CCOc2c(C)cccc2C)CCN1C[C@H](C)O	ZINC000247141872	402558306	/nfs/dbraw/zinc/55/83/06/402558306.db2.gz	LCICMSVQOPPRNS-ROUUACIJSA-N	0	3	320.477	2.459	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cnn(Cc2ccccc2)c1	ZINC000247158026	402558941	/nfs/dbraw/zinc/55/89/41/402558941.db2.gz	KGTXFJUMULAJRC-YJBOKZPZSA-N	0	3	324.428	2.240	10	0		DEAEHN
CCOc1ccc(OCC(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1	ZINC000247201236	402560257	/nfs/dbraw/zinc/56/02/57/402560257.db2.gz	LQXBLINQKUDDMU-HUUCEWRRSA-N	0	3	318.417	2.159	10	0		DEAEHN
Cc1[nH]c2ccccc2c1CCNC(=O)NC[C@@H]1CCCN1C	ZINC000171202239	402566599	/nfs/dbraw/zinc/56/65/99/402566599.db2.gz	JZHWPFQFKQPZFB-AWEZNQCLSA-N	0	3	314.433	2.412	10	0		DEAEHN
CC[C@@H](C)CS(=O)(=O)N1CCCC[C@@H](N2CCCC2)C1	ZINC000247516092	402570568	/nfs/dbraw/zinc/57/05/68/402570568.db2.gz	WGVOFXCCBUZTKS-HUUCEWRRSA-N	0	3	302.484	2.313	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2cc3c(s2)CCOC3)C1	ZINC000247514492	402570814	/nfs/dbraw/zinc/57/08/14/402570814.db2.gz	YQODEPWLXLYBGQ-WCQYABFASA-N	0	3	308.447	2.279	10	0		DEAEHN
CCOCCCNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179084175	402570961	/nfs/dbraw/zinc/57/09/61/402570961.db2.gz	XDJXBUYQBCMENI-JKSUJKDBSA-N	0	3	305.422	2.158	10	0		DEAEHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NCCCc1ccccn1	ZINC000246186072	402517064	/nfs/dbraw/zinc/51/70/64/402517064.db2.gz	KAGUVIIPBBFHAV-CVEARBPZSA-N	0	3	318.465	2.434	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H](C)CNc2ccccc2)C1	ZINC000246194532	402517532	/nfs/dbraw/zinc/51/75/32/402517532.db2.gz	BTPDRUJTDWGUIR-GDBMZVCRSA-N	0	3	304.438	2.271	10	0		DEAEHN
O=C(CN1CCN2CCC[C@@H]2C1)Nc1cccc2c1N=S=N2	ZINC000178635832	402520076	/nfs/dbraw/zinc/52/00/76/402520076.db2.gz	PYBQILCTLHAADV-LLVKDONJSA-N	0	3	317.418	2.132	10	0		DEAEHN
CCC[C@@H](NC(=O)CN1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000246260455	402521384	/nfs/dbraw/zinc/52/13/84/402521384.db2.gz	GFMCAWFJUAVCPP-ZWKOTPCHSA-N	0	3	315.461	2.424	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCC2(c3ccc(F)cc3)CC2)C1	ZINC000170831130	402530177	/nfs/dbraw/zinc/53/01/77/402530177.db2.gz	YXNYYXRDEKMGJP-HNNXBMFYSA-N	0	3	305.397	2.203	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)C(=O)Nc2ccc(C(C)(C)C)cc2)C1	ZINC000170845224	402532217	/nfs/dbraw/zinc/53/22/17/402532217.db2.gz	JOXLWYLMSQXKJS-OAHLLOKOSA-N	0	3	317.433	2.085	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)CCc2ncc(-c3ccccc3)o2)C1	ZINC000170856726	402533697	/nfs/dbraw/zinc/53/36/97/402533697.db2.gz	KSNYGXCCXYVWCQ-HNNXBMFYSA-N	0	3	313.401	2.437	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)CSc2nc3ccccc3o2)C1	ZINC000170861179	402534104	/nfs/dbraw/zinc/53/41/04/402534104.db2.gz	XAMZDPAXEWKCNB-LLVKDONJSA-N	0	3	305.403	2.082	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000170865897	402534912	/nfs/dbraw/zinc/53/49/12/402534912.db2.gz	YREOBAACAGPNSY-GFCCVEGCSA-N	0	3	316.323	2.290	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(Cc2cccnc2)C2CC2)C1	ZINC000171351397	402579990	/nfs/dbraw/zinc/57/99/90/402579990.db2.gz	YYZQOZFOTKSKBU-HNNXBMFYSA-N	0	3	302.422	2.240	10	0		DEAEHN
Cc1nn(C)c(C)c1CCNC(=O)[C@H](C(C)C)N1CCCCC1	ZINC000171432016	402586997	/nfs/dbraw/zinc/58/69/97/402586997.db2.gz	KGHHMWXPHHTDOT-KRWDZBQOSA-N	0	3	320.481	2.206	10	0		DEAEHN
CCOCc1cc(CN2C[C@@H](C(N)=O)CC[C@@H]2C)ccc1OC	ZINC000179433948	402589877	/nfs/dbraw/zinc/58/98/77/402589877.db2.gz	YQWLDKVMEDIWEK-ZFWWWQNUSA-N	0	3	320.433	2.318	10	0		DEAEHN
O=C(c1ccc(O)cc1[O-])N1CCC(C[NH+]2CCCC2)CC1	ZINC000179495718	402592319	/nfs/dbraw/zinc/59/23/19/402592319.db2.gz	QUSOESVEUHSKNU-UHFFFAOYSA-N	0	3	304.390	2.046	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)C(=O)Nc1cccc(C)c1	ZINC000190338185	402593823	/nfs/dbraw/zinc/59/38/23/402593823.db2.gz	CCKBGFAQAFNFNV-HZPDHXFCSA-N	0	3	315.417	2.019	10	0		DEAEHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)N[C@@H]1CCCOC1	ZINC000171610681	402601387	/nfs/dbraw/zinc/60/13/87/402601387.db2.gz	VFUPQBUXXATPSZ-QGZVFWFLSA-N	0	3	319.449	2.459	10	0		DEAEHN
CCOc1ccccc1NC(=O)[C@@H](C)N1CCN2CCC[C@@H]2C1	ZINC000171640941	402605230	/nfs/dbraw/zinc/60/52/30/402605230.db2.gz	IXYVPZORBUVXKI-HUUCEWRRSA-N	0	3	317.433	2.192	10	0		DEAEHN
COc1ccc(COC[C@@H](O)CN2CCS[C@@H](C)C2)cc1	ZINC000171687564	402609944	/nfs/dbraw/zinc/60/99/44/402609944.db2.gz	UWYOYXAAIUNXAL-ZFWWWQNUSA-N	0	3	311.447	2.010	10	0		DEAEHN
C[C@H](CNC(=O)c1cn2ccnc2s1)N1CCC[C@H](C)C1	ZINC000248963856	402615906	/nfs/dbraw/zinc/61/59/06/402615906.db2.gz	RKASKDVCXIHCQQ-NWDGAFQWSA-N	0	3	306.435	2.246	10	0		DEAEHN
COc1ccc(NC(=O)C[C@@H](C)NCC2(C)OCCCO2)cc1	ZINC000190645190	402616043	/nfs/dbraw/zinc/61/60/43/402616043.db2.gz	AAQPXYFMSGOGGI-CYBMUJFWSA-N	0	3	322.405	2.155	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)NC(C)C)C1	ZINC000190676149	402617727	/nfs/dbraw/zinc/61/77/27/402617727.db2.gz	ZDBWHTYGZQZWSL-CYBMUJFWSA-N	0	3	310.467	2.323	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000249172945	402622414	/nfs/dbraw/zinc/62/24/14/402622414.db2.gz	LQBXBTSGKVXHRK-GJZGRUSLSA-N	0	3	317.433	2.183	10	0		DEAEHN
CCc1ccccc1NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000249150379	402622463	/nfs/dbraw/zinc/62/24/63/402622463.db2.gz	HBLLJAVERXQYLL-ZFWWWQNUSA-N	0	3	317.433	2.129	10	0		DEAEHN
CC[C@@H]1CN(c2ccccc2)CCN1CCN1CCO[C@@H](C)C1	ZINC000249262081	402624183	/nfs/dbraw/zinc/62/41/83/402624183.db2.gz	HFAQZXLSBFGSKK-ZWKOTPCHSA-N	0	3	317.477	2.308	10	0		DEAEHN
C[C@H](c1ccccc1)N1CC[C@@H](NCc2cc(C(N)=O)co2)C1	ZINC000249434133	402629681	/nfs/dbraw/zinc/62/96/81/402629681.db2.gz	IACABQHFYRYDID-CZUORRHYSA-N	0	3	313.401	2.304	10	0		DEAEHN
Cc1c(-c2cc(CN(C)[C@@]3(CO)CC[C@@H](C)C3)on2)cnn1C	ZINC000249529883	402633465	/nfs/dbraw/zinc/63/34/65/402633465.db2.gz	ASBYZQPYSPAALC-PXAZEXFGSA-N	0	3	318.421	2.366	10	0		DEAEHN
CCOC(=O)N[C@@H]1CCCN(C[C@@](C)(O)c2ccccc2)C1	ZINC000249723052	402638817	/nfs/dbraw/zinc/63/88/17/402638817.db2.gz	CQAINOUJVZXEQV-NVXWUHKLSA-N	0	3	306.406	2.105	10	0		DEAEHN
O=C(NCCOC1CCCCCC1)N1CCN2CCC[C@H]2C1	ZINC000172478976	402658412	/nfs/dbraw/zinc/65/84/12/402658412.db2.gz	CYVOOYGGJHLTDU-HNNXBMFYSA-N	0	3	309.454	2.215	10	0		DEAEHN
CC(C)[C@H](C)CNC(=O)N(CCN(C)C)Cc1ccccn1	ZINC000172502959	402659579	/nfs/dbraw/zinc/65/95/79/402659579.db2.gz	KUWPWVPRBQTLDO-OAHLLOKOSA-N	0	3	306.454	2.447	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@H](N[C@H]2CCOc3ccccc32)C1	ZINC000250949575	402646941	/nfs/dbraw/zinc/64/69/41/402646941.db2.gz	OAQWJVWYPBIUCP-GUTXKFCHSA-N	0	3	309.431	2.456	10	0		DEAEHN
O=C1[C@H](N2CCN3CCC[C@@H]3C2)CCCN1c1cccc(F)c1	ZINC000172290278	402648258	/nfs/dbraw/zinc/64/82/58/402648258.db2.gz	OEGINSPNMGSFHZ-IAGOWNOFSA-N	0	3	317.408	2.101	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccc(Cl)cn1)N1CCCN(C2CC2)CC1	ZINC000172347462	402651218	/nfs/dbraw/zinc/65/12/18/402651218.db2.gz	JNFIYAHWFQAYRF-LBPRGKRZSA-N	0	3	322.840	2.232	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)NCCCN(C)Cc1ccccc1	ZINC000191312851	402660020	/nfs/dbraw/zinc/66/00/20/402660020.db2.gz	KQFUIBBSIQDEEL-RDJZCZTQSA-N	0	3	304.434	2.440	10	0		DEAEHN
CN1CCC[C@@H](CNc2ccc3nnnn3n2)[C@H]1c1ccccc1	ZINC000252477144	402653994	/nfs/dbraw/zinc/65/39/94/402653994.db2.gz	IYCRVFMRRVYHFZ-WMLDXEAASA-N	0	3	323.404	2.014	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCCC[C@@H]1c1cn[nH]c1)N(C)C1CC1	ZINC000182701798	402710269	/nfs/dbraw/zinc/71/02/69/402710269.db2.gz	ZFHQGEMRDGXMDI-SWLSCSKDSA-N	0	3	305.426	2.129	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@](C)(O)C2CCCCC2)C1	ZINC000191493541	402673636	/nfs/dbraw/zinc/67/36/36/402673636.db2.gz	CNMMMZQTSSCFHH-WBVHZDCISA-N	0	3	311.470	2.101	10	0		DEAEHN
CCN(CC)C(=O)C1(NCCC(=O)NC(C)C)CCCCC1	ZINC000172822200	402677043	/nfs/dbraw/zinc/67/70/43/402677043.db2.gz	RNDGCPAFEJIKLZ-UHFFFAOYSA-N	0	3	311.470	2.062	10	0		DEAEHN
Fc1ccccc1SCCN1CC[C@H](N2CCOCC2)C1	ZINC000173934288	402720138	/nfs/dbraw/zinc/72/01/38/402720138.db2.gz	BKBXIHUBNFOQPY-AWEZNQCLSA-N	0	3	310.438	2.324	10	0		DEAEHN
N[C@@H](C(=O)N1CCSC2(CCCCC2)C1)C1CCOCC1	ZINC000262077009	402721841	/nfs/dbraw/zinc/72/18/41/402721841.db2.gz	SVMMCQRBFSFKJX-CQSZACIVSA-N	0	3	312.479	2.019	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)Cc2ccccc2C)[C@H](C)C1	ZINC000173262435	402690249	/nfs/dbraw/zinc/69/02/49/402690249.db2.gz	JLANVHAWVSCBMP-WBVHZDCISA-N	0	3	324.490	2.487	10	0		DEAEHN
COCCCN(C)CCNC(=O)N1CCC[C@H]1c1ccco1	ZINC000173373371	402694227	/nfs/dbraw/zinc/69/42/27/402694227.db2.gz	QWPRTOMIAFCSMT-AWEZNQCLSA-N	0	3	309.410	2.094	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@H]1CCN(Cc2cocn2)C1	ZINC000191980140	402702148	/nfs/dbraw/zinc/70/21/48/402702148.db2.gz	MPQWHOBJMRXFFA-CYBMUJFWSA-N	0	3	306.435	2.393	10	0		DEAEHN
Cc1cnc([C@H](C)CNC(=O)N2CC[C@@H](N3CC=CC3)C2)s1	ZINC000183193036	402746004	/nfs/dbraw/zinc/74/60/04/402746004.db2.gz	NPUIRPNOXRHMJG-TZMCWYRMSA-N	0	3	320.462	2.211	10	0		DEAEHN
C[C@H](Oc1ccc(F)c(F)c1)c1nc([C@H]2CNCCN2C)no1	ZINC000263248455	402750095	/nfs/dbraw/zinc/75/00/95/402750095.db2.gz	PPDJYMVHHJOJOQ-TVQRCGJNSA-N	0	3	324.331	2.064	10	0		DEAEHN
c1coc(-c2ncc(CN[C@H]3CCc4ncnn4C3)s2)c1	ZINC000193092036	402764364	/nfs/dbraw/zinc/76/43/64/402764364.db2.gz	DGGQTVQAKLLMLA-JTQLQIEISA-N	0	3	301.375	2.099	10	0		DEAEHN
COC(=O)c1cccc(NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000175012302	402771531	/nfs/dbraw/zinc/77/15/31/402771531.db2.gz	GLEQNUSPFDQZLF-WFASDCNBSA-N	0	3	319.405	2.420	10	0		DEAEHN
Cc1cnn(CCN[C@H]2CCN(c3cccc(Cl)c3)C2=O)c1	ZINC000175224601	402789827	/nfs/dbraw/zinc/78/98/27/402789827.db2.gz	INNWAXYALNGIMS-HNNXBMFYSA-N	0	3	318.808	2.240	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cccc(C(=O)OC)c2)C1	ZINC000194310850	402791691	/nfs/dbraw/zinc/79/16/91/402791691.db2.gz	NQWUEUCAYAYVSQ-AWEZNQCLSA-N	0	3	305.378	2.079	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000194368731	402793889	/nfs/dbraw/zinc/79/38/89/402793889.db2.gz	UJDOOYRWSJCWFL-BPQIPLTHSA-N	0	3	316.445	2.440	10	0		DEAEHN
O[C@H](Cc1ccccc1)CN1CCCN(c2ccccn2)CC1	ZINC000183779276	402796861	/nfs/dbraw/zinc/79/68/61/402796861.db2.gz	FDMLNXVYLYFIIG-GOSISDBHSA-N	0	3	311.429	2.197	10	0		DEAEHN
Cc1cc(C)cc([C@H]2CCN(C(=O)C(C)S(C)(=O)=O)C2)c1	ZINC000183778300	402797232	/nfs/dbraw/zinc/79/72/32/402797232.db2.gz	YUJGBHJKABJRHC-KGLIPLIRSA-N	0	3	309.431	2.052	10	0		DEAEHN
CC(C)OCCNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000183801888	402798655	/nfs/dbraw/zinc/79/86/55/402798655.db2.gz	HVSUIAHQYXDNAR-HZPDHXFCSA-N	0	3	305.422	2.156	10	0		DEAEHN
CCOC(=O)CCN[C@@H](CO)c1cccc(Br)c1	ZINC000183912256	402804603	/nfs/dbraw/zinc/80/46/03/402804603.db2.gz	TZRGFKMSSJLFBU-LBPRGKRZSA-N	0	3	316.195	2.025	10	0		DEAEHN
C[C@@H](NC(=O)NC[C@H](O)CN1CCCCC1)C1CCCCC1	ZINC000175414636	402804873	/nfs/dbraw/zinc/80/48/73/402804873.db2.gz	IDPXQAJHNVOGSO-ZBFHGGJFSA-N	0	3	311.470	2.101	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccn(-c2cccc(Cl)c2)n1	ZINC000194690811	402810365	/nfs/dbraw/zinc/81/03/65/402810365.db2.gz	ZNHILWZZHPTKAR-AWEZNQCLSA-N	0	3	318.808	2.350	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)COc1ccc(F)cc1Cl	ZINC000194728361	402812928	/nfs/dbraw/zinc/81/29/28/402812928.db2.gz	UHPXYBZYTNFMTJ-NSHDSACASA-N	0	3	300.761	2.068	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)N(C)C2CCN(C)CC2)s1	ZINC000175567156	402817785	/nfs/dbraw/zinc/81/77/85/402817785.db2.gz	WJXGCLBZJNCZTN-LLVKDONJSA-N	0	3	311.451	2.325	10	0		DEAEHN
CCCN1CCC(CNS(=O)(=O)c2cccc(C)c2)CC1	ZINC000195098736	402831544	/nfs/dbraw/zinc/83/15/44/402831544.db2.gz	BQHRSJDBVJQBFN-UHFFFAOYSA-N	0	3	310.463	2.395	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)N[C@@H]1COc2ccccc21	ZINC000195197656	402836469	/nfs/dbraw/zinc/83/64/69/402836469.db2.gz	VTTKNWVBJXOQLR-DZGCQCFKSA-N	0	3	303.406	2.294	10	0		DEAEHN
O=C(c1cccnc1SC(F)F)N1CCN2CCC[C@H]2C1	ZINC000195318424	402841486	/nfs/dbraw/zinc/84/14/86/402841486.db2.gz	GPKVRPXVZBLXPG-JTQLQIEISA-N	0	3	313.373	2.317	10	0		DEAEHN
CC[C@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1nccs1	ZINC000175157807	402784034	/nfs/dbraw/zinc/78/40/34/402784034.db2.gz	DLCVEFYBCBWMGF-STQMWFEESA-N	0	3	306.435	2.250	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(COC(C)(C)C)on1	ZINC000184524857	402848801	/nfs/dbraw/zinc/84/88/01/402848801.db2.gz	DQJDCMCXOONIDF-QWHCGFSZSA-N	0	3	321.421	2.298	10	0		DEAEHN
C/C(=C\C(=O)N(C)C1CCN(CCn2cccn2)CC1)C1CC1	ZINC000264554579	402888730	/nfs/dbraw/zinc/88/87/30/402888730.db2.gz	YTNCYQBISFHIEH-CCEZHUSRSA-N	0	3	316.449	2.162	10	0		DEAEHN
Cc1cn2cc(NC(=O)N3CC[C@H]4CC[C@@H](C3)N4C)ccc2n1	ZINC000266768324	402989943	/nfs/dbraw/zinc/98/99/43/402989943.db2.gz	RTFNNFIIDZYWAP-CABCVRRESA-N	0	3	313.405	2.343	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCc2cn3ccsc3n2)CCN1C	ZINC000266637202	402980244	/nfs/dbraw/zinc/98/02/44/402980244.db2.gz	BCUGGPVKFSIDJC-AAEUAGOBSA-N	0	3	321.450	2.020	10	0		DEAEHN
Cc1cc(N[C@H]2CCN(C)[C@H]2c2ccccc2)n2ncnc2n1	ZINC000270269177	403180020	/nfs/dbraw/zinc/18/00/20/403180020.db2.gz	JZOWANFTBBMXOU-HOCLYGCPSA-N	0	3	308.389	2.290	10	0		DEAEHN
CC(=O)CCc1ccc(OC[C@H](O)CN2C[C@@H](C)[C@H]2C)cc1	ZINC000293532188	403497117	/nfs/dbraw/zinc/49/71/17/403497117.db2.gz	XEIWVAPEKSOPSX-FRFSOERESA-N	0	3	305.418	2.288	10	0		DEAEHN
C[C@@H](NCCCS(=O)(=O)N(C)C)c1cccc(Cl)c1	ZINC000341073476	403761305	/nfs/dbraw/zinc/76/13/05/403761305.db2.gz	VHYBEIDOGAEVFS-LLVKDONJSA-N	0	3	304.843	2.272	10	0		DEAEHN
C/C=C\C[C@H](CO)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000351634658	403818740	/nfs/dbraw/zinc/81/87/40/403818740.db2.gz	RUIZNSDYMRKRSX-AOAYNFQDSA-N	0	3	317.433	2.058	10	0		DEAEHN
O=C(C1CC1)N1CCCCC[C@@H]1C1CCN(CCCO)CC1	ZINC000369280952	404032189	/nfs/dbraw/zinc/03/21/89/404032189.db2.gz	USYVVRXHVQJRMY-QGZVFWFLSA-N	0	3	308.466	2.262	10	0		DEAEHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)/C=C/c2ccnn2C)C1	ZINC000369709171	404202738	/nfs/dbraw/zinc/20/27/38/404202738.db2.gz	BGMHRDUGXOMOFG-BLGFXRMMSA-N	0	3	324.428	2.166	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNCC[C@H]1CCCCO1	ZINC000291743980	404502064	/nfs/dbraw/zinc/50/20/64/404502064.db2.gz	PHDXXKSKJAOJHC-QGZVFWFLSA-N	0	3	300.406	2.375	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)nc1	ZINC000297122278	404460423	/nfs/dbraw/zinc/46/04/23/404460423.db2.gz	IGIQFMVHQVLQAS-SMDDNHRTSA-N	0	3	304.394	2.231	10	0		DEAEHN
COc1ccccc1N1CCC[C@@H](NCc2c(C)cnn2C)C1	ZINC000375770081	404743318	/nfs/dbraw/zinc/74/33/18/404743318.db2.gz	SDEBFHZZMYGLQZ-OAHLLOKOSA-N	0	3	314.433	2.496	10	0		DEAEHN
CCCNC(=O)[C@@H]1CCCN(Cc2ccc(-c3cc[nH]n3)o2)C1	ZINC000435132576	404958149	/nfs/dbraw/zinc/95/81/49/404958149.db2.gz	YDFIJHCLNLZKIP-CYBMUJFWSA-N	0	3	316.405	2.408	10	0		DEAEHN
COC(=O)[C@@H](C1CC1)N1CCC(c2ncc3n2CCCC3)CC1	ZINC000434688315	404924644	/nfs/dbraw/zinc/92/46/44/404924644.db2.gz	KWEHZYGVWVWXRI-MRXNPFEDSA-N	0	3	317.433	2.350	10	0		DEAEHN
CC(=O)NC[C@H]1CCCN(Cc2ccc(-c3cc[nH]n3)o2)C1	ZINC000434834177	404938668	/nfs/dbraw/zinc/93/86/68/404938668.db2.gz	OIYUDBKBVUDUKI-CYBMUJFWSA-N	0	3	302.378	2.018	10	0		DEAEHN
CCN1CC[C@H](NC(=O)c2c(F)cccc2Br)C1	ZINC000389945344	405042825	/nfs/dbraw/zinc/04/28/25/405042825.db2.gz	CSGVRSLHQNFTQB-VIFPVBQESA-N	0	3	315.186	2.412	10	0		DEAEHN
COC(=O)C(C)(C)N1CCN(C[C@H]2C[C@H]2c2ccccc2)CC1	ZINC000361394041	405053950	/nfs/dbraw/zinc/05/39/50/405053950.db2.gz	CRYIGOSETWFWLJ-SJORKVTESA-N	0	3	316.445	2.359	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)c2ncccc2N)CN1Cc1ccccc1	ZINC000398036983	405060544	/nfs/dbraw/zinc/06/05/44/405060544.db2.gz	JDVQFNVVSRRDKK-HIFRSBDPSA-N	0	3	310.401	2.057	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@H]1CCc2cn(C(C)C)nc2C1	ZINC000361456532	405082528	/nfs/dbraw/zinc/08/25/28/405082528.db2.gz	IDPQZKAXCQELFX-DOTOQJQBSA-N	0	3	318.465	2.312	10	0		DEAEHN
CN(C(=O)c1ccc2c(c1O)OC(C)(C)C2)C1CCN(C)CC1	ZINC000408409850	405199222	/nfs/dbraw/zinc/19/92/22/405199222.db2.gz	FJRBGBRATITAQT-UHFFFAOYSA-N	0	3	318.417	2.272	10	0		DEAEHN
COc1ccc(CN2CCN3CCOC[C@H]3C2)c2ccccc12	ZINC000368285656	405234337	/nfs/dbraw/zinc/23/43/37/405234337.db2.gz	WPLJEEQECMRCOA-MRXNPFEDSA-N	0	3	312.413	2.365	10	0		DEAEHN
COc1cccc([C@@H](C)CC(=O)NCCNc2ccncc2)c1	ZINC000440048245	405300446	/nfs/dbraw/zinc/30/04/46/405300446.db2.gz	DFBZQECEJMZXGH-AWEZNQCLSA-N	0	3	313.401	2.234	10	0		DEAEHN
O[C@H](COC[C@@H]1CCCO1)CN1CCC=C(c2ccccc2)C1	ZINC000556506001	405486011	/nfs/dbraw/zinc/48/60/11/405486011.db2.gz	SORQBDZVIGSERC-OALUTQOASA-N	0	3	317.429	2.332	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2cccc3cc[nH]c32)CC12COC2	ZINC000449363186	405525023	/nfs/dbraw/zinc/52/50/23/405525023.db2.gz	LOZLOMUEONOSFH-HNNXBMFYSA-N	0	3	314.385	2.179	10	0		DEAEHN
COc1nsc(CN[C@H](C)[C@H]2CCOC2)c1Br	ZINC000638692270	405620128	/nfs/dbraw/zinc/62/01/28/405620128.db2.gz	FVJKMZQFXNCYAU-SFYZADRCSA-N	0	3	321.240	2.429	10	0		DEAEHN
CC[C@@H](CCO)CNCc1snc(OC)c1Br	ZINC000638764834	405656062	/nfs/dbraw/zinc/65/60/62/405656062.db2.gz	BMEMCRHQXUWZSA-QMMMGPOBSA-N	0	3	323.256	2.412	10	0		DEAEHN
CCn1nncc1CN1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000459517672	405938131	/nfs/dbraw/zinc/93/81/31/405938131.db2.gz	RHLAXDVRSOHINA-INIZCTEOSA-N	0	3	313.449	2.252	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)c1	ZINC000457590304	405909740	/nfs/dbraw/zinc/90/97/40/405909740.db2.gz	FFRVYNLOPLTGMR-XJKSGUPXSA-N	0	3	318.417	2.194	10	0		DEAEHN
CN1CCC(C(=O)N2CCC[C@@H](CC(=O)OC(C)(C)C)C2)CC1	ZINC000531871254	406017889	/nfs/dbraw/zinc/01/78/89/406017889.db2.gz	RCMJVQMIRODFAG-AWEZNQCLSA-N	0	3	324.465	2.299	10	0		DEAEHN
CC[C@H](C)N[C@@H](CNC(=O)N[C@H](C)[C@@H](C)OC)c1ccco1	ZINC000461007604	406081752	/nfs/dbraw/zinc/08/17/52/406081752.db2.gz	LAJDOYQGRZFXJE-DGAVXFQQSA-N	0	3	311.426	2.431	10	0		DEAEHN
Cc1csc([C@H](C)NC(=O)N[C@H]2CN(C3CC3)C[C@@H]2C)n1	ZINC000532060542	406039468	/nfs/dbraw/zinc/03/94/68/406039468.db2.gz	JSLFJKQGWFMXAO-GAFUQQFSSA-N	0	3	308.451	2.294	10	0		DEAEHN
C[C@@H](CNC(=O)N1CC[C@H](C(F)(F)F)[C@H]1C)N(C)C1CC1	ZINC000471823022	406121260	/nfs/dbraw/zinc/12/12/60/406121260.db2.gz	CKKPXMUUACKDRP-UMNHJUIQSA-N	0	3	307.360	2.451	10	0		DEAEHN
CO[C@@H]1CC[C@@H](NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000471825250	406122398	/nfs/dbraw/zinc/12/23/98/406122398.db2.gz	KBTSHBUQXKWRIJ-BRWVUGGUSA-N	0	3	319.449	2.026	10	0		DEAEHN
CO[C@H]1CC[C@H](NC(=O)Nc2ccccc2CCN(C)C)C1	ZINC000471964792	406133886	/nfs/dbraw/zinc/13/38/86/406133886.db2.gz	JXTRQNNCWLSGSS-GJZGRUSLSA-N	0	3	305.422	2.480	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccc(F)cc1OC(F)F	ZINC000487623704	406251828	/nfs/dbraw/zinc/25/18/28/406251828.db2.gz	SASNLWAHOPEFOJ-JTQLQIEISA-N	0	3	302.296	2.251	10	0		DEAEHN
CCc1ccc([C@H](C)NC(=O)CN2CC[C@H](CO)[C@H]2C)cc1	ZINC000488806589	406350096	/nfs/dbraw/zinc/35/00/96/406350096.db2.gz	VFEXURUWGSXIAX-JJRVBVJISA-N	0	3	304.434	2.129	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N(C)CC1CCCC1	ZINC000637963006	406499217	/nfs/dbraw/zinc/49/92/17/406499217.db2.gz	JKWKXHURGMGAKZ-QGZVFWFLSA-N	0	3	303.450	2.094	10	0		DEAEHN
C[C@@H]1CCC[C@@H](NC(=O)[C@@H](N)CN(C)Cc2ccccc2)C1	ZINC000637919263	406477367	/nfs/dbraw/zinc/47/73/67/406477367.db2.gz	RIFCFJOWDJYYJH-OIISXLGYSA-N	0	3	303.450	2.141	10	0		DEAEHN
C[C@H]1CCCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)CC1	ZINC000637957176	406494956	/nfs/dbraw/zinc/49/49/56/406494956.db2.gz	DKPDPDWLZIXCNE-DOTOQJQBSA-N	0	3	303.450	2.094	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637869918	406455572	/nfs/dbraw/zinc/45/55/72/406455572.db2.gz	ZWBNTWZGCLPNDC-SJORKVTESA-N	0	3	303.450	2.237	10	0		DEAEHN
CC[C@@]1(C)CCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)C1	ZINC000638030816	406532866	/nfs/dbraw/zinc/53/28/66/406532866.db2.gz	LPFWPVRPNBUCDK-WMZOPIPTSA-N	0	3	303.450	2.094	10	0		DEAEHN
CC[C@]1(C)CCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)C1	ZINC000638030814	406533057	/nfs/dbraw/zinc/53/30/57/406533057.db2.gz	LPFWPVRPNBUCDK-FUHWJXTLSA-N	0	3	303.450	2.094	10	0		DEAEHN
COC(=O)CC1(CC(=O)NC[C@H](C)N2CCCC2)CCCC1	ZINC000526071384	406541057	/nfs/dbraw/zinc/54/10/57/406541057.db2.gz	BUBQLGVYLATSNO-AWEZNQCLSA-N	0	3	310.438	2.101	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N[C@H]1CCCC1(C)C	ZINC000638004683	406519255	/nfs/dbraw/zinc/51/92/55/406519255.db2.gz	FBTJIQGOVODXMO-CVEARBPZSA-N	0	3	303.450	2.141	10	0		DEAEHN
CCc1cnc(CNC[C@H]2CCC3(CCOCC3)[C@@H]2O)s1	ZINC000548992068	406571005	/nfs/dbraw/zinc/57/10/05/406571005.db2.gz	UKLSCIPZZYNPLK-IUODEOHRSA-N	0	3	310.463	2.363	10	0		DEAEHN
COc1nsc(CNC[C@H]2CCOC2)c1Br	ZINC000638360854	406724643	/nfs/dbraw/zinc/72/46/43/406724643.db2.gz	JGRAYARHOMOOAB-SSDOTTSWSA-N	0	3	307.213	2.040	10	0		DEAEHN
OCc1cc(OCCN2CCCC2)ccc1Br	ZINC000128925370	196004574	/nfs/dbraw/zinc/00/45/74/196004574.db2.gz	ANXBWTUGLMTWAA-UHFFFAOYSA-N	0	3	300.196	2.416	10	0		DEAEHN
C[C@@H](N)c1cc(Br)ccc1N1CCn2cnnc2C1	ZINC000128930025	196005010	/nfs/dbraw/zinc/00/50/10/196005010.db2.gz	NEAZWJXTFXDWHH-SECBINFHSA-N	0	3	322.210	2.081	10	0		DEAEHN
CC[C@H](C)NCC(=O)Nc1ncc(Br)cc1C	ZINC000129631225	196063569	/nfs/dbraw/zinc/06/35/69/196063569.db2.gz	IBDVCEZALHAGCF-VIFPVBQESA-N	0	3	300.200	2.479	10	0		DEAEHN
Cc1ccc(S(=O)(=O)NCCCC(F)(F)F)cc1CN	ZINC000131234532	196152032	/nfs/dbraw/zinc/15/20/32/196152032.db2.gz	XAVQOJWHNKDKGC-UHFFFAOYSA-N	0	3	310.341	2.075	10	0		DEAEHN
CSCC[C@@H](C)NS(=O)(=O)c1cccc([C@@H](C)N)c1	ZINC000131234068	196152222	/nfs/dbraw/zinc/15/22/22/196152222.db2.gz	NDKKMWSMANDMEF-GHMZBOCLSA-N	0	3	302.465	2.126	10	0		DEAEHN
Nc1nc(NCCCCC(F)(F)F)nc(N2CCCC2)n1	ZINC000131265451	196154930	/nfs/dbraw/zinc/15/49/30/196154930.db2.gz	KDXRLMUMGAWUOG-UHFFFAOYSA-N	0	3	304.320	2.199	10	0		DEAEHN
CC[C@@H](C)[C@@](C)(O)c1c(Br)cnn1CCN(C)C	ZINC000131446565	196169948	/nfs/dbraw/zinc/16/99/48/196169948.db2.gz	RELCFGLPXIVMTB-ZWNOBZJWSA-N	0	3	318.259	2.461	10	0		DEAEHN
C[C@@H]1C[C@H](N2C(=O)C3(CC3)N[C@H]2c2cccs2)CCN1C	ZINC000131488500	196173118	/nfs/dbraw/zinc/17/31/18/196173118.db2.gz	UPDQGJUCLDMSMH-YRGRVCCFSA-N	0	3	305.447	2.194	10	0		DEAEHN
CCN[C@@H](Cc1cccc(F)c1F)[C@@H]1CCCCS1(=O)=O	ZINC000131484036	196173476	/nfs/dbraw/zinc/17/34/76/196173476.db2.gz	MNTJOEKLTMRWJB-KBPBESRZSA-N	0	3	317.401	2.453	10	0		DEAEHN
CCN[C@@H](c1ncccc1F)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000131662514	196188988	/nfs/dbraw/zinc/18/89/88/196188988.db2.gz	WDINFXUSUMSTHA-SGMGOOAPSA-N	0	3	314.426	2.475	10	0		DEAEHN
NC(=O)CCN[C@H]1CCCc2sc(Br)cc21	ZINC000132275027	196240487	/nfs/dbraw/zinc/24/04/87/196240487.db2.gz	NHIJXFCLZFRTIZ-QMMMGPOBSA-N	0	3	303.225	2.353	10	0		DEAEHN
C[C@H](NCCNC(=O)N(C)C)c1ccc(Br)cc1	ZINC000132281174	196241621	/nfs/dbraw/zinc/24/16/21/196241621.db2.gz	DVKHOBNEUMPJNU-JTQLQIEISA-N	0	3	314.227	2.371	10	0		DEAEHN
C[C@H]1CCC[C@@]1(O)c1c(Br)cnn1CCN(C)C	ZINC000132489576	196259250	/nfs/dbraw/zinc/25/92/50/196259250.db2.gz	ZRHFBGNGEQDWPZ-GWCFXTLKSA-N	0	3	316.243	2.215	10	0		DEAEHN
CC[S@](=O)CCNCc1cccc(NC(=O)C(F)(F)F)c1	ZINC000132495324	196259322	/nfs/dbraw/zinc/25/93/22/196259322.db2.gz	QPGYHOLOGYSGRC-OAQYLSRUSA-N	0	3	322.352	2.046	10	0		DEAEHN
CCN(CC)c1nc(N)nc(N(CC(F)(F)F)C(C)C)n1	ZINC000132615668	196270862	/nfs/dbraw/zinc/27/08/62/196270862.db2.gz	JQPQEKWPAXSQTR-UHFFFAOYSA-N	0	3	306.336	2.077	10	0		DEAEHN
CN[C@@H](CC[C@H]1CCCO1)c1c(Br)cnn1C	ZINC000133733421	196333379	/nfs/dbraw/zinc/33/33/79/196333379.db2.gz	FOBWGJIHQDHHHH-KOLCDFICSA-N	0	3	302.216	2.402	10	0		DEAEHN
CC(=O)NC1CCN([C@@H](c2ccc(Cl)s2)[C@H](C)N)CC1	ZINC000133741582	196333459	/nfs/dbraw/zinc/33/34/59/196333459.db2.gz	GRCLYWMNXIZZMV-LKFCYVNXSA-N	0	3	315.870	2.390	10	0		DEAEHN
CNc1cc(N2CCN(C3CCCC3)CC2)nc(SC)n1	ZINC000134107668	196361999	/nfs/dbraw/zinc/36/19/99/196361999.db2.gz	WRYUGMZBHUMKHM-UHFFFAOYSA-N	0	3	307.467	2.305	10	0		DEAEHN
Cc1ccc2c(CCN[C@@H](C)CS(C)(=O)=O)cn(C)c2c1	ZINC000188699551	225030610	/nfs/dbraw/zinc/03/06/10/225030610.db2.gz	APOXLRRGWJTEHD-ZDUSSCGKSA-N	0	3	308.447	2.052	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCCC[C@@H](c2c[nH]nc2N)C1	ZINC000616628480	422515889	/nfs/dbraw/zinc/51/58/89/422515889.db2.gz	LTQSCPNHHFAUSY-GFCCVEGCSA-N	0	3	323.441	2.086	10	0		DEAEHN
CC(C)(N)c1cn(Cc2cc(F)ccc2Br)nn1	ZINC000070118104	424841987	/nfs/dbraw/zinc/84/19/87/424841987.db2.gz	XBYLERAHZBNJSF-UHFFFAOYSA-N	0	3	313.174	2.422	10	0		DEAEHN
CCC[C@@H](C)NC(=O)[C@H](C)N1CCC(Cc2nccn2C)CC1	ZINC000105876282	424849282	/nfs/dbraw/zinc/84/92/82/424849282.db2.gz	SHIGFVAOIGEGMK-CABCVRRESA-N	0	3	320.481	2.368	10	0		DEAEHN
C[C@@]1(CNC(=O)C2CC(=O)C2)CCCN1Cc1ccccc1	ZINC000153798894	424859837	/nfs/dbraw/zinc/85/98/37/424859837.db2.gz	UGQXRRIWGVWDAN-SFHVURJKSA-N	0	3	300.402	2.136	10	0		DEAEHN
Cc1nc(NCCN2CC=C(C)CC2)cc(C(F)(F)F)n1	ZINC000546581330	424865012	/nfs/dbraw/zinc/86/50/12/424865012.db2.gz	PTHLPZORWYMQPL-UHFFFAOYSA-N	0	3	300.328	2.868	10	0		DEAEHN
CC(C)O[C@H]1CCCN(C[C@H](O)COCc2ccccc2)C1	ZINC000404487758	424928087	/nfs/dbraw/zinc/92/80/87/424928087.db2.gz	ODNDTBIJZYEMJO-ROUUACIJSA-N	0	3	307.434	2.454	10	0		DEAEHN
O[C@@H]1C[C@H]2CN(Cc3cccc(Cl)c3Cl)CCN2C1	ZINC000405239587	424930467	/nfs/dbraw/zinc/93/04/67/424930467.db2.gz	AIKCFTXALXDIRP-NWDGAFQWSA-N	0	3	301.217	2.244	10	0		DEAEHN
Cc1ccsc1CNC(=O)CN(C)[C@@]1(CO)CC[C@@H](C)C1	ZINC000249564556	424887787	/nfs/dbraw/zinc/88/77/87/424887787.db2.gz	MSGDHNHHYRWZFN-WBMJQRKESA-N	0	3	310.463	2.156	10	0		DEAEHN
CN(CCN1CCCC1)C(=O)Nc1cc(C2(C)CCCC2)on1	ZINC000563345276	424897989	/nfs/dbraw/zinc/89/79/89/424897989.db2.gz	QMQAHNUHMWXOPP-UHFFFAOYSA-N	0	3	320.437	3.066	10	0		DEAEHN
CN1CCC(CNC(=O)CCC(=O)c2ccc(F)c(F)c2)CC1	ZINC000087238840	267393848	/nfs/dbraw/zinc/39/38/48/267393848.db2.gz	SJGCRNWDJBKDJP-UHFFFAOYSA-N	0	3	324.371	2.386	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)Nc3cc(C)on3)cc2)CC1	ZINC000175070976	267514160	/nfs/dbraw/zinc/51/41/60/267514160.db2.gz	VOYKLXIFULQTNS-UHFFFAOYSA-N	0	3	314.389	2.377	10	0		DEAEHN
Cc1oc(Br)cc1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000396751503	269104163	/nfs/dbraw/zinc/10/41/63/269104163.db2.gz	SZEDCMDLGGHRLN-SNVBAGLBSA-N	0	3	313.195	2.271	10	0		DEAEHN
CC(C)[C@@H](C)C(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000397637035	269106492	/nfs/dbraw/zinc/10/64/92/269106492.db2.gz	QNAGKNSBMOBPGR-MRXNPFEDSA-N	0	3	318.461	2.422	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1N[C@@H]1CCCn2ncnc21	ZINC000247153859	274355635	/nfs/dbraw/zinc/35/56/35/274355635.db2.gz	RROUWWHHGHNCRJ-DJIMGWMZSA-N	0	3	311.433	2.223	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)Nc1cc(F)ccc1F	ZINC000175343620	276182763	/nfs/dbraw/zinc/18/27/63/276182763.db2.gz	GEXOTZNUIYDQGI-ZDUSSCGKSA-N	0	3	311.376	2.319	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000246717350	276368996	/nfs/dbraw/zinc/36/89/96/276368996.db2.gz	NZAYJQGOPYQXHN-LSDHHAIUSA-N	0	3	309.454	2.262	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@@]23CCc2ccccc23)n1	ZINC000263221638	277116516	/nfs/dbraw/zinc/11/65/16/277116516.db2.gz	LXSXRUDPQYCDAJ-HDMKZQKVSA-N	0	3	310.401	2.017	10	0		DEAEHN
CN1CC[C@H](NC(=O)[C@H]2CCCc3n[nH]cc32)[C@H]1c1ccccc1	ZINC000248045301	277168796	/nfs/dbraw/zinc/16/87/96/277168796.db2.gz	MVDGVHWKKSTESJ-JCGIZDLHSA-N	0	3	324.428	2.391	10	0		DEAEHN
CC(C)(CNC(=O)N1CC[C@H]2OCCC[C@H]2C1)N1CCCCC1	ZINC000132807939	277300850	/nfs/dbraw/zinc/30/08/50/277300850.db2.gz	RVHVAIIUTSRLRR-JKSUJKDBSA-N	0	3	323.481	2.461	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)N[C@@H]2CCCC(F)(F)C2)CN1C1CC1	ZINC000495063357	278021438	/nfs/dbraw/zinc/02/14/38/278021438.db2.gz	WVYBTVNWOSQGBP-UTUOFQBUSA-N	0	3	301.381	2.489	10	0		DEAEHN
CC(=O)N1CC[C@@H](N[C@@H]2CNCCC2(F)F)c2ccccc2C1	ZINC000423481288	278052540	/nfs/dbraw/zinc/05/25/40/278052540.db2.gz	NZELBEIEUOTMPC-HZPDHXFCSA-N	0	3	323.387	2.067	10	0		DEAEHN
C[C@H](CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O)CS(C)(=O)=O	ZINC000368269124	278188954	/nfs/dbraw/zinc/18/89/54/278188954.db2.gz	FDWBLXGISSKIAZ-QXSJWSMHSA-N	0	3	317.495	2.073	10	0		DEAEHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)[C@H]1CCCc2n[nH]cc21	ZINC000246641207	278189871	/nfs/dbraw/zinc/18/98/71/278189871.db2.gz	ULTAHWAQDVDHET-MCIONIFRSA-N	0	3	304.438	2.066	10	0		DEAEHN
Cc1cnn([C@H]2CCCN(C[C@H]3CC4(CCC4)C(=O)O3)C2)c1	ZINC000248894754	279035240	/nfs/dbraw/zinc/03/52/40/279035240.db2.gz	TUVUVKUGGOHVBU-LSDHHAIUSA-N	0	3	303.406	2.314	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCC[C@@H]1Cn1ccnc1	ZINC000177413153	279123876	/nfs/dbraw/zinc/12/38/76/279123876.db2.gz	ZQJAFDAVLVCHLC-HZPDHXFCSA-N	0	3	321.469	2.033	10	0		DEAEHN
O=C1[C@@H](N2CCN3CCC[C@@H]3C2)CCCN1c1cccc(F)c1	ZINC000172290275	280313849	/nfs/dbraw/zinc/31/38/49/280313849.db2.gz	OEGINSPNMGSFHZ-SJORKVTESA-N	0	3	317.408	2.101	10	0		DEAEHN
CCc1cnc(CCNC(=O)N[C@H](C)CN2CCCCC2)s1	ZINC000073664322	281545128	/nfs/dbraw/zinc/54/51/28/281545128.db2.gz	SXFKERCHTUXGSW-CYBMUJFWSA-N	0	3	324.494	2.422	10	0		DEAEHN
COc1cccc(CNC(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000079122044	281586838	/nfs/dbraw/zinc/58/68/38/281586838.db2.gz	QYSVYFRUOGNEKZ-HNNXBMFYSA-N	0	3	307.438	2.471	10	0		DEAEHN
CCC(C)(C)NC(=O)[C@@H](C)N1CCC[C@H]1Cn1ccnc1C	ZINC000246915093	282000271	/nfs/dbraw/zinc/00/02/71/282000271.db2.gz	GFYKTKVHSZTWRA-HIFRSBDPSA-N	0	3	306.454	2.349	10	0		DEAEHN
C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000471902388	289004433	/nfs/dbraw/zinc/00/44/33/289004433.db2.gz	YUHDLSACIYXIJP-CKYFFXLPSA-N	0	3	305.344	2.205	10	0		DEAEHN
C[C@H](C(=O)NC(=O)NC1CC1)N1CCC[C@@]2(CC=CCC2)C1	ZINC000114493974	289331730	/nfs/dbraw/zinc/33/17/30/289331730.db2.gz	NPMPMWKOXITLPO-DYVFJYSZSA-N	0	3	305.422	2.185	10	0		DEAEHN
CN1CCN(C(=O)[C@@H]2CCCc3[nH]ncc32)[C@H](c2ccccc2)C1	ZINC000132614043	290020939	/nfs/dbraw/zinc/02/09/39/290020939.db2.gz	VPZVMNLJLSFUGT-QAPCUYQASA-N	0	3	324.428	2.345	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCC(F)(F)F)[C@H]1c1ccccc1	ZINC000245704088	290139539	/nfs/dbraw/zinc/13/95/39/290139539.db2.gz	ZYYLYNZRXBDYOB-VXGBXAGGSA-N	0	3	301.312	2.293	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H](C[NH3+])CC(C)C)c(Cl)cc1F	ZINC000236624514	301398408	/nfs/dbraw/zinc/39/84/08/301398408.db2.gz	KVFNTXRHDGRSJQ-SNVBAGLBSA-N	0	3	322.833	2.439	10	0		DEAEHN
C[C@H](N[C@@H]1CCC(=O)N(C)C1)c1ccc(Br)cn1	ZINC000576522200	326299722	/nfs/dbraw/zinc/29/97/22/326299722.db2.gz	ZJINVSOUQMDPLA-GXSJLCMTSA-N	0	3	312.211	2.116	10	0		DEAEHN
C[C@@H](NC(=O)Nc1nncs1)[C@H](c1ccccc1)N(C)C	ZINC000185941389	332274990	/nfs/dbraw/zinc/27/49/90/332274990.db2.gz	BNKOWGYJZCOASR-ZYHUDNBSSA-N	0	3	305.407	2.351	10	0		DEAEHN
CCN(CC(=O)Nc1ccc2c(c1)OCCO2)C[C@H](C)COC	ZINC000189544957	333103120	/nfs/dbraw/zinc/10/31/20/333103120.db2.gz	YTPUYUWYRBJHND-ZDUSSCGKSA-N	0	3	322.405	2.001	10	0		DEAEHN
Cc1nc(CC(C)C)oc1C(=O)N1CC[C@H](N2CCCC2)C1	ZINC000190270614	336262021	/nfs/dbraw/zinc/26/20/21/336262021.db2.gz	MGOVYZWQUCZJIG-AWEZNQCLSA-N	0	3	305.422	2.492	10	0		DEAEHN
Cc1ccc(-n2cccn2)cc1NC(=O)N1CCCN(C)CC1	ZINC000191274581	534240127	/nfs/dbraw/zinc/24/01/27/534240127.db2.gz	HTBZVNCQIFRZSB-UHFFFAOYSA-N	0	3	313.405	2.350	10	0		DEAEHN
CCCc1cc(NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)n(C)n1	ZINC000246390909	521372474	/nfs/dbraw/zinc/37/24/74/521372474.db2.gz	KXAQISZNWICVFF-GXTWGEPZSA-N	0	3	307.442	2.319	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H](C)Cc2c(C)noc2C)C1	ZINC000157384832	521621524	/nfs/dbraw/zinc/62/15/24/521621524.db2.gz	ZNJKXQOPSYAUFR-SMDDNHRTSA-N	0	3	308.426	2.006	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](COC)c2ccc(C)o2)C1	ZINC000245426914	521645954	/nfs/dbraw/zinc/64/59/54/521645954.db2.gz	GRMUDMKGIXDGEZ-UONOGXRCSA-N	0	3	309.410	2.059	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@H](C)NC(=O)CC2CCCCC2)C1	ZINC000249866784	521647229	/nfs/dbraw/zinc/64/72/29/521647229.db2.gz	IDTMJJLBBUEYRK-HOCLYGCPSA-N	0	3	323.481	2.062	10	0		DEAEHN
CN(C)CCN(Cc1cccs1)C(=O)CCc1ccnn1C	ZINC000128862316	521752169	/nfs/dbraw/zinc/75/21/69/521752169.db2.gz	DFMDRMDSEUEQEV-UHFFFAOYSA-N	0	3	320.462	2.005	10	0		DEAEHN
COC1CCC(N[C@H](c2nccn2C)C2CCOCC2)CC1	ZINC000336912326	522692344	/nfs/dbraw/zinc/69/23/44/522692344.db2.gz	JFTTYPATLZLNLW-GPANFISMSA-N	0	3	307.438	2.435	10	0		DEAEHN
COCCN1CCC[C@@H]1CN[C@H](C)c1ccc(OC)cc1OC	ZINC000163420873	523829717	/nfs/dbraw/zinc/82/97/17/523829717.db2.gz	UJRWBTRGDKFIAA-HUUCEWRRSA-N	0	3	322.449	2.465	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(C)C1CCC(C)CC1	ZINC000111865831	523831417	/nfs/dbraw/zinc/83/14/17/523831417.db2.gz	NMTCFVFXPSNUFQ-GPANFISMSA-N	0	3	311.470	2.317	10	0		DEAEHN
COc1ccc(CN2CCC[C@@H](Cn3cncn3)C2)c(OC)c1	ZINC000128445555	524028154	/nfs/dbraw/zinc/02/81/54/524028154.db2.gz	JTGIYFADLADUBV-CQSZACIVSA-N	0	3	316.405	2.208	10	0		DEAEHN
COCCOc1ccc(CN2CC[C@@H](c3cnn(C)c3)C2)cc1	ZINC000128526003	524044274	/nfs/dbraw/zinc/04/42/74/524044274.db2.gz	LEZNDQOIBYGPNH-MRXNPFEDSA-N	0	3	315.417	2.435	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(Br)cc1	ZINC000450663233	534789561	/nfs/dbraw/zinc/78/95/61/534789561.db2.gz	RONPLPQGVDDKLP-RNCFNFMXSA-N	0	3	300.196	2.440	10	0		DEAEHN
COc1ccccc1OCCN1CCC[C@@H](Cn2cncn2)C1	ZINC000105884350	524675090	/nfs/dbraw/zinc/67/50/90/524675090.db2.gz	UOGWGNYVWNUIAS-OAHLLOKOSA-N	0	3	316.405	2.078	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)CSCc2ccncc2)CCN1C	ZINC000127503989	525245178	/nfs/dbraw/zinc/24/51/78/525245178.db2.gz	YZHTWVFGSRGBKW-HIFRSBDPSA-N	0	3	307.463	2.256	10	0		DEAEHN
Cc1ccnc(C2CCN(C(=O)[C@H](C(C)C)N(C)C)CC2)n1	ZINC000363819179	525641513	/nfs/dbraw/zinc/64/15/13/525641513.db2.gz	HGBZOIBDRWOTBM-HNNXBMFYSA-N	0	3	304.438	2.077	10	0		DEAEHN
Cc1nc(CN2CCN(C[C@H](C)Cc3ccccc3)CC2)no1	ZINC000132334030	526866171	/nfs/dbraw/zinc/86/61/71/526866171.db2.gz	OOULFTBMDIGMJN-OAHLLOKOSA-N	0	3	314.433	2.374	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)N1C[C@@H]2CCCC[C@@H]2C1	ZINC000262587012	535042823	/nfs/dbraw/zinc/04/28/23/535042823.db2.gz	ZVLUSPSITUUGJE-CGSPGFDNSA-N	0	3	306.450	2.168	10	0		DEAEHN
CCCCn1cc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c(C)n1	ZINC000248571894	535141274	/nfs/dbraw/zinc/14/12/74/535141274.db2.gz	MPKLHNZKYIKBON-HIFRSBDPSA-N	0	3	304.438	2.300	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)Nc1cccc(Cn2cncn2)c1	ZINC000261626147	535297234	/nfs/dbraw/zinc/29/72/34/535297234.db2.gz	COGZLPYIMPJXOD-OAHLLOKOSA-N	0	3	313.405	2.043	10	0		DEAEHN
CC[NH+]1CCC(CCNC(=O)Cc2ccc([O-])c(F)c2)CC1	ZINC000449947678	535446654	/nfs/dbraw/zinc/44/66/54/535446654.db2.gz	IIISLZGROQDKJL-UHFFFAOYSA-N	0	3	308.397	2.312	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)CN(CC)CC)[C@@H]1Oc1ccccc1	ZINC000251665868	535462122	/nfs/dbraw/zinc/46/21/22/535462122.db2.gz	LJKQOYKOZGJYBD-JZXOWHBKSA-N	0	3	320.433	2.069	10	0		DEAEHN
CCCc1nc(C)c(-c2nc([C@H]3CNCCN3C)no2)s1	ZINC000263218320	535485682	/nfs/dbraw/zinc/48/56/82/535485682.db2.gz	LIGPWFOKGHXJSY-SNVBAGLBSA-N	0	3	307.423	2.030	10	0		DEAEHN
CCOC(=O)C[C@H]1C[C@H](OC)CN1Cc1cccc2c1NCC2	ZINC000261928382	535745967	/nfs/dbraw/zinc/74/59/67/535745967.db2.gz	LFPSXPZQGRSACG-CVEARBPZSA-N	0	3	318.417	2.197	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2ncc(-c3cccc(F)c3)o2)CCO1	ZINC000175205433	535947762	/nfs/dbraw/zinc/94/77/62/535947762.db2.gz	BKUVRQXBMKWUAF-OAHLLOKOSA-N	0	3	319.380	2.243	10	0		DEAEHN
CN1CCC[C@H](CCNC(=O)C(=O)c2ccc3c(c2)CCC3)C1	ZINC000458164626	536382554	/nfs/dbraw/zinc/38/25/54/536382554.db2.gz	KJGYVGBMZCRKRQ-CQSZACIVSA-N	0	3	314.429	2.206	10	0		DEAEHN
COc1ccc(/C(C)=C/C(=O)N2CCN3CCC2CC3)cc1	ZINC000188657881	536560001	/nfs/dbraw/zinc/56/00/01/536560001.db2.gz	HDQCJQUBJUIHMP-BUHFOSPRSA-N	0	3	300.402	2.405	10	0		DEAEHN
COc1ccc(F)cc1[C@@H](C)NCC1CCS(=O)(=O)CC1	ZINC000358353966	536633641	/nfs/dbraw/zinc/63/36/41/536633641.db2.gz	LGIJVFHAPSARQI-LLVKDONJSA-N	0	3	315.410	2.310	10	0		DEAEHN
CO[C@@H]1CN([C@@H](C)C(=O)N(C)Cc2ccccc2)CC[C@@H]1C	ZINC000252059676	536737572	/nfs/dbraw/zinc/73/75/72/536737572.db2.gz	ZQLJPTHFNGKEGJ-YQQAZPJKSA-N	0	3	304.434	2.390	10	0		DEAEHN
CO[C@H]1CC[C@@H](NC(=O)N[C@@H](CC(C)C)CN2CCCC2)C1	ZINC000454838628	536761009	/nfs/dbraw/zinc/76/10/09/536761009.db2.gz	BKPMMKIACQMIEL-PMPSAXMXSA-N	0	3	311.470	2.364	10	0		DEAEHN
COc1ccc(CN[C@@H]2CCC[C@H]2[C@H]2COCCN2)c(F)c1	ZINC000261933506	536897466	/nfs/dbraw/zinc/89/74/66/536897466.db2.gz	LZVLFZCQKRHUGS-DJIMGWMZSA-N	0	3	308.397	2.081	10	0		DEAEHN
CC(C)(C)OC(=O)NC[C@@H]1CCC[C@]2(C1)NCCc1nc[nH]c12	ZINC000724101893	563496470	/nfs/dbraw/zinc/49/64/70/563496470.db2.gz	RVRZWRHKXSIWJF-SJKOYZFVSA-N	0	3	320.437	2.466	10	0		DEAEHN
CCC[C@@H](N)C(=O)N(Cc1ccccc1)C[C@@H](O)c1ccco1	ZINC000236900818	625411620	/nfs/dbraw/zinc/41/16/20/625411620.db2.gz	JHEJZZWONBURBW-HZPDHXFCSA-N	0	3	316.401	2.469	10	0		DEAEHN
Cc1nc(N)sc1C(=O)N[C@@H](C)CN(C)Cc1ccccc1	ZINC000309694054	625600398	/nfs/dbraw/zinc/60/03/98/625600398.db2.gz	DRAQEDDHVMJNPT-NSHDSACASA-N	0	3	318.446	2.284	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)S(=O)(=O)/C=C\c2ccccc2)CCN1C	ZINC000255677078	625613850	/nfs/dbraw/zinc/61/38/50/625613850.db2.gz	XJRFVWBOBRTAOG-MITIMNCUSA-N	0	3	308.447	2.402	10	0		DEAEHN
C/C=C(\C)C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000176064582	624606265	/nfs/dbraw/zinc/60/62/65/624606265.db2.gz	UHYPDPQRMOLMEU-LZWSPWQCSA-N	0	3	315.417	2.417	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)Nc1ccc(OCc2nc(C)no2)cc1	ZINC000237015290	636245186	/nfs/dbraw/zinc/24/51/86/636245186.db2.gz	KNSPRKIGQBDRTP-MEBBXXQBSA-N	0	3	318.377	2.269	10	0		DEAEHN
COC(=O)/C(C)=C\CN1CCN(Cc2ccccc2C)CC1	ZINC000746494702	638349033	/nfs/dbraw/zinc/34/90/33/638349033.db2.gz	SAYIJNWAWRLUQN-PXNMLYILSA-N	0	3	302.418	2.232	10	0		DEAEHN
COC(=O)C[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000151464442	646385605	/nfs/dbraw/zinc/38/56/05/646385605.db2.gz	PURFPBDKMOZUHK-UKRRQHHQSA-N	0	3	305.374	2.003	10	0		DEAEHN
CCOC1CCN(Cn2cnc3c2ncnc3NC(C)C)CC1	ZINC000170902696	646674289	/nfs/dbraw/zinc/67/42/89/646674289.db2.gz	BWAPVVOUMUWPHJ-UHFFFAOYSA-N	0	3	318.425	2.105	10	0		DEAEHN
CCCN(CCN(C)C)C(=O)c1cc(Cl)nc(N(C)C)c1	ZINC000733150408	647893725	/nfs/dbraw/zinc/89/37/25/647893725.db2.gz	JDWWIOVFTNVQQM-UHFFFAOYSA-N	0	3	312.845	2.215	10	0		DEAEHN
COC(=O)CCNC(=O)CN[C@@H](C)c1ccc(C(C)(C)C)cc1	ZINC000154370662	647995336	/nfs/dbraw/zinc/99/53/36/647995336.db2.gz	PNJSJKMHZVNWGX-ZDUSSCGKSA-N	0	3	320.433	2.314	10	0		DEAEHN
O=C(C[C@H]1COC(=O)C1)O[C@H]1CCCN(Cc2ccccc2)C1	ZINC000183167832	649045070	/nfs/dbraw/zinc/04/50/70/649045070.db2.gz	ANPWNIZDCKQKBH-HOTGVXAUSA-N	0	3	317.385	2.147	10	0		DEAEHN
c1ncn(Cc2ccc(CN[C@H]3CCCc4n[nH]cc43)cc2)n1	ZINC000353440684	685344238	/nfs/dbraw/zinc/34/42/38/685344238.db2.gz	ZYJROVWGMMOFNE-INIZCTEOSA-N	0	3	308.389	2.217	10	0		DEAEHN
CCON1CCC(NCc2ccn(Cc3ccccc3)n2)CC1	ZINC000389940354	685436880	/nfs/dbraw/zinc/43/68/80/685436880.db2.gz	MEXSMVRCJSNNQY-UHFFFAOYSA-N	0	3	314.433	2.437	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)N(C)Cc1ccc(Br)o1	ZINC000037819843	683884939	/nfs/dbraw/zinc/88/49/39/683884939.db2.gz	YVMRGZXCMJLNRB-GZMMTYOYSA-N	0	3	303.200	2.374	10	0		DEAEHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCOC[C@@H]2C)cc1	ZINC000192518214	684451204	/nfs/dbraw/zinc/45/12/04/684451204.db2.gz	RQXRJRHXXIYLQV-NILFDRSVSA-N	0	3	316.357	2.015	10	0		DEAEHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@H]2CCOC[C@@H]2C)c1	ZINC000192509491	684451459	/nfs/dbraw/zinc/45/14/59/684451459.db2.gz	LFJSHDBHSPDWLD-TUKIKUTGSA-N	0	3	316.357	2.015	10	0		DEAEHN
CC(C)(C)OC(=O)[C@H]1CCN(C[C@H]2CC3(CCC3)C(=O)O2)C1	ZINC000248831729	685168959	/nfs/dbraw/zinc/16/89/59/685168959.db2.gz	ILAXHIZZXSOEIN-QWHCGFSZSA-N	0	3	309.406	2.136	10	0		DEAEHN
COc1ccc(C[N@@H+]2CC[C@H](c3cc(=O)[n-]c(N)n3)C2)cc1C	ZINC000931031728	694298211	/nfs/dbraw/zinc/29/82/11/694298211.db2.gz	DDFYMLZRANVMRC-ZDUSSCGKSA-N	0	3	314.389	2.071	10	0		DEAEHN
COc1ccc(C[N@H+]2CC[C@H](c3cc(=O)[n-]c(N)n3)C2)cc1C	ZINC000931031728	694298216	/nfs/dbraw/zinc/29/82/16/694298216.db2.gz	DDFYMLZRANVMRC-ZDUSSCGKSA-N	0	3	314.389	2.071	10	0		DEAEHN
C[C@@](O)(CN1CC[C@@]2(CCOC2)C1)C(F)(F)C(F)(F)F	ZINC000724109850	777242234	/nfs/dbraw/zinc/24/22/34/777242234.db2.gz	PQPRKSLQWITOLJ-NXEZZACHSA-N	0	3	303.271	2.047	10	0		DEAEHN
CSCc1ccc(CNCC(C)(C)S(C)(=O)=O)cc1	ZINC000725120100	777590323	/nfs/dbraw/zinc/59/03/23/777590323.db2.gz	FVNYKTURNDKPLM-UHFFFAOYSA-N	0	3	301.477	2.462	10	0		DEAEHN
CC1(C)C[NH2+]C[C@H]1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000721888492	781564361	/nfs/dbraw/zinc/56/43/61/781564361.db2.gz	NVMQRCGUSPDVRG-SNVBAGLBSA-N	0	3	323.245	2.270	10	0		DEAEHN
Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)N(C)CC1CC(O)C1	ZINC000190201262	786182274	/nfs/dbraw/zinc/18/22/74/786182274.db2.gz	RGOVKSRPAKZHJT-WXLSXGNJSA-N	0	3	304.434	2.263	10	0		DEAEHN
Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)N(C)CC1CC(O)C1	ZINC000190201278	786182407	/nfs/dbraw/zinc/18/24/07/786182407.db2.gz	RGOVKSRPAKZHJT-QRNKSROTSA-N	0	3	304.434	2.263	10	0		DEAEHN
CN1C[C@@H](CCNCc2ccc(Br)o2)CC1=O	ZINC000723551988	787344386	/nfs/dbraw/zinc/34/43/86/787344386.db2.gz	KDZAJOHNLQXUSI-VIFPVBQESA-N	0	3	301.184	2.000	10	0		DEAEHN
Cc1cc(C)c(S(=O)(=O)N2CCNCCC2(C)C)s1	ZINC000712507129	792192155	/nfs/dbraw/zinc/19/21/55/792192155.db2.gz	QBWZCRPVDILKRT-UHFFFAOYSA-N	0	3	302.465	2.128	10	0		DEAEHN
COc1ccc(CNCC[C@@H]2CCCS2(=O)=O)cc1Cl	ZINC000714367806	792311269	/nfs/dbraw/zinc/31/12/69/792311269.db2.gz	VSJTXGPEMFPXRS-LBPRGKRZSA-N	0	3	317.838	2.406	10	0		DEAEHN
C[C@H](NCC1CC(NC(=O)OC(C)(C)C)C1)c1nccn1C	ZINC000715068022	792379799	/nfs/dbraw/zinc/37/97/99/792379799.db2.gz	RIGIFSUZKAHKCS-HIFPTAJRSA-N	0	3	308.426	2.374	10	0		DEAEHN
CS(=O)(=O)C1CC(NCc2ccc(Br)s2)C1	ZINC000716074481	792556240	/nfs/dbraw/zinc/55/62/40/792556240.db2.gz	BSUCHDMBIWGOMJ-UHFFFAOYSA-N	0	3	324.265	2.176	10	0		DEAEHN
c1ccc(-c2ncc(CNCCOC[C@@H]3CCOC3)cn2)cc1	ZINC000068993965	1082130154	/nfs/dbraw/zinc/13/01/54/1082130154.db2.gz	LQDDKZRQLYCVGJ-OAHLLOKOSA-N	0	3	313.401	2.286	10	0		DEAEHN
CN1CCC[C@@H]2[C@H]1CCN2C(=O)c1cncc(Br)c1	ZINC000720819099	1086168915	/nfs/dbraw/zinc/16/89/15/1086168915.db2.gz	YHHUWJOIPWKRBH-CHWSQXEVSA-N	0	3	324.222	2.153	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CCC2(CCCC2)C1	ZINC000702392346	1086427419	/nfs/dbraw/zinc/42/74/19/1086427419.db2.gz	SWFQTIUSDFDHMT-KRWDZBQOSA-N	0	3	315.461	2.238	10	0		DEAEHN
COC[C@H](C)OC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000704489275	1086582865	/nfs/dbraw/zinc/58/28/65/1086582865.db2.gz	NTTVFGMLKUSEAT-GOEBONIOSA-N	0	3	306.406	2.364	10	0		DEAEHN
c1ccc(SCC[NH+]2CCC(Cc3nnn[n-]3)CC2)cc1	ZINC000095107387	1138226895	/nfs/dbraw/zinc/22/68/95/1138226895.db2.gz	SMAGRMPQXBHZEG-UHFFFAOYSA-N	0	3	303.435	2.247	10	0		DEAEHN
c1ccc(SCC[NH+]2CCC(Cc3nn[n-]n3)CC2)cc1	ZINC000095107387	1138226901	/nfs/dbraw/zinc/22/69/01/1138226901.db2.gz	SMAGRMPQXBHZEG-UHFFFAOYSA-N	0	3	303.435	2.247	10	0		DEAEHN
CCN[C@H]1c2ccccc2C[C@@H]1Sc1nnnn1C1CC1	ZINC000081867477	192332856	/nfs/dbraw/zinc/33/28/56/192332856.db2.gz	LTVWNGOHKDGIMG-KBPBESRZSA-N	0	3	301.419	2.376	10	0		DEAEHN
Cn1cc(SC[C@H](N)c2ccc3c(c2)OCCCO3)cn1	ZINC000081893135	192334148	/nfs/dbraw/zinc/33/41/48/192334148.db2.gz	IOBLUQAKZPTAIA-ZDUSSCGKSA-N	0	3	305.403	2.374	10	0		DEAEHN
c1c(C2CC2)[nH]nc1N1CCN(CC[C@H]2CCCCO2)CC1	ZINC000426773482	230816676	/nfs/dbraw/zinc/81/66/76/230816676.db2.gz	JWKUQSSPHBKTTL-OAHLLOKOSA-N	0	3	304.438	2.368	10	0		DEAEHN
CC[C@@H](N)[C@@H](C)S(=O)(=O)c1ccc(Br)cc1	ZINC000081933356	192341679	/nfs/dbraw/zinc/34/16/79/192341679.db2.gz	MOVUGOIGTAQIDA-LDYMZIIASA-N	0	3	306.225	2.349	10	0		DEAEHN
Cc1nn(C)c(Sc2ccc(Br)cn2)c1CN	ZINC000079445557	185171965	/nfs/dbraw/zinc/17/19/65/185171965.db2.gz	UHIWTNMCOUBNQJ-UHFFFAOYSA-N	0	3	313.224	2.496	10	0		DEAEHN
CCCN[C@H]1c2ccccc2CC[C@@H]1S(=O)(=O)CCOC	ZINC000081944544	192345474	/nfs/dbraw/zinc/34/54/74/192345474.db2.gz	URKPGMHITAUUHX-HOTGVXAUSA-N	0	3	311.447	2.103	10	0		DEAEHN
CCN[C@@H](CS(=O)(=O)CCOC)c1c(C)cc(C)cc1C	ZINC000081944438	192346025	/nfs/dbraw/zinc/34/60/25/192346025.db2.gz	ZTSYKOXDNDGGPU-HNNXBMFYSA-N	0	3	313.463	2.324	10	0		DEAEHN
CS(=O)(=O)CCC[C@H](N)c1cc(Br)cs1	ZINC000082720533	185196282	/nfs/dbraw/zinc/19/62/82/185196282.db2.gz	PXACEMULHNWJMX-QMMMGPOBSA-N	0	3	312.254	2.335	10	0		DEAEHN
NC[C@H](NC[C@@H]1CCCO1)c1cc(Br)ccc1F	ZINC000087928555	185237795	/nfs/dbraw/zinc/23/77/95/185237795.db2.gz	UVPYHUGRURNESN-GWCFXTLKSA-N	0	3	317.202	2.357	10	0		DEAEHN
COCCN1C(=O)CC[C@@H](N)[C@H]1c1ccc(Cl)cc1F	ZINC000165614870	197678165	/nfs/dbraw/zinc/67/81/65/197678165.db2.gz	QNQQNZMNTPPCAW-TZMCWYRMSA-N	0	3	300.761	2.116	10	0		DEAEHN
CN(C)c1nc(Cl)nc(NC2C[C@H]3CCC[C@@H](C2)N3C)n1	ZINC000088165086	185241065	/nfs/dbraw/zinc/24/10/65/185241065.db2.gz	OOKPPTDSVCBVQK-FGWVZKOKSA-N	0	3	310.833	2.018	10	0		DEAEHN
CN[C@@H]1CCCN(c2cc(OC)ccc2Br)C1=O	ZINC000088330709	185245940	/nfs/dbraw/zinc/24/59/40/185245940.db2.gz	ADVWEUCDHFBERY-LLVKDONJSA-N	0	3	313.195	2.173	10	0		DEAEHN
CCN(CC)CC(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1	ZINC000088250380	185243656	/nfs/dbraw/zinc/24/36/56/185243656.db2.gz	IMGLKZYSRNKDAA-GFCCVEGCSA-N	0	3	311.376	2.002	10	0		DEAEHN
NCc1ccccc1S(=O)(=O)N1CCC[C@H](C(F)(F)F)C1	ZINC000088419188	185249438	/nfs/dbraw/zinc/24/94/38/185249438.db2.gz	VKYNFZLQNDYAAA-NSHDSACASA-N	0	3	322.352	2.108	10	0		DEAEHN
CN[C@](C)(CCCN1CCC(C(F)(F)F)CC1)C(=O)OC	ZINC000088435521	185250518	/nfs/dbraw/zinc/25/05/18/185250518.db2.gz	YUSIWYZKKUNAEN-CYBMUJFWSA-N	0	3	310.360	2.192	10	0		DEAEHN
C[C@@H]1CCC[C@](N)(C(=O)Nc2cnc(Br)cn2)C1	ZINC000088446382	185251278	/nfs/dbraw/zinc/25/12/78/185251278.db2.gz	VAJOOEOHERGNSX-PRHODGIISA-N	0	3	313.199	2.085	10	0		DEAEHN
CCCN(CC)S(=O)(=O)c1ccc(CNCC(C)C)o1	ZINC000088543669	185256931	/nfs/dbraw/zinc/25/69/31/185256931.db2.gz	KKHZPRXFSNHJCM-UHFFFAOYSA-N	0	3	302.440	2.446	10	0		DEAEHN
CC(C)CC[C@H](C)NCc1ccc(S(=O)(=O)N(C)C)o1	ZINC000088539912	185255535	/nfs/dbraw/zinc/25/55/35/185255535.db2.gz	CUARBTXXVYDKPM-LBPRGKRZSA-N	0	3	302.440	2.444	10	0		DEAEHN
N[C@@H]1CCC[C@H]1S(=O)(=O)c1cccc(Br)c1	ZINC000081982906	192348922	/nfs/dbraw/zinc/34/89/22/192348922.db2.gz	MALSJWIGRFPKLF-GHMZBOCLSA-N	0	3	304.209	2.103	10	0		DEAEHN
CCN[C@H](Cc1ncnn1C)c1ccccc1Br	ZINC000088581940	185258458	/nfs/dbraw/zinc/25/84/58/185258458.db2.gz	LWJWKWTURLNKTH-GFCCVEGCSA-N	0	3	309.211	2.471	10	0		DEAEHN
COCCNCCc1nnc([C@H](OC)c2ccccc2)s1	ZINC000088824154	185266574	/nfs/dbraw/zinc/26/65/74/185266574.db2.gz	JJWQNULVKVUNLQ-CQSZACIVSA-N	0	3	307.419	2.052	10	0		DEAEHN
CCCN[C@H]1CCOC[C@@H]1S(=O)(=O)c1cccc(Cl)c1	ZINC000081982180	192349659	/nfs/dbraw/zinc/34/96/59/192349659.db2.gz	XPTQWDBTHQVZHO-KBPBESRZSA-N	0	3	317.838	2.271	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1cc(Cl)ccc1C	ZINC000090293341	185289854	/nfs/dbraw/zinc/28/98/54/185289854.db2.gz	MCZUUGBXPHONAY-UHFFFAOYSA-N	0	3	302.827	2.021	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000090293291	185290009	/nfs/dbraw/zinc/29/00/09/185290009.db2.gz	MIWAORVUUXFMMJ-UHFFFAOYSA-N	0	3	323.245	2.366	10	0		DEAEHN
N[C@H]1COC[C@H]1c1nc(Cc2ccc(Cl)cc2Cl)no1	ZINC000090364352	185292707	/nfs/dbraw/zinc/29/27/07/185292707.db2.gz	JGNJKGUCKPJVHU-KOLCDFICSA-N	0	3	314.172	2.408	10	0		DEAEHN
CN(Cc1ccccc1Br)[C@H](CN)c1cncn1C	ZINC000090167506	185284537	/nfs/dbraw/zinc/28/45/37/185284537.db2.gz	BYQZYLJCYIZCPG-CYBMUJFWSA-N	0	3	323.238	2.314	10	0		DEAEHN
Cc1cc(Cl)c(NC(=O)[C@@H]2COC[C@@H]2N)c2cccnc12	ZINC000090379768	185293702	/nfs/dbraw/zinc/29/37/02/185293702.db2.gz	MMTFFXUEVJXRQZ-PWSUYJOCSA-N	0	3	305.765	2.109	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1c(Cl)ccc(C)c1Cl	ZINC000090431447	185295926	/nfs/dbraw/zinc/29/59/26/185295926.db2.gz	GATUYKIZHZQVSK-WCBMZHEXSA-N	0	3	303.189	2.475	10	0		DEAEHN
Cc1cc(Br)ccc1NC(=O)[C@]1(C)COC[C@H]1N	ZINC000090580358	185304813	/nfs/dbraw/zinc/30/48/13/185304813.db2.gz	SUWDLYOSKDVZDN-DGCLKSJQSA-N	0	3	313.195	2.060	10	0		DEAEHN
CN(C)C[C@H]1CSCCCN1C(=O)c1cccc(N(C)C)c1	ZINC000090700135	185310418	/nfs/dbraw/zinc/31/04/18/185310418.db2.gz	ZISVBQJQWZTTAJ-INIZCTEOSA-N	0	3	321.490	2.262	10	0		DEAEHN
COC(=O)c1cc(NC(=O)CNC(C)(C)C)c(F)cc1F	ZINC000092460738	185320305	/nfs/dbraw/zinc/32/03/05/185320305.db2.gz	CDKCGADIOPFJPC-UHFFFAOYSA-N	0	3	300.305	2.078	10	0		DEAEHN
CCNc1ccc(Cl)c(C(=O)N(C)C[C@H]2CCCN2C)n1	ZINC000092674218	185332872	/nfs/dbraw/zinc/33/28/72/185332872.db2.gz	YHVMTIZQIUJGRB-LLVKDONJSA-N	0	3	310.829	2.333	10	0		DEAEHN
COCC[C@H](C)N[C@@H](CO)c1cccc(Br)c1	ZINC000181390516	199288644	/nfs/dbraw/zinc/28/86/44/199288644.db2.gz	WJZITYMBTYEFID-GWCFXTLKSA-N	0	3	302.212	2.497	10	0		DEAEHN
COC(=O)CNC(=O)CCN[C@H](C)c1ccc(CC(C)C)cc1	ZINC000181406746	199292370	/nfs/dbraw/zinc/29/23/70/199292370.db2.gz	TZPHJDHMUUUHIL-CQSZACIVSA-N	0	3	320.433	2.215	10	0		DEAEHN
CC[C@@H](CSC)N(C)S(=O)(=O)c1csc(CNC)c1	ZINC000168549480	197725011	/nfs/dbraw/zinc/72/50/11/197725011.db2.gz	ZHNFNAKDIUQQMH-JTQLQIEISA-N	0	3	322.521	2.230	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cc(COC(C)(C)C)on2)C1	ZINC000186374214	282273851	/nfs/dbraw/zinc/27/38/51/282273851.db2.gz	QTEIYYLRSWIEBR-DOMZBBRYSA-N	0	3	323.437	2.448	10	0		DEAEHN
CCc1nn(C)c(CC)c1CN[C@@H](COC)C1CCOCC1	ZINC000188273607	529766630	/nfs/dbraw/zinc/76/66/30/529766630.db2.gz	VPIJXGTWKMQBTJ-INIZCTEOSA-N	0	3	309.454	2.076	10	0		DEAEHN
C[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccncc1	ZINC000036954908	539334957	/nfs/dbraw/zinc/33/49/57/539334957.db2.gz	DYKRVXSUSZVVNO-RYUDHWBXSA-N	0	3	305.403	2.141	10	0		DEAEHN
C[C@@H](C1CC1)N(C(=O)CN(C)[C@@]1(CO)CC[C@@H](C)C1)C1CC1	ZINC000188019087	282295704	/nfs/dbraw/zinc/29/57/04/282295704.db2.gz	XXUSTPCPXUGXMY-GLJUWKHASA-N	0	3	308.466	2.259	10	0		DEAEHN
CN(C[C@@H]1CC=CCC1)C(=O)NCCN1CCN(C)C(C)(C)C1	ZINC000440996744	529944687	/nfs/dbraw/zinc/94/46/87/529944687.db2.gz	ZJYZGNRUSRZMET-MRXNPFEDSA-N	0	3	322.497	2.010	10	0		DEAEHN
COC[C@H](O)CN[C@H](C)c1ccc(Br)cc1OC	ZINC000190435137	282320375	/nfs/dbraw/zinc/32/03/75/282320375.db2.gz	QNVZBYMRZGXJKE-MWLCHTKSSA-N	0	3	318.211	2.116	10	0		DEAEHN
COC[C@H](C)C(=O)Nc1ccc(N(C)C2CCN(C)CC2)cc1	ZINC000103383378	185449184	/nfs/dbraw/zinc/44/91/84/185449184.db2.gz	LSJMITDTNCMEOX-AWEZNQCLSA-N	0	3	319.449	2.438	10	0		DEAEHN
Cc1nc(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)sc1C	ZINC000245484640	282391291	/nfs/dbraw/zinc/39/12/91/282391291.db2.gz	HURMKTKXPORPNL-GWCFXTLKSA-N	0	3	310.467	2.384	10	0		DEAEHN
CCc1cnc(CCNC(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)s1	ZINC000126316859	539477344	/nfs/dbraw/zinc/47/73/44/539477344.db2.gz	FJXXEGHZVGPUGF-NEPJUHHUSA-N	0	3	322.478	2.172	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCC(C)(C)c1ccncc1	ZINC000130236592	539494354	/nfs/dbraw/zinc/49/43/54/539494354.db2.gz	RKTYXEPOOPRFDL-INIZCTEOSA-N	0	3	318.465	2.485	10	0		DEAEHN
CCc1cc(NC(=O)NCC2CCN(CCO)CC2)ccc1C	ZINC000181986292	199372049	/nfs/dbraw/zinc/37/20/49/199372049.db2.gz	FVXNFFQABVWQAU-UHFFFAOYSA-N	0	3	319.449	2.383	10	0		DEAEHN
CN1CCO[C@H](CNC2CC2)[C@@H]1c1cc(F)c(F)c(F)c1	ZINC000070287704	190877508	/nfs/dbraw/zinc/87/75/08/190877508.db2.gz	CTKJDIUVVHYUBU-HIFRSBDPSA-N	0	3	300.324	2.228	10	0		DEAEHN
CC(C)N(C)CC(=O)NC1(c2noc(C3CC3)n2)CCCC1	ZINC000175710642	539624934	/nfs/dbraw/zinc/62/49/34/539624934.db2.gz	XCBDGYISKIJCNA-UHFFFAOYSA-N	0	3	306.410	2.173	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)NC[C@@H]2CCN(C3CC3)C2)s1	ZINC000176102983	539626182	/nfs/dbraw/zinc/62/61/82/539626182.db2.gz	SMKLHNXTUYDEFL-NEPJUHHUSA-N	0	3	323.462	2.373	10	0		DEAEHN
CCOc1ccccc1[C@@H](CC)NC[C@H](O)CN1CCCC1=O	ZINC000179741311	539642451	/nfs/dbraw/zinc/64/24/51/539642451.db2.gz	YFKFOTFXDULKJH-GOEBONIOSA-N	0	3	320.433	2.109	10	0		DEAEHN
NC[C@H](NC[C@H]1CCCO1)c1ccc(Br)s1	ZINC000083774174	192382645	/nfs/dbraw/zinc/38/26/45/192382645.db2.gz	KMQFJYVDTSCPCA-BDAKNGLRSA-N	0	3	305.241	2.279	10	0		DEAEHN
O=C(C/C=C\c1ccc(F)cc1)NC[C@@H](O)CN1CCCCC1	ZINC000255618103	282652558	/nfs/dbraw/zinc/65/25/58/282652558.db2.gz	QJMGGKDELKODSB-VGOKWCNXSA-N	0	3	320.408	2.192	10	0		DEAEHN
Fc1cc(Br)cnc1N1CCN2CCC[C@@H]2C1	ZINC000229537938	539732927	/nfs/dbraw/zinc/73/29/27/539732927.db2.gz	AJNDAWFYKKPDCU-SNVBAGLBSA-N	0	3	300.175	2.268	10	0		DEAEHN
COC(=O)c1ccc(Cl)c(N[C@H](C)C[C@@H]2COCCN2)c1	ZINC000133649637	186003659	/nfs/dbraw/zinc/00/36/59/186003659.db2.gz	VJAOOIUTBKBXSB-ZYHUDNBSSA-N	0	3	312.797	2.306	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@H](C)OCC1CC1	ZINC000245868572	539759212	/nfs/dbraw/zinc/75/92/12/539759212.db2.gz	QWUBRABEZVJFTI-GJZGRUSLSA-N	0	3	304.434	2.438	10	0		DEAEHN
CCCCN(CC)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138324074	186015487	/nfs/dbraw/zinc/01/54/87/186015487.db2.gz	ZEYVAIBTPOXNMD-UHFFFAOYSA-N	0	3	306.378	2.234	10	0		DEAEHN
CCNCc1cc(F)c(F)c(S(=O)(=O)N(CC)C2CC2)c1	ZINC000138438358	186016900	/nfs/dbraw/zinc/01/69/00/186016900.db2.gz	VGAFMAIZQUCHHV-UHFFFAOYSA-N	0	3	318.389	2.247	10	0		DEAEHN
NCC1(c2nc(-c3ccc(Br)cn3)no2)CCC1	ZINC000139803501	186023749	/nfs/dbraw/zinc/02/37/49/186023749.db2.gz	XXHIPGLLQZNVSF-UHFFFAOYSA-N	0	3	309.167	2.275	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2ccsc2)N(C[C@@H]2CCCN2CC)C1=O	ZINC000140310714	186026189	/nfs/dbraw/zinc/02/61/89/186026189.db2.gz	GMEXUMAGBVZHRL-SOUVJXGZSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCS(=O)(=O)CCC[C@@H](N)c1ncccc1Br	ZINC000140363572	186026783	/nfs/dbraw/zinc/02/67/83/186026783.db2.gz	WQOVCYAHFGHSKK-SNVBAGLBSA-N	0	3	321.240	2.059	10	0		DEAEHN
CC(C)[C@@H]1N[C@H](c2ccsc2)N(C[C@@H]2CCN(C)C2)C1=O	ZINC000142206181	186031726	/nfs/dbraw/zinc/03/17/26/186031726.db2.gz	KMLBPNGJMIMYMQ-SNPRPXQTSA-N	0	3	307.463	2.155	10	0		DEAEHN
Cc1ccc([C@@H]2NC3(CC3)C(=O)N2C2CCN(C)CC2)s1	ZINC000141194594	186029077	/nfs/dbraw/zinc/02/90/77/186029077.db2.gz	SIJKXRVXRYDUNL-CQSZACIVSA-N	0	3	305.447	2.114	10	0		DEAEHN
CNCc1ccc(Oc2ccc(S(C)(=O)=O)cc2)nc1C	ZINC000148249956	186043808	/nfs/dbraw/zinc/04/38/08/186043808.db2.gz	OSGSNJCNYHULGE-UHFFFAOYSA-N	0	3	306.387	2.305	10	0		DEAEHN
CN[C@H](C)c1ccc(N2CCN(CC(F)(F)F)CC2)cn1	ZINC000148568327	186044788	/nfs/dbraw/zinc/04/47/88/186044788.db2.gz	LVPZCFVRAMQVSU-LLVKDONJSA-N	0	3	302.344	2.046	10	0		DEAEHN
CN(C1CCC1)S(=O)(=O)c1cc(Cl)cc(CN)c1F	ZINC000144669998	186035717	/nfs/dbraw/zinc/03/57/17/186035717.db2.gz	NOPIZLFYWUYRLA-UHFFFAOYSA-N	0	3	306.790	2.111	10	0		DEAEHN
CN(C1CCC1)S(=O)(=O)c1cc(F)c(Cl)c(CN)c1	ZINC000144607751	186035769	/nfs/dbraw/zinc/03/57/69/186035769.db2.gz	GWTTYVONUZGPJV-UHFFFAOYSA-N	0	3	306.790	2.111	10	0		DEAEHN
COc1cccc(CCC(=O)N2CCCN(C3CC3)CC2)c1	ZINC000149078774	186047902	/nfs/dbraw/zinc/04/79/02/186047902.db2.gz	ICZMGYRRPUHCRX-UHFFFAOYSA-N	0	3	302.418	2.325	10	0		DEAEHN
CCN[C@H](c1ccc(Cl)c(OC)c1)[C@H]1CCS(=O)(=O)C1	ZINC000150147819	186054833	/nfs/dbraw/zinc/05/48/33/186054833.db2.gz	FIDPZPIVEIPWIZ-SMDDNHRTSA-N	0	3	317.838	2.434	10	0		DEAEHN
CC(C)NC(=O)CN1CCN(C[C@@H](C)Cc2ccccc2)CC1	ZINC000182028625	199376034	/nfs/dbraw/zinc/37/60/34/199376034.db2.gz	OQEJFSGAMDNLJB-KRWDZBQOSA-N	0	3	317.477	2.007	10	0		DEAEHN
Cc1ccc(Br)c(NC(=O)[C@]2(C)COC[C@@H]2N)c1	ZINC000163966494	186144304	/nfs/dbraw/zinc/14/43/04/186144304.db2.gz	FMSDPADXUWQUGQ-WCQYABFASA-N	0	3	313.195	2.060	10	0		DEAEHN
CCN[C@@H]1c2ccccc2[C@H](C)C[C@@H]1S(=O)(=O)CCOC	ZINC000164292315	186155394	/nfs/dbraw/zinc/15/53/94/186155394.db2.gz	PBPAAKUSIGVTNS-UHOFOFEASA-N	0	3	311.447	2.274	10	0		DEAEHN
O=C(NCCSc1ccccc1)N1CCN2CCC[C@H]2C1	ZINC000171898860	198003581	/nfs/dbraw/zinc/00/35/81/198003581.db2.gz	WHWCVDQXYGQMNC-AWEZNQCLSA-N	0	3	305.447	2.268	10	0		DEAEHN
O=C(NCc1ccc(F)c(Cl)c1)N1CCN2CCC[C@H]2C1	ZINC000171906456	198006248	/nfs/dbraw/zinc/00/62/48/198006248.db2.gz	OHQSNBXOXMNOTH-LBPRGKRZSA-N	0	3	311.788	2.469	10	0		DEAEHN
C[C@H](C(=O)N1C[C@H]2CCCN2C[C@H]1C)n1cnc2ccccc21	ZINC000172058500	198032973	/nfs/dbraw/zinc/03/29/73/198032973.db2.gz	VRFPLHAQYKQRHR-RBSFLKMASA-N	0	3	312.417	2.292	10	0		DEAEHN
Fc1cc(Br)cnc1N1CCN2CCC[C@H]2C1	ZINC000300419306	539860335	/nfs/dbraw/zinc/86/03/35/539860335.db2.gz	AJNDAWFYKKPDCU-JTQLQIEISA-N	0	3	300.175	2.268	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cc3ccccc3[nH]c2=O)CCN1C	ZINC000172995231	198174596	/nfs/dbraw/zinc/17/45/96/198174596.db2.gz	YHQUGBQSEGAYIW-JSGCOSHPSA-N	0	3	313.401	2.083	10	0		DEAEHN
COc1ccc(NC(=O)NC(=O)CN2C[C@H](C)CC[C@@H]2C)cc1	ZINC000072897502	191249490	/nfs/dbraw/zinc/24/94/90/191249490.db2.gz	SXWYWASIEDJDFI-OLZOCXBDSA-N	0	3	319.405	2.464	10	0		DEAEHN
Cn1nccc1C1CCN(C[C@@H]2CC3(CCC3)C(=O)O2)CC1	ZINC000191978599	282861410	/nfs/dbraw/zinc/86/14/10/282861410.db2.gz	LGVAICYCWSCRHY-AWEZNQCLSA-N	0	3	303.406	2.085	10	0		DEAEHN
Cc1csc([C@@H](NC(=O)N2CC[C@@H](N(C)C)C2)C2CC2)n1	ZINC000173914447	198268403	/nfs/dbraw/zinc/26/84/03/198268403.db2.gz	IOOWLHVFDRZKBR-OLZOCXBDSA-N	0	3	308.451	2.248	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCc2cccc(O)c2)CCN1C	ZINC000174616287	198359867	/nfs/dbraw/zinc/35/98/67/198359867.db2.gz	GAEJHGHKAOHXPU-HIFRSBDPSA-N	0	3	305.422	2.059	10	0		DEAEHN
COc1ccc([C@@H](O)CN(C)Cc2ccccc2N)cc1OC	ZINC000039375013	354168323	/nfs/dbraw/zinc/16/83/23/354168323.db2.gz	XOJFVTPWEZEOND-INIZCTEOSA-N	0	3	316.401	2.451	10	0		DEAEHN
O=C([C@H]1CCCN(Cc2cccc(Cl)c2)C1)N1CCOCC1	ZINC000038832727	354168763	/nfs/dbraw/zinc/16/87/63/354168763.db2.gz	HEUVRDGSGVLDAT-HNNXBMFYSA-N	0	3	322.836	2.411	10	0		DEAEHN
CN(Cc1ccc(CO)cc1)C[C@H]1CCCN1c1cccnn1	ZINC000364977363	283108150	/nfs/dbraw/zinc/10/81/50/283108150.db2.gz	GKWCDNAJNOTLDK-QGZVFWFLSA-N	0	3	312.417	2.070	10	0		DEAEHN
O=C1[C@@H](N[C@H]2CCCc3sccc32)CCN1C1CCOCC1	ZINC000367412115	283113559	/nfs/dbraw/zinc/11/35/59/283113559.db2.gz	GJNWUIYIKVSTKM-GJZGRUSLSA-N	0	3	320.458	2.495	10	0		DEAEHN
N[C@H]1CCCC[C@H]1Nc1nc(-c2ccccc2)c2c(=O)[nH]cc-2[nH]1	ZINC000117717363	355777893	/nfs/dbraw/zinc/77/78/93/355777893.db2.gz	JGNFRPZOVOEHCX-QWHCGFSZSA-N	0	3	323.400	2.069	10	0		DEAEHN
COCCN(C)CCNC(=O)N(C)[C@H](C)Cc1ccc(C)cc1	ZINC000125817906	355813206	/nfs/dbraw/zinc/81/32/06/355813206.db2.gz	DMNWLGXUEUGELX-MRXNPFEDSA-N	0	3	321.465	2.146	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)CN[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000182032167	356106071	/nfs/dbraw/zinc/10/60/71/356106071.db2.gz	ICCOIINIWKHVET-KGLIPLIRSA-N	0	3	315.421	2.079	10	0		DEAEHN
CC[C@H]1CN(CCCC(=O)OC(C)(C)C)CCN1CCOC	ZINC000181818603	356097625	/nfs/dbraw/zinc/09/76/25/356097625.db2.gz	UUDGYATYRJMQQI-HNNXBMFYSA-N	0	3	314.470	2.151	10	0		DEAEHN
NC(=S)CN(CC(=O)Nc1cccc(F)c1)C1CCCC1	ZINC000080223165	192013791	/nfs/dbraw/zinc/01/37/91/192013791.db2.gz	QYETXBLQMHUQBJ-UHFFFAOYSA-N	0	3	309.410	2.295	10	0		DEAEHN
COC[C@H](C)CN1CCN(c2cc(C)nc(C(C)C)n2)CC1	ZINC000189591707	356215841	/nfs/dbraw/zinc/21/58/41/356215841.db2.gz	ANCHDBLJBMMACW-CQSZACIVSA-N	0	3	306.454	2.313	10	0		DEAEHN
CC(C)CN1CCN(C[C@@H](C(N)=S)c2ccccc2)CC1	ZINC000080797699	192191748	/nfs/dbraw/zinc/19/17/48/192191748.db2.gz	XGUIQMGPSNNLHL-MRXNPFEDSA-N	0	3	305.491	2.330	10	0		DEAEHN
COc1ccc([C@@](C)(O)[C@@H]2CCCN2Cc2ccnn2C)cc1	ZINC000225546053	356276724	/nfs/dbraw/zinc/27/67/24/356276724.db2.gz	JXTZPCVZWCWXAV-ZWKOTPCHSA-N	0	3	315.417	2.301	10	0		DEAEHN
CCOC(=O)[C@]1(C(C)C)CCN(CC(=O)NC(C)(C)CC)C1	ZINC000194855740	356245743	/nfs/dbraw/zinc/24/57/43/356245743.db2.gz	YCRPINAXGUTAPZ-QGZVFWFLSA-N	0	3	312.454	2.202	10	0		DEAEHN
NCc1ccc(OC(F)(F)F)nc1I	ZINC000238682667	356305253	/nfs/dbraw/zinc/30/52/53/356305253.db2.gz	PZEYWSGJCQCZBZ-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
CC[C@]1(CO)CCCN(C[C@@H](O)COc2ccc(C)cc2)C1	ZINC000249581437	356330566	/nfs/dbraw/zinc/33/05/66/356330566.db2.gz	RGQYUUZINJPGFK-AEFFLSMTSA-N	0	3	307.434	2.219	10	0		DEAEHN
COC[C@H](C)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000249784780	356331558	/nfs/dbraw/zinc/33/15/58/356331558.db2.gz	LXHHPXROKBOPSR-IUODEOHRSA-N	0	3	309.385	2.304	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)NC[C@@H]2C[C@H]2c2ccccc2)C1	ZINC000252441996	356333508	/nfs/dbraw/zinc/33/35/08/356333508.db2.gz	FYUFMLWIAFPIIA-PVAVHDDUSA-N	0	3	301.434	2.431	10	0		DEAEHN
C[C@H](NCc1ccn(C)n1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000400499463	283157492	/nfs/dbraw/zinc/15/74/92/283157492.db2.gz	ICXWIJSDHBPEAF-QWHCGFSZSA-N	0	3	308.426	2.155	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3c(c2)OCCO3)C1	ZINC000246622585	283160218	/nfs/dbraw/zinc/16/02/18/283160218.db2.gz	KAFLHDFWLFCINT-GJZGRUSLSA-N	0	3	316.401	2.014	10	0		DEAEHN
CN[C@H](c1cnn(C)c1I)C1CCC1	ZINC000306604260	356404606	/nfs/dbraw/zinc/40/46/06/356404606.db2.gz	YQFYDGMNSCUDRZ-VIFPVBQESA-N	0	3	305.163	2.085	10	0		DEAEHN
CNC(=O)[C@@H](C)CN(C)Cc1cc(Cl)cc2c1OCOC2	ZINC000081527281	192283289	/nfs/dbraw/zinc/28/32/89/192283289.db2.gz	SHFQMUHMEVOJQK-JTQLQIEISA-N	0	3	312.797	2.020	10	0		DEAEHN
CN[C@H](CCN1CCn2cnnc2C1)c1ccccc1Cl	ZINC000081541506	192285753	/nfs/dbraw/zinc/28/57/53/192285753.db2.gz	XLZUQLYWFDYDFQ-CQSZACIVSA-N	0	3	305.813	2.098	10	0		DEAEHN
COC(=O)c1cncnc1N[C@@H](C)CN(C)Cc1ccccc1	ZINC000381045020	356669715	/nfs/dbraw/zinc/66/97/15/356669715.db2.gz	FMZFRVCIQSYPQP-ZDUSSCGKSA-N	0	3	314.389	2.196	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N1CC(=O)NCC[C@H]1COc2ccccc2O1	ZINC000579785308	357029101	/nfs/dbraw/zinc/02/91/01/357029101.db2.gz	VBZWMBJUTQUFDO-ZNMIVQPWSA-N	0	3	318.417	2.206	10	0		DEAEHN
CCCN(C)S(=O)(=O)c1cc(CNCC)n(C(C)C)c1	ZINC000088946915	192664649	/nfs/dbraw/zinc/66/46/49/192664649.db2.gz	BQQTUWOIXKPYHN-UHFFFAOYSA-N	0	3	301.456	2.209	10	0		DEAEHN
O=C(NCCOCC1CCC1)N1CCC[C@@H]1CN1CCCCC1	ZINC000584694363	357291525	/nfs/dbraw/zinc/29/15/25/357291525.db2.gz	UEJXFPNQQZGKMU-QGZVFWFLSA-N	0	3	323.481	2.463	10	0		DEAEHN
CCCNCc1sccc1S(=O)(=O)N1CCC[C@@H]1C	ZINC000088971821	192676220	/nfs/dbraw/zinc/67/62/20/192676220.db2.gz	MPORWLQZGSQGSA-NSHDSACASA-N	0	3	302.465	2.421	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)c2ncsc2Br)CCN1C	ZINC000581962732	357276041	/nfs/dbraw/zinc/27/60/41/357276041.db2.gz	ACKCSGCTKLFMGE-JGVFFNPUSA-N	0	3	318.240	2.118	10	0		DEAEHN
CCC(O)(CC)CNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179476415	199042026	/nfs/dbraw/zinc/04/20/26/199042026.db2.gz	PKAUSUYETFFABR-HZPDHXFCSA-N	0	3	319.449	2.282	10	0		DEAEHN
C[C@H]1C[C@H](CCN2CCC[C@@H]2CS(N)(=O)=O)C[C@@H](C)C1	ZINC000408245656	291120065	/nfs/dbraw/zinc/12/00/65/291120065.db2.gz	HURSBFPHAIJYDK-CBBWQLFWSA-N	0	3	302.484	2.202	10	0		DEAEHN
CCOCCN1CCN(Cc2cccc3nccn32)C[C@H]1CC	ZINC000180087650	199115796	/nfs/dbraw/zinc/11/57/96/199115796.db2.gz	UJKOURNXIWGTGI-MRXNPFEDSA-N	0	3	316.449	2.267	10	0		DEAEHN
Cn1cc([C@H]2CCN(Cc3cn(C)nc3C(C)(C)C)C2)cn1	ZINC000180331742	199146327	/nfs/dbraw/zinc/14/63/27/199146327.db2.gz	IRYVENLXWXCIQQ-ZDUSSCGKSA-N	0	3	301.438	2.441	10	0		DEAEHN
CC1(CNC(=O)N2CCN3CCC[C@@H]3C2)Cc2ccccc2C1	ZINC000180580974	199179662	/nfs/dbraw/zinc/17/96/62/199179662.db2.gz	WELXFSWXNYNGIP-QGZVFWFLSA-N	0	3	313.445	2.281	10	0		DEAEHN
Cc1nccn1-c1ccc([C@H](C)N[C@@H]2CCc3ncnn3C2)cc1	ZINC000180589363	199180683	/nfs/dbraw/zinc/18/06/83/199180683.db2.gz	WKOHCONEJQIXMF-XJKSGUPXSA-N	0	3	322.416	2.438	10	0		DEAEHN
CN(C[C@H]1CCCN(C)C1)C(=O)NCc1ccc(Cl)cn1	ZINC000180825779	199214402	/nfs/dbraw/zinc/21/44/02/199214402.db2.gz	HVDVGBMPDZDRKK-LBPRGKRZSA-N	0	3	310.829	2.218	10	0		DEAEHN
CC(=O)N1CC[C@H](NCC[C@@H](C)[S@](C)=O)c2ccccc21	ZINC000598679102	359288471	/nfs/dbraw/zinc/28/84/71/359288471.db2.gz	XCXWCSCVYSTBIO-RKFVTTHHSA-N	0	3	308.447	2.231	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](C)c1ccccc1)N(C)CCN(C)C1CC1	ZINC000186788386	200011457	/nfs/dbraw/zinc/01/14/57/200011457.db2.gz	NGAQYVRAENAMQA-LSDHHAIUSA-N	0	3	303.450	2.278	10	0		DEAEHN
Cn1cc([C@@H]2CCN(Cc3ccc4c(c3)CCC(=O)N4C)C2)cn1	ZINC000187004996	200046170	/nfs/dbraw/zinc/04/61/70/200046170.db2.gz	FMOYBYJMUHWAIX-MRXNPFEDSA-N	0	3	324.428	2.319	10	0		DEAEHN
CC(C)C[C@H](CO)N(C)C(=O)NCCN(C)Cc1ccccc1	ZINC000188491117	200255059	/nfs/dbraw/zinc/25/50/59/200255059.db2.gz	GZMRMABZSWHGMO-QGZVFWFLSA-N	0	3	321.465	2.167	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)c1ccnc(F)c1F	ZINC000189196396	200363413	/nfs/dbraw/zinc/36/34/13/200363413.db2.gz	VGAMDEHARBIFID-ZDUSSCGKSA-N	0	3	319.355	2.263	10	0		DEAEHN
CC(C)OC1CC(N[C@@H](Cc2ccccc2)C(=O)N(C)C)C1	ZINC000189531439	200417881	/nfs/dbraw/zinc/41/78/81/200417881.db2.gz	VUGNHKODQJYILE-JCYILVPMSA-N	0	3	304.434	2.232	10	0		DEAEHN
CCOC[C@@H](NCc1cnc(C(=O)OCC)s1)C(C)C	ZINC000602830162	360577584	/nfs/dbraw/zinc/57/75/84/360577584.db2.gz	LRSBDGGJCXTHMV-GFCCVEGCSA-N	0	3	300.424	2.471	10	0		DEAEHN
CC[C@H](CN1CCCC1)NC(=O)CN(C)c1ccc(Cl)cn1	ZINC000605371808	360962566	/nfs/dbraw/zinc/96/25/66/360962566.db2.gz	CXUKRGZNFQPQBE-CQSZACIVSA-N	0	3	324.856	2.162	10	0		DEAEHN
CN(C)CCn1cc(Nc2cnc3cc(F)c(F)cc3n2)cn1	ZINC000605567941	360979879	/nfs/dbraw/zinc/97/98/79/360979879.db2.gz	HMRHPCBXLDTCDP-UHFFFAOYSA-N	0	3	318.331	2.410	10	0		DEAEHN
COC1CCN(C(C)(C)CNC(=O)NCCCC2CC2)CC1	ZINC000605604736	360984141	/nfs/dbraw/zinc/98/41/41/360984141.db2.gz	AGTWYGXMPLDTSZ-UHFFFAOYSA-N	0	3	311.470	2.365	10	0		DEAEHN
COC[C@H](NC1CCN(C(N)=O)CC1)c1ccc(Cl)cc1	ZINC000194040962	201168797	/nfs/dbraw/zinc/16/87/97/201168797.db2.gz	HYBYYOVPZFZAOA-AWEZNQCLSA-N	0	3	311.813	2.160	10	0		DEAEHN
CCN(CC)CCc1nc(C)c(Br)c(NC)n1	ZINC000090752309	192928384	/nfs/dbraw/zinc/92/83/84/192928384.db2.gz	FUBPSMCBHMHNDU-UHFFFAOYSA-N	0	3	301.232	2.474	10	0		DEAEHN
CCn1cc([C@@H](C)N[C@@H]2CCCN(c3ncccn3)C2)cn1	ZINC000194983961	201321484	/nfs/dbraw/zinc/32/14/84/201321484.db2.gz	AEKJFPTWCLXBFL-UKRRQHHQSA-N	0	3	300.410	2.013	10	0		DEAEHN
C[C@H]1c2ccccc2O[C@H]1C(=O)N(C)[C@H]1CCN(C)C[C@H]1C	ZINC000247396233	291321394	/nfs/dbraw/zinc/32/13/94/291321394.db2.gz	MHWVOEHIZFBHTH-RPCCPQHDSA-N	0	3	302.418	2.350	10	0		DEAEHN
C[C@@H](C(=O)Nc1nc2ccccc2s1)N1CC[C@H](N(C)C)C1	ZINC000623014930	364855367	/nfs/dbraw/zinc/85/53/67/364855367.db2.gz	AGLQTYVRXWXCHA-RYUDHWBXSA-N	0	3	318.446	2.259	10	0		DEAEHN
CS(=O)(=O)c1cccc(CNC[C@@H](O)C2CCCCC2)c1	ZINC000449119028	240077300	/nfs/dbraw/zinc/07/73/00/240077300.db2.gz	VVDKYEMOWPDZHZ-MRXNPFEDSA-N	0	3	311.447	2.121	10	0		DEAEHN
Brc1ccnc2c1CN(CCCn1ccnc1)CC2	ZINC000623287337	364967523	/nfs/dbraw/zinc/96/75/23/364967523.db2.gz	YTTYKSSHQMOLDA-UHFFFAOYSA-N	0	3	321.222	2.489	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2cccc(OCC)c2)CC12COC2	ZINC000449362829	240397819	/nfs/dbraw/zinc/39/78/19/240397819.db2.gz	LFTHLKLNKJGJRD-MRXNPFEDSA-N	0	3	319.401	2.097	10	0		DEAEHN
O=C(C[C@H]1CSCCN1)Nc1ccc(N2CCCC2)cc1	ZINC000091135283	193001675	/nfs/dbraw/zinc/00/16/75/193001675.db2.gz	BANPPIJGYGGJHL-AWEZNQCLSA-N	0	3	305.447	2.320	10	0		DEAEHN
CN1CCOC[C@H]1CNCc1ccc(F)c(Br)c1	ZINC000623710755	365140030	/nfs/dbraw/zinc/14/00/30/365140030.db2.gz	MTMOCFBOQPQDRR-LLVKDONJSA-N	0	3	317.202	2.008	10	0		DEAEHN
CN1CCOC[C@H]1CNCc1cccc(Br)c1F	ZINC000623713240	365140990	/nfs/dbraw/zinc/14/09/90/365140990.db2.gz	WDESXWWUHDJDMX-LLVKDONJSA-N	0	3	317.202	2.008	10	0		DEAEHN
NCc1cnn(-c2ccc(Br)cn2)c1C(F)F	ZINC000091339918	193044206	/nfs/dbraw/zinc/04/42/06/193044206.db2.gz	LGYQMGZDXCCXDP-UHFFFAOYSA-N	0	3	303.110	2.426	10	0		DEAEHN
CC[C@@H](C)[C@H](N)C(=O)Nc1ccc(Br)c(C)n1	ZINC000091507088	193066055	/nfs/dbraw/zinc/06/60/55/193066055.db2.gz	AIFHSVBGHPKRAB-HQJQHLMTSA-N	0	3	300.200	2.464	10	0		DEAEHN
C[C@@H]1[NH2+]CC[C@H]1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000624415465	365416131	/nfs/dbraw/zinc/41/61/31/365416131.db2.gz	KYINRVMZBXPIFV-WRWORJQWSA-N	0	3	309.218	2.022	10	0		DEAEHN
CC(C)CNCc1ncoc1-c1cccc(S(C)(=O)=O)c1	ZINC000091959405	193133094	/nfs/dbraw/zinc/13/30/94/193133094.db2.gz	YNIWBLDSGFFWGQ-UHFFFAOYSA-N	0	3	308.403	2.491	10	0		DEAEHN
NCc1ccc(NC(=O)N2CCOCC2)cc1C(F)(F)F	ZINC000091970153	193133815	/nfs/dbraw/zinc/13/38/15/193133815.db2.gz	HOPOPMYUWKUYSA-UHFFFAOYSA-N	0	3	303.284	2.028	10	0		DEAEHN
Cc1oc(CNC(C)C)cc1S(=O)(=O)N1C[C@@H](C)[C@H](C)C1	ZINC000092113499	193161058	/nfs/dbraw/zinc/16/10/58/193161058.db2.gz	OQGCUCQFXPRFKN-VXGBXAGGSA-N	0	3	314.451	2.363	10	0		DEAEHN
COC[C@@H](O)CN1CC[C@H](c2cccc(Br)c2)C1	ZINC000451573228	243140868	/nfs/dbraw/zinc/14/08/68/243140868.db2.gz	UFUGFHILBFHKPD-JSGCOSHPSA-N	0	3	314.223	2.246	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000262141813	203210053	/nfs/dbraw/zinc/21/00/53/203210053.db2.gz	PJDJAGBYMJQAFX-WHOFXGATSA-N	0	3	309.841	2.408	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)NCCCc1cc(OC)ccc1OC	ZINC000262578846	203336989	/nfs/dbraw/zinc/33/69/89/203336989.db2.gz	PQDWNWADCPVLEG-QGZVFWFLSA-N	0	3	308.422	2.270	10	0		DEAEHN
CN(CCc1cccs1)S(=O)(=O)c1cccc(CN)c1	ZINC000093294742	193226111	/nfs/dbraw/zinc/22/61/11/193226111.db2.gz	LZGSSOFLVXZRSW-UHFFFAOYSA-N	0	3	310.444	2.070	10	0		DEAEHN
[NH3+][C@]1(C(=O)[O-])CCC[C@H]1CCN1CCC(C(F)(F)F)CC1	ZINC000093596152	193270849	/nfs/dbraw/zinc/27/08/49/193270849.db2.gz	SPRWFZKVWVBDTA-GXFFZTMASA-N	0	3	308.344	2.233	10	0		DEAEHN
CN[C@@]1(C(N)=O)CCC[C@H](Sc2nc3ccccc3o2)C1	ZINC000093777941	193304993	/nfs/dbraw/zinc/30/49/93/193304993.db2.gz	MAYSBZNLYIKTBH-BONVTDFDSA-N	0	3	305.403	2.306	10	0		DEAEHN
CCN[C@]1(C(N)=O)CC[C@@H](Sc2cc(F)ccc2F)C1	ZINC000093851295	193319243	/nfs/dbraw/zinc/31/92/43/193319243.db2.gz	SDTMABATPDVCQK-QMTHXVAHSA-N	0	3	300.374	2.443	10	0		DEAEHN
NC(=O)[C@@]1(NC2CC2)CC[C@H](Sc2ncccc2Cl)C1	ZINC000093854118	193319499	/nfs/dbraw/zinc/31/94/99/193319499.db2.gz	JTUGHOBCIDXPEF-IINYFYTJSA-N	0	3	311.838	2.356	10	0		DEAEHN
COCC1CCN(c2nc(C(F)(F)F)ccc2CN)CC1	ZINC000094334321	193360374	/nfs/dbraw/zinc/36/03/74/193360374.db2.gz	FMVIAIUONWHQDG-UHFFFAOYSA-N	0	3	303.328	2.422	10	0		DEAEHN
CNCc1cc(F)c(O[C@@H](C)C(=O)NCC(C)C)c(F)c1	ZINC000094346563	193363448	/nfs/dbraw/zinc/36/34/48/193363448.db2.gz	LKADBIKETWGPDZ-JTQLQIEISA-N	0	3	300.349	2.224	10	0		DEAEHN
COCCNCc1cc(Cl)c(O[C@@H](C)[C@H](C)O)c(OC)c1	ZINC000094653297	193390401	/nfs/dbraw/zinc/39/04/01/193390401.db2.gz	AXZFTRKWMSQCKC-QWRGUYRKSA-N	0	3	317.813	2.233	10	0		DEAEHN
CC(C)(C)NCc1cn([C@@H]2CCO[C@@]3(CCSC3)C2)nn1	ZINC000094419108	193368775	/nfs/dbraw/zinc/36/87/75/193368775.db2.gz	AGVWYGBJNDHTLD-HIFRSBDPSA-N	0	3	310.467	2.393	10	0		DEAEHN
CCOC(=O)[C@@]1(NCCN(CC)CC)CCCS[C@@H]1C	ZINC000094479798	193372804	/nfs/dbraw/zinc/37/28/04/193372804.db2.gz	QPBOANDXGQXIIY-UKRRQHHQSA-N	0	3	302.484	2.135	10	0		DEAEHN
CN(C[C@@H]1CCCN1C)c1nc(Br)cn2ccnc12	ZINC000094491368	193373661	/nfs/dbraw/zinc/37/36/61/193373661.db2.gz	RXXWEQCGRNUGJW-JTQLQIEISA-N	0	3	324.226	2.022	10	0		DEAEHN
c1ccc2c(c1)CNC[C@H]2c1nc([C@@H]2CSCCO2)no1	ZINC000094501787	193374767	/nfs/dbraw/zinc/37/47/67/193374767.db2.gz	WKQHFVXXMOCLCI-OLZOCXBDSA-N	0	3	303.387	2.109	10	0		DEAEHN
[NH3+]C[C@@H]1CCC[C@@H]1C(=O)Nc1cc(Br)ccc1[O-]	ZINC000094573702	193381516	/nfs/dbraw/zinc/38/15/16/193381516.db2.gz	GJFNEJDPIJYBLH-WPRPVWTQSA-N	0	3	313.195	2.468	10	0		DEAEHN
CN[C@@H](Cc1ncnn1C)c1cc(C(F)(F)F)ccc1F	ZINC000094594899	193381973	/nfs/dbraw/zinc/38/19/73/193381973.db2.gz	DXIPLOKGYICXJJ-NSHDSACASA-N	0	3	302.275	2.476	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cccc(C(F)(F)F)c2N)C1	ZINC000094599054	193383091	/nfs/dbraw/zinc/38/30/91/193383091.db2.gz	MUHBIMZTRHNWFU-SECBINFHSA-N	0	3	301.312	2.064	10	0		DEAEHN
CC1(CNCc2cccc(NC(=O)C(F)(F)F)c2)COC1	ZINC000094721984	193394082	/nfs/dbraw/zinc/39/40/82/193394082.db2.gz	QSYIHAMMCHVNLY-UHFFFAOYSA-N	0	3	302.296	2.314	10	0		DEAEHN
CS(=O)(=O)c1ccc(Nc2nc3cc(N)ccc3[nH]2)cc1	ZINC000094770234	193396626	/nfs/dbraw/zinc/39/66/26/193396626.db2.gz	YKVVDKGZIKMPAY-UHFFFAOYSA-N	0	3	302.359	2.292	10	0		DEAEHN
CCn1c(=O)[nH]nc1Sc1cc(C)c(F)cc1[C@H](C)NC	ZINC000094768538	193396634	/nfs/dbraw/zinc/39/66/34/193396634.db2.gz	AVIJGWZFCMHAEE-VIFPVBQESA-N	0	3	310.398	2.470	10	0		DEAEHN
O=C(Nc1ccc(C(F)(F)F)cc1)c1n[nH]c2c1CNCC2	ZINC000082807272	284298821	/nfs/dbraw/zinc/29/88/21/284298821.db2.gz	MQKADSDBAKBZCL-UHFFFAOYSA-N	0	3	310.279	2.327	10	0		DEAEHN
C[C@@]1(NCC(=O)Nc2cccc(Br)c2)CCOC1	ZINC000161762598	197516691	/nfs/dbraw/zinc/51/66/91/197516691.db2.gz	VAHGRFWQPZOZND-CYBMUJFWSA-N	0	3	313.195	2.156	10	0		DEAEHN
C[C@H]1SCCS[C@H]1c1noc(-c2ccc(CN)cn2)n1	ZINC000161912378	197528240	/nfs/dbraw/zinc/52/82/40/197528240.db2.gz	ADXCQGIBXPJKHR-LDYMZIIASA-N	0	3	308.432	2.500	10	0		DEAEHN
Cc1ccccc1CNS(=O)(=O)c1cc(CN)ccc1C	ZINC000020189399	182195480	/nfs/dbraw/zinc/19/54/80/182195480.db2.gz	YWFFMBCZJPFIHU-UHFFFAOYSA-N	0	3	304.415	2.241	10	0		DEAEHN
C[C@H](CNC(=O)NCC1CCCCCC1)CN1CCN(C)CC1	ZINC000454626976	246001645	/nfs/dbraw/zinc/00/16/45/246001645.db2.gz	UJLYHBOPFGACHW-MRXNPFEDSA-N	0	3	324.513	2.140	10	0		DEAEHN
CN(C)CC(C)(C)NC(=O)NC1CCN(c2ccccc2)CC1	ZINC000457961092	248092093	/nfs/dbraw/zinc/09/20/93/248092093.db2.gz	ZAJHMDCHKAVXDY-UHFFFAOYSA-N	0	3	318.465	2.295	10	0		DEAEHN
CCN1CCC[C@@H](N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000040502328	183084446	/nfs/dbraw/zinc/08/44/46/183084446.db2.gz	QCVZVKVBYADPJQ-DZGCQCFKSA-N	0	3	310.463	2.225	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1ccc(Cl)nn1)c1ccccc1	ZINC000040802330	183136317	/nfs/dbraw/zinc/13/63/17/183136317.db2.gz	CFXJPCZJQHXFJW-CYBMUJFWSA-N	0	3	304.781	2.163	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2ccc(F)c(C(F)(F)F)c2)C1	ZINC000040713146	183121694	/nfs/dbraw/zinc/12/16/94/183121694.db2.gz	FKVWSMABAPABMQ-KWQFWETISA-N	0	3	306.259	2.160	10	0		DEAEHN
CC(C)NC(=O)[C@@H](C)Oc1c(Br)cccc1CN	ZINC000042411324	183265069	/nfs/dbraw/zinc/26/50/69/183265069.db2.gz	QCCBUXPWBUZIFG-SECBINFHSA-N	0	3	315.211	2.200	10	0		DEAEHN
CC(C)NC(=O)CN(C)c1ccc(C(F)(F)F)cc1CN	ZINC000042600236	183290211	/nfs/dbraw/zinc/29/02/11/183290211.db2.gz	YXKWAAOZVIOLLQ-UHFFFAOYSA-N	0	3	303.328	2.125	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)cc1)N(C)CC(=O)NC1CC1	ZINC000042945177	183319865	/nfs/dbraw/zinc/31/98/65/183319865.db2.gz	WPAXAGKPHJSHCY-HOCLYGCPSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)cc1)N1CCCC[C@@H]1C(N)=O	ZINC000042946470	183321087	/nfs/dbraw/zinc/32/10/87/183321087.db2.gz	NRGSUZIVQQOQER-ZNMIVQPWSA-N	0	3	309.841	2.458	10	0		DEAEHN
O=C(NC[C@H](O)CN1CCCCC1)Nc1ccc(Cl)cc1	ZINC000043157660	183342191	/nfs/dbraw/zinc/34/21/91/183342191.db2.gz	KFSQGXPQCVSTJE-AWEZNQCLSA-N	0	3	311.813	2.308	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccc(Cl)s1)N1CCCC[C@@H]1C(N)=O	ZINC000043253711	183348079	/nfs/dbraw/zinc/34/80/79/183348079.db2.gz	GPXUJZPRSXTTAS-SBMIAAHKSA-N	0	3	301.843	2.130	10	0		DEAEHN
CCCN(CCO)[C@@H](CN)c1cc(Br)cs1	ZINC000043286604	183350567	/nfs/dbraw/zinc/35/05/67/183350567.db2.gz	JKCQUFIBVJBYDE-JTQLQIEISA-N	0	3	307.257	2.215	10	0		DEAEHN
CN[C@H](c1ccc(C(F)(F)F)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000043300515	183351930	/nfs/dbraw/zinc/35/19/30/183351930.db2.gz	UHZAGXBXDXEPGJ-CMPLNLGQSA-N	0	3	307.337	2.401	10	0		DEAEHN
CN[C@H](c1cccc(Br)c1)[C@H]1CCS(=O)(=O)C1	ZINC000043300590	183352355	/nfs/dbraw/zinc/35/23/55/183352355.db2.gz	SRQFIDCGFGIHCR-CMPLNLGQSA-N	0	3	318.236	2.144	10	0		DEAEHN
CCN[C@@H](c1ccc(OC(F)F)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000043300891	183352589	/nfs/dbraw/zinc/35/25/89/183352589.db2.gz	GOEBGGAWXCKOKE-AAEUAGOBSA-N	0	3	319.373	2.373	10	0		DEAEHN
CCCN[C@H](c1ccc(F)c(F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000043301255	183352606	/nfs/dbraw/zinc/35/26/06/183352606.db2.gz	YJUSQFCHDBYYAJ-BXUZGUMPSA-N	0	3	303.374	2.440	10	0		DEAEHN
CCCN[C@@H](c1ccc(F)cc1F)[C@@H]1CCS(=O)(=O)C1	ZINC000043301236	183352774	/nfs/dbraw/zinc/35/27/74/183352774.db2.gz	MCAYHRALHRHKHE-QMTHXVAHSA-N	0	3	303.374	2.440	10	0		DEAEHN
NC[C@H](c1ccccc1Br)N1CCCC[C@@H]1CO	ZINC000043092493	183335849	/nfs/dbraw/zinc/33/58/49/183335849.db2.gz	UQZLKVDNOHLUKD-BXUZGUMPSA-N	0	3	313.239	2.296	10	0		DEAEHN
CO[C@@H]1C[C@@H](CO)N(Cc2cccc(OCC(F)(F)F)c2)C1	ZINC000284532147	218066748	/nfs/dbraw/zinc/06/67/48/218066748.db2.gz	JZVFWLKTDWGQKW-GXTWGEPZSA-N	0	3	319.323	2.209	10	0		DEAEHN
O=C(NCc1cscn1)N1CCC[C@@H]1CN1CCCCC1	ZINC000105210111	194085596	/nfs/dbraw/zinc/08/55/96/194085596.db2.gz	IWAAIMFJWSOJRD-CQSZACIVSA-N	0	3	308.451	2.303	10	0		DEAEHN
C[C@H]1CC(=O)N(C[C@@H](N)c2cccc(C(F)(F)F)c2)C1=O	ZINC000105677554	194118975	/nfs/dbraw/zinc/11/89/75/194118975.db2.gz	AYWWYLZGZHJAAV-GZMMTYOYSA-N	0	3	300.280	2.100	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)c2ccc(F)cc2)C[C@@H]1CC	ZINC000105838109	194144174	/nfs/dbraw/zinc/14/41/74/194144174.db2.gz	YOFBYSYFHKYVJW-ROUUACIJSA-N	0	3	324.440	2.292	10	0		DEAEHN
CC(C)Oc1ccc(CNC[C@H]2CN(C3CC3)CCO2)cc1	ZINC000106379548	194204084	/nfs/dbraw/zinc/20/40/84/194204084.db2.gz	VAIXBPKKPURDKI-SFHVURJKSA-N	0	3	304.434	2.427	10	0		DEAEHN
C[C@H](NCCc1nncn1C)c1ccccc1Br	ZINC000109421235	194262433	/nfs/dbraw/zinc/26/24/33/194262433.db2.gz	FSXXDEUIFHZWJM-JTQLQIEISA-N	0	3	309.211	2.471	10	0		DEAEHN
C[C@H]1CN(CCNc2cccc(Br)c2)CCN1C	ZINC000110756320	194356697	/nfs/dbraw/zinc/35/66/97/194356697.db2.gz	HUFRCDOCSWMNNN-LBPRGKRZSA-N	0	3	312.255	2.497	10	0		DEAEHN
Brc1ccc2c(c1)CC[C@H](NCc1nc[nH]n1)C2	ZINC000110821891	194361184	/nfs/dbraw/zinc/36/11/84/194361184.db2.gz	PANIMNQZEADLPG-LBPRGKRZSA-N	0	3	307.195	2.214	10	0		DEAEHN
Brc1ccc2c(c1)CC[C@H](NCc1nnc[nH]1)C2	ZINC000110821891	194361186	/nfs/dbraw/zinc/36/11/86/194361186.db2.gz	PANIMNQZEADLPG-LBPRGKRZSA-N	0	3	307.195	2.214	10	0		DEAEHN
CCCN[C@@H](Cc1ccc(F)cc1Cl)CS(C)(=O)=O	ZINC000060706253	184154546	/nfs/dbraw/zinc/15/45/46/184154546.db2.gz	FCKKUAVNKMYQDH-LBPRGKRZSA-N	0	3	307.818	2.434	10	0		DEAEHN
CCN(C(C)=O)c1nc(CN2CCCN(C3CC3)CC2)cs1	ZINC000061041027	184160073	/nfs/dbraw/zinc/16/00/73/184160073.db2.gz	KZJNSZZXONLERN-UHFFFAOYSA-N	0	3	322.478	2.186	10	0		DEAEHN
CCNC(C)(C)C(=O)Nc1ccc(Cl)c(C(=O)N(C)C)c1	ZINC000061291730	184167846	/nfs/dbraw/zinc/16/78/46/184167846.db2.gz	UZPUPPUWCONAIJ-UHFFFAOYSA-N	0	3	311.813	2.368	10	0		DEAEHN
Cc1cc(N[C@H]2CCN(C3CC3)C2)ccc1NS(C)(=O)=O	ZINC000061982612	184199697	/nfs/dbraw/zinc/19/96/97/184199697.db2.gz	IRHGSGSYIQSPAF-ZDUSSCGKSA-N	0	3	309.435	2.015	10	0		DEAEHN
CCNCCS(=O)(=O)N(C)[C@H](C)c1ccccc1Cl	ZINC000062027792	184201672	/nfs/dbraw/zinc/20/16/72/184201672.db2.gz	BROLHOPSEYONPX-LLVKDONJSA-N	0	3	304.843	2.272	10	0		DEAEHN
COCCNCc1c(Cl)cccc1N1CCCN(C)CC1	ZINC000062734910	184251530	/nfs/dbraw/zinc/25/15/30/184251530.db2.gz	SUTPRFQVYYGBOF-UHFFFAOYSA-N	0	3	311.857	2.218	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cc(Cl)c(N)c(Cl)c1	ZINC000119875491	195052894	/nfs/dbraw/zinc/05/28/94/195052894.db2.gz	IHHBRXRUNDCLLT-VIFPVBQESA-N	0	3	302.205	2.400	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000159235858	197337747	/nfs/dbraw/zinc/33/77/47/197337747.db2.gz	UVKMUQGMBCDSKX-NUEKZKHPSA-N	0	3	317.433	2.014	10	0		DEAEHN
C[C@H]1C[C@H]1NS(=O)(=O)c1ccc(F)c(CNC(C)(C)C)c1	ZINC000159109909	197328204	/nfs/dbraw/zinc/32/82/04/197328204.db2.gz	NUIWRCSDVBIPLI-IINYFYTJSA-N	0	3	314.426	2.401	10	0		DEAEHN
COc1ccc(COCCCC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000120218119	195121892	/nfs/dbraw/zinc/12/18/92/195121892.db2.gz	WYQZXGMJCLNFOY-MRXNPFEDSA-N	0	3	320.433	2.155	10	0		DEAEHN
CCc1ccsc1[C@H](O)c1c(OC)cnn1CCN(C)C	ZINC000158765239	197300167	/nfs/dbraw/zinc/30/01/67/197300167.db2.gz	RQGNKDUSINVKSZ-CQSZACIVSA-N	0	3	309.435	2.159	10	0		DEAEHN
CCNCc1sccc1S(=O)(=O)N1C[C@H]2CCC[C@@H]2C1	ZINC000158754789	197299016	/nfs/dbraw/zinc/29/90/16/197299016.db2.gz	OHWKDIIEHBNOHG-VXGBXAGGSA-N	0	3	314.476	2.278	10	0		DEAEHN
C[C@@H]1C[C@H](Nc2nc3ccc(Br)cn3n2)CCN1C	ZINC000158443634	197272924	/nfs/dbraw/zinc/27/29/24/197272924.db2.gz	YEEBLHYKBGULJI-MWLCHTKSSA-N	0	3	324.226	2.386	10	0		DEAEHN
CO[C@@H]1CC[C@H]2OCCN(CCCOCC(F)(F)F)[C@@H]2C1	ZINC000158009122	197234808	/nfs/dbraw/zinc/23/48/08/197234808.db2.gz	KVCZXXMFGIOAQX-JHJVBQTASA-N	0	3	311.344	2.224	10	0		DEAEHN
NCc1cc(S(=O)(=O)NCCC2CCC2)ccc1Cl	ZINC000157515207	197193200	/nfs/dbraw/zinc/19/32/00/197193200.db2.gz	NKHPIRCPFBWYLX-UHFFFAOYSA-N	0	3	302.827	2.267	10	0		DEAEHN
COCCNCCOc1c(Br)cccc1OC	ZINC000157289487	197177526	/nfs/dbraw/zinc/17/75/26/197177526.db2.gz	KKMUZKWTNKHNTD-UHFFFAOYSA-N	0	3	304.184	2.073	10	0		DEAEHN
C[C@](O)(Cc1cc(Br)cs1)C[C@H]1COCCN1	ZINC000156923847	197150468	/nfs/dbraw/zinc/15/04/68/197150468.db2.gz	IHLYWHBCVRYCPL-CMPLNLGQSA-N	0	3	320.252	2.183	10	0		DEAEHN
C[C@H]1CNC[C@H](C)N1C(=O)c1ccc(OC(F)(F)F)cc1	ZINC000156713111	197135142	/nfs/dbraw/zinc/13/51/42/197135142.db2.gz	MRCGVJOGZDRZGR-UWVGGRQHSA-N	0	3	302.296	2.408	10	0		DEAEHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)CC[S@@](C)=O)CC1	ZINC000156012538	197080212	/nfs/dbraw/zinc/08/02/12/197080212.db2.gz	XVGQGFQKONAVDN-FPTDNZKUSA-N	0	3	322.474	2.097	10	0		DEAEHN
CSCCC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1	ZINC000155262063	197037520	/nfs/dbraw/zinc/03/75/20/197037520.db2.gz	GXPQIVMBHJQGOM-ZDUSSCGKSA-N	0	3	307.463	2.476	10	0		DEAEHN
OC1(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)CCC1	ZINC000408257276	285235902	/nfs/dbraw/zinc/23/59/02/285235902.db2.gz	RUTUELSEHNOUDR-CQSZACIVSA-N	0	3	304.438	2.099	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)C(=O)Nc2cccc(Cl)c2)CCN1C	ZINC000120623403	195203444	/nfs/dbraw/zinc/20/34/44/195203444.db2.gz	RKUQOEPSEALSLJ-RISCZKNCSA-N	0	3	323.824	2.220	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H]1CCN(c2ccccc2F)C1=O	ZINC000177714920	285274876	/nfs/dbraw/zinc/27/48/76/285274876.db2.gz	XMXXABFTCUFXGN-WMLDXEAASA-N	0	3	319.424	2.347	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc(COC)cc2)CCN1CCOC	ZINC000120931817	195266358	/nfs/dbraw/zinc/26/63/58/195266358.db2.gz	WSECATNXXAVLHO-SFHVURJKSA-N	0	3	306.450	2.376	10	0		DEAEHN
c1cnc(N2CC[C@H]3[C@H]2CCN3Cc2ccc3c(c2)OCO3)nc1	ZINC000248342647	257107513	/nfs/dbraw/zinc/10/75/13/257107513.db2.gz	YOYFXKDQEPNCCL-LSDHHAIUSA-N	0	3	324.384	2.059	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C)c(F)c1	ZINC000121828447	195356826	/nfs/dbraw/zinc/35/68/26/195356826.db2.gz	AIEKAIPPKZHRSL-CYBMUJFWSA-N	0	3	323.412	2.165	10	0		DEAEHN
CN1CCC(CN2C(=O)C3(CC3)N[C@@H]2c2cccs2)CC1	ZINC000122019521	195390935	/nfs/dbraw/zinc/39/09/35/195390935.db2.gz	KVNVGCMSQKKOIH-AWEZNQCLSA-N	0	3	305.447	2.053	10	0		DEAEHN
CC(C)(C)NC(=O)COc1ccc(Br)c(CN)c1	ZINC000127982550	195926602	/nfs/dbraw/zinc/92/66/02/195926602.db2.gz	SMGAJFXRELRROP-UHFFFAOYSA-N	0	3	315.211	2.201	10	0		DEAEHN
C[C@@H](O)CN(Cc1ccc(Br)c(F)c1)[C@@H](C)CO	ZINC000190857653	533656430	/nfs/dbraw/zinc/65/64/30/533656430.db2.gz	JWFAHGHUKVHWBO-VHSXEESVSA-N	0	3	320.202	2.152	10	0		DEAEHN
C[C@H]1C[C@@]2(CCN1C(=O)OC(C)(C)C)NCCc1ncn(C)c12	ZINC000725242531	542769960	/nfs/dbraw/zinc/76/99/60/542769960.db2.gz	CCOAJLOSKMXREB-YVEFUNNKSA-N	0	3	320.437	2.181	10	0		DEAEHN
COc1cc(OC)c(CNCCN2CC=C(C)CC2)c(OC)c1	ZINC000358143614	133123905	/nfs/dbraw/zinc/12/39/05/133123905.db2.gz	SWJMCVYKUVINJG-UHFFFAOYSA-N	0	3	320.433	2.454	10	0		DEAEHN
Cc1ccc2[nH]c(CNC(=O)CC3CCN(C)CC3)nc2c1	ZINC000362854789	133255546	/nfs/dbraw/zinc/25/55/46/133255546.db2.gz	JHUBKJLGNWDTIB-UHFFFAOYSA-N	0	3	300.406	2.219	10	0		DEAEHN
C[C@H](N[C@@H]1CCC(=O)N[C@H]1C)c1cncc(Br)c1	ZINC000563446685	292057888	/nfs/dbraw/zinc/05/78/88/292057888.db2.gz	XGCPCGTZNATJPS-HOTUBEGUSA-N	0	3	312.211	2.162	10	0		DEAEHN
CC(C)C[C@H](CO)N(C)C(=O)NCC(C)(C)N1CCCCC1	ZINC000188190101	145008287	/nfs/dbraw/zinc/00/82/87/145008287.db2.gz	NFDOQUMOGYKQHI-OAHLLOKOSA-N	0	3	313.486	2.299	10	0		DEAEHN
CC(=O)Nc1ccc(C(=O)NCc2ccc3c(c2)CNC3)cc1	ZINC000188753512	145016777	/nfs/dbraw/zinc/01/67/77/145016777.db2.gz	DTJDNZMGLBUFFJ-UHFFFAOYSA-N	0	3	309.369	2.178	10	0		DEAEHN
CCn1cc([C@@H]2CN(CCN3CCC(C)CC3)CCO2)cn1	ZINC000190807559	145048952	/nfs/dbraw/zinc/04/89/52/145048952.db2.gz	YGEHVDRNUDKQFV-KRWDZBQOSA-N	0	3	306.454	2.008	10	0		DEAEHN
COCCN1CCC[C@H]1CNCc1ccc(Br)o1	ZINC000190944240	145050519	/nfs/dbraw/zinc/05/05/19/145050519.db2.gz	YUEHDUZSBJMWFO-NSHDSACASA-N	0	3	317.227	2.243	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2ccc(OCC3CC3)cc2)C[C@H]1C	ZINC000191335872	145056410	/nfs/dbraw/zinc/05/64/10/145056410.db2.gz	YPYOGQMKOYNXBH-HZPDHXFCSA-N	0	3	318.461	2.362	10	0		DEAEHN
Cc1cc(=O)[n-]c([C@@H](C)N2CCC(C[NH+]3CCCC3)CC2)n1	ZINC000192544792	145074896	/nfs/dbraw/zinc/07/48/96/145074896.db2.gz	OLIYMJAMATYFBG-CQSZACIVSA-N	0	3	304.438	2.359	10	0		DEAEHN
Cc1csc2c1ncnc2N[C@@H](C)CCN1CCN(C)CC1	ZINC000192779308	145078904	/nfs/dbraw/zinc/07/89/04/145078904.db2.gz	PFTUTMLXVPZEMG-ZDUSSCGKSA-N	0	3	319.478	2.438	10	0		DEAEHN
COc1ncccc1CN1C[C@@H](c2ccsc2)[C@H](CO)C1	ZINC000193568448	145086943	/nfs/dbraw/zinc/08/69/43/145086943.db2.gz	JPNCKQMUFQCUPU-GJZGRUSLSA-N	0	3	304.415	2.360	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(C(=O)[C@H]3[C@@H]4CCCC[C@@H]43)C2)CC1	ZINC000246459438	145103669	/nfs/dbraw/zinc/10/36/69/145103669.db2.gz	JLFBFMHQXKHJAO-WNRNVDISSA-N	0	3	319.493	2.051	10	0		DEAEHN
C[C@H](C(=O)NC[C@]1(O)CCc2ccccc21)N1[C@H](C)CC[C@@H]1C	ZINC000246518550	145105867	/nfs/dbraw/zinc/10/58/67/145105867.db2.gz	IURXOOJKROBWOE-NXEZDXNNSA-N	0	3	316.445	2.198	10	0		DEAEHN
COc1cc(OC)cc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1	ZINC000246605044	145107991	/nfs/dbraw/zinc/10/79/91/145107991.db2.gz	JDWLJCCISMFRFH-GUYCJALGSA-N	0	3	318.417	2.260	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCO[C@@H](c3ccsc3)C2)C1	ZINC000246632339	145109040	/nfs/dbraw/zinc/10/90/40/145109040.db2.gz	OIPGEKAFAWMPRD-LSDHHAIUSA-N	0	3	323.462	2.315	10	0		DEAEHN
CCc1nc([C@H](C)NC(=O)N2CCN3CCC[C@H]3C2)cs1	ZINC000246667412	145109958	/nfs/dbraw/zinc/10/99/58/145109958.db2.gz	SXFGEBPVVPOZTJ-RYUDHWBXSA-N	0	3	308.451	2.256	10	0		DEAEHN
C[C@H](COCc1ccccc1)NC(=O)N1CCN2CCC[C@H]2C1	ZINC000246889915	145118633	/nfs/dbraw/zinc/11/86/33/145118633.db2.gz	HDGTUBKBADDKNS-WBVHZDCISA-N	0	3	317.433	2.081	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cccc(C(=O)OC)c1	ZINC000247043890	145124599	/nfs/dbraw/zinc/12/45/99/145124599.db2.gz	VRRNYPMTZZTIQK-CVEARBPZSA-N	0	3	316.401	2.172	10	0		DEAEHN
Cc1ccc(OCC(=O)N2C[C@H]3CCCN3C[C@H]2C)c(C)c1	ZINC000247142724	145127680	/nfs/dbraw/zinc/12/76/80/145127680.db2.gz	JUYCSCGXXLMNFU-HZPDHXFCSA-N	0	3	302.418	2.377	10	0		DEAEHN
CN(C)[C@H](CNC(=O)NC[C@H]1CCCC[C@H]1O)c1ccccc1	ZINC000247283818	145131430	/nfs/dbraw/zinc/13/14/30/145131430.db2.gz	TTZVAZSYLMUUII-BRWVUGGUSA-N	0	3	319.449	2.140	10	0		DEAEHN
C[C@H](C(=O)N1CCC(Cn2cccn2)CC1)N1[C@H](C)CC[C@@H]1C	ZINC000247371607	145135097	/nfs/dbraw/zinc/13/50/97/145135097.db2.gz	NVFPWTRHOYJCFV-OWCLPIDISA-N	0	3	318.465	2.383	10	0		DEAEHN
Cc1ncsc1CN(C)C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000247462801	145137975	/nfs/dbraw/zinc/13/79/75/145137975.db2.gz	UNLJPTXCKDFUKE-YPMHNXCESA-N	0	3	310.467	2.322	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)CC1CCCCC1	ZINC000247486027	145138894	/nfs/dbraw/zinc/13/88/94/145138894.db2.gz	TVJDGKAOLWNPFD-HIFRSBDPSA-N	0	3	300.468	2.065	10	0		DEAEHN
Cc1ccc(-c2cc(C(=O)N3C[C@H]4CCC[N@H+]4C[C@H]3C)[n-]n2)o1	ZINC000247503894	145139827	/nfs/dbraw/zinc/13/98/27/145139827.db2.gz	VHLSUHDLKWQUQZ-DGCLKSJQSA-N	0	3	314.389	2.287	10	0		DEAEHN
Cc1ccc(-c2cc(C(=O)N3C[C@H]4CCC[N@@H+]4C[C@H]3C)[n-]n2)o1	ZINC000247503894	145139829	/nfs/dbraw/zinc/13/98/29/145139829.db2.gz	VHLSUHDLKWQUQZ-DGCLKSJQSA-N	0	3	314.389	2.287	10	0		DEAEHN
c1sc(-c2ccccn2)nc1CN1CCN2CCC[C@H]2C1	ZINC000247597855	145142066	/nfs/dbraw/zinc/14/20/66/145142066.db2.gz	SVIXCWWPXHWXDI-AWEZNQCLSA-N	0	3	300.431	2.485	10	0		DEAEHN
C[C@@H]1CCC[C@H](C)N1C(=O)CN1CC[C@@]2(O)CCCC[C@H]2C1	ZINC000248025724	145146166	/nfs/dbraw/zinc/14/61/66/145146166.db2.gz	OXELYCZDTSZMAT-DFGXFYAUSA-N	0	3	308.466	2.403	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)CN1CC[C@@]2(O)CCCC[C@@H]2C1	ZINC000248039267	145147984	/nfs/dbraw/zinc/14/79/84/145147984.db2.gz	SLDXRWFXEAFVDS-NUJGCVRESA-N	0	3	308.466	2.405	10	0		DEAEHN
C[C@@H](c1nc(-c2cccnc2)no1)N1CCN2CCCC[C@H]2C1	ZINC000248369785	145151736	/nfs/dbraw/zinc/15/17/36/145151736.db2.gz	WRIDYCPGCHQRMV-ZFWWWQNUSA-N	0	3	313.405	2.363	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)C1	ZINC000248824372	145168671	/nfs/dbraw/zinc/16/86/71/145168671.db2.gz	LRHFIUSCLKTVSK-GVDBMIGSSA-N	0	3	317.433	2.252	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCO[C@H](C3CC3)C2)CCN1C	ZINC000248867907	145170824	/nfs/dbraw/zinc/17/08/24/145170824.db2.gz	QHOVEKRRWUUVIQ-BVUBDWEXSA-N	0	3	309.454	2.068	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCC[C@H]2CCCCO2)CCN1C	ZINC000248887561	145172398	/nfs/dbraw/zinc/17/23/98/145172398.db2.gz	QVNDIPKXBSKFJS-OWCLPIDISA-N	0	3	311.470	2.460	10	0		DEAEHN
CCN(CCO)CCNC(=O)N[C@@H]1CC[C@@H](C)c2ccccc21	ZINC000248986364	145175396	/nfs/dbraw/zinc/17/53/96/145175396.db2.gz	KADICSSBIJCDOD-RHSMWYFYSA-N	0	3	319.449	2.238	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1N[C@H]1CCN(c2ccccc2Cl)C1=O	ZINC000249327562	145182040	/nfs/dbraw/zinc/18/20/40/145182040.db2.gz	SOSVFFGYJDBMPV-XBFCOCLRSA-N	0	3	308.809	2.460	10	0		DEAEHN
Cc1cc(=O)[nH]cc1C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000253556146	145203274	/nfs/dbraw/zinc/20/32/74/145203274.db2.gz	RNCYKLVIEKHQSO-RDJZCZTQSA-N	0	3	311.385	2.271	10	0		DEAEHN
COCc1cccc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)c1	ZINC000261810775	145229024	/nfs/dbraw/zinc/22/90/24/145229024.db2.gz	GMSVMCHRHVQCCD-IIDMSEBBSA-N	0	3	318.417	2.304	10	0		DEAEHN
CC(C)n1cc2cc(NC(=O)C3(N)CCOCC3)ccc2n1	ZINC000261840746	145232424	/nfs/dbraw/zinc/23/24/24/145232424.db2.gz	LQFPHKXQBPTJCG-UHFFFAOYSA-N	0	3	302.378	2.064	10	0		DEAEHN
CCc1ccccc1CNC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C	ZINC000261845465	145233090	/nfs/dbraw/zinc/23/30/90/145233090.db2.gz	IYZVNUXTWQSIEZ-TXPKVOOTSA-N	0	3	316.445	2.398	10	0		DEAEHN
COc1ccccc1[C@H]1CNCCN1Cc1noc(C2CC2)n1	ZINC000261874819	145236214	/nfs/dbraw/zinc/23/62/14/145236214.db2.gz	XWZMGEIYFNZUBW-CQSZACIVSA-N	0	3	314.389	2.102	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)NCc1ccc(F)c(F)c1	ZINC000261878062	145236830	/nfs/dbraw/zinc/23/68/30/145236830.db2.gz	MEAJIYSNQHUMPH-JDSLSITLSA-N	0	3	324.371	2.114	10	0		DEAEHN
NC1(C(=O)Nc2ncc(-c3ccccc3)s2)CCOCC1	ZINC000261908088	145240500	/nfs/dbraw/zinc/24/05/00/145240500.db2.gz	SNARMIJWZISOEM-UHFFFAOYSA-N	0	3	303.387	2.257	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C	ZINC000261910866	145240920	/nfs/dbraw/zinc/24/09/20/145240920.db2.gz	QEUHSYJGUZOUQU-GPMSIDNRSA-N	0	3	316.445	2.486	10	0		DEAEHN
COc1ccccc1[C@@H]1CNCCN1Cc1nc(C(C)C)no1	ZINC000262275015	145273097	/nfs/dbraw/zinc/27/30/97/145273097.db2.gz	TVCVJUUMUFPRFZ-AWEZNQCLSA-N	0	3	316.405	2.348	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)Nc1cc(F)cc(F)c1	ZINC000262460120	145284887	/nfs/dbraw/zinc/28/48/87/145284887.db2.gz	ILCKKAIJFZAFCQ-WOSRLPQWSA-N	0	3	310.344	2.436	10	0		DEAEHN
Cc1ccccc1CNC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000262558325	145292973	/nfs/dbraw/zinc/29/29/73/145292973.db2.gz	USJKAXYOUUZJNS-RVKKMQEKSA-N	0	3	302.418	2.144	10	0		DEAEHN
CCN(CC)Cc1cccc(NC(=O)[C@H]2CC(F)(F)CN2)c1	ZINC000262950883	145313709	/nfs/dbraw/zinc/31/37/09/145313709.db2.gz	JPWWXSHAQGFHFG-CQSZACIVSA-N	0	3	311.376	2.464	10	0		DEAEHN
Cc1ccccc1SCc1nc([C@H]2CNCCN2C)no1	ZINC000263204722	145336157	/nfs/dbraw/zinc/33/61/57/145336157.db2.gz	JOEISJNOCZYBOX-GFCCVEGCSA-N	0	3	304.419	2.246	10	0		DEAEHN
CC(C)c1ccc(OCc2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263203915	145336247	/nfs/dbraw/zinc/33/62/47/145336247.db2.gz	JKAWPPJLNOALAE-HNNXBMFYSA-N	0	3	316.405	2.348	10	0		DEAEHN
CCOc1ccc(/C=C/c2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263213559	145336795	/nfs/dbraw/zinc/33/67/95/145336795.db2.gz	KNFYCTADOHXIRR-RZIFZGNASA-N	0	3	314.389	2.215	10	0		DEAEHN
COC1CCC(N[C@@H](c2nccn2C)C2CCOCC2)CC1	ZINC000336912327	292160138	/nfs/dbraw/zinc/16/01/38/292160138.db2.gz	JFTTYPATLZLNLW-UYSNPLJNSA-N	0	3	307.438	2.435	10	0		DEAEHN
Cc1cccc(C(C)C)c1NC(=O)NC[C@@]1(O)CCN(C)C1	ZINC000358433522	147133913	/nfs/dbraw/zinc/13/39/13/147133913.db2.gz	HYIBEVMYTRKCBY-KRWDZBQOSA-N	0	3	305.422	2.307	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N(C)Cc1nc2ccccc2n1C	ZINC000358709503	147187259	/nfs/dbraw/zinc/18/72/59/147187259.db2.gz	AEAJZOOQNFFBQA-MRXNPFEDSA-N	0	3	314.433	2.406	10	0		DEAEHN
CC(=O)Nc1cccc(-n2cnnc2SC[C@@H](C)N(C)C)c1	ZINC000358857129	147219973	/nfs/dbraw/zinc/21/99/73/147219973.db2.gz	YJWKHCOPDIJNIJ-LLVKDONJSA-N	0	3	319.434	2.268	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)NCc1ccc2cc[nH]c2n1	ZINC000360712965	147372517	/nfs/dbraw/zinc/37/25/17/147372517.db2.gz	KUZYVWGBOARAIX-IUODEOHRSA-N	0	3	315.421	2.045	10	0		DEAEHN
C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000073896254	401724082	/nfs/dbraw/zinc/72/40/82/401724082.db2.gz	LLERNUWBHSHDTM-CJNGLKHVSA-N	0	3	315.417	2.107	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H]2CCc3ccccc32)C1	ZINC000111836861	401725535	/nfs/dbraw/zinc/72/55/35/401725535.db2.gz	PXLAMAVLMFGKST-HOTGVXAUSA-N	0	3	301.434	2.500	10	0		DEAEHN
C[C@H](NC(=O)C1CCN(C)CC1)c1cccc(-n2ccnc2)c1	ZINC000074173944	401732636	/nfs/dbraw/zinc/73/26/36/401732636.db2.gz	DSAKNUHRRRUCGA-AWEZNQCLSA-N	0	3	312.417	2.391	10	0		DEAEHN
CNc1cc(N2CCC[C@H]2CN[C@H](C)c2ccncc2)ncn1	ZINC000111227153	401701325	/nfs/dbraw/zinc/70/13/25/401701325.db2.gz	NBPAKKRERLVBBF-HIFRSBDPSA-N	0	3	312.421	2.233	10	0		DEAEHN
C[C@@H]1CN(C(=O)CN2CCC[C@@]3(CC=CCC3)C2)C[C@H](C)O1	ZINC000114495414	401802447	/nfs/dbraw/zinc/80/24/47/401802447.db2.gz	QYYTWTDYFOYGKQ-JZXOWHBKSA-N	0	3	306.450	2.445	10	0		DEAEHN
CC1(C)NC(=O)N(CCN2CCC[C@]3(CC=CCC3)C2)C1=O	ZINC000114493929	401802580	/nfs/dbraw/zinc/80/25/80/401802580.db2.gz	ZFCOXFGIDWLRFE-QGZVFWFLSA-N	0	3	305.422	2.139	10	0		DEAEHN
CCCC1(CNC(=O)NC[C@H]2CCCN2CCOC)CCC1	ZINC000128035379	401760239	/nfs/dbraw/zinc/76/02/39/401760239.db2.gz	RZMDHEPDESHUNW-OAHLLOKOSA-N	0	3	311.470	2.367	10	0		DEAEHN
C[C@H](Oc1ccc(F)cc1Cl)C(=O)N1CC[C@@H](N(C)C)C1	ZINC000112897502	401761229	/nfs/dbraw/zinc/76/12/29/401761229.db2.gz	IWMRFMHSUHPNRU-CMPLNLGQSA-N	0	3	314.788	2.409	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2ccc(C)cc2OC)C1	ZINC000128076007	401762009	/nfs/dbraw/zinc/76/20/09/401762009.db2.gz	ZPDYTXKLKZENPI-HNNXBMFYSA-N	0	3	305.422	2.287	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N2CC[C@@H]3OCCC[C@@H]3C2)c1	ZINC000128115529	401763664	/nfs/dbraw/zinc/76/36/64/401763664.db2.gz	GQOBSLZLOVUUFF-SJORKVTESA-N	0	3	302.418	2.389	10	0		DEAEHN
CC(C)N(CC(=O)NCc1ccccc1F)C1CCOCC1	ZINC000077323024	401810095	/nfs/dbraw/zinc/81/00/95/401810095.db2.gz	OOROETNTGPKHHM-UHFFFAOYSA-N	0	3	308.397	2.331	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)CC1CCCCC1	ZINC000113305823	401775826	/nfs/dbraw/zinc/77/58/26/401775826.db2.gz	TVJDGKAOLWNPFD-UKRRQHHQSA-N	0	3	300.468	2.065	10	0		DEAEHN
COc1cc(CN2CCC[C@@H](Cn3cncn3)C2)cc(OC)c1	ZINC000128518421	401780883	/nfs/dbraw/zinc/78/08/83/401780883.db2.gz	YGRRBDACCGZDDE-CQSZACIVSA-N	0	3	316.405	2.208	10	0		DEAEHN
Cc1cccc(CN(CCN(C)C)C(=O)NCC2(C)COC2)c1	ZINC000114968106	401816732	/nfs/dbraw/zinc/81/67/32/401816732.db2.gz	WQSFNXKLAHAQOR-UHFFFAOYSA-N	0	3	319.449	2.105	10	0		DEAEHN
COc1ccc(CC2CCN([C@@H]3CCN(C)C3=O)CC2)cc1	ZINC000116275107	401847946	/nfs/dbraw/zinc/84/79/46/401847946.db2.gz	TUUNWZDEUNKWNR-QGZVFWFLSA-N	0	3	302.418	2.180	10	0		DEAEHN
Cn1cc([C@@H]2CCN(CCC(=O)Nc3ccc(F)cc3)C2)cn1	ZINC000116317401	401849368	/nfs/dbraw/zinc/84/93/68/401849368.db2.gz	DVBZNQSAZXWSEG-CYBMUJFWSA-N	0	3	316.380	2.377	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)C2(c3ccc(Cl)cc3)CC2)CCO1	ZINC000116795829	401859484	/nfs/dbraw/zinc/85/94/84/401859484.db2.gz	ILRIZEXLAMMGRW-HNNXBMFYSA-N	0	3	322.836	2.161	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)Cc2ccc3ccccc3c2)CCO1	ZINC000116796549	401859890	/nfs/dbraw/zinc/85/98/90/401859890.db2.gz	PEOBPPHKVVNOGZ-SFHVURJKSA-N	0	3	312.413	2.171	10	0		DEAEHN
C[C@@H](CC(=O)N1CCO[C@@H](CN(C)C)C1)c1cccc(F)c1	ZINC000116797054	401860061	/nfs/dbraw/zinc/86/00/61/401860061.db2.gz	UVDRMOPECBOVLU-BBRMVZONSA-N	0	3	308.397	2.108	10	0		DEAEHN
CCOCCC1(CNC(=O)NCCN2CCCC[C@@H]2C)CC1	ZINC000132085953	401862064	/nfs/dbraw/zinc/86/20/64/401862064.db2.gz	WXTCGOBHVIKKNV-HNNXBMFYSA-N	0	3	311.470	2.367	10	0		DEAEHN
CCc1cc(C)c(C(=O)NC[C@H](C)CN2CCN(CC)CC2)o1	ZINC000132122522	401862775	/nfs/dbraw/zinc/86/27/75/401862775.db2.gz	LUJCVMFBGGEXJA-AWEZNQCLSA-N	0	3	321.465	2.154	10	0		DEAEHN
CCCn1cc(CN[C@H](CO)Cc2c[nH]c3ccccc23)cn1	ZINC000116918093	401864293	/nfs/dbraw/zinc/86/42/93/401864293.db2.gz	XGDOZUNRKDQQMF-INIZCTEOSA-N	0	3	312.417	2.468	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc(C(=O)OC(C)C)cc1	ZINC000135140645	401928014	/nfs/dbraw/zinc/92/80/14/401928014.db2.gz	QRCZHLFKIXHUKF-KRWDZBQOSA-N	0	3	309.406	2.129	10	0		DEAEHN
CC(C)(C)c1ccc(CNCCC(=O)N2CCOCC2)s1	ZINC000135298566	401934354	/nfs/dbraw/zinc/93/43/54/401934354.db2.gz	JFWPBEMOOVGEED-UHFFFAOYSA-N	0	3	310.463	2.384	10	0		DEAEHN
O=C(NCCc1cc(F)ccc1F)NC1CCN(C2CC2)CC1	ZINC000083173492	401900426	/nfs/dbraw/zinc/90/04/26/401900426.db2.gz	VVYPPRKTCGAYOL-UHFFFAOYSA-N	0	3	323.387	2.433	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(Br)cn1	ZINC000083550238	401901438	/nfs/dbraw/zinc/90/14/38/401901438.db2.gz	UORFEHKHFAXYTN-CMPLNLGQSA-N	0	3	324.222	2.153	10	0		DEAEHN
CC(C)N1CCCC[C@@H]1C(=O)N1CCC(n2ccnc2)CC1	ZINC000118782713	401907667	/nfs/dbraw/zinc/90/76/67/401907667.db2.gz	WBIWUCGEKVRKKL-MRXNPFEDSA-N	0	3	304.438	2.310	10	0		DEAEHN
Cc1ccc(NC(=O)N2CCO[C@H](CN(C)C)C2)c(Cl)c1	ZINC000118789088	401908172	/nfs/dbraw/zinc/90/81/72/401908172.db2.gz	LJUCUTIMQIINAM-GFCCVEGCSA-N	0	3	311.813	2.443	10	0		DEAEHN
CCOc1cc(C)ccc1NC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000118807167	401909090	/nfs/dbraw/zinc/90/90/90/401909090.db2.gz	BSCDPPUXYPMNLF-CQSZACIVSA-N	0	3	321.421	2.188	10	0		DEAEHN
COCCOc1ccc([C@@H](C)NCCc2nc(C)no2)cc1	ZINC000089518194	401950602	/nfs/dbraw/zinc/95/06/02/401950602.db2.gz	JYSRXXIWYZSAJC-GFCCVEGCSA-N	0	3	305.378	2.297	10	0		DEAEHN
C[C@@H](N[C@@H]1CCCN(c2cccnn2)C1)c1cncc(F)c1	ZINC000089732201	401959270	/nfs/dbraw/zinc/95/92/70/401959270.db2.gz	UWCHAPMSUQTHGJ-IUODEOHRSA-N	0	3	301.369	2.330	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Cc2cccc(OC(F)(F)F)c2)C1	ZINC000119942159	401972126	/nfs/dbraw/zinc/97/21/26/401972126.db2.gz	IVOWSKUKSAEREW-LBPRGKRZSA-N	0	3	316.323	2.290	10	0		DEAEHN
CCC[C@H](C(=O)N1CCCN(c2ccccc2)CC1)N(C)C	ZINC000137270612	401981866	/nfs/dbraw/zinc/98/18/66/401981866.db2.gz	WYBMWEGUZRXTQC-QGZVFWFLSA-N	0	3	303.450	2.456	10	0		DEAEHN
COc1ccc(C[C@@H](C)CNC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000120634422	401996376	/nfs/dbraw/zinc/99/63/76/401996376.db2.gz	AKXASLICZJIUSN-ZBFHGGJFSA-N	0	3	319.449	2.267	10	0		DEAEHN
c1ccc(OCCOCCN2CCS[C@H]3COCC[C@@H]32)cc1	ZINC000135547974	401944298	/nfs/dbraw/zinc/94/42/98/401944298.db2.gz	BUPOMMCRTNYVFS-IRXDYDNUSA-N	0	3	323.458	2.288	10	0		DEAEHN
CC[C@@H](C(=O)NCc1ccccc1-n1ccc(C)n1)N(C)C	ZINC000121365584	402031607	/nfs/dbraw/zinc/03/16/07/402031607.db2.gz	KRDVALOVYKGZGO-HNNXBMFYSA-N	0	3	300.406	2.137	10	0		DEAEHN
CCNC(=O)CCN1CCC[C@H]1c1ccc(OC)c(OC)c1	ZINC000051283900	402033214	/nfs/dbraw/zinc/03/32/14/402033214.db2.gz	JMFOYDOGYNQGNZ-AWEZNQCLSA-N	0	3	306.406	2.367	10	0		DEAEHN
CCN(CC)C(=O)C[C@H](C)NCc1cccnc1-n1ccnc1	ZINC000151533252	402041997	/nfs/dbraw/zinc/04/19/97/402041997.db2.gz	QATRHDOFGOCTAL-AWEZNQCLSA-N	0	3	315.421	2.004	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2ccc(OC)cc2)C1	ZINC000052497352	402042969	/nfs/dbraw/zinc/04/29/69/402042969.db2.gz	HAOKBVVFIUQIBB-HNNXBMFYSA-N	0	3	305.422	2.021	10	0		DEAEHN
CCOCCC1(CNC(=O)N[C@H]2CCCN(CC)C2)CCC1	ZINC000151642388	402048048	/nfs/dbraw/zinc/04/80/48/402048048.db2.gz	SQJLRJVCQBKROO-HNNXBMFYSA-N	0	3	311.470	2.367	10	0		DEAEHN
COc1ccc(NC(=O)C2(N)Cc3ccccc3C2)cc1F	ZINC000150943540	402005756	/nfs/dbraw/zinc/00/57/56/402005756.db2.gz	WOGSKMZDWQZGRK-UHFFFAOYSA-N	0	3	300.333	2.269	10	0		DEAEHN
CC[N@@H+]1CC[C@@H](N(C)C(=O)c2cc(OC)ccc2[O-])[C@H](C)C1	ZINC000122293609	402070464	/nfs/dbraw/zinc/07/04/64/402070464.db2.gz	NRGIMLIIYAMLJE-IUODEOHRSA-N	0	3	306.406	2.203	10	0		DEAEHN
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(OC)ccc2[O-])[C@H](C)C1	ZINC000122293609	402070467	/nfs/dbraw/zinc/07/04/67/402070467.db2.gz	NRGIMLIIYAMLJE-IUODEOHRSA-N	0	3	306.406	2.203	10	0		DEAEHN
CC(C)N(C)CC(=O)N1C[C@@H](C)O[C@@H](c2ccc(F)cc2)C1	ZINC000152194287	402081075	/nfs/dbraw/zinc/08/10/75/402081075.db2.gz	KRGWTELGHNNQKH-CZUORRHYSA-N	0	3	308.397	2.454	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cc(-c3cccnc3)on2)CCN1C	ZINC000123026149	402106659	/nfs/dbraw/zinc/10/66/59/402106659.db2.gz	SNBAJNHDJOYMNL-OCCSQVGLSA-N	0	3	314.389	2.291	10	0		DEAEHN
COCCN(C)CCCNC(=O)N[C@@H](C)c1ccccc1C	ZINC000061188072	402107533	/nfs/dbraw/zinc/10/75/33/402107533.db2.gz	KEEHJLZIKZONKT-HNNXBMFYSA-N	0	3	307.438	2.324	10	0		DEAEHN
CC(C)N(C(=O)CN1CCC[C@H](Cc2nccn2C)C1)C(C)C	ZINC000123625656	402138668	/nfs/dbraw/zinc/13/86/68/402138668.db2.gz	WWFGFNLFJSXKFO-MRXNPFEDSA-N	0	3	320.481	2.320	10	0		DEAEHN
CCC[C@H](Cc1ccccc1)N(CCC)CC(=O)NC(N)=O	ZINC000066900130	402145602	/nfs/dbraw/zinc/14/56/02/402145602.db2.gz	UUSOLDCORQWUGW-OAHLLOKOSA-N	0	3	305.422	2.305	10	0		DEAEHN
CN(CC1CCN(C)CC1)C(=O)c1coc(Br)c1	ZINC000103451935	402189305	/nfs/dbraw/zinc/18/93/05/402189305.db2.gz	GKZMNCGMYMXAEU-UHFFFAOYSA-N	0	3	315.211	2.456	10	0		DEAEHN
COC(=O)CCNC(=O)CN[C@@H](C)c1ccc(CC(C)C)cc1	ZINC000102685582	402170507	/nfs/dbraw/zinc/17/05/07/402170507.db2.gz	JGLFYIBATYGGME-AWEZNQCLSA-N	0	3	320.433	2.215	10	0		DEAEHN
COc1ccc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c(OC)c1	ZINC000124277715	402172720	/nfs/dbraw/zinc/17/27/20/402172720.db2.gz	WGGMXOFHDBGNDW-STQMWFEESA-N	0	3	306.406	2.259	10	0		DEAEHN
CCOCCNC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000153850513	402174840	/nfs/dbraw/zinc/17/48/40/402174840.db2.gz	RUYAOVQMPGKXJP-SFHVURJKSA-N	0	3	319.449	2.377	10	0		DEAEHN
CC(C)OC[C@H](O)CN1CCC[C@@H]1c1ccc2c(c1)OCO2	ZINC000102950529	402175670	/nfs/dbraw/zinc/17/56/70/402175670.db2.gz	CNXOUWBGIBHGJF-HUUCEWRRSA-N	0	3	307.390	2.338	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC[C@@H]1c1c(C)nn(C)c1C)N(C)C	ZINC000155631580	402263562	/nfs/dbraw/zinc/26/35/62/402263562.db2.gz	MVKGTKKKGHSFCX-CABCVRRESA-N	0	3	306.454	2.431	10	0		DEAEHN
c1ccc(-c2nnc([C@@H]3CCCN3CCC3OCCO3)[nH]2)cc1	ZINC000125215775	402219522	/nfs/dbraw/zinc/21/95/22/402219522.db2.gz	CNRKZFCSRUZNPV-AWEZNQCLSA-N	0	3	314.389	2.372	10	0		DEAEHN
COc1ncc(C)cc1NC(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000125301410	402224811	/nfs/dbraw/zinc/22/48/11/402224811.db2.gz	BUXLOERSONUQJP-GXTWGEPZSA-N	0	3	306.410	2.249	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccn(C2CCCC2)n1	ZINC000154812692	402233739	/nfs/dbraw/zinc/23/37/39/402233739.db2.gz	DLMKSXRJJNEXJU-UKRRQHHQSA-N	0	3	302.422	2.307	10	0		DEAEHN
CN(C)[C@@H](CNC(=O)c1cnn2c1CCCC2)c1ccccc1	ZINC000125941753	402257703	/nfs/dbraw/zinc/25/77/03/402257703.db2.gz	HXAJUGKNUAXYOR-KRWDZBQOSA-N	0	3	312.417	2.252	10	0		DEAEHN
CCn1nccc1CCN1C[C@@H](O)C[C@@H]1c1cccc(F)c1	ZINC000225787129	402323797	/nfs/dbraw/zinc/32/37/97/402323797.db2.gz	NWPKKTRWXIBBBQ-DLBZAZTESA-N	0	3	303.381	2.393	10	0		DEAEHN
CN1CCC(NC(=O)N2CCCC[C@H]2c2nccs2)CC1	ZINC000176146726	402283516	/nfs/dbraw/zinc/28/35/16/402283516.db2.gz	SLVYGCRSMBRSRA-ZDUSSCGKSA-N	0	3	308.451	2.474	10	0		DEAEHN
CCCCNC(=O)C1(NCCC(=O)NC(C)C)CCCCC1	ZINC000176378967	402304263	/nfs/dbraw/zinc/30/42/63/402304263.db2.gz	MFOOZIRJTUIDIF-UHFFFAOYSA-N	0	3	311.470	2.110	10	0		DEAEHN
Cc1cc(F)ccc1CCNC(=O)N1CCN2CCC[C@H]2C1	ZINC000176424289	402308235	/nfs/dbraw/zinc/30/82/35/402308235.db2.gz	GOZLDOYLPOSDGQ-INIZCTEOSA-N	0	3	305.397	2.166	10	0		DEAEHN
CCN1CCN(c2cccc(NC(=O)N[C@@H]3C[C@H]3C)c2)CC1	ZINC000184919572	402309806	/nfs/dbraw/zinc/30/98/06/402309806.db2.gz	PJBCQBJNTUPMNC-CZUORRHYSA-N	0	3	302.422	2.358	10	0		DEAEHN
CC(C)N1C[C@H](N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)[C@@H](C)C1	ZINC000159099273	402317266	/nfs/dbraw/zinc/31/72/66/402317266.db2.gz	HXEZMZLVPYHCEJ-ZQIUZPCESA-N	0	3	324.490	2.469	10	0		DEAEHN
CC(C)c1nnc(CCC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)o1	ZINC000176896289	402347536	/nfs/dbraw/zinc/34/75/36/402347536.db2.gz	BPMUZGRXCZJGEH-QWHCGFSZSA-N	0	3	308.426	2.067	10	0		DEAEHN
CCc1cccc(NC(=O)C(=O)N(C)C[C@H]2CCCN2CC)c1	ZINC000176898187	402348385	/nfs/dbraw/zinc/34/83/85/402348385.db2.gz	WTKCWGACFKJGKN-MRXNPFEDSA-N	0	3	317.433	2.130	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cccnc1N1CCCC1	ZINC000176980500	402356461	/nfs/dbraw/zinc/35/64/61/402356461.db2.gz	UUSTZQLXDNXBSJ-HNNXBMFYSA-N	0	3	316.449	2.238	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@@H](Cc1ccccc1)N(C)C	ZINC000176999296	402358250	/nfs/dbraw/zinc/35/82/50/402358250.db2.gz	DIOKHSLEQYZGPH-QZTJIDSGSA-N	0	3	317.477	2.102	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1ccc(OC)cc1	ZINC000177024667	402360434	/nfs/dbraw/zinc/36/04/34/402360434.db2.gz	DKJUYVUZNPHOFY-OAHLLOKOSA-N	0	3	305.422	2.321	10	0		DEAEHN
CC(C)C[C@@H](C)C(=O)NCc1ccnc(OCCN(C)C)c1	ZINC000185549085	402360839	/nfs/dbraw/zinc/36/08/39/402360839.db2.gz	ODGVDZOYDCBVLM-CQSZACIVSA-N	0	3	307.438	2.320	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(-c2cccnc2)on1	ZINC000177026270	402360974	/nfs/dbraw/zinc/36/09/74/402360974.db2.gz	MYZJGUCESUYOGN-AWEZNQCLSA-N	0	3	314.389	2.293	10	0		DEAEHN
Cc1cc(=O)[nH]cc1C(=O)NC[C@H](N)c1ccc(C(C)C)cc1	ZINC000236728854	402378544	/nfs/dbraw/zinc/37/85/44/402378544.db2.gz	IRLQIQGGBUNZHW-INIZCTEOSA-N	0	3	313.401	2.237	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1Cc1ccc(-n2ccnc2)nc1	ZINC000177372558	402395452	/nfs/dbraw/zinc/39/54/52/402395452.db2.gz	UGWXWNKJFFMOOB-KRWDZBQOSA-N	0	3	322.416	2.437	10	0		DEAEHN
CN(CC1CCN(C[C@H](O)c2ccccc2)CC1)C(=O)C1CC1	ZINC000177461316	402404823	/nfs/dbraw/zinc/40/48/23/402404823.db2.gz	LWLNGRKIHQIBFP-SFHVURJKSA-N	0	3	316.445	2.300	10	0		DEAEHN
CCO[C@H]1C[C@@H](NCc2cn3ccccc3n2)C12CCOCC2	ZINC000186211668	402410910	/nfs/dbraw/zinc/41/09/10/402410910.db2.gz	CISRECOJWMKYJY-CVEARBPZSA-N	0	3	315.417	2.398	10	0		DEAEHN
CCC[C@@H](C(=O)NCCCc1nc2ccccc2n1C)N(C)C	ZINC000162169502	402412025	/nfs/dbraw/zinc/41/20/25/402412025.db2.gz	QFMXAVMFGKLYDN-INIZCTEOSA-N	0	3	316.449	2.352	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H](C)CCc1cccn1C	ZINC000177550225	402415124	/nfs/dbraw/zinc/41/51/24/402415124.db2.gz	ZPNJXJWMGQMHFH-DOTOQJQBSA-N	0	3	320.481	2.472	10	0		DEAEHN
Cc1nn(C)c(C)c1CCNC(=O)[C@H](C)[C@H](N)c1ccccc1	ZINC000237708734	402418538	/nfs/dbraw/zinc/41/85/38/402418538.db2.gz	LZRSJFLATHBHPQ-PXAZEXFGSA-N	0	3	314.433	2.032	10	0		DEAEHN
NC1(C(=O)N2CCC(Oc3ccc(F)cc3)CC2)CCCC1	ZINC000237881856	402424730	/nfs/dbraw/zinc/42/47/30/402424730.db2.gz	QMBUWNLWNAJRNR-UHFFFAOYSA-N	0	3	306.381	2.467	10	0		DEAEHN
COC(C)(C)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000177678177	402425353	/nfs/dbraw/zinc/42/53/53/402425353.db2.gz	FTMZVYHJAZYNDA-UHFFFAOYSA-N	0	3	320.433	2.254	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)NCc1ccccc1F	ZINC000177700877	402427676	/nfs/dbraw/zinc/42/76/76/402427676.db2.gz	OCTOAVGJXSAKDF-HOCLYGCPSA-N	0	3	321.440	2.247	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)NCCc1cccs1	ZINC000177713964	402429505	/nfs/dbraw/zinc/42/95/05/402429505.db2.gz	RDGHAHJIZHTKDA-LSDHHAIUSA-N	0	3	323.506	2.211	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccccc1O	ZINC000177818983	402438887	/nfs/dbraw/zinc/43/88/87/402438887.db2.gz	IROPOAWGQGZIFG-CVEARBPZSA-N	0	3	302.418	2.410	10	0		DEAEHN
CC1(C)C[C@H](NC2CCS(=O)(=O)CC2)c2ccccc2O1	ZINC000163074264	402440644	/nfs/dbraw/zinc/44/06/44/402440644.db2.gz	LZNAINOFYWAODA-AWEZNQCLSA-N	0	3	309.431	2.456	10	0		DEAEHN
CC1(C)C[C@@H](NC2CCS(=O)(=O)CC2)c2ccccc2O1	ZINC000163074375	402440999	/nfs/dbraw/zinc/44/09/99/402440999.db2.gz	LZNAINOFYWAODA-CQSZACIVSA-N	0	3	309.431	2.456	10	0		DEAEHN
C[C@H](NC(=O)CCc1ccnn1C)[C@@H](c1ccccc1)N(C)C	ZINC000185949652	402391961	/nfs/dbraw/zinc/39/19/61/402391961.db2.gz	YSIIYOAPCOWODX-KSSFIOAISA-N	0	3	314.433	2.160	10	0		DEAEHN
CCS(=O)(=O)C[C@H](C)N[C@H](C)c1ccccc1-n1cccn1	ZINC000177332467	402392269	/nfs/dbraw/zinc/39/22/69/402392269.db2.gz	CNFDDSJXDLRMEA-UONOGXRCSA-N	0	3	321.446	2.346	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCC[C@@H]1CCCCO1	ZINC000186624917	402449205	/nfs/dbraw/zinc/44/92/05/402449205.db2.gz	OECUYCXWRVDNNN-CVEARBPZSA-N	0	3	311.470	2.461	10	0		DEAEHN
COC[C@H](NCc1ccc(N2CCCC2)nc1)C1CCOCC1	ZINC000187750974	402510643	/nfs/dbraw/zinc/51/06/43/402510643.db2.gz	YMOWTBORQUYHDP-KRWDZBQOSA-N	0	3	319.449	2.213	10	0		DEAEHN
C[C@H](C(=O)Nc1ccc2c(c1)OCC(=O)N2)N1[C@H](C)CC[C@@H]1C	ZINC000245202047	402452546	/nfs/dbraw/zinc/45/25/46/402452546.db2.gz	PBDVYQLFCHTPTP-GRYCIOLGSA-N	0	3	317.389	2.217	10	0		DEAEHN
Cc1ccc(CN2CCC(CN3CCOCC3)CC2)c(C)n1	ZINC000186680802	402454448	/nfs/dbraw/zinc/45/44/48/402454448.db2.gz	VHOFIFKPPLETPL-UHFFFAOYSA-N	0	3	303.450	2.243	10	0		DEAEHN
C[C@H]1CC[C@@H](C(=O)NC2CCN(CCc3ccccc3)CC2)O1	ZINC000178057464	402456115	/nfs/dbraw/zinc/45/61/15/402456115.db2.gz	KJEKYBNQJRIDLR-YJBOKZPZSA-N	0	3	316.445	2.377	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)NC[C@@H]1CCCS1	ZINC000164390705	402461858	/nfs/dbraw/zinc/46/18/58/402461858.db2.gz	ONGQDLYEPGGRHX-CVEARBPZSA-N	0	3	321.490	2.354	10	0		DEAEHN
COc1ccccc1-c1nnc(CN(C)CCN(C)C2CC2)o1	ZINC000186756354	402462058	/nfs/dbraw/zinc/46/20/58/402462058.db2.gz	GBHSXKABSPTGDI-UHFFFAOYSA-N	0	3	316.405	2.271	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cnn(CC(C)C)c1C	ZINC000164509881	402463655	/nfs/dbraw/zinc/46/36/55/402463655.db2.gz	IBIHNLPEWCKRBP-OAHLLOKOSA-N	0	3	306.454	2.404	10	0		DEAEHN
CC(C)n1cnnc1[C@H]1CCCN(C[C@@H](O)COC(C)(C)C)C1	ZINC000245541117	402469306	/nfs/dbraw/zinc/46/93/06/402469306.db2.gz	QECRSEDGJMACFK-LSDHHAIUSA-N	0	3	324.469	2.214	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCCN(C2CC2)CC1)c1nccs1	ZINC000187011508	402477987	/nfs/dbraw/zinc/47/79/87/402477987.db2.gz	JTUGHOXMDNVTGX-LBPRGKRZSA-N	0	3	308.451	2.126	10	0		DEAEHN
C[C@@H]1CC[C@@](CO)(N(C)CC(=O)N(C2CC2)C2CCCC2)C1	ZINC000187922686	402512957	/nfs/dbraw/zinc/51/29/57/402512957.db2.gz	DKRQRROQJPYSPH-RDTXWAMCSA-N	0	3	308.466	2.403	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@@H]1CCCN(C(C)C)C1=O	ZINC000178288949	402480353	/nfs/dbraw/zinc/48/03/53/402480353.db2.gz	WQSGLMIORYSFER-JKSUJKDBSA-N	0	3	304.438	2.055	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1Cc1nc(-c2ccoc2)no1	ZINC000178303996	402482900	/nfs/dbraw/zinc/48/29/00/402482900.db2.gz	QEVXZWBEVYUXNB-CQSZACIVSA-N	0	3	313.361	2.499	10	0		DEAEHN
COc1cc(F)cc(CNC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c1	ZINC000245725935	402483487	/nfs/dbraw/zinc/48/34/87/402483487.db2.gz	DTFFQWLQTOATQT-CABCVRRESA-N	0	3	321.396	2.212	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc(OC3COC3)cc2)C1	ZINC000187159957	402485594	/nfs/dbraw/zinc/48/55/94/402485594.db2.gz	UKXICPYIOYOKIZ-AWEZNQCLSA-N	0	3	319.405	2.070	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1csc([C@H]2CCCO2)n1	ZINC000245881146	402494141	/nfs/dbraw/zinc/49/41/41/402494141.db2.gz	IARLFILKQYDICR-YRGRVCCFSA-N	0	3	321.446	2.303	10	0		DEAEHN
C[N@@H+]1CC[C@H]2[C@@H](CCCN2C(=O)NCc2ccc([O-])c(F)c2)C1	ZINC000246016746	402503708	/nfs/dbraw/zinc/50/37/08/402503708.db2.gz	UNAXLXYSKFISAU-ZFWWWQNUSA-N	0	3	321.396	2.157	10	0		DEAEHN
C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)NCc2ccc([O-])c(F)c2)C1	ZINC000246016746	402503711	/nfs/dbraw/zinc/50/37/11/402503711.db2.gz	UNAXLXYSKFISAU-ZFWWWQNUSA-N	0	3	321.396	2.157	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)cc1C	ZINC000246034822	402504769	/nfs/dbraw/zinc/50/47/69/402504769.db2.gz	ARTBBOCNLZBALN-GDBMZVCRSA-N	0	3	310.463	2.310	10	0		DEAEHN
CS[C@@H](C(=O)NC[C@H](O)CN1CCCCC1)c1ccccc1	ZINC000178517934	402506904	/nfs/dbraw/zinc/50/69/04/402506904.db2.gz	AIIOFVKLFSKPTK-JKSUJKDBSA-N	0	3	322.474	2.054	10	0		DEAEHN
CC1(C)CCCN1CC(=O)N1CCN(Cc2cccs2)CC1	ZINC000171066920	402554136	/nfs/dbraw/zinc/55/41/36/402554136.db2.gz	JEUADUVQQDKIGK-UHFFFAOYSA-N	0	3	321.490	2.267	10	0		DEAEHN
CCCCCc1nnc(NC(=O)N2CC[C@H](N(C)C)C2)s1	ZINC000171071415	402554593	/nfs/dbraw/zinc/55/45/93/402554593.db2.gz	IQAYSXBPPIENCW-NSHDSACASA-N	0	3	311.455	2.439	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H]2CCCO[C@H]2C(C)C)C1	ZINC000247098650	402556921	/nfs/dbraw/zinc/55/69/21/402556921.db2.gz	QGYDLHRDLVSDKH-JYJNAYRXSA-N	0	3	311.470	2.221	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000189821209	402560383	/nfs/dbraw/zinc/56/03/83/402560383.db2.gz	RXKPUXGJDSXTSA-QMCVQRASSA-N	0	3	302.418	2.363	10	0		DEAEHN
C[C@H]1CN(C2CCN(Cc3ccnc(Cl)c3)CC2)CCO1	ZINC000171147092	402561968	/nfs/dbraw/zinc/56/19/68/402561968.db2.gz	ORKMQUFYDZQQGL-ZDUSSCGKSA-N	0	3	309.841	2.420	10	0		DEAEHN
Cc1noc2ncc(C(=O)N(C)[C@@H]3CCN(C)[C@@H](C)C3)cc12	ZINC000247535792	402571439	/nfs/dbraw/zinc/57/14/39/402571439.db2.gz	XQXIHTPORWWLPT-GXFFZTMASA-N	0	3	302.378	2.086	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)c2cccc(F)c2)[C@@H](C)C1	ZINC000246243492	402519615	/nfs/dbraw/zinc/51/96/15/402519615.db2.gz	RYOLLJHINLBBSO-WFASDCNBSA-N	0	3	314.426	2.177	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)N(C)C	ZINC000178645955	402521190	/nfs/dbraw/zinc/52/11/90/402521190.db2.gz	CQGPQALZTATGCC-HZPDHXFCSA-N	0	3	308.397	2.456	10	0		DEAEHN
CC(=O)Nc1cccc([C@H](C)NC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000170828593	402530474	/nfs/dbraw/zinc/53/04/74/402530474.db2.gz	SZODTJVXMFHNGM-BLLLJJGKSA-N	0	3	318.421	2.052	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Cn2ccc3ccc(Cl)cc32)C1	ZINC000170855742	402533212	/nfs/dbraw/zinc/53/32/12/402533212.db2.gz	MOOQHRXEERNPSI-CQSZACIVSA-N	0	3	305.809	2.457	10	0		DEAEHN
COc1ccc(C(=O)N2CC[C@@H](N(C)C)C2)cc1OC(F)F	ZINC000170865888	402534906	/nfs/dbraw/zinc/53/49/06/402534906.db2.gz	AWKLRDYREAUVFC-LLVKDONJSA-N	0	3	314.332	2.073	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)Nc2cccc3c2OCCO3)C1	ZINC000246532786	402535613	/nfs/dbraw/zinc/53/56/13/402535613.db2.gz	UXCMMVGFCNPBHS-GXTWGEPZSA-N	0	3	319.405	2.308	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@@H](C)NCCN1CCO[C@H](C)C1	ZINC000178767781	402537010	/nfs/dbraw/zinc/53/70/10/402537010.db2.gz	QMFLXJPXGXEYLN-ZIAGYGMSSA-N	0	3	308.470	2.318	10	0		DEAEHN
CCCN(CCC)C(=O)CCC(=O)N[C@@H]1CCCN(CC)C1	ZINC000170903723	402540163	/nfs/dbraw/zinc/54/01/63/402540163.db2.gz	RMCUJSSHUPQNTN-OAHLLOKOSA-N	0	3	311.470	2.016	10	0		DEAEHN
C[C@H](CNC(=O)NCCCc1ccccn1)N1CCC(C)CC1	ZINC000179188797	402579593	/nfs/dbraw/zinc/57/95/93/402579593.db2.gz	WBVJJHFVCQXAFJ-MRXNPFEDSA-N	0	3	318.465	2.434	10	0		DEAEHN
CC[C@H](C)[C@H](O)CNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248136227	402583292	/nfs/dbraw/zinc/58/32/92/402583292.db2.gz	XNLRIEVQHRGXRI-LLLHUVSDSA-N	0	3	319.449	2.138	10	0		DEAEHN
COc1ccc(/C=C/C(=O)N2CCN3CCC[C@H]3C2)cc1OC	ZINC000171584448	402597232	/nfs/dbraw/zinc/59/72/32/402597232.db2.gz	INNYAUSKAARTAZ-VFADXPBXSA-N	0	3	316.401	2.024	10	0		DEAEHN
COc1ccc(CN2CCCN(C3CC3)CC2)c(OC)c1OC	ZINC000179729324	402599014	/nfs/dbraw/zinc/59/90/14/402599014.db2.gz	MPTMSFMQJDAJTN-UHFFFAOYSA-N	0	3	320.433	2.383	10	0		DEAEHN
COc1cc(OC)c(CN2CCCN(C3CC3)CC2)c(OC)c1	ZINC000179731953	402599146	/nfs/dbraw/zinc/59/91/46/402599146.db2.gz	ICZSHIHTIFIARE-UHFFFAOYSA-N	0	3	320.433	2.383	10	0		DEAEHN
C[C@@H](Nc1ccc(OC2CCN(C)CC2)nc1)[C@@H]1CCOC1	ZINC000179743328	402599633	/nfs/dbraw/zinc/59/96/33/402599633.db2.gz	PMTGHRHQSFDFQN-ZIAGYGMSSA-N	0	3	305.422	2.392	10	0		DEAEHN
CC(C)=CCC[C@H](C)CCN1CC[C@@H](NS(C)(=O)=O)C1	ZINC000248648494	402601861	/nfs/dbraw/zinc/60/18/61/402601861.db2.gz	JTTMHOXHQCGRHH-LSDHHAIUSA-N	0	3	302.484	2.383	10	0		DEAEHN
CC(C)(C)OC[C@H](O)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000248694114	402603957	/nfs/dbraw/zinc/60/39/57/402603957.db2.gz	JHBIISMITHGVKK-QAPCUYQASA-N	0	3	305.418	2.294	10	0		DEAEHN
Nc1nc(CN2CCC(c3ccn[nH]3)CC2)nc2ccccc12	ZINC000171639816	402605313	/nfs/dbraw/zinc/60/53/13/402605313.db2.gz	KVCZMQHYAYGJCW-UHFFFAOYSA-N	0	3	308.389	2.315	10	0		DEAEHN
COC(=O)C1CCC(C(=O)N(CCN(C)C)C2CCCC2)CC1	ZINC000180048035	402605595	/nfs/dbraw/zinc/60/55/95/402605595.db2.gz	RZXKTXUVZYYUTM-UHFFFAOYSA-N	0	3	324.465	2.299	10	0		DEAEHN
COc1c(C)cc(CN2C[C@H](C)[C@H](N3CCOCC3)C2)cc1C	ZINC000180228218	402610148	/nfs/dbraw/zinc/61/01/48/402610148.db2.gz	ZJXIYKOOPIHHDE-FUHWJXTLSA-N	0	3	318.461	2.465	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1n[nH]c2c1CCCCC2	ZINC000248909903	402613995	/nfs/dbraw/zinc/61/39/95/402613995.db2.gz	MRHCOFMXFHWCSV-KBPBESRZSA-N	0	3	316.449	2.377	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)Nc2ccc(-c3ncon3)cc2)C1	ZINC000171738544	402616979	/nfs/dbraw/zinc/61/69/79/402616979.db2.gz	WCOAXHHCEXXLHE-LBPRGKRZSA-N	0	3	315.377	2.200	10	0		DEAEHN
C[C@@H]1CSCCN(CC(=O)N2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000249020702	402617746	/nfs/dbraw/zinc/61/77/46/402617746.db2.gz	KSYOQGNPICJQFY-NWDGAFQWSA-N	0	3	324.412	2.472	10	0		DEAEHN
CC(C)n1ccnc1CN1CCC(N2CCO[C@@H](C)C2)CC1	ZINC000171749987	402617775	/nfs/dbraw/zinc/61/77/75/402617775.db2.gz	DCVCSUXPBZOPQC-HNNXBMFYSA-N	0	3	306.454	2.149	10	0		DEAEHN
CCNC(=O)CCN1[C@H](C(=O)OC(C)(C)C)C[C@@H]2CCCC[C@@H]21	ZINC000249397992	402628422	/nfs/dbraw/zinc/62/84/22/402628422.db2.gz	BMIFDURBCUCIFD-KKUMJFAQSA-N	0	3	324.465	2.487	10	0		DEAEHN
CCc1nc2c(s1)[C@H](N[C@H]1CCc3ncnn3C1)CCC2	ZINC000180608084	402621498	/nfs/dbraw/zinc/62/14/98/402621498.db2.gz	MLNNSEOPBJTGBV-WDEREUQCSA-N	0	3	303.435	2.279	10	0		DEAEHN
COC[C@@H](Cc1ccccc1)N(C)C[C@@H](O)COC(C)(C)C	ZINC000249149507	402622291	/nfs/dbraw/zinc/62/22/91/402622291.db2.gz	XKQKXPROJPTSAY-IAGOWNOFSA-N	0	3	309.450	2.352	10	0		DEAEHN
COC(=O)[C@H]1C[C@H](c2ccccc2)CN(Cc2ccnn2C)C1	ZINC000180719851	402624533	/nfs/dbraw/zinc/62/45/33/402624533.db2.gz	TYRXHTMOUCGKOM-HOTGVXAUSA-N	0	3	313.401	2.199	10	0		DEAEHN
Cc1ccc(OCCCNC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000171906301	402632327	/nfs/dbraw/zinc/63/23/27/402632327.db2.gz	WHPMQQMHMJPPIU-INIZCTEOSA-N	0	3	317.433	2.254	10	0		DEAEHN
O=C(NCCCOC1CCCCC1)N1CCN2CCC[C@H]2C1	ZINC000171899180	402632621	/nfs/dbraw/zinc/63/26/21/402632621.db2.gz	MMNIZXIXXBZKRR-HNNXBMFYSA-N	0	3	309.454	2.215	10	0		DEAEHN
Cc1cc(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc(=O)[nH]1	ZINC000180888746	402629381	/nfs/dbraw/zinc/62/93/81/402629381.db2.gz	IYWQTAGYMLRPBH-DOTOQJQBSA-N	0	3	311.385	2.271	10	0		DEAEHN
CCCc1ccc(NC(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000181130220	402635833	/nfs/dbraw/zinc/63/58/33/402635833.db2.gz	HJJZBGUHEJJMJM-INIZCTEOSA-N	0	3	305.422	2.433	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)N[C@H](c2ccccc2)C2CC2)CCO1	ZINC000172118661	402641365	/nfs/dbraw/zinc/64/13/65/402641365.db2.gz	FHMAXBSIQQNWRW-IAGOWNOFSA-N	0	3	317.433	2.110	10	0		DEAEHN
Cc1cccc(CNC(=O)N[C@H](C)CN2CCC[C@@H](C)C2)n1	ZINC000249789604	402642004	/nfs/dbraw/zinc/64/20/04/402642004.db2.gz	UAAFGNAMTJBWKE-UKRRQHHQSA-N	0	3	304.438	2.310	10	0		DEAEHN
CNC(=O)c1ccc(CN(C)C[C@@H](O)C2CCCCC2)cc1	ZINC000191267668	402655463	/nfs/dbraw/zinc/65/54/63/402655463.db2.gz	KOCBUTVBTXIFBV-QGZVFWFLSA-N	0	3	304.434	2.419	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@](C)(Cc1ccccc1)[C@@H](C)O)N(C)C	ZINC000192049168	402707832	/nfs/dbraw/zinc/70/78/32/402707832.db2.gz	CVPCLDBAIPKEDZ-SZVBFZGTSA-N	0	3	320.477	2.463	10	0		DEAEHN
C[C@@H](CS(C)(=O)=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000182677449	402708108	/nfs/dbraw/zinc/70/81/08/402708108.db2.gz	UPDPIUOCTNXYBZ-RDJZCZTQSA-N	0	3	324.490	2.064	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NCC[C@H]1CCCCO1	ZINC000182807388	402718094	/nfs/dbraw/zinc/71/80/94/402718094.db2.gz	QLUAGNQHRRCPMC-OAHLLOKOSA-N	0	3	320.433	2.316	10	0		DEAEHN
Cc1ncsc1CN1C[C@@H](F)C[C@H]1CN(C)[C@@H]1CCOC1	ZINC000253416909	402664780	/nfs/dbraw/zinc/66/47/80/402664780.db2.gz	OJJAVWHXEYLDHK-MJBXVCDLSA-N	0	3	313.442	2.085	10	0		DEAEHN
CC[C@H](NC(=O)N1CCCN(C2CC2)CC1)c1nccs1	ZINC000172615670	402666330	/nfs/dbraw/zinc/66/63/30/402666330.db2.gz	STAYAHRCTXJPML-ZDUSSCGKSA-N	0	3	308.451	2.474	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2snnc2C(C)(C)C)C1	ZINC000191457478	402671409	/nfs/dbraw/zinc/67/14/09/402671409.db2.gz	WVGFVPGZCLYSLB-NWDGAFQWSA-N	0	3	322.478	2.392	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@](C)(O)C2CCCCC2)C1	ZINC000191493520	402673718	/nfs/dbraw/zinc/67/37/18/402673718.db2.gz	CNMMMZQTSSCFHH-RDJZCZTQSA-N	0	3	311.470	2.101	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N[C@@H]1CCc3ncnn3C1)CCS2	ZINC000191529717	402676586	/nfs/dbraw/zinc/67/65/86/402676586.db2.gz	SXZXYVGGKAQBBR-BXUZGUMPSA-N	0	3	316.430	2.428	10	0		DEAEHN
O[C@H](CSC[C@@H]1CCCO1)CN1CCc2ccccc2C1	ZINC000191610502	402681291	/nfs/dbraw/zinc/68/12/91/402681291.db2.gz	JVMBSFIJODCBAX-IRXDYDNUSA-N	0	3	307.459	2.318	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1cccc(F)c1C	ZINC000173025569	402683010	/nfs/dbraw/zinc/68/30/10/402683010.db2.gz	CFVTWSIDXRECLZ-NSHDSACASA-N	0	3	302.415	2.143	10	0		DEAEHN
CC(C)OCCN1CCC(N(C)CC(=O)OC(C)(C)C)CC1	ZINC000191978007	402702243	/nfs/dbraw/zinc/70/22/43/402702243.db2.gz	SYELRHCQHCMIKZ-UHFFFAOYSA-N	0	3	314.470	2.149	10	0		DEAEHN
CN(CCCN1CCN(C)CC1)Cc1nc2cc(F)ccc2o1	ZINC000182954371	402729407	/nfs/dbraw/zinc/72/94/07/402729407.db2.gz	JLQFVUHSSNSKGJ-UHFFFAOYSA-N	0	3	320.412	2.036	10	0		DEAEHN
CC1(C)CCc2ccccc2[C@@H]1NCC(=O)N1CCOCC1	ZINC000183130702	402741972	/nfs/dbraw/zinc/74/19/72/402741972.db2.gz	KOJPKRXCPWIRBQ-KRWDZBQOSA-N	0	3	302.418	2.149	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)Nc1cnn(CC2CC2)c1	ZINC000174481767	402743468	/nfs/dbraw/zinc/74/34/68/402743468.db2.gz	RGAGMKCZLVQONL-ZDUSSCGKSA-N	0	3	305.426	2.289	10	0		DEAEHN
C[C@@H](NCC(=O)N(Cc1ccccc1)C1CC1)[C@H]1CCCO1	ZINC000183174783	402744628	/nfs/dbraw/zinc/74/46/28/402744628.db2.gz	IUTBZZXTCBNGIT-RHSMWYFYSA-N	0	3	302.418	2.335	10	0		DEAEHN
C[C@@H](NC(=O)c1ccnc(OCCN(C)C)c1)C1CCCC1	ZINC000183206560	402746873	/nfs/dbraw/zinc/74/68/73/402746873.db2.gz	IPJDTQXVOAZBGR-CYBMUJFWSA-N	0	3	305.422	2.331	10	0		DEAEHN
CCOCCNC(=O)CN[C@@H]1c2ccccc2CCC1(C)C	ZINC000183224844	402748555	/nfs/dbraw/zinc/74/85/55/402748555.db2.gz	MIAMHPHEQSWHGH-QGZVFWFLSA-N	0	3	304.434	2.442	10	0		DEAEHN
CCCC[C@H](CC)CNC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000192803984	402750857	/nfs/dbraw/zinc/75/08/57/402750857.db2.gz	ZFLUPXFLMJVLKC-JKSUJKDBSA-N	0	3	313.486	2.349	10	0		DEAEHN
Cc1cccc(O[C@H](C)c2nc([C@H]3CNCCN3C)no2)c1	ZINC000263263013	402751479	/nfs/dbraw/zinc/75/14/79/402751479.db2.gz	RECJTIYTFDRTFW-TZMCWYRMSA-N	0	3	302.378	2.094	10	0		DEAEHN
COc1ccccc1N1CC[C@H](N[C@H](C)c2ccnn2C)C1	ZINC000192952921	402758192	/nfs/dbraw/zinc/75/81/92/402758192.db2.gz	BVWNHYRVIXVGBL-KGLIPLIRSA-N	0	3	300.406	2.358	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(Cc3ccc(Cl)nc3)C2)CC1	ZINC000174881321	402761115	/nfs/dbraw/zinc/76/11/15/402761115.db2.gz	URDRUQKFIGJNTK-INIZCTEOSA-N	0	3	322.884	2.337	10	0		DEAEHN
CCCCOC[C@H](O)CN[C@@H](C)c1cccc(NC(C)=O)c1	ZINC000193241381	402768630	/nfs/dbraw/zinc/76/86/30/402768630.db2.gz	XBUVLGQNZJJECO-SUMWQHHRSA-N	0	3	308.422	2.473	10	0		DEAEHN
CCc1ccc([C@H](CN2CCOCC2)N[C@H]2CCCOC2)cc1	ZINC000183563525	402776134	/nfs/dbraw/zinc/77/61/34/402776134.db2.gz	XNIFQARHTAVSFC-OALUTQOASA-N	0	3	318.461	2.391	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc(OC)c(OC)c2)C1	ZINC000194317038	402791938	/nfs/dbraw/zinc/79/19/38/402791938.db2.gz	FRSGGGXYEDYCPS-ZDUSSCGKSA-N	0	3	307.394	2.310	10	0		DEAEHN
CC(C)C(=O)Nc1ccc(C(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000195330009	402842144	/nfs/dbraw/zinc/84/21/44/402842144.db2.gz	LAYIJAFGQPOBLE-MRXNPFEDSA-N	0	3	315.417	2.201	10	0		DEAEHN
CCc1c(C(=O)N2CCN3CCC[C@H]3C2)cnn1-c1ccccc1	ZINC000195329240	402842349	/nfs/dbraw/zinc/84/23/49/402842349.db2.gz	MZIVLCFKQYMOLO-INIZCTEOSA-N	0	3	324.428	2.355	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)N1CCCc2ccccc21	ZINC000175344854	402799065	/nfs/dbraw/zinc/79/90/65/402799065.db2.gz	NVAFQWFZOCUBOW-QGZVFWFLSA-N	0	3	315.461	2.382	10	0		DEAEHN
O[C@@H]1c2ccccc2C[C@H]1N1CCCN(c2ccccn2)CC1	ZINC000183811399	402799807	/nfs/dbraw/zinc/79/98/07/402799807.db2.gz	QXMPTOBGJORKTR-IEBWSBKVSA-N	0	3	309.413	2.252	10	0		DEAEHN
CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1cc(OC)ccc1[O-]	ZINC000175437918	402806607	/nfs/dbraw/zinc/80/66/07/402806607.db2.gz	NHXXVFHUINHQPS-CHWSQXEVSA-N	0	3	304.390	2.100	10	0		DEAEHN
CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc(OC)ccc1[O-]	ZINC000175437918	402806608	/nfs/dbraw/zinc/80/66/08/402806608.db2.gz	NHXXVFHUINHQPS-CHWSQXEVSA-N	0	3	304.390	2.100	10	0		DEAEHN
O=C(CCCOc1ccc(F)cc1F)N1CCN2CCC[C@@H]2C1	ZINC000195338886	402842968	/nfs/dbraw/zinc/84/29/68/402842968.db2.gz	GXGXTKHWUBXQOU-CQSZACIVSA-N	0	3	324.371	2.430	10	0		DEAEHN
CN1CCC[C@@H]1CNC(=O)c1c[nH]nc1-c1ccc(F)cc1	ZINC000194714039	402812020	/nfs/dbraw/zinc/81/20/20/402812020.db2.gz	IGHGNFOOLRKAKP-CYBMUJFWSA-N	0	3	302.353	2.040	10	0		DEAEHN
CCN1CCN(CCCCNC(=O)N2C[C@@H](C)CC[C@@H]2C)CC1	ZINC000175531892	402815196	/nfs/dbraw/zinc/81/51/96/402815196.db2.gz	QUPZZQKSDXSOIF-IRXDYDNUSA-N	0	3	324.513	2.234	10	0		DEAEHN
CCN1CCN(CCCCNC(=O)N2C[C@@H](C)CC[C@H]2C)CC1	ZINC000175531931	402815364	/nfs/dbraw/zinc/81/53/64/402815364.db2.gz	QUPZZQKSDXSOIF-DLBZAZTESA-N	0	3	324.513	2.234	10	0		DEAEHN
COc1cccc([C@@H](C)C(=O)N2CCCN(C3CC3)CC2)c1	ZINC000195410343	402844761	/nfs/dbraw/zinc/84/47/61/402844761.db2.gz	SKBSUPLVAARDQH-CQSZACIVSA-N	0	3	302.418	2.495	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)N2CCC[C@H]2c2ccc[nH]2)CN1C1CC1	ZINC000267912128	403040835	/nfs/dbraw/zinc/04/08/35/403040835.db2.gz	ZYAXVKZIHLWZSC-WWGRRREGSA-N	0	3	302.422	2.486	10	0		DEAEHN
Cn1cc(-c2cc(CN3CC[C@@H](N4CCCCC4)C3)on2)cn1	ZINC000274418937	403053744	/nfs/dbraw/zinc/05/37/44/403053744.db2.gz	NTWQCHPYFJXYED-OAHLLOKOSA-N	0	3	315.421	2.135	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1occc1Br	ZINC000268155128	403055256	/nfs/dbraw/zinc/05/52/56/403055256.db2.gz	PJOMZOPMUYRMTJ-SECBINFHSA-N	0	3	301.184	2.208	10	0		DEAEHN
Cn1cc([C@@H]2NC(=O)CC[C@H]2NCc2cccc3cc[nH]c32)cn1	ZINC000275660057	403113193	/nfs/dbraw/zinc/11/31/93/403113193.db2.gz	UZGQEQJUDHVQFW-QAPCUYQASA-N	0	3	323.400	2.011	10	0		DEAEHN
CN1CC[C@]2(CCN(C(=O)c3coc(Br)c3)C2)C1	ZINC000292261619	403337338	/nfs/dbraw/zinc/33/73/38/403337338.db2.gz	POPCDDBSKMGQQV-ZDUSSCGKSA-N	0	3	313.195	2.210	10	0		DEAEHN
Cc1nocc1CNC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000293229474	403420919	/nfs/dbraw/zinc/42/09/19/403420919.db2.gz	KNRBBBLRAPFNIP-GOSISDBHSA-N	0	3	315.417	2.364	10	0		DEAEHN
COC[C@@H]1C[C@@H](OC)CN1Cc1cnc(-c2ccccc2)[nH]1	ZINC000343866853	403768054	/nfs/dbraw/zinc/76/80/54/403768054.db2.gz	ICUSFWNPOXJNQR-JKSUJKDBSA-N	0	3	301.390	2.312	10	0		DEAEHN
COc1coc(CN(C)[C@H](C)Cc2ccc(O)cc2)cc1=O	ZINC000361729985	403828264	/nfs/dbraw/zinc/82/82/64/403828264.db2.gz	WKVUQTBXHDWZEK-GFCCVEGCSA-N	0	3	303.358	2.417	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCC[C@H](CC(=O)OC(C)C)C1	ZINC000361807928	403877165	/nfs/dbraw/zinc/87/71/65/403877165.db2.gz	LLZNNJMUKCQLQX-CVEARBPZSA-N	0	3	324.465	2.441	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCC[C@H](CC(=O)OC(C)C)C1	ZINC000361807930	403877849	/nfs/dbraw/zinc/87/78/49/403877849.db2.gz	LLZNNJMUKCQLQX-HZPDHXFCSA-N	0	3	324.465	2.441	10	0		DEAEHN
CC(C)[C@H](N)c1cn(Cc2ccc(Br)cn2)nn1	ZINC000305908288	403951000	/nfs/dbraw/zinc/95/10/00/403951000.db2.gz	GVHDOVORPQQNET-LBPRGKRZSA-N	0	3	310.199	2.140	10	0		DEAEHN
CN(C)c1cccc(NC(=O)N2CC[C@@]3(C2)CCCN(C)C3)n1	ZINC000296104058	404094570	/nfs/dbraw/zinc/09/45/70/404094570.db2.gz	AWYUZPNBFQZYIF-KRWDZBQOSA-N	0	3	317.437	2.097	10	0		DEAEHN
c1cn(CCCNCc2ccccc2OCc2ccncc2)nn1	ZINC000344295658	404037554	/nfs/dbraw/zinc/03/75/54/404037554.db2.gz	LXKWXUYZEBHNJN-UHFFFAOYSA-N	0	3	323.400	2.432	10	0		DEAEHN
C[C@H](NC1CCC2(CC1)OCCO2)c1nnc2n1CCCCC2	ZINC000319683737	404057204	/nfs/dbraw/zinc/05/72/04/404057204.db2.gz	JWSZKRQLAHKRSD-ZDUSSCGKSA-N	0	3	320.437	2.341	10	0		DEAEHN
CC(=O)N1CC[C@H](NCC[C@H](C)[S@](C)=O)c2ccccc2C1	ZINC000352847750	404661285	/nfs/dbraw/zinc/66/12/85/404661285.db2.gz	GGTUOBVTPBOJKF-SRMJIJMDSA-N	0	3	322.474	2.227	10	0		DEAEHN
Cc1c2ccccc2oc1CNC(=O)NCCNc1ccncc1	ZINC000360869344	404841387	/nfs/dbraw/zinc/84/13/87/404841387.db2.gz	CZKKTXFVCURLDV-UHFFFAOYSA-N	0	3	324.384	2.469	10	0		DEAEHN
c1cn(-c2ccccc2)nc1CN[C@H]1CCO[C@]2(CCOC2)C1	ZINC000367365676	405025951	/nfs/dbraw/zinc/02/59/51/405025951.db2.gz	QOHHAWVUGWNDFX-MAUKXSAKSA-N	0	3	313.401	2.300	10	0		DEAEHN
CCn1cc(Br)cc1C(=O)N[C@H]1CCN(CC)C1	ZINC000389976078	405043439	/nfs/dbraw/zinc/04/34/39/405043439.db2.gz	IZSAHGPBNLFJEA-NSHDSACASA-N	0	3	314.227	2.095	10	0		DEAEHN
CCCN1CC[C@H](NC(=O)c2nscc2Br)C1	ZINC000404868438	405069729	/nfs/dbraw/zinc/06/97/29/405069729.db2.gz	XCYJIMOXIKEKNU-QMMMGPOBSA-N	0	3	318.240	2.120	10	0		DEAEHN
COc1ccc(Br)cc1CNC[C@@H]1[C@H]2COC[C@H]21	ZINC000367573463	405088432	/nfs/dbraw/zinc/08/84/32/405088432.db2.gz	HTXPKNMRLCAMJZ-XYYAHUGASA-N	0	3	312.207	2.440	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CCCC[C@@H](N3CCCC3)C2)o1	ZINC000408096404	405111522	/nfs/dbraw/zinc/11/15/22/405111522.db2.gz	BCFRTACZSNBVJN-CQSZACIVSA-N	0	3	312.435	2.227	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N1CC(=O)N1CCO[C@@H](c2cccc(O)c2)C1	ZINC000408351559	405183540	/nfs/dbraw/zinc/18/35/40/405183540.db2.gz	GFIPEQFUQJDQDM-JKIFEVAISA-N	0	3	318.417	2.165	10	0		DEAEHN
c1c[nH]c([C@@H]2CCCN2CCc2nnnn2-c2ccccc2)c1	ZINC000438754543	405254072	/nfs/dbraw/zinc/25/40/72/405254072.db2.gz	PNIRNEANTKJTCS-INIZCTEOSA-N	0	3	308.389	2.370	10	0		DEAEHN
Cc1ccc2[nH]c(CNC(=O)N(CCN(C)C)C(C)C)nc2c1	ZINC000440240257	405307032	/nfs/dbraw/zinc/30/70/32/405307032.db2.gz	KIVQUFLKDOUMRO-UHFFFAOYSA-N	0	3	317.437	2.353	10	0		DEAEHN
Cc1ccc2nc(CNC(=O)N(CCN(C)C)C(C)C)[nH]c2c1	ZINC000440240257	405307033	/nfs/dbraw/zinc/30/70/33/405307033.db2.gz	KIVQUFLKDOUMRO-UHFFFAOYSA-N	0	3	317.437	2.353	10	0		DEAEHN
COCCN(C(=O)Nc1ccccc1CCN(C)C)C1CC1	ZINC000446589973	405385874	/nfs/dbraw/zinc/38/58/74/405385874.db2.gz	MVIVINRBUVEMJL-UHFFFAOYSA-N	0	3	305.422	2.433	10	0		DEAEHN
CC(C)(C)OC(=O)c1ccc(CN[C@]2(CCO)CCOC2)cc1	ZINC000447090837	405402101	/nfs/dbraw/zinc/40/21/01/405402101.db2.gz	MQVNCDSWTGONES-GOSISDBHSA-N	0	3	321.417	2.273	10	0		DEAEHN
c1cc(CN2CCOCC3(CC3)C2)ccc1CN1CCOCC1	ZINC000420931105	405408534	/nfs/dbraw/zinc/40/85/34/405408534.db2.gz	FWDXSKDKLWWGRQ-UHFFFAOYSA-N	0	3	316.445	2.131	10	0		DEAEHN
C[C@@H](CNC(=O)N1C[C@H](C)O[C@@H](c2ccccc2)C1)N(C)C	ZINC000455430152	405408737	/nfs/dbraw/zinc/40/87/37/405408737.db2.gz	JLGWKBDMLDMQCA-OFQRWUPVSA-N	0	3	305.422	2.108	10	0		DEAEHN
CN(C)CCn1nccc1NC(=O)N[C@@H]1CCC12CCCC2	ZINC000455656789	405440641	/nfs/dbraw/zinc/44/06/41/405440641.db2.gz	LFJZVIQIYVSIBN-CYBMUJFWSA-N	0	3	305.426	2.289	10	0		DEAEHN
COC[C@@H](C)CNCc1snc(OC)c1Br	ZINC000638445376	405472653	/nfs/dbraw/zinc/47/26/53/405472653.db2.gz	NJAVKWSHZNLKRT-ZETCQYMHSA-N	0	3	309.229	2.286	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2ccc(C)c(C)c2)CC12COC2	ZINC000449365806	405526849	/nfs/dbraw/zinc/52/68/49/405526849.db2.gz	QIYFBMGALXEIRE-MRXNPFEDSA-N	0	3	303.402	2.315	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NC[C@H]1CCCC12CC2	ZINC000638794586	405674004	/nfs/dbraw/zinc/67/40/04/405674004.db2.gz	FBDWWKFWEGLGTC-SJORKVTESA-N	0	3	315.461	2.142	10	0		DEAEHN
CCc1noc(C)c1CN1CC2(CCOCC2)CC[C@H]1CO	ZINC000528637912	405689668	/nfs/dbraw/zinc/68/96/68/405689668.db2.gz	HOOLKTVHQUGPKL-AWEZNQCLSA-N	0	3	308.422	2.299	10	0		DEAEHN
O=C(NCC1CCCCCC1)N[C@@H]1CCCN(CCCO)C1	ZINC000459038359	405707431	/nfs/dbraw/zinc/70/74/31/405707431.db2.gz	ZGGLQCPSCLXULU-MRXNPFEDSA-N	0	3	311.470	2.103	10	0		DEAEHN
CC[C@](C)(NC(=O)[C@H](N)CN(C)Cc1ccccc1)C1CC1	ZINC000638858131	405720349	/nfs/dbraw/zinc/72/03/49/405720349.db2.gz	LQRUNFSHGNDQCV-AEFFLSMTSA-N	0	3	303.450	2.141	10	0		DEAEHN
CO[C@H](CNC[C@H]1CCCCS1(=O)=O)C1CCCCC1	ZINC000639035635	405833112	/nfs/dbraw/zinc/83/31/12/405833112.db2.gz	FUINKMUMGYHYLX-HUUCEWRRSA-N	0	3	303.468	2.139	10	0		DEAEHN
c1ccc(N2CC[C@H](CN3CCO[C@@]4(CCOC4)C3)C2)cc1	ZINC000639052050	405847579	/nfs/dbraw/zinc/84/75/79/405847579.db2.gz	HTWMELBXTQPPOY-AEFFLSMTSA-N	0	3	302.418	2.004	10	0		DEAEHN
CC(=O)[C@](C)(O)CN1CC[C@H](OCCCc2ccccc2)C1	ZINC000450477066	405919374	/nfs/dbraw/zinc/91/93/74/405919374.db2.gz	UMSBMELCRXGHNY-ZWKOTPCHSA-N	0	3	305.418	2.050	10	0		DEAEHN
CCn1nnc(C)c1CN1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000562516171	406022386	/nfs/dbraw/zinc/02/23/86/406022386.db2.gz	IXBARULUKNZDDQ-HNNXBMFYSA-N	0	3	314.437	2.244	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN(C)CCc1cccc(Br)c1	ZINC000451059717	406033752	/nfs/dbraw/zinc/03/37/52/406033752.db2.gz	OAMPZCABGNEYEW-AWEZNQCLSA-N	0	3	314.223	2.263	10	0		DEAEHN
COc1nsc(CNCC[C@@H](C)CCO)c1Br	ZINC000639214246	405979886	/nfs/dbraw/zinc/97/98/86/405979886.db2.gz	OBZRFVKRLMANIT-MRVPVSSYSA-N	0	3	323.256	2.412	10	0		DEAEHN
C(c1nc(C2CCC2)no1)N1CCCN(C[C@H]2CCCO2)CC1	ZINC000639450363	406093483	/nfs/dbraw/zinc/09/34/83/406093483.db2.gz	KXDSJCMKAHXFKI-OAHLLOKOSA-N	0	3	320.437	2.024	10	0		DEAEHN
c1ccc(CN2CCCO[C@H](CN3C[C@@H]4C[C@H]3CS4)C2)cc1	ZINC000459784542	406045359	/nfs/dbraw/zinc/04/53/59/406045359.db2.gz	AEUDCQMPYYSGEX-BZSNNMDCSA-N	0	3	318.486	2.467	10	0		DEAEHN
c1nc2n(n1)[C@@H](CN1CCC[C@]3(C1)OCc1ccccc13)CC2	ZINC000639593871	406160556	/nfs/dbraw/zinc/16/05/56/406160556.db2.gz	WVJJUTRSYLLYHS-CRAIPNDOSA-N	0	3	310.401	2.287	10	0		DEAEHN
CNS(=O)(=O)c1cccc(CN[C@@H]2CC[C@H]2C2CCC2)c1	ZINC000516787302	406106360	/nfs/dbraw/zinc/10/63/60/406106360.db2.gz	JOEMMTZILFNPOI-JKSUJKDBSA-N	0	3	308.447	2.263	10	0		DEAEHN
C[C@]1(F)CNCCN(Cc2nc3cc(Cl)ccc3c(=O)[nH]2)C1	ZINC000569003101	292383359	/nfs/dbraw/zinc/38/33/59/292383359.db2.gz	QGYYCAJAMASQDQ-HNNXBMFYSA-N	0	3	324.787	2.122	10	0		DEAEHN
C[C@@H]1[C@H](CO)CCN1CC(=O)N(C)[C@H]1CCCc2ccccc21	ZINC000488731363	406341594	/nfs/dbraw/zinc/34/15/94/406341594.db2.gz	JKKOTMDAEWWFQU-HFTRVMKXSA-N	0	3	316.445	2.225	10	0		DEAEHN
CCCCN(C(=O)[C@H](N)CN(C)Cc1ccccc1)C1CC1	ZINC000637938006	406485940	/nfs/dbraw/zinc/48/59/40/406485940.db2.gz	ZQMVJQQMTICXMX-QGZVFWFLSA-N	0	3	303.450	2.237	10	0		DEAEHN
C[C@H]1CC[C@H](C)N1CC(=O)Nc1cccc(N2CCOCC2)c1	ZINC000524797247	406462372	/nfs/dbraw/zinc/46/23/72/406462372.db2.gz	XYVSVGQDVOLDDZ-GJZGRUSLSA-N	0	3	317.433	2.335	10	0		DEAEHN
NC[C@@H](NC(=O)c1csc(C(F)(F)F)c1)C(F)(F)F	ZINC000638396254	406747595	/nfs/dbraw/zinc/74/75/95/406747595.db2.gz	AKJMWJSEKRVOGG-RXMQYKEDSA-N	0	3	306.231	2.386	10	0		DEAEHN
C[C@@H](N[C@H]1CCc2ncnn2C1)c1ccc(F)cc1N(C)C	ZINC000180594418	287071750	/nfs/dbraw/zinc/07/17/50/287071750.db2.gz	GCCRCVNPHYUXEW-YPMHNXCESA-N	0	3	303.385	2.149	10	0		DEAEHN
CCNc1ncc(Br)c(NC2CCN(C)CC2)n1	ZINC000129118414	196021273	/nfs/dbraw/zinc/02/12/73/196021273.db2.gz	JSQKGIRVJHHUIT-UHFFFAOYSA-N	0	3	314.231	2.177	10	0		DEAEHN
CCNC(C)(C)C(=O)Nc1ncc(Br)cc1C	ZINC000129564413	196057968	/nfs/dbraw/zinc/05/79/68/196057968.db2.gz	POCIYQNOLPECBU-UHFFFAOYSA-N	0	3	300.200	2.479	10	0		DEAEHN
C[C@H](NC(=O)C(C)(C)N1CCNCC1)c1ccccc1Cl	ZINC000129697101	196068826	/nfs/dbraw/zinc/06/88/26/196068826.db2.gz	JNYLHBYZXBIBKI-LBPRGKRZSA-N	0	3	309.841	2.201	10	0		DEAEHN
O=C1C[C@@H](NCCCC(F)(F)F)C(=O)N1C1CCCCC1	ZINC000130546368	196089953	/nfs/dbraw/zinc/08/99/53/196089953.db2.gz	QJSJXDYRJYCDDE-LLVKDONJSA-N	0	3	306.328	2.379	10	0		DEAEHN
O=C1C[C@H](NCCCC(F)(F)F)C(=O)N1c1ccccc1	ZINC000130547949	196089981	/nfs/dbraw/zinc/08/99/81/196089981.db2.gz	KTWPDEBVIRGIIP-NSHDSACASA-N	0	3	300.280	2.251	10	0		DEAEHN
CC(C)n1ncnc1C[C@@H](N)c1ccc(Br)cn1	ZINC000130779311	196109461	/nfs/dbraw/zinc/10/94/61/196109461.db2.gz	XOHPYNVEFWQNRL-SNVBAGLBSA-N	0	3	310.199	2.259	10	0		DEAEHN
CCN[C@@H](C)c1c(CC)nn(CCCS(C)(=O)=O)c1CC	ZINC000131115399	196141384	/nfs/dbraw/zinc/14/13/84/196141384.db2.gz	IBTYCTBYBSELGS-LBPRGKRZSA-N	0	3	315.483	2.113	10	0		DEAEHN
CC(C)[C@@](C)(C[NH3+])[N-]S(=O)(=O)c1ccc(F)cc1Cl	ZINC000131156714	196144812	/nfs/dbraw/zinc/14/48/12/196144812.db2.gz	TWZKWUUWNVYIAM-GFCCVEGCSA-N	0	3	308.806	2.131	10	0		DEAEHN
CS(=O)(=O)CCC[C@@H](N)c1ccc(F)cc1Br	ZINC000131306490	196159289	/nfs/dbraw/zinc/15/92/89/196159289.db2.gz	APZJTNPQJMIZNY-LLVKDONJSA-N	0	3	324.215	2.413	10	0		DEAEHN
COc1ccc(C(N)=S)cc1CN(C)[C@@H]1CCCC[C@@H]1O	ZINC000131720903	196193989	/nfs/dbraw/zinc/19/39/89/196193989.db2.gz	CBJLTKRPYZLGMJ-KGLIPLIRSA-N	0	3	308.447	2.065	10	0		DEAEHN
CCN[C@H](C)c1ccc(OCCS(=O)(=O)CC)c(F)c1	ZINC000131792624	196199311	/nfs/dbraw/zinc/19/93/11/196199311.db2.gz	PVNKQYXUERIMLW-LLVKDONJSA-N	0	3	303.399	2.310	10	0		DEAEHN
C[C@H]1CNC[C@@H](COCc2ccc(Br)cc2)O1	ZINC000132683228	196275690	/nfs/dbraw/zinc/27/56/90/196275690.db2.gz	OFZMUOSBSLYQQL-GWCFXTLKSA-N	0	3	300.196	2.343	10	0		DEAEHN
CCn1ncc(Br)c1[C@]1(O)CCN2CCC[C@@H]2C1	ZINC000132986535	196301848	/nfs/dbraw/zinc/30/18/48/196301848.db2.gz	ZVFSGUFUPZCABF-MFKMUULPSA-N	0	3	314.227	2.111	10	0		DEAEHN
CCNCc1sc(N2CCS(=O)CC2)nc1[C@@H](C)CC	ZINC000133101095	196311690	/nfs/dbraw/zinc/31/16/90/196311690.db2.gz	UPCIDGOQEQLGFL-NSHDSACASA-N	0	3	315.508	2.335	10	0		DEAEHN
CC[C@H](C)c1nc(N(CCOC)CCOC)sc1CN	ZINC000133134913	196314065	/nfs/dbraw/zinc/31/40/65/196314065.db2.gz	BOQNRTLXDFVFSU-NSHDSACASA-N	0	3	301.456	2.215	10	0		DEAEHN
CC[C@@H](CSC)NS(=O)(=O)c1cccc([C@H](C)NC)c1	ZINC000133237941	196324011	/nfs/dbraw/zinc/32/40/11/196324011.db2.gz	RPFJBBXTCRJYIU-AAEUAGOBSA-N	0	3	316.492	2.387	10	0		DEAEHN
CN[C@@H](CC[C@@H]1CCCO1)c1c(Br)cnn1C	ZINC000133733005	196332007	/nfs/dbraw/zinc/33/20/07/196332007.db2.gz	FOBWGJIHQDHHHH-ONGXEEELSA-N	0	3	302.216	2.402	10	0		DEAEHN
COc1ccc2c(c1)-c1nc(N3CCNCC3)sc1CC2	ZINC000134024701	196354867	/nfs/dbraw/zinc/35/48/67/196354867.db2.gz	HYTGIBORRFNJKU-UHFFFAOYSA-N	0	3	301.415	2.327	10	0		DEAEHN
CCS(=O)(=O)N1CC(CNc2ccnc3c(C)cccc23)C1	ZINC000302586471	230309507	/nfs/dbraw/zinc/30/95/07/230309507.db2.gz	VHPYZNIMSLLXLO-UHFFFAOYSA-N	0	3	319.430	2.237	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC[C@H](Nc2cc[nH]n2)CC1	ZINC000616627588	422515235	/nfs/dbraw/zinc/51/52/35/422515235.db2.gz	HSDKGAXWRYREBU-ZDUSSCGKSA-N	0	3	323.441	2.201	10	0		DEAEHN
O[C@@H]1C[C@H]2CN(Cc3c(Cl)cccc3Cl)CCN2C1	ZINC000405310366	424931731	/nfs/dbraw/zinc/93/17/31/424931731.db2.gz	MUBAJJPQKUYYSN-WDEREUQCSA-N	0	3	301.217	2.244	10	0		DEAEHN
CCOC(=O)C[C@@H](N)c1ccccc1I	ZINC000575439320	424946770	/nfs/dbraw/zinc/94/67/70/424946770.db2.gz	SAWBGPVIIFGCIO-SNVBAGLBSA-N	0	3	319.142	2.244	10	0		DEAEHN
CN1C[C@@H](CNCc2c(F)cccc2Br)CC1=O	ZINC000657694846	425387153	/nfs/dbraw/zinc/38/71/53/425387153.db2.gz	HOCZXVSPVREICS-SECBINFHSA-N	0	3	315.186	2.156	10	0		DEAEHN
CN1C[C@@H](CNCc2cc(Br)ccc2F)CC1=O	ZINC000657694403	425387799	/nfs/dbraw/zinc/38/77/99/425387799.db2.gz	LRMAKZDJZZIJNJ-SECBINFHSA-N	0	3	315.186	2.156	10	0		DEAEHN
CCn1nccc1[C@@H]1OCCC[C@H]1CNCc1conc1C	ZINC000657582612	425370208	/nfs/dbraw/zinc/37/02/08/425370208.db2.gz	WADIOGKHPVGEGR-XJKSGUPXSA-N	0	3	304.394	2.457	10	0		DEAEHN
CC[C@H](C)c1ccc(S(=O)(=O)N[C@H]2CNCC[C@@H]2C)cc1	ZINC000193415220	287787264	/nfs/dbraw/zinc/78/72/64/287787264.db2.gz	AFOPAZWEKMJYQP-XEZPLFJOSA-N	0	3	310.463	2.476	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)N1CCN(Cc2cccs2)CC1	ZINC000262392047	275814901	/nfs/dbraw/zinc/81/49/01/275814901.db2.gz	BJVNYLINCHVKBC-OAHLLOKOSA-N	0	3	321.490	2.171	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccc2c(c1)OCCCO2)N(C)C	ZINC000161975973	276021426	/nfs/dbraw/zinc/02/14/26/276021426.db2.gz	UXKYFEVVJGTYNH-AWEZNQCLSA-N	0	3	306.406	2.194	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cccc2c1OCCO2	ZINC000176988648	276181940	/nfs/dbraw/zinc/18/19/40/276181940.db2.gz	OINGDXFXEPECOO-ZDUSSCGKSA-N	0	3	304.390	2.014	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CCCS(=O)(=O)c1ccccc1	ZINC000175329998	276182843	/nfs/dbraw/zinc/18/28/43/276182843.db2.gz	KDHWSHISCRGTPB-INIZCTEOSA-N	0	3	324.490	2.267	10	0		DEAEHN
CN1CC[C@@H]2CN(C(=O)Nc3nc(C(F)(F)F)cs3)C[C@@H]21	ZINC000454300124	277148800	/nfs/dbraw/zinc/14/88/00/277148800.db2.gz	JKNFKWYXACWPDF-SFYZADRCSA-N	0	3	320.340	2.330	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)[C@@H]2COc3ccccc32)C1	ZINC000247022206	277155587	/nfs/dbraw/zinc/15/55/87/277155587.db2.gz	ZMXVQQKWPKHRFG-NUEKZKHPSA-N	0	3	300.402	2.105	10	0		DEAEHN
CO[C@@H](C)[C@H](C)NC(=O)N1CCN(CC2CCCCC2)CC1	ZINC000190655984	277277222	/nfs/dbraw/zinc/27/72/22/277277222.db2.gz	FFDAYZGGRGWPDN-GJZGRUSLSA-N	0	3	311.470	2.317	10	0		DEAEHN
C/C(=C/C(=O)N1CCO[C@@H](CN(C)C)C1)c1ccc(F)cc1	ZINC000116787318	277727346	/nfs/dbraw/zinc/72/73/46/277727346.db2.gz	LLYOSNFJEVOEQY-DDKJEQMHSA-N	0	3	306.381	2.018	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N(C)C[C@@H]1CCCN(C)C1	ZINC000117806904	278109002	/nfs/dbraw/zinc/10/90/02/278109002.db2.gz	GYDDULAJABNCQX-CPUCHLNUSA-N	0	3	302.418	2.351	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000177169885	279138358	/nfs/dbraw/zinc/13/83/58/279138358.db2.gz	GDSVKPBFHRSSQV-ZBYUQBLASA-N	0	3	300.402	2.293	10	0		DEAEHN
CC(C)C[C@H](CO)N(C)C(=O)N[C@H](C)CN1CCC[C@H](C)C1	ZINC000249486001	279167205	/nfs/dbraw/zinc/16/72/05/279167205.db2.gz	YGFIMBLTGUALJV-ARFHVFGLSA-N	0	3	313.486	2.155	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1C(=O)[C@H]1CCCc2[nH]ncc21	ZINC000134469656	279173555	/nfs/dbraw/zinc/17/35/55/279173555.db2.gz	PSVZJJAJZDHBTI-KGLIPLIRSA-N	0	3	313.405	2.026	10	0		DEAEHN
CCN(CCNC(=O)N1CC[C@@H](C(F)(F)F)[C@H]1C)C1CC1	ZINC000471816325	279196180	/nfs/dbraw/zinc/19/61/80/279196180.db2.gz	NCQUKIXGMWDAPL-ZYHUDNBSSA-N	0	3	307.360	2.453	10	0		DEAEHN
Cc1ccc(O)c(NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000262425977	280920236	/nfs/dbraw/zinc/92/02/36/280920236.db2.gz	FKGQVQCCVOYFQP-HYSWKAIVSA-N	0	3	304.390	2.172	10	0		DEAEHN
Cc1ccc2[nH]c(C(=O)N3CCO[C@@H](CN(C)C)C3)cc2c1C	ZINC000116792893	281024024	/nfs/dbraw/zinc/02/40/24/281024024.db2.gz	LGDAOZLLMYEMQD-AWEZNQCLSA-N	0	3	315.417	2.187	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)CCC(C)(C)C	ZINC000173832608	288311667	/nfs/dbraw/zinc/31/16/67/288311667.db2.gz	VAJVETNWLZYNIX-UONOGXRCSA-N	0	3	302.484	2.311	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000122668591	289081225	/nfs/dbraw/zinc/08/12/25/289081225.db2.gz	BOHJAVLQDGOKHA-CFAJVAMVSA-N	0	3	302.418	2.492	10	0		DEAEHN
C[C@H](NC(=O)[C@H]1NCCCC1(C)C)c1ccc(NC(N)=O)cc1	ZINC000261940105	289916970	/nfs/dbraw/zinc/91/69/70/289916970.db2.gz	UQRYFRZENVLDJM-SMDDNHRTSA-N	0	3	318.421	2.133	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NC2CCC(O)CC2)[C@H]1c1ccccc1	ZINC000245658818	290138191	/nfs/dbraw/zinc/13/81/91/290138191.db2.gz	OZXHLKWIQKYJKB-BHUNQDJPSA-N	0	3	317.433	2.035	10	0		DEAEHN
Cc1nc([C@H](C)N2CC[C@@H](n3cnc4c3CCCC4)C2)n[nH]1	ZINC000408466856	293377693	/nfs/dbraw/zinc/37/76/93/293377693.db2.gz	MRAHYLFGMNWVFL-WCQYABFASA-N	0	3	300.410	2.196	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](NC[C@H](C)N1CCOCC1)CCCO2	ZINC000123246980	295271810	/nfs/dbraw/zinc/27/18/10/295271810.db2.gz	NQMLQVLNQYBAMZ-YOEHRIQHSA-N	0	3	320.433	2.219	10	0		DEAEHN
COc1ncccc1C(=O)N1CCCC[C@H](N2CCCC2)C1	ZINC000107529981	295461941	/nfs/dbraw/zinc/46/19/41/295461941.db2.gz	IUJRFQFSHDFWDY-AWEZNQCLSA-N	0	3	303.406	2.181	10	0		DEAEHN
NC(=O)NC(=O)CN[C@H](c1cccc(Cl)c1)C1CCCC1	ZINC000181045431	303271306	/nfs/dbraw/zinc/27/13/06/303271306.db2.gz	BLMLIVBFOWFXLL-AWEZNQCLSA-N	0	3	309.797	2.356	10	0		DEAEHN
c1cn(-c2ccccc2)c(CN2CCNC[C@H]2c2cccnc2)n1	ZINC000262012383	304859506	/nfs/dbraw/zinc/85/95/06/304859506.db2.gz	VEUPXMAVGGOMAK-SFHVURJKSA-N	0	3	319.412	2.414	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)N2CC3(CCCC3)OC(C)(C)C2)C1	ZINC000188184763	333038714	/nfs/dbraw/zinc/03/87/14/333038714.db2.gz	DCHPLLOIFQJTBO-HNNXBMFYSA-N	0	3	323.481	2.461	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)NC[C@@H]3CCCN(C)C3)cc2c1	ZINC000189263969	333067469	/nfs/dbraw/zinc/06/74/69/333067469.db2.gz	IMODOZUOHGJAQT-LBPRGKRZSA-N	0	3	301.390	2.248	10	0		DEAEHN
COC[C@@H](C)CN1CCC(n2c3ccccc3[nH]c2=O)CC1	ZINC000189592823	333151120	/nfs/dbraw/zinc/15/11/20/333151120.db2.gz	SYBYXXYXUAPTPS-ZDUSSCGKSA-N	0	3	303.406	2.249	10	0		DEAEHN
CO[C@H]1CC[C@H](NC(=O)N[C@H](C)CN(C)Cc2ccccc2)C1	ZINC000582084528	333205517	/nfs/dbraw/zinc/20/55/17/333205517.db2.gz	UWWIXJYWSLHHAG-PVAVHDDUSA-N	0	3	319.449	2.374	10	0		DEAEHN
CCOC(=O)CCN[C@@H](CCc1ccccc1)CC(=O)OCC	ZINC000584595889	337374077	/nfs/dbraw/zinc/37/40/77/337374077.db2.gz	IMZDPGDSIVIBAO-INIZCTEOSA-N	0	3	321.417	2.484	10	0		DEAEHN
CCOC(=O)C(C(=O)OCC)[C@@H](c1cccc(C)c1)N(C)C	ZINC000584651116	337380850	/nfs/dbraw/zinc/38/08/50/337380850.db2.gz	MUTBYKGKKSPOGP-OAHLLOKOSA-N	0	3	307.390	2.340	10	0		DEAEHN
O=C(NCCNc1ccncc1)C1CCC(C(F)(F)F)CC1	ZINC000444754562	534343408	/nfs/dbraw/zinc/34/34/08/534343408.db2.gz	TZPIXOWFCMKYPY-UHFFFAOYSA-N	0	3	315.339	2.400	10	0		DEAEHN
CCN1CCN(CCCCNC(=O)N2CCCC23CCC3)CC1	ZINC000365670360	521678953	/nfs/dbraw/zinc/67/89/53/521678953.db2.gz	RZCVVUHCYQRGLI-UHFFFAOYSA-N	0	3	322.497	2.132	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(C)[C@H](C)c1ccccc1	ZINC000111866013	523831970	/nfs/dbraw/zinc/83/19/70/523831970.db2.gz	BPTQFANMFQTAGB-WBVHZDCISA-N	0	3	319.449	2.500	10	0		DEAEHN
COc1ccc(CC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1F	ZINC000124463090	523888814	/nfs/dbraw/zinc/88/88/14/523888814.db2.gz	UNPSMMQOFIZVJS-TZMCWYRMSA-N	0	3	308.397	2.318	10	0		DEAEHN
C[C@@H](c1nnc(-c2ccccc2)o1)N1CCO[C@@H](CN(C)C)C1	ZINC000247007724	526184768	/nfs/dbraw/zinc/18/47/68/526184768.db2.gz	BXTDLSHCCGDIOU-ZFWWWQNUSA-N	0	3	316.405	2.060	10	0		DEAEHN
Fc1cccc(OCCN2CCC[C@H](Cn3cncn3)C2)c1	ZINC000105884085	526396512	/nfs/dbraw/zinc/39/65/12/526396512.db2.gz	MOHUMIIBVZTXHI-AWEZNQCLSA-N	0	3	304.369	2.208	10	0		DEAEHN
Fc1cccc(OCCN2CCC[C@@H](Cn3cncn3)C2)c1	ZINC000105884088	526396583	/nfs/dbraw/zinc/39/65/83/526396583.db2.gz	MOHUMIIBVZTXHI-CQSZACIVSA-N	0	3	304.369	2.208	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2S(=O)(=O)/C=C/c2ccccc2)C1	ZINC000252657139	536473180	/nfs/dbraw/zinc/47/31/80/536473180.db2.gz	IUQFFBPAIKRDIY-GABYWQGASA-N	0	3	320.458	2.403	10	0		DEAEHN
Cn1nccc1C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000163422344	527594440	/nfs/dbraw/zinc/59/44/40/527594440.db2.gz	PVIQPWAGEUERJA-SFHVURJKSA-N	0	3	312.417	2.205	10	0		DEAEHN
CC(C)N(C)CC(=O)NCCN1CCc2c(Cl)cccc2C1	ZINC000189406178	528812306	/nfs/dbraw/zinc/81/23/06/528812306.db2.gz	UFDIDNAXKOWCNN-UHFFFAOYSA-N	0	3	323.868	2.155	10	0		DEAEHN
CCC(CC)[C@@H]1C[C@H](NC(=O)N2CCN3CCC[C@@H]3C2)CCO1	ZINC000183745590	535127476	/nfs/dbraw/zinc/12/74/76/535127476.db2.gz	XAWPCHHSLIJACJ-ZACQAIPSSA-N	0	3	323.481	2.460	10	0		DEAEHN
CCCc1nc(CN2CCN(C[C@H](C)O)[C@@H](CC)C2)cs1	ZINC000246646876	535525527	/nfs/dbraw/zinc/52/55/27/535525527.db2.gz	AZXVQWQUSHESHW-ZFWWWQNUSA-N	0	3	311.495	2.373	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)[C@H]1CCc2nc(C(C)C)[nH]c2C1	ZINC000372392137	535567974	/nfs/dbraw/zinc/56/79/74/535567974.db2.gz	ACEUEJVKIHUMDQ-UONOGXRCSA-N	0	3	318.465	2.239	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)[C@H]1CCc2[nH]c(C(C)C)nc2C1	ZINC000372392137	535567977	/nfs/dbraw/zinc/56/79/77/535567977.db2.gz	ACEUEJVKIHUMDQ-UONOGXRCSA-N	0	3	318.465	2.239	10	0		DEAEHN
CCC[C@H]1CN(C[C@H](O)CC2CCCC2)CCN1CCOC	ZINC000191028691	535741160	/nfs/dbraw/zinc/74/11/60/535741160.db2.gz	FCLFRYXIIUMALN-ZWKOTPCHSA-N	0	3	312.498	2.360	10	0		DEAEHN
CCc1ccccc1S(=O)(=O)N1CC[C@H]2[C@@H](CCCN2C)C1	ZINC000249487407	535972826	/nfs/dbraw/zinc/97/28/26/535972826.db2.gz	XIMZGFUEUZATSM-HOTGVXAUSA-N	0	3	322.474	2.354	10	0		DEAEHN
CN(C)C(=O)c1cccc(CN2CCN3CCCC[C@H]3C2)c1	ZINC000248329397	536102662	/nfs/dbraw/zinc/10/26/62/536102662.db2.gz	DDSWEZZJRALHQL-KRWDZBQOSA-N	0	3	301.434	2.059	10	0		DEAEHN
CCc1ccc(NC(=O)[C@@H](C)N2CCN3CCC[C@H]3C2)cc1	ZINC000246287767	536188697	/nfs/dbraw/zinc/18/86/97/536188697.db2.gz	IGHYDONQACXFEJ-PBHICJAKSA-N	0	3	301.434	2.356	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCc2ccccn2)[C@H]1c1ccccc1	ZINC000245663323	536456190	/nfs/dbraw/zinc/45/61/90/536456190.db2.gz	QIELEZYDGIIWDJ-IAGOWNOFSA-N	0	3	310.401	2.326	10	0		DEAEHN
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1C[C@H](O)CCc1ccccc1	ZINC000248809604	536551711	/nfs/dbraw/zinc/55/17/11/536551711.db2.gz	HKZLVUAIWHVJBY-MLHJIOFPSA-N	0	3	317.429	2.254	10	0		DEAEHN
COCCOc1ccc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1	ZINC000247470032	536609233	/nfs/dbraw/zinc/60/92/33/536609233.db2.gz	RPKSANWGWUISAN-HOCLYGCPSA-N	0	3	318.417	2.021	10	0		DEAEHN
COc1ccc(Br)c(CN[C@H]2CN(C)C[C@@H]2C)c1	ZINC000358086098	536628672	/nfs/dbraw/zinc/62/86/72/536628672.db2.gz	WLFDAGVAEUNFBM-HZMBPMFUSA-N	0	3	313.239	2.497	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc(-n2ccnc2)cc1C	ZINC000192066273	536629831	/nfs/dbraw/zinc/62/98/31/536629831.db2.gz	DLPNJBNUBMVWPP-KRWDZBQOSA-N	0	3	303.406	2.058	10	0		DEAEHN
COCCN1CCN(C/C=C\c2ccccc2OC)C[C@@H]1C	ZINC000255596076	536873386	/nfs/dbraw/zinc/87/33/86/536873386.db2.gz	WZSYZNHXOFJEDF-IOBAAEILSA-N	0	3	304.434	2.361	10	0		DEAEHN
COc1cc2c(cc1OC)[C@H]1[C@H]3C(=CC[C@@H]1O[C@@H]2O)CCN3C	ZINC000085511779	560073781	/nfs/dbraw/zinc/07/37/81/560073781.db2.gz	VHYYSQODIQWPDO-LIRZEXBASA-N	0	3	317.385	2.211	10	0	biogenic,in-vitro	DEAEHN
C/C(=C/c1ccc(F)cc1)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000255652395	625596743	/nfs/dbraw/zinc/59/67/43/625596743.db2.gz	OVRRSDGJDGAXRJ-IVOILVROSA-N	0	3	306.381	2.018	10	0		DEAEHN
C[C@H](O)CCCN(C(=O)OC(C)(C)C)c1ccc(CN)nc1	ZINC000757134189	623048030	/nfs/dbraw/zinc/04/80/30/623048030.db2.gz	LLNUPLBNBNOFKR-LBPRGKRZSA-N	0	3	309.410	2.443	10	0		DEAEHN
O=Cc1cnc(N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)nc1	ZINC000310187857	625642200	/nfs/dbraw/zinc/64/22/00/625642200.db2.gz	YZCHYQPPPCYISD-ZWKOTPCHSA-N	0	3	322.412	2.247	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NS(=O)(=O)/C=C\c2ccccc2)C1	ZINC000255558248	625087037	/nfs/dbraw/zinc/08/70/37/625087037.db2.gz	RLXDRJFAKYKGCQ-WGCVJFFOSA-N	0	3	308.447	2.305	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)/C=C\c1ccccc1	ZINC000255774344	625719680	/nfs/dbraw/zinc/71/96/80/625719680.db2.gz	OSVVPTLARKRONN-QXBIUURJSA-N	0	3	306.431	2.156	10	0		DEAEHN
COC(=O)/C(C)=C/CN(C)[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000746500339	638350426	/nfs/dbraw/zinc/35/04/26/638350426.db2.gz	SCDDIOJXNLVEBG-SSUFTNFISA-N	0	3	314.389	2.379	10	0		DEAEHN
CC[S@](=O)CCN[C@@H](C)c1ccc(NC(C)=O)cc1OC	ZINC000747870020	638486492	/nfs/dbraw/zinc/48/64/92/638486492.db2.gz	BVTOXTLOIXYUCE-MQJDWESPSA-N	0	3	312.435	2.073	10	0		DEAEHN
COCCN1CCC[C@H](NC(=O)/C=C(/C)c2cccc(F)c2)C1	ZINC000732080108	647539556	/nfs/dbraw/zinc/53/95/56/647539556.db2.gz	VVQXGRKGCXHNIF-IFCKCIONSA-N	0	3	320.408	2.456	10	0		DEAEHN
C[C@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NNc2ccncc2)c1	ZINC000180517526	648497298	/nfs/dbraw/zinc/49/72/98/648497298.db2.gz	XRXRHQCEMXPWIW-NHYWBVRUSA-N	0	3	310.357	2.433	10	0		DEAEHN
Cc1noc(CCC(=O)O[C@@H]2CCN(Cc3ccccc3)C2)n1	ZINC000133467720	684220500	/nfs/dbraw/zinc/22/05/00/684220500.db2.gz	CSSRCGWXJSTTPK-OAHLLOKOSA-N	0	3	315.373	2.128	10	0		DEAEHN
COCC[N@@H+]1CCN(Cc2c([O-])ccc(Cl)c2F)C[C@@H]1C	ZINC000191336557	684425969	/nfs/dbraw/zinc/42/59/69/684425969.db2.gz	CFWGKUOXOSNPFW-NSHDSACASA-N	0	3	316.804	2.337	10	0		DEAEHN
COCC[N@H+]1CCN(Cc2c([O-])ccc(Cl)c2F)C[C@@H]1C	ZINC000191336557	684425975	/nfs/dbraw/zinc/42/59/75/684425975.db2.gz	CFWGKUOXOSNPFW-NSHDSACASA-N	0	3	316.804	2.337	10	0		DEAEHN
Cn1c(=O)sc2cc(CNC[C@@](C)(O)c3ccco3)ccc21	ZINC000192631361	684454247	/nfs/dbraw/zinc/45/42/47/684454247.db2.gz	KWBYTJLBOHFLOL-MRXNPFEDSA-N	0	3	318.398	2.190	10	0		DEAEHN
COCCN1CCN(Cn2cnc3cc(C)c(C)cc32)C[C@@H]1C	ZINC000247255092	685144910	/nfs/dbraw/zinc/14/49/10/685144910.db2.gz	YAUNQGZFUKBEDT-INIZCTEOSA-N	0	3	316.449	2.263	10	0		DEAEHN
O[C@@H]1C[C@H](N[C@@H](c2ccc(F)cc2)C2CC2)[C@H]1n1cccn1	ZINC000886096794	692002633	/nfs/dbraw/zinc/00/26/33/692002633.db2.gz	FVVCVAWOWAGXJQ-YLFCFFPRSA-N	0	3	301.365	2.437	10	0		DEAEHN
CN1C[C@@H](CCNCc2ccsc2Br)CC1=O	ZINC000723547032	777121452	/nfs/dbraw/zinc/12/14/52/777121452.db2.gz	CBUQYYSSQKKDLQ-VIFPVBQESA-N	0	3	317.252	2.469	10	0		DEAEHN
Cc1cn(C)nc1CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000723502003	777114733	/nfs/dbraw/zinc/11/47/33/777114733.db2.gz	XTDNIIJSTWCLPX-ZIAGYGMSSA-N	0	3	322.453	2.464	10	0		DEAEHN
Cc1ccc([C@H](CNC(=O)N(C)CC2CC(O)C2)N(C)C)cc1	ZINC000190404196	786403223	/nfs/dbraw/zinc/40/32/23/786403223.db2.gz	WDICZNPJBWVXQK-PREGVCBESA-N	0	3	319.449	2.010	10	0		DEAEHN
CC1(C)C[C@H](NC2CN(C(=O)OCc3ccccc3)C2)CO1	ZINC000397333839	790175914	/nfs/dbraw/zinc/17/59/14/790175914.db2.gz	SBYGZSUPXSERSG-AWEZNQCLSA-N	0	3	304.390	2.165	10	0		DEAEHN
Cn1cc(CNCC[C@H]2CCSC2)c(Br)n1	ZINC000712499443	792190748	/nfs/dbraw/zinc/19/07/48/792190748.db2.gz	YYUMZUQWUGEWSO-VIFPVBQESA-N	0	3	304.257	2.415	10	0		DEAEHN
COc1cccc(/C(C)=C\C(=O)N[C@H]2CCN(C3CC3)C2)c1	ZINC000751362853	792339847	/nfs/dbraw/zinc/33/98/47/792339847.db2.gz	LVCQJHSRNHAOTK-WVUXNXBLSA-N	0	3	300.402	2.451	10	0		DEAEHN
c1nn(-c2ccccc2)cc1CNCCOC[C@H]1CCOC1	ZINC000068993841	795087507	/nfs/dbraw/zinc/08/75/07/795087507.db2.gz	RMLQWCHPFJEXHA-HNNXBMFYSA-N	0	3	301.390	2.015	10	0		DEAEHN
CN1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cncc(Br)c1	ZINC000720819103	1086169226	/nfs/dbraw/zinc/16/92/26/1086169226.db2.gz	YHHUWJOIPWKRBH-QWHCGFSZSA-N	0	3	324.222	2.153	10	0		DEAEHN
CN1CCC[C@H]2[C@@H]1CCN2C(=O)c1cccc(Br)n1	ZINC000720829371	1086185982	/nfs/dbraw/zinc/18/59/82/1086185982.db2.gz	MBYXZIBDHZXNEQ-RYUDHWBXSA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1NCc1cc(Br)nn1C	ZINC000701043507	1086347154	/nfs/dbraw/zinc/34/71/54/1086347154.db2.gz	MATCLLXXDYMABT-SREGZZRCSA-N	0	3	302.216	2.084	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N1CCC2(CCCC2)C1	ZINC000702392347	1086427618	/nfs/dbraw/zinc/42/76/18/1086427618.db2.gz	SWFQTIUSDFDHMT-QGZVFWFLSA-N	0	3	315.461	2.238	10	0		DEAEHN
COC[C@H](C)OC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1	ZINC000704424503	1086579999	/nfs/dbraw/zinc/57/99/99/1086579999.db2.gz	LXSKSDKQEQSBCM-OFQRWUPVSA-N	0	3	306.406	2.411	10	0		DEAEHN
CC[C@@H]1[C@@H](NCc2cncn2C)CCN1C(=O)OC(C)(C)C	ZINC000704628824	1086585654	/nfs/dbraw/zinc/58/56/54/1086585654.db2.gz	IIWFPZJBFXRQDO-UONOGXRCSA-N	0	3	308.426	2.298	10	0		DEAEHN
COC1(OC)CC[C@H]1N[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000710908957	1086690621	/nfs/dbraw/zinc/69/06/21/1086690621.db2.gz	XUCCUGMXZZARSM-CHWSQXEVSA-N	0	3	314.426	2.127	10	0		DEAEHN
COC1(OC)CC[C@@H]1NC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000710947386	1086691198	/nfs/dbraw/zinc/69/11/98/1086691198.db2.gz	NYFFRAPUQGLUTG-STQMWFEESA-N	0	3	316.442	2.277	10	0		DEAEHN
Cc1noc([C@@H]2CN(C[C@H]3CCc4ccccc43)CCN2C)n1	ZINC000606442344	1088602258	/nfs/dbraw/zinc/60/22/58/1088602258.db2.gz	FSBTUSQUQVSORH-WBVHZDCISA-N	0	3	312.417	2.397	10	0		DEAEHN
C[C@H]1[C@H](NC(=O)c2cc(Cl)c(N)c(Cl)c2)CCN1C	ZINC000719391755	1089082516	/nfs/dbraw/zinc/08/25/16/1089082516.db2.gz	IRFRERKUNJPENT-WRWORJQWSA-N	0	3	302.205	2.398	10	0		DEAEHN
Cc1nn(C)c(C)c1CNCCOC(F)(F)C(F)(F)F	ZINC000720228206	1089536621	/nfs/dbraw/zinc/53/66/21/1089536621.db2.gz	CYKFMFPNILCVAF-UHFFFAOYSA-N	0	3	301.259	2.298	10	0		DEAEHN
CN(CCNC(=O)c1cc(F)c(F)cc1N)Cc1ccccc1	ZINC000386946308	1144509000	/nfs/dbraw/zinc/50/90/00/1144509000.db2.gz	WPKFKNBAILFTQB-UHFFFAOYSA-N	0	3	319.355	2.409	10	0		DEAEHN
CCN[C@@H](CSCCC(=O)OC)c1ccc2c(c1)OCO2	ZINC000081790313	192324444	/nfs/dbraw/zinc/32/44/44/192324444.db2.gz	VAFUJHUAPQXILW-LBPRGKRZSA-N	0	3	311.403	2.362	10	0		DEAEHN
CCCN[C@H]1CCOC[C@@H]1S(=O)(=O)c1cc(C)ccc1C	ZINC000081922257	192338537	/nfs/dbraw/zinc/33/85/37/192338537.db2.gz	RGSIAGDBFVJNAV-HOCLYGCPSA-N	0	3	311.447	2.234	10	0		DEAEHN
c1ccc(CCN2CCN(CCOC3CCOCC3)CC2)cc1	ZINC000625053861	365627900	/nfs/dbraw/zinc/62/79/00/365627900.db2.gz	UUSWUCJAYWXVGR-UHFFFAOYSA-N	0	3	318.461	2.042	10	0		DEAEHN
CN[C@H]1CCOC[C@H]1S(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000081930526	192341807	/nfs/dbraw/zinc/34/18/07/192341807.db2.gz	NUHQKGZXGQECRY-LSDHHAIUSA-N	0	3	311.447	2.135	10	0		DEAEHN
CCCN[C@H](CS(=O)(=O)CCOC)c1ccc(C)c(C)c1	ZINC000081943242	192343660	/nfs/dbraw/zinc/34/36/60/192343660.db2.gz	KJXXBKYCMIYKCL-MRXNPFEDSA-N	0	3	313.463	2.405	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)CCOC)c1ccc(CC)cc1	ZINC000081961902	192345393	/nfs/dbraw/zinc/34/53/93/192345393.db2.gz	YTWLRLQLMJCDMK-INIZCTEOSA-N	0	3	313.463	2.351	10	0		DEAEHN
CN1CCC(N(C(=O)c2ccc3c(c2)OCO3)C2CC2)CC1	ZINC000082341171	185176654	/nfs/dbraw/zinc/17/66/54/185176654.db2.gz	IGQDDKUNUAAJAM-UHFFFAOYSA-N	0	3	302.374	2.114	10	0		DEAEHN
CCN[C@@H](c1ccc(CC)cc1)[C@@H](C)S(=O)(=O)CCOC	ZINC000081944990	192345946	/nfs/dbraw/zinc/34/59/46/192345946.db2.gz	OOHJJPSXYOBMNH-CZUORRHYSA-N	0	3	313.463	2.349	10	0		DEAEHN
O=C(Nc1cccc(Br)c1)c1n[nH]c2c1CNCC2	ZINC000082807323	185205700	/nfs/dbraw/zinc/20/57/00/185205700.db2.gz	DITBLOSSGBIGRA-UHFFFAOYSA-N	0	3	321.178	2.070	10	0		DEAEHN
Cc1ccc(C(=O)NC[C@@H]2CCN(C)[C@H]2c2cccnc2)n1C	ZINC000328615528	231246386	/nfs/dbraw/zinc/24/63/86/231246386.db2.gz	AWDZDBJOSADRFL-RDJZCZTQSA-N	0	3	312.417	2.151	10	0		DEAEHN
Cc1cc(C(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)no1	ZINC000328643874	231278644	/nfs/dbraw/zinc/27/86/44/231278644.db2.gz	ZAXFXVLCZQEGDX-HOCLYGCPSA-N	0	3	314.389	2.143	10	0		DEAEHN
Cc1nn(C)c(C[C@H](N)c2cscn2)c1Br	ZINC000087594523	185228939	/nfs/dbraw/zinc/22/89/39/185228939.db2.gz	JBSDTBBBTPNREP-ZETCQYMHSA-N	0	3	301.213	2.190	10	0		DEAEHN
CC(C)(N)CS(=O)(=O)Cc1cc(Br)cs1	ZINC000088072309	185238809	/nfs/dbraw/zinc/23/88/09/185238809.db2.gz	WORVYOKFQURBHD-UHFFFAOYSA-N	0	3	312.254	2.163	10	0		DEAEHN
C[C@H](CNC(=O)NC[C@H]1CCCN1C)c1ccc(F)cc1F	ZINC000174351496	282193524	/nfs/dbraw/zinc/19/35/24/282193524.db2.gz	ASBINLYGQMCIRW-DGCLKSJQSA-N	0	3	311.376	2.462	10	0		DEAEHN
CCCN[C@H]1CCN(c2c3nsnc3ccc2Cl)C1=O	ZINC000088120681	185240055	/nfs/dbraw/zinc/24/00/55/185240055.db2.gz	CKUMQJDFJDSSRC-JTQLQIEISA-N	0	3	310.810	2.450	10	0		DEAEHN
N[C@@H]1CC(=O)N(c2c3nsnc3c(Cl)cc2Cl)C1	ZINC000088127203	185240435	/nfs/dbraw/zinc/24/04/35/185240435.db2.gz	XZZYPMGCZVJOQC-SCSAIBSYSA-N	0	3	303.174	2.062	10	0		DEAEHN
CC[C@H](CN)S(=O)(=O)N[C@@H](C)C12CC3CC(CC(C3)C1)C2	ZINC000088471905	185251896	/nfs/dbraw/zinc/25/18/96/185251896.db2.gz	ASVDHEULBKBTQO-BQOUJGBCSA-N	0	3	314.495	2.248	10	0		DEAEHN
CC1(O)CCN(C[C@@H](O)COCc2ccc(Cl)cc2)CC1	ZINC000177306945	282203687	/nfs/dbraw/zinc/20/36/87/282203687.db2.gz	RCFLWNXQLWWRRW-OAHLLOKOSA-N	0	3	313.825	2.064	10	0		DEAEHN
CCN(C1CC1)S(=O)(=O)c1ccc(CNC(C)(C)C)o1	ZINC000088543617	185256741	/nfs/dbraw/zinc/25/67/41/185256741.db2.gz	DJLNLDCIABDBOD-UHFFFAOYSA-N	0	3	300.424	2.341	10	0		DEAEHN
CCOC(=O)[C@H]1CNCCN1[C@@H](C)c1ccc(Cl)s1	ZINC000088658015	185261776	/nfs/dbraw/zinc/26/17/76/185261776.db2.gz	WUJAOHZZLAQMHB-VHSXEESVSA-N	0	3	302.827	2.299	10	0		DEAEHN
N[C@@H]1CCC[C@@H]1S(=O)(=O)c1cccc(Br)c1	ZINC000081982907	192349295	/nfs/dbraw/zinc/34/92/95/192349295.db2.gz	MALSJWIGRFPKLF-MNOVXSKESA-N	0	3	304.209	2.103	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2cccc(Br)c2)CC[C@@H]1O	ZINC000166096567	197688346	/nfs/dbraw/zinc/68/83/46/197688346.db2.gz	JBDIFIOJOJFINT-SWHYSGLUSA-N	0	3	313.239	2.152	10	0		DEAEHN
N[C@@H]1COC[C@H]1c1nc(-c2cc(Br)cs2)no1	ZINC000090364817	185292777	/nfs/dbraw/zinc/29/27/77/185292777.db2.gz	ZUDZIDCKPUASMF-RNFRBKRXSA-N	0	3	316.180	2.002	10	0		DEAEHN
Cc1cc2ncc([C@H](C)NCC[C@@H](C)[S@](C)=O)c(C)n2n1	ZINC000090517978	185300098	/nfs/dbraw/zinc/30/00/98/185300098.db2.gz	WZYQOMYFHDIPOA-SMDDFHAHSA-N	0	3	308.451	2.154	10	0		DEAEHN
N[C@@H]1COC[C@H]1C(=O)Nc1ccc(Br)cc1Cl	ZINC000090379214	185293686	/nfs/dbraw/zinc/29/36/86/185293686.db2.gz	IKFPSKSMKGYSNV-VXNVDRBHSA-N	0	3	319.586	2.015	10	0		DEAEHN
Cc1nc(-c2ccc(NC(=O)[C@@H]3COC[C@H]3N)cc2)cs1	ZINC000090383768	185293842	/nfs/dbraw/zinc/29/38/42/185293842.db2.gz	XRQXSSPUZHSRHB-CHWSQXEVSA-N	0	3	303.387	2.031	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)N[C@@H](c1cccs1)C1CCCC1	ZINC000090432778	185295830	/nfs/dbraw/zinc/29/58/30/185295830.db2.gz	AWJLRBYTGJTIIV-GZBFAFLISA-N	0	3	308.447	2.330	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1ccc(Cl)c2ncccc12	ZINC000090433782	185296116	/nfs/dbraw/zinc/29/61/16/185296116.db2.gz	ZIPKIHQGTARFCT-ZWNOBZJWSA-N	0	3	305.765	2.061	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1ccc(SC(F)(F)F)cc1	ZINC000090433440	185296320	/nfs/dbraw/zinc/29/63/20/185296320.db2.gz	OELSYOSZDXZJAE-WDEREUQCSA-N	0	3	320.336	2.471	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)N(C)Cc1cccc(Cl)c1Cl	ZINC000090434499	185296350	/nfs/dbraw/zinc/29/63/50/185296350.db2.gz	BDNIFCNOJVDLAZ-JQWIXIFHSA-N	0	3	317.216	2.186	10	0		DEAEHN
C[C@@]1(C(=O)Nc2ccccc2SC(F)F)COC[C@@H]1N	ZINC000090580451	185305014	/nfs/dbraw/zinc/30/50/14/185305014.db2.gz	MLDGCCXMDSONKD-GXFFZTMASA-N	0	3	302.346	2.304	10	0		DEAEHN
C[C@]1(C(=O)N2CCC[C@@H]2c2cccc(Cl)c2)COC[C@@H]1N	ZINC000090593660	185305961	/nfs/dbraw/zinc/30/59/61/185305961.db2.gz	XRWYMQVRRYHTGV-YCPHGPKFSA-N	0	3	308.809	2.367	10	0		DEAEHN
COc1cccc(C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c1F	ZINC000090685629	185309603	/nfs/dbraw/zinc/30/96/03/185309603.db2.gz	RGQZKNZDMLUWGR-TZMCWYRMSA-N	0	3	306.381	2.391	10	0		DEAEHN
Cc1cc(C)n2c(CN3CCN(CC(C)C)CC3)cnc2n1	ZINC000179679438	282231560	/nfs/dbraw/zinc/23/15/60/282231560.db2.gz	CCZZZRJZEBDCOJ-UHFFFAOYSA-N	0	3	301.438	2.120	10	0		DEAEHN
CC(C)[C@@H](CO)NCc1cccc(NC(=O)C(F)(F)F)c1	ZINC000092393002	185315594	/nfs/dbraw/zinc/31/55/94/185315594.db2.gz	GLWMQSJELVFWBW-GFCCVEGCSA-N	0	3	304.312	2.294	10	0		DEAEHN
Cn1cc(CN2CCN3CCCC[C@@H]3C2)c(-c2cccnc2)n1	ZINC000092616060	185329158	/nfs/dbraw/zinc/32/91/58/185329158.db2.gz	ZUEDDKGJSMKJLE-QGZVFWFLSA-N	0	3	311.433	2.152	10	0		DEAEHN
COCCOc1ccccc1CN1CCN2CCCC[C@@H]2C1	ZINC000092616181	185329346	/nfs/dbraw/zinc/32/93/46/185329346.db2.gz	FPDRTPBRMFWUCG-QGZVFWFLSA-N	0	3	304.434	2.382	10	0		DEAEHN
CN(C[C@@H]1CCCN1C)C(=O)c1ccc2nc(N)sc2c1	ZINC000092628654	185330614	/nfs/dbraw/zinc/33/06/14/185330614.db2.gz	RCJGAFKDVPCCMU-NSHDSACASA-N	0	3	304.419	2.045	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCN([C@H](C)c2nccs2)CC1)N(C)C	ZINC000185760646	282266369	/nfs/dbraw/zinc/26/63/69/282266369.db2.gz	MCQOUTDYFFJQAW-KGLIPLIRSA-N	0	3	324.494	2.079	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)NCCN1CCC(C)CC1	ZINC000186297099	282271927	/nfs/dbraw/zinc/27/19/27/282271927.db2.gz	SREPYOBWQFCNJG-UHFFFAOYSA-N	0	3	323.412	2.365	10	0		DEAEHN
C[NH+](C)[C@H]1CC[C@@H](NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)C1	ZINC000093994640	282268870	/nfs/dbraw/zinc/26/88/70/282268870.db2.gz	SOYYJLILDMNPQR-OLZOCXBDSA-N	0	3	318.417	2.318	10	0		DEAEHN
CCN[C@@H](Cc1cccc(OC)c1)[C@H]1CCCCS1(=O)=O	ZINC000168605024	197725500	/nfs/dbraw/zinc/72/55/00/197725500.db2.gz	XAJOWEBFIUHGAV-JKSUJKDBSA-N	0	3	311.447	2.183	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCC(C)(C)c2ccncc2)CCN1C	ZINC000092362428	539425027	/nfs/dbraw/zinc/42/50/27/539425027.db2.gz	YJFFYYZXIORQFD-HOCLYGCPSA-N	0	3	318.465	2.483	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@H]1Cc2cc(F)ccc2O1	ZINC000245433270	282387851	/nfs/dbraw/zinc/38/78/51/282387851.db2.gz	PPYAEDQETQAKKR-GOEBONIOSA-N	0	3	306.381	2.072	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N2CCN3CCC[C@H]3C2)C12CCCC2	ZINC000245485158	282391538	/nfs/dbraw/zinc/39/15/38/282391538.db2.gz	IVZXMJORLQNAQA-HRCADAONSA-N	0	3	321.465	2.214	10	0		DEAEHN
CC(C)(C)OC(=O)NCC[C@H]1c2ccccc2CCN1CCO	ZINC000616679663	362908739	/nfs/dbraw/zinc/90/87/39/362908739.db2.gz	WXASBCGQDYVVEF-INIZCTEOSA-N	0	3	320.433	2.493	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)Nc2cnn(CC3CC3)c2)[C@@H](C)C1	ZINC000176487664	539627274	/nfs/dbraw/zinc/62/72/74/539627274.db2.gz	ZNCXPJNEUHEROA-WFASDCNBSA-N	0	3	305.426	2.143	10	0		DEAEHN
CCc1nn(C)cc1CN1CCC[C@H](Cn2nc(C)nc2C)C1	ZINC000180121128	539644288	/nfs/dbraw/zinc/64/42/88/539644288.db2.gz	MIEHRZQPTZCFTO-HNNXBMFYSA-N	0	3	316.453	2.103	10	0		DEAEHN
Cc1cccc(OCCCNC(=O)CN[C@H](C)[C@@H]2CCCO2)c1	ZINC000183197305	539660251	/nfs/dbraw/zinc/66/02/51/539660251.db2.gz	VCENULKSKXABJG-WBVHZDCISA-N	0	3	320.433	2.037	10	0		DEAEHN
Cc1cc(N2CC[C@@H](CN(C)Cc3cccnc3)C2)nc(C)n1	ZINC000186558523	539676093	/nfs/dbraw/zinc/67/60/93/539676093.db2.gz	UGSVUYAQCKJPPC-KRWDZBQOSA-N	0	3	311.433	2.447	10	0		DEAEHN
Brc1ccc2c(c1)[C@@H](NCCc1nnc[nH]1)CCO2	ZINC000080573695	192168555	/nfs/dbraw/zinc/16/85/55/192168555.db2.gz	LGXCBYZIYVSSHD-NSHDSACASA-N	0	3	323.194	2.223	10	0		DEAEHN
CN1C(=O)C[C@H](N[C@H]2CCCOC2)[C@@H]1c1ccc(Cl)cc1	ZINC000245594657	282646051	/nfs/dbraw/zinc/64/60/51/282646051.db2.gz	MPXIVSAOILZNAI-DZKIICNBSA-N	0	3	308.809	2.380	10	0		DEAEHN
C[C@@H](NC1CC(O)C1)c1ccc(I)cc1	ZINC000084442839	192430352	/nfs/dbraw/zinc/43/03/52/192430352.db2.gz	XZKXLYGJQBNLST-HUUUCTMMSA-N	0	3	317.170	2.465	10	0		DEAEHN
O=S(=O)(c1cc(CNC2CC2)cc(F)c1F)N1CCCC1	ZINC000138248512	186015772	/nfs/dbraw/zinc/01/57/72/186015772.db2.gz	OXLZQBVRXNRBEW-UHFFFAOYSA-N	0	3	316.373	2.001	10	0		DEAEHN
CC(C)Cn1ncnc1C[C@@H](N)c1ncccc1Br	ZINC000140342091	186026882	/nfs/dbraw/zinc/02/68/82/186026882.db2.gz	KYXXQTHHSAXFFN-LLVKDONJSA-N	0	3	324.226	2.334	10	0		DEAEHN
CC[C@H]1CC[C@H](C)N1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000139277894	186020700	/nfs/dbraw/zinc/02/07/00/186020700.db2.gz	LQEOBSLNRPHZJV-ONGXEEELSA-N	0	3	318.389	2.375	10	0		DEAEHN
CC[C@@H]1N[C@H](c2ccc(C)s2)N(C[C@@H]2CCN(C)C2)C1=O	ZINC000142184950	186031854	/nfs/dbraw/zinc/03/18/54/186031854.db2.gz	QJJWEWDIERFKOP-IPYPFGDCSA-N	0	3	307.463	2.217	10	0		DEAEHN
NC[C@]1(Nc2ccccc2)CCS(=O)(=O)c2ccccc21	ZINC000147658768	186040622	/nfs/dbraw/zinc/04/06/22/186040622.db2.gz	IHOGGQYFFLTDDG-MRXNPFEDSA-N	0	3	302.399	2.130	10	0		DEAEHN
CCc1cc(Br)ccc1NC(=O)[C@H](N)CCOC	ZINC000148156485	186043275	/nfs/dbraw/zinc/04/32/75/186043275.db2.gz	KENRBLPZFDIVJL-LLVKDONJSA-N	0	3	315.211	2.314	10	0		DEAEHN
Cc1ccc([C@H]2N[C@@H](C)C(=O)N2CCN2CCCCC2)s1	ZINC000144040180	186034261	/nfs/dbraw/zinc/03/42/61/186034261.db2.gz	OAGDDYYCMQNGJC-ZFWWWQNUSA-N	0	3	307.463	2.361	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2ccsc2)N([C@@H]2CCCN(CC)C2)C1=O	ZINC000144311866	186035062	/nfs/dbraw/zinc/03/50/62/186035062.db2.gz	FJXMVCUFNLWXHQ-QLFBSQMISA-N	0	3	307.463	2.441	10	0		DEAEHN
N[C@@H](Cc1cn2ccsc2n1)[C@@H]1COc2ccccc2O1	ZINC000149186622	186048344	/nfs/dbraw/zinc/04/83/44/186048344.db2.gz	ZNYSWBQISIMJOM-FZMZJTMJSA-N	0	3	301.371	2.106	10	0		DEAEHN
O=C1C[C@H](NC[C@@H]2CCCS2)C(=O)N1C1CCCCCC1	ZINC000149831356	186053033	/nfs/dbraw/zinc/05/30/33/186053033.db2.gz	OIRIPVGWANOYJL-KBPBESRZSA-N	0	3	310.463	2.322	10	0		DEAEHN
C[NH2+]Cc1ccc(S(=O)(=O)[N-]CCCC(F)(F)F)s1	ZINC000149983078	186054241	/nfs/dbraw/zinc/05/42/41/186054241.db2.gz	NOTWBLCGCYKDRS-UHFFFAOYSA-N	0	3	316.370	2.088	10	0		DEAEHN
COc1ccccc1/C=C\CN1CC[C@H](N2CCOCC2)C1	ZINC000255775675	539786672	/nfs/dbraw/zinc/78/66/72/539786672.db2.gz	SSJUCUIROSFXSB-AATOQMJSSA-N	0	3	302.418	2.115	10	0		DEAEHN
CCNc1nc(NCc2cscn2)nc(N(CC)CC)n1	ZINC000155714713	186105835	/nfs/dbraw/zinc/10/58/35/186105835.db2.gz	MJZXPQRQBTZQAK-UHFFFAOYSA-N	0	3	307.427	2.218	10	0		DEAEHN
COc1cccc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1OC	ZINC000155754019	186109465	/nfs/dbraw/zinc/10/94/65/186109465.db2.gz	NBPWZRCCHDIANW-OCCSQVGLSA-N	0	3	306.406	2.162	10	0		DEAEHN
Cc1ccc(Br)c(NC(=O)C[C@@H]2CNCCO2)c1	ZINC000163961834	186143962	/nfs/dbraw/zinc/14/39/62/186143962.db2.gz	ZBIOJRMICVXYOU-SNVBAGLBSA-N	0	3	313.195	2.075	10	0		DEAEHN
Cc1oc(C)c(S(=O)(=O)NC2CC(C)C2)c1CNC(C)C	ZINC000163992497	186145386	/nfs/dbraw/zinc/14/53/86/186145386.db2.gz	BBLNJNLOQSELQO-UHFFFAOYSA-N	0	3	314.451	2.471	10	0		DEAEHN
CCn1ncc(Br)c1[C@@](C)(F)C[C@@H]1COCCN1	ZINC000164055925	186147131	/nfs/dbraw/zinc/14/71/31/186147131.db2.gz	SJWIZJQLLMYXHX-SKDRFNHKSA-N	0	3	320.206	2.229	10	0		DEAEHN
CN(CC(=O)N1CCC[C@@H](C(F)(F)F)C1)CC1CCOCC1	ZINC000155840557	186117151	/nfs/dbraw/zinc/11/71/51/186117151.db2.gz	HKEHPMJOHWSXFL-CYBMUJFWSA-N	0	3	322.371	2.146	10	0		DEAEHN
O=S1(=O)CCC[C@H]1CNCc1c[nH]c2cc(Cl)ccc12	ZINC000163895508	186141673	/nfs/dbraw/zinc/14/16/73/186141673.db2.gz	XPPVDURZVWUSDD-LBPRGKRZSA-N	0	3	312.822	2.488	10	0		DEAEHN
CCn1ncnc1C[C@H](N)c1csc(Br)c1	ZINC000163920836	186141898	/nfs/dbraw/zinc/14/18/98/186141898.db2.gz	RMGBZOABRVICKW-QMMMGPOBSA-N	0	3	301.213	2.365	10	0		DEAEHN
CC(C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1)=C1CNC1	ZINC000164278605	186154258	/nfs/dbraw/zinc/15/42/58/186154258.db2.gz	KBGRUABKKZKRRK-HNNXBMFYSA-N	0	3	306.793	2.160	10	0		DEAEHN
Cc1ccc(OCCNC(=O)N2CC[C@@H](N3CC=CC3)C2)cc1	ZINC000173334619	186177954	/nfs/dbraw/zinc/17/79/54/186177954.db2.gz	AUKKKODUAITKSI-MRXNPFEDSA-N	0	3	315.417	2.030	10	0		DEAEHN
CC[C@H](CNC(=O)NC[C@@H]1CCCN1C)Oc1ccccc1F	ZINC000175683798	186187451	/nfs/dbraw/zinc/18/74/51/186187451.db2.gz	OVKUJPPSTDJWAU-UONOGXRCSA-N	0	3	323.412	2.377	10	0		DEAEHN
O=C(Nc1ccc(-n2cccn2)cc1)N1CCN2CCC[C@@H]2C1	ZINC000171888175	198002286	/nfs/dbraw/zinc/00/22/86/198002286.db2.gz	PKSKGRLVYUBQKF-MRXNPFEDSA-N	0	3	311.389	2.184	10	0		DEAEHN
O=C(NCCOc1ccc(Cl)cc1)N1CCN2CCC[C@@H]2C1	ZINC000171898619	198003718	/nfs/dbraw/zinc/00/37/18/198003718.db2.gz	NMPORGCHQHFPRK-CQSZACIVSA-N	0	3	323.824	2.208	10	0		DEAEHN
CSCC(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000171948372	198013013	/nfs/dbraw/zinc/01/30/13/198013013.db2.gz	JQILUIXMIMPOLY-UHFFFAOYSA-N	0	3	302.509	2.217	10	0		DEAEHN
C/C(=C\C(=O)N1CCO[C@H](CN(C)C)C1)c1cccc(F)c1	ZINC000172308040	198076629	/nfs/dbraw/zinc/07/66/29/198076629.db2.gz	CUEYGTAANHYLHC-LRFDDAOPSA-N	0	3	306.381	2.018	10	0		DEAEHN
C[C@@H]1[C@@H](NC(=O)c2ncccc2N)CCN1Cc1ccccc1	ZINC000309734763	539878134	/nfs/dbraw/zinc/87/81/34/539878134.db2.gz	QHNOROUYLYVCNP-CJNGLKHVSA-N	0	3	310.401	2.057	10	0		DEAEHN
C[C@@H](N[C@H](C)c1ccc2c(c1)CCCC2)C(=O)N1CCNC1=O	ZINC000072789115	191229004	/nfs/dbraw/zinc/22/90/04/191229004.db2.gz	KYHJSGQDUVBPQR-CHWSQXEVSA-N	0	3	315.417	2.156	10	0		DEAEHN
CN(C[C@@H]1CC[N@H+](C)C1)C(=O)c1ccc2c(c1[O-])OC(C)(C)C2	ZINC000333274937	539954146	/nfs/dbraw/zinc/95/41/46/539954146.db2.gz	OFNMIFOLXHMXOY-GFCCVEGCSA-N	0	3	318.417	2.129	10	0		DEAEHN
CN(C[C@@H]1CC[N@@H+](C)C1)C(=O)c1ccc2c(c1[O-])OC(C)(C)C2	ZINC000333274937	539954148	/nfs/dbraw/zinc/95/41/48/539954148.db2.gz	OFNMIFOLXHMXOY-GFCCVEGCSA-N	0	3	318.417	2.129	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c(C)c1	ZINC000173275244	198205731	/nfs/dbraw/zinc/20/57/31/198205731.db2.gz	BDKHDFPSAZOYCO-HUUCEWRRSA-N	0	3	310.463	2.407	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCc2ccccc2F)CCN1C	ZINC000173441483	198215396	/nfs/dbraw/zinc/21/53/96/198215396.db2.gz	NFCHJFZKIJOORC-HIFRSBDPSA-N	0	3	307.413	2.492	10	0		DEAEHN
CCN(CC)CC(=O)N1C[C@@H](C)O[C@@H](c2ccc(F)cc2)C1	ZINC000173523289	198223875	/nfs/dbraw/zinc/22/38/75/198223875.db2.gz	OIOMBGIPIXGXJD-CZUORRHYSA-N	0	3	308.397	2.456	10	0		DEAEHN
CO[C@H](CNC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccccc1	ZINC000173701384	198242426	/nfs/dbraw/zinc/24/24/26/198242426.db2.gz	ZTTJCUSCFJKMOS-IAGOWNOFSA-N	0	3	315.417	2.030	10	0		DEAEHN
Cc1ccc(O[C@@H](C)CNC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000173917081	198267758	/nfs/dbraw/zinc/26/77/58/198267758.db2.gz	IDYSKSZHDOOMSN-LSDHHAIUSA-N	0	3	305.422	2.108	10	0		DEAEHN
CCN1CCN(c2ccc(NC(=O)CSC)c(C)c2)CC1	ZINC000042158163	354189880	/nfs/dbraw/zinc/18/98/80/354189880.db2.gz	LOUOUEUQTSMXGL-UHFFFAOYSA-N	0	3	307.463	2.438	10	0		DEAEHN
CC(C)[C@@H]1C[C@@H](NCc2c(Br)cnn2C)CCO1	ZINC000487579349	535268659	/nfs/dbraw/zinc/26/86/59/535268659.db2.gz	VMOFSYDREUDFKM-GWCFXTLKSA-N	0	3	316.243	2.476	10	0		DEAEHN
COc1cc(Cl)c(CC(=O)NCCN(C)C)cc1Cl	ZINC000074963814	191396771	/nfs/dbraw/zinc/39/67/71/191396771.db2.gz	KLAOIXVWRLAYNR-UHFFFAOYSA-N	0	3	305.205	2.222	10	0		DEAEHN
NC[C@@H](NC(=O)c1sccc1Br)C(F)(F)F	ZINC000401715026	540142072	/nfs/dbraw/zinc/14/20/72/540142072.db2.gz	AIMJQVAHPAVKJN-RXMQYKEDSA-N	0	3	317.130	2.130	10	0		DEAEHN
CC(C)OC(=O)CCN1CCC(c2nnc3ccccn32)CC1	ZINC000075739539	191513451	/nfs/dbraw/zinc/51/34/51/191513451.db2.gz	VTBHQDBYAMXZBD-UHFFFAOYSA-N	0	3	316.405	2.250	10	0		DEAEHN
COC(OC)[C@@H](C)NCc1ccc(O)c(Br)c1	ZINC000079609079	191955953	/nfs/dbraw/zinc/95/59/53/191955953.db2.gz	KOLQJCZZAHWOES-MRVPVSSYSA-N	0	3	304.184	2.252	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@@H](C)Cc2ccc(OC)cc2)C1	ZINC000179338971	356022061	/nfs/dbraw/zinc/02/20/61/356022061.db2.gz	OBDRMUXVRWXRMF-GOEBONIOSA-N	0	3	304.434	2.474	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)NCC2CCC(C)(C)CC2)CCO1	ZINC000179604422	356029865	/nfs/dbraw/zinc/02/98/65/356029865.db2.gz	SCKGOVNSGKLXPQ-HNNXBMFYSA-N	0	3	311.470	2.175	10	0		DEAEHN
CC[C@H](NCC(=O)N1CCC[C@H](C(F)(F)F)C1)[C@@H]1CCCO1	ZINC000182385799	356125156	/nfs/dbraw/zinc/12/51/56/356125156.db2.gz	ICHISXGYVYVYRF-AVGNSLFASA-N	0	3	322.371	2.335	10	0		DEAEHN
CC[C@@H]1CN(CCCC(=O)OC(C)(C)C)CCN1CCOC	ZINC000181818585	356096849	/nfs/dbraw/zinc/09/68/49/356096849.db2.gz	UUDGYATYRJMQQI-OAHLLOKOSA-N	0	3	314.470	2.151	10	0		DEAEHN
CNCc1ccnn1CCOc1ccc(Br)cc1	ZINC000080082363	192000010	/nfs/dbraw/zinc/00/00/10/192000010.db2.gz	LMPPXCZVQUBWAV-UHFFFAOYSA-N	0	3	310.195	2.444	10	0		DEAEHN
C[C@@H](NCc1cc(=O)n2ccccc2n1)[C@H]1COc2ccccc21	ZINC000185620505	356208464	/nfs/dbraw/zinc/20/84/64/356208464.db2.gz	YGCGPOSJZZTGCU-CZUORRHYSA-N	0	3	321.380	2.349	10	0		DEAEHN
C=Cn1cc(CNCCc2csc(N3CCCC3)n2)cn1	ZINC000194320334	356238576	/nfs/dbraw/zinc/23/85/76/356238576.db2.gz	WNRMTCGIQFDOHF-UHFFFAOYSA-N	0	3	303.435	2.373	10	0		DEAEHN
C[C@@H](CNC(=O)NCCN1CCCC[C@H]1C)c1nccs1	ZINC000248612846	356323057	/nfs/dbraw/zinc/32/30/57/356323057.db2.gz	YBYDPRALCCUUPY-QWHCGFSZSA-N	0	3	310.467	2.420	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)NCc1cccnc1OC1CCCC1	ZINC000236890274	202054776	/nfs/dbraw/zinc/05/47/76/202054776.db2.gz	MCPYSAUWZNZUIN-WFASDCNBSA-N	0	3	305.422	2.393	10	0		DEAEHN
CC[C@@H](C)[C@H]([NH3+])C(=O)NCc1ccc([O-])c(Br)c1	ZINC000236946356	202085912	/nfs/dbraw/zinc/08/59/12/202085912.db2.gz	PJFZMQXTAYHRIQ-PELKAZGASA-N	0	3	315.211	2.144	10	0		DEAEHN
CCCNCc1ccc(F)c(S(=O)(=O)N(C)C2CC2)c1	ZINC000088941175	192662417	/nfs/dbraw/zinc/66/24/17/192662417.db2.gz	OJDGUUSCHCVIRF-UHFFFAOYSA-N	0	3	300.399	2.108	10	0		DEAEHN
CCN(CC(C)C)S(=O)(=O)c1cc(CNC)n(C(C)C)c1	ZINC000088949874	192665630	/nfs/dbraw/zinc/66/56/30/192665630.db2.gz	TYFMGTKIUVMQCH-UHFFFAOYSA-N	0	3	315.483	2.455	10	0		DEAEHN
O[C@H](COC[C@@H]1CCCO1)CN1CC[C@@H](c2ccccc2F)C1	ZINC000582015118	357286824	/nfs/dbraw/zinc/28/68/24/357286824.db2.gz	HZRGVXUKNLROAX-PMPSAXMXSA-N	0	3	323.408	2.172	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCCc2ccccn2)[C@@H]1c1ccccc1	ZINC000179383103	199026762	/nfs/dbraw/zinc/02/67/62/199026762.db2.gz	DXUAYNYNSWBWRS-MSOLQXFVSA-N	0	3	324.428	2.369	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cccc(C(=O)OC(C)(C)C)c2)C1	ZINC000179494250	199045199	/nfs/dbraw/zinc/04/51/99/199045199.db2.gz	NFDBOOAFALNWAX-HNNXBMFYSA-N	0	3	318.417	2.418	10	0		DEAEHN
CC(C)C1CCN(C(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)CC1	ZINC000262426573	535378287	/nfs/dbraw/zinc/37/82/87/535378287.db2.gz	FLRMLCSDVCHXIC-RVKKMQEKSA-N	0	3	308.466	2.414	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)[C@H]2Oc3ccccc3O[C@H]2C)CCN1C	ZINC000172619344	291124774	/nfs/dbraw/zinc/12/47/74/291124774.db2.gz	UQWFOXUOYFFRGV-ZJOBFFGXSA-N	0	3	318.417	2.156	10	0		DEAEHN
CCOC(=O)[C@H]1CCCCN1C(=O)CN[C@@H](C)c1cccs1	ZINC000180928471	199229662	/nfs/dbraw/zinc/22/96/62/199229662.db2.gz	JWJJERDQRBLTPM-QWHCGFSZSA-N	0	3	324.446	2.343	10	0		DEAEHN
Cc1cnn(CCN2CCC(NC(=O)CC3CCCC3)CC2)c1	ZINC000596202997	358638918	/nfs/dbraw/zinc/63/89/18/358638918.db2.gz	JQTPVRULLHNBPC-UHFFFAOYSA-N	0	3	318.465	2.352	10	0		DEAEHN
COCCN(C)CCNC(=O)N[C@H]1c2cc(C)ccc2C[C@@H]1C	ZINC000181201219	199264373	/nfs/dbraw/zinc/26/43/73/199264373.db2.gz	IVNJDUSLNVCHKM-WMLDXEAASA-N	0	3	319.449	2.106	10	0		DEAEHN
CNCc1csc(S(=O)(=O)NC2(C)CCCCC2)c1	ZINC000089013105	192696559	/nfs/dbraw/zinc/69/65/59/192696559.db2.gz	NKVBCBCIXGPFHL-UHFFFAOYSA-N	0	3	302.465	2.469	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N(C)CC(C)(C)C)cn1CC	ZINC000089013727	192698649	/nfs/dbraw/zinc/69/86/49/192698649.db2.gz	RXEVTULFUDDYJX-UHFFFAOYSA-N	0	3	315.483	2.284	10	0		DEAEHN
C[C@@H]1CCCN(S(=O)(=O)c2cc(CN)ccc2F)CC1	ZINC000089036791	192712553	/nfs/dbraw/zinc/71/25/53/192712553.db2.gz	SYVDZRPBKDLLGW-LLVKDONJSA-N	0	3	300.399	2.095	10	0		DEAEHN
CC(=O)N1CC[C@H](NCC[C@@H](C)[S@@](C)=O)c2ccccc21	ZINC000598679100	359287952	/nfs/dbraw/zinc/28/79/52/359287952.db2.gz	XCXWCSCVYSTBIO-PYDTXJQDSA-N	0	3	308.447	2.231	10	0		DEAEHN
CCn1nc(C)c(Br)c1C[C@H](N)c1ccncn1	ZINC000089296963	192761552	/nfs/dbraw/zinc/76/15/52/192761552.db2.gz	NMHSONPAUPLFEP-VIFPVBQESA-N	0	3	310.199	2.006	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)CN(C)c1ccc(Cl)cn1	ZINC000600439506	359743262	/nfs/dbraw/zinc/74/32/62/359743262.db2.gz	JJEUACXDAXFVQJ-AWEZNQCLSA-N	0	3	324.856	2.162	10	0		DEAEHN
COC(=O)c1cc(N[C@@H](C)CN(C)Cc2ccccc2)ncn1	ZINC000603327376	360793544	/nfs/dbraw/zinc/79/35/44/360793544.db2.gz	CIBILWLVEJZDLP-ZDUSSCGKSA-N	0	3	314.389	2.196	10	0		DEAEHN
CC[C@H](CN1CCCC1)NC(=O)Cn1ncc2ccccc21	ZINC000605516813	360974791	/nfs/dbraw/zinc/97/47/91/360974791.db2.gz	GFCHOBWZMKRNRF-OAHLLOKOSA-N	0	3	300.406	2.027	10	0		DEAEHN
CN(C)CCn1cc(NCc2cnc3ccc(Cl)cn23)cn1	ZINC000606469849	361013231	/nfs/dbraw/zinc/01/32/31/361013231.db2.gz	VEJHMWWOGSCJRG-UHFFFAOYSA-N	0	3	318.812	2.358	10	0		DEAEHN
Cn1ccc(C(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)n1	ZINC000607538318	361094716	/nfs/dbraw/zinc/09/47/16/361094716.db2.gz	PDJGMXTVTHPEHN-IUODEOHRSA-N	0	3	318.446	2.295	10	0		DEAEHN
Cc1cccnc1C(F)(F)C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000192708376	200926544	/nfs/dbraw/zinc/92/65/44/200926544.db2.gz	BAAJXEIQSKBSHH-STQMWFEESA-N	0	3	311.376	2.327	10	0		DEAEHN
C[C@@H](NCCO[C@@H]1CCCCO1)c1ccc(-n2cncn2)cc1	ZINC000193083815	200988588	/nfs/dbraw/zinc/98/85/88/200988588.db2.gz	WWEUASYUGWJOBP-RHSMWYFYSA-N	0	3	316.405	2.461	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccoc1Br	ZINC000193323245	201029213	/nfs/dbraw/zinc/02/92/13/201029213.db2.gz	KRBRPFHDVPZLDG-VHSXEESVSA-N	0	3	313.195	2.351	10	0		DEAEHN
Cn1nc(Br)cc1CNC[C@@H]1CC(C)(C)CO1	ZINC000717624984	799426365	/nfs/dbraw/zinc/42/63/65/799426365.db2.gz	KTGDASUOUHYKHP-JTQLQIEISA-N	0	3	302.216	2.087	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@H]1CCN(Cc2ccon2)C1	ZINC000195265687	201369896	/nfs/dbraw/zinc/36/98/96/201369896.db2.gz	LOIKVTAJZACEAF-CYBMUJFWSA-N	0	3	306.435	2.393	10	0		DEAEHN
c1cc(CN[C@@H]2CCc3c[nH]nc3C2)n(CCc2ccccc2)n1	ZINC000621340683	364360125	/nfs/dbraw/zinc/36/01/25/364360125.db2.gz	NKULFHCXGLPQEF-QGZVFWFLSA-N	0	3	321.428	2.496	10	0		DEAEHN
CC(=O)N1CC[C@@H](NCCO[C@H]2CC2(F)F)c2ccccc21	ZINC000621765390	364538820	/nfs/dbraw/zinc/53/88/20/364538820.db2.gz	XUEQFXPSFKTGKG-HIFRSBDPSA-N	0	3	310.344	2.498	10	0		DEAEHN
CS(=O)(=O)CC1(CCNCc2ccncc2Cl)CC1	ZINC000623562603	365080054	/nfs/dbraw/zinc/08/00/54/365080054.db2.gz	WRWDBIDVKPCKFY-UHFFFAOYSA-N	0	3	302.827	2.040	10	0		DEAEHN
C[C@@H](NC[C@H]1COCCN1C)c1sccc1Br	ZINC000624173045	365318957	/nfs/dbraw/zinc/31/89/57/365318957.db2.gz	ZKMZRSUHAUYSKW-ZJUUUORDSA-N	0	3	319.268	2.492	10	0		DEAEHN
C[C@H](CN1CCOCC1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000091511780	193066642	/nfs/dbraw/zinc/06/66/42/193066642.db2.gz	JMURDQWOHGQZAJ-OAHLLOKOSA-N	0	3	322.424	2.390	10	0		DEAEHN
CNCc1cc(Cl)cc(Cl)c1OC[C@@H]1CN(C)CCO1	ZINC000092054307	193149983	/nfs/dbraw/zinc/14/99/83/193149983.db2.gz	TWYKIGFDORXHJP-LBPRGKRZSA-N	0	3	319.232	2.422	10	0		DEAEHN
C[C@@H](NC(=O)[C@H]1CCOC[C@H]1C)[C@H](c1ccccc1)N(C)C	ZINC000248840050	296101755	/nfs/dbraw/zinc/10/17/55/296101755.db2.gz	FNVPUIMISCJKLL-TXCZRRACSA-N	0	3	304.434	2.467	10	0		DEAEHN
COC[C@@H](N)Cc1cn(-c2ccc(Cl)c(Cl)c2)nn1	ZINC000630587769	367741392	/nfs/dbraw/zinc/74/13/92/367741392.db2.gz	ZCQVUNJIIMLWLV-QMMMGPOBSA-N	0	3	301.177	2.090	10	0		DEAEHN
COC[C@H](N)Cc1cn(Cc2ccc(Cl)c(Cl)c2)nn1	ZINC000630587044	367741624	/nfs/dbraw/zinc/74/16/24/367741624.db2.gz	VXLJVMDPVXAEQQ-SNVBAGLBSA-N	0	3	315.204	2.149	10	0		DEAEHN
CC(=O)N1CC[C@@H](CN(C)Cc2cc(-c3ccccc3)n[nH]2)C1	ZINC000092101888	193159858	/nfs/dbraw/zinc/15/98/58/193159858.db2.gz	QGCGARCUZMIRKS-HNNXBMFYSA-N	0	3	312.417	2.377	10	0		DEAEHN
CNCc1cc(F)c(C)c(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)c1	ZINC000092113970	193161205	/nfs/dbraw/zinc/16/12/05/193161205.db2.gz	SZQBFOIMIMJARL-GHMZBOCLSA-N	0	3	314.426	2.130	10	0		DEAEHN
CCNCc1cccc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)c1C	ZINC000092113417	193161220	/nfs/dbraw/zinc/16/12/20/193161220.db2.gz	GGBLQNTWWYXRAL-STQMWFEESA-N	0	3	310.463	2.381	10	0		DEAEHN
CC[C@H](C)CN(C)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115652	193163243	/nfs/dbraw/zinc/16/32/43/193163243.db2.gz	YQICBIJIVOXPFE-NSHDSACASA-N	0	3	302.415	2.212	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCCCC[C@H]2C)c(F)c1	ZINC000092116227	193164110	/nfs/dbraw/zinc/16/41/10/193164110.db2.gz	ZYZBGTOAUWNRLV-GFCCVEGCSA-N	0	3	314.426	2.498	10	0		DEAEHN
c1c(CNCCCc2ccccc2)nnn1C[C@@H]1CCOC1	ZINC000631031539	367977054	/nfs/dbraw/zinc/97/70/54/367977054.db2.gz	AATQWCUBKCHLKT-INIZCTEOSA-N	0	3	300.406	2.037	10	0		DEAEHN
C[S@](=O)Cc1cc(NC(=O)[C@@H]2CCCCN2)ccc1Cl	ZINC000262483913	203306109	/nfs/dbraw/zinc/30/61/09/203306109.db2.gz	SYSKLFROWSSISX-RBZFPXEDSA-N	0	3	314.838	2.299	10	0		DEAEHN
CCC[C@](C)(N)C(=O)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000262524239	203319604	/nfs/dbraw/zinc/31/96/04/203319604.db2.gz	FYCVIKQVJPGTQB-JSGCOSHPSA-N	0	3	302.777	2.146	10	0		DEAEHN
CCC(CC)N(CC(C)C)S(=O)(=O)c1c[nH]c(CN)c1	ZINC000093326643	193233762	/nfs/dbraw/zinc/23/37/62/193233762.db2.gz	AMQGHBOZXUWXJF-UHFFFAOYSA-N	0	3	301.456	2.309	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N(C)CCc2cccs2)cc1CN	ZINC000093294695	193226349	/nfs/dbraw/zinc/22/63/49/193226349.db2.gz	NUVUHSKUICSFOU-UHFFFAOYSA-N	0	3	324.471	2.378	10	0		DEAEHN
COCCNCc1c[nH]nc1-c1c(Cl)nc2ccccn21	ZINC000093296751	193226424	/nfs/dbraw/zinc/22/64/24/193226424.db2.gz	KWMUCRWZORWSRL-UHFFFAOYSA-N	0	3	305.769	2.114	10	0		DEAEHN
CNCc1ccccc1S(=O)(=O)N(C)CCc1cccs1	ZINC000093294701	193226834	/nfs/dbraw/zinc/22/68/34/193226834.db2.gz	BZSAGRNEEUYUTH-UHFFFAOYSA-N	0	3	324.471	2.331	10	0		DEAEHN
C[C@@H](Cc1cccs1)N(C)S(=O)(=O)c1cccc(CN)c1	ZINC000093294586	193226998	/nfs/dbraw/zinc/22/69/98/193226998.db2.gz	AAUINYORFRVFBF-LBPRGKRZSA-N	0	3	324.471	2.459	10	0		DEAEHN
CCN[C@@]1(C(=O)OC)CCC[C@H](N(C)CCC(F)(F)F)C1	ZINC000093756622	193301993	/nfs/dbraw/zinc/30/19/93/193301993.db2.gz	CTWYVPBSOZPPBL-AAEUAGOBSA-N	0	3	310.360	2.335	10	0		DEAEHN
CCN[C@@H](Cc1c(F)cccc1Cl)[C@H]1CN(C)CCN1C	ZINC000093895497	193325600	/nfs/dbraw/zinc/32/56/00/193325600.db2.gz	MZOSCTHQNVASSY-JKSUJKDBSA-N	0	3	313.848	2.246	10	0		DEAEHN
Cn1cnnc1CCNCc1cc(F)cc(Br)c1	ZINC000093982334	193333929	/nfs/dbraw/zinc/33/39/29/193333929.db2.gz	GFEKPDKQZHUOFM-UHFFFAOYSA-N	0	3	313.174	2.049	10	0		DEAEHN
Nc1ccc(N2CCN(c3ccccc3Cl)CC2)nc1N	ZINC000094259903	193355249	/nfs/dbraw/zinc/35/52/49/193355249.db2.gz	NTNBOQPHLKEQQE-UHFFFAOYSA-N	0	3	303.797	2.226	10	0		DEAEHN
CC1(C)CCC[C@@H](CN2CCN(c3nccs3)CC2)[C@H]1O	ZINC000094289138	193356467	/nfs/dbraw/zinc/35/64/67/193356467.db2.gz	NNLXYGUMCZTBJS-UONOGXRCSA-N	0	3	309.479	2.452	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccccc1Cl)N(C)CCS(C)(=O)=O	ZINC000094297393	193356536	/nfs/dbraw/zinc/35/65/36/193356536.db2.gz	VOILHYLVCXBHMJ-UONOGXRCSA-N	0	3	318.870	2.095	10	0		DEAEHN
CC(C)CNCc1cnn([C@@H]2CCC[C@@H](S(C)(=O)=O)C2)c1	ZINC000094644015	193389733	/nfs/dbraw/zinc/38/97/33/193389733.db2.gz	HFRJEMRVSFBNHN-HUUCEWRRSA-N	0	3	313.467	2.157	10	0		DEAEHN
CC(C)(C)NCc1cn([C@H]2CCO[C@]3(CCSC3)C2)nn1	ZINC000094419107	193368765	/nfs/dbraw/zinc/36/87/65/193368765.db2.gz	AGVWYGBJNDHTLD-DZGCQCFKSA-N	0	3	310.467	2.393	10	0		DEAEHN
c1ccc2c(c1)CNC[C@@H]2c1nc([C@H]2CSCCO2)no1	ZINC000094501788	193374513	/nfs/dbraw/zinc/37/45/13/193374513.db2.gz	WKQHFVXXMOCLCI-QWHCGFSZSA-N	0	3	303.387	2.109	10	0		DEAEHN
CCN1CCC[C@H]1CNc1nc2c(Br)cccn2n1	ZINC000094602690	193383598	/nfs/dbraw/zinc/38/35/98/193383598.db2.gz	XEWQFHGZCPZHNX-JTQLQIEISA-N	0	3	324.226	2.388	10	0		DEAEHN
Cc1ncc(CN2CCC[C@H](N3CCC(CO)CC3)C2)s1	ZINC000019837277	182154997	/nfs/dbraw/zinc/15/49/97/182154997.db2.gz	NZKFWSGWIAPHCC-HNNXBMFYSA-N	0	3	309.479	2.120	10	0		DEAEHN
Cc1ccccc1CNS(=O)(=O)c1ccc(F)c(CN)c1	ZINC000020189123	182195629	/nfs/dbraw/zinc/19/56/29/182195629.db2.gz	OPGYHBGEDKXPNA-UHFFFAOYSA-N	0	3	308.378	2.071	10	0		DEAEHN
COCCn1ncc(Br)c1[C@H](N)CSC(C)C	ZINC000160078481	197384436	/nfs/dbraw/zinc/38/44/36/197384436.db2.gz	LBEOCLKHWDGYPT-SNVBAGLBSA-N	0	3	322.272	2.433	10	0		DEAEHN
C[C@@H](CNC(=O)NCCOCc1ccc(Cl)cc1)N(C)C	ZINC000454713515	246092054	/nfs/dbraw/zinc/09/20/54/246092054.db2.gz	MXTUVXJQSYCWBX-LBPRGKRZSA-N	0	3	313.829	2.106	10	0		DEAEHN
Cc1c(Cl)cccc1NC(=O)CN1CCN2CCC[C@@H]2C1	ZINC000023249624	182354343	/nfs/dbraw/zinc/35/43/43/182354343.db2.gz	LTZLXDFFERSUJE-CYBMUJFWSA-N	0	3	307.825	2.367	10	0		DEAEHN
COc1cccc2c1[C@]13CCN(C)[C@H](C2)[C@]1(OC)CCC(=O)C3	ZINC000029330780	182560735	/nfs/dbraw/zinc/56/07/35/182560735.db2.gz	FXPIRWWMNVRGSD-BHIYHBOVSA-N	0	3	315.413	2.331	10	0		DEAEHN
CCc1ccc(NC(=O)NC[C@@H](O)CN2CCCCC2)cc1F	ZINC000158759667	291645637	/nfs/dbraw/zinc/64/56/37/291645637.db2.gz	DTLQVPHHKYJKRT-OAHLLOKOSA-N	0	3	323.412	2.356	10	0		DEAEHN
CN(C)CCOc1ccc(NC(=O)c2cc(F)c[nH]2)cc1F	ZINC000458282833	248247249	/nfs/dbraw/zinc/24/72/49/248247249.db2.gz	VYMJDEUDVQVJKM-UHFFFAOYSA-N	0	3	309.316	2.486	10	0		DEAEHN
CNCCS(=O)(=O)Nc1c(C)cc(C)cc1Br	ZINC000159817283	197366512	/nfs/dbraw/zinc/36/65/12/197366512.db2.gz	PQCWNXIWPUGKIT-UHFFFAOYSA-N	0	3	321.240	2.027	10	0		DEAEHN
COC(=O)C(C)(C)N1CCN(CC2CCC(F)(F)CC2)CC1	ZINC000459434818	248628450	/nfs/dbraw/zinc/62/84/50/248628450.db2.gz	UZUNKOPOHKFHLX-UHFFFAOYSA-N	0	3	318.408	2.381	10	0		DEAEHN
Cc1nnc([C@H](C)NC(=O)c2cccc(CN3CCCC3)c2)o1	ZINC000531846167	284619527	/nfs/dbraw/zinc/61/95/27/284619527.db2.gz	UKGUSCGRRIPVPT-LBPRGKRZSA-N	0	3	314.389	2.465	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2ccc(Cl)c3cccnc23)C1	ZINC000040634095	183111505	/nfs/dbraw/zinc/11/15/05/183111505.db2.gz	FOOOJBGADONOGS-RNCFNFMXSA-N	0	3	305.765	2.204	10	0		DEAEHN
CCC[C@@H](N)C(=O)NCc1cc(Br)ccc1F	ZINC000041069550	183162265	/nfs/dbraw/zinc/16/22/65/183162265.db2.gz	MNTCRGNOSHGMJX-LLVKDONJSA-N	0	3	303.175	2.332	10	0		DEAEHN
C[C@H](C(=O)N1C[C@H](C)N(CCN(C)C)[C@@H](C)C1)C1CCCC1	ZINC000041313784	183185359	/nfs/dbraw/zinc/18/53/59/183185359.db2.gz	XRRDQWZIJLAVDT-JYJNAYRXSA-N	0	3	309.498	2.296	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cncc(Br)c2)C1	ZINC000042356375	183257210	/nfs/dbraw/zinc/25/72/10/183257210.db2.gz	SENMOIQAXBCBPE-GFCCVEGCSA-N	0	3	312.211	2.058	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)cc1)N1CCCC[C@@H]1C(N)=O	ZINC000042946473	183320285	/nfs/dbraw/zinc/32/02/85/183320285.db2.gz	NRGSUZIVQQOQER-KFWWJZLASA-N	0	3	309.841	2.458	10	0		DEAEHN
C[C@H](N)[C@H](c1ccccc1Cl)N(CC(N)=O)C1CCCC1	ZINC000043052484	183332959	/nfs/dbraw/zinc/33/29/59/183332959.db2.gz	YCULDEVESYUEIE-MEDUHNTESA-N	0	3	309.841	2.458	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)s1)N(C)CC(=O)NC1CC1	ZINC000043252651	183346741	/nfs/dbraw/zinc/34/67/41/183346741.db2.gz	HLBSYKIULJKWDY-HZMBPMFUSA-N	0	3	315.870	2.390	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)s1)N(CC)CC(=O)NC	ZINC000043252674	183346815	/nfs/dbraw/zinc/34/68/15/183346815.db2.gz	BIOURBQQMPPWSO-NOZJJQNGSA-N	0	3	303.859	2.248	10	0		DEAEHN
CCCNC(=O)CN(C)[C@@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043253533	183347712	/nfs/dbraw/zinc/34/77/12/183347712.db2.gz	VNDFMIUHZFVTCR-NOZJJQNGSA-N	0	3	303.859	2.248	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccc(Cl)s1)N1CCCC[C@@H]1C(N)=O	ZINC000043253713	183347924	/nfs/dbraw/zinc/34/79/24/183347924.db2.gz	GPXUJZPRSXTTAS-LNLATYFQSA-N	0	3	301.843	2.130	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccc(Br)s1)N(CCO)C1CC1	ZINC000043262751	183349056	/nfs/dbraw/zinc/34/90/56/183349056.db2.gz	HHBKVKQXDBDIJW-PELKAZGASA-N	0	3	319.268	2.356	10	0		DEAEHN
CC(C)N(CCO)[C@H](CN)c1ccc(Br)s1	ZINC000043262723	183349196	/nfs/dbraw/zinc/34/91/96/183349196.db2.gz	DKNCBPTVKCCKBL-SECBINFHSA-N	0	3	307.257	2.213	10	0		DEAEHN
N[C@H](c1ccc(F)c(Br)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000043299826	183351414	/nfs/dbraw/zinc/35/14/14/183351414.db2.gz	SAZBQZCEEBDZJO-LDYMZIIASA-N	0	3	322.199	2.023	10	0		DEAEHN
CCN[C@@H](c1ccc(OC(F)F)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000043300889	183352014	/nfs/dbraw/zinc/35/20/14/183352014.db2.gz	GOEBGGAWXCKOKE-YPMHNXCESA-N	0	3	319.373	2.373	10	0		DEAEHN
Cc1ccc([C@H](Oc2cccc(S(C)(=O)=O)c2)[C@H](C)N)o1	ZINC000043366997	183357272	/nfs/dbraw/zinc/35/72/72/183357272.db2.gz	LTOFSEPSVKDLHS-XHDPSFHLSA-N	0	3	309.387	2.459	10	0		DEAEHN
N[C@H]1C[C@@H]1NC(=O)c1cc(C(F)(F)F)ccc1Br	ZINC000159797883	197365391	/nfs/dbraw/zinc/36/53/91/197365391.db2.gz	QXVOUSCJPBAULR-IUCAKERBSA-N	0	3	323.112	2.297	10	0		DEAEHN
CN(C[C@H]1CCN(C)C1)C(=O)c1coc(Br)c1	ZINC000104502062	194011637	/nfs/dbraw/zinc/01/16/37/194011637.db2.gz	GSOJZVHQMLYHHD-VIFPVBQESA-N	0	3	301.184	2.066	10	0		DEAEHN
O=S(=O)(C[C@@H]1CCCC[NH2+]1)[N-]c1cccc2ncccc12	ZINC000105232244	194088088	/nfs/dbraw/zinc/08/80/88/194088088.db2.gz	TTWKDRLJGCZQMG-LBPRGKRZSA-N	0	3	305.403	2.119	10	0		DEAEHN
C[C@H](CNC(=O)N(C)Cc1ccc(Cl)nc1)N(C)C1CC1	ZINC000105268239	194091783	/nfs/dbraw/zinc/09/17/83/194091783.db2.gz	IPRGLYNLBUJBGG-LLVKDONJSA-N	0	3	310.829	2.359	10	0		DEAEHN
CCCc1nc(NCC)c(C)c(NC2CCS(=O)CC2)n1	ZINC000159473056	197355964	/nfs/dbraw/zinc/35/59/64/197355964.db2.gz	QJYNKXGPNVYESW-UHFFFAOYSA-N	0	3	310.467	2.492	10	0		DEAEHN
CCCNc1nc(CC)nc(NC2CCS(=O)CC2)c1C	ZINC000159459040	197355471	/nfs/dbraw/zinc/35/54/71/197355471.db2.gz	SRSUAOGVYATFBY-UHFFFAOYSA-N	0	3	310.467	2.492	10	0		DEAEHN
CN(c1cccnn1)C1CCN(CCOc2ccccc2)CC1	ZINC000105806179	194133405	/nfs/dbraw/zinc/13/34/05/194133405.db2.gz	SDOAVXRZVSJOLD-UHFFFAOYSA-N	0	3	312.417	2.456	10	0		DEAEHN
C[C@@H](O)CN1CCN(CCOc2cccc(Cl)c2)C[C@@H]1C	ZINC000105912409	194167587	/nfs/dbraw/zinc/16/75/87/194167587.db2.gz	MJNJKQRTEWQQFM-UONOGXRCSA-N	0	3	312.841	2.106	10	0		DEAEHN
C[C@@H](C(=O)N1CCCCC1)N1CCC(Cc2nccn2C)CC1	ZINC000105918454	194168619	/nfs/dbraw/zinc/16/86/19/194168619.db2.gz	MXSVPMVVDWDHIW-HNNXBMFYSA-N	0	3	318.465	2.076	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Cc2coc(-c3cccs3)n2)C1	ZINC000106023716	194179954	/nfs/dbraw/zinc/17/99/54/194179954.db2.gz	AZURSUAYGDSLQI-GFCCVEGCSA-N	0	3	305.403	2.108	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2cccc(OC(F)F)c2)C[C@@H]1C	ZINC000106097983	194185149	/nfs/dbraw/zinc/18/51/49/194185149.db2.gz	RORGIVJUCCUBTF-QWHCGFSZSA-N	0	3	314.376	2.175	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)[C@H](C)COC)c1cccc(OC)c1	ZINC000103362476	284771343	/nfs/dbraw/zinc/77/13/43/284771343.db2.gz	ZCULCLSKBCROSI-PBHICJAKSA-N	0	3	322.449	2.477	10	0		DEAEHN
CCN(CC)[C@H](C(=O)N1CC[C@H](N(C)C)C1)c1ccccc1	ZINC000104898370	284786461	/nfs/dbraw/zinc/78/64/61/284786461.db2.gz	XZHYGNHESSDRKV-IRXDYDNUSA-N	0	3	303.450	2.232	10	0		DEAEHN
CC[C@H](N)[C@H](c1cccc(Cl)c1)N1CCNC(=O)C1(C)C	ZINC000110653676	194346758	/nfs/dbraw/zinc/34/67/58/194346758.db2.gz	AYHPTHQIWDEKKI-KBPBESRZSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)cc1)N1CCNC(=O)C1(C)C	ZINC000110653194	194347232	/nfs/dbraw/zinc/34/72/32/194347232.db2.gz	UYJGPXDCKQIJAF-ZIAGYGMSSA-N	0	3	309.841	2.329	10	0		DEAEHN
C[C@@H]1CN(c2c(C(N)=S)cnc3ccccc32)CCN1C	ZINC000110755779	194356431	/nfs/dbraw/zinc/35/64/31/194356431.db2.gz	BKKGSFOYPIHVSG-LLVKDONJSA-N	0	3	300.431	2.009	10	0		DEAEHN
CC[C@@H]1CN([C@@H](CN)c2ccc(Br)o2)CCN1C	ZINC000110711334	194353152	/nfs/dbraw/zinc/35/31/52/194353152.db2.gz	YVKPGXJWXBMSKY-MNOVXSKESA-N	0	3	316.243	2.068	10	0		DEAEHN
CCCN([C@H]1CCCNC1)S(=O)(=O)c1cccc(Cl)c1	ZINC000110942199	194372332	/nfs/dbraw/zinc/37/23/32/194372332.db2.gz	VWDIJOBWVMOUHB-ZDUSSCGKSA-N	0	3	316.854	2.493	10	0		DEAEHN
CCCN[C@@H](c1cccc(F)c1F)[C@H]1CCS(=O)(=O)C1	ZINC000111037647	194386125	/nfs/dbraw/zinc/38/61/25/194386125.db2.gz	GDJSXROCKVKNDR-IINYFYTJSA-N	0	3	303.374	2.440	10	0		DEAEHN
CCCOCCOc1ncc(Br)cc1CNC	ZINC000111110942	194392577	/nfs/dbraw/zinc/39/25/77/194392577.db2.gz	XRVSGHBUMILEFO-UHFFFAOYSA-N	0	3	303.200	2.369	10	0		DEAEHN
CCCN[C@@H](Cc1cc(Cl)ccc1OC)CS(C)(=O)=O	ZINC000060706358	184154454	/nfs/dbraw/zinc/15/44/54/184154454.db2.gz	HDKNNUUIRCVJFE-ZDUSSCGKSA-N	0	3	319.854	2.304	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)Nc1cccc(Cl)c1	ZINC000061040950	184160351	/nfs/dbraw/zinc/16/03/51/184160351.db2.gz	URUJNDMKTWWEBZ-UHFFFAOYSA-N	0	3	307.825	2.449	10	0		DEAEHN
CNC(C)(C)C(=O)Nc1cccc(I)c1	ZINC000061300341	184167735	/nfs/dbraw/zinc/16/77/35/184167735.db2.gz	ZLVZGBDIHRAGHM-UHFFFAOYSA-N	0	3	318.158	2.228	10	0		DEAEHN
CN1CCCC[C@@H]1CNc1nc(Cl)nc(N2CCCC2)n1	ZINC000061540835	184173730	/nfs/dbraw/zinc/17/37/30/184173730.db2.gz	GTCWQKYUVZRLFN-LLVKDONJSA-N	0	3	310.833	2.021	10	0		DEAEHN
CN1CCCC[C@H]1CNc1nc(Cl)nc(N2CCCC2)n1	ZINC000061540837	184173761	/nfs/dbraw/zinc/17/37/61/184173761.db2.gz	GTCWQKYUVZRLFN-NSHDSACASA-N	0	3	310.833	2.021	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1cncc(Br)c1	ZINC000061652043	184180875	/nfs/dbraw/zinc/18/08/75/184180875.db2.gz	BDGZLUOXZMEFHE-LBPRGKRZSA-N	0	3	312.211	2.010	10	0		DEAEHN
NCc1ccccc1CNS(=O)(=O)c1cccc(Cl)c1	ZINC000061841267	184189554	/nfs/dbraw/zinc/18/95/54/184189554.db2.gz	RIJZYOKNMZFWBX-UHFFFAOYSA-N	0	3	310.806	2.277	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccco1)N1CCN(CC(F)(F)F)CC1	ZINC000061940814	184197178	/nfs/dbraw/zinc/19/71/78/184197178.db2.gz	XIHDFPNLJCJDIR-WCQYABFASA-N	0	3	305.344	2.238	10	0		DEAEHN
COc1ccc(C[C@@]2(O)CCN(C)C2)cc1Br	ZINC000061986839	184199869	/nfs/dbraw/zinc/19/98/69/184199869.db2.gz	KBVQELNQVPKKFH-ZDUSSCGKSA-N	0	3	300.196	2.067	10	0		DEAEHN
C[C@H](Cc1ccccc1)NS(=O)(=O)c1cccc(CN)c1	ZINC000062187544	184216501	/nfs/dbraw/zinc/21/65/01/184216501.db2.gz	YEZKIBGWTHNOEO-CYBMUJFWSA-N	0	3	304.415	2.055	10	0		DEAEHN
Nc1c(Cl)ncnc1O[C@H]1CCN(Cc2ccccc2)C1	ZINC000062365277	184232921	/nfs/dbraw/zinc/23/29/21/184232921.db2.gz	JGPNONISNQKXKK-LBPRGKRZSA-N	0	3	304.781	2.366	10	0		DEAEHN
CCN[C@H](c1cc(F)c(F)c(F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000062706585	184248845	/nfs/dbraw/zinc/24/88/45/184248845.db2.gz	JKSPIBOJCFZYAP-OQPBUACISA-N	0	3	307.337	2.189	10	0		DEAEHN
COCCNCc1ccc(OCC(=O)OC(C)C)c(Cl)c1	ZINC000062730591	184251097	/nfs/dbraw/zinc/25/10/97/184251097.db2.gz	LYYBIOUDXXRGAK-UHFFFAOYSA-N	0	3	315.797	2.406	10	0		DEAEHN
COCCNCc1cc(Cl)ccc1OCc1ncccn1	ZINC000062731091	184251219	/nfs/dbraw/zinc/25/12/19/184251219.db2.gz	MZJWULYAYWIZKO-UHFFFAOYSA-N	0	3	307.781	2.445	10	0		DEAEHN
CC(C)(C)NCc1c(N2CCC[C@H]2CO)nc2sccn12	ZINC000062736778	184251608	/nfs/dbraw/zinc/25/16/08/184251608.db2.gz	ZKUCGDZKBJPUOU-NSHDSACASA-N	0	3	308.451	2.245	10	0		DEAEHN
c1ccc(C[C@@H]2CSC(N[C@H]3CN4CCC3CC4)=N2)cc1	ZINC000063220250	184279279	/nfs/dbraw/zinc/27/92/79/184279279.db2.gz	KCLIKTGYUCMWBH-CVEARBPZSA-N	0	3	301.459	2.384	10	0		DEAEHN
Clc1cccc(NCCN2CC[C@@H](N3CCOCC3)C2)c1	ZINC000062974868	184263634	/nfs/dbraw/zinc/26/36/34/184263634.db2.gz	ONPGGHTUIYJZCV-MRXNPFEDSA-N	0	3	309.841	2.158	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@@H]1C[C@@H]1C1CCCCC1	ZINC000536020223	284929305	/nfs/dbraw/zinc/92/93/05/284929305.db2.gz	UALIKBLWGPMDAC-HZPDHXFCSA-N	0	3	302.422	2.183	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C	ZINC000247656932	285024480	/nfs/dbraw/zinc/02/44/80/285024480.db2.gz	YQTUOXZRDHBDSA-QKPAOTATSA-N	0	3	311.470	2.221	10	0		DEAEHN
CCOc1ccc(C(=O)CCC(=O)N(C)CCCN(C)C)cc1	ZINC000539416149	285076224	/nfs/dbraw/zinc/07/62/24/285076224.db2.gz	MSYCRUATVNEQPK-UHFFFAOYSA-N	0	3	320.433	2.458	10	0		DEAEHN
C[C@H]1CCOCCN1CCC(=O)N1CCc2ccccc2C1	ZINC000364614127	404471064	/nfs/dbraw/zinc/47/10/64/404471064.db2.gz	PUQWRQHCOPLALI-HNNXBMFYSA-N	0	3	302.418	2.072	10	0		DEAEHN
N[C@H](c1cc(F)cc(C(F)(F)F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000159215748	197337512	/nfs/dbraw/zinc/33/75/12/197337512.db2.gz	KLFZBSYOXQUJBR-CPCISQLKSA-N	0	3	311.300	2.279	10	0		DEAEHN
CC(C)NC(=O)[C@@H](CN)Cc1cc(F)cc(C(F)(F)F)c1	ZINC000159198670	197334507	/nfs/dbraw/zinc/33/45/07/197334507.db2.gz	ANUQBUPVSFFWFI-SNVBAGLBSA-N	0	3	306.303	2.487	10	0		DEAEHN
CCCCCN(C)S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159067552	197323773	/nfs/dbraw/zinc/32/37/73/197323773.db2.gz	PAUQHNCKDNTJBN-UHFFFAOYSA-N	0	3	302.415	2.404	10	0		DEAEHN
NC(=O)[C@]1(NCc2ccccc2)Cc2ccc(Cl)cc2C1	ZINC000158940487	197313401	/nfs/dbraw/zinc/31/34/01/197313401.db2.gz	XKWMYWZMMBFHSJ-KRWDZBQOSA-N	0	3	300.789	2.453	10	0		DEAEHN
COc1csc([C@H](O)c2c(Cl)cnn2CCN(C)C)c1	ZINC000158668622	197292363	/nfs/dbraw/zinc/29/23/63/197292363.db2.gz	PMEHPXMNKSPROT-ZDUSSCGKSA-N	0	3	315.826	2.250	10	0		DEAEHN
CCc1ccc(CN)cc1S(=O)(=O)N1C[C@H]2CCC[C@@H]2C1	ZINC000158753064	197299374	/nfs/dbraw/zinc/29/93/74/197299374.db2.gz	CIGOMCGMIUKRCV-HUUCEWRRSA-N	0	3	308.447	2.128	10	0		DEAEHN
CCNCc1sccc1S(=O)(=O)N1C[C@@H]2CCC[C@@H]2C1	ZINC000158754637	197298816	/nfs/dbraw/zinc/29/88/16/197298816.db2.gz	OHWKDIIEHBNOHG-TXEJJXNPSA-N	0	3	314.476	2.278	10	0		DEAEHN
N[C@@H](CS(=O)(=O)c1cc(Cl)ccc1Cl)[C@@H]1CCOC1	ZINC000158740773	197298381	/nfs/dbraw/zinc/29/83/81/197298381.db2.gz	UWWHAPMHUOJHQG-KCJUWKMLSA-N	0	3	324.229	2.131	10	0		DEAEHN
CC(C)(C)[C@@H](N)C(=O)Nc1ccc(Sc2nc[nH]n2)cc1	ZINC000158259738	197257908	/nfs/dbraw/zinc/25/79/08/197257908.db2.gz	UWULLZYPRTVKQA-NSHDSACASA-N	0	3	305.407	2.268	10	0		DEAEHN
CNc1nc(NC[C@@]2(C)CCCS2)nc(N2CCCC2)n1	ZINC000157715415	197209930	/nfs/dbraw/zinc/20/99/30/197209930.db2.gz	DVJTXDSXQQCMMR-CQSZACIVSA-N	0	3	308.455	2.211	10	0		DEAEHN
CCc1csc([C@@H]2CCCN(CCN3C(=O)CCC3=O)C2)n1	ZINC000157047136	197157954	/nfs/dbraw/zinc/15/79/54/197157954.db2.gz	RKJYGEMUSWOHFJ-GFCCVEGCSA-N	0	3	321.446	2.034	10	0		DEAEHN
NCc1ccccc1NC(=O)C[S@](=O)Cc1ccccc1	ZINC000155959084	197077638	/nfs/dbraw/zinc/07/76/38/197077638.db2.gz	PHCRRUOGFKZJNP-NRFANRHFSA-N	0	3	302.399	2.033	10	0		DEAEHN
COc1ccc(OC)c(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000155533849	197064189	/nfs/dbraw/zinc/06/41/89/197064189.db2.gz	DIECCKWIPJUJDJ-DOMZBBRYSA-N	0	3	306.406	2.162	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cc(Br)c[nH]2)C1	ZINC000155404876	197051489	/nfs/dbraw/zinc/05/14/89/197051489.db2.gz	YDZNXITUJVPSNH-SKDRFNHKSA-N	0	3	314.227	2.236	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)NC1CCC(C)CC1	ZINC000245476902	285242191	/nfs/dbraw/zinc/24/21/91/285242191.db2.gz	TZVDNPOFRZGYBC-MNAZLIDISA-N	0	3	309.498	2.486	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCCC[C@H]1c1cn[nH]c1	ZINC000245977324	285256893	/nfs/dbraw/zinc/25/68/93/285256893.db2.gz	OVMZPZMHYYVUNH-CABCVRRESA-N	0	3	305.426	2.131	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NCC1(O)CCCCC1	ZINC000153225060	196862238	/nfs/dbraw/zinc/86/22/38/196862238.db2.gz	MGQMJIPDXILABV-UHFFFAOYSA-N	0	3	320.433	2.052	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc(OC)cc2OC)CCN1CCOC	ZINC000120908353	195262393	/nfs/dbraw/zinc/26/23/93/195262393.db2.gz	DDXGMWGFBNCNLR-INIZCTEOSA-N	0	3	322.449	2.246	10	0		DEAEHN
CC[C@H]1CN(Cc2cc(OC)cc(OC)c2)CCN1CCOC	ZINC000120938640	195267456	/nfs/dbraw/zinc/26/74/56/195267456.db2.gz	AOSRUAQZXXEEKJ-INIZCTEOSA-N	0	3	322.449	2.246	10	0		DEAEHN
Cc1nnc([C@@H]2CC[C@H]3[C@H](CCN3CCN3CCCCC3)O2)o1	ZINC000248051479	257109401	/nfs/dbraw/zinc/10/94/01/257109401.db2.gz	XFXPGYFEAYGOPP-JYJNAYRXSA-N	0	3	320.437	2.158	10	0		DEAEHN
CC1=N[C@]2(CC[C@H]3CN(Cc4ccc(F)cc4)C[C@H]32)C(=O)N1C	ZINC000248005770	257111492	/nfs/dbraw/zinc/11/14/92/257111492.db2.gz	BWGJXZJKYYMHLM-LESCRADOSA-N	0	3	315.392	2.297	10	0		DEAEHN
c1csc(CN2C[C@@H]3CCC[C@H](CN4CCOCC4)[C@@H]3C2)n1	ZINC000263621720	257103979	/nfs/dbraw/zinc/10/39/79/257103979.db2.gz	BWLJWQMGAKCHIV-PMPSAXMXSA-N	0	3	321.490	2.323	10	0		DEAEHN
CC(C)NC(=O)[C@@H]1C[C@H]2CCN(CCc3ccccc3)C[C@H]2O1	ZINC000253374892	257105874	/nfs/dbraw/zinc/10/58/74/257105874.db2.gz	NWEYDZJOTSJOBT-FGTMMUONSA-N	0	3	316.445	2.233	10	0		DEAEHN
CN(CC(=O)NCc1ccc2c(c1)OCO2)C[C@@H]1CC=CCC1	ZINC000544114496	285332409	/nfs/dbraw/zinc/33/24/09/285332409.db2.gz	IDUOJUASOOEGKZ-CQSZACIVSA-N	0	3	316.401	2.320	10	0		DEAEHN
CCN1CCN(CCC(=O)N[C@@H](C)c2ccccc2C)CC1	ZINC000121914576	195372692	/nfs/dbraw/zinc/37/26/92/195372692.db2.gz	BLAHEXRGFNKUSW-INIZCTEOSA-N	0	3	303.450	2.200	10	0		DEAEHN
CCOCCN(CCOCC)c1ncc(CNC)cc1Cl	ZINC000124313124	195626950	/nfs/dbraw/zinc/62/69/50/195626950.db2.gz	HDSWKUPVDWULDZ-UHFFFAOYSA-N	0	3	315.845	2.334	10	0		DEAEHN
Cc1nc(NN)c(C)c(Sc2ccc3c(c2)OCCO3)n1	ZINC000124374213	195634295	/nfs/dbraw/zinc/63/42/95/195634295.db2.gz	YJEZGZARINHGPZ-UHFFFAOYSA-N	0	3	304.375	2.301	10	0		DEAEHN
Cc1nn(C)c(CC(=O)[C@@]2(C)CCCCN2)c1Br	ZINC000127149408	195851771	/nfs/dbraw/zinc/85/17/71/195851771.db2.gz	MXDBZXPPXGRREE-CYBMUJFWSA-N	0	3	314.227	2.135	10	0		DEAEHN
COC[C@](C)(O)CNCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000545199442	285398105	/nfs/dbraw/zinc/39/81/05/285398105.db2.gz	DQTSZVZKNFPALZ-QGZVFWFLSA-N	0	3	309.406	2.129	10	0		DEAEHN
COc1ccc(C#N)cc1CN1CCC[C@@H](CC(N)=O)CC1	ZINC000299746212	533270928	/nfs/dbraw/zinc/27/09/28/533270928.db2.gz	VUOQVNNSEAKYNO-CYBMUJFWSA-N	0	3	301.390	2.044	10	0		DEAEHN
CC(C)[C@@H](NC(=O)OC(C)(C)C)[C@]1(C)NCCc2ncn(C)c21	ZINC000725242733	542770103	/nfs/dbraw/zinc/77/01/03/542770103.db2.gz	NYPJEEIYIPBFDI-DYVFJYSZSA-N	0	3	322.453	2.330	10	0		DEAEHN
COc1ccc(CNCCN2CC=C(C)CC2)c(OC)c1OC	ZINC000358126608	133123071	/nfs/dbraw/zinc/12/30/71/133123071.db2.gz	AXDQRHAMJDLWNG-UHFFFAOYSA-N	0	3	320.433	2.454	10	0		DEAEHN
CN(C)C1(CN(C)C(=O)NCc2ccc3cc[nH]c3n2)CCC1	ZINC000360492614	133185360	/nfs/dbraw/zinc/18/53/60/133185360.db2.gz	SKMQJVZCKFSWEP-UHFFFAOYSA-N	0	3	315.421	2.189	10	0		DEAEHN
COC(=O)c1cc(CN2CCC(C3CCOCC3)CC2)cn1C	ZINC000373253603	133384145	/nfs/dbraw/zinc/38/41/45/133384145.db2.gz	FLXXSSQUSDTQTM-UHFFFAOYSA-N	0	3	320.433	2.450	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C	ZINC000187513453	145000172	/nfs/dbraw/zinc/00/01/72/145000172.db2.gz	RNQPYNQWKCWEOX-MCIONIFRSA-N	0	3	318.421	2.029	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC([C@@H]3CCCO3)CC2)C1	ZINC000187619777	145001325	/nfs/dbraw/zinc/00/13/25/145001325.db2.gz	DSSZDLPLVPSTNJ-HOTGVXAUSA-N	0	3	309.454	2.071	10	0		DEAEHN
CC(C)C[C@H](CO)N(C)C(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000188534942	145013127	/nfs/dbraw/zinc/01/31/27/145013127.db2.gz	GUBXVEZLMHASEW-JKSUJKDBSA-N	0	3	313.486	2.155	10	0		DEAEHN
CCc1nc(C2CCN([C@@H](C)C(=O)NCCC(C)C)CC2)n[nH]1	ZINC000190662622	145045507	/nfs/dbraw/zinc/04/55/07/145045507.db2.gz	BQRXVGCJOORWLZ-ZDUSSCGKSA-N	0	3	321.469	2.097	10	0		DEAEHN
CCc1n[nH]c(C2CCN([C@@H](C)C(=O)NCCC(C)C)CC2)n1	ZINC000190662622	145045508	/nfs/dbraw/zinc/04/55/08/145045508.db2.gz	BQRXVGCJOORWLZ-ZDUSSCGKSA-N	0	3	321.469	2.097	10	0		DEAEHN
CCc1nnc(C2CCN([C@@H](C)C(=O)NCCC(C)C)CC2)[nH]1	ZINC000190662622	145045509	/nfs/dbraw/zinc/04/55/09/145045509.db2.gz	BQRXVGCJOORWLZ-ZDUSSCGKSA-N	0	3	321.469	2.097	10	0		DEAEHN
Cc1nc(CC2CC2)sc1C(=O)N1CCN2CCC[C@H]2C1	ZINC000191584473	145060848	/nfs/dbraw/zinc/06/08/48/145060848.db2.gz	SKPAQRWOYROPPW-ZDUSSCGKSA-N	0	3	305.447	2.324	10	0		DEAEHN
CCOC1CC(CCNC(=O)N(C)C[C@H]2CCCN2CC)C1	ZINC000191686648	145062757	/nfs/dbraw/zinc/06/27/57/145062757.db2.gz	RCWRLBCBXJLNNK-HWOWSKLDSA-N	0	3	311.470	2.317	10	0		DEAEHN
CCn1cnnc1C1CCN(CCO[C@H]2CCCCO2)CC1	ZINC000193051313	145081526	/nfs/dbraw/zinc/08/15/26/145081526.db2.gz	JBGBJTAPKOEWRA-HNNXBMFYSA-N	0	3	308.426	2.021	10	0		DEAEHN
c1cc(CCCN2CCO[C@@]3(CCOC3)C2)cc2c1OCC2	ZINC000193315407	145084107	/nfs/dbraw/zinc/08/41/07/145084107.db2.gz	WYHSYLXZCCNMBI-SFHVURJKSA-N	0	3	303.402	2.045	10	0		DEAEHN
C[C@H](C(=O)NCCC1=CCCCC1)N1CCN2CCC[C@H]2C1	ZINC000246403595	145101704	/nfs/dbraw/zinc/10/17/04/145101704.db2.gz	QEVDKCXORKOWLJ-WBVHZDCISA-N	0	3	305.466	2.162	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCC[C@@H](n2cc(C)cn2)C1	ZINC000246405505	145102315	/nfs/dbraw/zinc/10/23/15/145102315.db2.gz	RUWRASANEUATMV-JKSUJKDBSA-N	0	3	319.453	2.022	10	0		DEAEHN
Clc1ccc(-n2cc(CN3CCN4CCC[C@H]4C3)nn2)cc1	ZINC000246706710	145111390	/nfs/dbraw/zinc/11/13/90/145111390.db2.gz	ZUCHVWNKZGRFTE-INIZCTEOSA-N	0	3	317.824	2.201	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(-c2ccncc2)on1	ZINC000246770494	145113736	/nfs/dbraw/zinc/11/37/36/145113736.db2.gz	AVWHASIPSBEUDO-OCCSQVGLSA-N	0	3	312.373	2.045	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)CSCc1cccnc1	ZINC000246935743	145119721	/nfs/dbraw/zinc/11/97/21/145119721.db2.gz	KGTBFJVLBYUHRG-CVEARBPZSA-N	0	3	319.474	2.400	10	0		DEAEHN
O[C@@H](CN1CCC[C@@H](Cn2cncn2)C1)c1ccccc1Cl	ZINC000247123676	145126707	/nfs/dbraw/zinc/12/67/07/145126707.db2.gz	JWCRISOCQRMDCM-CJNGLKHVSA-N	0	3	320.824	2.377	10	0		DEAEHN
CC[C@@H]1CN(CCCOc2ccccc2)CCN1C[C@H](C)O	ZINC000247196908	145128823	/nfs/dbraw/zinc/12/88/23/145128823.db2.gz	OQNBXYLOEBMZOT-DLBZAZTESA-N	0	3	306.450	2.233	10	0		DEAEHN
CC(=O)Nc1cccc(CN2CCS[C@H]3COCC[C@H]32)c1	ZINC000247293562	145132208	/nfs/dbraw/zinc/13/22/08/145132208.db2.gz	UHVMQVPDPMUQEN-CVEARBPZSA-N	0	3	306.431	2.351	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCC[C@H]1C1CCC1	ZINC000247495792	145139030	/nfs/dbraw/zinc/13/90/30/145139030.db2.gz	MPPKZDVICNDKQN-CVEARBPZSA-N	0	3	309.454	2.071	10	0		DEAEHN
c1ccc(Cc2nnc(N3CCN4CCC[C@H]4C3)s2)cc1	ZINC000248467074	145156249	/nfs/dbraw/zinc/15/62/49/145156249.db2.gz	SPOUATFOSQEZNG-AWEZNQCLSA-N	0	3	300.431	2.413	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC[C@@H](c2nncn2C(C)C)C1	ZINC000248659495	145163561	/nfs/dbraw/zinc/16/35/61/145163561.db2.gz	VGJJLYZQHQHSJQ-HZPDHXFCSA-N	0	3	324.469	2.216	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)COCC1CC1	ZINC000248745099	145166267	/nfs/dbraw/zinc/16/62/67/145166267.db2.gz	FLCQOBUOUKUKRW-WMLDXEAASA-N	0	3	302.418	2.050	10	0		DEAEHN
CC1(C)CN(C[C@@H](O)Cn2cccn2)CC[C@@H]1C(F)(F)F	ZINC000248814817	145168498	/nfs/dbraw/zinc/16/84/98/145168498.db2.gz	UDCRNWFVAXNHAN-NEPJUHHUSA-N	0	3	305.344	2.154	10	0		DEAEHN
CC(C)N1CCC[C@H](N2C[C@H](CO)[C@@H](c3ccsc3)C2)C1=O	ZINC000249551256	145186251	/nfs/dbraw/zinc/18/62/51/145186251.db2.gz	HZRVZDXQGQIIRA-OAGGEKHMSA-N	0	3	322.474	2.155	10	0		DEAEHN
CCOc1ccc(OC[C@H](O)CN2CC[C@H](C)[C@@H](OC)C2)cc1	ZINC000251679339	145195645	/nfs/dbraw/zinc/19/56/45/145195645.db2.gz	IWNRRURPFYVKFZ-DAYGRLMNSA-N	0	3	323.433	2.182	10	0		DEAEHN
Cc1cc2ncc([C@H](C)NCC[C@@H](C)[S@](C)=O)c(C)n2n1	ZINC000252732888	145199926	/nfs/dbraw/zinc/19/99/26/145199926.db2.gz	WZYQOMYFHDIPOA-IDFMNXDXSA-N	0	3	308.451	2.154	10	0		DEAEHN
c1nn(-c2ccccc2)cc1CN1CCNC[C@H]1c1cccnc1	ZINC000261706558	145219084	/nfs/dbraw/zinc/21/90/84/145219084.db2.gz	KCGHOMMQPLCRRZ-IBGZPJMESA-N	0	3	319.412	2.414	10	0		DEAEHN
COCc1cccc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000261810780	145228897	/nfs/dbraw/zinc/22/88/97/145228897.db2.gz	GMSVMCHRHVQCCD-RVKKMQEKSA-N	0	3	318.417	2.304	10	0		DEAEHN
NC1(C(=O)NCc2ccc(-c3ccccc3)cc2)CCOCC1	ZINC000261814828	145229738	/nfs/dbraw/zinc/22/97/38/145229738.db2.gz	JUYXDYFKYPFLSL-UHFFFAOYSA-N	0	3	310.397	2.478	10	0		DEAEHN
CCC(CC)c1nnc(NC(=O)[C@@H](N)C2CCOCC2)s1	ZINC000261845436	145233162	/nfs/dbraw/zinc/23/31/62/145233162.db2.gz	QYWKGAWRYCVYAV-NSHDSACASA-N	0	3	312.439	2.134	10	0		DEAEHN
NC1(C(=O)N2CCC(Cc3ccccc3F)CC2)CCOCC1	ZINC000261895898	145238798	/nfs/dbraw/zinc/23/87/98/145238798.db2.gz	RADXUIHYUIXBAL-UHFFFAOYSA-N	0	3	320.408	2.115	10	0		DEAEHN
COc1ccc(NC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)cc1F	ZINC000261956883	145247025	/nfs/dbraw/zinc/24/70/25/145247025.db2.gz	XGLMHRZWPRDUNM-FABXCBLPSA-N	0	3	322.380	2.305	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)NCc1ccc(F)cc1F	ZINC000261976941	145248784	/nfs/dbraw/zinc/24/87/84/145248784.db2.gz	ZSPXYLMLVOILGJ-SUYBPPKGSA-N	0	3	324.371	2.114	10	0		DEAEHN
COc1ccccc1[C@H]1CNCCN1Cc1nc(C)c(C)o1	ZINC000262274965	145272896	/nfs/dbraw/zinc/27/28/96/145272896.db2.gz	SYQQXDDOEWDOGJ-OAHLLOKOSA-N	0	3	301.390	2.447	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)NCc1ccc(Cl)cc1	ZINC000262498024	145288316	/nfs/dbraw/zinc/28/83/16/145288316.db2.gz	LRASTTIFBPIFRY-CPUCHLNUSA-N	0	3	322.836	2.489	10	0		DEAEHN
COc1ccccc1N1CC[C@@H](NC(=O)C2(N)CCCCC2)C1	ZINC000262677064	145299744	/nfs/dbraw/zinc/29/97/44/145299744.db2.gz	SZCZIMGCVYMTDV-CQSZACIVSA-N	0	3	317.433	2.052	10	0		DEAEHN
C[C@@H]1C[NH2+]CC[C@H]1[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000262745944	145302960	/nfs/dbraw/zinc/30/29/60/145302960.db2.gz	DTXOVJOIKQDJPG-LDYMZIIASA-N	0	3	323.245	2.270	10	0		DEAEHN
C[C@@H]1[C@H](C)NCCN1C(=O)c1cnn(-c2cccc(Cl)c2)c1	ZINC000262787965	145305209	/nfs/dbraw/zinc/30/52/09/145305209.db2.gz	MSVSBQCRAOEAIW-NWDGAFQWSA-N	0	3	318.808	2.348	10	0		DEAEHN
CC(C)COc1cccc(-c2nc([C@H]3CNCCN3C)no2)c1	ZINC000263108965	145325874	/nfs/dbraw/zinc/32/58/74/145325874.db2.gz	ACQJGMYZNFQXRB-OAHLLOKOSA-N	0	3	316.405	2.348	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2cncc(-c3ccccc3)c2)n1	ZINC000263225126	145338760	/nfs/dbraw/zinc/33/87/60/145338760.db2.gz	MQLLOGPMWFNPSD-INIZCTEOSA-N	0	3	321.384	2.375	10	0		DEAEHN
c1cn(-c2csc(CN3CCN(CC4CC4)CC3)c2)cn1	ZINC000346198938	146036785	/nfs/dbraw/zinc/03/67/85/146036785.db2.gz	FYWARZPECAXZKF-UHFFFAOYSA-N	0	3	302.447	2.461	10	0		DEAEHN
COc1cccc(CN(CCN(C)C)C(=O)NC[C@H]2C[C@H]2C)c1	ZINC000358563796	147156905	/nfs/dbraw/zinc/15/69/05/147156905.db2.gz	QXXKDQLLLYHXKK-GDBMZVCRSA-N	0	3	319.449	2.424	10	0		DEAEHN
COC(=O)[C@@H](NC[C@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000358851780	147219381	/nfs/dbraw/zinc/21/93/81/147219381.db2.gz	MWXJABMLUAPWTL-SJORKVTESA-N	0	3	302.418	2.192	10	0		DEAEHN
C[C@](O)(CNCc1cnc(N2CCCC2)nc1)C1CCCCC1	ZINC000565927341	292190894	/nfs/dbraw/zinc/19/08/94/292190894.db2.gz	UEEWTZJYWHTDJQ-SFHVURJKSA-N	0	3	318.465	2.498	10	0		DEAEHN
C[C@H](Cn1c(=O)[nH]c2ccccc2c1=O)N(C)Cc1ccccc1	ZINC000111672587	401721064	/nfs/dbraw/zinc/72/10/64/401721064.db2.gz	GOXQRMHZRQDTLQ-CQSZACIVSA-N	0	3	323.396	2.210	10	0		DEAEHN
C[C@@H]1CN(C(=O)C2CCN(C)CC2)C[C@H](c2ccc(F)cc2)O1	ZINC000073989769	401727176	/nfs/dbraw/zinc/72/71/76/401727176.db2.gz	DCBKIUDJFJTUIE-CXAGYDPISA-N	0	3	320.408	2.456	10	0		DEAEHN
CN(C)C(=O)CCNCc1ccc(Br)c(F)c1	ZINC000127432784	401734814	/nfs/dbraw/zinc/73/48/14/401734814.db2.gz	JTABGUIYHCSCFU-UHFFFAOYSA-N	0	3	303.175	2.156	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)C(C)(C)C	ZINC000074318170	401735041	/nfs/dbraw/zinc/73/50/41/401735041.db2.gz	QZKLHOJMUGKMBY-GFCCVEGCSA-N	0	3	305.422	2.351	10	0		DEAEHN
C[C@@H](NCc1nnc2n1c1ccccc1c(=O)n2C)C(C)(C)C	ZINC000074317801	401735331	/nfs/dbraw/zinc/73/53/31/401735331.db2.gz	YKIGEMLZRMBUPV-LLVKDONJSA-N	0	3	313.405	2.105	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2ccc(N3CCCC3)nc2)CCN1C	ZINC000127558704	401740088	/nfs/dbraw/zinc/74/00/88/401740088.db2.gz	XVABXRAITXGDSW-HOCLYGCPSA-N	0	3	316.449	2.237	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2csc(-c3ccco3)n2)CCO1	ZINC000071878848	401690734	/nfs/dbraw/zinc/69/07/34/401690734.db2.gz	KEGCURWXSNWOKC-ZDUSSCGKSA-N	0	3	307.419	2.166	10	0		DEAEHN
COc1cc([C@H](C)NCCC[S@](C)=O)cc(OC)c1OC	ZINC000126828676	401709732	/nfs/dbraw/zinc/70/97/32/401709732.db2.gz	HHFBFRMVMXDABK-WIUDPPPLSA-N	0	3	315.435	2.132	10	0		DEAEHN
CC(C)(C)OC(=O)NCC1(NCc2cncnc2)CCCC1	ZINC000111389080	401714332	/nfs/dbraw/zinc/71/43/32/401714332.db2.gz	ZQRJFEQYSDAMJU-UHFFFAOYSA-N	0	3	306.410	2.404	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(C)CC2CCN(C)CC2)s1	ZINC000075810982	401769021	/nfs/dbraw/zinc/76/90/21/401769021.db2.gz	HICOGFLLLJGZTO-UHFFFAOYSA-N	0	3	324.494	2.231	10	0		DEAEHN
CCCNC(=O)C1CCN(C[C@@](C)(O)c2ccccc2)CC1	ZINC000075826747	401769964	/nfs/dbraw/zinc/76/99/64/401769964.db2.gz	XXEFPNXRSVRPEG-GOSISDBHSA-N	0	3	304.434	2.132	10	0		DEAEHN
CCc1c(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)[nH]c(C)c1C(C)=O	ZINC000113225990	401770650	/nfs/dbraw/zinc/77/06/50/401770650.db2.gz	DPNHGGZOCQYVKG-SMDDNHRTSA-N	0	3	317.433	2.397	10	0		DEAEHN
Cc1c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cnn1C(C)(C)C	ZINC000113222729	401770728	/nfs/dbraw/zinc/77/07/28/401770728.db2.gz	FHVMOZDJMUTPOE-JSGCOSHPSA-N	0	3	304.438	2.255	10	0		DEAEHN
Cc1ccc(C(C)(C)CN(C)C[C@H](O)CN2CCCC2=O)cc1	ZINC000075861584	401771184	/nfs/dbraw/zinc/77/11/84/401771184.db2.gz	YPYJVUQKCDPAOO-KRWDZBQOSA-N	0	3	318.461	2.188	10	0		DEAEHN
CCc1ccccc1OCC(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000113230957	401771973	/nfs/dbraw/zinc/77/19/73/401771973.db2.gz	AWBKNCXGQBZLEJ-GOEBONIOSA-N	0	3	302.418	2.323	10	0		DEAEHN
CC[C@@H](CO)N1CCN(CCCOc2ccccc2C)CC1	ZINC000075961610	401775251	/nfs/dbraw/zinc/77/52/51/401775251.db2.gz	YKHSEZZZZUKJFP-KRWDZBQOSA-N	0	3	306.450	2.152	10	0		DEAEHN
Cc1ccn2c(CN3CCC[C@@H](Cn4cncn4)C3)cnc2c1	ZINC000128508739	401780178	/nfs/dbraw/zinc/78/01/78/401780178.db2.gz	QWILRAOBWFWBBZ-OAHLLOKOSA-N	0	3	310.405	2.146	10	0		DEAEHN
COC(=O)[C@H](C)CN(Cc1ccccc1)C(=O)CN(C)C(C)C	ZINC000128531715	401781346	/nfs/dbraw/zinc/78/13/46/401781346.db2.gz	OVLLPUNULCHSBC-OAHLLOKOSA-N	0	3	320.433	2.165	10	0		DEAEHN
Cc1cccn2c(CN3CCC[C@H](Cn4cncn4)C3)cnc12	ZINC000128603855	401785169	/nfs/dbraw/zinc/78/51/69/401785169.db2.gz	HJHBFKLQBWNXLG-HNNXBMFYSA-N	0	3	310.405	2.146	10	0		DEAEHN
Cc1cccc(CNC(=O)NC[C@H](C)N2CCC(C)CC2)n1	ZINC000128994999	401796994	/nfs/dbraw/zinc/79/69/94/401796994.db2.gz	XVRIAZZHPNBGNW-HNNXBMFYSA-N	0	3	304.438	2.310	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)NC[C@@H]2CCCC[C@@H]2O)c1	ZINC000077516038	401818695	/nfs/dbraw/zinc/81/86/95/401818695.db2.gz	HWWNAGIBXPWLGO-HOCLYGCPSA-N	0	3	305.422	2.421	10	0		DEAEHN
CCN(CC)CC(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000117269511	401870813	/nfs/dbraw/zinc/87/08/13/401870813.db2.gz	OSQWCWRMFYRLEG-HNNXBMFYSA-N	0	3	319.449	2.122	10	0		DEAEHN
Cc1cc(=O)[nH]cc1C(=O)N1CCN(C2CCC(C)CC2)CC1	ZINC000130301022	401826458	/nfs/dbraw/zinc/82/64/58/401826458.db2.gz	LCSUGNZXABIULF-UHFFFAOYSA-N	0	3	317.433	2.020	10	0		DEAEHN
CC(C)CC[C@@](C)(O)CNC(=O)NCCN1CCC[C@@H](C)C1	ZINC000077774381	401830403	/nfs/dbraw/zinc/83/04/03/401830403.db2.gz	GQWYQJJDLGGUID-NVXWUHKLSA-N	0	3	313.486	2.205	10	0		DEAEHN
Cc1cnn(CCN[C@H]2CCCN(c3cccc(F)c3)C2=O)c1	ZINC000115542908	401831302	/nfs/dbraw/zinc/83/13/02/401831302.db2.gz	CRZTXQWOVFHCKW-INIZCTEOSA-N	0	3	316.380	2.116	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N2CC[C@@H](c3cnn(C)c3)C2)cc1	ZINC000116113305	401842120	/nfs/dbraw/zinc/84/21/20/401842120.db2.gz	MUWRZQHCTJWUJV-MRXNPFEDSA-N	0	3	312.417	2.111	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC(C)(C)c2nc(C)cs2)C1	ZINC000116535575	401854133	/nfs/dbraw/zinc/85/41/33/401854133.db2.gz	XXZPZHPXJZVQRX-LBPRGKRZSA-N	0	3	310.467	2.470	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2)CCO1	ZINC000116785326	401858633	/nfs/dbraw/zinc/85/86/33/401858633.db2.gz	HONIGCODNCXWFP-BZUAXINKSA-N	0	3	322.836	2.233	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1ccc([S@@](C)=O)cc1	ZINC000078615043	401858754	/nfs/dbraw/zinc/85/87/54/401858754.db2.gz	BFSBZIWQAMLUFI-SZNDQCEHSA-N	0	3	310.463	2.130	10	0		DEAEHN
CC[C@@H](Sc1ccccc1)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000116783280	401858789	/nfs/dbraw/zinc/85/87/89/401858789.db2.gz	RMOSUZFDSWDAAJ-GOEBONIOSA-N	0	3	322.474	2.346	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)NCCCC2CCCCC2)CCO1	ZINC000117033033	401867117	/nfs/dbraw/zinc/86/71/17/401867117.db2.gz	LMYPRBGOTLGELQ-INIZCTEOSA-N	0	3	311.470	2.319	10	0		DEAEHN
Cc1ccccc1[C@H](C)NC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000117023035	401867176	/nfs/dbraw/zinc/86/71/76/401867176.db2.gz	YOKCKVILYVFJHW-LSDHHAIUSA-N	0	3	305.422	2.028	10	0		DEAEHN
Cc1cccc([C@@H](C)NC(=O)N2CCO[C@H](CN(C)C)C2)c1C	ZINC000117052180	401867710	/nfs/dbraw/zinc/86/77/10/401867710.db2.gz	JUYQILAJYXFOEY-HZPDHXFCSA-N	0	3	319.449	2.336	10	0		DEAEHN
CC(C)OC(=O)c1ccc(CN2CCO[C@@H](CN(C)C)C2)cc1	ZINC000135057203	401925492	/nfs/dbraw/zinc/92/54/92/401925492.db2.gz	JTOPYPOCFFLDKW-KRWDZBQOSA-N	0	3	320.433	2.014	10	0		DEAEHN
COc1cc(C[NH2+][C@H]2CCO[C@H]2C)cc(Br)c1[O-]	ZINC000135312101	401935235	/nfs/dbraw/zinc/93/52/35/401935235.db2.gz	SIDMTCYVGRJIFF-KWQFWETISA-N	0	3	316.195	2.430	10	0		DEAEHN
COc1cc(CNCCO)cc(Br)c1OC(C)C	ZINC000033456716	401891405	/nfs/dbraw/zinc/89/14/05/401891405.db2.gz	DEOLQBSBNXSKJL-UHFFFAOYSA-N	0	3	318.211	2.327	10	0		DEAEHN
Cc1cccc(CN[C@@H](C)c2ccc(S(N)(=O)=O)cc2)c1	ZINC000035230409	401897122	/nfs/dbraw/zinc/89/71/22/401897122.db2.gz	PJOQCILMFZGPPV-ZDUSSCGKSA-N	0	3	304.415	2.493	10	0		DEAEHN
CC(C)NC(=O)CCN(CCc1ccccc1)[C@@H]1CCOC1	ZINC000084134022	401902338	/nfs/dbraw/zinc/90/23/38/401902338.db2.gz	ADWRIKNOLCRDQE-QGZVFWFLSA-N	0	3	304.434	2.235	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)Nc3ccccn3)cc2)CC1	ZINC000118758460	401907057	/nfs/dbraw/zinc/90/70/57/401907057.db2.gz	QVSRSDOTZXVZMX-UHFFFAOYSA-N	0	3	310.401	2.476	10	0		DEAEHN
Cc1nccn1-c1ccc([C@H](C)N[C@@H](C)CS(C)(=O)=O)cc1	ZINC000089633103	401954890	/nfs/dbraw/zinc/95/48/90/401954890.db2.gz	RHTMOVXOFDGJAB-STQMWFEESA-N	0	3	321.446	2.264	10	0		DEAEHN
CCCC[C@H](C(=O)OC)N1CCC[C@H](Cc2nccn2C)C1	ZINC000090003380	401978339	/nfs/dbraw/zinc/97/83/39/401978339.db2.gz	VXSAECIQRJLYNZ-HUUCEWRRSA-N	0	3	307.438	2.406	10	0		DEAEHN
CCn1c2ccccc2nc1[C@@H](C)NC1CCN(C(N)=O)CC1	ZINC000090037044	401979538	/nfs/dbraw/zinc/97/95/38/401979538.db2.gz	VOLZZIYPYCRZEG-GFCCVEGCSA-N	0	3	315.421	2.250	10	0		DEAEHN
COc1ccc(CNC(=O)CN2CCC[C@@H]2CSC)cc1	ZINC000135440517	401939226	/nfs/dbraw/zinc/93/92/26/401939226.db2.gz	LNXWDYLNENKUMA-CQSZACIVSA-N	0	3	308.447	2.139	10	0		DEAEHN
CCO[C@@H]1C[C@H](N(C)C[C@@H](C)CS(C)(=O)=O)C12CCCC2	ZINC000119367432	401945183	/nfs/dbraw/zinc/94/51/83/401945183.db2.gz	DNWJQMYWVAYJKQ-QLFBSQMISA-N	0	3	317.495	2.337	10	0		DEAEHN
C[C@H](C(=O)Nc1cc(-c2nccn2C)[nH]n1)N1CCCCCC1	ZINC000119369853	401945340	/nfs/dbraw/zinc/94/53/40/401945340.db2.gz	PFILYJSXXMILDY-GFCCVEGCSA-N	0	3	316.409	2.013	10	0		DEAEHN
CNc1snc(C)c1C(=O)NC[C@H]1CCCN1CC(C)C	ZINC000119422571	401949514	/nfs/dbraw/zinc/94/95/14/401949514.db2.gz	TVPCLVDMYNRPTI-GFCCVEGCSA-N	0	3	310.467	2.343	10	0		DEAEHN
CCN(CCNC(=O)NCc1ccn(C2CCCC2)n1)C1CC1	ZINC000151019100	402010929	/nfs/dbraw/zinc/01/09/29/402010929.db2.gz	AWACUOXJPIKOGY-UHFFFAOYSA-N	0	3	319.453	2.282	10	0		DEAEHN
CCCOc1cccc(CN2CC[C@@H](N3CCOCC3)C2)c1	ZINC000121047929	402011756	/nfs/dbraw/zinc/01/17/56/402011756.db2.gz	BHWUDZNLCKUBNI-QGZVFWFLSA-N	0	3	304.434	2.382	10	0		DEAEHN
CCCOc1cccc(CN2CC[C@H](N3CCOCC3)C2)c1	ZINC000121047796	402011977	/nfs/dbraw/zinc/01/19/77/402011977.db2.gz	BHWUDZNLCKUBNI-KRWDZBQOSA-N	0	3	304.434	2.382	10	0		DEAEHN
COCCCNC(=O)CN1C[C@@H](c2ccc(OC)cc2)C[C@H]1C	ZINC000151046672	402012627	/nfs/dbraw/zinc/01/26/27/402012627.db2.gz	VFHAGDNUCTUJFZ-ZBFHGGJFSA-N	0	3	320.433	2.026	10	0		DEAEHN
CCN1CCN(CCCCNC(=O)NC(C)(CC)CC)CC1	ZINC000121068320	402013340	/nfs/dbraw/zinc/01/33/40/402013340.db2.gz	NTARLQAEAAFFDK-UHFFFAOYSA-N	0	3	312.502	2.282	10	0		DEAEHN
O=C(CC1CCCC1)NC1CCN(CC2=CCCOC2)CC1	ZINC000093321450	402014648	/nfs/dbraw/zinc/01/46/48/402014648.db2.gz	HQKZETMOYVOCFD-UHFFFAOYSA-N	0	3	306.450	2.494	10	0		DEAEHN
CN(C)C[C@@H](NCc1cc(C(N)=O)cs1)c1ccccc1	ZINC000093685369	402018718	/nfs/dbraw/zinc/01/87/18/402018718.db2.gz	KUJRXPKGDMODMJ-OAHLLOKOSA-N	0	3	303.431	2.240	10	0		DEAEHN
CC(=O)Nc1ccc(Cl)c(C(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000121252045	402023268	/nfs/dbraw/zinc/02/32/68/402023268.db2.gz	PDZDGOSGFZRYER-LBPRGKRZSA-N	0	3	309.797	2.075	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H](C)Oc1ccc(OC)cc1)N(C)C	ZINC000121666997	402048052	/nfs/dbraw/zinc/04/80/52/402048052.db2.gz	KYRYSWCOWFSUGR-BBRMVZONSA-N	0	3	308.422	2.309	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2ccc(C)c(OC)c2)C1	ZINC000054780766	402072031	/nfs/dbraw/zinc/07/20/31/402072031.db2.gz	FMGAYPOSJAJDLR-HNNXBMFYSA-N	0	3	305.422	2.287	10	0		DEAEHN
CN(C)C[C@H](NC(=O)Cc1cn2ccccc2n1)c1ccccc1	ZINC000122625238	402087647	/nfs/dbraw/zinc/08/76/47/402087647.db2.gz	WSIPOYSKZCJWSJ-KRWDZBQOSA-N	0	3	322.412	2.296	10	0		DEAEHN
COc1cc(C)c([C@@H](C)N[C@@H]2CCC(=O)N(C)C2)cc1OC	ZINC000152362394	402091731	/nfs/dbraw/zinc/09/17/31/402091731.db2.gz	FRYQOOSXGBOZLD-CHWSQXEVSA-N	0	3	306.406	2.284	10	0		DEAEHN
NC(=O)c1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cn1	ZINC000122806486	402095231	/nfs/dbraw/zinc/09/52/31/402095231.db2.gz	FMLMSDQALVEOAS-UHFFFAOYSA-N	0	3	324.384	2.029	10	0		DEAEHN
CNC(=O)c1ccc(CN2CC[C@H](Oc3cccnc3)C2)cc1	ZINC000152473071	402097226	/nfs/dbraw/zinc/09/72/26/402097226.db2.gz	ZJEPBONYODFMSX-KRWDZBQOSA-N	0	3	311.385	2.095	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(Cc2ccccn2)C2CC2)C1	ZINC000057870666	402097223	/nfs/dbraw/zinc/09/72/23/402097223.db2.gz	NNYBYDCIPYRPRG-HNNXBMFYSA-N	0	3	302.422	2.240	10	0		DEAEHN
COCc1ccc(C(=O)N[C@@H](CN(C)C)c2ccccc2)o1	ZINC000096990237	402100005	/nfs/dbraw/zinc/10/00/05/402100005.db2.gz	OHMHDDAGRVPHBK-HNNXBMFYSA-N	0	3	302.374	2.459	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)CCc2nc(C(C)(C)C)no2)CCN1C	ZINC000123055784	402108436	/nfs/dbraw/zinc/10/84/36/402108436.db2.gz	WZSUUUKQBFLWDD-STQMWFEESA-N	0	3	322.453	2.241	10	0		DEAEHN
C[C@H]1CC[C@H](C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)O1	ZINC000153005901	402121997	/nfs/dbraw/zinc/12/19/97/402121997.db2.gz	QILBKAMRGOCVNV-SWLSCSKDSA-N	0	3	319.405	2.061	10	0		DEAEHN
CN(Cc1csc(Br)c1)CC1(O)CCOCC1	ZINC000123179463	402114521	/nfs/dbraw/zinc/11/45/21/402114521.db2.gz	FXDZHQKIOZEUIJ-UHFFFAOYSA-N	0	3	320.252	2.484	10	0		DEAEHN
CC(C)[C@@H](O)CC(=O)NC(C)(C)CN(C)Cc1ccccc1	ZINC000153119165	402127676	/nfs/dbraw/zinc/12/76/76/402127676.db2.gz	CWSNZKQUYHQQNX-INIZCTEOSA-N	0	3	306.450	2.420	10	0		DEAEHN
O=S(=O)(NCc1ccc2c(c1)CNC2)c1cccc(Cl)c1	ZINC000097829541	402133299	/nfs/dbraw/zinc/13/32/99/402133299.db2.gz	YDZZCOFLONGNIA-UHFFFAOYSA-N	0	3	322.817	2.422	10	0		DEAEHN
O=C(NCc1nc(C2CC2)cs1)N1CC[C@H](N2CC=CC2)C1	ZINC000123369682	402123872	/nfs/dbraw/zinc/12/38/72/402123872.db2.gz	QNOGVZPCTQWRHH-ZDUSSCGKSA-N	0	3	318.446	2.176	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1noc2c1CCCCC2	ZINC000153442804	402145871	/nfs/dbraw/zinc/14/58/71/402145871.db2.gz	VVFQXYLHSIDHBF-QWHCGFSZSA-N	0	3	303.406	2.252	10	0		DEAEHN
CC(C)CCOc1ccc([C@H](C)N[C@H](C)C(=O)NC(N)=O)cc1	ZINC000101583036	402150423	/nfs/dbraw/zinc/15/04/23/402150423.db2.gz	QDJPQSCTPWAKDG-QWHCGFSZSA-N	0	3	321.421	2.346	10	0		DEAEHN
COC[C@H](C)C(=O)Nc1ccccc1NC1CCN(C)CC1	ZINC000103434363	402187842	/nfs/dbraw/zinc/18/78/42/402187842.db2.gz	BCBJTIRKUMYSMF-ZDUSSCGKSA-N	0	3	305.422	2.414	10	0		DEAEHN
COc1cccc(CNC(=O)N[C@H](C)CN2CCC[C@H](C)C2)n1	ZINC000101993181	402160483	/nfs/dbraw/zinc/16/04/83/402160483.db2.gz	JETUSIHNEWLTMG-UONOGXRCSA-N	0	3	320.437	2.010	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cccc(OC(F)(F)F)c1	ZINC000154669619	402225488	/nfs/dbraw/zinc/22/54/88/402225488.db2.gz	JJLFNYUDQRAMDC-NSHDSACASA-N	0	3	302.296	2.409	10	0		DEAEHN
Cc1c(CCC(=O)N[C@H](CN(C)C)c2ccccc2)cnn1C	ZINC000125390750	402229835	/nfs/dbraw/zinc/22/98/35/402229835.db2.gz	HHNWVDDJQSREBN-QGZVFWFLSA-N	0	3	314.433	2.080	10	0		DEAEHN
C[C@]1(CNC(=O)C2(O)CCCC2)CCCN1Cc1ccccc1	ZINC000154846355	402235891	/nfs/dbraw/zinc/23/58/91/402235891.db2.gz	SSOWIXGLKLWGMA-GOSISDBHSA-N	0	3	316.445	2.462	10	0		DEAEHN
CC(C)c1noc2ncc(C(=O)NC[C@@H]3CCCN(C)C3)cc21	ZINC000108329612	402250006	/nfs/dbraw/zinc/25/00/06/402250006.db2.gz	RROUAJWOPWMUSB-LBPRGKRZSA-N	0	3	316.405	2.418	10	0		DEAEHN
CCc1noc(CC)c1CC(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000155497844	402259272	/nfs/dbraw/zinc/25/92/72/402259272.db2.gz	HJVKQAKHPMNNBM-SWLSCSKDSA-N	0	3	307.438	2.187	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)N[C@H]1CCOC(C)(C)C1	ZINC000155563461	402260700	/nfs/dbraw/zinc/26/07/00/402260700.db2.gz	GJXMUNRITAKIKM-AWEZNQCLSA-N	0	3	320.433	2.314	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCO[C@H](c2ccsc2)C1)N(C)C1CC1	ZINC000124967964	402206236	/nfs/dbraw/zinc/20/62/36/402206236.db2.gz	HNDRSOXAQKMQIB-WFASDCNBSA-N	0	3	323.462	2.314	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2cnc(C3CC3)nc2)CCN1C	ZINC000176113391	402279788	/nfs/dbraw/zinc/27/97/88/402279788.db2.gz	LLPCZIPXTJAAFT-BXUZGUMPSA-N	0	3	303.410	2.300	10	0		DEAEHN
CC1(C)CC[C@@H](CN2CCC(c3ccnn3CCO)CC2)O1	ZINC000184669680	402290310	/nfs/dbraw/zinc/29/03/10/402290310.db2.gz	RSZXFFPNEIBHJE-HNNXBMFYSA-N	0	3	307.438	2.012	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)NCCc1cc(F)ccc1F	ZINC000176400982	402306019	/nfs/dbraw/zinc/30/60/19/402306019.db2.gz	MFGXPEJXVZXERE-CQSZACIVSA-N	0	3	311.376	2.291	10	0		DEAEHN
CC(C)[C@@](C)(O)CN1CCCN(C(=O)c2ccsc2)CC1	ZINC000184967495	402313591	/nfs/dbraw/zinc/31/35/91/402313591.db2.gz	FCRVQKIFRHRLHI-INIZCTEOSA-N	0	3	310.463	2.303	10	0		DEAEHN
CCOC[C@@H]1CCCN(Cc2cc(-c3cnn(C)c3)no2)C1	ZINC000185005015	402316159	/nfs/dbraw/zinc/31/61/59/402316159.db2.gz	GJQHDRAGOGKRBJ-CYBMUJFWSA-N	0	3	304.394	2.324	10	0		DEAEHN
Cn1cc(-c2cc(CN3CC[C@H]4OCCC[C@@H]4C3)on2)cn1	ZINC000185027869	402317955	/nfs/dbraw/zinc/31/79/55/402317955.db2.gz	BHDNDNNIHATEFV-MLGOLLRUSA-N	0	3	302.378	2.076	10	0		DEAEHN
CN(Cc1cc(-c2cnn(C)c2)no1)C[C@H]1CCCC[C@@H]1O	ZINC000185058418	402321036	/nfs/dbraw/zinc/32/10/36/402321036.db2.gz	HRQHLZBNLKCQCX-WBMJQRKESA-N	0	3	304.394	2.058	10	0		DEAEHN
Cc1ncsc1CN(C)C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000176836962	402341555	/nfs/dbraw/zinc/34/15/55/402341555.db2.gz	UNLJPTXCKDFUKE-AAEUAGOBSA-N	0	3	310.467	2.322	10	0		DEAEHN
CC[C@H](CNC(=O)N1CC[C@H](N(C)C)C1)Oc1cccc(C)c1	ZINC000176841400	402342087	/nfs/dbraw/zinc/34/20/87/402342087.db2.gz	DMJRWWCCRCLJGH-JKSUJKDBSA-N	0	3	319.449	2.498	10	0		DEAEHN
C[C@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)C1CCCC1	ZINC000185393267	402349075	/nfs/dbraw/zinc/34/90/75/402349075.db2.gz	ZUJHVYUPPJOTBN-HNNXBMFYSA-N	0	3	324.513	2.280	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@H]2CCCC[NH2+]C2)sc1Cl	ZINC000231810355	402357018	/nfs/dbraw/zinc/35/70/18/402357018.db2.gz	YATSVZRTNISCEG-VIFPVBQESA-N	0	3	308.856	2.130	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccccc1OCCOC	ZINC000177016260	402359560	/nfs/dbraw/zinc/35/95/60/402359560.db2.gz	JNNSMMKBLVJXJJ-OAHLLOKOSA-N	0	3	320.433	2.268	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C[C@@H](C)NC(=O)C1CCCC1	ZINC000177032703	402361497	/nfs/dbraw/zinc/36/14/97/402361497.db2.gz	WLBBQHRYNLTGJY-ZBFHGGJFSA-N	0	3	323.481	2.014	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(-c2ccncc2)on1	ZINC000177037142	402362209	/nfs/dbraw/zinc/36/22/09/402362209.db2.gz	CMMNFVCMCVCKCS-CQSZACIVSA-N	0	3	314.389	2.293	10	0		DEAEHN
C[C@@H]1CN(CCOc2ccccc2Cl)C[C@@H]1N1CCOCC1	ZINC000177221523	402382675	/nfs/dbraw/zinc/38/26/75/402382675.db2.gz	JSSNYZPTBKKBDB-ZBFHGGJFSA-N	0	3	324.852	2.371	10	0		DEAEHN
OC[C@H]1C[C@H](O)CN1CCCOc1cccc2ccccc21	ZINC000185179841	402330968	/nfs/dbraw/zinc/33/09/68/402330968.db2.gz	AFTVDRWSBDLOJP-CVEARBPZSA-N	0	3	301.386	2.036	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)CCc2cccc3c2OCO3)CCN1C	ZINC000186041742	402398119	/nfs/dbraw/zinc/39/81/19/402398119.db2.gz	RNCQYEVDOUHACE-DZGCQCFKSA-N	0	3	318.417	2.289	10	0		DEAEHN
CC(C)n1ccnc1CN1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000161864769	402401779	/nfs/dbraw/zinc/40/17/79/402401779.db2.gz	QQRPTHWXLFAURN-QGZVFWFLSA-N	0	3	319.497	2.066	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCc1sc(C)nc1C	ZINC000177498663	402409430	/nfs/dbraw/zinc/40/94/30/402409430.db2.gz	RHWHPZYWEFKMCV-CQSZACIVSA-N	0	3	324.494	2.428	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2cn3ccccc3n2)C12CCOCC2	ZINC000186211608	402410740	/nfs/dbraw/zinc/41/07/40/402410740.db2.gz	CISRECOJWMKYJY-JKSUJKDBSA-N	0	3	315.417	2.398	10	0		DEAEHN
COCCC1(CNC(=O)N2CCN3CCC[C@H]3C2)CCCCC1	ZINC000186283718	402417851	/nfs/dbraw/zinc/41/78/51/402417851.db2.gz	MJHGHRRCXBMZPH-INIZCTEOSA-N	0	3	323.481	2.463	10	0		DEAEHN
CCN(C(=O)[C@@H](C)COC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000186309453	402419771	/nfs/dbraw/zinc/41/97/71/402419771.db2.gz	HCCKMCRWAALSRE-RDJZCZTQSA-N	0	3	304.434	2.392	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)Nc1ccccc1OC	ZINC000177697249	402427816	/nfs/dbraw/zinc/42/78/16/402427816.db2.gz	JEUWVYXOLHFYKZ-CQSZACIVSA-N	0	3	305.422	2.050	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)NCc1ccc(F)cc1	ZINC000177713861	402429713	/nfs/dbraw/zinc/42/97/13/402429713.db2.gz	IZKXGJIXFOCQEA-YOEHRIQHSA-N	0	3	321.440	2.247	10	0		DEAEHN
CCC[C@H](C(=O)NC1CCC(O)(c2cccnc2)CC1)N(C)C	ZINC000186503794	402437053	/nfs/dbraw/zinc/43/70/53/402437053.db2.gz	UELPZWQBBPSOSE-UPTPFMHGSA-N	0	3	319.449	2.058	10	0		DEAEHN
COc1ccc(O)cc1C(=O)N1CCC[C@@H]1CN1CCCCC1	ZINC000186525112	402439175	/nfs/dbraw/zinc/43/91/75/402439175.db2.gz	NKOCSWWRVMAYDP-CQSZACIVSA-N	0	3	318.417	2.491	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(CCn3ccnc3)C2)c1	ZINC000163237671	402444882	/nfs/dbraw/zinc/44/48/82/402444882.db2.gz	VKUAAJIJMIPVKP-CQSZACIVSA-N	0	3	301.390	2.390	10	0		DEAEHN
Cc1ccc([C@@H](CNC(=O)NCC2(CCO)CC2)N(C)C)cc1	ZINC000186618045	402448071	/nfs/dbraw/zinc/44/80/71/402448071.db2.gz	RUDJVXQJZYHPQQ-MRXNPFEDSA-N	0	3	319.449	2.060	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)N(C)C	ZINC000161540228	402390791	/nfs/dbraw/zinc/39/07/91/402390791.db2.gz	QZPUQQBJZLHLGS-QZTJIDSGSA-N	0	3	317.477	2.498	10	0		DEAEHN
CN(C)Cc1cc(CNC(=O)[C@H](N)c2ccccc2)ccc1F	ZINC000237048586	402392985	/nfs/dbraw/zinc/39/29/85/402392985.db2.gz	SYMLQJPZOIVMSE-QGZVFWFLSA-N	0	3	315.392	2.204	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1ccc(OC)c(F)c1	ZINC000177355376	402393997	/nfs/dbraw/zinc/39/39/97/402393997.db2.gz	ULNZRZZVMMZQNA-CQSZACIVSA-N	0	3	323.412	2.460	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2COc3ccccc3C2)CCN1C	ZINC000246097710	402509837	/nfs/dbraw/zinc/50/98/37/402509837.db2.gz	HABPMEKSBRBRSC-VNQPRFMTSA-N	0	3	317.433	2.114	10	0		DEAEHN
CC(C)(C)OC[C@@H](O)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000186665016	402452818	/nfs/dbraw/zinc/45/28/18/402452818.db2.gz	JHBIISMITHGVKK-MAUKXSAKSA-N	0	3	305.418	2.294	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)CSC[C@H]1CCCCO1	ZINC000245398800	402455916	/nfs/dbraw/zinc/45/59/16/402455916.db2.gz	UOMGNKXACANRCN-HUUCEWRRSA-N	0	3	314.495	2.279	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(=O)NC2CCN(CCc3ccccc3)CC2)O1	ZINC000178057454	402456216	/nfs/dbraw/zinc/45/62/16/402456216.db2.gz	KJEKYBNQJRIDLR-QAPCUYQASA-N	0	3	316.445	2.377	10	0		DEAEHN
COC[C@@H](NC(=O)NCCN1CCCC[C@@H]1C)c1ccco1	ZINC000245425045	402459249	/nfs/dbraw/zinc/45/92/49/402459249.db2.gz	DKFCWCHDWDFUAN-UONOGXRCSA-N	0	3	309.410	2.141	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@@H]1COc2ccccc2C1	ZINC000245428963	402460047	/nfs/dbraw/zinc/46/00/47/402460047.db2.gz	JSXAXTLWSOEVLA-HOTGVXAUSA-N	0	3	302.418	2.180	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)NC[C@H]1CCCS1	ZINC000164390941	402461874	/nfs/dbraw/zinc/46/18/74/402461874.db2.gz	ONGQDLYEPGGRHX-HZPDHXFCSA-N	0	3	321.490	2.354	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000245470647	402463799	/nfs/dbraw/zinc/46/37/99/402463799.db2.gz	NCAMHGFEFYSKTJ-ZBFHGGJFSA-N	0	3	319.449	2.449	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cnn(CC(C)C)c1C	ZINC000164510010	402463822	/nfs/dbraw/zinc/46/38/22/402463822.db2.gz	IBIHNLPEWCKRBP-HNNXBMFYSA-N	0	3	306.454	2.404	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)NCc1cccs1	ZINC000245472846	402464172	/nfs/dbraw/zinc/46/41/72/402464172.db2.gz	PKUKICRGUIFFKW-ZIAGYGMSSA-N	0	3	309.479	2.169	10	0		DEAEHN
Cc1cccnc1CN1CCC[C@@H]1CN1C[C@@H](C)O[C@H](C)C1	ZINC000245535288	402468358	/nfs/dbraw/zinc/46/83/58/402468358.db2.gz	KPUPUJHFNWZMOI-BRWVUGGUSA-N	0	3	303.450	2.464	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCCc2ccccn2)[C@H]1c1ccccc1	ZINC000245620377	402474184	/nfs/dbraw/zinc/47/41/84/402474184.db2.gz	DXUAYNYNSWBWRS-ZWKOTPCHSA-N	0	3	324.428	2.369	10	0		DEAEHN
Cc1nnc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)s1	ZINC000245649032	402476660	/nfs/dbraw/zinc/47/66/60/402476660.db2.gz	MIOZWWRYSWYJNG-STQMWFEESA-N	0	3	317.418	2.413	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCc2ccccn2)[C@H]1c1ccccc1	ZINC000245663321	402478099	/nfs/dbraw/zinc/47/80/99/402478099.db2.gz	QIELEZYDGIIWDJ-DLBZAZTESA-N	0	3	310.401	2.326	10	0		DEAEHN
CCC(C)(C)NC(=O)[C@H](C)N1CCC[C@@H]1Cn1ccnc1C	ZINC000178291142	402480610	/nfs/dbraw/zinc/48/06/10/402480610.db2.gz	GFYKTKVHSZTWRA-DZGCQCFKSA-N	0	3	306.454	2.349	10	0		DEAEHN
CC(C)(C)OC[C@@H](O)CN1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1	ZINC000245703681	402480874	/nfs/dbraw/zinc/48/08/74/402480874.db2.gz	CURAMFPEZCWRNM-KGLIPLIRSA-N	0	3	322.453	2.038	10	0		DEAEHN
Cc1cnc([C@H](C)CNC(=O)N2CCCN(C3CC3)CC2)s1	ZINC000187079814	402481579	/nfs/dbraw/zinc/48/15/79/402481579.db2.gz	PJMOXLXWKUXATE-GFCCVEGCSA-N	0	3	322.478	2.435	10	0		DEAEHN
CC[C@H]1CN(Cc2cccc3[nH]ccc32)CCN1C[C@H](C)O	ZINC000245717227	402482603	/nfs/dbraw/zinc/48/26/03/402482603.db2.gz	HEUIZFTUTMCJIY-HOCLYGCPSA-N	0	3	301.434	2.445	10	0		DEAEHN
CCc1ccc([C@@H](CNC(=O)CCCCC(N)=O)N(C)C)cc1	ZINC000187178558	402486675	/nfs/dbraw/zinc/48/66/75/402486675.db2.gz	FORUUZWFSAAKSH-MRXNPFEDSA-N	0	3	319.449	2.014	10	0		DEAEHN
O=C1[C@H](N2CCN3CCC[C@H]3C2)CCCN1c1ccccc1F	ZINC000245781514	402487750	/nfs/dbraw/zinc/48/77/50/402487750.db2.gz	MGLINLPOLHRZSW-WMLDXEAASA-N	0	3	317.408	2.101	10	0		DEAEHN
CN1C(=O)CCc2cc(CN[C@H]3Cc4ccccc4[C@H]3O)ccc21	ZINC000187245427	402490134	/nfs/dbraw/zinc/49/01/34/402490134.db2.gz	WJDFLMXKBVWKLB-FXAWDEMLSA-N	0	3	322.408	2.344	10	0		DEAEHN
COc1ccc(O)cc1C(=O)NCc1ccccc1CN(C)C	ZINC000187266663	402490878	/nfs/dbraw/zinc/49/08/78/402490878.db2.gz	LDMAWGDQRKDYQX-UHFFFAOYSA-N	0	3	314.385	2.392	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CC[C@@H]3[C@@H](CCCN3C)C2)c(C)o1	ZINC000245919224	402497416	/nfs/dbraw/zinc/49/74/16/402497416.db2.gz	QLWWZVFZVGVEBH-UONOGXRCSA-N	0	3	312.435	2.001	10	0		DEAEHN
O=C(NCC1(Cc2ccccc2)CC1)N1CCN2CCC[C@@H]2C1	ZINC000178455085	402500739	/nfs/dbraw/zinc/50/07/39/402500739.db2.gz	ANYGRORQCRJJAQ-QGZVFWFLSA-N	0	3	313.445	2.499	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)NCCc2ccccc2F)C1	ZINC000245959305	402500960	/nfs/dbraw/zinc/50/09/60/402500960.db2.gz	MJTQUAQIUWMDIZ-RDJZCZTQSA-N	0	3	319.424	2.494	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)NCc2ccc(F)cc2)C1	ZINC000245961457	402500982	/nfs/dbraw/zinc/50/09/82/402500982.db2.gz	UVTJEPAJZQSDCM-HOCLYGCPSA-N	0	3	305.397	2.451	10	0		DEAEHN
CC(C)[C@@H](CNC(=O)N1CCN2CCC[C@H]2C1)c1cccnc1	ZINC000246160103	402514030	/nfs/dbraw/zinc/51/40/30/402514030.db2.gz	QJGSFDIHYBPFGV-DLBZAZTESA-N	0	3	316.449	2.311	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)Nc1nnc(C(F)F)s1	ZINC000246089668	402508308	/nfs/dbraw/zinc/50/83/08/402508308.db2.gz	INNBNZTXHOBOJN-YUMQZZPRSA-N	0	3	317.365	2.176	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)[C@H](C)[C@H](N)c1ccccc1	ZINC000178809715	402542874	/nfs/dbraw/zinc/54/28/74/402542874.db2.gz	QMHDGIIYCMXBAT-PBHICJAKSA-N	0	3	314.433	2.491	10	0		DEAEHN
CN(C)c1nc(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)ns1	ZINC000246793287	402545176	/nfs/dbraw/zinc/54/51/76/402545176.db2.gz	MJZPZFFDZCIDJJ-JSGCOSHPSA-N	0	3	321.494	2.053	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(-c2ncon2)cc1	ZINC000246813877	402545814	/nfs/dbraw/zinc/54/58/14/402545814.db2.gz	CFPHEZRLFUBFPR-DOMZBBRYSA-N	0	3	312.373	2.045	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cnc2ccccc2n1	ZINC000246826171	402546405	/nfs/dbraw/zinc/54/64/05/402546405.db2.gz	AKVKWUYAVHLWGQ-KGLIPLIRSA-N	0	3	310.401	2.329	10	0		DEAEHN
CC(C)OC1CC(NCc2cnc(N3CCOCC3)c(F)c2)C1	ZINC000189580583	402546911	/nfs/dbraw/zinc/54/69/11/402546911.db2.gz	ZTHXILFIDXREMN-UHFFFAOYSA-N	0	3	323.412	2.103	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1C[C@@H](C)CCC[C@@H]1C	ZINC000246922102	402549650	/nfs/dbraw/zinc/54/96/50/402549650.db2.gz	JEMACGWFAWGGII-HRCADAONSA-N	0	3	311.470	2.317	10	0		DEAEHN
Cc1cccc(C)c1OCCN1CCN(C[C@@H](C)O)[C@@H](C)C1	ZINC000246999623	402553066	/nfs/dbraw/zinc/55/30/66/402553066.db2.gz	BLZVRLCKASVIPK-DLBZAZTESA-N	0	3	306.450	2.069	10	0		DEAEHN
CC(C)C(=O)Nc1cccc(NC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000171075109	402554881	/nfs/dbraw/zinc/55/48/81/402554881.db2.gz	KLFFHSDAVGVOPW-OAHLLOKOSA-N	0	3	318.421	2.449	10	0		DEAEHN
CCOc1ccc(NC(=O)N2CC[C@H](N(C)C)C2)cc1OC	ZINC000171072657	402554886	/nfs/dbraw/zinc/55/48/86/402554886.db2.gz	NKXWDZLENWJBFH-ZDUSSCGKSA-N	0	3	307.394	2.262	10	0		DEAEHN
CC(C)C[C@@H]1COCCN1C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000247367979	402565128	/nfs/dbraw/zinc/56/51/28/402565128.db2.gz	OYRBBKGFMXCLMH-XHSDSOJGSA-N	0	3	311.470	2.172	10	0		DEAEHN
C[C@H](C(=O)N1CCO[C@@H](c2nccs2)C1)N1[C@H](C)CC[C@@H]1C	ZINC000247493934	402569682	/nfs/dbraw/zinc/56/96/82/402569682.db2.gz	MGIFJCTVNMEKDW-XJFOESAGSA-N	0	3	323.462	2.304	10	0		DEAEHN
COC(=O)Nc1cccc(C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000247511643	402570676	/nfs/dbraw/zinc/57/06/76/402570676.db2.gz	YKZBUHVVHQPNEV-IUODEOHRSA-N	0	3	319.405	2.323	10	0		DEAEHN
C[C@H](Oc1cccc(F)c1)C(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000247520367	402570731	/nfs/dbraw/zinc/57/07/31/402570731.db2.gz	WQQWLVYMBRPNJE-KCQAQPDRSA-N	0	3	306.381	2.288	10	0		DEAEHN
O=C(CC1CCC2(CC1)OCCO2)N1CCCN(C2CC2)CC1	ZINC000188341379	402519489	/nfs/dbraw/zinc/51/94/89/402519489.db2.gz	YVZOXBMRROOSRV-UHFFFAOYSA-N	0	3	322.449	2.007	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)C1CCN(C[C@H](O)CC(F)(F)F)CC1	ZINC000188964225	402529329	/nfs/dbraw/zinc/52/93/29/402529329.db2.gz	FVLBGTDRBHWQJR-WCQYABFASA-N	0	3	324.387	2.172	10	0		DEAEHN
CC(C)N(CCN(C)C)C(=O)N[C@H]1CCOc2ccccc21	ZINC000178708218	402529371	/nfs/dbraw/zinc/52/93/71/402529371.db2.gz	PGJYOAQXGLKCGF-HNNXBMFYSA-N	0	3	305.422	2.492	10	0		DEAEHN
Cc1cccc(C)c1OC[C@@H](C)NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170833985	402530719	/nfs/dbraw/zinc/53/07/19/402530719.db2.gz	FEQOYQBLXVONTP-HZPDHXFCSA-N	0	3	319.449	2.416	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)N[C@H]2CCCOc3ccccc32)C1	ZINC000170836044	402531512	/nfs/dbraw/zinc/53/15/12/402531512.db2.gz	MIRNVLIHXIOIRF-ZFWWWQNUSA-N	0	3	303.406	2.246	10	0		DEAEHN
CC(C)COC[C@H](NC(=O)N1CC[C@@H](N(C)C)C1)c1ccco1	ZINC000170836068	402531655	/nfs/dbraw/zinc/53/16/55/402531655.db2.gz	BFZDQVSLKXLUEH-CABCVRRESA-N	0	3	323.437	2.339	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)C(=O)Nc2ccccc2C(C)(C)C)C1	ZINC000170845128	402532234	/nfs/dbraw/zinc/53/22/34/402532234.db2.gz	OYLWKQXSPOGZBG-ZDUSSCGKSA-N	0	3	317.433	2.085	10	0		DEAEHN
Cc1cc(C)n(-c2ccc(C(=O)N3CC[C@H](N(C)C)C3)cc2)n1	ZINC000170862377	402534085	/nfs/dbraw/zinc/53/40/85/402534085.db2.gz	PESYGZYFUHKFHV-KRWDZBQOSA-N	0	3	312.417	2.265	10	0		DEAEHN
COc1cc(C(=O)N2CC[C@@H](N(C)C)C2)ccc1OC(F)F	ZINC000170862176	402534270	/nfs/dbraw/zinc/53/42/70/402534270.db2.gz	GPVAOBUTULGHSX-LLVKDONJSA-N	0	3	314.332	2.073	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)CCC(=O)c2ccc(Cl)cc2)C1	ZINC000170863391	402534287	/nfs/dbraw/zinc/53/42/87/402534287.db2.gz	FMVKXBUCACIFRR-CQSZACIVSA-N	0	3	308.809	2.465	10	0		DEAEHN
CN(CC1CCN(C)CC1)C(=O)N[C@H]1COc2ccccc21	ZINC000170880659	402537249	/nfs/dbraw/zinc/53/72/49/402537249.db2.gz	PPIZWTDNDBBNQY-HNNXBMFYSA-N	0	3	303.406	2.103	10	0		DEAEHN
COc1ccccc1COC[C@@H](O)CN1CCS[C@@H](C)C1	ZINC000170901521	402539827	/nfs/dbraw/zinc/53/98/27/402539827.db2.gz	ILZFTFLVTXKHIX-ZFWWWQNUSA-N	0	3	311.447	2.010	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21	ZINC000248570104	402596033	/nfs/dbraw/zinc/59/60/33/402596033.db2.gz	LREJGIBVCQIKCO-FGTMMUONSA-N	0	3	313.445	2.450	10	0		DEAEHN
COC(=O)[C@@H](c1ccccc1C)N1CCN2CCCC[C@H]2C1	ZINC000248604088	402597980	/nfs/dbraw/zinc/59/79/80/402597980.db2.gz	DXUIIMQOBCAUQK-DOTOQJQBSA-N	0	3	302.418	2.379	10	0		DEAEHN
O=C(c1sccc1OC(F)F)N1CCN2CCC[C@H]2C1	ZINC000171587190	402598062	/nfs/dbraw/zinc/59/80/62/402598062.db2.gz	QYELBIJWINPEKA-VIFPVBQESA-N	0	3	302.346	2.270	10	0		DEAEHN
CO[C@H](C)CNC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000190407711	402598725	/nfs/dbraw/zinc/59/87/25/402598725.db2.gz	XXXVGZXLSCWGHE-WBVHZDCISA-N	0	3	319.449	2.375	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NC[C@@H](c2ccccc2)N(C)C)CC[C@H]1C	ZINC000190452866	402602401	/nfs/dbraw/zinc/60/24/01/402602401.db2.gz	UUIUWNZMOXIESH-HYVNUMGLSA-N	0	3	319.449	2.356	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(Cc2cc[nH]n2)C1	ZINC000190468846	402603561	/nfs/dbraw/zinc/60/35/61/402603561.db2.gz	HMTPATUSIYOSIJ-ZDUSSCGKSA-N	0	3	305.451	2.129	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](N[C@@H](Cc2ccc(Cl)cc2)C(N)=O)C1	ZINC000248706580	402604305	/nfs/dbraw/zinc/60/43/05/402604305.db2.gz	ABYGCGGRDMUVKX-UHOFOFEASA-N	0	3	323.868	2.055	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccccc2OC(F)(F)F)C1	ZINC000180163217	402608926	/nfs/dbraw/zinc/60/89/26/402608926.db2.gz	SAIWXFKHPVVGOA-SNVBAGLBSA-N	0	3	302.296	2.361	10	0		DEAEHN
CC(C)COC1CCN(C(=O)NC[C@@H](C)N(C)C2CC2)CC1	ZINC000171695546	402611358	/nfs/dbraw/zinc/61/13/58/402611358.db2.gz	FTLRCXATPHBRJV-CQSZACIVSA-N	0	3	311.470	2.316	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CCOC[C@H]1C	ZINC000248881431	402612963	/nfs/dbraw/zinc/61/29/63/402612963.db2.gz	SKNYXJURVQGUAV-BFYDXBDKSA-N	0	3	304.434	2.296	10	0		DEAEHN
CN(CC1CCN(C)CC1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000171738471	402616789	/nfs/dbraw/zinc/61/67/89/402616789.db2.gz	XOSSJWCTEQNFBG-INIZCTEOSA-N	0	3	317.433	2.493	10	0		DEAEHN
C[C@H](O)CN(Cc1ccc(C(=O)OC(C)(C)C)cc1)[C@@H](C)CO	ZINC000190860899	402628359	/nfs/dbraw/zinc/62/83/59/402628359.db2.gz	YFZYMFJFEXQIJW-KBPBESRZSA-N	0	3	323.433	2.206	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(C(=O)Nc3ccsc3)C2)CC1	ZINC000180573206	402620272	/nfs/dbraw/zinc/62/02/72/402620272.db2.gz	VWYGQTSNZBUBLC-HNNXBMFYSA-N	0	3	322.478	2.382	10	0		DEAEHN
Cc1cc(CCNC(=O)N2CCC[C@@H](N(C)C)C2)cc(C)c1O	ZINC000190919982	402631699	/nfs/dbraw/zinc/63/16/99/402631699.db2.gz	XNAAVOYWGUSBHH-MRXNPFEDSA-N	0	3	319.449	2.287	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000249635461	402637512	/nfs/dbraw/zinc/63/75/12/402637512.db2.gz	RXKPUXGJDSXTSA-LLLHUVSDSA-N	0	3	302.418	2.363	10	0		DEAEHN
CCOC(=O)CN(C)C(=O)CN[C@@H](C)c1ccc(C(C)C)cc1	ZINC000171912693	402633260	/nfs/dbraw/zinc/63/32/60/402633260.db2.gz	UMKGFUATHXUBDS-AWEZNQCLSA-N	0	3	320.433	2.482	10	0		DEAEHN
Cc1ccccc1CCNC(=O)CN(C)[C@@]1(CO)CC[C@@H](C)C1	ZINC000249529760	402633589	/nfs/dbraw/zinc/63/35/89/402633589.db2.gz	AQSAPHNTAXXWJR-BEFAXECRSA-N	0	3	318.461	2.137	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COc2c(C)cccc2C)CC[C@H]1C	ZINC000251887167	402650601	/nfs/dbraw/zinc/65/06/01/402650601.db2.gz	QBEMHJPJZMDPEN-KBRIMQKVSA-N	0	3	307.434	2.400	10	0		DEAEHN
COc1cc(C[NH2+]C[C@@H](C)OC)cc(Br)c1[O-]	ZINC000191209025	402650842	/nfs/dbraw/zinc/65/08/42/402650842.db2.gz	AJSNSDGHYGGWAQ-MRVPVSSYSA-N	0	3	304.184	2.288	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@H](C)N2CCc3ccccc3C2)C1	ZINC000252441899	402652877	/nfs/dbraw/zinc/65/28/77/402652877.db2.gz	DKDKSSCQDFJUDL-YJBOKZPZSA-N	0	3	315.461	2.034	10	0		DEAEHN
COCCCN(C)CCNC(=O)N[C@H]1CCCc2ccccc21	ZINC000173577305	402703491	/nfs/dbraw/zinc/70/34/91/402703491.db2.gz	SENCMQDUCGWXMM-KRWDZBQOSA-N	0	3	319.449	2.332	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@@H]2CN1C(=O)C[C@@H](N)c1ccccc1	ZINC000262041471	402721581	/nfs/dbraw/zinc/72/15/81/402721581.db2.gz	BYHLWYRMMOBOMR-DJIMGWMZSA-N	0	3	301.434	2.162	10	0		DEAEHN
Cc1ccc(C[C@@H](C)NC(=O)N2CCN3CCC[C@@H]3C2)s1	ZINC000172611156	402666506	/nfs/dbraw/zinc/66/65/06/402666506.db2.gz	RLHXTRJEVSPBGO-TZMCWYRMSA-N	0	3	307.463	2.477	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2snnc2C(C)(C)C)CCN1C	ZINC000191430470	402669265	/nfs/dbraw/zinc/66/92/65/402669265.db2.gz	WBLBSSHDQUHTGI-WDEREUQCSA-N	0	3	310.467	2.390	10	0		DEAEHN
Cc1ccc(C)c(OCCN2CC[C@@H](N3CCOCC3)C2)c1	ZINC000173925154	402719422	/nfs/dbraw/zinc/71/94/22/402719422.db2.gz	GGVLVICNECBAKA-QGZVFWFLSA-N	0	3	304.434	2.089	10	0		DEAEHN
FC(F)(F)Cn1ccnc1CN1CCN2CCCC[C@@H]2C1	ZINC000172801604	402676628	/nfs/dbraw/zinc/67/66/28/402676628.db2.gz	UPEWLKDUPCFISM-GFCCVEGCSA-N	0	3	302.344	2.116	10	0		DEAEHN
CCC[C@@H]1CCc2nc(NC(=O)C3(N)CCOCC3)sc2C1	ZINC000261958019	402719937	/nfs/dbraw/zinc/71/99/37/402719937.db2.gz	ZYAMYYXJAPBCLC-LLVKDONJSA-N	0	3	323.462	2.495	10	0		DEAEHN
Cc1cc(C)cc(OCCCN2CC[C@H](N3CCOCC3)C2)c1	ZINC000173944445	402720665	/nfs/dbraw/zinc/72/06/65/402720665.db2.gz	AHPVXZKOVWHVBB-SFHVURJKSA-N	0	3	318.461	2.479	10	0		DEAEHN
C[C@@H]1CN(CC2CCN(C(=O)NCCC3CC3)CC2)C[C@@H](C)O1	ZINC000174057357	402725437	/nfs/dbraw/zinc/72/54/37/402725437.db2.gz	LCMWORUHLGZQPN-HUUCEWRRSA-N	0	3	323.481	2.317	10	0		DEAEHN
c1cn(CCCN2CCC[C@@H](c3nncn3C3CC3)C2)cn1	ZINC000182963788	402729925	/nfs/dbraw/zinc/72/99/25/402729925.db2.gz	WJEMZGHDBBTABE-CQSZACIVSA-N	0	3	300.410	2.079	10	0		DEAEHN
C[C@H](NCC(=O)Nc1ccc(N2CCCC2)cc1)[C@H]1CCCO1	ZINC000183115877	402740140	/nfs/dbraw/zinc/74/01/40/402740140.db2.gz	OTEPQIISQWGXBA-WMLDXEAASA-N	0	3	317.433	2.382	10	0		DEAEHN
C[C@H](NCC(=O)Nc1ccc(N2CCCC2)cc1)[C@@H]1CCCO1	ZINC000183115839	402740259	/nfs/dbraw/zinc/74/02/59/402740259.db2.gz	OTEPQIISQWGXBA-YOEHRIQHSA-N	0	3	317.433	2.382	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCCCOC2CCCC2)CCN1C	ZINC000174454828	402742024	/nfs/dbraw/zinc/74/20/24/402742024.db2.gz	UXQLQRWTRHDEBH-HUUCEWRRSA-N	0	3	311.470	2.460	10	0		DEAEHN
COc1ccc(NC(=O)[C@H](C)N[C@@H](C)[C@@H]2CCCO2)cc1OC	ZINC000183181699	402745036	/nfs/dbraw/zinc/74/50/36/402745036.db2.gz	UZPQTHWIZAGDSE-OBJOEFQTSA-N	0	3	322.405	2.188	10	0		DEAEHN
CS[C@@H](c1nc([C@H]2CNCCN2C)no1)c1ccccc1	ZINC000263275993	402753133	/nfs/dbraw/zinc/75/31/33/402753133.db2.gz	SWFIFPHKCLURES-CHWSQXEVSA-N	0	3	304.419	2.098	10	0		DEAEHN
C[C@@H](Cc1cccc(F)c1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263283222	402754219	/nfs/dbraw/zinc/75/42/19/402754219.db2.gz	UPNFPPNUTDZQHV-FZMZJTMJSA-N	0	3	304.369	2.131	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cc(OC)cc(OC)c2)C1	ZINC000194317168	402792163	/nfs/dbraw/zinc/79/21/63/402792163.db2.gz	PHAIBTCVRSZGEL-GFCCVEGCSA-N	0	3	307.394	2.310	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)NCc1cccc(C)c1	ZINC000175334120	402797952	/nfs/dbraw/zinc/79/79/52/402797952.db2.gz	AIXIYHCPAVFMNM-QGZVFWFLSA-N	0	3	303.450	2.027	10	0		DEAEHN
Cc1cc(C(=O)N2CCN3CCC[C@@H]3C2)nn1-c1ccccc1	ZINC000195333616	402842460	/nfs/dbraw/zinc/84/24/60/402842460.db2.gz	OOKNCUIJGIXRFT-MRXNPFEDSA-N	0	3	310.401	2.101	10	0		DEAEHN
O[C@H]1c2ccccc2C[C@H]1N1CCCN(c2ccccn2)CC1	ZINC000183811432	402799651	/nfs/dbraw/zinc/79/96/51/402799651.db2.gz	QXMPTOBGJORKTR-MJGOQNOKSA-N	0	3	309.413	2.252	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)C2=Cc3cccc(OC)c3OC2)C1	ZINC000194827689	402817503	/nfs/dbraw/zinc/81/75/03/402817503.db2.gz	HYHXGBAISFUYRZ-HNNXBMFYSA-N	0	3	316.401	2.072	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000194918894	402822874	/nfs/dbraw/zinc/82/28/74/402822874.db2.gz	APVDLTCKGWPKTL-VFSICIBPSA-N	0	3	308.466	2.474	10	0		DEAEHN
Cc1ccc(NC(=O)NC2CCN(CCN(C)C)CC2)s1	ZINC000175777923	402831697	/nfs/dbraw/zinc/83/16/97/402831697.db2.gz	DNWAUEYVRTXYKO-UHFFFAOYSA-N	0	3	310.467	2.204	10	0		DEAEHN
CCN(CC)CC(=O)NC1(c2noc(C(C)C)n2)CCCC1	ZINC000175806735	402834693	/nfs/dbraw/zinc/83/46/93/402834693.db2.gz	SJLLXUVUUPWPIE-UHFFFAOYSA-N	0	3	308.426	2.420	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCCC[C@@H]2CCCCO2)CCN1C	ZINC000184383958	402839656	/nfs/dbraw/zinc/83/96/56/402839656.db2.gz	QVNDIPKXBSKFJS-OAGGEKHMSA-N	0	3	311.470	2.460	10	0		DEAEHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)NCCOCC1CCC1	ZINC000566536170	292249630	/nfs/dbraw/zinc/24/96/30/292249630.db2.gz	NKGFJAHXKMLDAK-LSDHHAIUSA-N	0	3	311.470	2.223	10	0		DEAEHN
COCCCOC1CN(C(=O)Nc2cccc(CN(C)C)c2)C1	ZINC000175993005	402846746	/nfs/dbraw/zinc/84/67/46/402846746.db2.gz	ZLUZOBJCNKFNPK-UHFFFAOYSA-N	0	3	321.421	2.017	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000176004967	402847425	/nfs/dbraw/zinc/84/74/25/402847425.db2.gz	AKLMZVIBFXVDAK-KGLIPLIRSA-N	0	3	305.422	2.424	10	0		DEAEHN
CC(=O)N1CC[C@@H](N[C@H]2CCCOC2)c2ccc(F)cc2C1	ZINC000184510694	402847789	/nfs/dbraw/zinc/84/77/89/402847789.db2.gz	VKDLVBYQVINCRL-DOTOQJQBSA-N	0	3	306.381	2.388	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN(Cc3cn4cccnc4n3)C2)n1	ZINC000195516235	402849294	/nfs/dbraw/zinc/84/92/94/402849294.db2.gz	MJHCUOZNQOCONF-OAHLLOKOSA-N	0	3	322.416	2.367	10	0		DEAEHN
CCN1CCC(NC(=O)N2CCCC[C@H]2c2cn[nH]c2)CC1	ZINC000272470539	402941108	/nfs/dbraw/zinc/94/11/08/402941108.db2.gz	QALVXGPPAJIBOX-HNNXBMFYSA-N	0	3	305.426	2.131	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@H]1NCc1ccc(Br)cc1F	ZINC000282262647	403137771	/nfs/dbraw/zinc/13/77/71/403137771.db2.gz	HCIXSCSNBCVYAX-QPUJVOFHSA-N	0	3	315.186	2.345	10	0		DEAEHN
COc1ccc(F)cc1[C@@H](C)NC(=O)N1CC[C@H](N(C)C)C1	ZINC000170830864	286322253	/nfs/dbraw/zinc/32/22/53/286322253.db2.gz	XNDHLKYVIIQQID-YPMHNXCESA-N	0	3	309.385	2.241	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)[C@H](C)N[C@@H]1CCOC[C@H]1C	ZINC000277544901	403229320	/nfs/dbraw/zinc/22/93/20/403229320.db2.gz	SHOGXOXSWKBXRO-TYNCELHUSA-N	0	3	304.390	2.231	10	0		DEAEHN
CCn1cc(CCN2C[C@@H](O)C[C@H]2c2cccc(F)c2)cn1	ZINC000286380635	403513292	/nfs/dbraw/zinc/51/32/92/403513292.db2.gz	ZBZCBGAZMGWCCM-IRXDYDNUSA-N	0	3	303.381	2.393	10	0		DEAEHN
CN1CCC[C@]2(CCN(C(=O)c3cc4c(s3)CCOC4)C2)C1	ZINC000293926794	403601214	/nfs/dbraw/zinc/60/12/14/403601214.db2.gz	IVVOQZYRCATWNU-KRWDZBQOSA-N	0	3	320.458	2.379	10	0		DEAEHN
CNC(=O)c1cccnc1NC[C@H](C)N(C)Cc1ccccc1	ZINC000301395049	403623422	/nfs/dbraw/zinc/62/34/22/403623422.db2.gz	LDACLBLYFGVUSD-AWEZNQCLSA-N	0	3	312.417	2.374	10	0		DEAEHN
CCn1nccc1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000332950421	403640169	/nfs/dbraw/zinc/64/01/69/403640169.db2.gz	VISCKNCJCNIZMC-GOEBONIOSA-N	0	3	313.405	2.470	10	0		DEAEHN
CN1CCO[C@H]2CN(c3ccnc4cc(Cl)ccc43)C[C@H]21	ZINC000301661245	403660926	/nfs/dbraw/zinc/66/09/26/403660926.db2.gz	MSAYLTYGPLSKAJ-CVEARBPZSA-N	0	3	303.793	2.407	10	0		DEAEHN
c1cn(C[C@@H]2CCCN(Cc3ccc(-c4cc[nH]n4)o3)C2)nn1	ZINC000369476119	404108626	/nfs/dbraw/zinc/10/86/26/404108626.db2.gz	IKBFFCQMWHMNQW-CYBMUJFWSA-N	0	3	312.377	2.173	10	0		DEAEHN
CC(C)(C)n1cnc(C(=O)N2CCCC[C@@H](N3CCCC3)C2)n1	ZINC000329746278	404439217	/nfs/dbraw/zinc/43/92/17/404439217.db2.gz	RSKYRAPLSKAHLV-CQSZACIVSA-N	0	3	319.453	2.124	10	0		DEAEHN
O=C(CN1CCC2(C1)CCCCC2)NC(=O)NCC(F)(F)F	ZINC000364836031	404538727	/nfs/dbraw/zinc/53/87/27/404538727.db2.gz	CENREAWVTKLCMH-UHFFFAOYSA-N	0	3	321.343	2.031	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNCCCOCC1CC1	ZINC000291973145	404606866	/nfs/dbraw/zinc/60/68/66/404606866.db2.gz	QWTIAJFKNWJVBV-UHFFFAOYSA-N	0	3	300.406	2.233	10	0		DEAEHN
C[C@@H]1CCOCCN1CCCN1CCN(c2ccccc2)CC1	ZINC000375728087	404735354	/nfs/dbraw/zinc/73/53/54/404735354.db2.gz	XKNZSUZKCYDYMJ-GOSISDBHSA-N	0	3	317.477	2.310	10	0		DEAEHN
CN(C)Cc1ccccc1C(=O)N1CCC[C@@H](n2cccn2)C1	ZINC000365897503	404740845	/nfs/dbraw/zinc/74/08/45/404740845.db2.gz	XXMXWVUBYYQGNR-MRXNPFEDSA-N	0	3	312.417	2.422	10	0		DEAEHN
CCN(CCNC(=O)N1CCCC[C@H]1c1ccnn1C)C1CC1	ZINC000376129694	404806467	/nfs/dbraw/zinc/80/64/67/404806467.db2.gz	HZBGCIPXOKPEJQ-INIZCTEOSA-N	0	3	319.453	2.141	10	0		DEAEHN
O=C(NC[C@@H]1CN2CCC[C@H]2CO1)N1CCC2(C1)CCCCC2	ZINC000377877462	404849698	/nfs/dbraw/zinc/84/96/98/404849698.db2.gz	BRRBAYVIWCWJBL-JKSUJKDBSA-N	0	3	321.465	2.215	10	0		DEAEHN
c1cc(-c2ccc(CN[C@@H]3CCO[C@@]4(CCOC4)C3)o2)n[nH]1	ZINC000366822981	404853315	/nfs/dbraw/zinc/85/33/15/404853315.db2.gz	HBSSDFSOSBMNRS-WBMJQRKESA-N	0	3	303.362	2.097	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N2CC[C@H]3[C@@H](CCCN3C3CC3)C2)[nH]1	ZINC000408025451	405092383	/nfs/dbraw/zinc/09/23/83/405092383.db2.gz	BWGAUTNWIQPZOO-GUYCJALGSA-N	0	3	315.417	2.306	10	0		DEAEHN
Cn1nnc2cc(CN3CC[C@]4(O)CCCC[C@H]4C3)ccc21	ZINC000408073306	405106326	/nfs/dbraw/zinc/10/63/26/405106326.db2.gz	PZHKLUHRJLMVHY-WMLDXEAASA-N	0	3	300.406	2.095	10	0		DEAEHN
CCN1CCN(CC(C)(C)NCc2ncc(C3CC3)o2)CC1	ZINC000451988770	405120415	/nfs/dbraw/zinc/12/04/15/405120415.db2.gz	PPVZTNXGRGSUON-UHFFFAOYSA-N	0	3	306.454	2.058	10	0		DEAEHN
COC(=O)C1=C(C)O[C@@H](CN2CCC(C3CCOCC3)CC2)C1	ZINC000367952800	405202469	/nfs/dbraw/zinc/20/24/69/405202469.db2.gz	WLBWBTWRTQZOPZ-MRXNPFEDSA-N	0	3	323.433	2.361	10	0		DEAEHN
O=C(NCCNc1ccncc1)c1c[nH]cc1-c1ccc(F)cc1	ZINC000439043711	405263860	/nfs/dbraw/zinc/26/38/60/405263860.db2.gz	XGWUWSVFEUYKOL-UHFFFAOYSA-N	0	3	324.359	2.480	10	0		DEAEHN
CN1CC[C@@H]2CN(C(=O)[C@@H]3C[C@@H]3c3cc(F)ccc3F)C[C@@H]21	ZINC000453036288	405277239	/nfs/dbraw/zinc/27/72/39/405277239.db2.gz	NVZBGRJYHRCQSV-AEKOTVAKSA-N	0	3	306.356	2.231	10	0		DEAEHN
COc1c(F)ccc(F)c1C(=O)N1CCC[C@H]2CN(C)C[C@H]21	ZINC000425060464	405239925	/nfs/dbraw/zinc/23/99/25/405239925.db2.gz	VVSMGBLWDSTPNN-GXFFZTMASA-N	0	3	310.344	2.140	10	0		DEAEHN
O=C(NCCNc1ccncc1)c1ncsc1-c1ccccc1	ZINC000438678310	405253126	/nfs/dbraw/zinc/25/31/26/405253126.db2.gz	HBLQQEXRJOCPSJ-UHFFFAOYSA-N	0	3	324.409	2.469	10	0		DEAEHN
CC=CC[C@@H]1NC(=O)N(c2cccc(OCCN(C)C)c2)C1=O	ZINC000445912730	405362703	/nfs/dbraw/zinc/36/27/03/405362703.db2.gz	KWPBLQJVTRISIH-RGDDUWESSA-N	0	3	317.389	2.018	10	0		DEAEHN
CCOC(=O)[C@H]1CN(C[C@@H](C)c2ccc(F)cc2)CC12COC2	ZINC000449367929	405529714	/nfs/dbraw/zinc/52/97/14/405529714.db2.gz	ZYONEIOTPTZQAI-CZUORRHYSA-N	0	3	321.392	2.441	10	0		DEAEHN
CCN(CCNC(=O)c1ncsc1Br)C1CC1	ZINC000557590229	405609897	/nfs/dbraw/zinc/60/98/97/405609897.db2.gz	GZXFFHWNEULHQN-UHFFFAOYSA-N	0	3	318.240	2.120	10	0		DEAEHN
COc1nsc(CNC[C@]2(C)CCOC2)c1Br	ZINC000638610660	405571271	/nfs/dbraw/zinc/57/12/71/405571271.db2.gz	DJGIVMCXVDFKIJ-NSHDSACASA-N	0	3	321.240	2.430	10	0		DEAEHN
CC(=O)c1cc(C(=O)N[C@H]2C[C@@H](N(C)C)C2(C)C)c(C)nc1C	ZINC000636103080	405741833	/nfs/dbraw/zinc/74/18/33/405741833.db2.gz	ZDRKJSJCIKFCHG-JKSUJKDBSA-N	0	3	317.433	2.360	10	0		DEAEHN
C[C@H]1CCCN1C(=O)CCN1CC[C@@H](c2nc(C3CC3)no2)C1	ZINC000560367030	405800447	/nfs/dbraw/zinc/80/04/47/405800447.db2.gz	CUYTXZQHWDFPST-GXTWGEPZSA-N	0	3	318.421	2.137	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)NCCN2CCCCCC2)c1	ZINC000457448319	405844650	/nfs/dbraw/zinc/84/46/50/405844650.db2.gz	ZJGBWRZGPFQKTN-UHFFFAOYSA-N	0	3	318.417	2.387	10	0		DEAEHN
C[C@H]1CCCN(C(=O)[C@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000530813704	405864825	/nfs/dbraw/zinc/86/48/25/405864825.db2.gz	AXRXJCONRZYNBS-LPHOPBHVSA-N	0	3	316.445	2.272	10	0		DEAEHN
c1nc2n(n1)[C@H](CN(Cc1ccccc1)C[C@@H]1CCCO1)CC2	ZINC000639460032	406098317	/nfs/dbraw/zinc/09/83/17/406098317.db2.gz	QSAXDXQJHURARD-IRXDYDNUSA-N	0	3	312.417	2.447	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(C[C@H]1CCc3ncnn31)CC2	ZINC000639562904	406147337	/nfs/dbraw/zinc/14/73/37/406147337.db2.gz	AKTKNFBOZGDQTI-QGZVFWFLSA-N	0	3	310.401	2.069	10	0		DEAEHN
c1coc(-c2ncc(CNCCc3nnc4n3CCC4)s2)c1	ZINC000486931260	406190324	/nfs/dbraw/zinc/19/03/24/406190324.db2.gz	BCLHAHZZNMBNAH-UHFFFAOYSA-N	0	3	315.402	2.273	10	0		DEAEHN
Cc1cnn(CCN2CCC(c3nnc4ccccn43)CC2)c1	ZINC000569388846	406247699	/nfs/dbraw/zinc/24/76/99/406247699.db2.gz	ICUJGNWYRLPZSW-UHFFFAOYSA-N	0	3	310.405	2.114	10	0		DEAEHN
CO[C@@H](C)[C@@H](C)N[C@H](C)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000519851329	406262646	/nfs/dbraw/zinc/26/26/46/406262646.db2.gz	PWDRZMBDJWXEDA-CQFBVYMNSA-N	0	3	308.466	2.473	10	0		DEAEHN
c1ncn(-c2ccc(CNCc3ccc4[nH]cnc4c3)cc2)n1	ZINC000537311578	406287336	/nfs/dbraw/zinc/28/73/36/406287336.db2.gz	OKBMHQFNNKZEOT-UHFFFAOYSA-N	0	3	304.357	2.433	10	0		DEAEHN
c1ncn(-c2ccc(CNCc3ccc4nc[nH]c4c3)cc2)n1	ZINC000537311578	406287343	/nfs/dbraw/zinc/28/73/43/406287343.db2.gz	OKBMHQFNNKZEOT-UHFFFAOYSA-N	0	3	304.357	2.433	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NC1(C)CCCCC1	ZINC000637938473	406485765	/nfs/dbraw/zinc/48/57/65/406485765.db2.gz	YLXOARRMLZQFBA-INIZCTEOSA-N	0	3	303.450	2.285	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N(C)Cc1ccccc1	ZINC000637867326	406454131	/nfs/dbraw/zinc/45/41/31/406454131.db2.gz	GXFZIOZWYIEMMF-GOSISDBHSA-N	0	3	311.429	2.104	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)NCCN3CC[C@@H](C)C3)cc2)c1	ZINC000524774616	406459005	/nfs/dbraw/zinc/45/90/05/406459005.db2.gz	RHPAMRVKQJXTSB-CQSZACIVSA-N	0	3	312.417	2.252	10	0		DEAEHN
CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)c1nnc([C@H](C)CC)[n-]1	ZINC000490355863	406463344	/nfs/dbraw/zinc/46/33/44/406463344.db2.gz	WEGPIPHEDXZJJM-JHJVBQTASA-N	0	3	307.442	2.370	10	0		DEAEHN
CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)c1nnc([C@H](C)CC)[n-]1	ZINC000490355863	406463350	/nfs/dbraw/zinc/46/33/50/406463350.db2.gz	WEGPIPHEDXZJJM-JHJVBQTASA-N	0	3	307.442	2.370	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@H](C)c1nnc([C@H](C)CC)[nH]1	ZINC000490355863	406463353	/nfs/dbraw/zinc/46/33/53/406463353.db2.gz	WEGPIPHEDXZJJM-JHJVBQTASA-N	0	3	307.442	2.370	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N(C)Cc1ccsc1	ZINC000637891139	406464430	/nfs/dbraw/zinc/46/44/30/406464430.db2.gz	ATLKVIPNAXHGJJ-INIZCTEOSA-N	0	3	317.458	2.166	10	0		DEAEHN
Cc1cccc(NC(=O)[C@H](N)CN(C)Cc2ccccc2)c1O	ZINC000638170537	406603886	/nfs/dbraw/zinc/60/38/86/406603886.db2.gz	SBWSTJYOLUSUQT-OAHLLOKOSA-N	0	3	313.401	2.098	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N[C@@H]1CC12CCCCC2	ZINC000638290288	406675895	/nfs/dbraw/zinc/67/58/95/406675895.db2.gz	FDDCNAPECMOYGK-DLBZAZTESA-N	0	3	315.461	2.285	10	0		DEAEHN
C[C@H](C1CC1)N(Cc1ccccc1)C(=O)[C@@H]1CNCCOC1	ZINC000643617668	407017563	/nfs/dbraw/zinc/01/75/63/407017563.db2.gz	LXLLJQIRVFKGMW-RHSMWYFYSA-N	0	3	302.418	2.050	10	0		DEAEHN
CCNc1ncc(C(=O)N2C[C@H]3CCCN3C[C@H]2CC)s1	ZINC000129650527	196064975	/nfs/dbraw/zinc/06/49/75/196064975.db2.gz	FTYRLEPBVJZVRY-VXGBXAGGSA-N	0	3	308.451	2.274	10	0		DEAEHN
CN(C)C[C@H](NC(=O)[C@@H](N)c1cccs1)c1ccccc1	ZINC000130565024	196092069	/nfs/dbraw/zinc/09/20/69/196092069.db2.gz	UJEZUSXTBUCONO-ZFWWWQNUSA-N	0	3	303.431	2.167	10	0		DEAEHN
CS[C@H](C)CCNCC(=O)Nc1ccc2c(c1)OCCO2	ZINC000130613644	196095271	/nfs/dbraw/zinc/09/52/71/196095271.db2.gz	PSUHGEWNKQILBQ-LLVKDONJSA-N	0	3	310.419	2.128	10	0		DEAEHN
C[C@@H](CN1C(=O)C2(CC2)N[C@@H]1c1ccsc1)N1CCCC1	ZINC000130756034	196107083	/nfs/dbraw/zinc/10/70/83/196107083.db2.gz	BDWBZDYJDFLQKI-JSGCOSHPSA-N	0	3	305.447	2.195	10	0		DEAEHN
CN[C@H](C)c1cccc(S(=O)(=O)NCC[C@@H](C)SC)c1	ZINC000130940489	196124651	/nfs/dbraw/zinc/12/46/51/196124651.db2.gz	YOIZZYMGZMGCDB-VXGBXAGGSA-N	0	3	316.492	2.387	10	0		DEAEHN
Cc1cc(Cl)c(C)c(S(=O)(=O)[N-]C/C=C/C[NH3+])c1Cl	ZINC000131197682	196148608	/nfs/dbraw/zinc/14/86/08/196148608.db2.gz	QTIOABXRPKNZME-ONEGZZNKSA-N	0	3	323.245	2.403	10	0		DEAEHN
CC[C@H](C)[C@@](C)(O)c1c(Br)cnn1CCN(C)C	ZINC000131446773	196170152	/nfs/dbraw/zinc/17/01/52/196170152.db2.gz	RELCFGLPXIVMTB-GXFFZTMASA-N	0	3	318.259	2.461	10	0		DEAEHN
CC(C)[NH2+]CCCS(=O)(=O)[N-]c1cccc2ccncc21	ZINC000131553403	196179337	/nfs/dbraw/zinc/17/93/37/196179337.db2.gz	SUHUFXBNZYAIBW-UHFFFAOYSA-N	0	3	307.419	2.365	10	0		DEAEHN
NCc1ccc(Cl)c(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)c1	ZINC000132209260	196235533	/nfs/dbraw/zinc/23/55/33/196235533.db2.gz	IFGQPHAUVIOSNP-RYUDHWBXSA-N	0	3	314.838	2.219	10	0		DEAEHN
CCCNc1ncc(Br)c(NC[C@@H](C)N(C)C)n1	ZINC000132225243	196237210	/nfs/dbraw/zinc/23/72/10/196237210.db2.gz	GRPYMGZHUOJTHB-SECBINFHSA-N	0	3	316.247	2.423	10	0		DEAEHN
CCCNc1nc(Cl)nc(N(CCN(C)C)CC(C)C)n1	ZINC000132583676	196268343	/nfs/dbraw/zinc/26/83/43/196268343.db2.gz	NKYQTMBPNBKSCB-UHFFFAOYSA-N	0	3	314.865	2.371	10	0		DEAEHN
CC[C@H](C)c1nc(N(CCOC)CCOC)sc1CNC	ZINC000133134462	196314197	/nfs/dbraw/zinc/31/41/97/196314197.db2.gz	WPXQATRXDHJXKT-LBPRGKRZSA-N	0	3	315.483	2.475	10	0		DEAEHN
CNC(=O)c1ccc(Cl)c(NC(=O)[C@]2(C)CCCCN2)c1	ZINC000133165882	196316986	/nfs/dbraw/zinc/31/69/86/196316986.db2.gz	XBGCQUJRTHAOTH-HNNXBMFYSA-N	0	3	309.797	2.170	10	0		DEAEHN
CN(C)CCNC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000133899598	196344455	/nfs/dbraw/zinc/34/44/55/196344455.db2.gz	HHDBETOQCWVUBT-LBPRGKRZSA-N	0	3	303.328	2.021	10	0		DEAEHN
CCN(CC)Cc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000133947262	196347805	/nfs/dbraw/zinc/34/78/05/196347805.db2.gz	BMDKRPMQKJQBTM-UHFFFAOYSA-N	0	3	310.341	2.195	10	0		DEAEHN
CC[S@@](=O)CCN1C[C@H](c2ccccc2)NC[C@@H]1C(C)C	ZINC000134235799	196373132	/nfs/dbraw/zinc/37/31/32/196373132.db2.gz	ZOQGGOATBGVOGZ-LZJOCLMNSA-N	0	3	308.491	2.426	10	0		DEAEHN
CCC(CO)(CO)N[C@H](C)c1ccc(Br)s1	ZINC000134466341	196393801	/nfs/dbraw/zinc/39/38/01/196393801.db2.gz	JOSLCGIPLPJDBR-MRVPVSSYSA-N	0	3	308.241	2.295	10	0		DEAEHN
C[C@@H](CNC(=O)c1sc2cnccc2c1N)N1CCCC1	ZINC000135954354	196511141	/nfs/dbraw/zinc/51/11/41/196511141.db2.gz	QSLAODQGTUWYGW-JTQLQIEISA-N	0	3	304.419	2.093	10	0		DEAEHN
C[C@@H](NCCO[C@@H]1CCCCO1)c1ccc(-n2ccnn2)cc1	ZINC000193092379	225152297	/nfs/dbraw/zinc/15/22/97/225152297.db2.gz	JGASNIBBUVLYOB-RHSMWYFYSA-N	0	3	316.405	2.461	10	0		DEAEHN
CC[C@H](C(=O)N1CC[C@H](c2cc(OC)cc(OC)c2)C1)N(C)C	ZINC000133822770	287477349	/nfs/dbraw/zinc/47/73/49/287477349.db2.gz	PPAMIYXMMYHEID-SUMWQHHRSA-N	0	3	320.433	2.360	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC[C@@H](c2cc(N)n[nH]2)CC1	ZINC000616628383	422515725	/nfs/dbraw/zinc/51/57/25/422515725.db2.gz	QTGHZLONXFIWCB-GFCCVEGCSA-N	0	3	323.441	2.086	10	0		DEAEHN
CC(C)Cc1ccc([C@H](C)NC(=O)C(C)S(C)(=O)=O)cc1	ZINC000045765843	424818307	/nfs/dbraw/zinc/81/83/07/424818307.db2.gz	CDCLEDDNDKIMPK-QWHCGFSZSA-N	0	3	311.447	2.495	10	0		DEAEHN
Cc1nnc(NC[C@H]2CCCCN2Cc2ccccc2)nc1C	ZINC000359523833	424830515	/nfs/dbraw/zinc/83/05/15/424830515.db2.gz	IMOSXZIZUHJEPC-QGZVFWFLSA-N	0	3	311.433	2.955	10	0		DEAEHN
CC(C)CCNC(=O)[C@@H](C)N1CCC(Cc2nccn2C)CC1	ZINC000105876257	424849601	/nfs/dbraw/zinc/84/96/01/424849601.db2.gz	GHGLROMVLHOOQK-OAHLLOKOSA-N	0	3	320.481	2.225	10	0		DEAEHN
Cc1ccccc1[C@H](C)NCC(=O)NC(=O)NC1CCCC1	ZINC000192854396	424866407	/nfs/dbraw/zinc/86/64/07/424866407.db2.gz	FOCZCFYJDUGKTQ-ZDUSSCGKSA-N	0	3	303.406	2.414	10	0		DEAEHN
c1cc(CN[C@@H]2CO[C@@H](C3CC3)C2)cc(N2CCSCC2)n1	ZINC000639386463	424857757	/nfs/dbraw/zinc/85/77/57/424857757.db2.gz	IVMHOZRRDYLZFP-JKSUJKDBSA-N	0	3	319.474	2.292	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)CCc2nnc(C3CCCC3)o2)C1	ZINC000155674876	424862362	/nfs/dbraw/zinc/86/23/62/424862362.db2.gz	YFSZVXFDZKZHPG-AWEZNQCLSA-N	0	3	320.437	2.260	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC[C@@](C)(O)C(F)(F)F	ZINC000381928606	424909766	/nfs/dbraw/zinc/90/97/66/424909766.db2.gz	QWPWZGUXUFCYTN-GXTWGEPZSA-N	0	3	304.356	2.410	10	0		DEAEHN
C[C@@H](CNC(=O)c1nscc1Br)N1CCCC1	ZINC000404888754	424929553	/nfs/dbraw/zinc/92/95/53/424929553.db2.gz	HGGUUJWVRULUIG-QMMMGPOBSA-N	0	3	318.240	2.120	10	0		DEAEHN
CCc1nc(CNC(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)cs1	ZINC000085403432	267387954	/nfs/dbraw/zinc/38/79/54/267387954.db2.gz	ZMQAXXMTCJKVHW-WCQYABFASA-N	0	3	310.467	2.187	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)s1	ZINC000085409806	267388116	/nfs/dbraw/zinc/38/81/16/267388116.db2.gz	MGOYTNFZTQGSOL-JSGCOSHPSA-N	0	3	324.494	2.230	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2cccc3c2OCCO3)CCN1C	ZINC000175415627	267518701	/nfs/dbraw/zinc/51/87/01/267518701.db2.gz	APRFKTKOJLHWPL-CHWSQXEVSA-N	0	3	319.405	2.404	10	0		DEAEHN
C[C@H](CNC(=O)OC(C)(C)C)N(C)C[C@H](O)COC(C)(C)C	ZINC000178862671	267588279	/nfs/dbraw/zinc/58/82/79/267588279.db2.gz	PBPSRHOFWXCKJH-OLZOCXBDSA-N	0	3	318.458	2.007	10	0		DEAEHN
COC(=O)CC1(CC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)CCCC1	ZINC000189322049	267690534	/nfs/dbraw/zinc/69/05/34/267690534.db2.gz	JZIGBIXYTMIYRR-LSDHHAIUSA-N	0	3	324.465	2.441	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CC1(CC(=O)OC)CCCC1	ZINC000189378103	267693092	/nfs/dbraw/zinc/69/30/92/267693092.db2.gz	DYBYWXGBPUCVRR-OAHLLOKOSA-N	0	3	324.465	2.443	10	0		DEAEHN
CCN1CC[C@H](NC(=O)N[C@H]2CCO[C@H](c3cccs3)C2)C1	ZINC000334128271	269023059	/nfs/dbraw/zinc/02/30/59/269023059.db2.gz	REJMFKVSSQEWPI-IHRRRGAJSA-N	0	3	323.462	2.362	10	0		DEAEHN
C[C@H]1CCN[C@@H](C(=O)NCCCCOCc2ccccc2)C1	ZINC000390703812	269097772	/nfs/dbraw/zinc/09/77/72/269097772.db2.gz	AUQYBAKASZAXLN-DOTOQJQBSA-N	0	3	304.434	2.488	10	0		DEAEHN
COc1nccc(CNC(C)(C)CCNC(=O)OC(C)(C)C)n1	ZINC000397331323	269105758	/nfs/dbraw/zinc/10/57/58/269105758.db2.gz	ZLDTVXSXRJMORI-UHFFFAOYSA-N	0	3	324.425	2.268	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)Nc1cc2c(cc1F)CCC(=O)N2	ZINC000261867701	273579988	/nfs/dbraw/zinc/57/99/88/273579988.db2.gz	KXOZBWSAZIGPEE-HNNXBMFYSA-N	0	3	319.380	2.427	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)Nc2ccc(C)cc2F)c1	ZINC000105881656	274830326	/nfs/dbraw/zinc/83/03/26/274830326.db2.gz	GKMKABGSKTZWOO-CYBMUJFWSA-N	0	3	304.369	2.256	10	0		DEAEHN
CC(C)[C@H]1OCC[C@@H]1CN[C@@H](C(=O)N(C)C)c1ccccc1	ZINC000275322234	275716357	/nfs/dbraw/zinc/71/63/57/275716357.db2.gz	PDSWPAJXBIVFLT-BRWVUGGUSA-N	0	3	304.434	2.467	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H](c1ccc(C)cc1)N(C)C)N(C)C	ZINC000161802888	276038531	/nfs/dbraw/zinc/03/85/31/276038531.db2.gz	SEGLHAHQSXSERL-IAGOWNOFSA-N	0	3	305.466	2.444	10	0		DEAEHN
CC(C)c1nnc(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)n1C	ZINC000246471945	276074209	/nfs/dbraw/zinc/07/42/09/276074209.db2.gz	FZAJQYZKQOJHEN-HOCLYGCPSA-N	0	3	317.481	2.387	10	0		DEAEHN
CC(C)(C)CCS(=O)(=O)N1CCC(N2CCCC2)CC1	ZINC000113280013	277142493	/nfs/dbraw/zinc/14/24/93/277142493.db2.gz	AVKVZLRLHNIGST-UHFFFAOYSA-N	0	3	302.484	2.313	10	0		DEAEHN
CN1CC[C@H](NC(=O)C2CCC(O)CC2)[C@H]1c1ccccc1	ZINC000248747213	277164984	/nfs/dbraw/zinc/16/49/84/277164984.db2.gz	NOZBTFZSKBFZNQ-SJJHQCBESA-N	0	3	302.418	2.099	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCc2ccccn2)[C@@H]1c1ccccc1	ZINC000179274554	277167271	/nfs/dbraw/zinc/16/72/71/277167271.db2.gz	QIELEZYDGIIWDJ-IRXDYDNUSA-N	0	3	310.401	2.326	10	0		DEAEHN
COC(=O)[C@@H](NC[C@H](C1CC1)N(C)Cc1ccccc1)C1CC1	ZINC000358664459	277341675	/nfs/dbraw/zinc/34/16/75/277341675.db2.gz	UBOPBHUCZPSACU-MSOLQXFVSA-N	0	3	316.445	2.438	10	0		DEAEHN
C[C@@H](CN1CCCCCC1)NC(=O)c1nnc2ccccc2n1	ZINC000329601122	277574228	/nfs/dbraw/zinc/57/42/28/277574228.db2.gz	XLDOGGCHKVLFAF-ZDUSSCGKSA-N	0	3	313.405	2.019	10	0		DEAEHN
C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000471902391	278075872	/nfs/dbraw/zinc/07/58/72/278075872.db2.gz	YUHDLSACIYXIJP-SCVCMEIPSA-N	0	3	305.344	2.205	10	0		DEAEHN
CSC1(CNC(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000194915121	278125000	/nfs/dbraw/zinc/12/50/00/278125000.db2.gz	LDWLRAQVOZINKS-HNNXBMFYSA-N	0	3	321.490	2.354	10	0		DEAEHN
CC(C)(C)[C@H](NC[C@H](O)CN1CCOCC1)c1ccc(F)cc1	ZINC000157829209	278534049	/nfs/dbraw/zinc/53/40/49/278534049.db2.gz	PFEQOABGKSXIAS-DLBZAZTESA-N	0	3	324.440	2.196	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2)N(C)C	ZINC000178657097	278922581	/nfs/dbraw/zinc/92/25/81/278922581.db2.gz	XIZUAXIDAKXSIX-BLLLJJGKSA-N	0	3	317.433	2.479	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)Nc1cc(F)ccc1F	ZINC000175343599	279301169	/nfs/dbraw/zinc/30/11/69/279301169.db2.gz	GEXOTZNUIYDQGI-CYBMUJFWSA-N	0	3	311.376	2.319	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(C(F)(F)F)nc1	ZINC000247016513	288311862	/nfs/dbraw/zinc/31/18/62/288311862.db2.gz	FYKHYLISRUAHDU-PWSUYJOCSA-N	0	3	313.323	2.409	10	0		DEAEHN
CC[C@](C)(O)CN[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1	ZINC000192159684	281294215	/nfs/dbraw/zinc/29/42/15/281294215.db2.gz	RCCGEVROHORUDB-BMFZPTHFSA-N	0	3	310.825	2.362	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@@H]2CCCOc3ccccc32)C1	ZINC000170836036	289312589	/nfs/dbraw/zinc/31/25/89/289312589.db2.gz	MIRNVLIHXIOIRF-UKRRQHHQSA-N	0	3	303.406	2.246	10	0		DEAEHN
C[C@H](N[C@@H](C)[C@@H]1CCCO1)C(=O)NC(=O)Nc1ccccc1F	ZINC000183142792	289992308	/nfs/dbraw/zinc/99/23/08/289992308.db2.gz	RUIPODJCICPMRU-MJVIPROJSA-N	0	3	323.368	2.019	10	0		DEAEHN
C[C@H](N[C@H]1CCC(=O)N[C@H]1C1CC1)C(=O)N1CCCCCC1	ZINC000328844987	290041633	/nfs/dbraw/zinc/04/16/33/290041633.db2.gz	RJVKKTPDCSNLNX-NOLJZWGESA-N	0	3	307.438	2.265	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2CCCC[C@@H]2C(F)(F)F)n1	ZINC000263274270	290061832	/nfs/dbraw/zinc/06/18/32/290061832.db2.gz	SQBHEBUKYLWXPI-OUAUKWLOSA-N	0	3	318.343	2.482	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cccc(OC[C@@H]3CCCO3)c2)C1	ZINC000170856256	325716058	/nfs/dbraw/zinc/71/60/58/325716058.db2.gz	VFQJGQYLPHSPJA-RDJZCZTQSA-N	0	3	318.417	2.021	10	0		DEAEHN
N[C@H](CNC(=O)c1coc(Br)c1)c1ccccc1	ZINC000378918868	333064175	/nfs/dbraw/zinc/06/41/75/333064175.db2.gz	NZHPEPMRTVCJTO-LLVKDONJSA-N	0	3	309.163	2.472	10	0		DEAEHN
O=S1(=O)CCC(CNCc2ccc(Cl)cc2F)CC1	ZINC000189408905	333084132	/nfs/dbraw/zinc/08/41/32/333084132.db2.gz	CRQBQYQMUJSZAG-UHFFFAOYSA-N	0	3	305.802	2.394	10	0		DEAEHN
COC[C@@H](C)CN1CCCN(C(=O)c2ccccc2F)CC1	ZINC000189640114	333190446	/nfs/dbraw/zinc/19/04/46/333190446.db2.gz	ZXFJBZIUUKQWLI-AWEZNQCLSA-N	0	3	308.397	2.256	10	0		DEAEHN
Cn1c2ccc(CNCCc3cscn3)cc2sc1=O	ZINC000192594589	341876616	/nfs/dbraw/zinc/87/66/16/341876616.db2.gz	GARKJDHPJXCWTE-UHFFFAOYSA-N	0	3	305.428	2.389	10	0		DEAEHN
CCN1CCN(C(=O)[C@@H]2CCc3nc(C(C)C)[nH]c3C2)[C@@H](C)C1	ZINC000553329398	500689359	/nfs/dbraw/zinc/68/93/59/500689359.db2.gz	HERAPKWRKANTGY-UONOGXRCSA-N	0	3	318.465	2.191	10	0		DEAEHN
CCN1CCN(C(=O)[C@@H]2CCc3[nH]c(C(C)C)nc3C2)[C@@H](C)C1	ZINC000553329398	500689363	/nfs/dbraw/zinc/68/93/63/500689363.db2.gz	HERAPKWRKANTGY-UONOGXRCSA-N	0	3	318.465	2.191	10	0		DEAEHN
C[C@H](N[C@H]1CCN(c2ncccc2Cl)C1)c1ccnn1C	ZINC000192953555	534003355	/nfs/dbraw/zinc/00/33/55/534003355.db2.gz	UGYFALPRUOBASN-RYUDHWBXSA-N	0	3	305.813	2.398	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)N(C)[C@@H](C)CO)c1ccccc1	ZINC000128388157	520831373	/nfs/dbraw/zinc/83/13/73/520831373.db2.gz	NYIGPUDFZIOHKX-HOCLYGCPSA-N	0	3	307.438	2.092	10	0		DEAEHN
CN(C)CCN(Cc1ccccc1F)C(=O)N[C@H]1CCCOC1	ZINC000171614451	521750339	/nfs/dbraw/zinc/75/03/39/521750339.db2.gz	WAGQGDSDOHHSEM-HNNXBMFYSA-N	0	3	323.412	2.078	10	0		DEAEHN
COCCN1CCC[C@@H]1CN[C@@H](C)c1ccc(OC)cc1OC	ZINC000163420767	523830629	/nfs/dbraw/zinc/83/06/29/523830629.db2.gz	UJRWBTRGDKFIAA-LSDHHAIUSA-N	0	3	322.449	2.465	10	0		DEAEHN
COc1ccc(CC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1F	ZINC000124463557	523889614	/nfs/dbraw/zinc/88/96/14/523889614.db2.gz	UNPSMMQOFIZVJS-OCCSQVGLSA-N	0	3	308.397	2.318	10	0		DEAEHN
COc1ccc(CN2CCC[C@H](Cn3cncn3)C2)c(OC)c1	ZINC000128445299	524029617	/nfs/dbraw/zinc/02/96/17/524029617.db2.gz	JTGIYFADLADUBV-AWEZNQCLSA-N	0	3	316.405	2.208	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N[C@H](CC(C)C)C(=O)OC(C)C	ZINC000358268241	534903063	/nfs/dbraw/zinc/90/30/63/534903063.db2.gz	XHRGRHYUJROJDP-CABCVRRESA-N	0	3	312.454	2.343	10	0		DEAEHN
O[C@@H](CN1CCC(n2cc(Cl)cn2)CC1)CC(F)(F)F	ZINC000364278018	527646799	/nfs/dbraw/zinc/64/67/99/527646799.db2.gz	BAXKVTTZXVBTKM-LLVKDONJSA-N	0	3	311.735	2.487	10	0		DEAEHN
CCN1CCN(Cc2ccc(NCc3cocn3)cc2)CC1	ZINC000192291799	529149449	/nfs/dbraw/zinc/14/94/49/529149449.db2.gz	GFNOVQANJTZHPO-UHFFFAOYSA-N	0	3	300.406	2.424	10	0		DEAEHN
CCCOc1nc(C)ccc1C(=O)N1CCC[C@@H](N(C)C)C1	ZINC000191102480	535292747	/nfs/dbraw/zinc/29/27/47/535292747.db2.gz	QCJOROINDCTOGM-CQSZACIVSA-N	0	3	305.422	2.345	10	0		DEAEHN
CCC[C@H]1CN(C[C@@H](O)C2CCCCC2)CCN1CCOC	ZINC000249067127	535742523	/nfs/dbraw/zinc/74/25/23/535742523.db2.gz	KHWBFZCBKJGSNT-ZWKOTPCHSA-N	0	3	312.498	2.360	10	0		DEAEHN
CC[C@H](NC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C)c1nccs1	ZINC000262433879	535856882	/nfs/dbraw/zinc/85/68/82/535856882.db2.gz	GCAYZPXWAXGODV-PVTKRXDGSA-N	0	3	323.462	2.243	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)NC[C@H]1N(C)CCCC1(C)C	ZINC000454876795	535882357	/nfs/dbraw/zinc/88/23/57/535882357.db2.gz	PRYHQNBJLKLCEM-OAHLLOKOSA-N	0	3	322.453	2.465	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(CC(=O)N2CCCC[C@H]2C)C1	ZINC000247154974	536174046	/nfs/dbraw/zinc/17/40/46/536174046.db2.gz	LXZJKEWXTPJHAU-HZPDHXFCSA-N	0	3	318.465	2.483	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2S(=O)(=O)/C=C\c2ccccc2)C1	ZINC000255275284	624076623	/nfs/dbraw/zinc/07/66/23/624076623.db2.gz	IUQFFBPAIKRDIY-JINBKUQRSA-N	0	3	320.458	2.403	10	0		DEAEHN
Cc1nccnc1[C@@H](C)NC1CC(NC(=O)OC(C)(C)C)C1	ZINC000235176460	625259083	/nfs/dbraw/zinc/25/90/83/625259083.db2.gz	WBHCZCLJGGZDSX-PNESKVBLSA-N	0	3	306.410	2.491	10	0		DEAEHN
C/C(=C/c1ccc(F)cc1)C(=O)NC[C@@H]1CN2CCC[C@H]2CO1	ZINC000749362952	638638013	/nfs/dbraw/zinc/63/80/13/638638013.db2.gz	GEUSPMWENQKBSN-RKXUAZDKSA-N	0	3	318.392	2.208	10	0		DEAEHN
CCN1CC[C@@H](N[C@@H](C)c2ccc(N3CCCC3=O)cc2)C1=O	ZINC000802318009	645516715	/nfs/dbraw/zinc/51/67/15/645516715.db2.gz	LWVQFJGEFUSFQE-XJKSGUPXSA-N	0	3	315.417	2.085	10	0		DEAEHN
CCOCCO[C@H]1CCN(C[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000157729477	646558000	/nfs/dbraw/zinc/55/80/00/646558000.db2.gz	LFJCLHSUCDYCSX-ROUUACIJSA-N	0	3	307.434	2.464	10	0		DEAEHN
O=C(CN1CCC2(CCCC2)C1)N1CCO[C@@H]2CCCC[C@H]21	ZINC000174276883	646802877	/nfs/dbraw/zinc/80/28/77/646802877.db2.gz	BNAUSICILHDISS-HZPDHXFCSA-N	0	3	306.450	2.423	10	0		DEAEHN
COCCN(CCN(C)C)C(=O)/C=C(\C)c1cccc(F)c1	ZINC000732074725	647539788	/nfs/dbraw/zinc/53/97/88/647539788.db2.gz	RZHXCDABWPNZIR-WYMLVPIESA-N	0	3	308.397	2.266	10	0		DEAEHN
CN(C)Cc1cc(CC2(NCC3CCCCC3)COC2)no1	ZINC000067897793	648373212	/nfs/dbraw/zinc/37/32/12/648373212.db2.gz	NNXKMYICZZMYAV-UHFFFAOYSA-N	0	3	307.438	2.218	10	0		DEAEHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@H]1CCOC[C@@H]1C	ZINC000192515043	684451178	/nfs/dbraw/zinc/45/11/78/684451178.db2.gz	CQIAIUTUGVHSAU-RWMBFGLXSA-N	0	3	316.357	2.015	10	0		DEAEHN
CN(C)C[C@H](NC(=O)[C@H]1CSCCS1)c1ccccc1	ZINC000192933719	684460511	/nfs/dbraw/zinc/46/05/11/684460511.db2.gz	WTIKUIIEKXZBBP-UONOGXRCSA-N	0	3	310.488	2.254	10	0		DEAEHN
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@H]1CCCN(Cc2ccccc2)C1	ZINC000248393546	685157727	/nfs/dbraw/zinc/15/77/27/685157727.db2.gz	XBEWPYBZFQOSDB-ARFHVFGLSA-N	0	3	317.385	2.003	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1CN[C@H](C)c1ccn(C)n1	ZINC000886095540	692002752	/nfs/dbraw/zinc/00/27/52/692002752.db2.gz	ZSDKYCNPDNRAFU-ZLENFMNRSA-N	0	3	317.437	2.199	10	0		DEAEHN
COCCN1CC[C@@H](Nc2cncc(Br)c2C)C1	ZINC000722736123	776715494	/nfs/dbraw/zinc/71/54/94/776715494.db2.gz	QFFYJRRJOOHVNN-LLVKDONJSA-N	0	3	314.227	2.285	10	0		DEAEHN
Cc1cn(C)nc1CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000723501999	777113481	/nfs/dbraw/zinc/11/34/81/777113481.db2.gz	XTDNIIJSTWCLPX-KGLIPLIRSA-N	0	3	322.453	2.464	10	0		DEAEHN
CN1C[C@@H](CCNCc2cscc2Br)CC1=O	ZINC000723551707	777121356	/nfs/dbraw/zinc/12/13/56/777121356.db2.gz	HWBZEPYMTRIXCQ-VIFPVBQESA-N	0	3	317.252	2.469	10	0		DEAEHN
CC[C@H](NCc1nc(Br)c[nH]1)[C@H]1CCCOC1	ZINC000724011147	777220773	/nfs/dbraw/zinc/22/07/73/777220773.db2.gz	CYGJJKQEOHRUGN-UWVGGRQHSA-N	0	3	302.216	2.467	10	0		DEAEHN
C[C@](O)(CN1CCC[C@H](CO)CC1)C(F)(F)C(F)(F)F	ZINC000724041293	777228848	/nfs/dbraw/zinc/22/88/48/777228848.db2.gz	NGCWVMDLZJTNAO-UWVGGRQHSA-N	0	3	305.287	2.029	10	0		DEAEHN
CN(C[C@H]1CCCCO1)C[C@](C)(O)C(F)(F)C(F)(F)F	ZINC000724112559	777244105	/nfs/dbraw/zinc/24/41/05/777244105.db2.gz	ULOOJYSYNBCYPK-ZJUUUORDSA-N	0	3	305.287	2.436	10	0		DEAEHN
CC(C)(CNCc1cc(F)c(F)c(F)c1)CS(C)(=O)=O	ZINC000723847343	787345394	/nfs/dbraw/zinc/34/53/94/787345394.db2.gz	GZGOXUCOHKWIAH-UHFFFAOYSA-N	0	3	309.353	2.264	10	0		DEAEHN
Cn1cc(CNC[C@@H]2CCCSC2)c(Br)n1	ZINC000712471712	792190799	/nfs/dbraw/zinc/19/07/99/792190799.db2.gz	WAUMZGDUTRWIIK-VIFPVBQESA-N	0	3	304.257	2.415	10	0		DEAEHN
C[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C)c1cn(C)nn1	ZINC000715841121	792513792	/nfs/dbraw/zinc/51/37/92/792513792.db2.gz	ZDNYACMKGLTBBU-AVGNSLFASA-N	0	3	323.441	2.111	10	0		DEAEHN
CCc1nc(CN[C@@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)n[nH]1	ZINC000401796586	801851926	/nfs/dbraw/zinc/85/19/26/801851926.db2.gz	JVJYDGNNVVUKHK-VXGBXAGGSA-N	0	3	323.441	2.102	10	0		DEAEHN
CS[C@@H](CO)[C@H](C)NCc1ccc(Br)nc1	ZINC000309928583	802214180	/nfs/dbraw/zinc/21/41/80/802214180.db2.gz	WSGBIVJUQPXPNM-WPRPVWTQSA-N	0	3	305.241	2.046	10	0		DEAEHN
CC(C)[C@H]1C[C@@H](NCc2cn(C)nc2Br)CCO1	ZINC000720661160	1085821371	/nfs/dbraw/zinc/82/13/71/1085821371.db2.gz	QZIZVPUMQPWEQO-NWDGAFQWSA-N	0	3	316.243	2.476	10	0		DEAEHN
CN(C)C[C@H](N)C(=O)Nc1ccccc1SC(F)(F)F	ZINC000702418261	1086432123	/nfs/dbraw/zinc/43/21/23/1086432123.db2.gz	XOPABALMLFQADL-QMMMGPOBSA-N	0	3	307.341	2.126	10	0		DEAEHN
C[C@@H]1CN(C(=O)[C@H](N)CN(C)Cc2ccccc2)C(C)(C)C1	ZINC000702337421	1086424548	/nfs/dbraw/zinc/42/45/48/1086424548.db2.gz	KWIGOOINYIPWAG-GOEBONIOSA-N	0	3	303.450	2.093	10	0		DEAEHN
CN(CCOCCNCc1ccncc1)C(=O)OC(C)(C)C	ZINC000705911326	1086628144	/nfs/dbraw/zinc/62/81/44/1086628144.db2.gz	XIAQWWPWLUVFDH-UHFFFAOYSA-N	0	3	309.410	2.055	10	0		DEAEHN
CCN(C(=O)c1ccc(Br)nc1)[C@@H]1CCN(C)C1	ZINC000710566977	1086687569	/nfs/dbraw/zinc/68/75/69/1086687569.db2.gz	XMRSDWQWUNFWFE-LLVKDONJSA-N	0	3	312.211	2.010	10	0		DEAEHN
Cn1nc(Br)cc1CNC[C@@H]1CCC(C)(C)CO1	ZINC000711280889	1087045342	/nfs/dbraw/zinc/04/53/42/1087045342.db2.gz	JRYLDAJYGBXWQU-NSHDSACASA-N	0	3	316.243	2.477	10	0		DEAEHN
C[C@H]1[C@@H](NC(=O)c2csc(Br)c2)CCN1C	ZINC000719387040	1089056080	/nfs/dbraw/zinc/05/60/80/1089056080.db2.gz	WGPYBEXFNPIERV-CBAPKCEASA-N	0	3	303.225	2.333	10	0		DEAEHN
CCN[C@H](CSCC(=O)OC)c1cc(OC)ccc1OC	ZINC000081793950	192323689	/nfs/dbraw/zinc/32/36/89/192323689.db2.gz	GJTPMZIVUBLHCU-CYBMUJFWSA-N	0	3	313.419	2.261	10	0		DEAEHN
CCOC(=O)CSC[C@H](NC)c1ccc(OC)cc1OC	ZINC000081794979	192324521	/nfs/dbraw/zinc/32/45/21/192324521.db2.gz	PSXATTNOJSBAFI-ZDUSSCGKSA-N	0	3	313.419	2.261	10	0		DEAEHN
Cc1ccc(OC[C@@H](O)CN(C)CCC(=O)OC(C)(C)C)cc1	ZINC000150871274	282107163	/nfs/dbraw/zinc/10/71/63/282107163.db2.gz	SFCVEYIPTNBHGP-HNNXBMFYSA-N	0	3	323.433	2.398	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N[C@@H](C)CN2CCCCC2)cc1	ZINC000278390460	214135901	/nfs/dbraw/zinc/13/59/01/214135901.db2.gz	AHNLWYLDQKKSOL-AWEZNQCLSA-N	0	3	317.433	2.274	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@H]1S(=O)(=O)c1ccc(C)c(C)c1	ZINC000081921890	192338606	/nfs/dbraw/zinc/33/86/06/192338606.db2.gz	YHSCOZLAEXEZIV-HZPDHXFCSA-N	0	3	311.447	2.234	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)NCc2ccn(C3CCCC3)n2)C1	ZINC000151473932	282117681	/nfs/dbraw/zinc/11/76/81/282117681.db2.gz	VKGRQYZCBWYXKS-CQSZACIVSA-N	0	3	319.453	2.139	10	0		DEAEHN
CCN[C@@H]1CCOC[C@@H]1S(=O)(=O)c1ccc(C(C)C)cc1	ZINC000081919961	192339169	/nfs/dbraw/zinc/33/91/69/192339169.db2.gz	ORKXAXYGJMLHSC-CVEARBPZSA-N	0	3	311.447	2.351	10	0		DEAEHN
C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccccc1	ZINC000278484459	214183919	/nfs/dbraw/zinc/18/39/19/214183919.db2.gz	KLHIANJSXBRJKC-CQSZACIVSA-N	0	3	303.406	2.404	10	0		DEAEHN
CN[C@H]1CCC[C@H]1S(=O)(=O)c1ccc(Br)cc1	ZINC000081933400	192340727	/nfs/dbraw/zinc/34/07/27/192340727.db2.gz	CERPDEJWLOIVLO-NWDGAFQWSA-N	0	3	318.236	2.363	10	0		DEAEHN
CN[C@H](CS(=O)(=O)c1cccc(C(F)(F)F)c1)C1CC1	ZINC000081935681	192342270	/nfs/dbraw/zinc/34/22/70/192342270.db2.gz	UAMKHCUZNBUHNW-GFCCVEGCSA-N	0	3	307.337	2.477	10	0		DEAEHN
Cc1ncc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(C(C)C)n1	ZINC000247565095	282141547	/nfs/dbraw/zinc/14/15/47/282141547.db2.gz	ZXEJPKATRHPJLS-GXTWGEPZSA-N	0	3	304.438	2.463	10	0		DEAEHN
CCN[C@@H]1CCOC[C@H]1S(=O)(=O)c1ccc(F)c(Cl)c1	ZINC000081946434	192345301	/nfs/dbraw/zinc/34/53/01/192345301.db2.gz	YIJANIVFGXWEOL-CHWSQXEVSA-N	0	3	321.801	2.020	10	0		DEAEHN
CCC(CC)CC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000150823436	282156223	/nfs/dbraw/zinc/15/62/23/282156223.db2.gz	HNACHAGMBNFGNH-KRWDZBQOSA-N	0	3	309.498	2.441	10	0		DEAEHN
COc1ccc2c(c1)C(C)(C)C[C@@H]2N[C@@H]1CCC(=O)N(C)C1=O	ZINC000333560681	282955363	/nfs/dbraw/zinc/95/53/63/282955363.db2.gz	KWLPZUMQBYMECA-CABCVRRESA-N	0	3	316.401	2.155	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)N[C@H]2CCCC[C@@H]2n2cccn2)C1	ZINC000072525955	282184366	/nfs/dbraw/zinc/18/43/66/282184366.db2.gz	VPJGTZBWWXDDIC-PMPSAXMXSA-N	0	3	319.453	2.102	10	0		DEAEHN
C[C@@H](CNC(=O)N1CC[C@@H](N(C)C)C1)c1ccc(F)cc1F	ZINC000173509848	282191169	/nfs/dbraw/zinc/19/11/69/282191169.db2.gz	CBNAZHHAXRIXBD-WCQYABFASA-N	0	3	311.376	2.414	10	0		DEAEHN
Cc1nnc([C@H]2CCCN(Cc3nc4cccnc4s3)C2)[nH]1	ZINC000328858487	231368197	/nfs/dbraw/zinc/36/81/97/231368197.db2.gz	DMJHAFZDMSNFDN-NSHDSACASA-N	0	3	314.418	2.497	10	0		DEAEHN
CN1CCCC[C@@H]1COc1nc2c(cc1C(N)=S)CCC2	ZINC000088165697	185240764	/nfs/dbraw/zinc/24/07/64/185240764.db2.gz	VJFHJCGQOJNUOA-GFCCVEGCSA-N	0	3	305.447	2.068	10	0		DEAEHN
CC1(C)CC(=O)N(c2ccc(CN)c(C(F)(F)F)c2)C1=O	ZINC000088191308	185241341	/nfs/dbraw/zinc/24/13/41/185241341.db2.gz	KNFSJUYZZDWOCP-UHFFFAOYSA-N	0	3	300.280	2.454	10	0		DEAEHN
CN[C@@H]1CCN(c2cc(Cl)ccc2Br)C1=O	ZINC000088123204	185240187	/nfs/dbraw/zinc/24/01/87/185240187.db2.gz	WYHXOTQVZKDTNY-SECBINFHSA-N	0	3	303.587	2.427	10	0		DEAEHN
CC(=O)Nc1ccc(NC(=O)C2(N)CC2)c(C(F)(F)F)c1	ZINC000088130912	185240489	/nfs/dbraw/zinc/24/04/89/185240489.db2.gz	UZOCIULXVIHDGT-UHFFFAOYSA-N	0	3	301.268	2.094	10	0		DEAEHN
CNC(C)(C)C(=O)Nc1cc(OC)ccc1Br	ZINC000088321407	185245477	/nfs/dbraw/zinc/24/54/77/185245477.db2.gz	OSTKGUGFRKWOGK-UHFFFAOYSA-N	0	3	301.184	2.394	10	0		DEAEHN
NC[C@@](O)(CN1CCC[C@H](C(F)(F)F)C1)c1ccccc1	ZINC000088439774	185250624	/nfs/dbraw/zinc/25/06/24/185250624.db2.gz	OLOGXUCWZRKQHW-UONOGXRCSA-N	0	3	302.340	2.107	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@H](CC)C(C)C)o1	ZINC000088542961	185256428	/nfs/dbraw/zinc/25/64/28/185256428.db2.gz	CANMAWHFVVQUME-CYBMUJFWSA-N	0	3	302.440	2.492	10	0		DEAEHN
COCCNCCc1nnc(-c2cc(F)c(F)c(F)c2)s1	ZINC000088824216	185266609	/nfs/dbraw/zinc/26/66/09/185266609.db2.gz	NOTNCOKQENDMLJ-UHFFFAOYSA-N	0	3	317.336	2.401	10	0		DEAEHN
CN[C@@H](c1ccccc1)[C@H](C(C)C)S(=O)(=O)CCCOC	ZINC000081985742	192349571	/nfs/dbraw/zinc/34/95/71/192349571.db2.gz	JPKPHCZEAQIEFK-HOTGVXAUSA-N	0	3	313.463	2.423	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@@H]1S(=O)(=O)Cc1ccccc1C	ZINC000081984804	192349974	/nfs/dbraw/zinc/34/99/74/192349974.db2.gz	ADBNXIQZGXONDS-CVEARBPZSA-N	0	3	311.447	2.067	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)[C@@H]1COC[C@@H]1NC	ZINC000090434236	185296140	/nfs/dbraw/zinc/29/61/40/185296140.db2.gz	OXBPVDPUTAQCON-YPMHNXCESA-N	0	3	312.797	2.302	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1ccc(F)c(C(F)(F)F)c1	ZINC000090436281	185296229	/nfs/dbraw/zinc/29/62/29/185296229.db2.gz	OKJBJMYJHIBZES-GZMMTYOYSA-N	0	3	306.259	2.017	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1ccc(OC(C)C)c(Cl)c1	ZINC000090433702	185296278	/nfs/dbraw/zinc/29/62/78/185296278.db2.gz	XIMDZKXHXLGCAQ-DGCLKSJQSA-N	0	3	312.797	2.300	10	0		DEAEHN
CCCOc1ccc(NC(=O)[C@]2(C)COC[C@@H]2N)cc1Cl	ZINC000090590080	185305458	/nfs/dbraw/zinc/30/54/58/185305458.db2.gz	GZGIEFHJYZSYQN-DZGCQCFKSA-N	0	3	312.797	2.431	10	0		DEAEHN
C[C@]1(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)COC[C@@H]1N	ZINC000090599236	185305791	/nfs/dbraw/zinc/30/57/91/185305791.db2.gz	FRHSYZLNQRFVGS-GWCFXTLKSA-N	0	3	320.723	2.244	10	0		DEAEHN
C(CN1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1)OC1CCOCC1	ZINC000625277651	365710395	/nfs/dbraw/zinc/71/03/95/365710395.db2.gz	JPMJJUOXFSXPHU-CQSZACIVSA-N	0	3	320.437	2.057	10	0		DEAEHN
Cc1ccc(NC(=O)[C@]2(C)COC[C@@H]2N)cc1Br	ZINC000090604357	185306206	/nfs/dbraw/zinc/30/62/06/185306206.db2.gz	TZDPEWYBLHCDHA-WCQYABFASA-N	0	3	313.195	2.060	10	0		DEAEHN
C[C@@]1(c2nc(Cc3c(F)cccc3Cl)no2)COC[C@@H]1N	ZINC000090573783	185304319	/nfs/dbraw/zinc/30/43/19/185304319.db2.gz	YVBGWNFJFVYUKN-SMDDNHRTSA-N	0	3	311.744	2.068	10	0		DEAEHN
Cc1cc(NC(=O)[C@]2(C)COC[C@H]2N)ccc1Br	ZINC000090580524	185304773	/nfs/dbraw/zinc/30/47/73/185304773.db2.gz	BVDHVVBTSSHWMF-DGCLKSJQSA-N	0	3	313.195	2.060	10	0		DEAEHN
COc1cccc(C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c1F	ZINC000090685632	185309635	/nfs/dbraw/zinc/30/96/35/185309635.db2.gz	RGQZKNZDMLUWGR-OCCSQVGLSA-N	0	3	306.381	2.391	10	0		DEAEHN
COc1ccccc1C(=O)N1CCCSC[C@@H]1CN(C)C	ZINC000090699817	185310352	/nfs/dbraw/zinc/31/03/52/185310352.db2.gz	YZWMKGMVFBCHKP-ZDUSSCGKSA-N	0	3	308.447	2.205	10	0		DEAEHN
CCCCS(=O)(=O)N1CCCSC[C@@H]1CN1CCCC1	ZINC000090701034	185310410	/nfs/dbraw/zinc/31/04/10/185310410.db2.gz	LXRQPYFNKHLFAD-AWEZNQCLSA-N	0	3	320.524	2.020	10	0		DEAEHN
CC1(C)CCc2ccccc2[C@H]1[NH2+]CCCOC(=O)N=C(N)[O-]	ZINC000183223821	282240530	/nfs/dbraw/zinc/24/05/30/282240530.db2.gz	CDSZFCGXWRVXSJ-CQSZACIVSA-N	0	3	319.405	2.485	10	0		DEAEHN
CC1(C)CCc2ccccc2[C@H]1[NH2+]CCCOC([O-])=NC(N)=O	ZINC000183223821	282240534	/nfs/dbraw/zinc/24/05/34/282240534.db2.gz	CDSZFCGXWRVXSJ-CQSZACIVSA-N	0	3	319.405	2.485	10	0		DEAEHN
CN[C@H]1c2cc(OC)ccc2C[C@@H]1Sc1nnc(C)n1C	ZINC000092911769	185348504	/nfs/dbraw/zinc/34/85/04/185348504.db2.gz	UKEUKTBTKMRZCD-KBPBESRZSA-N	0	3	304.419	2.110	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CCc1cccc2c1OCO2	ZINC000186221150	282269852	/nfs/dbraw/zinc/26/98/52/282269852.db2.gz	QMPCMTLSUINAPE-HNNXBMFYSA-N	0	3	318.417	2.291	10	0		DEAEHN
CSCCN(C)S(=O)(=O)c1cc(CNC(C)C)cs1	ZINC000168531031	197725047	/nfs/dbraw/zinc/72/50/47/197725047.db2.gz	OCTNMKGZORZEFX-UHFFFAOYSA-N	0	3	322.521	2.230	10	0		DEAEHN
CN(Cc1ccccn1)[C@H]1CCCN(C(=O)c2ccon2)CC1	ZINC000328636628	530005263	/nfs/dbraw/zinc/00/52/63/530005263.db2.gz	ODVUCNUIHIIFKR-HNNXBMFYSA-N	0	3	314.389	2.196	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccc(Br)c(F)c1	ZINC000195316787	530063652	/nfs/dbraw/zinc/06/36/52/530063652.db2.gz	ZCFRARIHAORQBN-JTQLQIEISA-N	0	3	315.186	2.412	10	0		DEAEHN
COC(=O)C(C)(C)[C@@H]1CCCN(C[C@H](O)CC(F)(F)F)C1	ZINC000615794709	362704645	/nfs/dbraw/zinc/70/46/45/362704645.db2.gz	PCOMMJZSQACRJX-GHMZBOCLSA-N	0	3	311.344	2.211	10	0		DEAEHN
COCc1cc(N2CCNCC2)nc(-c2cccc(Cl)c2)n1	ZINC000070451660	190894766	/nfs/dbraw/zinc/89/47/66/190894766.db2.gz	UYRAUDGOFBEOHF-UHFFFAOYSA-N	0	3	318.808	2.353	10	0		DEAEHN
Clc1ccc(-c2cc3c(N4CCNCC4)nccn3n2)cc1	ZINC000070459144	190897788	/nfs/dbraw/zinc/89/77/88/190897788.db2.gz	QIIZDUOFFBDRHL-UHFFFAOYSA-N	0	3	313.792	2.459	10	0		DEAEHN
CCN1CCN(C(=O)[C@H](C)N[C@@H](C)c2ccc(C)c(F)c2)CC1	ZINC000181347088	539650918	/nfs/dbraw/zinc/65/09/18/539650918.db2.gz	OMLQWGLJYLYHIN-GJZGRUSLSA-N	0	3	321.440	2.337	10	0		DEAEHN
C[C@H](N)c1cccc(S(=O)(=O)N[C@@H](C)c2nccs2)c1	ZINC000080343697	192150612	/nfs/dbraw/zinc/15/06/12/192150612.db2.gz	CAUSGIGIURQSAH-UWVGGRQHSA-N	0	3	311.432	2.202	10	0		DEAEHN
Cc1cc(N2CCC[C@H](NCc3cccs3)C2=O)n(C)n1	ZINC000080526746	192165199	/nfs/dbraw/zinc/16/51/99/192165199.db2.gz	RAIVRYDMLHKMSK-ZDUSSCGKSA-N	0	3	304.419	2.075	10	0		DEAEHN
CCN1CCC(n2nccc2NC(=O)c2ccn(C)c2C)CC1	ZINC000195198245	539721242	/nfs/dbraw/zinc/72/12/42/539721242.db2.gz	IGGWILREHRLFLW-UHFFFAOYSA-N	0	3	315.421	2.439	10	0		DEAEHN
CN1C[C@@H](NCc2ccc(OC(F)(F)F)cc2)CCC1=O	ZINC000084062150	192399490	/nfs/dbraw/zinc/39/94/90/192399490.db2.gz	UXQTWIOUNVBKSF-NSHDSACASA-N	0	3	302.296	2.296	10	0		DEAEHN
CN[C@H](Cc1ncnn1C)c1ccc(Br)s1	ZINC000083974297	192392830	/nfs/dbraw/zinc/39/28/30/192392830.db2.gz	SDIBEMJWJOWICI-SSDOTTSWSA-N	0	3	301.213	2.142	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Cc2cccc(C(F)(F)F)c2)C1	ZINC000170863462	197840060	/nfs/dbraw/zinc/84/00/60/197840060.db2.gz	LZKPYCXWNUAMSG-ZDUSSCGKSA-N	0	3	300.324	2.410	10	0		DEAEHN
NC[C@H]1c2cc(OCc3ccccc3)ccc2CN1CCCO	ZINC000071684834	191008077	/nfs/dbraw/zinc/00/80/77/191008077.db2.gz	YEWWIQDPFKIVKQ-IBGZPJMESA-N	0	3	312.413	2.463	10	0		DEAEHN
CC1CCC(N)(c2nc3c(cccc3S(C)(=O)=O)[nH]2)CC1	ZINC000138133095	186014643	/nfs/dbraw/zinc/01/46/43/186014643.db2.gz	AKJJRWNMYYWJFD-UHFFFAOYSA-N	0	3	307.419	2.331	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N2CCCC2(C)C)c1	ZINC000139038144	186019685	/nfs/dbraw/zinc/01/96/85/186019685.db2.gz	UMKWTOXNGZPTHN-UHFFFAOYSA-N	0	3	318.389	2.247	10	0		DEAEHN
C[C@@H]1CCC[C@@](N)(c2nc3c(cccc3S(C)(=O)=O)[nH]2)C1	ZINC000138156901	186014288	/nfs/dbraw/zinc/01/42/88/186014288.db2.gz	QMZYXUVYRIGUIP-BMIGLBTASA-N	0	3	307.419	2.331	10	0		DEAEHN
CC(C)[C@@H]1N[C@@H](c2ccsc2)N(C[C@@H]2CCN(C)C2)C1=O	ZINC000142205790	186031662	/nfs/dbraw/zinc/03/16/62/186031662.db2.gz	KMLBPNGJMIMYMQ-VHDGCEQUSA-N	0	3	307.463	2.155	10	0		DEAEHN
CCCN(C(C)C)[C@@]1(CN)CCS(=O)(=O)c2ccccc21	ZINC000147640812	186040756	/nfs/dbraw/zinc/04/07/56/186040756.db2.gz	RRCMUWJXJRQFND-MRXNPFEDSA-N	0	3	310.463	2.138	10	0		DEAEHN
CCN[C@H](c1cncs1)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000147684847	186041585	/nfs/dbraw/zinc/04/15/85/186041585.db2.gz	FUTORUNVHWNQSQ-MDZLAQPJSA-N	0	3	302.465	2.397	10	0		DEAEHN
CN[C@H](C)c1ccc(N2CCN(c3nccs3)CC2)cn1	ZINC000148141671	186043195	/nfs/dbraw/zinc/04/31/95/186043195.db2.gz	KXRVVTSAPBSHQS-GFCCVEGCSA-N	0	3	303.435	2.145	10	0		DEAEHN
CN1CCC[C@H](CN2C(=O)C3(CC3)N[C@H]2c2cccs2)C1	ZINC000144250169	186034871	/nfs/dbraw/zinc/03/48/71/186034871.db2.gz	RCIKQPDPMDUNPY-GXTWGEPZSA-N	0	3	305.447	2.053	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@@H](C)C(=O)N2C[C@@H]2CCCN(C)C2)s1	ZINC000144210312	186035260	/nfs/dbraw/zinc/03/52/60/186035260.db2.gz	ZKWNESKGACEZGO-GZBFAFLISA-N	0	3	307.463	2.217	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@@H](C)C(=O)N2[C@@H](CN(C)C)C(C)C)s1	ZINC000145031497	186036641	/nfs/dbraw/zinc/03/66/41/186036641.db2.gz	GVGDOLRPTAFQIN-KCQAQPDRSA-N	0	3	309.479	2.462	10	0		DEAEHN
CCCNc1nc(Cl)nc(N2CC[C@@H](N3CCCC3)C2)n1	ZINC000149936226	186053511	/nfs/dbraw/zinc/05/35/11/186053511.db2.gz	UBVQWRWQBJGREM-LLVKDONJSA-N	0	3	310.833	2.021	10	0		DEAEHN
CCN[C@@H](c1ccc2cccnc2c1)[C@@H]1CCS(=O)(=O)C1	ZINC000150123873	186054648	/nfs/dbraw/zinc/05/46/48/186054648.db2.gz	LTWLFHXRGGNUNS-ZBFHGGJFSA-N	0	3	304.415	2.320	10	0		DEAEHN
CCCN[C@@H]1CCCc2nc([C@H]3CCS(=O)(=O)C3)sc21	ZINC000150258239	186055981	/nfs/dbraw/zinc/05/59/81/186055981.db2.gz	CYDLNXBLKFDMJS-WDEREUQCSA-N	0	3	314.476	2.422	10	0		DEAEHN
COc1ccc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c(OC)c1	ZINC000155824616	186115741	/nfs/dbraw/zinc/11/57/41/186115741.db2.gz	JZXSSNUQUJDGGR-WFASDCNBSA-N	0	3	306.406	2.162	10	0		DEAEHN
CCn1ncc(Br)c1C(=O)c1ccc(CN)cc1	ZINC000164068853	186147965	/nfs/dbraw/zinc/14/79/65/186147965.db2.gz	ZPRSISVPWRGAIN-UHFFFAOYSA-N	0	3	308.179	2.355	10	0		DEAEHN
NCc1ccccc1NC(=O)CC[S@@](=O)c1ccccc1	ZINC000155906286	186121981	/nfs/dbraw/zinc/12/19/81/186121981.db2.gz	DBWLQLDDKNQAFM-NRFANRHFSA-N	0	3	302.399	2.282	10	0		DEAEHN
C[C@H](C(=O)Nc1ccccc1CN)[S@](=O)c1ccccc1	ZINC000155908186	186122437	/nfs/dbraw/zinc/12/24/37/186122437.db2.gz	QCAWBIDARBZNTF-XUSGNXJCSA-N	0	3	302.399	2.280	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1ccc(Br)cc1	ZINC000159569808	186127703	/nfs/dbraw/zinc/12/77/03/186127703.db2.gz	WCSMOBVQXGMJBL-NSHDSACASA-N	0	3	301.184	2.142	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Cc2ccccc2Br)C1	ZINC000171508450	186170282	/nfs/dbraw/zinc/17/02/82/186170282.db2.gz	MNOPJNOSLVGJDA-GFCCVEGCSA-N	0	3	311.223	2.154	10	0		DEAEHN
CC(C(=O)N(C)Cc1ccc(Br)cc1)=C1CNC1	ZINC000164149062	186150887	/nfs/dbraw/zinc/15/08/87/186150887.db2.gz	DZPWILQPYFVDSO-UHFFFAOYSA-N	0	3	309.207	2.327	10	0		DEAEHN
Cc1n[nH]c(C)c1[C@H](C)CC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000164253748	186153331	/nfs/dbraw/zinc/15/33/31/186153331.db2.gz	JDSGQZQWFSPEFM-JMSVASOKSA-N	0	3	306.454	2.461	10	0		DEAEHN
CCCc1cc(NC(=O)N(C)C[C@@H]2CCCN2CC)n(C)n1	ZINC000179693261	186206137	/nfs/dbraw/zinc/20/61/37/186206137.db2.gz	PKCAMXYJEZUTAU-AWEZNQCLSA-N	0	3	307.442	2.321	10	0		DEAEHN
CCSCc1cc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)no1	ZINC000186041310	186234678	/nfs/dbraw/zinc/23/46/78/186234678.db2.gz	MBADHQUAKGPNEK-VXGBXAGGSA-N	0	3	311.451	2.482	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1OCCNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171901210	198003675	/nfs/dbraw/zinc/00/36/75/198003675.db2.gz	HOVGJAWRFSTUOY-OAGGEKHMSA-N	0	3	309.454	2.071	10	0		DEAEHN
CCn1c(C)nnc1CN1CCN(C2CCC(C)CC2)CC1	ZINC000172011289	198025432	/nfs/dbraw/zinc/02/54/32/198025432.db2.gz	RBNDVKUDWKSXSG-UHFFFAOYSA-N	0	3	305.470	2.303	10	0		DEAEHN
O=C(NCCc1cc2ccccc2o1)N1CCN2CCC[C@@H]2C1	ZINC000172495798	198105985	/nfs/dbraw/zinc/10/59/85/198105985.db2.gz	LYJXXMNRLGEIDX-OAHLLOKOSA-N	0	3	313.401	2.465	10	0		DEAEHN
C[C@H]1CSCCN1C(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000172559255	198115051	/nfs/dbraw/zinc/11/50/51/198115051.db2.gz	ZOFUZSKOKOWVDJ-GOEBONIOSA-N	0	3	321.490	2.306	10	0		DEAEHN
Cc1cc(C)cc(CCNC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000172644076	198130848	/nfs/dbraw/zinc/13/08/48/198130848.db2.gz	RCFLYNCKCOFXKL-KRWDZBQOSA-N	0	3	301.434	2.336	10	0		DEAEHN
CCc1ccc([C@H]2CCCCN2CCCC(=O)NC(N)=O)o1	ZINC000172871090	198160165	/nfs/dbraw/zinc/16/01/65/198160165.db2.gz	XCTZXZHHBGRAOK-CYBMUJFWSA-N	0	3	307.394	2.344	10	0		DEAEHN
O=C(NCc1ccccc1Cl)N1CC[C@H](N2CC=CC2)C1	ZINC000173226924	198198024	/nfs/dbraw/zinc/19/80/24/198198024.db2.gz	OVUVDBDLMZSVAM-AWEZNQCLSA-N	0	3	305.809	2.496	10	0		DEAEHN
O=C(Nc1nc[n-]n1)[C@]12CCC[C@@H]1C[N@H+](Cc1ccccc1)C2	ZINC000333054292	539947045	/nfs/dbraw/zinc/94/70/45/539947045.db2.gz	LXXDZELTNNBDOD-PBHICJAKSA-N	0	3	311.389	2.046	10	0		DEAEHN
O=C(Nc1nc[n-]n1)[C@]12CCC[C@@H]1C[N@@H+](Cc1ccccc1)C2	ZINC000333054292	539947049	/nfs/dbraw/zinc/94/70/49/539947049.db2.gz	LXXDZELTNNBDOD-PBHICJAKSA-N	0	3	311.389	2.046	10	0		DEAEHN
CCOc1cccc(CNC(=O)N2CC[C@@H](N3CC=CC3)C2)c1	ZINC000173767743	198250082	/nfs/dbraw/zinc/25/00/82/198250082.db2.gz	DCVHQCDXBKFNIF-MRXNPFEDSA-N	0	3	315.417	2.241	10	0		DEAEHN
Cc1ccccc1O[C@@H](C)CNC(=O)N1CC[C@H](N(C)C)C1	ZINC000173916883	198268362	/nfs/dbraw/zinc/26/83/62/198268362.db2.gz	OGYCRSFAPCDYGU-GJZGRUSLSA-N	0	3	305.422	2.108	10	0		DEAEHN
C[C@@H]1CC[C@H](C)CN1C(=O)C(=O)Nc1cccc(CN(C)C)c1	ZINC000173826828	198257716	/nfs/dbraw/zinc/25/77/16/198257716.db2.gz	COPGRAYMOZGOCO-UONOGXRCSA-N	0	3	317.433	2.334	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCCOc2cccc(F)c2)CCN1C	ZINC000174046762	198285400	/nfs/dbraw/zinc/28/54/00/198285400.db2.gz	QKUKEUZEGNXCIF-ZFWWWQNUSA-N	0	3	323.412	2.329	10	0		DEAEHN
CC[C@@H](CO)N1CCN(CCCc2cccc(OC)c2)CC1	ZINC000174132310	198295296	/nfs/dbraw/zinc/29/52/96/198295296.db2.gz	OXFKBOOKXRQHIU-KRWDZBQOSA-N	0	3	306.450	2.016	10	0		DEAEHN
COc1cc(CNC(=O)N2CC[C@H](N3CC=CC3)C2)ccc1C	ZINC000174269170	198312654	/nfs/dbraw/zinc/31/26/54/198312654.db2.gz	PSJYSLUDNDJYFM-INIZCTEOSA-N	0	3	315.417	2.159	10	0		DEAEHN
C[C@H](CNC[C@@H](O)c1ccccc1)NC(=O)Cc1ccccc1	ZINC000040504051	354169601	/nfs/dbraw/zinc/16/96/01/354169601.db2.gz	NMIXRSULZCHUEE-CRAIPNDOSA-N	0	3	312.413	2.057	10	0		DEAEHN
CCC(=O)OC[C@H]1CN(Cc2ccccc2)C[C@@H]1OC(=O)CC	ZINC000048533464	354353673	/nfs/dbraw/zinc/35/36/73/354353673.db2.gz	IAILZLXBCDRKGE-CVEARBPZSA-N	0	3	319.401	2.393	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC[C@H]2c2ccncc2)C1	ZINC000062652237	354637000	/nfs/dbraw/zinc/63/70/00/354637000.db2.gz	XVOPTNGZAKRZRH-HOTGVXAUSA-N	0	3	302.422	2.412	10	0		DEAEHN
CCCNC(=O)c1cccnc1N1CCN[C@@H](c2ccccc2)C1	ZINC000065255721	354681095	/nfs/dbraw/zinc/68/10/95/354681095.db2.gz	OOZYXKOFOYKKRC-QGZVFWFLSA-N	0	3	324.428	2.372	10	0		DEAEHN
COC(C)(C)C[C@@H](C)NC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000073722365	191346270	/nfs/dbraw/zinc/34/62/70/191346270.db2.gz	ZIBUHHXAMDBZRA-KGLIPLIRSA-N	0	3	301.475	2.466	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCC[C@@H]([C@@H](C)O)C1	ZINC000089930755	355548375	/nfs/dbraw/zinc/54/83/75/355548375.db2.gz	ZYHGCCHTMRFKSZ-NVXWUHKLSA-N	0	3	304.434	2.128	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)C[C@@H]2CCOc3ccccc32)C1	ZINC000117796715	355778641	/nfs/dbraw/zinc/77/86/41/355778641.db2.gz	GLFUBRKGYUXASX-GJZGRUSLSA-N	0	3	302.418	2.401	10	0		DEAEHN
CC(C)Oc1ccccc1CN1CC[C@H](CO)[C@H](N(C)C)C1	ZINC000169751058	355979735	/nfs/dbraw/zinc/97/97/35/355979735.db2.gz	JLCPZHVWXFOQQO-IAGOWNOFSA-N	0	3	306.450	2.218	10	0		DEAEHN
CCC(CC)N1CC[C@H](CO)[C@H](NC(=O)c2ccccc2)C1	ZINC000169786489	355983502	/nfs/dbraw/zinc/98/35/02/355983502.db2.gz	YMHHLXNENHMZIB-NVXWUHKLSA-N	0	3	304.434	2.288	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)c1ccccc1SC	ZINC000170809283	355994051	/nfs/dbraw/zinc/99/40/51/355994051.db2.gz	IYAQZXALXUPPKE-ZDUSSCGKSA-N	0	3	308.447	2.249	10	0		DEAEHN
Cc1noc(C)c1C[C@H](C)NC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000156762919	355953684	/nfs/dbraw/zinc/95/36/84/355953684.db2.gz	UWZXDRYJKDQFKL-SWLSCSKDSA-N	0	3	324.469	2.498	10	0		DEAEHN
COc1ccc(F)cc1[C@@H](C)NC[C@H](C)CS(C)(=O)=O	ZINC000179948411	356037234	/nfs/dbraw/zinc/03/72/34/356037234.db2.gz	IREAILPCEYIMAP-WDEREUQCSA-N	0	3	303.399	2.166	10	0		DEAEHN
c1cn(CCCN2CCN(c3nc4ccccc4o3)CC2)cn1	ZINC000182753709	356143395	/nfs/dbraw/zinc/14/33/95/356143395.db2.gz	ISUABPQSWXDOEC-UHFFFAOYSA-N	0	3	311.389	2.237	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCCN([C@H]2CN3CCC2CC3)CC1	ZINC000226093353	356278080	/nfs/dbraw/zinc/27/80/80/356278080.db2.gz	QORVYMUFFVFZEQ-HNNXBMFYSA-N	0	3	309.454	2.023	10	0		DEAEHN
C[C@@H]1CCC[C@@](N)(C(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1	ZINC000080915121	192201835	/nfs/dbraw/zinc/20/18/35/192201835.db2.gz	CBSNSEAGIMGTKE-PSLIRLAXSA-N	0	3	309.797	2.285	10	0		DEAEHN
COC[C@H]1CCN([C@@H](CN)c2ccc(Br)s2)C1	ZINC000081041421	192219793	/nfs/dbraw/zinc/21/97/93/192219793.db2.gz	YPFIUCLKXLQXGG-UWVGGRQHSA-N	0	3	319.268	2.479	10	0		DEAEHN
Ic1cnc([C@H]2NC[C@H]2C2CC2)s1	ZINC000306898457	356406075	/nfs/dbraw/zinc/40/60/75/356406075.db2.gz	XHFWMAOOCMLTFN-XPUUQOCRSA-N	0	3	306.172	2.418	10	0		DEAEHN
NC[C@H](c1cc(Cl)cc(Cl)c1)N1CCn2cnnc2C1	ZINC000081532993	192284452	/nfs/dbraw/zinc/28/44/52/192284452.db2.gz	PJMBTTFSPBQACI-GFCCVEGCSA-N	0	3	312.204	2.101	10	0		DEAEHN
CCOC(=O)CCCN[C@@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000081544640	192288051	/nfs/dbraw/zinc/28/80/51/192288051.db2.gz	COGWPUUCOXAXDG-LBPRGKRZSA-N	0	3	313.419	2.084	10	0		DEAEHN
CCN[C@H](C)c1cccc(S(=O)(=O)N[C@H](C)CCOC)c1	ZINC000081717783	192316077	/nfs/dbraw/zinc/31/60/77/192316077.db2.gz	GTHWBSLHFVSPNL-CHWSQXEVSA-N	0	3	314.451	2.060	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)Nc1ccc(OCc2nc(C)no2)cc1	ZINC000236910685	202066255	/nfs/dbraw/zinc/06/62/55/202066255.db2.gz	KNSPRKIGQBDRTP-ZUZCIYMTSA-N	0	3	318.377	2.269	10	0		DEAEHN
CCCOc1ccc(C(=O)CCC(=O)N(C)[C@@H](C)CN)cc1	ZINC000236937102	202080075	/nfs/dbraw/zinc/08/00/75/202080075.db2.gz	YBRBNACJZSHQCW-ZDUSSCGKSA-N	0	3	306.406	2.244	10	0		DEAEHN
COC[C@@](C)(O)CNCc1ccc(Br)c(F)c1	ZINC000382537734	356676369	/nfs/dbraw/zinc/67/63/69/356676369.db2.gz	CCICONHFMQQHSO-LBPRGKRZSA-N	0	3	306.175	2.075	10	0		DEAEHN
c1cn([C@H]2CCCN(CCOCCOc3ccccc3)C2)nn1	ZINC000425497230	283209003	/nfs/dbraw/zinc/20/90/03/283209003.db2.gz	CDZFEYOIMIGMCJ-INIZCTEOSA-N	0	3	316.405	2.011	10	0		DEAEHN
c1cnn(-c2cccc(CN3CC[C@H](Nc4ncccn4)C3)c2)c1	ZINC000578771038	356870978	/nfs/dbraw/zinc/87/09/78/356870978.db2.gz	HRYMXCOMVNJELY-INIZCTEOSA-N	0	3	320.400	2.349	10	0		DEAEHN
O[C@H](COC[C@@H]1CCCO1)CN1CCCc2sccc2C1	ZINC000593439708	358079196	/nfs/dbraw/zinc/07/91/96/358079196.db2.gz	BLZHSROVTVDHDV-GJZGRUSLSA-N	0	3	311.447	2.053	10	0		DEAEHN
CCC[C@@H](C)CN1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000180132792	199120924	/nfs/dbraw/zinc/12/09/24/199120924.db2.gz	BZQNBZRZJUJSDW-MSOLQXFVSA-N	0	3	320.477	2.480	10	0		DEAEHN
CC(C)CSCCN[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000180205153	199130751	/nfs/dbraw/zinc/13/07/51/199130751.db2.gz	UDEXZVQOZZTJLI-LBPRGKRZSA-N	0	3	316.492	2.374	10	0		DEAEHN
c1cc(-c2noc(CN3CC[C@H](N4CCCCC4)C3)n2)co1	ZINC000594024881	358192548	/nfs/dbraw/zinc/19/25/48/358192548.db2.gz	UCNLEBLUBTVHCA-AWEZNQCLSA-N	0	3	302.378	2.390	10	0		DEAEHN
CCOc1ccc([C@@H](C)NC[C@@H]2CN(C)CCO2)cc1OCC	ZINC000180493754	199166155	/nfs/dbraw/zinc/16/61/55/199166155.db2.gz	RIFUFQQIICTPPL-GDBMZVCRSA-N	0	3	322.449	2.465	10	0		DEAEHN
C[C@H](CNC(=O)N(C)[C@H](C)c1cnn(C)c1)N1CCC(C)CC1	ZINC000180791036	199209828	/nfs/dbraw/zinc/20/98/28/199209828.db2.gz	HQUNUAGKNYZUBH-HUUCEWRRSA-N	0	3	321.469	2.243	10	0		DEAEHN
CCOCc1cccc(NC(=O)N2CCO[C@H](CN(C)C)C2)c1	ZINC000181195905	199263589	/nfs/dbraw/zinc/26/35/89/199263589.db2.gz	OUBKCFQGHPZFBJ-MRXNPFEDSA-N	0	3	321.421	2.017	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)Nc2ccc3ncsc3c2)CCO1	ZINC000181166954	199258992	/nfs/dbraw/zinc/25/89/92/199258992.db2.gz	KBXDPMNUULCOBX-LBPRGKRZSA-N	0	3	320.418	2.091	10	0		DEAEHN
Cc1sc(CN)cc1S(=O)(=O)N1C[C@@H](C)CC[C@@H]1C	ZINC000089050824	192721661	/nfs/dbraw/zinc/72/16/61/192721661.db2.gz	POZFKGUQEOFIGB-UWVGGRQHSA-N	0	3	302.465	2.324	10	0		DEAEHN
C[C@H]1CC[C@@](CO)(N(C)CC(=O)N(C)Cc2ccccc2F)C1	ZINC000187944539	200181001	/nfs/dbraw/zinc/18/10/01/200181001.db2.gz	ZHLOKLIWMJAHFJ-KBXCAEBGSA-N	0	3	322.424	2.267	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2cccc(Br)n2)C1	ZINC000188584867	200270813	/nfs/dbraw/zinc/27/08/13/200270813.db2.gz	BRWIZHQZXDMXFX-SECBINFHSA-N	0	3	313.199	2.012	10	0		DEAEHN
CN(CCC(=O)N1CCc2ccccc2C1)C[C@H]1CCCO1	ZINC000188969499	200328596	/nfs/dbraw/zinc/32/85/96/200328596.db2.gz	PGXIHLJOLDZOHB-QGZVFWFLSA-N	0	3	302.418	2.072	10	0		DEAEHN
C[C@@H](C(=O)NCc1cn2c(n1)CCCC2)N1CCCCCC1	ZINC000603819759	360861813	/nfs/dbraw/zinc/86/18/13/360861813.db2.gz	VEEAVLBSUZHKMU-AWEZNQCLSA-N	0	3	304.438	2.100	10	0		DEAEHN
Cn1ccc(C(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)n1	ZINC000607538317	361094911	/nfs/dbraw/zinc/09/49/11/361094911.db2.gz	PDJGMXTVTHPEHN-DOMZBBRYSA-N	0	3	318.446	2.295	10	0		DEAEHN
CC(C)N(C)CC(=O)N[C@@H](Cc1nccn1C)c1ccccc1	ZINC000608206556	361184461	/nfs/dbraw/zinc/18/44/61/361184461.db2.gz	YEFDHELIYRISDR-INIZCTEOSA-N	0	3	314.433	2.160	10	0		DEAEHN
COC(=O)C(C)(C)[C@@H](NC(=O)CN(C)C(C)C)c1ccccc1	ZINC000610824718	361472087	/nfs/dbraw/zinc/47/20/87/361472087.db2.gz	LDVKFWWOTOWQAC-INIZCTEOSA-N	0	3	320.433	2.383	10	0		DEAEHN
COC(=O)C(C)(C)[C@@H](NC[C@@H](O)COC(C)C)c1ccccc1	ZINC000611406868	361593272	/nfs/dbraw/zinc/59/32/72/361593272.db2.gz	ZCRNODXUMDRGQQ-CVEARBPZSA-N	0	3	323.433	2.302	10	0		DEAEHN
Cc1ccc(CN(C)CC(O)CN(C)Cc2ccc(C)o2)o1	ZINC000194401140	201218446	/nfs/dbraw/zinc/21/84/46/201218446.db2.gz	VIYVMQWKFBXEPR-UHFFFAOYSA-N	0	3	306.406	2.414	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC(c2c(F)cncc2F)=C[C@H](N)C1	ZINC000675078729	541286374	/nfs/dbraw/zinc/28/63/74/541286374.db2.gz	RWOMLISNYFDZGE-JTQLQIEISA-N	0	3	311.332	2.321	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC(c2cc(Cl)cnc2N)=C[C@@H](N)C1	ZINC000675078452	541286462	/nfs/dbraw/zinc/28/64/62/541286462.db2.gz	PWTRSXZLBKZNAN-LLVKDONJSA-N	0	3	324.812	2.279	10	0		DEAEHN
CN(CC[C@@H]1CNCCO1)Cc1ccccc1Br	ZINC000091313774	193039176	/nfs/dbraw/zinc/03/91/76/193039176.db2.gz	YBACOHWWXUBWMU-CYBMUJFWSA-N	0	3	313.239	2.259	10	0		DEAEHN
C[C@H](NC[C@H]1COCCN1C)c1ccccc1Br	ZINC000624172814	365318685	/nfs/dbraw/zinc/31/86/85/365318685.db2.gz	VBDPQNODYWZXBV-RYUDHWBXSA-N	0	3	313.239	2.430	10	0		DEAEHN
C[C@H]1CC[C@@H]([N-]S(=O)(=O)c2c(Cl)cccc2Cl)C[NH2+]1	ZINC000624407014	365413269	/nfs/dbraw/zinc/41/32/69/365413269.db2.gz	RGSYOJGKTRSFGD-DTWKUNHWSA-N	0	3	323.245	2.412	10	0		DEAEHN
CNc1ncc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1Cl	ZINC000092023910	193143267	/nfs/dbraw/zinc/14/32/67/193143267.db2.gz	GYSRLIFWOGNCCV-NEPJUHHUSA-N	0	3	308.813	2.085	10	0		DEAEHN
O=C(c1ccsc1Br)N1CCN2CCC[C@@H]2C1	ZINC000449825702	241129563	/nfs/dbraw/zinc/12/95/63/241129563.db2.gz	CVRGJILIZVLZRI-SECBINFHSA-N	0	3	315.236	2.431	10	0		DEAEHN
Brc1ccc2c(c1)N(C[C@@H]1CNCCO1)CC21CC1	ZINC000629558585	367252009	/nfs/dbraw/zinc/25/20/09/367252009.db2.gz	JTBDMDGAYNODGH-LBPRGKRZSA-N	0	3	323.234	2.289	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N(C)[C@@H](C)C(C)C)c(F)c1	ZINC000092115698	193163331	/nfs/dbraw/zinc/16/33/31/193163331.db2.gz	COODKCQIBLFNQF-NSHDSACASA-N	0	3	302.415	2.210	10	0		DEAEHN
C[C@@H]1CCCCCN1S(=O)(=O)c1ccc(CN)cc1F	ZINC000092116229	193163955	/nfs/dbraw/zinc/16/39/55/193163955.db2.gz	QGGAJIZDNOMXLL-LLVKDONJSA-N	0	3	300.399	2.238	10	0		DEAEHN
C[C@H]1CCCCCN1S(=O)(=O)c1ccc(CN)cc1F	ZINC000092116230	193164561	/nfs/dbraw/zinc/16/45/61/193164561.db2.gz	QGGAJIZDNOMXLL-NSHDSACASA-N	0	3	300.399	2.238	10	0		DEAEHN
c1c(CNCC2(C3CCC3)CCC2)nnn1C[C@@H]1CCOC1	ZINC000631155249	368049867	/nfs/dbraw/zinc/04/98/67/368049867.db2.gz	MJYGOXHUTVJYTA-AWEZNQCLSA-N	0	3	304.438	2.375	10	0		DEAEHN
c1c(CN[C@@H]2CCC[C@H](C3CC3)C2)nnn1C[C@H]1CCOC1	ZINC000631164240	368055297	/nfs/dbraw/zinc/05/52/97/368055297.db2.gz	OWDGOLMHGWJFTA-VNQPRFMTSA-N	0	3	304.438	2.373	10	0		DEAEHN
CO[C@H](c1ccccc1F)[C@H](C)NC(=O)[C@@H](N)CCSC	ZINC000262125838	203205323	/nfs/dbraw/zinc/20/53/23/203205323.db2.gz	LJQWSGZKHLTNTA-BPNCWPANSA-N	0	3	314.426	2.098	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000262524234	203320344	/nfs/dbraw/zinc/32/03/44/203320344.db2.gz	FYCVIKQVJPGTQB-GXTWGEPZSA-N	0	3	302.777	2.146	10	0		DEAEHN
Cn1cc(CN2CC[C@H]3OCCC[C@@H]3C2)c(-c2ccncc2)n1	ZINC000093507134	193260669	/nfs/dbraw/zinc/26/06/69/193260669.db2.gz	KYYAMFKBGXWXDA-NVXWUHKLSA-N	0	3	312.417	2.483	10	0		DEAEHN
COc1ccc(C2CC(NCC(C)(C)S(C)(=O)=O)C2)cc1	ZINC000093520445	193263269	/nfs/dbraw/zinc/26/32/69/193263269.db2.gz	CEVJUCLPGXRJIM-UHFFFAOYSA-N	0	3	311.447	2.354	10	0		DEAEHN
NC(=O)[C@]1(N)CCC[C@@H]1CCSc1ccc(F)cc1F	ZINC000093627352	193276500	/nfs/dbraw/zinc/27/65/00/193276500.db2.gz	YFXKLOUXVGYQGL-OTYXRUKQSA-N	0	3	300.374	2.430	10	0		DEAEHN
NC(=O)[C@]1(N)CCC[C@@H](Sc2ccc(C(F)(F)F)cn2)C1	ZINC000093777634	193304726	/nfs/dbraw/zinc/30/47/26/193304726.db2.gz	XXJHPCPYGRAJQC-SKDRFNHKSA-N	0	3	319.352	2.318	10	0		DEAEHN
CCN[C@@]1(C(N)=O)CC[C@@H](Sc2nc3ccccc3[nH]2)C1	ZINC000093850324	193317531	/nfs/dbraw/zinc/31/75/31/193317531.db2.gz	HJLHYROCIYZNQX-BMIGLBTASA-N	0	3	304.419	2.041	10	0		DEAEHN
COc1ccccc1S[C@@H]1CC[C@@](NC2CC2)(C(N)=O)C1	ZINC000093851855	193318890	/nfs/dbraw/zinc/31/88/90/193318890.db2.gz	IFOUAXFZJRBZAN-WBMJQRKESA-N	0	3	306.431	2.316	10	0		DEAEHN
NC(=O)[C@@]1(NC2CC2)CC[C@@H](Sc2ncccc2Cl)C1	ZINC000093854117	193319562	/nfs/dbraw/zinc/31/95/62/193319562.db2.gz	JTUGHOBCIDXPEF-QMTHXVAHSA-N	0	3	311.838	2.356	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)s1)N(C)CCS(C)(=O)=O	ZINC000094297316	193356835	/nfs/dbraw/zinc/35/68/35/193356835.db2.gz	MDQQKFJOMJUFGX-BXKDBHETSA-N	0	3	324.899	2.156	10	0		DEAEHN
CN1CCC(Oc2nc(C(F)(F)F)ccc2C(N)=S)CC1	ZINC000094336376	193360825	/nfs/dbraw/zinc/36/08/25/193360825.db2.gz	TXPFQHBRXGRSFN-UHFFFAOYSA-N	0	3	319.352	2.208	10	0		DEAEHN
CCCCCNC(=O)[C@@H](C)Oc1c(F)cc(CN)cc1F	ZINC000094346198	193363091	/nfs/dbraw/zinc/36/30/91/193363091.db2.gz	ZAYDUJDNBBNKEU-SNVBAGLBSA-N	0	3	300.349	2.497	10	0		DEAEHN
CC(C)CNCc1cc(F)c(OCCS(C)(=O)=O)c(F)c1	ZINC000094347925	193363159	/nfs/dbraw/zinc/36/31/59/193363159.db2.gz	XPOAQWXXLSJIPY-UHFFFAOYSA-N	0	3	321.389	2.134	10	0		DEAEHN
CCNCc1cc(F)c(OCC(=O)N[C@@H](C)CC)c(F)c1	ZINC000094347055	193363671	/nfs/dbraw/zinc/36/36/71/193363671.db2.gz	FQJQOKSXMMLMPI-JTQLQIEISA-N	0	3	300.349	2.368	10	0		DEAEHN
CN[C@@H](c1ccc(Cl)c(Cl)c1)[C@H]1CN2CCN1CC2	ZINC000094508963	193375297	/nfs/dbraw/zinc/37/52/97/193375297.db2.gz	VIBCIXLMDJZSSP-KGLIPLIRSA-N	0	3	300.233	2.254	10	0		DEAEHN
CN1CCC[C@@H](CNc2nc3ccc(Br)cn3n2)C1	ZINC000094604854	193383556	/nfs/dbraw/zinc/38/35/56/193383556.db2.gz	OBMJHHOZMUNNBM-JTQLQIEISA-N	0	3	324.226	2.246	10	0		DEAEHN
CCN1CCC[C@H](Nc2nc3ccc(Br)cn3n2)C1	ZINC000094603783	193384258	/nfs/dbraw/zinc/38/42/58/193384258.db2.gz	WDUZTTPLFNBVED-NSHDSACASA-N	0	3	324.226	2.388	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@H]1NCc1ccc(Br)s1	ZINC000282449643	217003017	/nfs/dbraw/zinc/00/30/17/217003017.db2.gz	SJBURQKYJKTCJD-VXNVDRBHSA-N	0	3	303.225	2.267	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2ccccc2OC(F)(F)F)CCO1	ZINC000019230431	182108948	/nfs/dbraw/zinc/10/89/48/182108948.db2.gz	DAUMYULOVILZIK-PWSUYJOCSA-N	0	3	304.312	2.306	10	0		DEAEHN
C[C@@H](C(=O)Nc1c(Cl)cccc1Cl)N1CCNCC1	ZINC000020269994	182201739	/nfs/dbraw/zinc/20/17/39/182201739.db2.gz	BUGMDWREQWITRC-VIFPVBQESA-N	0	3	302.205	2.226	10	0		DEAEHN
COC(C)(C)CNCc1cnc2cnc(Br)cn12	ZINC000160070525	197383364	/nfs/dbraw/zinc/38/33/64/197383364.db2.gz	YIPOCQKPTWNWQW-UHFFFAOYSA-N	0	3	313.199	2.006	10	0		DEAEHN
O=C(Nc1cc(Cl)c(Cl)cc1Cl)[C@@H]1C[C@@H](O)CN1	ZINC000020434013	182217462	/nfs/dbraw/zinc/21/74/62/182217462.db2.gz	RAUWLOXWBXFHFD-FWOIEVBISA-N	0	3	309.580	2.308	10	0		DEAEHN
NC[C@@H](c1cccc(F)c1)N1CCN(c2nccs2)CC1	ZINC000021022962	182261388	/nfs/dbraw/zinc/26/13/88/182261388.db2.gz	QICBVXVFGNSQJH-AWEZNQCLSA-N	0	3	306.410	2.104	10	0		DEAEHN
Cc1ccccc1[C@@H](CN)N1CCN(c2nccs2)CC1	ZINC000021806759	182291106	/nfs/dbraw/zinc/29/11/06/182291106.db2.gz	OGGRWCPFKBCHCZ-OAHLLOKOSA-N	0	3	302.447	2.274	10	0		DEAEHN
CCc1oc(C(=O)N(CCN(C)C)C[C@@H]2CCCO2)cc1C	ZINC000155451796	291606202	/nfs/dbraw/zinc/60/62/02/291606202.db2.gz	BZSJLUAYFFSQPA-AWEZNQCLSA-N	0	3	308.422	2.333	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N(C)[C@H]2CCN(C(C)C)C2)c1	ZINC000457841039	248040986	/nfs/dbraw/zinc/04/09/86/248040986.db2.gz	HFISIQWIAOCERW-INIZCTEOSA-N	0	3	318.417	2.336	10	0		DEAEHN
Cc1cc(C)c(CN)c(Oc2ccc(S(C)(=O)=O)cc2)n1	ZINC000040509786	183086364	/nfs/dbraw/zinc/08/63/64/183086364.db2.gz	KMLCKNQVVSQEEQ-UHFFFAOYSA-N	0	3	306.387	2.353	10	0		DEAEHN
CCOC(=O)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1	ZINC000040615941	183109847	/nfs/dbraw/zinc/10/98/47/183109847.db2.gz	XXJBGYLFSVBYBU-INIZCTEOSA-N	0	3	318.417	2.139	10	0		DEAEHN
COCCCN(CCOC)[C@@H](CN)c1ccc(Cl)s1	ZINC000042420753	183267694	/nfs/dbraw/zinc/26/76/94/183267694.db2.gz	CKTICTONCAZAQU-NSHDSACASA-N	0	3	306.859	2.386	10	0		DEAEHN
COC[C@H](C)N(C)[C@@H](CN)c1cccc(Br)c1	ZINC000042517779	183279731	/nfs/dbraw/zinc/27/97/31/183279731.db2.gz	FOHWYGVBRPFPAF-GWCFXTLKSA-N	0	3	301.228	2.416	10	0		DEAEHN
CC[C@H](N)[C@@H](c1cccc(Cl)c1)N(C)CC(=O)NC1CC1	ZINC000043014406	183327753	/nfs/dbraw/zinc/32/77/53/183327753.db2.gz	SYLSHAJZKYEIAD-GOEBONIOSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@@H](N)[C@H](Oc1cccc(S(C)(=O)=O)c1)C(F)(F)F	ZINC000043385223	183357903	/nfs/dbraw/zinc/35/79/03/183357903.db2.gz	DAHNVFGACRWVEC-MNOVXSKESA-N	0	3	311.325	2.137	10	0		DEAEHN
CC[C@H](N)[C@@H](Oc1ccc(S(C)(=O)=O)cc1)C(F)(F)F	ZINC000043385211	183358162	/nfs/dbraw/zinc/35/81/62/183358162.db2.gz	WJGSMWSWCUCONZ-WDEREUQCSA-N	0	3	311.325	2.137	10	0		DEAEHN
NC1CN(C(=O)c2cc(C(F)(F)F)ccc2Br)C1	ZINC000159812205	197366468	/nfs/dbraw/zinc/36/64/68/197366468.db2.gz	IZMNRGYBERXCTN-UHFFFAOYSA-N	0	3	323.112	2.251	10	0		DEAEHN
COCCN(C)CCNC(=O)N(Cc1ccco1)C1CCCC1	ZINC000105233463	194088388	/nfs/dbraw/zinc/08/83/88/194088388.db2.gz	GUPIQNLLSBVSHN-UHFFFAOYSA-N	0	3	323.437	2.312	10	0		DEAEHN
Cc1occc1CN(C)C(=O)[C@H]1CCO[C@@H]1C1CCN(C)CC1	ZINC000284772252	218171329	/nfs/dbraw/zinc/17/13/29/218171329.db2.gz	ZLWZDGNAAALPNH-DLBZAZTESA-N	0	3	320.433	2.293	10	0		DEAEHN
Fc1cccc(OCCN2CCCC[C@H]2CN2CCOCC2)c1	ZINC000109821748	194289177	/nfs/dbraw/zinc/28/91/77/194289177.db2.gz	AUIGVGXZGBPZDM-KRWDZBQOSA-N	0	3	322.424	2.391	10	0		DEAEHN
O=c1ccccn1CCNCc1ccc(Br)cc1	ZINC000110056530	194307538	/nfs/dbraw/zinc/30/75/38/194307538.db2.gz	GDQAKWWUUXBMBR-UHFFFAOYSA-N	0	3	307.191	2.401	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1ccccc1COC	ZINC000110088922	194308915	/nfs/dbraw/zinc/30/89/15/194308915.db2.gz	SNCQCOUSSWFUAZ-HNNXBMFYSA-N	0	3	321.421	2.065	10	0		DEAEHN
CC1CCC2(CSC(NC[C@@H]3CCS(=O)(=O)C3)=N2)CC1	ZINC000053101437	183886991	/nfs/dbraw/zinc/88/69/91/183886991.db2.gz	DZMAYNJTSVROKF-LXVYMNJGSA-N	0	3	316.492	2.062	10	0		DEAEHN
C[C@@H]1Cc2ccccc2N(S(=O)(=O)C[C@@H]2CCCCN2)C1	ZINC000110389898	194326875	/nfs/dbraw/zinc/32/68/75/194326875.db2.gz	PPQZMOKGPXJXGS-HIFRSBDPSA-N	0	3	308.447	2.157	10	0		DEAEHN
CC[C@@H](N)[C@H](c1cccc(Cl)c1)N1CCNC(=O)[C@@H]1CC	ZINC000110677506	194349148	/nfs/dbraw/zinc/34/91/48/194349148.db2.gz	KOHYPDMHQAXYAM-ILXRZTDVSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@H]1CNCCN1c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000110678405	194349436	/nfs/dbraw/zinc/34/94/36/194349436.db2.gz	NKYRSVSBDQNKTP-JTQLQIEISA-N	0	3	322.352	2.168	10	0		DEAEHN
CN[C@H](C)c1ccc(C)cc1OCC(=O)NCC(F)(F)F	ZINC000110960313	194374622	/nfs/dbraw/zinc/37/46/22/194374622.db2.gz	IZZNHCNDEINCNT-SNVBAGLBSA-N	0	3	304.312	2.333	10	0		DEAEHN
CCOCCN(CC)c1ncc(Br)cc1CN	ZINC000111123581	194393290	/nfs/dbraw/zinc/39/32/90/194393290.db2.gz	BDOKPSZTXPHKSZ-UHFFFAOYSA-N	0	3	302.216	2.166	10	0		DEAEHN
CN(CC(=O)Nc1ccc(N)cc1Cl)CC1CCOCC1	ZINC000111156382	194396804	/nfs/dbraw/zinc/39/68/04/194396804.db2.gz	WOOHVIQSGCTEKE-UHFFFAOYSA-N	0	3	311.813	2.219	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)NCc1cccnc1	ZINC000057205843	184029738	/nfs/dbraw/zinc/02/97/38/184029738.db2.gz	PJNCMDUHZDOZEA-KRWDZBQOSA-N	0	3	312.417	2.054	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCO[C@H](c3ccccc3)C2)C1	ZINC000057869764	184059841	/nfs/dbraw/zinc/05/98/41/184059841.db2.gz	SXDRHRNSAINFNJ-SJORKVTESA-N	0	3	317.433	2.254	10	0		DEAEHN
O=C(NCCNc1ccncc1)NC[C@H]1CCCc2ccccc21	ZINC000535259935	284888616	/nfs/dbraw/zinc/88/86/16/284888616.db2.gz	GAPZRVRZZRYBHR-MRXNPFEDSA-N	0	3	324.428	2.335	10	0		DEAEHN
c1nc2ncnc(N[C@H]3CCCN(Cc4ccccc4)C3)c2[nH]1	ZINC000059386709	184137646	/nfs/dbraw/zinc/13/76/46/184137646.db2.gz	ZZUWXRIKRNRVQO-AWEZNQCLSA-N	0	3	308.389	2.429	10	0		DEAEHN
Cc1cc([N-]S(=O)(=O)c2ccc(CC[NH3+])cc2)ccc1F	ZINC000061121055	184162440	/nfs/dbraw/zinc/16/24/40/184162440.db2.gz	JSOHWAVVBPEDQT-UHFFFAOYSA-N	0	3	308.378	2.436	10	0		DEAEHN
CCOc1ccc(CC(=O)N2CCCN(C3CC3)CC2)cc1	ZINC000061605706	184177545	/nfs/dbraw/zinc/17/75/45/184177545.db2.gz	BYLTYOVMDBXGIB-UHFFFAOYSA-N	0	3	302.418	2.325	10	0		DEAEHN
O[C@@H]1CCN(c2cc(Br)ccc2CNC2CC2)C1	ZINC000061711265	184184913	/nfs/dbraw/zinc/18/49/13/184184913.db2.gz	ANBCHVHGHNMQRF-CYBMUJFWSA-N	0	3	311.223	2.272	10	0		DEAEHN
Cc1ccc(F)cc1S(=O)(=O)NCc1ccccc1CN	ZINC000061841356	184189288	/nfs/dbraw/zinc/18/92/88/184189288.db2.gz	ZOKUCLOVJUHIHS-UHFFFAOYSA-N	0	3	308.378	2.071	10	0		DEAEHN
Cc1cc(N[C@@H]2CCN(C3CC3)C2)ccc1NS(C)(=O)=O	ZINC000061982610	184199660	/nfs/dbraw/zinc/19/96/60/184199660.db2.gz	IRHGSGSYIQSPAF-CYBMUJFWSA-N	0	3	309.435	2.015	10	0		DEAEHN
C[C@H](c1ccccc1Cl)N(C)C(=O)[C@H](C)N1CCNCC1	ZINC000062028184	184202273	/nfs/dbraw/zinc/20/22/73/184202273.db2.gz	NVXFJIJOBXMQLB-OLZOCXBDSA-N	0	3	309.841	2.153	10	0		DEAEHN
C[C@H](Cc1ccccc1)NC(=O)c1c[nH]c(=NN)c(Cl)c1	ZINC000062192166	184218428	/nfs/dbraw/zinc/21/84/28/184218428.db2.gz	WQRXREFLPWJHFE-SNVBAGLBSA-N	0	3	304.781	2.382	10	0		DEAEHN
COCCN1C(=O)C[C@H](N)[C@H]1c1ccc(Cl)cc1Cl	ZINC000062210255	184220852	/nfs/dbraw/zinc/22/08/52/184220852.db2.gz	SYVQMSYSVBMYKP-WCQYABFASA-N	0	3	303.189	2.241	10	0		DEAEHN
COCCNCc1c(N(C)[C@@H](C)C2CC2)nc2sccn12	ZINC000062735989	184251078	/nfs/dbraw/zinc/25/10/78/184251078.db2.gz	BOTYVCCQCZMLJH-NSHDSACASA-N	0	3	308.451	2.367	10	0		DEAEHN
COCCNCc1c(N2C[C@H]3CC[C@@H]2C3)nc2sccn12	ZINC000062737446	184252032	/nfs/dbraw/zinc/25/20/32/184252032.db2.gz	OPZFFBNJQKWMFY-NWDGAFQWSA-N	0	3	306.435	2.121	10	0		DEAEHN
CCC1(C)CCN(S(=O)(=O)Cc2ccccc2CN)CC1	ZINC000062955456	184262348	/nfs/dbraw/zinc/26/23/48/184262348.db2.gz	SYFRNUNRYXLUOF-UHFFFAOYSA-N	0	3	310.463	2.487	10	0		DEAEHN
N[C@H](CNC(=O)c1cc(Br)c[nH]1)c1ccccc1	ZINC000062837853	184255533	/nfs/dbraw/zinc/25/55/33/184255533.db2.gz	KFMGLWNGIPGZNB-LLVKDONJSA-N	0	3	308.179	2.207	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2cc(C(F)(F)F)ccc2F)C1	ZINC000062657510	184246863	/nfs/dbraw/zinc/24/68/63/184246863.db2.gz	AWAJJOJSNMBJOZ-LDYMZIIASA-N	0	3	306.259	2.160	10	0		DEAEHN
[NH3+][C@@H]1CCCCC[C@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1F	ZINC000063213792	184278836	/nfs/dbraw/zinc/27/88/36/184278836.db2.gz	SITMCBBSDCISDH-VXGBXAGGSA-N	0	3	320.817	2.417	10	0		DEAEHN
COC(=O)N[C@H](CC(C)C)C(=O)Nc1cccc(CN(C)C)c1	ZINC000063289848	184280209	/nfs/dbraw/zinc/28/02/09/184280209.db2.gz	VVLDYFHAXVVGNS-OAHLLOKOSA-N	0	3	321.421	2.457	10	0		DEAEHN
Clc1nc(Cl)nc(N2CC[C@@H](N3CCCCC3)C2)n1	ZINC000062983401	184264173	/nfs/dbraw/zinc/26/41/73/184264173.db2.gz	MZEFYMUIZMNHID-SECBINFHSA-N	0	3	302.209	2.243	10	0		DEAEHN
CN[C@H](C)c1cccc(S(=O)(=O)NCCC(F)(F)F)c1	ZINC000063101544	184271188	/nfs/dbraw/zinc/27/11/88/184271188.db2.gz	NXZGBNNHGOLDBG-SECBINFHSA-N	0	3	310.341	2.198	10	0		DEAEHN
CS(=O)(=O)c1ccc(SCc2cccnc2CN)cc1	ZINC000063131527	184272163	/nfs/dbraw/zinc/27/21/63/184272163.db2.gz	CEHNSBBQWPYCTD-UHFFFAOYSA-N	0	3	308.428	2.236	10	0		DEAEHN
CC1CCC(CNS(=O)(=O)Cc2ccccc2CN)CC1	ZINC000063146006	184273565	/nfs/dbraw/zinc/27/35/65/184273565.db2.gz	ZGCLJWTXWYUGGQ-UHFFFAOYSA-N	0	3	310.463	2.391	10	0		DEAEHN
CC[NH2+][C@@H](C)c1ccccc1[N-]S(=O)(=O)C[C@@H]1CCCO1	ZINC000063155743	184274794	/nfs/dbraw/zinc/27/47/94/184274794.db2.gz	COQQGIATUQZSGD-STQMWFEESA-N	0	3	312.435	2.278	10	0		DEAEHN
[NH3+][C@H]1CCC[C@@H]1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000063174856	184276335	/nfs/dbraw/zinc/27/63/35/184276335.db2.gz	YFYQHLPXPVNWFL-QWRGUYRKSA-N	0	3	309.218	2.152	10	0		DEAEHN
CCCNc1nc(CCN(C)C)nc(C)c1Br	ZINC000158737756	197297664	/nfs/dbraw/zinc/29/76/64/197297664.db2.gz	YUOCNYQHEBTCPH-UHFFFAOYSA-N	0	3	301.232	2.474	10	0		DEAEHN
COC(=O)c1ccc(C)c(NC(=O)[C@@H](C)N[C@H](C)[C@H](C)OC)c1	ZINC000555121645	291787149	/nfs/dbraw/zinc/78/71/49/291787149.db2.gz	GRSOEBHIBXDTPS-UPJWGTAASA-N	0	3	322.405	2.122	10	0		DEAEHN
O=C(NCCNc1ccncc1)c1coc(-c2ccccc2)n1	ZINC000536017488	284929355	/nfs/dbraw/zinc/92/93/55/284929355.db2.gz	KDMGMNPGVSLFLF-UHFFFAOYSA-N	0	3	308.341	2.000	10	0		DEAEHN
O=C1CCN(CCCOc2cccc(C(F)(F)F)c2)CCN1	ZINC000065954586	184383550	/nfs/dbraw/zinc/38/35/50/184383550.db2.gz	QDIUCMSHLXWZPN-UHFFFAOYSA-N	0	3	316.323	2.296	10	0		DEAEHN
CNC(=O)c1cccc(C(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000185420690	207365499	/nfs/dbraw/zinc/36/54/99/207365499.db2.gz	MYVFTSZPIRWUMK-AWEZNQCLSA-N	0	3	317.433	2.041	10	0		DEAEHN
C[C@H](CNC(=O)N1CCO[C@@H](c2cccs2)C1)N(C)C1CC1	ZINC000120166192	195110672	/nfs/dbraw/zinc/11/06/72/195110672.db2.gz	QKKLIMBQFRXJOM-TZMCWYRMSA-N	0	3	323.462	2.314	10	0		DEAEHN
c1nc(N2CCCC2)ncc1CN1CCC[C@H]([C@H]2CCOC2)C1	ZINC000539893987	285098805	/nfs/dbraw/zinc/09/88/05/285098805.db2.gz	FGHLSVQITHZTID-IRXDYDNUSA-N	0	3	316.449	2.325	10	0		DEAEHN
CCNC(=O)N1CC[C@H](N[C@H](C)c2ccc(C)cc2OC)C1	ZINC000540157915	285111493	/nfs/dbraw/zinc/11/14/93/285111493.db2.gz	OPACUKRYSOMCEQ-KGLIPLIRSA-N	0	3	305.422	2.458	10	0		DEAEHN
CC(C)NC(=O)[C@H](CN)Cc1cc(F)cc(C(F)(F)F)c1	ZINC000159198490	197335217	/nfs/dbraw/zinc/33/52/17/197335217.db2.gz	ANUQBUPVSFFWFI-JTQLQIEISA-N	0	3	306.303	2.487	10	0		DEAEHN
C[C@@H]([C@@H](O)c1c(Br)cnn1CCN(C)C)C1CC1	ZINC000158856495	197306109	/nfs/dbraw/zinc/30/61/09/197306109.db2.gz	AURLOYXPMFCPMH-NOZJJQNGSA-N	0	3	316.243	2.287	10	0		DEAEHN
CCN[C@@H](c1c(Br)cnn1CCOC)C1CC1	ZINC000158769387	197300006	/nfs/dbraw/zinc/30/00/06/197300006.db2.gz	OGOBYJRHBUYYJC-LLVKDONJSA-N	0	3	302.216	2.353	10	0		DEAEHN
NCc1cc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)ccc1Cl	ZINC000158757799	197299244	/nfs/dbraw/zinc/29/92/44/197299244.db2.gz	XFCKWHDQTRNYHT-GHMZBOCLSA-N	0	3	314.838	2.219	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)ccc1C	ZINC000158749350	197298433	/nfs/dbraw/zinc/29/84/33/197298433.db2.gz	OQVPGZATQRNVNC-OKILXGFUSA-N	0	3	308.447	2.135	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)c1ccc(F)cc1)[C@H]1CCOC1	ZINC000158729327	197296975	/nfs/dbraw/zinc/29/69/75/197296975.db2.gz	GHWDWXUVYDESIX-WFASDCNBSA-N	0	3	315.410	2.004	10	0		DEAEHN
CN1CC[C@@H](n2c(N)nc3cc(F)c(Br)cc32)C1	ZINC000158385768	197267417	/nfs/dbraw/zinc/26/74/17/197267417.db2.gz	ORXYSKVZJVWMKX-SSDOTTSWSA-N	0	3	313.174	2.397	10	0		DEAEHN
[NH3+]Cc1cc(C(F)(F)F)ccc1[N-]S(=O)(=O)CC1CC1	ZINC000158317759	197261357	/nfs/dbraw/zinc/26/13/57/197261357.db2.gz	LYTFLDPNRYAIPR-UHFFFAOYSA-N	0	3	308.325	2.316	10	0		DEAEHN
NCc1cc(C(F)(F)F)ccc1NS(=O)(=O)CC1CC1	ZINC000158317759	197261358	/nfs/dbraw/zinc/26/13/58/197261358.db2.gz	LYTFLDPNRYAIPR-UHFFFAOYSA-N	0	3	308.325	2.316	10	0		DEAEHN
CCS(=O)(=O)NCCN[C@H](C)c1ccc(CC(C)C)cc1	ZINC000158306512	197260981	/nfs/dbraw/zinc/26/09/81/197260981.db2.gz	IDBZOSKGBVRMMF-CQSZACIVSA-N	0	3	312.479	2.475	10	0		DEAEHN
CC(C)(C)[C@@H](N)C(=O)Nc1cc(Cl)ccc1-n1cncn1	ZINC000158241730	197255716	/nfs/dbraw/zinc/25/57/16/197255716.db2.gz	USPVPZZEEWMOTJ-LBPRGKRZSA-N	0	3	307.785	2.233	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2ccccc2O[C@H]2CCOC2)C1	ZINC000120300420	195138860	/nfs/dbraw/zinc/13/88/60/195138860.db2.gz	NUPYAMOTQOQFTL-KGLIPLIRSA-N	0	3	319.405	2.022	10	0		DEAEHN
CCO[C@H]1C[C@](N)(C(=O)NCCCCC(F)(F)F)C1(C)C	ZINC000157513137	197192798	/nfs/dbraw/zinc/19/27/98/197192798.db2.gz	ZDFUTQLWRFUVPE-GWCFXTLKSA-N	0	3	310.360	2.368	10	0		DEAEHN
CCCN[C@H](Cc1ccc(OC)c(F)c1)[C@@H](C)S(C)(=O)=O	ZINC000157283867	197176698	/nfs/dbraw/zinc/17/66/98/197176698.db2.gz	GVYJRDSVVTZKHW-BXUZGUMPSA-N	0	3	317.426	2.178	10	0		DEAEHN
CC(C)OCCN(C)CCCOc1cccc(C(N)=S)c1	ZINC000157255164	197174641	/nfs/dbraw/zinc/17/46/41/197174641.db2.gz	KOHITLYPZRDQEM-UHFFFAOYSA-N	0	3	310.463	2.447	10	0		DEAEHN
CCCNc1nnc(CN2C[C@H]3CCCCN3C[C@@H]2C)s1	ZINC000157056923	197158823	/nfs/dbraw/zinc/15/88/23/197158823.db2.gz	UWHZFBBDZXPFRG-QWHCGFSZSA-N	0	3	309.483	2.419	10	0		DEAEHN
c1csc(N2CCN(Cc3ccc4c(c3)CNC4)CC2)n1	ZINC000156655792	197131448	/nfs/dbraw/zinc/13/14/48/197131448.db2.gz	XFWBSWKXCBMVCK-UHFFFAOYSA-N	0	3	300.431	2.069	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cccc(F)c2Br)C1	ZINC000156584007	197125588	/nfs/dbraw/zinc/12/55/88/197125588.db2.gz	ALZFUACUXVNZIH-VIFPVBQESA-N	0	3	315.186	2.364	10	0		DEAEHN
CN(C)c1nc(CN2CCN(CCC(C)(C)C)CC2)ns1	ZINC000156289011	197101689	/nfs/dbraw/zinc/10/16/89/197101689.db2.gz	REDNDLJHMHMPFY-UHFFFAOYSA-N	0	3	311.499	2.158	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)N[C@H]1CCCC[C@H]1C	ZINC000245458710	285241775	/nfs/dbraw/zinc/24/17/75/285241775.db2.gz	CZXFOYCTTSIBAQ-VQHPVUNQSA-N	0	3	309.498	2.486	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)Cc2cccc(N(C)C)c2)C1	ZINC000151451189	285265100	/nfs/dbraw/zinc/26/51/00/285265100.db2.gz	AVICVABQRDGQNC-INIZCTEOSA-N	0	3	318.465	2.378	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1F	ZINC000120580152	195195381	/nfs/dbraw/zinc/19/53/81/195195381.db2.gz	GVMSAQUFLBMQMC-OCCSQVGLSA-N	0	3	321.396	2.014	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc(NC(C)=O)cc2)CCN1CCOC	ZINC000120935025	195267352	/nfs/dbraw/zinc/26/73/52/195267352.db2.gz	ZFNJTMIWAKVMFE-GOSISDBHSA-N	0	3	319.449	2.188	10	0		DEAEHN
c1ccc(OC2CC2)c(CN2CCN(C[C@@H]3CCOC3)CC2)c1	ZINC000289978429	221356354	/nfs/dbraw/zinc/35/63/54/221356354.db2.gz	JNGVUVULKKJLBB-INIZCTEOSA-N	0	3	316.445	2.382	10	0		DEAEHN
O=C1C[C@@H]2[C@H](CCN2Cc2cccs2)N1CC1CCOCC1	ZINC000248002647	257111936	/nfs/dbraw/zinc/11/19/36/257111936.db2.gz	RNWDTCJJAUYQOI-JKSUJKDBSA-N	0	3	320.458	2.350	10	0		DEAEHN
COc1ccc(CN2C[C@@H]3CN(c4cccnc4)C(=O)[C@@H]3C2)cc1	ZINC000247902600	257115422	/nfs/dbraw/zinc/11/54/22/257115422.db2.gz	RHLCINPIWZPGFK-CRAIPNDOSA-N	0	3	323.396	2.185	10	0		DEAEHN
O=C([C@@H]1CN(Cc2ccsc2)C[C@@H]2OCC[C@@H]21)N1CCCC1	ZINC000247795836	257116974	/nfs/dbraw/zinc/11/69/74/257116974.db2.gz	RDCPTJIUZLBWMQ-OAGGEKHMSA-N	0	3	320.458	2.207	10	0		DEAEHN
Cc1ccsc1CN1C[C@@H]2OC[C@H](CN3CCCC3=O)[C@@H]2C1	ZINC000253599839	257104383	/nfs/dbraw/zinc/10/43/83/257104383.db2.gz	VHHTZTVGWSEESK-KKUMJFAQSA-N	0	3	320.458	2.126	10	0		DEAEHN
Cc1ccsc1CN1CCCN(Cc2cnn(C)c2)CC1	ZINC000121564201	195307081	/nfs/dbraw/zinc/30/70/81/195307081.db2.gz	TUZHNJZOMJDWNO-UHFFFAOYSA-N	0	3	304.463	2.498	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1CCC(Cc2nccn2C)CC1	ZINC000121908356	195372464	/nfs/dbraw/zinc/37/24/64/195372464.db2.gz	BZMXXSQVGAMYCJ-MRXNPFEDSA-N	0	3	318.465	2.076	10	0		DEAEHN
COc1ccc(C#N)cc1CN1CCC[C@H](CC(N)=O)CC1	ZINC000299746213	533269341	/nfs/dbraw/zinc/26/93/41/533269341.db2.gz	VUOQVNNSEAKYNO-ZDUSSCGKSA-N	0	3	301.390	2.044	10	0		DEAEHN
C[C@@H]1CCC[C@H](NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)[C@@H]1C	ZINC000262534885	296484765	/nfs/dbraw/zinc/48/47/65/296484765.db2.gz	QFDVHGYPMUONGC-DEHPNPAASA-N	0	3	308.466	2.460	10	0		DEAEHN
COc1cccc(F)c1[C@H](C)NC(=O)NC[C@@H]1CCCN1C	ZINC000174355551	132508697	/nfs/dbraw/zinc/50/86/97/132508697.db2.gz	DZUNFBSJBVBVJM-RYUDHWBXSA-N	0	3	309.385	2.289	10	0		DEAEHN
c1ccc(OCCOCCN2CCN(C3CCC3)CC2)cc1	ZINC000355327568	133017554	/nfs/dbraw/zinc/01/75/54/133017554.db2.gz	CZIAOMMTOJLCQN-UHFFFAOYSA-N	0	3	304.434	2.252	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)NCc1ccc2cc[nH]c2n1	ZINC000357796934	133100552	/nfs/dbraw/zinc/10/05/52/133100552.db2.gz	IVRBQKRFCWAXDP-OAHLLOKOSA-N	0	3	315.421	2.237	10	0		DEAEHN
COC[C@H](CC(C)C)NCc1cccc(N2CCOCC2)n1	ZINC000360005866	133156848	/nfs/dbraw/zinc/15/68/48/133156848.db2.gz	HMOIPORGCYVWMZ-INIZCTEOSA-N	0	3	307.438	2.069	10	0		DEAEHN
C[C@H]1CCOCCN1C[C@@H](O)COc1cccc2[nH]ccc21	ZINC000362235385	133218692	/nfs/dbraw/zinc/21/86/92/133218692.db2.gz	KMMBHCKRMJESEH-UONOGXRCSA-N	0	3	304.390	2.018	10	0		DEAEHN
COC(=O)CN(C)C(=O)CCN1CC[C@@H](C)C[C@@H]1c1ccco1	ZINC000362462646	133231882	/nfs/dbraw/zinc/23/18/82/133231882.db2.gz	GWPWPICEGALJDU-ZIAGYGMSSA-N	0	3	322.405	2.074	10	0		DEAEHN
c1nc2c([nH]1)C[C@@H](NCc1cnc([C@@H]3CCCO3)s1)CC2	ZINC000368258167	133266870	/nfs/dbraw/zinc/26/68/70/133266870.db2.gz	IYHMZRVRQWUCRA-HZMBPMFUSA-N	0	3	304.419	2.365	10	0		DEAEHN
CC(=O)N1CC[C@@H](N[C@@H]2C=C[C@H](CO)C2)c2ccc(F)cc2C1	ZINC000368402917	133272252	/nfs/dbraw/zinc/27/22/52/133272252.db2.gz	OVYMSQSGPXSUGG-FDQGKXFDSA-N	0	3	318.392	2.146	10	0		DEAEHN
Cc1ccc([C@@H]2CCCN2C[C@@H](O)COC2CCOCC2)o1	ZINC000368549490	133277612	/nfs/dbraw/zinc/27/76/12/133277612.db2.gz	QCRYAFWYURYLBX-ZBFHGGJFSA-N	0	3	309.406	2.281	10	0		DEAEHN
Cc1cc(CCNC(=O)[C@@H]2CCCCN2C2CCCC2)on1	ZINC000376392004	133292907	/nfs/dbraw/zinc/29/29/07/133292907.db2.gz	PNWWLGCHSROMRG-INIZCTEOSA-N	0	3	305.422	2.439	10	0		DEAEHN
C(N[C@@H]1CCC[C@H]([C@@H]2CCOC2)C1)c1nnc2n1CCCC2	ZINC000547397039	285571142	/nfs/dbraw/zinc/57/11/42/285571142.db2.gz	CLANFBNGDVIXST-RRFJBIMHSA-N	0	3	304.438	2.299	10	0		DEAEHN
C[C@@H]1CCC[C@@H]1C(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000344986520	404485072	/nfs/dbraw/zinc/48/50/72/404485072.db2.gz	DFNRXBFXIOPFSI-AYBZRNKSSA-N	0	3	316.445	2.176	10	0		DEAEHN
O=C(NCCCOC1CCCCC1)N1CC[C@@H](N2CC=CC2)C1	ZINC000173542799	144844189	/nfs/dbraw/zinc/84/41/89/144844189.db2.gz	SBJKUNKRGKGQQF-MRXNPFEDSA-N	0	3	321.465	2.382	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCc2c(cccc2NC(C)=O)C1)N(C)C	ZINC000178651155	144862559	/nfs/dbraw/zinc/86/25/59/144862559.db2.gz	WVHBVZXSTPIGLP-KRWDZBQOSA-N	0	3	317.433	2.260	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N(C)[C@H](CO)CC(C)C	ZINC000188407300	145011765	/nfs/dbraw/zinc/01/17/65/145011765.db2.gz	MEEPDLZHKCQGPY-CABCVRRESA-N	0	3	301.475	2.011	10	0		DEAEHN
CC(C)C[C@@H](CO)N(C)C(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000188534893	145013362	/nfs/dbraw/zinc/01/33/62/145013362.db2.gz	GUBXVEZLMHASEW-HOTGVXAUSA-N	0	3	313.486	2.155	10	0		DEAEHN
CCCCCCNC(=O)CN1CCC(c2nnc(CC)[nH]2)CC1	ZINC000190714019	145047229	/nfs/dbraw/zinc/04/72/29/145047229.db2.gz	OEOTYVIUYJROMS-UHFFFAOYSA-N	0	3	321.469	2.243	10	0		DEAEHN
O[C@@H](CC1CCCC1)CN1CCC[C@H](c2nnc3n2CCC3)C1	ZINC000191343514	145056320	/nfs/dbraw/zinc/05/63/20/145056320.db2.gz	LFFOJPDEFVOUGB-HOTGVXAUSA-N	0	3	318.465	2.345	10	0		DEAEHN
C[C@H]1CN(CCN2CCC(Oc3ccc(F)cc3)CC2)CCO1	ZINC000191496587	145059721	/nfs/dbraw/zinc/05/97/21/145059721.db2.gz	IBUACMZEOVIPOL-HNNXBMFYSA-N	0	3	322.424	2.390	10	0		DEAEHN
C[C@H](N)[C@H](C)C(=O)/N=c1/sccn1Cc1ccccc1F	ZINC000192086082	145070725	/nfs/dbraw/zinc/07/07/25/145070725.db2.gz	TTWJYBOBNMWVCD-JUIQWEOTSA-N	0	3	307.394	2.148	10	0		DEAEHN
C[C@H](N[C@@H](C)[C@@H]1CCCO1)C(=O)NCCc1ccc(F)cc1	ZINC000193128663	145083040	/nfs/dbraw/zinc/08/30/40/145083040.db2.gz	WMHQSRWFQYLASL-XEZPLFJOSA-N	0	3	308.397	2.030	10	0		DEAEHN
C[C@@H]1CN(CCOc2cccc(Cl)c2)C[C@H]1N1CCOCC1	ZINC000246129218	145093166	/nfs/dbraw/zinc/09/31/66/145093166.db2.gz	MCXNOXXKJRFKSP-RHSMWYFYSA-N	0	3	324.852	2.371	10	0		DEAEHN
CCCCO[C@@H]1C[C@@H](NC(=O)N2CC[C@@H](N(C)C)C2)C1(C)C	ZINC000246322544	145098595	/nfs/dbraw/zinc/09/85/95/145098595.db2.gz	AQQDGKZZDPUTRK-RBSFLKMASA-N	0	3	311.470	2.316	10	0		DEAEHN
C[C@H](C(=O)NCc1ccccc1F)N1CC[C@@H]2OCCC[C@H]2C1	ZINC000246445689	145103052	/nfs/dbraw/zinc/10/30/52/145103052.db2.gz	BOZHSDIPLNHNGB-KMFMINBZSA-N	0	3	320.408	2.331	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCO[C@@H](c2cccs2)C1	ZINC000246652619	145109537	/nfs/dbraw/zinc/10/95/37/145109537.db2.gz	CRTULYPVQFNUNX-UONOGXRCSA-N	0	3	323.462	2.315	10	0		DEAEHN
CC(C)[C@@H]1CN(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)CCS1	ZINC000246805645	145115277	/nfs/dbraw/zinc/11/52/77/145115277.db2.gz	DDTAEIJBEMPIPY-ZNMIVQPWSA-N	0	3	313.511	2.498	10	0		DEAEHN
C[C@@H](C(=O)NC1CCCC1)N1CCC[C@@H](Cc2nccn2C)C1	ZINC000247318347	145133583	/nfs/dbraw/zinc/13/35/83/145133583.db2.gz	SBLJJZQPXMPCOL-GJZGRUSLSA-N	0	3	318.465	2.122	10	0		DEAEHN
C[C@H](O)CN1CCN(CCOc2ccccc2Cl)C[C@H]1C	ZINC000247399412	145135957	/nfs/dbraw/zinc/13/59/57/145135957.db2.gz	YGPBEDOPPVYSSS-KGLIPLIRSA-N	0	3	312.841	2.106	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1OCCNC(=O)N1CCN2CCC[C@H]2C1	ZINC000247473157	145138527	/nfs/dbraw/zinc/13/85/27/145138527.db2.gz	HOVGJAWRFSTUOY-PMPSAXMXSA-N	0	3	309.454	2.071	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H]1CCC[C@@H]2OCC[C@H]21	ZINC000247476672	145138562	/nfs/dbraw/zinc/13/85/62/145138562.db2.gz	QRAHPYPTIHYENE-QXSJWSMHSA-N	0	3	309.454	2.070	10	0		DEAEHN
Cc1ccc(C)c(OCC(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000247508149	145139778	/nfs/dbraw/zinc/13/97/78/145139778.db2.gz	VOLPSUIDEIXMCM-HZPDHXFCSA-N	0	3	302.418	2.377	10	0		DEAEHN
CCOc1ccccc1CN1CCN(C[C@H](C)O)[C@H](CC)C1	ZINC000247543398	145141041	/nfs/dbraw/zinc/14/10/41/145141041.db2.gz	DEYLVEJEMGSQSN-DOTOQJQBSA-N	0	3	306.450	2.362	10	0		DEAEHN
c1ccc(-c2noc(CCN3CCN4CCCC[C@H]4C3)n2)cc1	ZINC000248344451	145151436	/nfs/dbraw/zinc/15/14/36/145151436.db2.gz	LPEGRMYXURNBCI-INIZCTEOSA-N	0	3	312.417	2.449	10	0		DEAEHN
CCN(C[C@H]1CCN(C[C@@H](O)C(F)(F)F)C1)CC(F)(F)F	ZINC000248393432	145152392	/nfs/dbraw/zinc/15/23/92/145152392.db2.gz	LSRMXCXLMRLMES-NXEZZACHSA-N	0	3	322.293	2.116	10	0		DEAEHN
CC[C@@H]1CN(CCCOCc2ccccc2)CCN1C[C@H](C)O	ZINC000248603967	145160640	/nfs/dbraw/zinc/16/06/40/145160640.db2.gz	VUZVYSALAWFXKY-PKOBYXMFSA-N	0	3	320.477	2.370	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccncc1	ZINC000248712651	145165077	/nfs/dbraw/zinc/16/50/77/145165077.db2.gz	BMKVAHZTCCUNLQ-MAUKXSAKSA-N	0	3	309.413	2.261	10	0		DEAEHN
CC1(C)CN(C[C@@H](O)Cn2cccn2)CC[C@H]1C(F)(F)F	ZINC000248814823	145168704	/nfs/dbraw/zinc/16/87/04/145168704.db2.gz	UDCRNWFVAXNHAN-VXGBXAGGSA-N	0	3	305.344	2.154	10	0		DEAEHN
O[C@@H](CC1CCCC1)CN1CCC[C@@H](c2nnc3n2CCC3)C1	ZINC000248902785	145172703	/nfs/dbraw/zinc/17/27/03/145172703.db2.gz	LFFOJPDEFVOUGB-CVEARBPZSA-N	0	3	318.465	2.345	10	0		DEAEHN
CCCn1cc(CN2CCCN(C[C@H]3CCC=CO3)CC2)cn1	ZINC000249039644	145176472	/nfs/dbraw/zinc/17/64/72/145176472.db2.gz	UJHZNANHUUDKNG-GOSISDBHSA-N	0	3	318.465	2.494	10	0		DEAEHN
OC[C@@H]1CN(C[C@H](O)CC(F)(F)F)C[C@@H]1c1ccsc1	ZINC000249291231	145182056	/nfs/dbraw/zinc/18/20/56/145182056.db2.gz	MLBHCSRYNGZJRI-QJPTWQEYSA-N	0	3	309.353	2.069	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC[C@H]2c2cccn2C)C1	ZINC000249772098	145189985	/nfs/dbraw/zinc/18/99/85/145189985.db2.gz	SYXDYXDBBBWGAP-ZBFHGGJFSA-N	0	3	304.438	2.356	10	0		DEAEHN
CCn1cnnc1[C@H]1CCCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000249894316	145192037	/nfs/dbraw/zinc/19/20/37/145192037.db2.gz	REXNIQCIEHZVOL-GOEBONIOSA-N	0	3	318.396	2.350	10	0		DEAEHN
COc1ccccc1[C@H]1CNCCN1Cc1noc(C(C)C)n1	ZINC000261601325	145209217	/nfs/dbraw/zinc/20/92/17/145209217.db2.gz	AHWKAHWWTIMALY-CQSZACIVSA-N	0	3	316.405	2.348	10	0		DEAEHN
C[C@H](NC(=O)[C@H](N)C1CCOCC1)c1ccc2c(c1)CCCC2	ZINC000261796764	145227302	/nfs/dbraw/zinc/22/73/02/145227302.db2.gz	NWWDZHZUOWFTDL-SCLBCKFNSA-N	0	3	316.445	2.497	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)NCc1ccc(F)c(F)c1	ZINC000261878066	145236635	/nfs/dbraw/zinc/23/66/35/145236635.db2.gz	MEAJIYSNQHUMPH-ZLENFMNRSA-N	0	3	324.371	2.114	10	0		DEAEHN
CCc1ccc(NC(=O)CN2CCNC[C@@H]2c2cccnc2)cc1	ZINC000261890632	145237852	/nfs/dbraw/zinc/23/78/52/145237852.db2.gz	ZPFSOUXQRXIXGM-GOSISDBHSA-N	0	3	324.428	2.229	10	0		DEAEHN
CCN(CC)c1ccc(N[C@@H]2CCC[C@@H]2[C@H]2COCCN2)cn1	ZINC000261894341	145238513	/nfs/dbraw/zinc/23/85/13/145238513.db2.gz	GYMFVIRCDLZNPQ-GVDBMIGSSA-N	0	3	318.465	2.497	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)Nc1ccc(F)cc1F	ZINC000262498276	145288191	/nfs/dbraw/zinc/28/81/91/145288191.db2.gz	LSHAECINLLVCCZ-ZXIHIIQKSA-N	0	3	310.344	2.436	10	0		DEAEHN
COc1cc(-c2noc([C@@H]3C[C@H]4CCCC[C@@H]4N3)n2)ncn1	ZINC000262516591	145289640	/nfs/dbraw/zinc/28/96/40/145289640.db2.gz	NPWRDKKULXRKJY-SCVCMEIPSA-N	0	3	301.350	2.128	10	0		DEAEHN
CN(Cc1ccc2c(c1)OCO2)C(=O)[C@H]1NCCCC1(C)C	ZINC000262518175	145289889	/nfs/dbraw/zinc/28/98/89/145289889.db2.gz	NTWRYWJLYKNEMT-OAHLLOKOSA-N	0	3	304.390	2.152	10	0		DEAEHN
CN(CCc1cccs1)C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C	ZINC000262575841	145294258	/nfs/dbraw/zinc/29/42/58/145294258.db2.gz	YDDCRIQRWJSAOU-CKEIUWERSA-N	0	3	322.474	2.282	10	0		DEAEHN
COc1ccccc1[C@@H](C)Cc1nc([C@@H]2CNCCN2C)no1	ZINC000263134814	145328432	/nfs/dbraw/zinc/32/84/32/145328432.db2.gz	BYPHWRUWFIKEJZ-JSGCOSHPSA-N	0	3	316.405	2.001	10	0		DEAEHN
C[C@H](C(=O)NC1CCC(C)CC1)N1CCC[C@H](c2nc[nH]n2)C1	ZINC000332962602	145392928	/nfs/dbraw/zinc/39/29/28/145392928.db2.gz	ICPVGODTCRQYIM-FUUBYGMNSA-N	0	3	319.453	2.068	10	0		DEAEHN
C[C@@H](NC(=O)[C@H](C)N[C@@H]1CCO[C@H]1C1CC1)c1ccccc1	ZINC000332988723	145393135	/nfs/dbraw/zinc/39/31/35/145393135.db2.gz	HNYXNTJRQQAXIE-GFOFROLCSA-N	0	3	302.418	2.409	10	0		DEAEHN
Cn1ccc(CNC2CCN(CCc3ccc(F)cc3)CC2)n1	ZINC000358270665	147103535	/nfs/dbraw/zinc/10/35/35/147103535.db2.gz	XDOUGALQVNVBFI-UHFFFAOYSA-N	0	3	316.424	2.356	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)NC[C@@](C)(O)C2CCCCC2)CCN1C	ZINC000358924192	147232400	/nfs/dbraw/zinc/23/24/00/147232400.db2.gz	DCCSANPGIXERQH-UKPHBRMFSA-N	0	3	311.470	2.100	10	0		DEAEHN
CS(=O)(=O)C1(CN[C@H](C[C@H]2CCOC2)c2ccccc2)CC1	ZINC000359029500	147249623	/nfs/dbraw/zinc/24/96/23/147249623.db2.gz	LHYUSQLGPRTLID-GDBMZVCRSA-N	0	3	323.458	2.321	10	0		DEAEHN
COc1ccc(Cl)cc1CNC(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000359343442	147311606	/nfs/dbraw/zinc/31/16/06/147311606.db2.gz	NACVFTWVZYCODX-CYBMUJFWSA-N	0	3	323.824	2.385	10	0		DEAEHN
Cn1nccc1C(=O)NC[C@H]1CCCN(C)[C@@H]1c1ccccc1	ZINC000370261544	148000665	/nfs/dbraw/zinc/00/06/65/148000665.db2.gz	NAPNMOXEXOWYKO-NVXWUHKLSA-N	0	3	312.417	2.233	10	0		DEAEHN
COCc1ccccc1CNC(=O)CN1CCCC12CCC2	ZINC000373104087	148210937	/nfs/dbraw/zinc/21/09/37/148210937.db2.gz	LLPPEFOEANWEQX-UHFFFAOYSA-N	0	3	302.418	2.468	10	0		DEAEHN
CN(Cc1ccc(F)cc1)C(=O)CN1CC[C@]2(C1)CCCOC2	ZINC000375280783	148351233	/nfs/dbraw/zinc/35/12/33/148351233.db2.gz	KHTBIBFNWMTGPT-SFHVURJKSA-N	0	3	320.408	2.287	10	0		DEAEHN
Cc1cnc2cc(C(=O)NC[C@@H]3CCCCN3C3CC3)ccn12	ZINC000565959674	292194356	/nfs/dbraw/zinc/19/43/56/292194356.db2.gz	QKUIFDMFGUYMCQ-INIZCTEOSA-N	0	3	312.417	2.389	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1C[C@@H](C)c2ccccc21	ZINC000111867875	401726458	/nfs/dbraw/zinc/72/64/58/401726458.db2.gz	NZKQDGRVKDLPAL-HUUCEWRRSA-N	0	3	317.433	2.431	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC1CCC(C)(C)CC1	ZINC000074167469	401731577	/nfs/dbraw/zinc/73/15/77/401731577.db2.gz	CGCXNDALLQNHHG-OAHLLOKOSA-N	0	3	311.470	2.365	10	0		DEAEHN
C[C@@H](NC(=O)C1CCN(C)CC1)c1cccc(-n2ccnc2)c1	ZINC000074173950	401732308	/nfs/dbraw/zinc/73/23/08/401732308.db2.gz	DSAKNUHRRRUCGA-CQSZACIVSA-N	0	3	312.417	2.391	10	0		DEAEHN
COc1c(C)cc(CN2CCC(N3CCNC3=O)CC2)cc1C	ZINC000127558615	401740117	/nfs/dbraw/zinc/74/01/17/401740117.db2.gz	BMZQZUDTXUKESI-UHFFFAOYSA-N	0	3	317.433	2.302	10	0		DEAEHN
C[C@@H](Oc1cncc(N2CCNCC2)n1)c1cccc(F)c1	ZINC000000003309	401687411	/nfs/dbraw/zinc/68/74/11/401687411.db2.gz	VIVXNAQRWKTJPF-GFCCVEGCSA-N	0	3	302.353	2.165	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc3c(c2)CCO3)CCN1CCOC	ZINC000111228135	401702087	/nfs/dbraw/zinc/70/20/87/401702087.db2.gz	OGUBKUGAZJLATN-QGZVFWFLSA-N	0	3	304.434	2.164	10	0		DEAEHN
COC(=O)CCN1CCC(CN2CCc3ccccc32)CC1	ZINC000111307700	401709753	/nfs/dbraw/zinc/70/97/53/401709753.db2.gz	XEEZNPOQGPTUCE-UHFFFAOYSA-N	0	3	302.418	2.324	10	0		DEAEHN
COc1c(CN2CCN(CC3CCCCC3)CC2)c(C)nn1C	ZINC000126994770	401716270	/nfs/dbraw/zinc/71/62/70/401716270.db2.gz	XKSRHDUBVFDFLI-UHFFFAOYSA-N	0	3	320.481	2.435	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)NC[C@@H](C)SC)cc2)CC1	ZINC000129476184	401804469	/nfs/dbraw/zinc/80/44/69/401804469.db2.gz	DHIPMZQFBAGNNU-CQSZACIVSA-N	0	3	321.490	2.310	10	0		DEAEHN
C[C@H](Oc1ccc(F)cc1Cl)C(=O)N1CC[C@H](N(C)C)C1	ZINC000112897500	401761317	/nfs/dbraw/zinc/76/13/17/401761317.db2.gz	IWMRFMHSUHPNRU-JQWIXIFHSA-N	0	3	314.788	2.409	10	0		DEAEHN
C[C@H](Oc1ccc(F)cc1Cl)C(=O)NC[C@@H]1CCCN1C	ZINC000112924355	401761922	/nfs/dbraw/zinc/76/19/22/401761922.db2.gz	GDFYSWWSVNXBES-JQWIXIFHSA-N	0	3	314.788	2.457	10	0		DEAEHN
COC[C@H]1CCCN(CC(=O)N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000112985427	401763204	/nfs/dbraw/zinc/76/32/04/401763204.db2.gz	LKQHZTNPPBKRQF-STQMWFEESA-N	0	3	322.371	2.146	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccn(-c2ccccc2)n1	ZINC000113226029	401770501	/nfs/dbraw/zinc/77/05/01/401770501.db2.gz	WGTOFCVPUZOBEK-GDBMZVCRSA-N	0	3	310.401	2.181	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(F)cc2nccnc21	ZINC000113226987	401771250	/nfs/dbraw/zinc/77/12/50/401771250.db2.gz	FIMHAGMBDUYWTM-WCQYABFASA-N	0	3	314.364	2.078	10	0		DEAEHN
COc1cc(OC)cc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000113233576	401772102	/nfs/dbraw/zinc/77/21/02/401772102.db2.gz	FLFNQZRICADCDK-TZMCWYRMSA-N	0	3	304.390	2.013	10	0		DEAEHN
COCCN1C(=O)CC[C@@H]2CN(Cc3ccc(C)cc3)CC[C@@H]21	ZINC000012199609	401781735	/nfs/dbraw/zinc/78/17/35/401781735.db2.gz	OYDAUGSAURIUCU-MSOLQXFVSA-N	0	3	316.445	2.454	10	0		DEAEHN
COc1cccc(CN2CCC[C@@H](Cn3cncn3)C2)c1OC	ZINC000128562721	401782964	/nfs/dbraw/zinc/78/29/64/401782964.db2.gz	BZLOVCRIYUBGLO-CQSZACIVSA-N	0	3	316.405	2.208	10	0		DEAEHN
Cn1cc([C@@H]2CCN(CCC(=O)Nc3cccc(F)c3)C2)cn1	ZINC000116313465	401849391	/nfs/dbraw/zinc/84/93/91/401849391.db2.gz	ZTQLEEIJSVVPLO-CYBMUJFWSA-N	0	3	316.380	2.377	10	0		DEAEHN
C[C@H](NC[C@@H]1CN(C)CCO1)c1ccc(Br)cc1	ZINC000078469439	401852285	/nfs/dbraw/zinc/85/22/85/401852285.db2.gz	ORTZTRPHUBFWBC-SMDDNHRTSA-N	0	3	313.239	2.430	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)Nc2nc3ccccc3s2)CCO1	ZINC000116928552	401864346	/nfs/dbraw/zinc/86/43/46/401864346.db2.gz	OVQOLLWTLXMFMJ-LLVKDONJSA-N	0	3	320.418	2.091	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1)N(C)C	ZINC000119171291	401930532	/nfs/dbraw/zinc/93/05/32/401930532.db2.gz	QXNJLLKCGOOPQN-WMLDXEAASA-N	0	3	321.440	2.499	10	0		DEAEHN
Cc1cccc(CNC(=O)N(CCN(C)C)Cc2ccco2)n1	ZINC000088503307	401932667	/nfs/dbraw/zinc/93/26/67/401932667.db2.gz	ZTWHQJOLVYPSKD-UHFFFAOYSA-N	0	3	316.405	2.256	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1c(C)cccc1F	ZINC000133935609	401896276	/nfs/dbraw/zinc/89/62/76/401896276.db2.gz	MFNJKBDFGSIDJF-CYBMUJFWSA-N	0	3	309.385	2.366	10	0		DEAEHN
CC(C)C[C@H](NC(=O)[C@H](N)C(C)C)C(=O)Nc1ccccc1	ZINC000035653273	401900174	/nfs/dbraw/zinc/90/01/74/401900174.db2.gz	LODYUHYUFPJMPF-LSDHHAIUSA-N	0	3	305.422	2.139	10	0	in-vitro	DEAEHN
COc1ccc([C@@H](C)N[C@@H]2C=C[C@H](CO)C2)cc1NC(C)=O	ZINC000134634485	401909715	/nfs/dbraw/zinc/90/97/15/401909715.db2.gz	HUFXRQPHSIHNBP-OSAQELSMSA-N	0	3	304.390	2.241	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCC2(CCOC)CCCC2)C1	ZINC000119957919	401972722	/nfs/dbraw/zinc/97/27/22/401972722.db2.gz	CYMUFJQCTKZLFD-HNNXBMFYSA-N	0	3	311.470	2.367	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCCN(c2ccccc2)CC1)N(C)C	ZINC000137270565	401981805	/nfs/dbraw/zinc/98/18/05/401981805.db2.gz	WYBMWEGUZRXTQC-KRWDZBQOSA-N	0	3	303.450	2.456	10	0		DEAEHN
O=C(NC[C@@H](O)CN1CCCCC1)Nc1ccc2c(c1)CCC2	ZINC000043389312	401938572	/nfs/dbraw/zinc/93/85/72/401938572.db2.gz	BXZSFXOYAUORHZ-QGZVFWFLSA-N	0	3	317.433	2.144	10	0		DEAEHN
C[C@@H]1CC[C@H](C(=O)N(CCN(C)C)Cc2cccc(F)c2)O1	ZINC000151044500	402012693	/nfs/dbraw/zinc/01/26/93/402012693.db2.gz	PHJBILORVRZZPF-CZUORRHYSA-N	0	3	308.397	2.283	10	0		DEAEHN
CC(C)[C@H](CO)N(Cc1ccccc1)C[C@H](O)C(F)(F)F	ZINC000121435914	402035735	/nfs/dbraw/zinc/03/57/35/402035735.db2.gz	WVMOPILJSDRPME-KBPBESRZSA-N	0	3	305.340	2.429	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)CCOc2ccccc2F)C1	ZINC000052593445	402044304	/nfs/dbraw/zinc/04/43/04/402044304.db2.gz	XFUGSGOEEWJEDU-CQSZACIVSA-N	0	3	323.412	2.330	10	0		DEAEHN
COc1ccc(CNC(=O)NC[C@@H]2CCCN2C)cc1Cl	ZINC000151625238	402047076	/nfs/dbraw/zinc/04/70/76/402047076.db2.gz	LDXFNMAMAUUNBU-LBPRGKRZSA-N	0	3	311.813	2.242	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCC2(c3ccc(F)cc3F)CC2)C1	ZINC000120860263	402004810	/nfs/dbraw/zinc/00/48/10/402004810.db2.gz	WVXZYUBLWQLZRU-ZDUSSCGKSA-N	0	3	323.387	2.342	10	0		DEAEHN
COCCOc1ccccc1CN1CCC(n2cncn2)CC1	ZINC000092648094	402007147	/nfs/dbraw/zinc/00/71/47/402007147.db2.gz	FPRFIHZUAVFNOX-UHFFFAOYSA-N	0	3	316.405	2.140	10	0		DEAEHN
Cc1cccc(CN(CCN(C)C)C(=O)[C@@H]2CC[C@H](C)O2)c1	ZINC000152349122	402090924	/nfs/dbraw/zinc/09/09/24/402090924.db2.gz	MIEKPHONBUSLFO-RDJZCZTQSA-N	0	3	304.434	2.453	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cc(F)cc3nccnc32)CCN1C	ZINC000122754485	402092985	/nfs/dbraw/zinc/09/29/85/402092985.db2.gz	SARKSJBCRGFBHO-WCQYABFASA-N	0	3	316.380	2.324	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)COCCOc2ccccc2)CCN1C	ZINC000122776665	402094201	/nfs/dbraw/zinc/09/42/01/402094201.db2.gz	JBXGSOTVKASOLO-HZPDHXFCSA-N	0	3	320.433	2.023	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)CCOc2ccccc2)C1	ZINC000057870150	402097478	/nfs/dbraw/zinc/09/74/78/402097478.db2.gz	KQEJAWJKOQHJTK-OAHLLOKOSA-N	0	3	305.422	2.191	10	0		DEAEHN
COc1ccc(CCNC(=O)C2CCN(C)CC2)c(Cl)c1	ZINC000123224768	402117081	/nfs/dbraw/zinc/11/70/81/402117081.db2.gz	XKFRUUDTBMGAEO-UHFFFAOYSA-N	0	3	310.825	2.349	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](NC[C@@H](C)N1CCOCC1)CCCO2	ZINC000123247172	402117644	/nfs/dbraw/zinc/11/76/44/402117644.db2.gz	NQMLQVLNQYBAMZ-PBHICJAKSA-N	0	3	320.433	2.219	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCN(c2nc(C)c(C)s2)CC1)N(C)C	ZINC000122122434	402062379	/nfs/dbraw/zinc/06/23/79/402062379.db2.gz	WDLYGLGFENSCCE-AWEZNQCLSA-N	0	3	324.494	2.139	10	0		DEAEHN
C[C@@H](CO)[C@@H](C)NC(=O)c1oc2ccccc2c1CN(C)C	ZINC000151902855	402064730	/nfs/dbraw/zinc/06/47/30/402064730.db2.gz	OYESNKMWNJKCAV-NWDGAFQWSA-N	0	3	304.390	2.241	10	0		DEAEHN
Cc1nn(CC(C)C)c(C)c1CC(=O)N(CCN(C)C)C(C)C	ZINC000151935589	402066323	/nfs/dbraw/zinc/06/63/23/402066323.db2.gz	GWUBRAXIICOLPH-UHFFFAOYSA-N	0	3	322.497	2.497	10	0		DEAEHN
Cc1cc(NC(=O)CCN2CCC(OCC(C)C)CC2)no1	ZINC000054322032	402066676	/nfs/dbraw/zinc/06/66/76/402066676.db2.gz	SDNVNXWMMOVRNT-UHFFFAOYSA-N	0	3	309.410	2.449	10	0		DEAEHN
COc1ccc2c(CC(=O)N3CCCN(C)CC3)coc2c1	ZINC000097617281	402128686	/nfs/dbraw/zinc/12/86/86/402128686.db2.gz	UCWRVAWCUQYHCH-UHFFFAOYSA-N	0	3	302.374	2.148	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cc3c(s2)CCOC3)CCN1C	ZINC000123771278	402145035	/nfs/dbraw/zinc/14/50/35/402145035.db2.gz	YEULMPPJNDHROU-AAEUAGOBSA-N	0	3	308.447	2.376	10	0		DEAEHN
CCOC(=O)CCN1CCC(NC(=O)CC2CCCC2)CC1	ZINC000066951273	402147407	/nfs/dbraw/zinc/14/74/07/402147407.db2.gz	HIVMUZLCPNMNRR-UHFFFAOYSA-N	0	3	310.438	2.101	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC[C@@H](c2nncn2C2CC2)C1)N(C)C	ZINC000153482863	402148237	/nfs/dbraw/zinc/14/82/37/402148237.db2.gz	LERCNROIMOJKPA-HIFRSBDPSA-N	0	3	319.453	2.049	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)Cc2noc3ccccc32)CCN1C	ZINC000124466240	402181403	/nfs/dbraw/zinc/18/14/03/402181403.db2.gz	NILYDXHGEHLFCA-OLZOCXBDSA-N	0	3	301.390	2.311	10	0		DEAEHN
Cc1nc(C[C@@H]2CCCN(CCC(=O)OC(C)(C)C)C2)no1	ZINC000103230580	402181945	/nfs/dbraw/zinc/18/19/45/402181945.db2.gz	OSTGKFBAVHMGRP-ZDUSSCGKSA-N	0	3	309.410	2.364	10	0		DEAEHN
COc1ccc(OC)c(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000124481308	402182131	/nfs/dbraw/zinc/18/21/31/402182131.db2.gz	CICBPWHQAIYXHA-OLZOCXBDSA-N	0	3	306.406	2.259	10	0		DEAEHN
C[C@H](CNC(=O)c1coc(Br)c1)N(C)C1CC1	ZINC000068216622	402187384	/nfs/dbraw/zinc/18/73/84/402187384.db2.gz	WQGIGBMSXPZLQC-MRVPVSSYSA-N	0	3	301.184	2.255	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1)N(C)C	ZINC000154081072	402191630	/nfs/dbraw/zinc/19/16/30/402191630.db2.gz	VQQOQOIUSCWUPJ-TZMCWYRMSA-N	0	3	324.856	2.160	10	0		DEAEHN
COc1cc([C@@H](C)N[C@@H](C)CCS(C)(=O)=O)ccc1F	ZINC000154271686	402202495	/nfs/dbraw/zinc/20/24/95/402202495.db2.gz	VEKDUUCUAZZDEF-WDEREUQCSA-N	0	3	303.399	2.308	10	0		DEAEHN
CSCCC(=O)NCc1ccccc1CN1CCC[C@H]1CO	ZINC000125115402	402213727	/nfs/dbraw/zinc/21/37/27/402213727.db2.gz	MSKNMAPTJVUSGH-INIZCTEOSA-N	0	3	322.474	2.013	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)NCCc1cccc(O)c1	ZINC000069415184	402221610	/nfs/dbraw/zinc/22/16/10/402221610.db2.gz	BRQNGTGBWGNFNP-CQSZACIVSA-N	0	3	305.422	2.108	10	0		DEAEHN
CN(CC(=O)N1CCC[C@H](C(F)(F)F)C1)C[C@@H]1CCCOC1	ZINC000107686664	402237407	/nfs/dbraw/zinc/23/74/07/402237407.db2.gz	PKXJRRNRKLQVBU-STQMWFEESA-N	0	3	322.371	2.146	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N[C@H]1CCO[C@H](C2CC2)C1	ZINC000125788520	402250712	/nfs/dbraw/zinc/25/07/12/402250712.db2.gz	OACWEPYFGQQUJN-XHSDSOJGSA-N	0	3	311.470	2.220	10	0		DEAEHN
CCOc1ccccc1OCC(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000155607357	402262185	/nfs/dbraw/zinc/26/21/85/402262185.db2.gz	TVJMXHHEWHKMLF-GJZGRUSLSA-N	0	3	320.433	2.309	10	0		DEAEHN
CC(C)N1CCO[C@@H](CN2CCN(CC3CCCCC3)CC2)C1	ZINC000105845697	402209483	/nfs/dbraw/zinc/20/94/83/402209483.db2.gz	XYXVHYSTWKJKBB-IBGZPJMESA-N	0	3	323.525	2.294	10	0		DEAEHN
COc1ccccc1N1CC[C@@H](NCc2ccc(CO)o2)C1	ZINC000154415259	402211536	/nfs/dbraw/zinc/21/15/36/402211536.db2.gz	SPBYDOHEYCCFOF-CYBMUJFWSA-N	0	3	302.374	2.149	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@](C)(O)c1cccc(Cl)c1)N(C)C	ZINC000185076602	402322654	/nfs/dbraw/zinc/32/26/54/402322654.db2.gz	SFSSFRQIMCKLDQ-ZBFHGGJFSA-N	0	3	312.841	2.394	10	0		DEAEHN
CCOc1ccc(NC(=O)NC[C@H]2CCCN2CCOC)cc1	ZINC000110083693	402280943	/nfs/dbraw/zinc/28/09/43/402280943.db2.gz	DBHOYSQKXQQOBM-OAHLLOKOSA-N	0	3	321.421	2.318	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1ccc(O)c(OC)c1	ZINC000176193192	402288952	/nfs/dbraw/zinc/28/89/52/402288952.db2.gz	XYNZDYBBWIZEQK-AWEZNQCLSA-N	0	3	321.421	2.027	10	0		DEAEHN
CCCCn1cc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c(C)n1	ZINC000184965139	402313112	/nfs/dbraw/zinc/31/31/12/402313112.db2.gz	GKONYVBMKDYZLT-BBRMVZONSA-N	0	3	306.454	2.450	10	0		DEAEHN
Cn1cc(-c2cc(CN(CCCO)CC(C)(C)C)on2)cn1	ZINC000185000563	402316305	/nfs/dbraw/zinc/31/63/05/402316305.db2.gz	LWFFGOHEGTVXDO-UHFFFAOYSA-N	0	3	306.410	2.306	10	0		DEAEHN
CC(C)[C@@](C)(O)CN1CCCN(C(=O)c2cccs2)CC1	ZINC000185010066	402316860	/nfs/dbraw/zinc/31/68/60/402316860.db2.gz	QDJMKXOXEAXVMS-INIZCTEOSA-N	0	3	310.463	2.303	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000159099132	402317421	/nfs/dbraw/zinc/31/74/21/402317421.db2.gz	HXEZMZLVPYHCEJ-KEYYUXOJSA-N	0	3	324.490	2.469	10	0		DEAEHN
Cc1cc(CN[C@@H]2CN(C(C)C)C[C@H]2C)ccc1S(C)(=O)=O	ZINC000230167642	402348576	/nfs/dbraw/zinc/34/85/76/402348576.db2.gz	BYVQXGCEJBHBSS-GDBMZVCRSA-N	0	3	324.490	2.217	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1ccc(F)cc1C	ZINC000176903463	402348820	/nfs/dbraw/zinc/34/88/20/402348820.db2.gz	FJZZCRUAXAVSCR-CQSZACIVSA-N	0	3	321.396	2.015	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CCc1nc2ccccc2[nH]1	ZINC000176977824	402356570	/nfs/dbraw/zinc/35/65/70/402356570.db2.gz	IXPHPWIKGMVEOL-CQSZACIVSA-N	0	3	314.433	2.438	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(-n2ccnc2)cc1	ZINC000176995874	402357557	/nfs/dbraw/zinc/35/75/57/402357557.db2.gz	OIMSDDMJGABSMK-QGZVFWFLSA-N	0	3	312.417	2.429	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cccc(NC(=O)OC)c1	ZINC000177014105	402359369	/nfs/dbraw/zinc/35/93/69/402359369.db2.gz	VDXNLKYFWAOAGS-HNNXBMFYSA-N	0	3	319.405	2.421	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc2c(c1)OCCCO2	ZINC000177029983	402360834	/nfs/dbraw/zinc/36/08/34/402360834.db2.gz	AQOLZHKDZZZMQB-HNNXBMFYSA-N	0	3	318.417	2.404	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)COc2ccc(F)cc2F)C1	ZINC000177065699	402366250	/nfs/dbraw/zinc/36/62/50/402366250.db2.gz	OKHHBEKPWZNULA-RISCZKNCSA-N	0	3	312.360	2.189	10	0		DEAEHN
COc1ccc(/C=C(\C)C(=O)N2CC[C@@H](N(C)C)C2)cc1F	ZINC000185820324	402380150	/nfs/dbraw/zinc/38/01/50/402380150.db2.gz	GWFCSRJDVJLLFU-BRADTZPFSA-N	0	3	306.381	2.400	10	0		DEAEHN
COc1ccc(/C=C(\C)C(=O)N2CC[C@H](N(C)C)C2)cc1F	ZINC000185820306	402380240	/nfs/dbraw/zinc/38/02/40/402380240.db2.gz	GWFCSRJDVJLLFU-TZIYXEQSSA-N	0	3	306.381	2.400	10	0		DEAEHN
Cc1ccc2ncnc(N3CCN(C4CCOCC4)CC3)c2c1	ZINC000176742364	402332607	/nfs/dbraw/zinc/33/26/07/402332607.db2.gz	KRHRUGBBPMQEDP-UHFFFAOYSA-N	0	3	312.417	2.239	10	0		DEAEHN
COCCNCCNC(=O)c1ccc2c(c1)Cc1ccccc1-2	ZINC000237351679	402405097	/nfs/dbraw/zinc/40/50/97/402405097.db2.gz	FUEJFELIRGIYRI-UHFFFAOYSA-N	0	3	310.397	2.224	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CCNC(=O)OC(C)(C)C	ZINC000177517254	402411741	/nfs/dbraw/zinc/41/17/41/402411741.db2.gz	ZPXSRTNEYLPTLC-CQSZACIVSA-N	0	3	308.426	2.181	10	0		DEAEHN
Cc1cccc2[nH]cc(CCNC(=O)C[C@@H]3CSCCN3)c21	ZINC000237739857	402419632	/nfs/dbraw/zinc/41/96/32/402419632.db2.gz	UJXHISYNWZDEKP-CQSZACIVSA-N	0	3	317.458	2.230	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)Nc1ccnn1C(C)C	ZINC000177696443	402427728	/nfs/dbraw/zinc/42/77/28/402427728.db2.gz	MLFVPGKLZLREHC-GJZGRUSLSA-N	0	3	321.469	2.207	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)Nc1ccc(OC)cc1	ZINC000177706885	402428794	/nfs/dbraw/zinc/42/87/94/402428794.db2.gz	CCNZZQJYFRPGCG-HOCLYGCPSA-N	0	3	319.449	2.438	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)NCc1ccccc1C	ZINC000177709034	402428976	/nfs/dbraw/zinc/42/89/76/402428976.db2.gz	HLTJSZOGULQDJK-FUHWJXTLSA-N	0	3	317.477	2.416	10	0		DEAEHN
CC1CCN(CCNC(=O)N2CC[C@@]3(O)CCCC[C@H]3C2)CC1	ZINC000162772370	402431218	/nfs/dbraw/zinc/43/12/18/402431218.db2.gz	IRFIMPJCMUSVIY-WMZOPIPTSA-N	0	3	323.481	2.055	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)N1CCC(Oc2ccccc2)CC1	ZINC000238044100	402434238	/nfs/dbraw/zinc/43/42/38/402434238.db2.gz	QAYTVTUENWAQFY-CQSZACIVSA-N	0	3	320.458	2.152	10	0		DEAEHN
CCC[C@@H](C(=O)NC1CCC(O)(c2cccnc2)CC1)N(C)C	ZINC000186503779	402436707	/nfs/dbraw/zinc/43/67/07/402436707.db2.gz	UELPZWQBBPSOSE-PQUAAJSLSA-N	0	3	319.449	2.058	10	0		DEAEHN
Cc1cccc(C)c1OCCCN1CCN(CCO)[C@H](C)C1	ZINC000187730153	402510304	/nfs/dbraw/zinc/51/03/04/402510304.db2.gz	UCZZNPCVPASRBG-QGZVFWFLSA-N	0	3	306.450	2.071	10	0		DEAEHN
CC[C@H]1CN(CCNS(C)(=O)=O)CC[C@H]1c1ccccc1	ZINC000245410448	402457912	/nfs/dbraw/zinc/45/79/12/402457912.db2.gz	RBERKAMGHLFWLM-GOEBONIOSA-N	0	3	310.463	2.051	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@@H]1Oc2ccccc2O[C@@H]1C	ZINC000245431824	402460684	/nfs/dbraw/zinc/46/06/84/402460684.db2.gz	NLQPXEOICMMPSY-CKEIUWERSA-N	0	3	318.417	2.158	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)N[C@H](C)c1cccs1	ZINC000245467539	402464047	/nfs/dbraw/zinc/46/40/47/402464047.db2.gz	KALIUFOVRIZWSM-KGLIPLIRSA-N	0	3	309.479	2.341	10	0		DEAEHN
CC(C)NC(=O)CCN(C)[C@@H](C)c1ccc([S@@](C)=O)cc1	ZINC000245479729	402464674	/nfs/dbraw/zinc/46/46/74/402464674.db2.gz	WOQZPMLYUNKHTM-YEJXKQKISA-N	0	3	310.463	2.332	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)c1cc(O)ccc1OC	ZINC000186957486	402473796	/nfs/dbraw/zinc/47/37/96/402473796.db2.gz	FEFAIRZZWSPWOS-ZDUSSCGKSA-N	0	3	306.406	2.395	10	0		DEAEHN
C[C@H]1CC[C@](CO)(N(C)CC(=O)N(C2CC2)C2CCCC2)C1	ZINC000187922772	402512891	/nfs/dbraw/zinc/51/28/91/402512891.db2.gz	DKRQRROQJPYSPH-KSSFIOAISA-N	0	3	308.466	2.403	10	0		DEAEHN
C[C@H](Cc1ccc(O)cc1)NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000245660247	402477467	/nfs/dbraw/zinc/47/74/67/402477467.db2.gz	DAKUDFPRCLMYSK-YCPHGPKFSA-N	0	3	319.449	2.447	10	0		DEAEHN
CNC(=O)c1ccc(CN2CCC[C@H]2Cn2ccnc2C)cc1	ZINC000178290501	402480334	/nfs/dbraw/zinc/48/03/34/402480334.db2.gz	KFKHAULIBLUHMI-KRWDZBQOSA-N	0	3	312.417	2.216	10	0		DEAEHN
COc1ccc(C[C@H](C)C(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000245699509	402480564	/nfs/dbraw/zinc/48/05/64/402480564.db2.gz	YVUOMNVHYPYFHC-HOCLYGCPSA-N	0	3	302.418	2.180	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1Cc1nc(-c2ccoc2)no1	ZINC000178303976	402482912	/nfs/dbraw/zinc/48/29/12/402482912.db2.gz	QEVXZWBEVYUXNB-AWEZNQCLSA-N	0	3	313.361	2.499	10	0		DEAEHN
CC[C@H]1CCCCN1C(=O)CN1CCC[C@@H]1Cn1ccnc1C	ZINC000178333102	402485617	/nfs/dbraw/zinc/48/56/17/402485617.db2.gz	LBAKERFAEJAZOF-DLBZAZTESA-N	0	3	318.465	2.447	10	0		DEAEHN
COc1cccc2c1CC[C@@H]2NC(=O)N1CCN2CCC[C@H]2C1	ZINC000245777153	402486901	/nfs/dbraw/zinc/48/69/01/402486901.db2.gz	PPERMVUMPGLNKC-BBRMVZONSA-N	0	3	315.417	2.172	10	0		DEAEHN
CCCn1nc(C)c(CN2CCN(CCOC)[C@@H](CC)C2)c1C	ZINC000245788003	402488510	/nfs/dbraw/zinc/48/85/10/402488510.db2.gz	VNXVVAMSNJNXTL-KRWDZBQOSA-N	0	3	322.497	2.453	10	0		DEAEHN
COC[C@H](C)CN(C)C[C@@H](c1cccs1)N1CCOCC1	ZINC000187232306	402489546	/nfs/dbraw/zinc/48/95/46/402489546.db2.gz	WHOSAHQIXLZFFO-CABCVRRESA-N	0	3	312.479	2.336	10	0		DEAEHN
COC[C@@H](C)CN(CCO)Cc1cnn(Cc2ccccc2)c1	ZINC000187273833	402491177	/nfs/dbraw/zinc/49/11/77/402491177.db2.gz	FNZGBWZKQWHJLZ-INIZCTEOSA-N	0	3	317.433	2.008	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cnc([C@H]2CCCO2)s1	ZINC000245846888	402491505	/nfs/dbraw/zinc/49/15/05/402491505.db2.gz	IOJUZRLZEBCQJS-JHJVBQTASA-N	0	3	321.446	2.303	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)N[C@H]2CC(C)(C)OC2(C)C)CCN1C	ZINC000245875390	402493352	/nfs/dbraw/zinc/49/33/52/402493352.db2.gz	AMLUKMCYSFVIIJ-RDBSUJKOSA-N	0	3	311.470	2.457	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCCc1ccccn1	ZINC000178429499	402497651	/nfs/dbraw/zinc/49/76/51/402497651.db2.gz	OAUORLAMRIFHMM-MRXNPFEDSA-N	0	3	304.438	2.140	10	0		DEAEHN
CCCCOC(=O)CCN1CC[C@@H]2[C@@H](CCC(=O)N2C2CC2)C1	ZINC000245928350	402498538	/nfs/dbraw/zinc/49/85/38/402498538.db2.gz	XXDNVZPVJGLYHG-GOEBONIOSA-N	0	3	322.449	2.195	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)[C@@H]1C[C@@H]1c1sccc1C	ZINC000245959691	402500865	/nfs/dbraw/zinc/50/08/65/402500865.db2.gz	RVJGSAMXSKMGQO-QLFBSQMISA-N	0	3	322.474	2.387	10	0		DEAEHN
CC(C)[C@@H](O)CC(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1	ZINC000187456038	402501824	/nfs/dbraw/zinc/50/18/24/402501824.db2.gz	YWQKCQGQRAXPOT-MSOLQXFVSA-N	0	3	318.461	2.420	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NS(=O)(=O)c2ccc3c(c2)CCC3)C1	ZINC000246094042	402508994	/nfs/dbraw/zinc/50/89/94/402508994.db2.gz	GXUQRUFYWJBJFY-SUMWQHHRSA-N	0	3	322.474	2.182	10	0		DEAEHN
CN(C)C(=O)[C@H](c1ccccc1)N1CC[C@@H]2OCCC[C@@H]2C1	ZINC000246739510	402542728	/nfs/dbraw/zinc/54/27/28/402542728.db2.gz	PCAHDJYQDUUYBI-IKGGRYGDSA-N	0	3	302.418	2.317	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2ccc3c(c2)OCCCO3)C1	ZINC000246828468	402546401	/nfs/dbraw/zinc/54/64/01/402546401.db2.gz	DSGSXLXIXVRPMP-DZGCQCFKSA-N	0	3	318.417	2.306	10	0		DEAEHN
C[C@@H](C(=O)N[C@H]1CCCC[C@H]1C)N1C[C@H]2CCC[C@@H](C1)C2O	ZINC000246955738	402550641	/nfs/dbraw/zinc/55/06/41/402550641.db2.gz	JLKUOAVMYAFSCO-FVXKBFGUSA-N	0	3	308.466	2.163	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)N[C@H]2CCOc3ccccc32)C1	ZINC000247079283	402556279	/nfs/dbraw/zinc/55/62/79/402556279.db2.gz	IBZHAVNRLXILJU-HIFRSBDPSA-N	0	3	303.406	2.151	10	0		DEAEHN
CCOC(=O)C1CCN(C(=O)CN[C@@H](C)c2cccs2)CC1	ZINC000171111040	402558634	/nfs/dbraw/zinc/55/86/34/402558634.db2.gz	NRNJDOFMSDBLOL-LBPRGKRZSA-N	0	3	324.446	2.200	10	0		DEAEHN
CSc1ccc(OCCN2CCN(C[C@H](C)O)[C@H](C)C2)cc1	ZINC000247236477	402560766	/nfs/dbraw/zinc/56/07/66/402560766.db2.gz	DIZMGQGRQCCEMY-CABCVRRESA-N	0	3	324.490	2.174	10	0		DEAEHN
CCOCCN1CCN(Cc2ccccc2N(C)C)C[C@H]1C	ZINC000247336536	402564257	/nfs/dbraw/zinc/56/42/57/402564257.db2.gz	FWASGJOZFLRIHK-MRXNPFEDSA-N	0	3	305.466	2.295	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)C2C[C@H]3CCC[C@@H](C2)C3=O)[C@@H](C)C1	ZINC000247442898	402567179	/nfs/dbraw/zinc/56/71/79/402567179.db2.gz	SDGAVEPLJIQAMU-DRFQVBMSSA-N	0	3	306.450	2.227	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CC[C@@H](C)C[C@H]1C	ZINC000247535448	402571203	/nfs/dbraw/zinc/57/12/03/402571203.db2.gz	XXTIGUDCYZBRHA-KLHDSHLOSA-N	0	3	311.470	2.221	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)Nc2nc3c(s2)COCC3)C1	ZINC000246281339	402522889	/nfs/dbraw/zinc/52/28/89/402522889.db2.gz	BNCREFQBBWVKRM-CMPLNLGQSA-N	0	3	324.450	2.066	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@@H]2OCCc3ccccc32)C1	ZINC000246300639	402524174	/nfs/dbraw/zinc/52/41/74/402524174.db2.gz	PSJJNWJLBXVLOT-XOKHGSTOSA-N	0	3	302.418	2.145	10	0		DEAEHN
CCCC(=O)N[C@@H]1CCCN(C[C@](C)(O)c2ccccc2)C1	ZINC000170779507	402524451	/nfs/dbraw/zinc/52/44/51/402524451.db2.gz	KECWBQXMCRHLFX-AEFFLSMTSA-N	0	3	304.434	2.275	10	0		DEAEHN
C[C@@H](C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)c1cccnc1	ZINC000246368993	402527443	/nfs/dbraw/zinc/52/74/43/402527443.db2.gz	QSCQBFFWPFXDNB-OWCLPIDISA-N	0	3	319.449	2.191	10	0		DEAEHN
Cc1ccc(OCCCCNC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170830074	402530524	/nfs/dbraw/zinc/53/05/24/402530524.db2.gz	DGXVTPUJSBLUPR-MRXNPFEDSA-N	0	3	319.449	2.500	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000170863218	402534326	/nfs/dbraw/zinc/53/43/26/402534326.db2.gz	LNORVIIIHHMDNI-NSHDSACASA-N	0	3	302.296	2.361	10	0		DEAEHN
COc1ccc(S[C@@H](C)C(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170865036	402535301	/nfs/dbraw/zinc/53/53/01/402535301.db2.gz	AVSHZTLZAIYBOT-QWHCGFSZSA-N	0	3	308.447	2.338	10	0		DEAEHN
NC(=O)c1coc(CNC2CCN(Cc3ccccc3)CC2)c1	ZINC000189403914	402536302	/nfs/dbraw/zinc/53/63/02/402536302.db2.gz	FRNQKWIRAZNGAI-UHFFFAOYSA-N	0	3	313.401	2.133	10	0		DEAEHN
O=C(/C=C/c1ccnc(Cl)c1)N1CCCN(C2CC2)CC1	ZINC000179171646	402578022	/nfs/dbraw/zinc/57/80/22/402578022.db2.gz	KPFFITOLNZSUCK-GORDUTHDSA-N	0	3	305.809	2.445	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@@H](C)c2c(C)noc2C)C1	ZINC000179251942	402582974	/nfs/dbraw/zinc/58/29/74/402582974.db2.gz	YLOJNTHEJZYRDS-BXUZGUMPSA-N	0	3	308.426	2.178	10	0		DEAEHN
C[C@H]1CN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)CCS1	ZINC000171429955	402587159	/nfs/dbraw/zinc/58/71/59/402587159.db2.gz	RSFRYGRTVUCZAK-GOEBONIOSA-N	0	3	321.490	2.306	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1n[nH]c2c1CCCCC2	ZINC000190272092	402588962	/nfs/dbraw/zinc/58/89/62/402588962.db2.gz	SIYMIAOYOWJQMP-ZDUSSCGKSA-N	0	3	306.454	2.385	10	0		DEAEHN
Cc1c(C(=O)N2CCN3CCC[C@@H]3C2)cnn1-c1ccccc1C	ZINC000171586284	402597761	/nfs/dbraw/zinc/59/77/61/402597761.db2.gz	RQFSTZNXBXJXNU-MRXNPFEDSA-N	0	3	324.428	2.409	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H]2CCCO[C@@H]2CC(C)C)C1	ZINC000248612997	402598907	/nfs/dbraw/zinc/59/89/07/402598907.db2.gz	YDXULGSEOFAALO-HRCADAONSA-N	0	3	311.470	2.364	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccc(F)c(F)c1)N1CCN2CCC[C@@H]2C1	ZINC000171639059	402604664	/nfs/dbraw/zinc/60/46/64/402604664.db2.gz	ZZSPSXBSSGXPSN-WCQYABFASA-N	0	3	309.360	2.072	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2nc3cccnc3s2)C1	ZINC000248739673	402606361	/nfs/dbraw/zinc/60/63/61/402606361.db2.gz	PENWNAMAVVCTGH-CMPLNLGQSA-N	0	3	304.419	2.150	10	0		DEAEHN
C[C@@H](CNC(=O)[C@H]1CCOC[C@H]1C)N(C)Cc1ccccc1	ZINC000248867385	402612357	/nfs/dbraw/zinc/61/23/57/402612357.db2.gz	NNNQZNNCKYBYAK-VYDXJSESSA-N	0	3	304.434	2.296	10	0		DEAEHN
CCN1CC[C@H](N(C)C(=O)[C@H]2C[C@@H](C(C)=O)C2(C)C)[C@@H](C)C1	ZINC000249084507	402620343	/nfs/dbraw/zinc/62/03/43/402620343.db2.gz	RWLQURBLOQPZOE-HNKHHVNMSA-N	0	3	308.466	2.426	10	0		DEAEHN
CCn1cc([C@@H](C)N[C@@H]2CCc3nc(C(C)C)nn3C2)cn1	ZINC000180653669	402622705	/nfs/dbraw/zinc/62/27/05/402622705.db2.gz	CLPTVXYYTRXSKJ-TZMCWYRMSA-N	0	3	302.426	2.284	10	0		DEAEHN
O=C(Nc1nc2c(s1)CCCC2)N1CCN2CCC[C@@H]2C1	ZINC000171806930	402624143	/nfs/dbraw/zinc/62/41/43/402624143.db2.gz	CFBLEGXZIIUQET-LLVKDONJSA-N	0	3	306.435	2.334	10	0		DEAEHN
CCOc1ccc(CNC(=O)N2CCN3CCC[C@H]3C2)cc1F	ZINC000171907554	402633112	/nfs/dbraw/zinc/63/31/12/402633112.db2.gz	GLXHBRWZVSMTIH-AWEZNQCLSA-N	0	3	321.396	2.214	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cccc(OC[C@H]2CCCO2)c1	ZINC000249748129	402639951	/nfs/dbraw/zinc/63/99/51/402639951.db2.gz	OIKPNBLXGKVYIM-DOTOQJQBSA-N	0	3	318.417	2.068	10	0		DEAEHN
COC(=O)CCN1CCC[C@H](c2nc(-c3ccccc3)n[nH]2)C1	ZINC000181295619	402640602	/nfs/dbraw/zinc/64/06/02/402640602.db2.gz	RDNIRDCXMBYRKR-AWEZNQCLSA-N	0	3	314.389	2.214	10	0		DEAEHN
Cc1cccc(CNC(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)n1	ZINC000249789601	402641771	/nfs/dbraw/zinc/64/17/71/402641771.db2.gz	UAAFGNAMTJBWKE-HIFRSBDPSA-N	0	3	304.438	2.310	10	0		DEAEHN
COC[C@H](N[C@H](CO)c1cccc(Br)c1)C1CC1	ZINC000181391041	402644209	/nfs/dbraw/zinc/64/42/09/402644209.db2.gz	XOIBIQOHMKBJEW-KGLIPLIRSA-N	0	3	314.223	2.497	10	0		DEAEHN
COC(=O)c1sc(N2C[C@@H]3CCCN3C[C@H]2C)nc1Cl	ZINC000251550282	402648171	/nfs/dbraw/zinc/64/81/71/402648171.db2.gz	BEKPCNIKTFUELD-BDAKNGLRSA-N	0	3	315.826	2.256	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)N1CC[C@@H](C)[C@H](OC)C1	ZINC000252061380	402653002	/nfs/dbraw/zinc/65/30/02/402653002.db2.gz	ZYKBTBBSEZUACJ-BZUAXINKSA-N	0	3	311.470	2.317	10	0		DEAEHN
Cc1csc([C@H]2CCCN(CCCN3CCOCC3)C2)n1	ZINC000173649917	402706523	/nfs/dbraw/zinc/70/65/23/402706523.db2.gz	DELQZRBZQSYOJH-HNNXBMFYSA-N	0	3	309.479	2.353	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c(C)c1	ZINC000173885553	402716886	/nfs/dbraw/zinc/71/68/86/402716886.db2.gz	USOJKSONJWFZFQ-GJZGRUSLSA-N	0	3	310.463	2.310	10	0		DEAEHN
COc1cccc(F)c1[C@@H](C)NC(=O)N1CC[C@H](N(C)C)C1	ZINC000173915388	402718871	/nfs/dbraw/zinc/71/88/71/402718871.db2.gz	AFUHQCVHXBPHEJ-NEPJUHHUSA-N	0	3	309.385	2.241	10	0		DEAEHN
COc1cccc(F)c1[C@@H](C)NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000173915415	402718933	/nfs/dbraw/zinc/71/89/33/402718933.db2.gz	AFUHQCVHXBPHEJ-VXGBXAGGSA-N	0	3	309.385	2.241	10	0		DEAEHN
COc1cc([C@@H](C)NCC(C)(C)C2(O)CCOCC2)ccn1	ZINC000566474751	292245774	/nfs/dbraw/zinc/24/57/74/292245774.db2.gz	HYJUAEFIYODFEO-CYBMUJFWSA-N	0	3	308.422	2.309	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1cccc(F)c1C	ZINC000173025574	402682796	/nfs/dbraw/zinc/68/27/96/402682796.db2.gz	CFVTWSIDXRECLZ-LLVKDONJSA-N	0	3	302.415	2.143	10	0		DEAEHN
Fc1cc2cccnc2c(CN2CC[C@H](N3CCOCC3)C2)c1	ZINC000173932445	402720290	/nfs/dbraw/zinc/72/02/90/402720290.db2.gz	ZMQNUSSGTTZPFJ-KRWDZBQOSA-N	0	3	315.392	2.280	10	0		DEAEHN
O=C(NCCCOC1CCCCC1)N1CC[C@H](N2CC=CC2)C1	ZINC000173542784	402702562	/nfs/dbraw/zinc/70/25/62/402702562.db2.gz	SBJKUNKRGKGQQF-INIZCTEOSA-N	0	3	321.465	2.382	10	0		DEAEHN
Cc1ccc2cccc(-c3nc([C@H]4CNCCN4C)no3)c2n1	ZINC000263232493	402748588	/nfs/dbraw/zinc/74/85/88/402748588.db2.gz	NOKSYLVMDHFBPQ-CQSZACIVSA-N	0	3	309.373	2.169	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cccc(-c3nnc(C)o3)c2)C1	ZINC000174646065	402750255	/nfs/dbraw/zinc/75/02/55/402750255.db2.gz	VJXDGIHVSNFVGK-HNNXBMFYSA-N	0	3	314.389	2.259	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2cc(F)cc3cccnc32)[C@H](C)C1	ZINC000192815715	402751792	/nfs/dbraw/zinc/75/17/92/402751792.db2.gz	UKQCRGIQJBLAOG-ZIAGYGMSSA-N	0	3	317.408	2.261	10	0		DEAEHN
CCc1nc(CN2CCCC[C@H](N3CCN(C)CC3)C2)cs1	ZINC000174903072	402762255	/nfs/dbraw/zinc/76/22/55/402762255.db2.gz	BJBTUEMKMJRQTF-INIZCTEOSA-N	0	3	322.522	2.307	10	0		DEAEHN
Cc1cnc([C@H](C)NC(=O)N2CC[C@H](N3CC=CC3)C2)s1	ZINC000174922587	402763895	/nfs/dbraw/zinc/76/38/95/402763895.db2.gz	ZQXZPQOHKQCTLA-STQMWFEESA-N	0	3	306.435	2.168	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H](C)c2ncc(C)s2)C1	ZINC000183688560	402789385	/nfs/dbraw/zinc/78/93/85/402789385.db2.gz	CHXBSWCAERPEIA-YPMHNXCESA-N	0	3	310.467	2.339	10	0		DEAEHN
C[C@@H](CC(=O)OC(C)(C)C)NCc1cccnc1-n1ccnc1	ZINC000183704338	402790624	/nfs/dbraw/zinc/79/06/24/402790624.db2.gz	YZIAUMLWYMTPLE-ZDUSSCGKSA-N	0	3	316.405	2.477	10	0		DEAEHN
COc1ccccc1[C@H](O)CN[C@H](C)CC(=O)OC(C)(C)C	ZINC000183712211	402790855	/nfs/dbraw/zinc/79/08/55/402790855.db2.gz	GLTASKIAFNCOFF-TZMCWYRMSA-N	0	3	309.406	2.439	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cc(OC)ccc2OC)C1	ZINC000194317757	402792237	/nfs/dbraw/zinc/79/22/37/402792237.db2.gz	MRBMXXHNNCLBEO-LBPRGKRZSA-N	0	3	307.394	2.310	10	0		DEAEHN
CCOc1ccccc1NC(=O)CN(C)C[C@@H]1CCCN1CC	ZINC000175357510	402799689	/nfs/dbraw/zinc/79/96/89/402799689.db2.gz	JAZQXBCBAMHCDF-HNNXBMFYSA-N	0	3	319.449	2.440	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)S(=O)(=O)c1ccc2c(c1)CCC2	ZINC000175391351	402802483	/nfs/dbraw/zinc/80/24/83/402802483.db2.gz	YQBZDGGHQOCEAT-MRXNPFEDSA-N	0	3	322.474	2.280	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N2CCN3CCCC[C@@H]3C2)cc1	ZINC000194601918	402804896	/nfs/dbraw/zinc/80/48/96/402804896.db2.gz	DMKVAYBVJBXACH-QGZVFWFLSA-N	0	3	301.434	2.059	10	0		DEAEHN
C[C@@H](C(=O)NCc1cccnc1N(C)C)N1[C@H](C)CC[C@@H]1C	ZINC000194666163	402808396	/nfs/dbraw/zinc/80/83/96/402808396.db2.gz	XYJPIEUFHKLRFM-MJBXVCDLSA-N	0	3	304.438	2.025	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N(C)C[C@H]1CCCN(C)C1	ZINC000175471322	402809413	/nfs/dbraw/zinc/80/94/13/402809413.db2.gz	GGEIKQOZVRYRRR-HNNXBMFYSA-N	0	3	321.469	2.022	10	0		DEAEHN
COc1ccc2c(CC(=O)NC[C@H]3CCCN3C)coc2c1	ZINC000194743846	402814241	/nfs/dbraw/zinc/81/42/41/402814241.db2.gz	JJVCSUOYYJYFQI-CYBMUJFWSA-N	0	3	302.374	2.194	10	0		DEAEHN
C[C@H](CNC(=O)[C@@H]1C[C@H](C)CC(C)(C)C1)CN1CCN(C)CC1	ZINC000184067306	402815550	/nfs/dbraw/zinc/81/55/50/402815550.db2.gz	BEGKYCHOYGBQAV-GVDBMIGSSA-N	0	3	323.525	2.449	10	0		DEAEHN
C[C@H](CNC(=O)[C@H]1C[C@@H](C)CC(C)(C)C1)CN1CCN(C)CC1	ZINC000184067254	402815747	/nfs/dbraw/zinc/81/57/47/402815747.db2.gz	BEGKYCHOYGBQAV-ZACQAIPSSA-N	0	3	323.525	2.449	10	0		DEAEHN
C[C@@H]1CN(CCOc2cccc(Cl)c2)C[C@@H]1N1CCOCC1	ZINC000175587603	402819587	/nfs/dbraw/zinc/81/95/87/402819587.db2.gz	MCXNOXXKJRFKSP-PBHICJAKSA-N	0	3	324.852	2.371	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ncc(-c2ccccc2)cn1)N(C)C	ZINC000184141462	402821405	/nfs/dbraw/zinc/82/14/05/402821405.db2.gz	OUEIBXQCARSVHX-MRXNPFEDSA-N	0	3	312.417	2.490	10	0		DEAEHN
Cc1cccc(OCCCC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000195315193	402841616	/nfs/dbraw/zinc/84/16/16/402841616.db2.gz	WQUDIZMHVOPEMK-INIZCTEOSA-N	0	3	302.418	2.461	10	0		DEAEHN
Cn1nccc1C1CCN(CCC(=O)NC2CCCC2)CC1	ZINC000195503960	402847951	/nfs/dbraw/zinc/84/79/51/402847951.db2.gz	SQNPWLBHNPZWOK-UHFFFAOYSA-N	0	3	304.438	2.048	10	0		DEAEHN
C[C@H]1CCCC[C@@H]1NC(=O)CN1CCC(c2ccn[nH]2)CC1	ZINC000195506644	402848220	/nfs/dbraw/zinc/84/82/20/402848220.db2.gz	QBIJTPLEIUJUJX-ZFWWWQNUSA-N	0	3	304.438	2.284	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2ccc(F)c(Cl)c2F)CCO1	ZINC000184515632	402848501	/nfs/dbraw/zinc/84/85/01/402848501.db2.gz	CJQMNTFETZGBMV-SECBINFHSA-N	0	3	318.751	2.021	10	0		DEAEHN
Cc1cn(-c2ccccc2)nc1C(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000184525063	402848950	/nfs/dbraw/zinc/84/89/50/402848950.db2.gz	YCQFKYQMPXVFHS-DOTOQJQBSA-N	0	3	324.428	2.489	10	0		DEAEHN
FC(F)(F)COCCN1CC[C@H](CNc2ccccn2)C1	ZINC000195516005	402849255	/nfs/dbraw/zinc/84/92/55/402849255.db2.gz	KBMWOGHELXPDOR-GFCCVEGCSA-N	0	3	303.328	2.394	10	0		DEAEHN
CCc1nnc(CNC(C)(C)CN(C)Cc2ccccc2)n1C	ZINC000195518401	402850103	/nfs/dbraw/zinc/85/01/03/402850103.db2.gz	VTZNABAFIUNZQS-UHFFFAOYSA-N	0	3	315.465	2.378	10	0		DEAEHN
CN(C[C@H](O)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000274148690	403031230	/nfs/dbraw/zinc/03/12/30/403031230.db2.gz	KQCPEFOEZJPFFH-KBPBESRZSA-N	0	3	302.340	2.116	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1cc2c([nH]c1=O)CCCCC2	ZINC000268210821	403062383	/nfs/dbraw/zinc/06/23/83/403062383.db2.gz	VKACHPQXXHLLFZ-AWEZNQCLSA-N	0	3	317.433	2.222	10	0		DEAEHN
CC(=O)N(C[C@H]1CCCN1Cc1cccc2nccn21)C1CC1	ZINC000275767291	403121714	/nfs/dbraw/zinc/12/17/14/403121714.db2.gz	RBHOKPBQFKJTEV-MRXNPFEDSA-N	0	3	312.417	2.310	10	0		DEAEHN
COCCCC(=O)N1CCC[C@H](N(C)Cc2ccccn2)CC1	ZINC000276018007	403139762	/nfs/dbraw/zinc/13/97/62/403139762.db2.gz	QNXHGOXPNREAKG-KRWDZBQOSA-N	0	3	319.449	2.321	10	0		DEAEHN
CCn1cc(CCN2C[C@@H](O)C[C@@H]2c2cccc(OC)c2)cn1	ZINC000286213548	403474404	/nfs/dbraw/zinc/47/44/04/403474404.db2.gz	QPWPLLSIJUXERO-FUHWJXTLSA-N	0	3	315.417	2.262	10	0		DEAEHN
C[C@H](NC(=O)N[C@H]1CCC[C@H](C(N)=O)C1)C1=CCN(C)CC1	ZINC000332903779	403634084	/nfs/dbraw/zinc/63/40/84/403634084.db2.gz	ZDXJHVFYBCFAQT-UBHSHLNASA-N	0	3	308.426	2.030	10	0		DEAEHN
CC(=O)N[C@H](C(=O)NCCN1[C@H](C)CCC[C@@H]1C)C1CCCC1	ZINC000341062674	403755856	/nfs/dbraw/zinc/75/58/56/403755856.db2.gz	CLBINWFCUSZENL-VBQJREDUSA-N	0	3	323.481	2.060	10	0		DEAEHN
CCC[C@H](O)CN1CC[C@@H](Oc2cccnc2N2CCCC2)C1	ZINC000295948824	404023664	/nfs/dbraw/zinc/02/36/64/404023664.db2.gz	LQDKVSRUVDVUGG-JKSUJKDBSA-N	0	3	319.449	2.296	10	0		DEAEHN
C[C@@H]1NC(=S)N(C[C@@H]2CCCN(C)[C@@H]2c2cccs2)C1=O	ZINC000369676931	404189053	/nfs/dbraw/zinc/18/90/53/404189053.db2.gz	BMPJEGMOMIDKBQ-GVXVVHGQSA-N	0	3	323.487	2.236	10	0		DEAEHN
CC(C)c1nn(C)cc1NC(=O)N1CC[C@H](N2CCCC2)C1	ZINC000373928132	404642867	/nfs/dbraw/zinc/64/28/67/404642867.db2.gz	IZDLFNJCGHRPGA-ZDUSSCGKSA-N	0	3	305.426	2.246	10	0		DEAEHN
CC(=O)c1cccc(OC[C@@H](O)CN(C(C)C)[C@H]2CCOC2)c1	ZINC000291953160	404597974	/nfs/dbraw/zinc/59/79/74/404597974.db2.gz	UQDHVGGJMKPNKV-IRXDYDNUSA-N	0	3	321.417	2.128	10	0		DEAEHN
Cn1cncc1CCN1CCC(Oc2ncccc2F)CC1	ZINC000297822583	404634654	/nfs/dbraw/zinc/63/46/54/404634654.db2.gz	YZUNFTARUQIDMU-UHFFFAOYSA-N	0	3	304.369	2.040	10	0		DEAEHN
C[C@]1(CNC(=O)c2ccnnc2)CCN(Cc2ccccc2)C1	ZINC000374155628	404699657	/nfs/dbraw/zinc/69/96/57/404699657.db2.gz	BWNORDDCEKRCST-GOSISDBHSA-N	0	3	310.401	2.119	10	0		DEAEHN
C[C@@H]1[C@H](C)N(C(=O)c2cccc(CN3CCCC3)c2)CCN1C	ZINC000356886072	404716865	/nfs/dbraw/zinc/71/68/65/404716865.db2.gz	SRBCWNQXDMNFPR-CVEARBPZSA-N	0	3	315.461	2.447	10	0		DEAEHN
CC(C)(C)OC(=O)c1ccc(CNC[C@@H]2COCCO2)cc1	ZINC000360967375	404864369	/nfs/dbraw/zinc/86/43/69/404864369.db2.gz	XGWGNJVGBMSZHY-OAHLLOKOSA-N	0	3	307.390	2.147	10	0		DEAEHN
CC(C)(C)OC(=O)c1ccc(CNC[C@H]2COCCO2)cc1	ZINC000360967374	404864430	/nfs/dbraw/zinc/86/44/30/404864430.db2.gz	XGWGNJVGBMSZHY-HNNXBMFYSA-N	0	3	307.390	2.147	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(C(=O)[C@H]1C[C@@H](C)CCN1)CC2	ZINC000423911912	404925717	/nfs/dbraw/zinc/92/57/17/404925717.db2.gz	SKAYKPJZJDJXEY-SCLBCKFNSA-N	0	3	314.429	2.205	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)c2cc(Br)ccc2F)C1	ZINC000389989318	405042644	/nfs/dbraw/zinc/04/26/44/405042644.db2.gz	MVLPXVQNIVENHS-SNVBAGLBSA-N	0	3	315.186	2.412	10	0		DEAEHN
CS[C@@H]1CN(C(=O)CCOCC(C)C)C[C@H]1N1CCCC1	ZINC000361632695	405173302	/nfs/dbraw/zinc/17/33/02/405173302.db2.gz	UJVIGRPSEGOOAG-HUUCEWRRSA-N	0	3	314.495	2.087	10	0		DEAEHN
CO[C@H]1C[C@@H](NCc2ccc(CS(C)(=O)=O)cc2)C12CCC2	ZINC000453064637	405280444	/nfs/dbraw/zinc/28/04/44/405280444.db2.gz	SEOPFKWTRUZOQV-CVEARBPZSA-N	0	3	323.458	2.278	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)NC[C@H](C)N1CCC[C@H](C)C1	ZINC000454504160	405354780	/nfs/dbraw/zinc/35/47/80/405354780.db2.gz	JIBIYUPOHLFICL-STQMWFEESA-N	0	3	322.453	2.465	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2ccc(OC)c(C)c2)CC12COC2	ZINC000449356941	405525406	/nfs/dbraw/zinc/52/54/06/405525406.db2.gz	CWSAHKDOZWXBLL-OAHLLOKOSA-N	0	3	319.401	2.015	10	0		DEAEHN
COc1cc(OC)c(C[C@@H](C)NCc2ccnn2C)c(OC)c1	ZINC000449466316	405573947	/nfs/dbraw/zinc/57/39/47/405573947.db2.gz	FQLFCWKEUUAZOL-GFCCVEGCSA-N	0	3	319.405	2.167	10	0		DEAEHN
Cc1csc(NC(=O)CN[C@H]2CCCC23CCOCC3)n1	ZINC000558628982	405677481	/nfs/dbraw/zinc/67/74/81/405677481.db2.gz	DSNKOBWAFLFOHF-LBPRGKRZSA-N	0	3	309.435	2.329	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N[C@@H](CO)Cc1ccc(C)c(C)c1	ZINC000457320455	405798713	/nfs/dbraw/zinc/79/87/13/405798713.db2.gz	MPUJBFODWACWRX-MSOLQXFVSA-N	0	3	318.461	2.197	10	0		DEAEHN
CCCN(CCN(C)C)C(=O)c1cc(C)cc(C(=O)OC)c1	ZINC000457541651	405890335	/nfs/dbraw/zinc/89/03/35/405890335.db2.gz	PZQZKBAJRNEQAX-UHFFFAOYSA-N	0	3	306.406	2.195	10	0		DEAEHN
O=C(N[C@H]1CCCC(F)(F)C1)N1CC[C@H](N2CCCC2)C1	ZINC000531772285	406005339	/nfs/dbraw/zinc/00/53/39/406005339.db2.gz	CGFUPXPRTXAFCK-STQMWFEESA-N	0	3	301.381	2.444	10	0		DEAEHN
C[C@@H]1CCN(C(=O)NCCOCCN(C)C)[C@H](c2ccco2)C1	ZINC000471631991	406103107	/nfs/dbraw/zinc/10/31/07/406103107.db2.gz	ADLRLUDOFCQAEJ-CABCVRRESA-N	0	3	323.437	2.340	10	0		DEAEHN
C[C@@H]1C[C@@H]1CNC(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000471668753	406107783	/nfs/dbraw/zinc/10/77/83/406107783.db2.gz	LYJQIACMXRWRLK-HYVNUMGLSA-N	0	3	301.434	2.464	10	0		DEAEHN
CO[C@H]1CC[C@@H](NC(=O)Nc2cccc(OCCN(C)C)c2)C1	ZINC000472339894	406138961	/nfs/dbraw/zinc/13/89/61/406138961.db2.gz	MNJJYAODFPRELQ-CABCVRRESA-N	0	3	321.421	2.316	10	0		DEAEHN
CC1(C)CN(C[C@@H](O)COC[C@H]2CCCO2)Cc2ccccc21	ZINC000534668168	406194132	/nfs/dbraw/zinc/19/41/32/406194132.db2.gz	MLTDSDIZVCZMCX-IAGOWNOFSA-N	0	3	319.445	2.336	10	0		DEAEHN
C[C@@H](Cc1ccccc1F)C(=O)NCCNc1ccncc1	ZINC000535261227	406217447	/nfs/dbraw/zinc/21/74/47/406217447.db2.gz	NMCPELPYDRFTJU-ZDUSSCGKSA-N	0	3	301.365	2.050	10	0		DEAEHN
C[C@]1(CO)CCCN1C(=O)c1cccc(CN2CCCC2)c1	ZINC000546115104	406351376	/nfs/dbraw/zinc/35/13/76/406351376.db2.gz	ITXIECYHVIVKJT-GOSISDBHSA-N	0	3	302.418	2.269	10	0		DEAEHN
C(N[C@@H]1CCC[C@@H]([C@H]2CCOC2)C1)c1nnc2n1CCCC2	ZINC000547397037	406406529	/nfs/dbraw/zinc/40/65/29/406406529.db2.gz	CLANFBNGDVIXST-QLFBSQMISA-N	0	3	304.438	2.299	10	0		DEAEHN
COC[C@@](C)(O)CN[C@@H]1CCCc2ncc(C(F)(F)F)cc21	ZINC000547659427	406429033	/nfs/dbraw/zinc/42/90/33/406429033.db2.gz	HQRYSWIIWMXCQY-KGLIPLIRSA-N	0	3	318.339	2.465	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NC1CCCCCC1	ZINC000637875326	406457861	/nfs/dbraw/zinc/45/78/61/406457861.db2.gz	SPXXSKKYJOHIMW-KRWDZBQOSA-N	0	3	303.450	2.285	10	0		DEAEHN
C[C@H](NC(=O)[C@@H](N)CN(C)Cc1ccccc1)c1cccs1	ZINC000637885240	406462290	/nfs/dbraw/zinc/46/22/90/406462290.db2.gz	JKNUQQNQYBRZGP-ZFWWWQNUSA-N	0	3	317.458	2.385	10	0		DEAEHN
Cc1nc2scc(C3CC3)n2c1CNC[C@]1(C)CCC(=O)N1	ZINC000571762015	406562797	/nfs/dbraw/zinc/56/27/97/406562797.db2.gz	WWBLIAKKXFDGCZ-INIZCTEOSA-N	0	3	318.446	2.340	10	0		DEAEHN
CC(C)C[C@@H]1CCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)C1	ZINC000637992954	406514208	/nfs/dbraw/zinc/51/42/08/406514208.db2.gz	WIKGQGAJQYUMEJ-ROUUACIJSA-N	0	3	317.477	2.340	10	0		DEAEHN
CC[C@@H]1C[C@@H](C)CN1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638006997	406520871	/nfs/dbraw/zinc/52/08/71/406520871.db2.gz	JYQDPKVVNOAYFV-OIISXLGYSA-N	0	3	303.450	2.093	10	0		DEAEHN
c1nc(CNC[C@H]2CCN2C2CCCC2)sc1C1OCCO1	ZINC000527807658	406757955	/nfs/dbraw/zinc/75/79/55/406757955.db2.gz	HQFBLMLUGUPUEX-CYBMUJFWSA-N	0	3	323.462	2.295	10	0		DEAEHN
CC(C)CC1(NC(=O)[C@@H](N)CN(C)Cc2ccccc2)CC1	ZINC000638431274	406767716	/nfs/dbraw/zinc/76/77/16/406767716.db2.gz	SNMFMTASWXPYOW-INIZCTEOSA-N	0	3	303.450	2.141	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCCc1nc2ccccc2o1	ZINC000572692428	406719281	/nfs/dbraw/zinc/71/92/81/406719281.db2.gz	GMKPACZMEPQOEZ-AWEZNQCLSA-N	0	3	301.390	2.361	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H]1CNCCOC1)c1ccc(Cl)cc1Cl	ZINC000643619215	407018387	/nfs/dbraw/zinc/01/83/87/407018387.db2.gz	PTOZSDXONZXTQU-NXEZZACHSA-N	0	3	317.216	2.407	10	0		DEAEHN
C[C@@H](O)C1CCN(Cc2ccccc2N2CCOCC2)CC1	ZINC000092970675	287077004	/nfs/dbraw/zinc/07/70/04/287077004.db2.gz	SOYJEMDOCAWWES-OAHLLOKOSA-N	0	3	304.434	2.116	10	0		DEAEHN
Cc1sc2[n-]c(COC3CCC([NH3+])CC3)nc(=O)c2c1C	ZINC000129155896	196024547	/nfs/dbraw/zinc/02/45/47/196024547.db2.gz	ULCIORZTFRUJTO-UHFFFAOYSA-N	0	3	307.419	2.388	10	0		DEAEHN
CCCNc1cc(C)ncc1C(=O)N[C@@H](C)CC[S@@](C)=O	ZINC000129660788	196066012	/nfs/dbraw/zinc/06/60/12/196066012.db2.gz	KSJNVKTVAKJDSL-MQJDWESPSA-N	0	3	311.451	2.099	10	0		DEAEHN
C[C@@H](CN1C(=O)C2(CC2)N[C@H]1c1cccs1)N1CCCC1	ZINC000130797065	196110934	/nfs/dbraw/zinc/11/09/34/196110934.db2.gz	NLPYNHQJTCLXPL-GXTWGEPZSA-N	0	3	305.447	2.195	10	0		DEAEHN
CCN[C@H](C)c1c(CC)nn([C@H]2CCS(=O)(=O)C2)c1CC	ZINC000131106111	196141029	/nfs/dbraw/zinc/14/10/29/196141029.db2.gz	SSFOZFNQEVSOCG-NEPJUHHUSA-N	0	3	313.467	2.038	10	0		DEAEHN
CN[C@H](Cc1ccc(C(F)(F)F)cc1)[C@H](C)S(C)(=O)=O	ZINC000131473268	196172773	/nfs/dbraw/zinc/17/27/73/196172773.db2.gz	GPTJHHKAOWSSEM-JOYOIKCWSA-N	0	3	309.353	2.269	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-]CC[C@@H](C)SC)o1	ZINC000131611676	196184544	/nfs/dbraw/zinc/18/45/44/196184544.db2.gz	AXOTXRGXGSSGEO-LLVKDONJSA-N	0	3	320.480	2.199	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CCC(c3cc[nH]n3)CC2)C1	ZINC000131629956	196185343	/nfs/dbraw/zinc/18/53/43/196185343.db2.gz	OUKWTNIVQJHJKF-CJNGLKHVSA-N	0	3	319.453	2.027	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CC[C@@H](C)[C@@H](C)C2)s1	ZINC000131750884	196196097	/nfs/dbraw/zinc/19/60/97/196196097.db2.gz	QQBKZEWLDRYZHJ-MNOVXSKESA-N	0	3	302.465	2.134	10	0		DEAEHN
C[C@@H](C(=O)N1CCC(c2cc[nH]n2)CC1)N1[C@H](C)CC[C@H]1C	ZINC000131934891	196211937	/nfs/dbraw/zinc/21/19/37/196211937.db2.gz	VAAZYIQFQIVCCD-MCIONIFRSA-N	0	3	304.438	2.377	10	0		DEAEHN
OCCN[C@H]1CCCc2sc(I)cc21	ZINC000132257749	196239834	/nfs/dbraw/zinc/23/98/34/196239834.db2.gz	SMNIZFDVZSWWKE-QMMMGPOBSA-N	0	3	323.199	2.312	10	0		DEAEHN
C[C@@H]1CCC[C@@]1(O)c1c(Br)cnn1CCN(C)C	ZINC000132489372	196260112	/nfs/dbraw/zinc/26/01/12/196260112.db2.gz	ZRHFBGNGEQDWPZ-MFKMUULPSA-N	0	3	316.243	2.215	10	0		DEAEHN
CO[C@@H]1CC[C@H]2OCCN(CCCCn3ccnc3C)[C@H]2C1	ZINC000132724321	196278048	/nfs/dbraw/zinc/27/80/48/196278048.db2.gz	GMFCJUCUVAVCGH-IXDOHACOSA-N	0	3	307.438	2.240	10	0		DEAEHN
CCNC1(c2nc(C)c(C)s2)CCN(C(=O)N(C)C)CC1	ZINC000132903837	196295193	/nfs/dbraw/zinc/29/51/93/196295193.db2.gz	UBASLOUGPGYVAO-UHFFFAOYSA-N	0	3	310.467	2.342	10	0		DEAEHN
CC(C)(CCc1ccccc1)NS(=O)(=O)[C@@H]1CCCNC1	ZINC000133760324	196334837	/nfs/dbraw/zinc/33/48/37/196334837.db2.gz	ZJWHVKPNRSOKAB-OAHLLOKOSA-N	0	3	310.463	2.069	10	0		DEAEHN
CN(C(=O)CCN1CC[C@](O)(C(F)(F)F)C1)c1ccccc1	ZINC000135130351	196446706	/nfs/dbraw/zinc/44/67/06/196446706.db2.gz	HQDLRGZEGHMKTG-CQSZACIVSA-N	0	3	316.323	2.039	10	0		DEAEHN
Cc1nnc(NC[C@H]2CCCN(C)[C@H]2c2cccs2)nc1C	ZINC000359574190	424830858	/nfs/dbraw/zinc/83/08/58/424830858.db2.gz	HHUULAZFYUSIDE-UKRRQHHQSA-N	0	3	317.462	3.045	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)CCCOc2ccc(OC)cc2)C1	ZINC000194630182	424877406	/nfs/dbraw/zinc/87/74/06/424877406.db2.gz	PNIYFGDIBBHIJT-HNNXBMFYSA-N	0	3	320.433	2.455	10	0		DEAEHN
Cc1nn(CC(C)C)c(C)c1CC(=O)N1CCN2CCC[C@@H]2C1	ZINC000195321540	424882290	/nfs/dbraw/zinc/88/22/90/424882290.db2.gz	HZECQQLNFCFFOQ-MRXNPFEDSA-N	0	3	318.465	2.005	10	0		DEAEHN
O=C(CCCOc1ccc(F)cc1)N1CCN2CCC[C@H]2C1	ZINC000195327675	424882734	/nfs/dbraw/zinc/88/27/34/424882734.db2.gz	ONZICLVWWICVPW-HNNXBMFYSA-N	0	3	306.381	2.291	10	0		DEAEHN
O[C@@]1(CCNCc2csc(Br)c2)CCOC1	ZINC000404178888	424925144	/nfs/dbraw/zinc/92/51/44/424925144.db2.gz	AUUNBJLGDCVDFC-NSHDSACASA-N	0	3	306.225	2.142	10	0		DEAEHN
CN1C[C@H](CNCc2cccc(Br)c2F)CC1=O	ZINC000657696300	425387111	/nfs/dbraw/zinc/38/71/11/425387111.db2.gz	HAPPDCWQKPWLLA-VIFPVBQESA-N	0	3	315.186	2.156	10	0		DEAEHN
COc1c(CNC[C@H]2CCN2Cc2ccccc2)c(C)nn1C	ZINC000657808662	425404976	/nfs/dbraw/zinc/40/49/76/425404976.db2.gz	ZNDVSCMEWAKFDU-MRXNPFEDSA-N	0	3	314.433	2.101	10	0		DEAEHN
CO[C@](C)(CNCc1cnn(C)c1C)COCc1ccccc1	ZINC000657591655	425371160	/nfs/dbraw/zinc/37/11/60/425371160.db2.gz	KFYMOEAZQUBHIT-GOSISDBHSA-N	0	3	317.433	2.440	10	0		DEAEHN
CN(C(=O)[C@@H]1CSc2ccccc21)[C@@H](CN)C(F)(F)F	ZINC000662980399	425771476	/nfs/dbraw/zinc/77/14/76/425771476.db2.gz	GXNNBLHPRQDXJU-KOLCDFICSA-N	0	3	304.337	2.224	10	0		DEAEHN
CC(C)[C@H](C)C(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000397637032	269106799	/nfs/dbraw/zinc/10/67/99/269106799.db2.gz	QNAGKNSBMOBPGR-INIZCTEOSA-N	0	3	318.461	2.422	10	0		DEAEHN
CC1(C)C[C@@H]1C(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000397638867	269106936	/nfs/dbraw/zinc/10/69/36/269106936.db2.gz	RCPGZBBBQRQFOA-MRXNPFEDSA-N	0	3	316.445	2.176	10	0		DEAEHN
COC(=O)CC1(CC(=O)NC[C@@H](C)N2CCCC2)CCCC1	ZINC000526071385	269502728	/nfs/dbraw/zinc/50/27/28/269502728.db2.gz	BUBQLGVYLATSNO-CQSZACIVSA-N	0	3	310.438	2.101	10	0		DEAEHN
CSC[C@@H](C)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000077572373	274176692	/nfs/dbraw/zinc/17/66/92/274176692.db2.gz	ZPUSYXICWFKHGQ-UKRRQHHQSA-N	0	3	309.479	2.210	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1CN1CCN(c2ccc3nncn3n2)CC1	ZINC000183054592	274287401	/nfs/dbraw/zinc/28/74/01/274287401.db2.gz	UIQXKNZYPZUDAV-CABCVRRESA-N	0	3	314.437	2.073	10	0		DEAEHN
C[C@@H]1CC[C@@H](NC(=O)NC[C@](C)(O)CN(C)C)c2ccccc21	ZINC000153150218	274312574	/nfs/dbraw/zinc/31/25/74/274312574.db2.gz	JJBAXKYOMMQCOV-QBIMZIAESA-N	0	3	319.449	2.237	10	0		DEAEHN
CCCC[C@H](COC)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000091343685	275985398	/nfs/dbraw/zinc/98/53/98/275985398.db2.gz	HRWHJKIBOYMLDM-GXTWGEPZSA-N	0	3	314.451	2.190	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCCC[C@@H]1[C@H](C)O	ZINC000359138344	276141499	/nfs/dbraw/zinc/14/14/99/276141499.db2.gz	KVUBOHAVADPFCQ-DOTOQJQBSA-N	0	3	304.434	2.270	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)N1CCc2sccc2C1	ZINC000175362125	276182475	/nfs/dbraw/zinc/18/24/75/276182475.db2.gz	ZTDQMHMRGQYSHK-HNNXBMFYSA-N	0	3	321.490	2.049	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000247962108	276362365	/nfs/dbraw/zinc/36/23/65/276362365.db2.gz	CYDGGGTXMQTSBC-RCCFBDPRSA-N	0	3	315.461	2.422	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000247962105	276362462	/nfs/dbraw/zinc/36/24/62/276362462.db2.gz	CYDGGGTXMQTSBC-KURKYZTESA-N	0	3	315.461	2.422	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)N1CCc2ccccc21	ZINC000245459077	276370633	/nfs/dbraw/zinc/37/06/33/276370633.db2.gz	DHGHHFCWSXZXQO-NVXWUHKLSA-N	0	3	315.461	2.380	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@@H]2CCCC[C@@H]2O)C1	ZINC000373019545	276374578	/nfs/dbraw/zinc/37/45/78/276374578.db2.gz	HWBGUXPUVMDBTF-NXOAAHMSSA-N	0	3	323.481	2.196	10	0		DEAEHN
CCc1nc2n(n1)C[C@@H](N[C@@H]1CCc3ccc(OC)cc31)CC2	ZINC000180608590	276694997	/nfs/dbraw/zinc/69/49/97/276694997.db2.gz	RKWABSFRQIWGNJ-XJKSGUPXSA-N	0	3	312.417	2.441	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NC[C@@H]1CCCS1)c1ccccc1	ZINC000162889832	276801647	/nfs/dbraw/zinc/80/16/47/276801647.db2.gz	PAVHZTSGGICWRQ-GJZGRUSLSA-N	0	3	307.463	2.484	10	0		DEAEHN
C[C@@H]1COCC[C@H]1N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	ZINC000191691592	277943596	/nfs/dbraw/zinc/94/35/96/277943596.db2.gz	XBQAUXDYFFCJHB-KCPJHIHWSA-N	0	3	308.809	2.460	10	0		DEAEHN
CC(=O)NC1(C(=O)N[C@@H](C)CN2CCCCCC2)CCCCC1	ZINC000186308844	278084277	/nfs/dbraw/zinc/08/42/77/278084277.db2.gz	QWNMSZGOABWQRT-HNNXBMFYSA-N	0	3	323.481	2.206	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)NCCCc1ccccn1	ZINC000179171134	278186287	/nfs/dbraw/zinc/18/62/87/278186287.db2.gz	VDWNXQRQJUXRBY-OAHLLOKOSA-N	0	3	304.438	2.188	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)C1	ZINC000246898556	279321028	/nfs/dbraw/zinc/32/10/28/279321028.db2.gz	RKRRLUXILOPPRT-JJXSEGSLSA-N	0	3	321.465	2.118	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)NC1CCC(C)CC1	ZINC000177703738	279328538	/nfs/dbraw/zinc/32/85/38/279328538.db2.gz	TZVDNPOFRZGYBC-XGHPGWEVSA-N	0	3	309.498	2.486	10	0		DEAEHN
C[C@H](N[C@@H]1CCO[C@@H]1C1CC1)C(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C	ZINC000332993196	279515803	/nfs/dbraw/zinc/51/58/03/279515803.db2.gz	DDGKPDUSLJKLJF-ZFCIPKFXSA-N	0	3	308.466	2.473	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cccc2c1OCO2	ZINC000174995804	281193228	/nfs/dbraw/zinc/19/32/28/281193228.db2.gz	UROCAYSMAGXILF-QWHCGFSZSA-N	0	3	302.374	2.114	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccc2c(c1)OCCCO2	ZINC000247116213	288312830	/nfs/dbraw/zinc/31/28/30/288312830.db2.gz	IWEPYBRWNZDQID-HIFRSBDPSA-N	0	3	316.401	2.157	10	0		DEAEHN
Cc1nccn1CCCN(C)C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000122038687	281767159	/nfs/dbraw/zinc/76/71/59/281767159.db2.gz	WGUZHYYFTFVEBA-MRXNPFEDSA-N	0	3	323.485	2.199	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000122668937	289081432	/nfs/dbraw/zinc/08/14/32/289081432.db2.gz	BOHJAVLQDGOKHA-LOUJCGABSA-N	0	3	302.418	2.492	10	0		DEAEHN
C[C@H](C(=O)N1CCCCCC1)N1CC[C@@]2(O)CCCC[C@@H]2C1	ZINC000252643940	289267337	/nfs/dbraw/zinc/26/73/37/289267337.db2.gz	HWQSJOKEJUOZNK-NUJGCVRESA-N	0	3	308.466	2.405	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)N1CC[C@@]2(O)CCCC[C@H]2C1	ZINC000247993773	289564279	/nfs/dbraw/zinc/56/42/79/289564279.db2.gz	JRXCZZBWMUGOBP-RYRKJORJSA-N	0	3	323.481	2.197	10	0		DEAEHN
Cc1nc(CN2CCCC[C@H](N3CCN(C)CC3)C2)cs1	ZINC000162049097	293263760	/nfs/dbraw/zinc/26/37/60/293263760.db2.gz	OIXSYPDNVGIAJX-INIZCTEOSA-N	0	3	308.495	2.053	10	0		DEAEHN
NC(=O)NC(=O)CN[C@@H](c1ccc(Cl)cc1)C1CCCC1	ZINC000182556530	303271423	/nfs/dbraw/zinc/27/14/23/303271423.db2.gz	OCEDNTZAOBVTOV-CQSZACIVSA-N	0	3	309.797	2.356	10	0		DEAEHN
CC(C)[C@@H](C)CNC(=O)N1CCN(CC2CCOCC2)CC1	ZINC000172507797	325731565	/nfs/dbraw/zinc/73/15/65/325731565.db2.gz	IPYVKNZPNUXRJD-HNNXBMFYSA-N	0	3	311.470	2.032	10	0		DEAEHN
Cc1cc(CN2C[C@@H](F)C[C@H]2CNCc2c(C)noc2C)on1	ZINC000328637770	325757655	/nfs/dbraw/zinc/75/76/55/325757655.db2.gz	OUFMYHNSMFZNGU-KBPBESRZSA-N	0	3	322.384	2.290	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)CCCN(C)CC1(CO)CC1	ZINC000573813529	326095525	/nfs/dbraw/zinc/09/55/25/326095525.db2.gz	STNUPKGFXYODRB-UHFFFAOYSA-N	0	3	318.417	2.312	10	0		DEAEHN
C[C@H](NC[C@H](O)COCc1ccco1)c1ccc2c(c1)OCO2	ZINC000030536025	331852159	/nfs/dbraw/zinc/85/21/59/331852159.db2.gz	KFKKOUQTVYFTNN-JSGCOSHPSA-N	0	3	319.357	2.237	10	0		DEAEHN
COC[C@@H](C)CN[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000187795587	332987554	/nfs/dbraw/zinc/98/75/54/332987554.db2.gz	WOMGQSOTRNWMNF-RDJZCZTQSA-N	0	3	304.434	2.092	10	0		DEAEHN
COC[C@H](C)CN[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O	ZINC000188198287	333039252	/nfs/dbraw/zinc/03/92/52/333039252.db2.gz	PTEKHCRIKQWLJE-YGRLFVJLSA-N	0	3	314.788	2.457	10	0		DEAEHN
CCn1cc(Cl)c(C(=O)Nc2ccc(OC3CNC3)cc2)n1	ZINC000584619406	337373623	/nfs/dbraw/zinc/37/36/23/337373623.db2.gz	NEZWKTGAWZLPJC-UHFFFAOYSA-N	0	3	320.780	2.159	10	0		DEAEHN
C[C@@H](CNC(=O)c1ccc2c(c1)NC(=O)C2(C)C)N(C)C1CC1	ZINC000293077862	534040360	/nfs/dbraw/zinc/04/03/60/534040360.db2.gz	QCIYYXSXINNRHD-NSHDSACASA-N	0	3	315.417	2.129	10	0		DEAEHN
NC(=O)[C@@H]1CCCN1C1CCN(c2ccc3ccccc3n2)CC1	ZINC000301964294	534425668	/nfs/dbraw/zinc/42/56/68/534425668.db2.gz	NRDGZAWCCORFSA-KRWDZBQOSA-N	0	3	324.428	2.153	10	0		DEAEHN
CC(C)c1csc(CNC(=O)N2CC[C@H](N3CC=CC3)C2)n1	ZINC000121909492	519853537	/nfs/dbraw/zinc/85/35/37/519853537.db2.gz	OOGYVDSYKZUETN-ZDUSSCGKSA-N	0	3	320.462	2.422	10	0		DEAEHN
CCCC(=O)N[C@@H]1CCCN(CCCCCn2cccn2)C1	ZINC000104682557	519875520	/nfs/dbraw/zinc/87/55/20/519875520.db2.gz	QWFPQFCZXNTLPB-MRXNPFEDSA-N	0	3	306.454	2.434	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)N(C)[C@@H](C)CO)c1ccsc1	ZINC000129704473	520835038	/nfs/dbraw/zinc/83/50/38/520835038.db2.gz	LECKCAVNSSMSCP-JSGCOSHPSA-N	0	3	313.467	2.153	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)NCCCc1nc(C(C)C)no1	ZINC000104342545	521588921	/nfs/dbraw/zinc/58/89/21/521588921.db2.gz	IEOZTSQJLPYGOK-CYBMUJFWSA-N	0	3	308.426	2.116	10	0		DEAEHN
CCc1nc(CNC(=O)NC[C@H]2CCCCN2CC)cs1	ZINC000111498299	522333408	/nfs/dbraw/zinc/33/34/08/522333408.db2.gz	SYGVGWPSRNDBMQ-CYBMUJFWSA-N	0	3	310.467	2.379	10	0		DEAEHN
COC[C@@](C)(CCO)NCCOc1ccccc1C(F)(F)F	ZINC000132548621	522522206	/nfs/dbraw/zinc/52/22/06/522522206.db2.gz	IAVFOXYQJZDVFO-CQSZACIVSA-N	0	3	321.339	2.461	10	0		DEAEHN
COc1cc(OC)c(CN[C@@H](C)CCn2cccn2)c(OC)c1	ZINC000157613289	522797505	/nfs/dbraw/zinc/79/75/05/522797505.db2.gz	XBGZOMFGOLOXEJ-ZDUSSCGKSA-N	0	3	319.405	2.477	10	0		DEAEHN
CN(Cc1ccccc1)CC(C)(C)NC(=O)NCC1(C)COC1	ZINC000158488799	523342871	/nfs/dbraw/zinc/34/28/71/523342871.db2.gz	RYVDGIMWABDDFE-UHFFFAOYSA-N	0	3	319.449	2.233	10	0		DEAEHN
COC(=O)[C@@H](C)Oc1ccc(CN(C)C[C@@H]2CCCO2)cc1	ZINC000128111025	523551748	/nfs/dbraw/zinc/55/17/48/523551748.db2.gz	CVTBRJZVSRWBME-CJNGLKHVSA-N	0	3	307.390	2.238	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NCc1ccc(C)c(F)c1	ZINC000111413460	523828179	/nfs/dbraw/zinc/82/81/79/523828179.db2.gz	FNFXNVHQCCJKDW-OAHLLOKOSA-N	0	3	323.412	2.044	10	0		DEAEHN
COC(=O)[C@H](C)Oc1ccc(CN(C)C[C@@H]2CCCO2)cc1	ZINC000128110807	523886766	/nfs/dbraw/zinc/88/67/66/523886766.db2.gz	CVTBRJZVSRWBME-BBRMVZONSA-N	0	3	307.390	2.238	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(Br)cc1	ZINC000450677598	534788479	/nfs/dbraw/zinc/78/84/79/534788479.db2.gz	RONPLPQGVDDKLP-ZANVPECISA-N	0	3	300.196	2.440	10	0		DEAEHN
Cc1cnc(CCN(C)C(=O)NC[C@@H](C)N(C)C2CC2)s1	ZINC000121314535	525991638	/nfs/dbraw/zinc/99/16/38/525991638.db2.gz	LMDLSMRFZMOSGR-LLVKDONJSA-N	0	3	310.467	2.118	10	0		DEAEHN
C[C@H](C(=O)NC1CCCCC1)N1CC[C@]2(O)CCCC[C@H]2C1	ZINC000247968049	526034131	/nfs/dbraw/zinc/03/41/31/526034131.db2.gz	IJGPTBQBQJJMQV-RVKKMQEKSA-N	0	3	308.466	2.451	10	0		DEAEHN
C/C=C\C[C@H](NC(=O)[C@H](C)N1[C@H](C)CC[C@H]1C)C(=O)OCC	ZINC000444309634	526333309	/nfs/dbraw/zinc/33/33/09/526333309.db2.gz	AQZXKOYQBULULT-PNOBCODNSA-N	0	3	310.438	2.262	10	0		DEAEHN
CC(=O)N[C@H]1CCCN(CCCc2ccc3c(c2)CCO3)C1	ZINC000192617984	526901785	/nfs/dbraw/zinc/90/17/85/526901785.db2.gz	QVNSQLFLNSHHTM-KRWDZBQOSA-N	0	3	302.418	2.155	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC(Oc2ccc(F)nc2)CC1)N(C)C	ZINC000191134282	535310078	/nfs/dbraw/zinc/31/00/78/535310078.db2.gz	KPTKAHQDMSGZQA-HNNXBMFYSA-N	0	3	323.412	2.321	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCN(C2CCCCC2)CC1	ZINC000361877454	535362835	/nfs/dbraw/zinc/36/28/35/535362835.db2.gz	NQLWTLBBHBCACH-KRWDZBQOSA-N	0	3	307.482	2.338	10	0		DEAEHN
CCN1CCC(N(C)C(=O)C(=O)c2ccc3c(c2)CCC3)CC1	ZINC000357293588	535455511	/nfs/dbraw/zinc/45/55/11/535455511.db2.gz	VFRCBWXAHLYDQP-UHFFFAOYSA-N	0	3	314.429	2.301	10	0		DEAEHN
CCOc1ncccc1CNC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000079196472	535596282	/nfs/dbraw/zinc/59/62/82/535596282.db2.gz	FWSKWHNECAUFIT-HNNXBMFYSA-N	0	3	322.453	2.256	10	0		DEAEHN
CCOc1cc(/C=C\C(=O)N[C@H]2CCCN(CC)C2)ccc1O	ZINC000493445509	535660614	/nfs/dbraw/zinc/66/06/14/535660614.db2.gz	BFDOBEIPTUMTPA-WWRUEGTHSA-N	0	3	318.417	2.405	10	0		DEAEHN
CN(C)C[C@H](NC(=O)N[C@@H]1C[C@H]2OCCC[C@H]12)c1ccccc1	ZINC000190493031	535952302	/nfs/dbraw/zinc/95/23/02/535952302.db2.gz	FIYZYVNOGWBOLP-WCXIOVBPSA-N	0	3	317.433	2.156	10	0		DEAEHN
CCc1ccccc1NC(=O)[C@@H](C)N1CCN2CCC[C@H]2C1	ZINC000247015241	535959164	/nfs/dbraw/zinc/95/91/64/535959164.db2.gz	CJQYGLCHHPZPTL-ZBFHGGJFSA-N	0	3	301.434	2.356	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N[C@@H]2CCC[C@H]3OCC[C@H]32)cc1	ZINC000246907773	535997947	/nfs/dbraw/zinc/99/79/47/535997947.db2.gz	FCXHLYQLBTZUCX-GVDBMIGSSA-N	0	3	302.418	2.436	10	0		DEAEHN
CC(C)(C)OC(=O)NC[C@H]1CCC[C@]2(C1)NCCc1nc[nH]c12	ZINC000724101900	563496205	/nfs/dbraw/zinc/49/62/05/563496205.db2.gz	RVRZWRHKXSIWJF-YVEFUNNKSA-N	0	3	320.437	2.466	10	0		DEAEHN
Nc1nc(N[C@@H]2CCN(Cc3ccccc3)C2)nc(C2CC2)n1	ZINC000309785004	625570043	/nfs/dbraw/zinc/57/00/43/625570043.db2.gz	GDXGTUQBVQYLED-CQSZACIVSA-N	0	3	310.405	2.018	10	0		DEAEHN
CN(C[C@@H]1CCCN(C)C1)S(=O)(=O)/C=C\c1ccccc1	ZINC000255318411	624161395	/nfs/dbraw/zinc/16/13/95/624161395.db2.gz	FQSPPJWNSAZXAJ-UILAEWCASA-N	0	3	308.447	2.261	10	0		DEAEHN
CC(=O)N1CCC[C@@H]1C(=O)C(C#N)c1nc2ccccc2s1	ZINC000041500961	641584840	/nfs/dbraw/zinc/58/48/40/641584840.db2.gz	USRZQIIJGHXVHS-DGCLKSJQSA-N	0	3	313.382	2.483	10	0		DEAEHN
CCNC(=O)N1CC[C@@H](N[C@H]2CCc3nc(Cl)ccc32)C1	ZINC000806148927	645803000	/nfs/dbraw/zinc/80/30/00/645803000.db2.gz	ZPAYBDGIERNDBD-PWSUYJOCSA-N	0	3	308.813	2.116	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccc(-n2ccnc2)cc1)N(C)C	ZINC000179649265	648404332	/nfs/dbraw/zinc/40/43/32/648404332.db2.gz	OOYQOILUNWSLFV-INIZCTEOSA-N	0	3	300.406	2.219	10	0		DEAEHN
COCc1ccsc1C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000181432503	648653443	/nfs/dbraw/zinc/65/34/43/648653443.db2.gz	IANXHMVOCHBCGF-LLVKDONJSA-N	0	3	315.354	2.251	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)CCCN1c1ncc(C=O)cn1	ZINC000382655018	685405689	/nfs/dbraw/zinc/40/56/89/685405689.db2.gz	HYEGYVCADSLKIH-OAHLLOKOSA-N	0	3	310.401	2.390	10	0		DEAEHN
CCCCCCNC(=O)[C@@H]1CCCN(C[C@H](O)C(F)(F)F)C1	ZINC000121133122	684105501	/nfs/dbraw/zinc/10/55/01/684105501.db2.gz	SBSPHRSZBLHPOV-OLZOCXBDSA-N	0	3	324.387	2.318	10	0		DEAEHN
C[C@H](Cn1ncc2ccccc2c1=O)NCc1ccc(F)nc1	ZINC000189172469	684374904	/nfs/dbraw/zinc/37/49/04/684374904.db2.gz	LSUHFWVYEYTXMO-GFCCVEGCSA-N	0	3	312.348	2.109	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)/C(C)=C/c1ccc(F)cc1	ZINC000176494781	782474040	/nfs/dbraw/zinc/47/40/40/782474040.db2.gz	PARUWCLXTIYWCT-ABDJAZHISA-N	0	3	320.408	2.456	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@H](CCO)C1CCCC1	ZINC000725106777	777586738	/nfs/dbraw/zinc/58/67/38/777586738.db2.gz	ZNPWPLLVDKBTKB-GFCCVEGCSA-N	0	3	316.243	2.213	10	0		DEAEHN
C[C@@H]1C[C@@H](CNCc2cn(C)nc2Br)[C@@H](C)O1	ZINC000712499155	792190005	/nfs/dbraw/zinc/19/00/05/792190005.db2.gz	WHJFOYFZWHMAAX-BBBLOLIVSA-N	0	3	302.216	2.086	10	0		DEAEHN
CC1(C)CCNCCN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000712506918	792190542	/nfs/dbraw/zinc/19/05/42/792190542.db2.gz	OEBNQISPHZOCJR-UHFFFAOYSA-N	0	3	302.827	2.103	10	0		DEAEHN
CCCn1cc([C@H](C)NCCN(C)Cc2ccccc2)nn1	ZINC000715881227	792530837	/nfs/dbraw/zinc/53/08/37/792530837.db2.gz	IVRBIJGUUACPGF-HNNXBMFYSA-N	0	3	301.438	2.471	10	0		DEAEHN
CC(C)[C@@H]1C[C@H](NCc2cn(C)nc2Br)CCO1	ZINC000720661159	1085821230	/nfs/dbraw/zinc/82/12/30/1085821230.db2.gz	QZIZVPUMQPWEQO-NEPJUHHUSA-N	0	3	316.243	2.476	10	0		DEAEHN
CN1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cccnc1Br	ZINC000720829357	1086184734	/nfs/dbraw/zinc/18/47/34/1086184734.db2.gz	MBWJUDTWGVJCSL-NWDGAFQWSA-N	0	3	324.222	2.153	10	0		DEAEHN
CN1CCC[C@@H]2[C@H]1CCN2C(=O)c1cccc(Br)n1	ZINC000720829373	1086186047	/nfs/dbraw/zinc/18/60/47/1086186047.db2.gz	MBYXZIBDHZXNEQ-VXGBXAGGSA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C)c1cnn(C)c1	ZINC000700737923	1086332867	/nfs/dbraw/zinc/33/28/67/1086332867.db2.gz	VQAFPUZZTZZSGQ-MBNYWOFBSA-N	0	3	308.426	2.469	10	0		DEAEHN
COC1(OC)CC[C@H]1NC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000710947383	1086691533	/nfs/dbraw/zinc/69/15/33/1086691533.db2.gz	NYFFRAPUQGLUTG-CHWSQXEVSA-N	0	3	316.442	2.277	10	0		DEAEHN
C[C@H]1[C@@H](NC(=O)c2c(F)cccc2Br)CCN1C	ZINC000719388967	1089080046	/nfs/dbraw/zinc/08/00/46/1089080046.db2.gz	UBBKVVKOMFTONQ-KWQFWETISA-N	0	3	315.186	2.411	10	0		DEAEHN
CN[C@H]1c2ccccc2OC[C@@H]1Sc1nnc(N(C)C)s1	ZINC000081769399	192323170	/nfs/dbraw/zinc/32/31/70/192323170.db2.gz	VQKDAHAGDUIFMJ-RYUDHWBXSA-N	0	3	322.459	2.418	10	0		DEAEHN
N[C@@H](CSc1ncccn1)c1ccc2c(c1)OCCCO2	ZINC000081871163	192332876	/nfs/dbraw/zinc/33/28/76/192332876.db2.gz	FKFMELHATKZXNA-LBPRGKRZSA-N	0	3	303.387	2.430	10	0		DEAEHN
CN[C@@H](C)[C@H](C)S(=O)(=O)c1ccccc1Br	ZINC000081931604	192341192	/nfs/dbraw/zinc/34/11/92/192341192.db2.gz	NOBJQKMATTWVFM-IUCAKERBSA-N	0	3	306.225	2.219	10	0		DEAEHN
CN[C@@H]1CCC[C@@H]1S(=O)(=O)c1ccc(Br)cc1	ZINC000081933388	192341201	/nfs/dbraw/zinc/34/12/01/192341201.db2.gz	CERPDEJWLOIVLO-NEPJUHHUSA-N	0	3	318.236	2.363	10	0		DEAEHN
COCCNCCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000081930554	192341503	/nfs/dbraw/zinc/34/15/03/192341503.db2.gz	GZMWOLCEUSDZJY-UHFFFAOYSA-N	0	3	313.463	2.384	10	0		DEAEHN
N[C@H]1CCC[C@@H]1S(=O)(=O)c1ccccc1Br	ZINC000081932221	192341727	/nfs/dbraw/zinc/34/17/27/192341727.db2.gz	ZRJMOIDTZCOAHG-ONGXEEELSA-N	0	3	304.209	2.103	10	0		DEAEHN
CN(C)C[C@H]1COCCN1C(=O)c1ccc(C(F)(F)F)cc1	ZINC000085469913	282141087	/nfs/dbraw/zinc/14/10/87/282141087.db2.gz	GJEXDIINBQYGSN-ZDUSSCGKSA-N	0	3	316.323	2.108	10	0		DEAEHN
CCN[C@H](C)[C@H](C)S(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000081936151	192343380	/nfs/dbraw/zinc/34/33/80/192343380.db2.gz	YYHVNYYOKMGJPU-NEPJUHHUSA-N	0	3	313.419	2.008	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N2CCCN(C3CC3)CC2)cc1	ZINC000194674393	282146292	/nfs/dbraw/zinc/14/62/92/282146292.db2.gz	NVEMBVNYHFVDTR-UHFFFAOYSA-N	0	3	301.434	2.059	10	0		DEAEHN
CN[C@H](CS(=O)(=O)CCOC)c1cccc2ccccc21	ZINC000081943613	192344719	/nfs/dbraw/zinc/34/47/19/192344719.db2.gz	BMTPBRNJQAWPRV-MRXNPFEDSA-N	0	3	307.415	2.162	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NC[C@H](c1ccco1)N(C)C	ZINC000079192869	185161414	/nfs/dbraw/zinc/16/14/14/185161414.db2.gz	JDYJITTWPUNIRP-LSDHHAIUSA-N	0	3	324.469	2.158	10	0		DEAEHN
COc1cccc(Cl)c1CC(=O)NC[C@@H]1CCCN(C)C1	ZINC000153499982	282172154	/nfs/dbraw/zinc/17/21/54/282172154.db2.gz	WNSQUKKOEGNXNF-LBPRGKRZSA-N	0	3	310.825	2.349	10	0		DEAEHN
C[C@@H]1CNCCN1c1ccccc1I	ZINC000083086709	185213161	/nfs/dbraw/zinc/21/31/61/185213161.db2.gz	BDMGYNJTTNNQHR-SECBINFHSA-N	0	3	302.159	2.089	10	0		DEAEHN
CCc1nnc(CN(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)o1	ZINC000328656740	231293193	/nfs/dbraw/zinc/29/31/93/231293193.db2.gz	ZQKDATXJWFAJLA-YOEHRIQHSA-N	0	3	315.421	2.152	10	0		DEAEHN
CCC[C@@H](C[NH3+])[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000087404216	185223732	/nfs/dbraw/zinc/22/37/32/185223732.db2.gz	VWCTZVRCMZEQJR-QMMMGPOBSA-N	0	3	311.234	2.399	10	0		DEAEHN
Cn1ccnc1CC1CCN(C(=O)c2ccc3cncn3c2)CC1	ZINC000328802261	231351808	/nfs/dbraw/zinc/35/18/08/231351808.db2.gz	JPHYIXVYRWXSSW-UHFFFAOYSA-N	0	3	323.400	2.163	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccc3nc(N)sc3c2)C1	ZINC000087847434	185233373	/nfs/dbraw/zinc/23/33/73/185233373.db2.gz	HHEGWLSKAZVNRM-LLVKDONJSA-N	0	3	304.419	2.093	10	0		DEAEHN
CN1CCCC[C@H]1COc1ncc(Br)cc1CO	ZINC000088165951	185241037	/nfs/dbraw/zinc/24/10/37/185241037.db2.gz	BVAHNZSMEGRGIB-LBPRGKRZSA-N	0	3	315.211	2.200	10	0		DEAEHN
CN[C@H]1CCN(c2cc(Cl)ccc2Br)C1=O	ZINC000088123205	185239992	/nfs/dbraw/zinc/23/99/92/185239992.db2.gz	WYHXOTQVZKDTNY-VIFPVBQESA-N	0	3	303.587	2.427	10	0		DEAEHN
CN(C)C[C@H](O)CNc1ccc(Cl)cc1Br	ZINC000088122949	185240149	/nfs/dbraw/zinc/24/01/49/185240149.db2.gz	KVQUWKGROWCRMC-SECBINFHSA-N	0	3	307.619	2.437	10	0		DEAEHN
CC[C@H](CN)S(=O)(=O)N[C@H](C)C12CC3CC(CC(C3)C1)C2	ZINC000088471907	185252074	/nfs/dbraw/zinc/25/20/74/185252074.db2.gz	ASVDHEULBKBTQO-QCJFITJRSA-N	0	3	314.495	2.248	10	0		DEAEHN
Nc1ccc(=O)n(CCCN2CCC[C@H](C(F)(F)F)C2)c1	ZINC000088416975	185249225	/nfs/dbraw/zinc/24/92/25/185249225.db2.gz	SLPPBJHHJDRIOD-NSHDSACASA-N	0	3	303.328	2.095	10	0		DEAEHN
COc1cc(C[NH2+][C@@H](C)CCCO)cc(Br)c1[O-]	ZINC000088503444	185254391	/nfs/dbraw/zinc/25/43/91/185254391.db2.gz	YKRDQDWIGMNQCN-VIFPVBQESA-N	0	3	318.211	2.414	10	0		DEAEHN
CC(C)CC[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)(C)C)o1	ZINC000088542023	185256174	/nfs/dbraw/zinc/25/61/74/185256174.db2.gz	NRDKVYWVFQLOKL-UHFFFAOYSA-N	0	3	302.440	2.492	10	0		DEAEHN
CC(C)CN(C)S(=O)(=O)c1ccc(CNC(C)(C)C)o1	ZINC000088543727	185256649	/nfs/dbraw/zinc/25/66/49/185256649.db2.gz	RQLOLPQORNZSNZ-UHFFFAOYSA-N	0	3	302.440	2.444	10	0		DEAEHN
CCCNCc1ccc(S(=O)(=O)N(C)[C@H](C)C(C)C)o1	ZINC000088543849	185256707	/nfs/dbraw/zinc/25/67/07/185256707.db2.gz	RZDFJKQKYKPZIS-GFCCVEGCSA-N	0	3	302.440	2.444	10	0		DEAEHN
N[C@@H]1CCCC[C@@H]1S(=O)(=O)c1cccc(Br)c1	ZINC000081982818	192349818	/nfs/dbraw/zinc/34/98/18/192349818.db2.gz	VZGDCABSKIKGPB-NEPJUHHUSA-N	0	3	318.236	2.493	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@H]1S(=O)(=O)c1cccc(Cl)c1	ZINC000081982183	192349967	/nfs/dbraw/zinc/34/99/67/192349967.db2.gz	XPTQWDBTHQVZHO-ZIAGYGMSSA-N	0	3	317.838	2.271	10	0		DEAEHN
CCN[C@@H](c1ccccc1)[C@H](C)S(=O)(=O)C1CCOCC1	ZINC000081989523	192350920	/nfs/dbraw/zinc/35/09/20/192350920.db2.gz	MMRFEZFNCDIPFR-XJKSGUPXSA-N	0	3	311.447	2.320	10	0		DEAEHN
C[C@H](NC[C@H](O)CO)c1cc2cc(Br)ccc2o1	ZINC000090282333	185289340	/nfs/dbraw/zinc/28/93/40/185289340.db2.gz	VQJDSDMXTQQEBU-KWQFWETISA-N	0	3	314.179	2.199	10	0		DEAEHN
CC[C@@H](NC[C@@](C)(O)CO)c1cccc(Br)c1	ZINC000090284465	185289453	/nfs/dbraw/zinc/28/94/53/185289453.db2.gz	QONJQHUWRPGOTB-CHWSQXEVSA-N	0	3	302.212	2.233	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1cc(Cl)cc2cccnc21	ZINC000090432813	185295795	/nfs/dbraw/zinc/29/57/95/185295795.db2.gz	ZWHYTUHNMOOISZ-YPMHNXCESA-N	0	3	305.765	2.061	10	0		DEAEHN
CC(C)Oc1ccc(NC(=O)[C@]2(C)COC[C@H]2N)cc1Cl	ZINC000090588731	185305657	/nfs/dbraw/zinc/30/56/57/185305657.db2.gz	RGKOLTABLDODMJ-UKRRQHHQSA-N	0	3	312.797	2.430	10	0		DEAEHN
O=C(c1ccno1)N1CCCSC[C@H]1CN1CCCCC1	ZINC000090701137	185310466	/nfs/dbraw/zinc/31/04/66/185310466.db2.gz	QEJPAOOOCDMYHG-CYBMUJFWSA-N	0	3	309.435	2.108	10	0		DEAEHN
CCCN[C@H]1c2cc(OC)ccc2CC[C@@H]1S(=O)(=O)CC	ZINC000092388567	185315262	/nfs/dbraw/zinc/31/52/62/185315262.db2.gz	JDSMTJLKZFMYEB-HOTGVXAUSA-N	0	3	311.447	2.485	10	0		DEAEHN
CN1CCC(n2c(N)nc3cc(Br)cnc32)CC1	ZINC000092575300	185326695	/nfs/dbraw/zinc/32/66/95/185326695.db2.gz	MAVAVOLDLBZXMW-UHFFFAOYSA-N	0	3	310.199	2.043	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(Cl)ccc1NN	ZINC000092675447	185333225	/nfs/dbraw/zinc/33/32/25/185333225.db2.gz	PLUKTRBCHGUYQP-LBPRGKRZSA-N	0	3	310.829	2.182	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C1(C(N)=S)CCCCC1	ZINC000092631811	185330596	/nfs/dbraw/zinc/33/05/96/185330596.db2.gz	NMSZJLKELRPOJF-CYBMUJFWSA-N	0	3	311.495	2.166	10	0		DEAEHN
C[NH+](C)C1CCN(c2cc3c(cc2Cl)C(=O)C(=O)[N-]3)CC1	ZINC000092772361	185339854	/nfs/dbraw/zinc/33/98/54/185339854.db2.gz	RBTVISQIADNYOA-UHFFFAOYSA-N	0	3	307.781	2.005	10	0		DEAEHN
CN(C)[C@@H](CNC(=O)CN1CCCC1(C)C)c1ccccc1	ZINC000184580726	282255104	/nfs/dbraw/zinc/25/51/04/282255104.db2.gz	GERXJYDOUAHZCZ-INIZCTEOSA-N	0	3	303.450	2.280	10	0		DEAEHN
CCN[C@@H]1c2cc(OC)ccc2C[C@H]1Sc1nncn1C	ZINC000092860535	185347092	/nfs/dbraw/zinc/34/70/92/185347092.db2.gz	YRZXHKKBFXQRQU-ZIAGYGMSSA-N	0	3	304.419	2.191	10	0		DEAEHN
C[C@@H]1C[C@H](NCc2cc(C(N)=O)co2)CN1Cc1ccccc1	ZINC000189411298	282309035	/nfs/dbraw/zinc/30/90/35/282309035.db2.gz	MPEBUXJYLNVPRL-CJNGLKHVSA-N	0	3	313.401	2.131	10	0		DEAEHN
CS[C@H]1CN(C(=O)c2cc(C)[nH]c2C)C[C@H]1N1CCCC1	ZINC000614279327	362338373	/nfs/dbraw/zinc/33/83/73/362338373.db2.gz	VBQZMBPXCWWLCG-CABCVRRESA-N	0	3	307.463	2.283	10	0		DEAEHN
COC(=O)C(C)(C)[C@H](NC[C@@H](O)CSC)c1ccccc1	ZINC000614567749	362410267	/nfs/dbraw/zinc/41/02/67/362410267.db2.gz	LJHWGIHIKOMXGL-ZIAGYGMSSA-N	0	3	311.447	2.240	10	0		DEAEHN
c1n[nH]cc1CN1CCN(C[C@H]2CCc3ccccc3C2)CC1	ZINC000625475245	365801733	/nfs/dbraw/zinc/80/17/33/365801733.db2.gz	ZKBPHCNBQUTYAL-INIZCTEOSA-N	0	3	310.445	2.332	10	0		DEAEHN
C[C@@H](NC(=O)C[C@@H]1CSCCN1)c1cc(F)ccc1F	ZINC000091134714	539418363	/nfs/dbraw/zinc/41/83/63/539418363.db2.gz	ULEOUNBQOVTTAC-MWLCHTKSSA-N	0	3	300.374	2.237	10	0		DEAEHN
OCC[C@@]1(CN[C@@H]2CCCOc3ccc(F)cc32)CCOC1	ZINC000125523667	539473400	/nfs/dbraw/zinc/47/34/00/539473400.db2.gz	TUJMKSAPJIGWNC-WBVHZDCISA-N	0	3	309.381	2.418	10	0		DEAEHN
CC[C@H](NCCCNC(=O)c1cccs1)c1nccn1C	ZINC000183264073	199564492	/nfs/dbraw/zinc/56/44/92/199564492.db2.gz	MGHCAKUHBPUOMT-LBPRGKRZSA-N	0	3	306.435	2.342	10	0		DEAEHN
COC(=O)C(C)(C)[C@H]1CCCN(C[C@@H](O)CC(F)(F)F)C1	ZINC000615794711	362704415	/nfs/dbraw/zinc/70/44/15/362704415.db2.gz	PCOMMJZSQACRJX-QWRGUYRKSA-N	0	3	311.344	2.211	10	0		DEAEHN
CS[C@H]1CN(C(=O)Nc2ccc(C)nc2)C[C@H]1N1CCCC1	ZINC000615932974	362735307	/nfs/dbraw/zinc/73/53/07/362735307.db2.gz	XKDHRBJJEYVZDH-CABCVRRESA-N	0	3	320.462	2.434	10	0		DEAEHN
COC(=O)c1cnc(-c2cccc(F)c2)nc1[C@@H]1CCCN1	ZINC000616579301	362894312	/nfs/dbraw/zinc/89/43/12/362894312.db2.gz	QBGQDEVIEXLYIK-ZDUSSCGKSA-N	0	3	301.321	2.494	10	0		DEAEHN
O=C1CCCN1C[C@@H](O)CNC1(c2ccc(Cl)cc2)CCC1	ZINC000178839700	539637440	/nfs/dbraw/zinc/63/74/40/539637440.db2.gz	HFZWDVZPCYTSQA-HNNXBMFYSA-N	0	3	322.836	2.292	10	0		DEAEHN
CC[C@@H]1CN(c2ncnc3c(C)cccc32)CCN1C[C@@H](C)O	ZINC000177929632	539633065	/nfs/dbraw/zinc/63/30/65/539633065.db2.gz	BPRIPESMJMOFLS-HUUCEWRRSA-N	0	3	314.433	2.220	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(Br)cn1	ZINC000083550236	192372648	/nfs/dbraw/zinc/37/26/48/192372648.db2.gz	UORFEHKHFAXYTN-ZYHUDNBSSA-N	0	3	324.222	2.153	10	0		DEAEHN
N[C@H](C[S@@](=O)c1ccccc1F)c1ccc2c(c1)OCO2	ZINC000084001290	192395796	/nfs/dbraw/zinc/39/57/96/192395796.db2.gz	BRLNHKWOLWZPJZ-GTJPDFRWSA-N	0	3	307.346	2.362	10	0		DEAEHN
COc1cc2c(c(F)c1)CN(CCc1nccs1)[C@H]2CN	ZINC000071683458	191006528	/nfs/dbraw/zinc/00/65/28/191006528.db2.gz	USHIPOCGMJPFEE-AWEZNQCLSA-N	0	3	307.394	2.349	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)Nc2cnn(C(C)(C)C)c2)C1	ZINC000245541812	539757013	/nfs/dbraw/zinc/75/70/13/539757013.db2.gz	QTMKZHRKHJWDNW-TZMCWYRMSA-N	0	3	307.442	2.488	10	0		DEAEHN
CC[C@H]1CCCCN1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138444836	186017296	/nfs/dbraw/zinc/01/72/96/186017296.db2.gz	BZVOBAGUYFGEDX-NSHDSACASA-N	0	3	318.389	2.377	10	0		DEAEHN
COc1cc(CNCCc2ncc[nH]2)c(SC)cc1OC	ZINC000139171381	186020190	/nfs/dbraw/zinc/02/01/90/186020190.db2.gz	IARMEUCQLXWDDR-UHFFFAOYSA-N	0	3	307.419	2.481	10	0		DEAEHN
C[C@H]1CCC[C@H](CN)N1[C@@H]1CCS(=O)(=O)c2ccccc21	ZINC000147723291	186041409	/nfs/dbraw/zinc/04/14/09/186041409.db2.gz	YQFPXOBVWQURQL-GZBFAFLISA-N	0	3	308.447	2.107	10	0		DEAEHN
O=C1N(CCN2CCCCC2)[C@@H](c2ccsc2)NC12CC2	ZINC000144043088	186034417	/nfs/dbraw/zinc/03/44/17/186034417.db2.gz	XSUCEMUSLGZVSQ-AWEZNQCLSA-N	0	3	305.447	2.197	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2ccsc2)N(CCN2CCCCC2)C1=O	ZINC000144076988	186035155	/nfs/dbraw/zinc/03/51/55/186035155.db2.gz	COSRYUYNSMLUNG-LSDHHAIUSA-N	0	3	307.463	2.443	10	0		DEAEHN
CCCNc1cc(NCCN(C)CCOC)nc(SC)n1	ZINC000149293897	186048928	/nfs/dbraw/zinc/04/89/28/186048928.db2.gz	BHZZRVXKDXYHHY-UHFFFAOYSA-N	0	3	313.471	2.011	10	0		DEAEHN
CN[C@H](c1cccc(OC(F)(F)F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000150093252	186054521	/nfs/dbraw/zinc/05/45/21/186054521.db2.gz	GZPINDMAPOUQIS-ZYHUDNBSSA-N	0	3	323.336	2.280	10	0		DEAEHN
COc1ccccc1N1CCC(NC(=O)CN(C)C(C)C)CC1	ZINC000150230075	186055872	/nfs/dbraw/zinc/05/58/72/186055872.db2.gz	VRZMYWSCRRFMTL-UHFFFAOYSA-N	0	3	319.449	2.120	10	0		DEAEHN
NCc1nc([C@@H]2CCS(=O)(=O)C2)sc1-c1ccccc1	ZINC000150325301	186056541	/nfs/dbraw/zinc/05/65/41/186056541.db2.gz	HZSOQBUHYJXGNY-LLVKDONJSA-N	0	3	308.428	2.171	10	0		DEAEHN
COc1ccc2c(c1)C(=O)N(C)C1(CCN(CC3CC3)CC1)N2	ZINC000072275145	191097413	/nfs/dbraw/zinc/09/74/13/191097413.db2.gz	HHFWTHBVLLESSL-UHFFFAOYSA-N	0	3	315.417	2.395	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@](C)(O)c1ccccc1Cl)N(C)C	ZINC000155865887	186118899	/nfs/dbraw/zinc/11/88/99/186118899.db2.gz	TVTDMZZPRSZTSC-ZBFHGGJFSA-N	0	3	312.841	2.394	10	0		DEAEHN
NCc1ccccc1NC(=O)C[S@@](=O)c1ccc(F)cc1	ZINC000155918161	186122896	/nfs/dbraw/zinc/12/28/96/186122896.db2.gz	AADZKNXOXYCRLH-NRFANRHFSA-N	0	3	306.362	2.031	10	0		DEAEHN
CN1C(=O)CC[C@H](NCc2c[nH]c3cc(Cl)ccc23)C1=O	ZINC000163890633	186141374	/nfs/dbraw/zinc/14/13/74/186141374.db2.gz	BSEGBKFFWQLSFE-LBPRGKRZSA-N	0	3	305.765	2.058	10	0		DEAEHN
COc1ccc(CCNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1	ZINC000173285082	186172147	/nfs/dbraw/zinc/17/21/47/186172147.db2.gz	KNGPVWPRSCSODL-GDBMZVCRSA-N	0	3	319.449	2.362	10	0		DEAEHN
C[C@@H]1C[C@@H](C)N(S(=O)(=O)c2ccc(CN)c(Cl)c2)C1	ZINC000164243671	186153442	/nfs/dbraw/zinc/15/34/42/186153442.db2.gz	LYHMFIUILXHAML-NXEZZACHSA-N	0	3	302.827	2.218	10	0		DEAEHN
N[C@H](C[C@H]1CCS(=O)(=O)C1)c1cscc1Br	ZINC000164381866	186157975	/nfs/dbraw/zinc/15/79/75/186157975.db2.gz	SWPVFICRSZIOFN-GMSGAONNSA-N	0	3	324.265	2.335	10	0		DEAEHN
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1CCN2CCC[C@@H]2C1	ZINC000171905033	198005356	/nfs/dbraw/zinc/00/53/56/198005356.db2.gz	YIHBZWSFUBBLFP-OWCLPIDISA-N	0	3	303.381	2.171	10	0		DEAEHN
CCn1cnnc1[C@@H]1CCCN(CCc2scnc2C)C1	ZINC000172532060	198110981	/nfs/dbraw/zinc/11/09/81/198110981.db2.gz	YRFUPYDWQIYYDD-CYBMUJFWSA-N	0	3	305.451	2.485	10	0		DEAEHN
CCN(C(=O)c1ccncc1Br)[C@@H]1CCN(C)C1	ZINC000617553698	363180073	/nfs/dbraw/zinc/18/00/73/363180073.db2.gz	OECRHPQPQUSTRT-SNVBAGLBSA-N	0	3	312.211	2.010	10	0		DEAEHN
Cc1cccc(CS(=O)(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000173274207	198205002	/nfs/dbraw/zinc/20/50/02/198205002.db2.gz	BHWGYCJRQUISCR-GDBMZVCRSA-N	0	3	310.463	2.239	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN(CCC(=O)OC(C)C)C2)n1	ZINC000173779645	198250923	/nfs/dbraw/zinc/25/09/23/198250923.db2.gz	RLGZJVUWLNMISK-HNNXBMFYSA-N	0	3	305.422	2.466	10	0		DEAEHN
CCOC(=O)[C@@H](CC)N1CC[C@H](CNc2cccc(C)n2)C1	ZINC000173779878	198251104	/nfs/dbraw/zinc/25/11/04/198251104.db2.gz	COXWBQQWQVGDEL-HUUCEWRRSA-N	0	3	305.422	2.466	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2ccc3c(c2)OCCO3)CCN1C	ZINC000174112978	198292698	/nfs/dbraw/zinc/29/26/98/198292698.db2.gz	RNWFDOSZCIKUOW-TZMCWYRMSA-N	0	3	319.405	2.404	10	0		DEAEHN
CSc1nc(C2CC2)nc(C)c1C(=O)N1CC[C@H](N(C)C)C1	ZINC000174583942	198355250	/nfs/dbraw/zinc/35/52/50/198355250.db2.gz	SJNXBIWRKYNAFA-LBPRGKRZSA-N	0	3	320.462	2.160	10	0		DEAEHN
Cc1ccc([C@H](O)CN2CCC(Nc3cccnn3)CC2)cc1	ZINC000174781209	198384350	/nfs/dbraw/zinc/38/43/50/198384350.db2.gz	URIYGTNAVOOYCL-QGZVFWFLSA-N	0	3	312.417	2.395	10	0		DEAEHN
COc1cc2c(cc1O)C(=O)O[C@@H]1CC=C3CCN(C)[C@H]3[C@H]21	ZINC000004102398	181073334	/nfs/dbraw/zinc/07/33/34/181073334.db2.gz	VLDOBKJPRUQEEC-FVQBIDKESA-N	0	3	301.342	2.058	10	0	biogenic,in-vitro	DEAEHN
COc1cccc(C[C@@H](c2ccccc2)N(CCO)CCO)c1	ZINC000039233824	354168809	/nfs/dbraw/zinc/16/88/09/354168809.db2.gz	RNVHGLPRCVJZRG-IBGZPJMESA-N	0	3	315.413	2.266	10	0		DEAEHN
CCC[C@H](N)C(=O)N1CCC[C@H]1c1ccc(OC)cc1OC	ZINC000236805703	202018142	/nfs/dbraw/zinc/01/81/42/202018142.db2.gz	ZZZWFAFWBZRVET-GJZGRUSLSA-N	0	3	306.406	2.495	10	0		DEAEHN
CN(C)C(=O)C1CCN(CCCOc2ccc(F)cc2)CC1	ZINC000061761425	354631748	/nfs/dbraw/zinc/63/17/48/354631748.db2.gz	VRLFKGWYOFYQJY-UHFFFAOYSA-N	0	3	308.397	2.395	10	0		DEAEHN
CN(C[C@@H]1CCN(C)C1)C(=O)c1occc1Br	ZINC000081749529	355446589	/nfs/dbraw/zinc/44/65/89/355446589.db2.gz	KBICIMJOWAYVRJ-SECBINFHSA-N	0	3	301.184	2.066	10	0		DEAEHN
C[C@@H](NC(=O)NC[C@H](C)N(C)C1CC1)c1ccc2c(c1)OCO2	ZINC000105100119	355719776	/nfs/dbraw/zinc/71/97/76/355719776.db2.gz	XBPZVQBMDBKGLK-NWDGAFQWSA-N	0	3	319.405	2.258	10	0		DEAEHN
Cc1ccc(CCNC(=O)N[C@H](CC(C)C)CN(C)C)cn1	ZINC000111826652	355750196	/nfs/dbraw/zinc/75/01/96/355750196.db2.gz	JEURNSQBWUMGRQ-MRXNPFEDSA-N	0	3	306.454	2.208	10	0		DEAEHN
O=C(c1ccccc1)n1c2ccccc2nc1N1CCNCC1	ZINC000116320416	355773706	/nfs/dbraw/zinc/77/37/06/355773706.db2.gz	FTYYNQMJNNYUIZ-UHFFFAOYSA-N	0	3	306.369	2.134	10	0		DEAEHN
C[C@@H](NCc1nnc(-c2ccccc2)n1C)C1CCOCC1	ZINC000179839682	356035220	/nfs/dbraw/zinc/03/52/20/356035220.db2.gz	FXHXGVQWRIAWQZ-CYBMUJFWSA-N	0	3	300.406	2.387	10	0		DEAEHN
CCC[C@H](C)CN(C)CC(=O)N1CCC(C(=O)OCC)CC1	ZINC000180013048	356039887	/nfs/dbraw/zinc/03/98/87/356039887.db2.gz	ZQBMYKGAPBZTDJ-AWEZNQCLSA-N	0	3	312.454	2.156	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@H](C)N[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000179205844	356018099	/nfs/dbraw/zinc/01/80/99/356018099.db2.gz	SJFLRVFKVQPPKO-IHRRRGAJSA-N	0	3	315.421	2.221	10	0		DEAEHN
COc1ccc(CCN[C@@H]2CCCS(=O)(=O)C2)c(Cl)c1	ZINC000183123024	356160523	/nfs/dbraw/zinc/16/05/23/356160523.db2.gz	BVXYWVRPUNLYMH-GFCCVEGCSA-N	0	3	317.838	2.058	10	0		DEAEHN
CC(C)CN1CCN(Cc2nnc(-c3ccccc3)n2C)CC1	ZINC000195514065	356255276	/nfs/dbraw/zinc/25/52/76/356255276.db2.gz	RNELRNFHWBBFTL-UHFFFAOYSA-N	0	3	313.449	2.256	10	0		DEAEHN
COC[C@@H]1CCN([C@@H](CN)c2cc(Br)cs2)C1	ZINC000081041553	192218576	/nfs/dbraw/zinc/21/85/76/192218576.db2.gz	ASJOMXQCUAEZKK-KOLCDFICSA-N	0	3	319.268	2.479	10	0		DEAEHN
O[C@H](CN1CCOC[C@@H]1[C@@H]1CCCC[C@H]1O)C1CCCCC1	ZINC000408043320	283165789	/nfs/dbraw/zinc/16/57/89/283165789.db2.gz	JVZNYNCJXJECAX-BSDSXHPESA-N	0	3	311.466	2.180	10	0		DEAEHN
CN(C[C@H]1CCc2nccn2C1)C(=O)c1cccc2n[nH]cc21	ZINC000328628501	356463818	/nfs/dbraw/zinc/46/38/18/356463818.db2.gz	NTEAKDOOXYNPTD-GFCCVEGCSA-N	0	3	309.373	2.094	10	0		DEAEHN
Cc1noc(C)c1CNC[C@@H]1C[C@H](F)CN1Cc1nccs1	ZINC000328636670	356464996	/nfs/dbraw/zinc/46/49/96/356464996.db2.gz	OEOLLGPYFSLHJC-STQMWFEESA-N	0	3	324.425	2.450	10	0		DEAEHN
CC[C@@H](C)[C@H](N)C(=O)NCCCc1cc(OC)ccc1OC	ZINC000236924874	202074243	/nfs/dbraw/zinc/07/42/43/202074243.db2.gz	QQPDBVQJBZEMCF-WBMJQRKESA-N	0	3	308.422	2.126	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N1CC(=O)NCC[C@@H]1COc2ccccc2O1	ZINC000579785307	357029082	/nfs/dbraw/zinc/02/90/82/357029082.db2.gz	VBZWMBJUTQUFDO-RBSFLKMASA-N	0	3	318.417	2.206	10	0		DEAEHN
CCCN(CCC)S(=O)(=O)c1cc(CNC)n(CC)c1	ZINC000088914761	192654244	/nfs/dbraw/zinc/65/42/44/192654244.db2.gz	YZGITGTZCQNFCY-UHFFFAOYSA-N	0	3	301.456	2.038	10	0		DEAEHN
CCCNCc1ccc(S(=O)(=O)N2CCC[C@@H]2CC)nc1	ZINC000088973170	192676176	/nfs/dbraw/zinc/67/61/76/192676176.db2.gz	XMWBRNLCPDDWCD-AWEZNQCLSA-N	0	3	311.451	2.144	10	0		DEAEHN
O[C@@H](CNc1ncc(C(F)(F)F)s1)CN1CCCCC1	ZINC000276745314	213081607	/nfs/dbraw/zinc/08/16/07/213081607.db2.gz	GZGSVNPMVABZAC-VIFPVBQESA-N	0	3	309.357	2.421	10	0		DEAEHN
CC[C@](C)(CCO)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179482814	199043478	/nfs/dbraw/zinc/04/34/78/199043478.db2.gz	MGLVBVYXUSSTMC-JFIYKMOQSA-N	0	3	319.449	2.282	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccccc2OC(F)(F)F)C1	ZINC000180163232	199125352	/nfs/dbraw/zinc/12/53/52/199125352.db2.gz	SAIWXFKHPVVGOA-JTQLQIEISA-N	0	3	302.296	2.361	10	0		DEAEHN
CCNC(=O)c1ccc(NC(=O)[C@@H]2NCCCC2(C)C)cc1	ZINC000262560697	535433400	/nfs/dbraw/zinc/43/34/00/535433400.db2.gz	VJLLSQFFOVHCLS-AWEZNQCLSA-N	0	3	303.406	2.153	10	0		DEAEHN
CO[C@H]1CN(C(=O)NCc2cccc(CN(C)C)c2)CC[C@H]1C	ZINC000187325313	200095504	/nfs/dbraw/zinc/09/55/04/200095504.db2.gz	LBIWLTLMERWLGD-PBHICJAKSA-N	0	3	319.449	2.315	10	0		DEAEHN
Cc1ccc(CNC(=O)CN(C)[C@@]2(CO)CC[C@H](C)C2)cc1	ZINC000187915797	200176096	/nfs/dbraw/zinc/17/60/96/200176096.db2.gz	GETFXUVBAZIEMU-YJBOKZPZSA-N	0	3	304.434	2.094	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NC[C@@H]1OCCc2ccccc21	ZINC000603343295	360801686	/nfs/dbraw/zinc/80/16/86/360801686.db2.gz	ZKLOOJNLBNUHAH-SJORKVTESA-N	0	3	302.418	2.291	10	0		DEAEHN
COc1ccc([C@H](C)NC(=O)N[C@H]2CCN(C3CC3)C2)cc1F	ZINC000604161803	360887672	/nfs/dbraw/zinc/88/76/72/360887672.db2.gz	NFCNOKQFVHKMJL-AAEUAGOBSA-N	0	3	321.396	2.431	10	0		DEAEHN
C[C@H](C(=O)NCc1cn2c(n1)CCCC2)N1CCCCCC1	ZINC000603819760	360861366	/nfs/dbraw/zinc/86/13/66/360861366.db2.gz	VEEAVLBSUZHKMU-CQSZACIVSA-N	0	3	304.438	2.100	10	0		DEAEHN
Cc1nnc(CN2CCN([C@@H](C)CCc3ccccc3)CC2)[nH]1	ZINC000605422495	360968059	/nfs/dbraw/zinc/96/80/59/360968059.db2.gz	FPAPACAWHDAJGN-HNNXBMFYSA-N	0	3	313.449	2.252	10	0		DEAEHN
CCOCCC(=O)N1CCC[C@@H](N(C)Cc2ccccn2)CC1	ZINC000275918496	212581639	/nfs/dbraw/zinc/58/16/39/212581639.db2.gz	JTKJGQDREQAOFV-QGZVFWFLSA-N	0	3	319.449	2.321	10	0		DEAEHN
CN(C)CCn1cc(NC(=O)c2cnc3ccsc3c2)cn1	ZINC000607821392	361114058	/nfs/dbraw/zinc/11/40/58/361114058.db2.gz	ZJFXDKJBWFMVFI-UHFFFAOYSA-N	0	3	315.402	2.307	10	0		DEAEHN
CS[C@@H](C(=O)Nc1cnn(CCN(C)C)c1)c1ccccc1	ZINC000610044037	361354328	/nfs/dbraw/zinc/35/43/28/361354328.db2.gz	KUJSZQWVIMRJEL-OAHLLOKOSA-N	0	3	318.446	2.488	10	0		DEAEHN
OCCOc1ccccc1CN[C@H]1[C@H]2CCO[C@H]2C12CCC2	ZINC000194055184	201172372	/nfs/dbraw/zinc/17/23/72/201172372.db2.gz	GKUMHHGDZZBOTF-HYVNUMGLSA-N	0	3	303.402	2.105	10	0		DEAEHN
CCOC(=O)[C@@H](CC)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000195292751	201374366	/nfs/dbraw/zinc/37/43/66/201374366.db2.gz	SITDGDGMLQEAAH-IAGOWNOFSA-N	0	3	319.449	2.177	10	0		DEAEHN
CCCCOC(=O)CN1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000195296936	201375387	/nfs/dbraw/zinc/37/53/87/201375387.db2.gz	PDBKXJCTVYNMPE-KRWDZBQOSA-N	0	3	319.449	2.179	10	0		DEAEHN
c1cc(CNCCN2CC=CCC2)n(CCc2ccccc2)n1	ZINC000621350613	364364428	/nfs/dbraw/zinc/36/44/28/364364428.db2.gz	NSYLNZVNIJFEQP-UHFFFAOYSA-N	0	3	310.445	2.477	10	0		DEAEHN
CCOC(=O)[C@H]1CN(C/C=C\c2ccccc2)CC12COC2	ZINC000449361249	240392886	/nfs/dbraw/zinc/39/28/86/240392886.db2.gz	JAJOTASDOPTNGN-CXOKCQFOSA-N	0	3	301.386	2.211	10	0		DEAEHN
OCCN1CCC[C@H](NCc2csc(C(F)(F)F)c2)C1	ZINC000623406830	365019237	/nfs/dbraw/zinc/01/92/37/365019237.db2.gz	LNEFXYKIDMVHMZ-NSHDSACASA-N	0	3	308.369	2.313	10	0		DEAEHN
COc1ccccc1[C@@H](C)N(C)C(=O)C[C@@H]1CSCCN1	ZINC000091136082	193002164	/nfs/dbraw/zinc/00/21/64/193002164.db2.gz	WUCUPCYSYPIWGI-CHWSQXEVSA-N	0	3	308.447	2.310	10	0		DEAEHN
C[C@H](NC[C@@H]1COCCN1C)c1ccc(Br)s1	ZINC000623713382	365142148	/nfs/dbraw/zinc/14/21/48/365142148.db2.gz	ZNTYHROHAZZTRH-VHSXEESVSA-N	0	3	319.268	2.492	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)C[C@@H](O)c1cccc(F)c1	ZINC000091229927	193024101	/nfs/dbraw/zinc/02/41/01/193024101.db2.gz	PIGGSQJIIUJAQZ-JKSUJKDBSA-N	0	3	310.413	2.342	10	0		DEAEHN
C[S@@](=O)CCN[C@H]1CCc2c1cccc2Br	ZINC000091341904	193043306	/nfs/dbraw/zinc/04/33/06/193043306.db2.gz	UUBRPKCUEHAMGI-LRDDRELGSA-N	0	3	302.237	2.405	10	0		DEAEHN
CN(C)C[C@H]1CCCN1c1nc(Cl)ncc1Br	ZINC000091658992	193086317	/nfs/dbraw/zinc/08/63/17/193086317.db2.gz	UDFIVJDAXIDEMH-MRVPVSSYSA-N	0	3	319.634	2.423	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@H]2CC[C@H](C)[NH2+]C2)sc1Cl	ZINC000624405066	365411702	/nfs/dbraw/zinc/41/17/02/365411702.db2.gz	BEPQPXDKEFLUEA-IUCAKERBSA-N	0	3	308.856	2.129	10	0		DEAEHN
CS[C@@H]1CN(Cc2nnc(C(C)C)s2)C[C@H]1N(C)C	ZINC000450636352	242044763	/nfs/dbraw/zinc/04/47/63/242044763.db2.gz	MPKQHKBNTIKDGH-GHMZBOCLSA-N	0	3	300.497	2.139	10	0		DEAEHN
C[C@H](c1ccccc1)[C@H](O)CN1C[C@]2(CCOC2)OC(C)(C)C1	ZINC000450897483	242367961	/nfs/dbraw/zinc/36/79/61/242367961.db2.gz	QALPZPQXIYAXCV-SUMDDJOVSA-N	0	3	319.445	2.421	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)cn1C(C)C	ZINC000092113920	193161230	/nfs/dbraw/zinc/16/12/30/193161230.db2.gz	KWXAATXKECGGAJ-STQMWFEESA-N	0	3	313.467	2.065	10	0		DEAEHN
CC(C)[C@@H]1CCCN1S(=O)(=O)c1ccc(CN)cc1F	ZINC000092116285	193164174	/nfs/dbraw/zinc/16/41/74/193164174.db2.gz	CFRJWCHAVPFBBT-ZDUSSCGKSA-N	0	3	300.399	2.094	10	0		DEAEHN
c1cc(CNCCCOC[C@H]2CCCO2)n(CC2CCC2)n1	ZINC000631037553	367982798	/nfs/dbraw/zinc/98/27/98/367982798.db2.gz	UOHODOKCHDCFGP-QGZVFWFLSA-N	0	3	307.438	2.359	10	0		DEAEHN
c1c(CNC(C2CCC2)C2CCC2)nnn1C[C@@H]1CCOC1	ZINC000631136192	368037725	/nfs/dbraw/zinc/03/77/25/368037725.db2.gz	SLCPJGPAYHLMLE-ZDUSSCGKSA-N	0	3	304.438	2.373	10	0		DEAEHN
c1c(CN[C@@H]2CC[C@@H]3CCC[C@@H]3C2)nnn1C[C@H]1CCOC1	ZINC000631080226	368005775	/nfs/dbraw/zinc/00/57/75/368005775.db2.gz	XXFASAQEVWGJGI-QKPAOTATSA-N	0	3	304.438	2.373	10	0		DEAEHN
[NH3+]CC1([N-]S(=O)(=O)c2cc(F)ccc2Cl)CCCCC1	ZINC000631980034	368478861	/nfs/dbraw/zinc/47/88/61/368478861.db2.gz	SAOKSDZPMLGUHA-UHFFFAOYSA-N	0	3	320.817	2.419	10	0		DEAEHN
O=C(N[C@@H]1CCOc2ccccc21)N1CC[C@H](N2CC=CC2)C1	ZINC000173373489	284083798	/nfs/dbraw/zinc/08/37/98/284083798.db2.gz	APSPGQNMZQBAHC-GOEBONIOSA-N	0	3	313.401	2.166	10	0		DEAEHN
CCCN[C@@H](Cc1c(Cl)c(C)nn1CC)C(OC)OC	ZINC000093305611	193227754	/nfs/dbraw/zinc/22/77/54/193227754.db2.gz	LJVXHTREFLNUOP-NSHDSACASA-N	0	3	303.834	2.394	10	0		DEAEHN
CN(CCc1cccs1)C(=O)c1c[nH]c(=NN)c(Cl)c1	ZINC000093294185	193226657	/nfs/dbraw/zinc/22/66/57/193226657.db2.gz	BSSWWGVWZQBOBT-UHFFFAOYSA-N	0	3	310.810	2.397	10	0		DEAEHN
CCOC(=O)[C@@]1(NC)CCC[C@H](N(C)CCC(F)(F)F)C1	ZINC000093756578	193302119	/nfs/dbraw/zinc/30/21/19/193302119.db2.gz	RCSDVJSNLJLJBI-WCQYABFASA-N	0	3	310.360	2.335	10	0		DEAEHN
CCOC(=O)[C@]1(N)CC[C@H](N2CCC(C(F)(F)F)CC2)C1	ZINC000093831932	193314913	/nfs/dbraw/zinc/31/49/13/193314913.db2.gz	FATSYPAJORRTNC-AAEUAGOBSA-N	0	3	308.344	2.074	10	0		DEAEHN
CN[C@H](Cc1c(Cl)cccc1Cl)[C@@H]1CN(C)CCN1C	ZINC000093894844	193325298	/nfs/dbraw/zinc/32/52/98/193325298.db2.gz	QOKTVIFXVJWRFI-CABCVRRESA-N	0	3	316.276	2.370	10	0		DEAEHN
CC(C)(C)c1csc(C[C@@H](N)C(C)(C)N2CCOCC2)n1	ZINC000094256855	193355255	/nfs/dbraw/zinc/35/52/55/193355255.db2.gz	AWJKGXAFIRJIGL-GFCCVEGCSA-N	0	3	311.495	2.421	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)s1)N(C)CCS(C)(=O)=O	ZINC000094297313	193357227	/nfs/dbraw/zinc/35/72/27/193357227.db2.gz	MDQQKFJOMJUFGX-CABZTGNLSA-N	0	3	324.899	2.156	10	0		DEAEHN
CN(C[C@@H]1CCCOC1)c1nc(C(F)(F)F)ccc1CN	ZINC000094334310	193360092	/nfs/dbraw/zinc/36/00/92/193360092.db2.gz	FWYKXFVRIGLAOR-JTQLQIEISA-N	0	3	303.328	2.422	10	0		DEAEHN
CNCc1cc(F)c(O[C@H](C)C(=O)NC(C)(C)C)c(F)c1	ZINC000094346418	193363350	/nfs/dbraw/zinc/36/33/50/193363350.db2.gz	DAHXTIGHWNBDNL-SECBINFHSA-N	0	3	300.349	2.366	10	0		DEAEHN
NCc1cccc(OCCS(=O)(=O)c2cccc(F)c2)c1	ZINC000094627288	193385415	/nfs/dbraw/zinc/38/54/15/193385415.db2.gz	XGPMRWOUIFHNGI-UHFFFAOYSA-N	0	3	309.362	2.137	10	0		DEAEHN
CCCN[C@H](c1ccn(C)n1)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094642592	193388648	/nfs/dbraw/zinc/38/86/48/193388648.db2.gz	PKEACHOWXMYBHN-IPYPFGDCSA-N	0	3	313.467	2.064	10	0		DEAEHN
CCNCc1c(C)nn([C@@H]2CCC[C@@H](S(C)(=O)=O)C2)c1C	ZINC000094643983	193390048	/nfs/dbraw/zinc/39/00/48/193390048.db2.gz	BRGCSZQZOQXFBE-ZIAGYGMSSA-N	0	3	313.467	2.138	10	0		DEAEHN
CCN1CCC[C@@H](Nc2nc3ccc(Br)cn3n2)C1	ZINC000094603784	193383920	/nfs/dbraw/zinc/38/39/20/193383920.db2.gz	WDUZTTPLFNBVED-LLVKDONJSA-N	0	3	324.226	2.388	10	0		DEAEHN
CN1CCC[C@H](CNc2nc3c(Br)cccn3n2)C1	ZINC000094604859	193383941	/nfs/dbraw/zinc/38/39/41/193383941.db2.gz	YZOBYUXAFQHYQV-SNVBAGLBSA-N	0	3	324.226	2.246	10	0		DEAEHN
CN1CCC[C@H](CNc2nc3ccc(Br)cn3n2)C1	ZINC000094604853	193383967	/nfs/dbraw/zinc/38/39/67/193383967.db2.gz	OBMJHHOZMUNNBM-SNVBAGLBSA-N	0	3	324.226	2.246	10	0		DEAEHN
O=C(N[C@H]1CCCc2occc21)N1CC[C@@H](N2CC=CC2)C1	ZINC000173950940	284189166	/nfs/dbraw/zinc/18/91/66/284189166.db2.gz	GXKBNEOWEVVYRG-HIFRSBDPSA-N	0	3	301.390	2.313	10	0		DEAEHN
CCOc1ccc(NC(=O)N2CC[C@@H](N3CCCC3)C2)cn1	ZINC000151521250	196692532	/nfs/dbraw/zinc/69/25/32/196692532.db2.gz	RXZTZEJUKCZQDZ-CQSZACIVSA-N	0	3	304.394	2.182	10	0		DEAEHN
Brc1sccc1CNCCN1CCCOCC1	ZINC000529568061	284212406	/nfs/dbraw/zinc/21/24/06/284212406.db2.gz	PYTCXCQOOXKYKZ-UHFFFAOYSA-N	0	3	319.268	2.323	10	0		DEAEHN
COC(=O)[C@H](N[C@@H]1CN(C(C)C)C[C@H]1C)c1ccccc1F	ZINC000246166615	284287802	/nfs/dbraw/zinc/28/78/02/284287802.db2.gz	FBPHUIJPTLRWSV-DAXOMENPSA-N	0	3	308.397	2.358	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)N1CCN(C)[C@@H](C)[C@H]1C)CC2	ZINC000530289635	284396524	/nfs/dbraw/zinc/39/65/24/284396524.db2.gz	FKVROCGMKNQUAX-BFHYXJOUSA-N	0	3	318.465	2.189	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N1CCN(C)[C@@H](C)[C@H]1C)C2	ZINC000530289635	284396526	/nfs/dbraw/zinc/39/65/26/284396526.db2.gz	FKVROCGMKNQUAX-BFHYXJOUSA-N	0	3	318.465	2.189	10	0		DEAEHN
COc1ccc(CN)cc1S(=O)(=O)NC1CCCCCC1	ZINC000020189739	182195609	/nfs/dbraw/zinc/19/56/09/182195609.db2.gz	LTEVEFLFMKMBST-UHFFFAOYSA-N	0	3	312.435	2.155	10	0		DEAEHN
CCCSC[C@@H](N)c1c(Br)cnn1CCOC	ZINC000160061340	197382961	/nfs/dbraw/zinc/38/29/61/197382961.db2.gz	YATHUIXNJHEAOH-SNVBAGLBSA-N	0	3	322.272	2.435	10	0		DEAEHN
CCCN[C@@H](Cc1cc(F)ccc1C)[C@H](C)S(C)(=O)=O	ZINC000097858693	193765044	/nfs/dbraw/zinc/76/50/44/193765044.db2.gz	ZUUVLNJQFYZSQX-WFASDCNBSA-N	0	3	301.427	2.478	10	0		DEAEHN
COc1ccc(Cl)cc1NC(=O)CN1CCN2CCC[C@@H]2C1	ZINC000023249641	182354288	/nfs/dbraw/zinc/35/42/88/182354288.db2.gz	IQVQQQWDDMPIQZ-CYBMUJFWSA-N	0	3	323.824	2.067	10	0		DEAEHN
C[C@@H](C(=O)N(CCN(C)C)Cc1ccco1)C1CCOCC1	ZINC000156049658	291614416	/nfs/dbraw/zinc/61/44/16/291614416.db2.gz	GKEWOQHUVXPQMF-CQSZACIVSA-N	0	3	308.422	2.233	10	0		DEAEHN
Cc1cn2cc(C(=O)NC3CCN(C4CCC4)CC3)sc2n1	ZINC000456681998	247356687	/nfs/dbraw/zinc/35/66/87/247356687.db2.gz	JIFNYZJOUKVBGQ-UHFFFAOYSA-N	0	3	318.446	2.451	10	0		DEAEHN
CC(C)[C@@H](CNS(=O)(=O)c1ccc(F)cc1)N1CCCC1	ZINC000040435958	183067116	/nfs/dbraw/zinc/06/71/16/183067116.db2.gz	MCIQXSDBNUFULE-OAHLLOKOSA-N	0	3	314.426	2.224	10	0		DEAEHN
Cc1cc(C)c(CN)c(Oc2cccc(S(C)(=O)=O)c2)n1	ZINC000040509788	183086047	/nfs/dbraw/zinc/08/60/47/183086047.db2.gz	MIIMWZRUHGMSHE-UHFFFAOYSA-N	0	3	306.387	2.353	10	0		DEAEHN
COc1ccc([C@@H](C(=O)NCCN(C)C)C(C)C)cc1OC	ZINC000040651908	183114430	/nfs/dbraw/zinc/11/44/30/183114430.db2.gz	FAVJZTSCMCOIRO-INIZCTEOSA-N	0	3	308.422	2.121	10	0		DEAEHN
Cc1ccc([C@H](CNS(C)(=O)=O)N2CCCCCC2)cc1	ZINC000040615852	183109481	/nfs/dbraw/zinc/10/94/81/183109481.db2.gz	YLPVWBRGKRLASA-INIZCTEOSA-N	0	3	310.463	2.461	10	0		DEAEHN
COC(=O)c1c2c(sc1NC(=O)C1(N)CCCC1)CCC2	ZINC000040858910	183142628	/nfs/dbraw/zinc/14/26/28/183142628.db2.gz	YLAFNLICUUQZCC-UHFFFAOYSA-N	0	3	308.403	2.233	10	0		DEAEHN
COC(=O)c1c(NC(=O)[C@@](C)(N)C2CC2)sc2c1CCC2	ZINC000040858907	183143121	/nfs/dbraw/zinc/14/31/21/183143121.db2.gz	ZFZDAGZXDBCSCX-HNNXBMFYSA-N	0	3	308.403	2.089	10	0		DEAEHN
Cc1cc(C(=O)NCCN(C)C)nn1-c1ccc(C)c(C)c1	ZINC000041455802	183192534	/nfs/dbraw/zinc/19/25/34/183192534.db2.gz	HMDZSOXDYQBMOM-UHFFFAOYSA-N	0	3	300.406	2.089	10	0		DEAEHN
CC[C@@H](C)NC(=O)COc1c(Br)cccc1CN	ZINC000042411378	183265595	/nfs/dbraw/zinc/26/55/95/183265595.db2.gz	SSIWWJGXUOWAEY-SECBINFHSA-N	0	3	315.211	2.201	10	0		DEAEHN
CNCc1cccc(Br)c1O[C@@H]1CCC[C@@H]1O	ZINC000042411601	183265981	/nfs/dbraw/zinc/26/59/81/183265981.db2.gz	WSGHFGJYIXXDLR-NWDGAFQWSA-N	0	3	300.196	2.461	10	0		DEAEHN
COCCN([C@H](CN)c1ccc(Br)o1)C1CC1	ZINC000042517942	183279613	/nfs/dbraw/zinc/27/96/13/183279613.db2.gz	WYQXFSHKPUZZSH-SNVBAGLBSA-N	0	3	303.200	2.153	10	0		DEAEHN
Cc1cccc([C@H](CN)Oc2ccc(S(C)(=O)=O)cc2)c1	ZINC000042969279	183324481	/nfs/dbraw/zinc/32/44/81/183324481.db2.gz	XIVNYIAMYJYXRM-INIZCTEOSA-N	0	3	305.399	2.477	10	0		DEAEHN
Cc1ccccc1[C@H](CN)Oc1cccc(S(C)(=O)=O)c1	ZINC000043040303	183331795	/nfs/dbraw/zinc/33/17/95/183331795.db2.gz	JBHGZZWUCLIKMX-INIZCTEOSA-N	0	3	305.399	2.477	10	0		DEAEHN
Cc1ccccc1[C@@H](CN)Oc1ccc(S(C)(=O)=O)cc1	ZINC000043040296	183332191	/nfs/dbraw/zinc/33/21/91/183332191.db2.gz	UOUWCGJVRCBMOU-MRXNPFEDSA-N	0	3	305.399	2.477	10	0		DEAEHN
CCCCN(CC(N)=O)[C@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043254161	183348000	/nfs/dbraw/zinc/34/80/00/183348000.db2.gz	XDJPQTCHFTYUEF-RNCFNFMXSA-N	0	3	303.859	2.377	10	0		DEAEHN
Cc1nc(C)n([C@@H](CN)c2ccc(Br)s2)n1	ZINC000043263505	183348782	/nfs/dbraw/zinc/34/87/82/183348782.db2.gz	AQXJUOROZGXLCS-QMMMGPOBSA-N	0	3	301.213	2.267	10	0		DEAEHN
NC[C@H](Sc1nc[nH]n1)c1ccc(Br)s1	ZINC000043283325	183350783	/nfs/dbraw/zinc/35/07/83/183350783.db2.gz	DJQWVRVGBPZEEA-LURJTMIESA-N	0	3	305.226	2.421	10	0		DEAEHN
N[C@@H](c1ccc(F)c(Br)c1)[C@H]1CCS(=O)(=O)C1	ZINC000043299827	183351400	/nfs/dbraw/zinc/35/14/00/183351400.db2.gz	SAZBQZCEEBDZJO-KWQFWETISA-N	0	3	322.199	2.023	10	0		DEAEHN
N[C@H](c1ccc(Br)cc1F)[C@@H]1CCS(=O)(=O)C1	ZINC000043299834	183351469	/nfs/dbraw/zinc/35/14/69/183351469.db2.gz	XABPTPWGEBQVHZ-HQJQHLMTSA-N	0	3	322.199	2.023	10	0		DEAEHN
N[C@H](c1ccccc1OC(F)(F)F)[C@@H]1CCS(=O)(=O)C1	ZINC000043300042	183352066	/nfs/dbraw/zinc/35/20/66/183352066.db2.gz	VCLCQEYSXYHCJV-KCJUWKMLSA-N	0	3	309.309	2.020	10	0		DEAEHN
CO[C@@H]1C[C@@H](CO)N(CCOc2ccc(C(F)(F)F)cc2)C1	ZINC000284709717	218143923	/nfs/dbraw/zinc/14/39/23/218143923.db2.gz	UWQHQAUHNRKKAZ-GXTWGEPZSA-N	0	3	319.323	2.166	10	0		DEAEHN
CC[C@@H]1CN(CCCOc2ccc(F)cc2)CCN1C[C@@H](C)O	ZINC000105825916	194138478	/nfs/dbraw/zinc/13/84/78/194138478.db2.gz	HBDTVUCCYVGAOI-NVXWUHKLSA-N	0	3	324.440	2.372	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)c2ccccc2F)C[C@H]1CC	ZINC000105838268	194143610	/nfs/dbraw/zinc/14/36/10/194143610.db2.gz	UWPRQXZOUGFKAF-QAPCUYQASA-N	0	3	324.440	2.292	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)NC[C@@H](C)c2ccccc2)c1	ZINC000105881298	194156102	/nfs/dbraw/zinc/15/61/02/194156102.db2.gz	RKYRUBKPDPYUDK-HZPDHXFCSA-N	0	3	314.433	2.090	10	0		DEAEHN
CC(C)OCCCN1CCCN(Cc2noc(C3CC3)n2)CC1	ZINC000105917042	194168038	/nfs/dbraw/zinc/16/80/38/194168038.db2.gz	DKBHIEYFZSEKPG-UHFFFAOYSA-N	0	3	322.453	2.270	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1CCCN1C[C@H](O)COC(C)(C)C	ZINC000105922218	194170770	/nfs/dbraw/zinc/17/07/70/194170770.db2.gz	NDGPHZIXXMIEOG-LSDHHAIUSA-N	0	3	309.454	2.350	10	0		DEAEHN
CC[C@H]1CN(Cc2cccc(C(=O)OC)c2)CCN1CCOC	ZINC000106115666	194187691	/nfs/dbraw/zinc/18/76/91/194187691.db2.gz	XKUHTHZDVNGMSF-KRWDZBQOSA-N	0	3	320.433	2.016	10	0		DEAEHN
CCn1cnnc1C1CCN(C[C@](C)(O)c2ccccc2)CC1	ZINC000106387135	194205742	/nfs/dbraw/zinc/20/57/42/194205742.db2.gz	RQYJOBSZCBWDRM-SFHVURJKSA-N	0	3	314.433	2.385	10	0		DEAEHN
CC(C)NCCS(=O)(=O)Nc1ccc(OC(F)F)cc1	ZINC000049642760	183751376	/nfs/dbraw/zinc/75/13/76/183751376.db2.gz	KSCBJUABWVCCSB-UHFFFAOYSA-N	0	3	308.350	2.028	10	0		DEAEHN
CCNCc1c(N2CCC[C@H]2CCCO)nc2sccn12	ZINC000052761677	183871032	/nfs/dbraw/zinc/87/10/32/183871032.db2.gz	VABNBVWWMKSAFX-LBPRGKRZSA-N	0	3	308.451	2.247	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)s1)N1CCNC(=O)[C@@H]1C	ZINC000110655171	194346521	/nfs/dbraw/zinc/34/65/21/194346521.db2.gz	UVHKUFTZCGEXFG-HOTUBEGUSA-N	0	3	301.843	2.000	10	0		DEAEHN
CC1(C)C(=O)NCCN1c1cccc(Cl)c1CNC1CC1	ZINC000110661389	194346711	/nfs/dbraw/zinc/34/67/11/194346711.db2.gz	XUHUYORAKCSENC-UHFFFAOYSA-N	0	3	307.825	2.307	10	0		DEAEHN
CNC(=O)[C@@H](C)N[C@H]1CCc2cc(Br)ccc2C1	ZINC000110822306	194361322	/nfs/dbraw/zinc/36/13/22/194361322.db2.gz	IEXUVURJTLHFNV-RNCFNFMXSA-N	0	3	311.223	2.031	10	0		DEAEHN
CCc1nc(N2CCN(C)C(C)(C)C2)sc1CNC1CC1	ZINC000110760437	194357369	/nfs/dbraw/zinc/35/73/69/194357369.db2.gz	KNBUKGDLVGFMHA-UHFFFAOYSA-N	0	3	308.495	2.488	10	0		DEAEHN
CCOCCN(CC)c1nc(C)c(CNCCOC)s1	ZINC000111124596	194392848	/nfs/dbraw/zinc/39/28/48/194392848.db2.gz	UMVAISVSRBSEBE-UHFFFAOYSA-N	0	3	301.456	2.050	10	0		DEAEHN
CN(C[C@@H]1CCCOC1)c1ncc(Br)cc1CN	ZINC000111173933	194398624	/nfs/dbraw/zinc/39/86/24/194398624.db2.gz	OXYXSYAQRNEYEH-JTQLQIEISA-N	0	3	314.227	2.166	10	0		DEAEHN
CCn1cc(NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)cn1	ZINC000057202847	184029585	/nfs/dbraw/zinc/02/95/85/184029585.db2.gz	XJSKBFCZLMFQQP-HNNXBMFYSA-N	0	3	315.421	2.197	10	0		DEAEHN
Cc1cc(NC(=O)N[C@H](Cc2ccccc2)CN(C)C)n(C)n1	ZINC000057205514	184029640	/nfs/dbraw/zinc/02/96/40/184029640.db2.gz	JPLIYRSOIGQSIR-OAHLLOKOSA-N	0	3	315.421	2.023	10	0		DEAEHN
CC(C)(C)c1cc(NC(=O)CN2CCCN(C3CC3)CC2)on1	ZINC000061041003	184160110	/nfs/dbraw/zinc/16/01/10/184160110.db2.gz	JXQJMDLIKYJHCK-UHFFFAOYSA-N	0	3	320.437	2.081	10	0		DEAEHN
c1cc(-c2noc(CN3CCCN(C4CC4)CC3)n2)cs1	ZINC000061041317	184160869	/nfs/dbraw/zinc/16/08/69/184160869.db2.gz	DPQFBDQGRZZQBU-UHFFFAOYSA-N	0	3	304.419	2.468	10	0		DEAEHN
CCN1CCC[C@H](Nc2nc(Cl)nc(N3CCCC3)n2)C1	ZINC000061539219	184172981	/nfs/dbraw/zinc/17/29/81/184172981.db2.gz	VERNCWOTALNWSA-NSHDSACASA-N	0	3	310.833	2.021	10	0		DEAEHN
COC(=O)c1sc(N2CCC[C@@H]2CN(C)C)nc1Cl	ZINC000061654770	184181247	/nfs/dbraw/zinc/18/12/47/184181247.db2.gz	QKFVHXBZHFDOGD-MRVPVSSYSA-N	0	3	303.815	2.114	10	0		DEAEHN
NC[C@H](c1ccc(OC(F)(F)F)cc1)N1CCCOCC1	ZINC000061916560	184195027	/nfs/dbraw/zinc/19/50/27/184195027.db2.gz	OIPBNDAHPTVTFW-CYBMUJFWSA-N	0	3	304.312	2.307	10	0		DEAEHN
NC[C@H](c1cc(Br)ccc1F)N1CCCOCC1	ZINC000061916544	184195352	/nfs/dbraw/zinc/19/53/52/184195352.db2.gz	DMINLJVMWXPWRK-CYBMUJFWSA-N	0	3	317.202	2.310	10	0		DEAEHN
COC(=O)[C@@]1(Nc2ccc(Br)cc2)CCN(C)C1	ZINC000061991468	184200165	/nfs/dbraw/zinc/20/01/65/184200165.db2.gz	PJOWZJBUHVGBTC-CYBMUJFWSA-N	0	3	313.195	2.108	10	0		DEAEHN
COCCN1C(=O)C[C@H](N)[C@@H]1c1ccc(Cl)cc1Cl	ZINC000062210256	184220987	/nfs/dbraw/zinc/22/09/87/184220987.db2.gz	SYVQMSYSVBMYKP-AAEUAGOBSA-N	0	3	303.189	2.241	10	0		DEAEHN
CN(Cc1nccn1C)[C@@H](CN)c1ccc(Br)cc1	ZINC000062247620	184225263	/nfs/dbraw/zinc/22/52/63/184225263.db2.gz	HTGIZIBTYJEAIM-ZDUSSCGKSA-N	0	3	323.238	2.314	10	0		DEAEHN
CC[C@H](N)c1cccc(S(=O)(=O)NCCC(F)(F)F)c1	ZINC000063101547	184271204	/nfs/dbraw/zinc/27/12/04/184271204.db2.gz	HPKPRNGQNIBBON-NSHDSACASA-N	0	3	310.341	2.327	10	0		DEAEHN
C[C@@H](CO)N(C)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000119620209	195004228	/nfs/dbraw/zinc/00/42/28/195004228.db2.gz	LLCUJBTUUREBKI-MAUKXSAKSA-N	0	3	319.449	2.063	10	0		DEAEHN
COCCC[C@H](N)C(=O)N1CCc2sccc2[C@@H]1C1CC1	ZINC000159304500	197343948	/nfs/dbraw/zinc/34/39/48/197343948.db2.gz	PQVPJUIFZQQFKN-ZFWWWQNUSA-N	0	3	308.447	2.338	10	0		DEAEHN
CNc1ncc(Br)c(N[C@@H]2CCN(C)[C@@H](C)C2)n1	ZINC000159241088	197339430	/nfs/dbraw/zinc/33/94/30/197339430.db2.gz	GBOLHPNTJFQYEN-DTWKUNHWSA-N	0	3	314.231	2.175	10	0		DEAEHN
C[C@H]1C[C@@H]1NS(=O)(=O)c1ccc(F)c(CNC(C)(C)C)c1	ZINC000159109636	197328836	/nfs/dbraw/zinc/32/88/36/197328836.db2.gz	NUIWRCSDVBIPLI-HZMBPMFUSA-N	0	3	314.426	2.401	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)CC2CCC2)cc(CN)c1F	ZINC000159113371	197328293	/nfs/dbraw/zinc/32/82/93/197328293.db2.gz	GAHSYOFOGPZCLD-UHFFFAOYSA-N	0	3	300.399	2.013	10	0		DEAEHN
COc1cc2c(cc1[C@H](CN)NCC(F)(F)F)O[C@@H](C)C2	ZINC000159066064	197323406	/nfs/dbraw/zinc/32/34/06/197323406.db2.gz	DMRIWGWPBVMTNT-KWQFWETISA-N	0	3	304.312	2.170	10	0		DEAEHN
CCC[C@@H](N)C(=O)Nc1nnc(Cc2ccc(F)cc2)s1	ZINC000158935707	197312090	/nfs/dbraw/zinc/31/20/90/197312090.db2.gz	HWLCBDVBLJGJIS-LLVKDONJSA-N	0	3	308.382	2.334	10	0		DEAEHN
CN[C@H](CS(=O)(=O)c1ccc(C(C)C)cc1)[C@@H]1CCOC1	ZINC000158714114	197295788	/nfs/dbraw/zinc/29/57/88/197295788.db2.gz	DZPAAJDTTDVNRZ-GDBMZVCRSA-N	0	3	311.447	2.208	10	0		DEAEHN
CCN[C@@H](C[C@@H]1CCCO1)c1c(Br)cnn1C	ZINC000158656673	197292127	/nfs/dbraw/zinc/29/21/27/197292127.db2.gz	HXMSRDJNQPOQPE-ONGXEEELSA-N	0	3	302.216	2.402	10	0		DEAEHN
CNCc1cccc(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)c1C	ZINC000158743648	197298333	/nfs/dbraw/zinc/29/83/33/197298333.db2.gz	AZYJKDAFEGGGAN-GASCZTMLSA-N	0	3	308.447	2.135	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)c1ccc(F)cc1)[C@@H]1CCOC1	ZINC000158729099	197297536	/nfs/dbraw/zinc/29/75/36/197297536.db2.gz	GHWDWXUVYDESIX-DOMZBBRYSA-N	0	3	315.410	2.004	10	0		DEAEHN
CCCN[C@H](CS(=O)(=O)c1ccc(C)cc1)[C@H]1CCOC1	ZINC000158725434	197297578	/nfs/dbraw/zinc/29/75/78/197297578.db2.gz	WVIDRLKQVOXQHP-GOEBONIOSA-N	0	3	311.447	2.173	10	0		DEAEHN
O=C(NCc1cccc(=O)[nH]1)c1cccc(CN2CCCC2)c1	ZINC000540852723	285130574	/nfs/dbraw/zinc/13/05/74/285130574.db2.gz	LYMSFWMYIHXLBQ-UHFFFAOYSA-N	0	3	311.385	2.313	10	0		DEAEHN
CCN[C@H](C[C@@H]1CCCO1)c1c(Br)cnn1C	ZINC000158656814	197292215	/nfs/dbraw/zinc/29/22/15/197292215.db2.gz	HXMSRDJNQPOQPE-GXSJLCMTSA-N	0	3	302.216	2.402	10	0		DEAEHN
C[C@@H]1OCC[C@H]1N(C)[C@@H](CN)c1cc2c(c(Cl)c1)OCO2	ZINC000158613389	197287410	/nfs/dbraw/zinc/28/74/10/197287410.db2.gz	PMAXPDKCEJRWTN-BIMULSAOSA-N	0	3	312.797	2.178	10	0		DEAEHN
CC[C@H]1CN(c2nc(NC)nc(N(CC)CC)n2)CCS1	ZINC000158510997	197279320	/nfs/dbraw/zinc/27/93/20/197279320.db2.gz	WNDIBYHVTVTRLE-NSHDSACASA-N	0	3	310.471	2.091	10	0		DEAEHN
NN=c1[nH]cc(C(=O)NC[C@@H]2CCCCS2)cc1Cl	ZINC000158491767	197277168	/nfs/dbraw/zinc/27/71/68/197277168.db2.gz	MOYMTORRNSTLAM-VIFPVBQESA-N	0	3	300.815	2.036	10	0		DEAEHN
COCCN(C)CCNc1cc(Br)c(F)cc1N	ZINC000157874501	197222310	/nfs/dbraw/zinc/22/23/10/197222310.db2.gz	QUDVXZGTESAXPX-UHFFFAOYSA-N	0	3	320.206	2.161	10	0		DEAEHN
CN[C@H](Cc1cccc(C(F)(F)F)c1)[C@@H](C)S(C)(=O)=O	ZINC000157711331	197209893	/nfs/dbraw/zinc/20/98/93/197209893.db2.gz	CITWIAHCFFXVBC-BXKDBHETSA-N	0	3	309.353	2.269	10	0		DEAEHN
CC[C@@H]1CN(S(=O)(=O)c2cccc([C@@H](C)N)c2)CCS1	ZINC000157701993	197208516	/nfs/dbraw/zinc/20/85/16/197208516.db2.gz	ORWMROGNQKCIPH-DGCLKSJQSA-N	0	3	314.476	2.222	10	0		DEAEHN
Cc1nc(CN2CCCN(CC3=CCCOC3)CC2)cs1	ZINC000157256606	197174004	/nfs/dbraw/zinc/17/40/04/197174004.db2.gz	ZOKRFLDCIULCCM-UHFFFAOYSA-N	0	3	307.463	2.306	10	0		DEAEHN
CCO[C@@H]1C[C@@](N)(C(=O)N(CC(F)(F)F)C2CC2)C1(C)C	ZINC000157137762	197164976	/nfs/dbraw/zinc/16/49/76/197164976.db2.gz	KWEXSKVLRJAIFF-ZWNOBZJWSA-N	0	3	308.344	2.072	10	0		DEAEHN
CC(C)OCCN(C)[C@H](CN)c1cc2c(c(Cl)c1)OCO2	ZINC000157122431	197164172	/nfs/dbraw/zinc/16/41/72/197164172.db2.gz	BBVRANBYISMMHD-CYBMUJFWSA-N	0	3	314.813	2.425	10	0		DEAEHN
NCc1ccccc1CC(=O)Nc1ncccc1Br	ZINC000157109449	197163170	/nfs/dbraw/zinc/16/31/70/197163170.db2.gz	WMQAHXMDGFBQJX-UHFFFAOYSA-N	0	3	320.190	2.484	10	0		DEAEHN
CCC[C@H](C(=O)N1CCc2c(nc(C(C)C)n2C)C1)N(C)C	ZINC000157013975	197155609	/nfs/dbraw/zinc/15/56/09/197155609.db2.gz	DKSDEJMPGZTMJW-OAHLLOKOSA-N	0	3	306.454	2.159	10	0		DEAEHN
Cc1ccc2ncc(CN[C@H]3CCCN(c4cccnn4)C3)n2c1	ZINC000156583558	197125801	/nfs/dbraw/zinc/12/58/01/197125801.db2.gz	SVSPIVSWDYJWDY-HNNXBMFYSA-N	0	3	322.416	2.191	10	0		DEAEHN
Cc1ccccc1CN1CCC(NC(=O)C[C@@H](O)C(C)C)CC1	ZINC000156359878	197106876	/nfs/dbraw/zinc/10/68/76/197106876.db2.gz	VBKSODLZXQBLLO-GOSISDBHSA-N	0	3	318.461	2.483	10	0		DEAEHN
CCN(CC)c1nc(N)nc(N[C@H](C)c2nc(C)cs2)n1	ZINC000156165182	197092177	/nfs/dbraw/zinc/09/21/77/197092177.db2.gz	OJQZIDLNPSOJLD-SECBINFHSA-N	0	3	307.427	2.238	10	0		DEAEHN
CC(C)CN1CCC[C@@H]1CN[C@H](C(N)=O)c1ccc(F)cc1	ZINC000155208460	197033536	/nfs/dbraw/zinc/03/35/36/197033536.db2.gz	SEEVIFOCNIAXTK-CVEARBPZSA-N	0	3	307.413	2.062	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCCc2cc3ccccc3o2)C1	ZINC000120737843	195227508	/nfs/dbraw/zinc/22/75/08/195227508.db2.gz	OMHGBGXJHVWZRK-CQSZACIVSA-N	0	3	301.390	2.321	10	0		DEAEHN
CC(=O)c1cnc(NC(=O)CCN(C)c2ccncc2)s1	ZINC000543714997	285306314	/nfs/dbraw/zinc/30/63/14/285306314.db2.gz	RPAZIEVNAUMYHG-UHFFFAOYSA-N	0	3	304.375	2.206	10	0		DEAEHN
CNC(=O)[C@@H]1C[C@H]2CN(Cc3ccc(C)s3)C[C@H]2N1C(C)C	ZINC000248117083	257108051	/nfs/dbraw/zinc/10/80/51/257108051.db2.gz	SRBJVBOJBCLYEK-CWRNSKLLSA-N	0	3	321.490	2.086	10	0		DEAEHN
CCOC[C@H]1CCN(C)C2(CN(Cc3cccnc3OC)C2)C1	ZINC000248145471	257108126	/nfs/dbraw/zinc/10/81/26/257108126.db2.gz	RQAGLJMRBPHHQY-HNNXBMFYSA-N	0	3	319.449	2.023	10	0		DEAEHN
C(CN1CCO[C@@H]2[C@H](OCC3CC3)CC[C@H]21)N1CCCCC1	ZINC000247841953	257116088	/nfs/dbraw/zinc/11/60/88/257116088.db2.gz	OJZXKKGWCJAELF-KURKYZTESA-N	0	3	308.466	2.131	10	0		DEAEHN
Cc1cccc(CN2C(=O)C[C@@H]3[C@H]2CCN3Cc2ccncc2)n1	ZINC000247862337	257116405	/nfs/dbraw/zinc/11/64/05/257116405.db2.gz	GYSZRRZUGDJXEH-QZTJIDSGSA-N	0	3	322.412	2.160	10	0		DEAEHN
c1cncc(C[C@@H]2[C@H](OCC3CC3)CCN2[C@@H]2CCOC2)c1	ZINC000247851487	257116644	/nfs/dbraw/zinc/11/66/44/257116644.db2.gz	RUSYQJTWRATFLC-KZNAEPCWSA-N	0	3	302.418	2.283	10	0		DEAEHN
CCc1cccc(NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C)c1	ZINC000121827177	195356922	/nfs/dbraw/zinc/35/69/22/195356922.db2.gz	DKMVLMGHZAHOQF-MRXNPFEDSA-N	0	3	319.449	2.280	10	0		DEAEHN
CO[C@@H](C)CCC(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190622801	533324601	/nfs/dbraw/zinc/32/46/01/533324601.db2.gz	DASGJGGZERTVOH-DOTOQJQBSA-N	0	3	319.449	2.177	10	0		DEAEHN
Cc1ccc([C@@H](C)N[C@@H]2CCN(C3CCOCC3)C2=O)cc1	ZINC000358182582	133126749	/nfs/dbraw/zinc/12/67/49/133126749.db2.gz	CSXIIHJSWCEAPA-RHSMWYFYSA-N	0	3	302.418	2.426	10	0		DEAEHN
CN1CCC(CC(=O)NCc2ccn(-c3ccccc3)n2)CC1	ZINC000362645190	133243174	/nfs/dbraw/zinc/24/31/74/133243174.db2.gz	YBCVMJGFGHJTMA-UHFFFAOYSA-N	0	3	312.417	2.220	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccc(O[C@@H]3CCOC3)cc2)C1	ZINC000329868639	404478150	/nfs/dbraw/zinc/47/81/50/404478150.db2.gz	XRKAIYGWIJVIAQ-DOTOQJQBSA-N	0	3	318.417	2.068	10	0		DEAEHN
C[C@H](C(=O)N1CCC(C)CC1)N1CCC(Cn2cccn2)CC1	ZINC000105886035	144624822	/nfs/dbraw/zinc/62/48/22/144624822.db2.gz	OPJMIJVHPCSNHJ-MRXNPFEDSA-N	0	3	318.465	2.242	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccnn2[C@@H](C)C2CC2)C1	ZINC000187729338	145003316	/nfs/dbraw/zinc/00/33/16/145003316.db2.gz	RIASGNARPSUPNH-GXTWGEPZSA-N	0	3	305.426	2.460	10	0		DEAEHN
O=C(c1cn2ccnc2s1)N1CCCN(C2CCCC2)CC1	ZINC000188534962	145013410	/nfs/dbraw/zinc/01/34/10/145013410.db2.gz	LAXNQPWJSPRCHZ-UHFFFAOYSA-N	0	3	318.446	2.486	10	0		DEAEHN
CC(C)c1nccn1CCC(=O)NCc1ccc2c(c1)CNC2	ZINC000188679982	145015546	/nfs/dbraw/zinc/01/55/46/145015546.db2.gz	IXPJAUSDFTUDMS-UHFFFAOYSA-N	0	3	312.417	2.316	10	0		DEAEHN
COc1ccc(C(=O)N2CC[C@H](N(C)C)C2)c(OC(C)C)c1	ZINC000191173791	145054098	/nfs/dbraw/zinc/05/40/98/145054098.db2.gz	MXYRRORESBNOKF-ZDUSSCGKSA-N	0	3	306.406	2.259	10	0		DEAEHN
Oc1ccc(N2CCN(C[C@@H](O)C3CCCCC3)CC2)cc1	ZINC000191221658	145054675	/nfs/dbraw/zinc/05/46/75/145054675.db2.gz	ZHOKDNXCBJZNQB-GOSISDBHSA-N	0	3	304.434	2.455	10	0		DEAEHN
Cc1ccc(CN[C@H]2CCCOC2)c(-n2cc(Cl)cn2)n1	ZINC000191533881	145060399	/nfs/dbraw/zinc/06/03/99/145060399.db2.gz	YGVOIVJSVHQCBE-AWEZNQCLSA-N	0	3	306.797	2.498	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2n[nH]c3c2CCCCC3)CCN1C	ZINC000191856295	145066111	/nfs/dbraw/zinc/06/61/11/145066111.db2.gz	ZMXORJQSPBNZTG-STQMWFEESA-N	0	3	304.438	2.233	10	0		DEAEHN
CC1(C)CCCN1CCN(Cc1ccccc1)S(C)(=O)=O	ZINC000191990165	145069000	/nfs/dbraw/zinc/06/90/00/145069000.db2.gz	ANSPWLUYPDVVND-UHFFFAOYSA-N	0	3	310.463	2.323	10	0		DEAEHN
C[C@@H]1CN(C[C@@H](O)c2ccc(Cl)cc2)C[C@@H]1N1CCOCC1	ZINC000246563793	145107044	/nfs/dbraw/zinc/10/70/44/145107044.db2.gz	UYLYWNJUQYJLOX-XOKHGSTOSA-N	0	3	324.852	2.026	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(N(C)C)cc1F	ZINC000246605045	145108446	/nfs/dbraw/zinc/10/84/46/145108446.db2.gz	HMBMYJQFTILHQX-JSGCOSHPSA-N	0	3	305.397	2.200	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)CSCc1ccccn1	ZINC000246982005	145121758	/nfs/dbraw/zinc/12/17/58/145121758.db2.gz	OLNWBQPRWQKNRO-HOTGVXAUSA-N	0	3	319.474	2.400	10	0		DEAEHN
O=C(CCN1CCS[C@@H]2COCC[C@H]21)Nc1ccc(F)cc1	ZINC000246991197	145122199	/nfs/dbraw/zinc/12/21/99/145122199.db2.gz	PFZCGQLPUDBFPN-HUUCEWRRSA-N	0	3	324.421	2.361	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cccc2c1OCCO2	ZINC000247021099	145124010	/nfs/dbraw/zinc/12/40/10/145124010.db2.gz	SOXVLFSLXKHSQI-KBPBESRZSA-N	0	3	316.401	2.157	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)[C@H](C)N2CCN3CCC[C@H]3C2)c1	ZINC000247071711	145126172	/nfs/dbraw/zinc/12/61/72/145126172.db2.gz	GNMACHLQEXWEHN-HOTGVXAUSA-N	0	3	301.434	2.410	10	0		DEAEHN
CN1CCC[C@H]2CN(C(=O)C(=O)c3ccc(Cl)cc3)CC[C@H]21	ZINC000247114340	145126754	/nfs/dbraw/zinc/12/67/54/145126754.db2.gz	QTSSRJFHYMAKBI-DZGCQCFKSA-N	0	3	320.820	2.465	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@H](c2ccccc2)N(C)C)CCN1C	ZINC000247342980	145134064	/nfs/dbraw/zinc/13/40/64/145134064.db2.gz	JHGJCWURZSQCDH-PVAVHDDUSA-N	0	3	303.450	2.230	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@H](C)Oc2cccc(F)c2)C1	ZINC000247354477	145134490	/nfs/dbraw/zinc/13/44/90/145134490.db2.gz	OFDDEQXXQHRSPG-WWGRRREGSA-N	0	3	308.397	2.438	10	0		DEAEHN
CN1CC[C@H](NC(=O)CC2(O)CCCC2)[C@H]1c1ccccc1	ZINC000247981933	145146068	/nfs/dbraw/zinc/14/60/68/145146068.db2.gz	HOXYCRAIWHTRLL-DOTOQJQBSA-N	0	3	302.418	2.243	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)CN1CC[C@@]2(O)CCCC[C@H]2C1	ZINC000248039263	145147273	/nfs/dbraw/zinc/14/72/73/145147273.db2.gz	SLDXRWFXEAFVDS-JZXOWHBKSA-N	0	3	308.466	2.405	10	0		DEAEHN
Cc1ccccc1NC(=O)CCN1CCN2CCCC[C@H]2C1	ZINC000248345832	145151014	/nfs/dbraw/zinc/15/10/14/145151014.db2.gz	NFWKBLIAZZKDJJ-INIZCTEOSA-N	0	3	301.434	2.494	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCCC[C@H]2CCCCO2)CCN1C	ZINC000248887555	145172333	/nfs/dbraw/zinc/17/23/33/145172333.db2.gz	QVNDIPKXBSKFJS-BZUAXINKSA-N	0	3	311.470	2.460	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCc1ccncn1	ZINC000249055295	145176530	/nfs/dbraw/zinc/17/65/30/145176530.db2.gz	OQYKJXAGAJPRGR-MAUKXSAKSA-N	0	3	324.428	2.046	10	0		DEAEHN
CCN(C[C@@H](O)COC(C)(C)C)C[C@@H]1COc2ccccc2O1	ZINC000249372172	145183010	/nfs/dbraw/zinc/18/30/10/145183010.db2.gz	DCORKMQWYRVKEN-HUUCEWRRSA-N	0	3	323.433	2.324	10	0		DEAEHN
CO[C@@H]1CC[C@@H]2OCCN(CCCCCn3cccn3)[C@H]2C1	ZINC000252801604	145201129	/nfs/dbraw/zinc/20/11/29/145201129.db2.gz	CPEKPVBJMRTZER-IKGGRYGDSA-N	0	3	307.438	2.322	10	0		DEAEHN
O=c1[nH]c(CCN2CCN3CCCC[C@H]3C2)nc2ccccc21	ZINC000253551386	145202235	/nfs/dbraw/zinc/20/22/35/145202235.db2.gz	ZTHJKWPFLTWDAE-AWEZNQCLSA-N	0	3	312.417	2.048	10	0		DEAEHN
Cc1ncc(-c2ccc(NC(=O)C3(N)CCOCC3)cc2)o1	ZINC000261695662	145217589	/nfs/dbraw/zinc/21/75/89/145217589.db2.gz	DLRBHCJKGSDPJS-UHFFFAOYSA-N	0	3	301.346	2.096	10	0		DEAEHN
CN(Cc1ccc(F)cc1Cl)C(=O)[C@@H](N)C1CCOCC1	ZINC000261770075	145224075	/nfs/dbraw/zinc/22/40/75/145224075.db2.gz	MFIBDIWQUTZLNV-AWEZNQCLSA-N	0	3	314.788	2.191	10	0		DEAEHN
O=C(CN1CCNC[C@H]1c1cccc(F)c1)NC1CCCCC1	ZINC000261790334	145226892	/nfs/dbraw/zinc/22/68/92/145226892.db2.gz	QBXJZOQYMLJRHP-KRWDZBQOSA-N	0	3	319.424	2.221	10	0		DEAEHN
Cc1ccc(C(C)(C)CN(C)C(=O)C2(N)CCOCC2)cc1	ZINC000261799603	145227114	/nfs/dbraw/zinc/22/71/14/145227114.db2.gz	ITEVZLVORKLVLS-UHFFFAOYSA-N	0	3	304.434	2.239	10	0		DEAEHN
Cc1ccc2ncc(CN3CCNC[C@H]3c3cccnc3)n2c1	ZINC000261796310	145227585	/nfs/dbraw/zinc/22/75/85/145227585.db2.gz	VLXBZFDECXWROV-KRWDZBQOSA-N	0	3	307.401	2.184	10	0		DEAEHN
NC1(C(=O)NCCSc2ccc(Cl)cc2)CCOCC1	ZINC000261814983	145229657	/nfs/dbraw/zinc/22/96/57/145229657.db2.gz	JXFZBNYFYBBIRS-UHFFFAOYSA-N	0	3	314.838	2.056	10	0		DEAEHN
NC1(C(=O)Nc2ccc(Nc3ccccc3)nc2)CCOCC1	ZINC000261817882	145229991	/nfs/dbraw/zinc/22/99/91/145229991.db2.gz	KBVWNPNMWSLFNP-UHFFFAOYSA-N	0	3	312.373	2.272	10	0		DEAEHN
C[C@H](NC(=O)[C@@H](N)C1CCOCC1)c1ccc(Cl)s1	ZINC000261851927	145233609	/nfs/dbraw/zinc/23/36/09/145233609.db2.gz	RPXFYKAJZCKQMZ-UFBFGSQYSA-N	0	3	302.827	2.333	10	0		DEAEHN
Cc1cccc(CN(C)C(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000261908724	145240067	/nfs/dbraw/zinc/24/00/67/145240067.db2.gz	PWJBEEYRGWKSOU-TXPKVOOTSA-N	0	3	316.445	2.486	10	0		DEAEHN
N[C@H](C(=O)NC[C@H]1CCCC[C@@H]1C(F)(F)F)C1CCOCC1	ZINC000261940366	145244728	/nfs/dbraw/zinc/24/47/28/145244728.db2.gz	JHRRVEQQQINXQZ-AGIUHOORSA-N	0	3	322.371	2.225	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N[C@@H]1C[C@H]1c1ccccc1	ZINC000261940032	145244792	/nfs/dbraw/zinc/24/47/92/145244792.db2.gz	UQDLGVYBTCTAEJ-DBDOFBCQSA-N	0	3	314.429	2.191	10	0		DEAEHN
COc1ccccc1[C@H]1CNCCN1Cc1nccn1C(F)F	ZINC000262205178	145269439	/nfs/dbraw/zinc/26/94/39/145269439.db2.gz	KUYHSIBXOGUWLD-CYBMUJFWSA-N	0	3	322.359	2.433	10	0		DEAEHN
CN(C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C)c1ccc(F)cc1	ZINC000262468395	145285567	/nfs/dbraw/zinc/28/55/67/145285567.db2.gz	JBDZXNWZGVPNCI-CKEIUWERSA-N	0	3	306.381	2.321	10	0		DEAEHN
O=C(COc1cccc(F)c1)NC[C@H]1NCCc2ccccc21	ZINC000262473954	145286688	/nfs/dbraw/zinc/28/66/88/145286688.db2.gz	YQFYFHIRQMFXAG-QGZVFWFLSA-N	0	3	314.360	2.208	10	0		DEAEHN
Cc1csc(C2(NC(=O)C[C@@H]3CSCCN3)CCC2)n1	ZINC000262745080	145302909	/nfs/dbraw/zinc/30/29/09/145302909.db2.gz	FSCSXUPANUAWFX-LLVKDONJSA-N	0	3	311.476	2.042	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(C(C)(C)Cc2ccccc2)n1	ZINC000263155689	145330448	/nfs/dbraw/zinc/33/04/48/145330448.db2.gz	DJIHMTPLZODILT-AWEZNQCLSA-N	0	3	300.406	2.166	10	0		DEAEHN
C[C@H]1CCc2sc(-c3nc([C@H]4CNCCN4C)no3)cc2C1	ZINC000263200639	145335389	/nfs/dbraw/zinc/33/53/89/145335389.db2.gz	JAIRNQIPVDRXMR-CMPLNLGQSA-N	0	3	318.446	2.499	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2ccc(OC(C)(C)C)cc2)n1	ZINC000263211756	145336469	/nfs/dbraw/zinc/33/64/69/145336469.db2.gz	KIOGRQBHVFDFJQ-CQSZACIVSA-N	0	3	316.405	2.490	10	0		DEAEHN
c1nc2ccccc2n1CCCNCc1cn2cccnc2n1	ZINC000357012813	147022866	/nfs/dbraw/zinc/02/28/66/147022866.db2.gz	RUVKUYRODDPDFK-UHFFFAOYSA-N	0	3	306.373	2.259	10	0		DEAEHN
CC[C@H](C)N[C@H](CNC(=O)Cn1nc(C)cc1C)c1ccco1	ZINC000359536800	147346218	/nfs/dbraw/zinc/34/62/18/147346218.db2.gz	KOZSZTROZKRKQC-SWLSCSKDSA-N	0	3	318.421	2.339	10	0		DEAEHN
CCCc1occc1C(=O)NC1CCN([C@@H]2CCOC2)CC1	ZINC000374232264	148220629	/nfs/dbraw/zinc/22/06/29/148220629.db2.gz	RUOFNJLGUHGBEW-CQSZACIVSA-N	0	3	306.406	2.215	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)NCCC1=CCCCC1	ZINC000111785525	401723392	/nfs/dbraw/zinc/72/33/92/401723392.db2.gz	HTTUYWGXWMOGKR-INIZCTEOSA-N	0	3	309.454	2.287	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000073896257	401724356	/nfs/dbraw/zinc/72/43/56/401724356.db2.gz	LLERNUWBHSHDTM-CZUORRHYSA-N	0	3	315.417	2.107	10	0		DEAEHN
CCC(CC)[C@H](O)CNC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000111826630	401724770	/nfs/dbraw/zinc/72/47/70/401724770.db2.gz	WUHVVOFGORXEPP-LSDHHAIUSA-N	0	3	301.475	2.059	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1c2ccccc2C[C@H]1C	ZINC000111865944	401726440	/nfs/dbraw/zinc/72/64/40/401726440.db2.gz	XYQCVSQGDYWPOY-GDBMZVCRSA-N	0	3	317.433	2.258	10	0		DEAEHN
Fc1cc(CNCCN2CCOCC2)ccc1Br	ZINC000127354105	401730574	/nfs/dbraw/zinc/73/05/74/401730574.db2.gz	NSHDSSPOXVXJKX-UHFFFAOYSA-N	0	3	317.202	2.010	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)N[C@H](C)C3CC3)cc2)CC1	ZINC000074196521	401732950	/nfs/dbraw/zinc/73/29/50/401732950.db2.gz	GWTPTAOMCAYKIA-CQSZACIVSA-N	0	3	301.434	2.357	10	0		DEAEHN
Cc1nn(C)c(C)c1CN1CCC(c2nnc3ccccn32)CC1	ZINC000112337602	401739600	/nfs/dbraw/zinc/73/96/00/401739600.db2.gz	DJOPEMDHSQSTMI-UHFFFAOYSA-N	0	3	324.432	2.459	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2cncc(Br)c2)C1	ZINC000126417272	401693156	/nfs/dbraw/zinc/69/31/56/401693156.db2.gz	YRJKSRIMVXBURZ-LLVKDONJSA-N	0	3	313.199	2.012	10	0		DEAEHN
CC(C)N1CCN(c2ccc(C(=O)N[C@@H]3C[C@H]3C)cc2)CC1	ZINC000072094588	401703647	/nfs/dbraw/zinc/70/36/47/401703647.db2.gz	WYPZUWOKMSEQFQ-RHSMWYFYSA-N	0	3	301.434	2.355	10	0		DEAEHN
O[C@@H](CN1CCCC[C@@H]1CN1CCOCC1)c1ccc(F)cc1	ZINC000111302420	401710170	/nfs/dbraw/zinc/71/01/70/401710170.db2.gz	HKPAHDBHAIYYDQ-MSOLQXFVSA-N	0	3	322.424	2.046	10	0		DEAEHN
Fc1ccc(Br)c(CNCCCn2ccnn2)c1	ZINC000126886375	401711838	/nfs/dbraw/zinc/71/18/38/401711838.db2.gz	HUULSTMQKGCIDK-UHFFFAOYSA-N	0	3	313.174	2.360	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1nc(C2CC2)cs1	ZINC000111413557	401715157	/nfs/dbraw/zinc/71/51/57/401715157.db2.gz	GRLBXWKCJDJIHH-GFCCVEGCSA-N	0	3	324.450	2.253	10	0		DEAEHN
O=C(CN[C@@H]1CCCC[C@@H]1n1cccn1)NC(C1CC1)C1CC1	ZINC000129090299	401798677	/nfs/dbraw/zinc/79/86/77/401798677.db2.gz	UPIBLYFFJQQDPB-CVEARBPZSA-N	0	3	316.449	2.261	10	0		DEAEHN
CCN(Cc1ccc(Cl)s1)C(=O)C1(N)CCOCC1	ZINC000127803427	401751146	/nfs/dbraw/zinc/75/11/46/401751146.db2.gz	XBFDVZALSFBWEO-UHFFFAOYSA-N	0	3	302.827	2.258	10	0		DEAEHN
Cc1noc([C@H]2CCCN(C[C@](C)(O)c3ccccc3)C2)n1	ZINC000075827427	401769670	/nfs/dbraw/zinc/76/96/70/401769670.db2.gz	BJZUDDIHMQQKIX-YOEHRIQHSA-N	0	3	301.390	2.465	10	0		DEAEHN
CCOc1ncc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1Cl	ZINC000113222467	401770319	/nfs/dbraw/zinc/77/03/19/401770319.db2.gz	QDRPFFRPPULLGQ-WCQYABFASA-N	0	3	323.824	2.442	10	0		DEAEHN
Cc1ccc(O[C@H](C)C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1	ZINC000113226778	401770858	/nfs/dbraw/zinc/77/08/58/401770858.db2.gz	NLJUVLKUAFRQHZ-ARFHVFGLSA-N	0	3	302.418	2.457	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)CC1CCCCC1	ZINC000113305825	401776336	/nfs/dbraw/zinc/77/63/36/401776336.db2.gz	TVJDGKAOLWNPFD-DZGCQCFKSA-N	0	3	300.468	2.065	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)NCc1cccc(OC)n1	ZINC000113608299	401783897	/nfs/dbraw/zinc/78/38/97/401783897.db2.gz	MIUZZCMHLDYNJI-OAHLLOKOSA-N	0	3	320.437	2.154	10	0		DEAEHN
CN1CCC(NC(=O)N2CCC[C@@H](c3nccs3)C2)CC1	ZINC000114819219	401811153	/nfs/dbraw/zinc/81/11/53/401811153.db2.gz	ZEQRPJUYDHBWCH-GFCCVEGCSA-N	0	3	308.451	2.126	10	0		DEAEHN
CCOCCC1(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)CC1	ZINC000132618964	401870551	/nfs/dbraw/zinc/87/05/51/401870551.db2.gz	GDOZBXDKMZDREL-CABCVRRESA-N	0	3	311.470	2.317	10	0		DEAEHN
CSC[C@H](C)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000077572372	401820910	/nfs/dbraw/zinc/82/09/10/401820910.db2.gz	ZPUSYXICWFKHGQ-DZGCQCFKSA-N	0	3	309.479	2.210	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)c1cc(C(C)(C)C)nn1C	ZINC000077639391	401823168	/nfs/dbraw/zinc/82/31/68/401823168.db2.gz	QOQAOZHVBCKKCE-CYBMUJFWSA-N	0	3	306.454	2.322	10	0		DEAEHN
CC(C)(CNC(=O)NC[C@H]1CCCC[C@H]1O)N1CCCCC1	ZINC000077753382	401828783	/nfs/dbraw/zinc/82/87/83/401828783.db2.gz	HEECTJHOLOODLY-HUUCEWRRSA-N	0	3	311.470	2.101	10	0		DEAEHN
Cn1cc([C@@H]2CCN(CCC(=O)Nc3ccccc3F)C2)cn1	ZINC000116314231	401849446	/nfs/dbraw/zinc/84/94/46/401849446.db2.gz	UNDNVEQCEBBDAQ-CYBMUJFWSA-N	0	3	316.380	2.377	10	0		DEAEHN
CN(C)CCn1ccc(NC(=O)Cc2cnc3ccccc3c2)n1	ZINC000131405862	401849679	/nfs/dbraw/zinc/84/96/79/401849679.db2.gz	GNKNIWANPRYYRT-UHFFFAOYSA-N	0	3	323.400	2.174	10	0		DEAEHN
CO[C@@]12CCC(=O)C[C@@]13CCN(C)[C@@H]2Cc1cccc(O)c13	ZINC000029334780	401855963	/nfs/dbraw/zinc/85/59/63/401855963.db2.gz	ISYGHNUANOXWEZ-KBAYOESNSA-N	0	3	301.386	2.028	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2ccc(Cl)c(Cl)c2)CCO1	ZINC000116796179	401859036	/nfs/dbraw/zinc/85/90/36/401859036.db2.gz	UJPNTPVVVNAHJQ-NSHDSACASA-N	0	3	317.216	2.396	10	0		DEAEHN
Cc1cccc([C@@H](C)NC(=O)N2CCO[C@@H](CN(C)C)C2)c1C	ZINC000117052187	401867774	/nfs/dbraw/zinc/86/77/74/401867774.db2.gz	JUYQILAJYXFOEY-CVEARBPZSA-N	0	3	319.449	2.336	10	0		DEAEHN
COCCOc1ccc(CNC(=O)CN2CCCC2(C)C)cc1	ZINC000077382968	401813515	/nfs/dbraw/zinc/81/35/15/401813515.db2.gz	PNJGDMBIPASIMF-UHFFFAOYSA-N	0	3	320.433	2.202	10	0		DEAEHN
CC[C@H]1CN(CCCc2cccc(OC)c2)CCN1C[C@@H](C)O	ZINC000119147707	401929525	/nfs/dbraw/zinc/92/95/25/401929525.db2.gz	BNFIAMSOLBZVQA-AEFFLSMTSA-N	0	3	320.477	2.405	10	0		DEAEHN
CC[C@H]1CCCCCN1C(=O)NC1CCN(CCN(C)C)CC1	ZINC000119198706	401932342	/nfs/dbraw/zinc/93/23/42/401932342.db2.gz	VCLUFRJTKDKSID-KRWDZBQOSA-N	0	3	324.513	2.377	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)Nn1cnc2ccccc21	ZINC000079496080	401874433	/nfs/dbraw/zinc/87/44/33/401874433.db2.gz	VCOIDJNZFGVSPV-ZDUSSCGKSA-N	0	3	303.410	2.266	10	0		DEAEHN
CCOc1c(F)cccc1C(=O)Nc1ccn(CCN(C)C)n1	ZINC000079829204	401881494	/nfs/dbraw/zinc/88/14/94/401881494.db2.gz	FYIXCIYJQRXONM-UHFFFAOYSA-N	0	3	320.368	2.235	10	0		DEAEHN
CCN1CCN(C[C@H](C)CNC(=O)N2C[C@H](C)CC[C@@H]2C)CC1	ZINC000080434001	401889486	/nfs/dbraw/zinc/88/94/86/401889486.db2.gz	VYQSFPDJMRIYJR-ZACQAIPSSA-N	0	3	324.513	2.090	10	0		DEAEHN
CC(C)(C)OC[C@H](O)CN1CCC(O)(c2ccccc2)CC1	ZINC000034255405	401892721	/nfs/dbraw/zinc/89/27/21/401892721.db2.gz	BOJOZWKSQMAMSF-MRXNPFEDSA-N	0	3	307.434	2.146	10	0		DEAEHN
COC(=O)c1ccc(CN2CC[C@@H](c3cnn(C)c3)C2)s1	ZINC000119241965	401935655	/nfs/dbraw/zinc/93/56/55/401935655.db2.gz	NEUMHQTWWXTRNU-LLVKDONJSA-N	0	3	305.403	2.258	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)Nc2ccc(F)cc2Cl)CCO1	ZINC000118789987	401908003	/nfs/dbraw/zinc/90/80/03/401908003.db2.gz	UXEVSXBZBWAQAD-NSHDSACASA-N	0	3	315.776	2.273	10	0		DEAEHN
CN(Cc1ccccc1)CC(C)(C)NCC(=O)NC(C)(C)C	ZINC000119008432	401919179	/nfs/dbraw/zinc/91/91/79/401919179.db2.gz	QFDFPFGYRYZKDJ-UHFFFAOYSA-N	0	3	305.466	2.401	10	0		DEAEHN
Cc1ccc(CCN2CC[C@@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000135685822	401950684	/nfs/dbraw/zinc/95/06/84/401950684.db2.gz	KNTPNVHBRUSSID-QGZVFWFLSA-N	0	3	322.474	2.037	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCc3ccc(F)cc3C2)C1	ZINC000136522768	401968875	/nfs/dbraw/zinc/96/88/75/401968875.db2.gz	AMLLVEUIXSBOPJ-INIZCTEOSA-N	0	3	305.397	2.378	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000119954957	401972817	/nfs/dbraw/zinc/97/28/17/401972817.db2.gz	DFVWVZZRVYSAOJ-QWHCGFSZSA-N	0	3	322.478	2.342	10	0		DEAEHN
C[C@@H](NC(=O)N1CCN(C2CCCCC2)CC1)[C@@H]1CCCO1	ZINC000136968657	401976810	/nfs/dbraw/zinc/97/68/10/401976810.db2.gz	ZUTWQXQXXWZFRH-ZBFHGGJFSA-N	0	3	309.454	2.214	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@H](c1ccccc1)N(C)C	ZINC000137111461	401979130	/nfs/dbraw/zinc/97/91/30/401979130.db2.gz	LBCIXODEBOHKAJ-IRXDYDNUSA-N	0	3	305.466	2.382	10	0		DEAEHN
CCN1CCN(C[C@H](C)CNC(=O)Nc2ccccc2)CC1	ZINC000047270977	401980336	/nfs/dbraw/zinc/98/03/36/401980336.db2.gz	QYDULXKWAYYQTO-OAHLLOKOSA-N	0	3	304.438	2.082	10	0		DEAEHN
COc1ccc(NC(=O)c2ccccc2OCCN(C)C)cn1	ZINC000047295267	401980794	/nfs/dbraw/zinc/98/07/94/401980794.db2.gz	ZVALQDGUAOTSGT-UHFFFAOYSA-N	0	3	315.373	2.283	10	0		DEAEHN
COc1cc([C@@H](C)NCC2(CS(C)(=O)=O)CC2)ccc1F	ZINC000090182959	401981018	/nfs/dbraw/zinc/98/10/18/401981018.db2.gz	DZCMGVCRWNYCNG-LLVKDONJSA-N	0	3	315.410	2.310	10	0		DEAEHN
Cc1nc(CCNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)sc1C	ZINC000120697156	401999041	/nfs/dbraw/zinc/99/90/41/401999041.db2.gz	OZKLBNWRHOOGKI-RISCZKNCSA-N	0	3	324.494	2.427	10	0		DEAEHN
Cc1ccc([C@H](C)N(C)CCn2nc3ccccn3c2=O)cc1	ZINC000047965069	401991232	/nfs/dbraw/zinc/99/12/32/401991232.db2.gz	KKSQFRRSUPRBOK-HNNXBMFYSA-N	0	3	310.401	2.497	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2ccc(C)c(C(F)(F)F)c2)C1	ZINC000044270647	401941151	/nfs/dbraw/zinc/94/11/51/401941151.db2.gz	BHFAAXYDEQBGRX-ZYHUDNBSSA-N	0	3	302.296	2.329	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H](C)N1CCc2sccc2C1)N(C)C	ZINC000135635706	401948887	/nfs/dbraw/zinc/94/88/87/401948887.db2.gz	RQFIIIDGELAAAR-DZGCQCFKSA-N	0	3	323.506	2.341	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cc(Br)ccc1F	ZINC000049096017	402012367	/nfs/dbraw/zinc/01/23/67/402012367.db2.gz	PFKQYYLFFBZYDW-JTQLQIEISA-N	0	3	315.186	2.412	10	0		DEAEHN
COc1ccccc1/C=C/CN1CCN(C[C@@H]2CCOC2)CC1	ZINC000093817731	402021161	/nfs/dbraw/zinc/02/11/61/402021161.db2.gz	VBZRDYKBDJPCEL-YXMMZVCTSA-N	0	3	316.445	2.363	10	0		DEAEHN
CCN(C[C@H]1CCN(C[C@H](O)C(F)(F)F)C1)CC(F)(F)F	ZINC000121423074	402035234	/nfs/dbraw/zinc/03/52/34/402035234.db2.gz	LSRMXCXLMRLMES-ZJUUUORDSA-N	0	3	322.293	2.116	10	0		DEAEHN
Cn1ncc2c1CCC[C@@H]2NCc1cccnc1-n1ccnc1	ZINC000151546976	402042684	/nfs/dbraw/zinc/04/26/84/402042684.db2.gz	GJYPICMPQYOKFL-HNNXBMFYSA-N	0	3	308.389	2.168	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCOc2ccc(C)cc2)C1	ZINC000052498136	402042998	/nfs/dbraw/zinc/04/29/98/402042998.db2.gz	SWIHOJHXUONJIJ-OAHLLOKOSA-N	0	3	305.422	2.157	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2ccc(OC(C)C)nc2)C1	ZINC000052527183	402043957	/nfs/dbraw/zinc/04/39/57/402043957.db2.gz	ZJEYIZJMOQOLGK-HNNXBMFYSA-N	0	3	320.437	2.152	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)CCOc2ccccc2C)C1	ZINC000052593449	402044296	/nfs/dbraw/zinc/04/42/96/402044296.db2.gz	KQTPTXDLVVXEHH-MRXNPFEDSA-N	0	3	319.449	2.500	10	0		DEAEHN
CCCn1cc(CN2CCCN(CC3=CCCOC3)CC2)cn1	ZINC000121681189	402048015	/nfs/dbraw/zinc/04/80/15/402048015.db2.gz	BJZCOVSGGPYMIJ-UHFFFAOYSA-N	0	3	318.465	2.148	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2cccc(-c3nccn3C)c2)C1	ZINC000150867246	402001572	/nfs/dbraw/zinc/00/15/72/402001572.db2.gz	OEYBLGMEHQIVSI-OAHLLOKOSA-N	0	3	313.405	2.255	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1csc([C@@H]2CCCO2)n1	ZINC000151817329	402058519	/nfs/dbraw/zinc/05/85/19/402058519.db2.gz	IARLFILKQYDICR-BZPMIXESSA-N	0	3	321.446	2.303	10	0		DEAEHN
CCN(CC)[C@H](C)CNC(=O)CSCC(=O)c1ccccc1	ZINC000121018007	402010603	/nfs/dbraw/zinc/01/06/03/402010603.db2.gz	BJCQPFQMABMSDC-CQSZACIVSA-N	0	3	322.474	2.449	10	0		DEAEHN
COC(=O)[C@H](C)[C@H](NCCC(=O)NC(C)C)c1ccccc1	ZINC000152095296	402075431	/nfs/dbraw/zinc/07/54/31/402075431.db2.gz	HZPHAGUGZQODFR-CJNGLKHVSA-N	0	3	306.406	2.041	10	0		DEAEHN
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCCN1CCCC[C@@H]1C	ZINC000056770092	402090504	/nfs/dbraw/zinc/09/05/04/402090504.db2.gz	UCTZZJWVQTYUSB-GJZGRUSLSA-N	0	3	319.449	2.497	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(Cc2cc(C(N)=O)cs2)C1	ZINC000122944490	402102946	/nfs/dbraw/zinc/10/29/46/402102946.db2.gz	CZXAEIFPHNPUSO-CYBMUJFWSA-N	0	3	318.446	2.443	10	0		DEAEHN
CN(C)CCN(Cc1ccco1)C(=O)NCc1cscn1	ZINC000123022626	402106343	/nfs/dbraw/zinc/10/63/43/402106343.db2.gz	DRZNJNBKJNXPKW-UHFFFAOYSA-N	0	3	308.407	2.010	10	0		DEAEHN
COc1cccc2c1CC[C@H]2NC(=O)NC[C@@H]1CCCN1C	ZINC000123104281	402110662	/nfs/dbraw/zinc/11/06/62/402110662.db2.gz	LNBIBQLZVWSNEQ-SWLSCSKDSA-N	0	3	303.406	2.076	10	0		DEAEHN
CC[C@](C)(O)C[NH+]1CCC(C(=O)Nc2ccccc2[O-])CC1	ZINC000123232622	402117135	/nfs/dbraw/zinc/11/71/35/402117135.db2.gz	DGLKUFULBLHCMH-KRWDZBQOSA-N	0	3	306.406	2.204	10	0		DEAEHN
C[C@@H](CO)[C@H](C)NCc1cc2c(cc1Br)OCO2	ZINC000123242064	402117520	/nfs/dbraw/zinc/11/75/20/402117520.db2.gz	BGBSYQYMZVYBKP-IUCAKERBSA-N	0	3	316.195	2.284	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000123257724	402118246	/nfs/dbraw/zinc/11/82/46/402118246.db2.gz	JLJPNLOBWWPCSJ-FZMZJTMJSA-N	0	3	321.396	2.339	10	0		DEAEHN
Cc1ccc([C@H]2CCCCN2CCCN2C(=O)CNC2=O)o1	ZINC000124622619	402188590	/nfs/dbraw/zinc/18/85/90/402188590.db2.gz	CMRCCGITEHOIMK-CYBMUJFWSA-N	0	3	305.378	2.057	10	0		DEAEHN
Cc1nn(C)c2sc(C(=O)N(C)[C@H]3CCN(C)[C@H](C)C3)cc12	ZINC000124708743	402192653	/nfs/dbraw/zinc/19/26/53/402192653.db2.gz	DYIRFKMRBLOPJQ-PWSUYJOCSA-N	0	3	320.462	2.498	10	0		DEAEHN
Cc1ccc([C@H](CNC(=O)Nc2nncs2)N(C)C)cc1	ZINC000067507425	402161321	/nfs/dbraw/zinc/16/13/21/402161321.db2.gz	HPNOLABPIXPRLF-LBPRGKRZSA-N	0	3	305.407	2.271	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)C(=O)c2ccc3c(c2)CCC3)CCN1C	ZINC000124082985	402163000	/nfs/dbraw/zinc/16/30/00/402163000.db2.gz	GDDLQCZIXPJGOA-GUYCJALGSA-N	0	3	314.429	2.299	10	0		DEAEHN
CC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000124274167	402172007	/nfs/dbraw/zinc/17/20/07/402172007.db2.gz	GAMRRTRACOJABQ-LRDDRELGSA-N	0	3	303.406	2.200	10	0		DEAEHN
NCC(=O)N1CCc2[nH]nc(-c3cccc4ccccc43)c2C1	ZINC000067847283	402174684	/nfs/dbraw/zinc/17/46/84/402174684.db2.gz	IDWBMNFKXGIQTD-UHFFFAOYSA-N	0	3	306.369	2.073	10	0		DEAEHN
O=C(CN1CCC[C@@H]1C1CCC1)N1CCO[C@H]2CCCC[C@H]21	ZINC000102927451	402175152	/nfs/dbraw/zinc/17/51/52/402175152.db2.gz	WHZIJCHFYCOVSB-ZACQAIPSSA-N	0	3	306.450	2.421	10	0		DEAEHN
COc1cccc(C(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)c1[O-]	ZINC000107529436	402234523	/nfs/dbraw/zinc/23/45/23/402234523.db2.gz	SUJMLDWOFSXVIT-AWEZNQCLSA-N	0	3	318.417	2.491	10	0		DEAEHN
CN(C)[C@H](CNC(=O)c1cnn2c1CCCC2)c1ccccc1	ZINC000125941966	402257922	/nfs/dbraw/zinc/25/79/22/402257922.db2.gz	HXAJUGKNUAXYOR-QGZVFWFLSA-N	0	3	312.417	2.252	10	0		DEAEHN
COc1ncc(Cl)c(NCCCNCc2cccnc2)n1	ZINC000125986349	402259544	/nfs/dbraw/zinc/25/95/44/402259544.db2.gz	IEZVPVPCKCRHMV-UHFFFAOYSA-N	0	3	307.785	2.125	10	0		DEAEHN
C[C@H](CNC(=O)N1CCO[C@H](c2ccsc2)C1)N(C)C1CC1	ZINC000124968179	402206166	/nfs/dbraw/zinc/20/61/66/402206166.db2.gz	HNDRSOXAQKMQIB-DOMZBBRYSA-N	0	3	323.462	2.314	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)NC[C@@H]1CCCN1C	ZINC000154358417	402208144	/nfs/dbraw/zinc/20/81/44/402208144.db2.gz	UYOMGGKRSOANIX-OCCSQVGLSA-N	0	3	321.469	2.401	10	0		DEAEHN
C[C@@H](C(=O)N1CCO[C@H](CN(C)C)C1)c1ccc(Cl)s1	ZINC000176608377	402323037	/nfs/dbraw/zinc/32/30/37/402323037.db2.gz	SWBLKZJGPLRCAN-GHMZBOCLSA-N	0	3	316.854	2.294	10	0		DEAEHN
CCc1ccc(C(C)(C)C(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000176608463	402323165	/nfs/dbraw/zinc/32/31/65/402323165.db2.gz	QTWCMMIYOAPNTB-KRWDZBQOSA-N	0	3	318.461	2.316	10	0		DEAEHN
CCc1cccc(CC(=O)N(CCN(C)C)C[C@H]2CCCO2)c1	ZINC000126153731	402267487	/nfs/dbraw/zinc/26/74/87/402267487.db2.gz	NUHXLXQXPREXPF-GOSISDBHSA-N	0	3	318.461	2.361	10	0		DEAEHN
CN(C)C(=O)C1CCN(Cc2ccc(-n3ccnc3)cc2)CC1	ZINC000071090286	402269865	/nfs/dbraw/zinc/26/98/65/402269865.db2.gz	KYFLDAKTMWMGDP-UHFFFAOYSA-N	0	3	312.417	2.173	10	0		DEAEHN
Fc1ccccc1OCCN1CCCC[C@@H]1CN1CCOCC1	ZINC000109819207	402276879	/nfs/dbraw/zinc/27/68/79/402276879.db2.gz	UXPUUXXCJCAJBK-MRXNPFEDSA-N	0	3	322.424	2.391	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1cccc2[nH]ccc21	ZINC000110091938	402280706	/nfs/dbraw/zinc/28/07/06/402280706.db2.gz	AKAUREBEEQJXEF-CYBMUJFWSA-N	0	3	316.405	2.400	10	0		DEAEHN
CCC1(C(=O)N2CCCC[C@@H](N3CCN(C)CC3)C2)CCC1	ZINC000176191303	402288631	/nfs/dbraw/zinc/28/86/31/402288631.db2.gz	WSBXSQGRXNJDJS-MRXNPFEDSA-N	0	3	307.482	2.195	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1ccc(O)c(OC)c1	ZINC000176193174	402288998	/nfs/dbraw/zinc/28/89/98/402288998.db2.gz	XYNZDYBBWIZEQK-CQSZACIVSA-N	0	3	321.421	2.027	10	0		DEAEHN
CC1(C)CCCC[C@@H]1NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000156910280	402289810	/nfs/dbraw/zinc/28/98/10/402289810.db2.gz	MXYOYGBEEOMEIE-CABCVRRESA-N	0	3	311.470	2.101	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)C1	ZINC000176289175	402296921	/nfs/dbraw/zinc/29/69/21/402296921.db2.gz	CNRMMWPSNZNWAQ-MRXNPFEDSA-N	0	3	311.385	2.022	10	0		DEAEHN
Cc1ccc2ncnc(N[C@@H](C)CCN3CCN(C)CC3)c2c1	ZINC000184827298	402302319	/nfs/dbraw/zinc/30/23/19/402302319.db2.gz	YRIDLDOBSWPWCY-HNNXBMFYSA-N	0	3	313.449	2.376	10	0		DEAEHN
CC(C)(C)OC(=O)NCC(C)(C)NCc1cccc(C(N)=O)c1	ZINC000221044727	402303019	/nfs/dbraw/zinc/30/30/19/402303019.db2.gz	QJJWINBTNLDLDK-UHFFFAOYSA-N	0	3	321.421	2.178	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cccc(F)c1Br	ZINC000226058292	402326009	/nfs/dbraw/zinc/32/60/09/402326009.db2.gz	YMQRTYNYHVCUFD-VIFPVBQESA-N	0	3	315.186	2.412	10	0		DEAEHN
NC(=O)[C@]1(O)CCCN(Cc2ccc(-c3ccccc3)cc2)C1	ZINC000225476408	402318227	/nfs/dbraw/zinc/31/82/27/402318227.db2.gz	WQSDNYCTBICZTB-IBGZPJMESA-N	0	3	310.397	2.166	10	0		DEAEHN
CCc1cccc(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000176951545	402353595	/nfs/dbraw/zinc/35/35/95/402353595.db2.gz	ILAQVSZTONKYFI-XJKSGUPXSA-N	0	3	310.463	2.256	10	0		DEAEHN
CCCc1noc(CCCC(=O)N(C)C[C@@H]2CCCN2CC)n1	ZINC000176968893	402355434	/nfs/dbraw/zinc/35/54/34/402355434.db2.gz	ZKGXITIMGRHQTK-AWEZNQCLSA-N	0	3	322.453	2.288	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc2ccccc2oc1=O	ZINC000176974394	402355899	/nfs/dbraw/zinc/35/58/99/402355899.db2.gz	LQQKLOGRYFFQSJ-CQSZACIVSA-N	0	3	314.385	2.349	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cccc(C(=O)OC)c1	ZINC000176976748	402356021	/nfs/dbraw/zinc/35/60/21/402356021.db2.gz	UEYUYXLGKGWXCI-OAHLLOKOSA-N	0	3	304.390	2.030	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CCc1nc2ccccc2[nH]1	ZINC000176977838	402356491	/nfs/dbraw/zinc/35/64/91/402356491.db2.gz	IXPHPWIKGMVEOL-AWEZNQCLSA-N	0	3	314.433	2.438	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2cnn3ccccc23)C12CCOCC2	ZINC000185663926	402368026	/nfs/dbraw/zinc/36/80/26/402368026.db2.gz	BDTLOMOUBIBMIM-DLBZAZTESA-N	0	3	315.417	2.398	10	0		DEAEHN
CC(C)[C@@H]1C[C@H]1C(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000185905160	402388264	/nfs/dbraw/zinc/38/82/64/402388264.db2.gz	AUZNZNMXBAOCLN-OKZBNKHCSA-N	0	3	316.445	2.162	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)Nc2nncs2)CN1Cc1ccccc1	ZINC000176677661	402327925	/nfs/dbraw/zinc/32/79/25/402327925.db2.gz	VTFPISPRRIKRTA-DGCLKSJQSA-N	0	3	317.418	2.323	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1c(OC)cccc1OC	ZINC000177424341	402400844	/nfs/dbraw/zinc/40/08/44/402400844.db2.gz	KFAVPLPRBSSOIW-ZDUSSCGKSA-N	0	3	306.406	2.260	10	0		DEAEHN
CCc1nc(CCNC(=O)N(C)C[C@H]2CCCN2CC)cs1	ZINC000177465560	402405536	/nfs/dbraw/zinc/40/55/36/402405536.db2.gz	HZBULWSXBXZLRY-CQSZACIVSA-N	0	3	324.494	2.374	10	0		DEAEHN
Cc1csc(CN2CCCC[C@H](N3CCN(C)CC3)C2)n1	ZINC000162051015	402407678	/nfs/dbraw/zinc/40/76/78/402407678.db2.gz	NGBWKJVRJFPIKG-HNNXBMFYSA-N	0	3	308.495	2.053	10	0		DEAEHN
CCO[C@H]1C[C@@H](NCc2ccc(CO)c(F)c2)C12CCOCC2	ZINC000186271142	402416612	/nfs/dbraw/zinc/41/66/12/402416612.db2.gz	RLBWPRKMADAWOD-SJORKVTESA-N	0	3	323.408	2.382	10	0		DEAEHN
O=C(NCCc1ccc(Cl)nc1)N1CCCN(C2CC2)CC1	ZINC000177623881	402421563	/nfs/dbraw/zinc/42/15/63/402421563.db2.gz	GRPORDQATDCNFH-UHFFFAOYSA-N	0	3	322.840	2.157	10	0		DEAEHN
Cc1nc(-c2ccccc2)ncc1C(=O)N1CC[C@@H](N(C)C)C1	ZINC000162600507	402425696	/nfs/dbraw/zinc/42/56/96/402425696.db2.gz	UYXLSIPFUOHXSP-OAHLLOKOSA-N	0	3	310.401	2.228	10	0		DEAEHN
CC(C)c1ccc(NC(=O)C(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000177698408	402427591	/nfs/dbraw/zinc/42/75/91/402427591.db2.gz	QKQXSIZZAUEASW-MRXNPFEDSA-N	0	3	315.417	2.055	10	0		DEAEHN
O=C(CCN1CCN2CCCC[C@@H]2C1)Nc1ccc(F)cc1	ZINC000177766412	402434093	/nfs/dbraw/zinc/43/40/93/402434093.db2.gz	IKJKMYICIRGXAA-MRXNPFEDSA-N	0	3	305.397	2.324	10	0		DEAEHN
C[C@]1(CNC(=O)Cn2cccn2)CCCN1Cc1ccccc1	ZINC000163375081	402447678	/nfs/dbraw/zinc/44/76/78/402447678.db2.gz	ONQVJAUVKIKYPX-GOSISDBHSA-N	0	3	312.417	2.054	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nn1cnc2ccccc21	ZINC000177308808	402390053	/nfs/dbraw/zinc/39/00/53/402390053.db2.gz	OMZMDZRGLGDWDB-CYBMUJFWSA-N	0	3	301.394	2.116	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H](C)c1ccc2c(c1)OCCO2)N(C)C	ZINC000161535018	402391018	/nfs/dbraw/zinc/39/10/18/402391018.db2.gz	BTVMRCFKRZZOKF-OCCSQVGLSA-N	0	3	306.406	2.365	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCC[C@@H]1CCCCO1	ZINC000186624936	402449170	/nfs/dbraw/zinc/44/91/70/402449170.db2.gz	OECUYCXWRVDNNN-HOTGVXAUSA-N	0	3	311.470	2.461	10	0		DEAEHN
Cc1ccc(CN2CCC[C@@H](C(=O)NCC3CC3)C2)c(C)n1	ZINC000186674089	402454036	/nfs/dbraw/zinc/45/40/36/402454036.db2.gz	NCJVCKVOGSXBMS-QGZVFWFLSA-N	0	3	301.434	2.437	10	0		DEAEHN
C[C@@H]1CCN(CCCN2C(=O)CNC2=O)[C@H]1c1cccc(F)c1	ZINC000245410463	402458121	/nfs/dbraw/zinc/45/81/21/402458121.db2.gz	RDQBVVBVLRPGML-MLGOLLRUSA-N	0	3	319.380	2.151	10	0		DEAEHN
COCC[C@H](Cc1cccc(F)c1)N[C@H]1CCCn2ncnc21	ZINC000164663648	402467091	/nfs/dbraw/zinc/46/70/91/402467091.db2.gz	JBATXHUNBWUTST-CVEARBPZSA-N	0	3	318.396	2.490	10	0		DEAEHN
COCCOc1ccccc1CN1CCN2CCCC[C@H]2C1	ZINC000245553500	402469830	/nfs/dbraw/zinc/46/98/30/402469830.db2.gz	FPDRTPBRMFWUCG-KRWDZBQOSA-N	0	3	304.434	2.382	10	0		DEAEHN
COCc1nc(C)c(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)s1	ZINC000245625461	402475228	/nfs/dbraw/zinc/47/52/28/402475228.db2.gz	GJUCSFOJYRZXBX-JQWIXIFHSA-N	0	3	311.451	2.153	10	0		DEAEHN
CN(C)C1(CN(C)CC(=O)Nc2cc(F)cc(F)c2)CCC1	ZINC000186974692	402475344	/nfs/dbraw/zinc/47/53/44/402475344.db2.gz	BZFJDAVHIPPZNX-UHFFFAOYSA-N	0	3	311.376	2.319	10	0		DEAEHN
CC[C@@H]1CN(Cc2cc(F)c(F)cc2F)CCN1C[C@H](C)O	ZINC000245724015	402483184	/nfs/dbraw/zinc/48/31/84/402483184.db2.gz	ILNPOQPVCYDCGB-WCQYABFASA-N	0	3	316.367	2.381	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2	ZINC000245736587	402484108	/nfs/dbraw/zinc/48/41/08/402484108.db2.gz	BJTDSTRBCOBGOC-FPCVCCKLSA-N	0	3	321.465	2.070	10	0		DEAEHN
C[C@@H](CCNCc1cncc(Br)c1)[S@](C)=O	ZINC000166505915	402485380	/nfs/dbraw/zinc/48/53/80/402485380.db2.gz	PLSSCEYHKHGREX-XXFAHNHDSA-N	0	3	305.241	2.091	10	0		DEAEHN
CCc1ccccc1S(=O)(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000187233743	402489338	/nfs/dbraw/zinc/48/93/38/402489338.db2.gz	XYCIQFDAZNWPCX-DZGCQCFKSA-N	0	3	310.463	2.256	10	0		DEAEHN
COC(=O)CCN1CCN(C[C@H](C)c2ccccc2)[C@H](C)C1	ZINC000245841701	402490628	/nfs/dbraw/zinc/49/06/28/402490628.db2.gz	CRBJBJAGRVBHFP-JKSUJKDBSA-N	0	3	304.434	2.359	10	0		DEAEHN
CN(C[C@@H]1COc2ccccc2O1)[C@@H]1Cc2ccccc2[C@H]1O	ZINC000245868629	402492375	/nfs/dbraw/zinc/49/23/75/402492375.db2.gz	QWZPKFVUXGRVBN-IDHHARJASA-N	0	3	311.381	2.417	10	0		DEAEHN
CCCCN(CCCC)C(=O)CN1C[C@@H](C(N)=O)CC[C@H]1C	ZINC000245870921	402493256	/nfs/dbraw/zinc/49/32/56/402493256.db2.gz	WFWHHNDZRZAACY-CABCVRRESA-N	0	3	311.470	2.001	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)NCCc2ccsc2)C1	ZINC000245906035	402496061	/nfs/dbraw/zinc/49/60/61/402496061.db2.gz	FHUUSOOKMDZRLZ-GJZGRUSLSA-N	0	3	307.463	2.416	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)[C@@H](O)C1CCCCC1	ZINC000187385280	402497472	/nfs/dbraw/zinc/49/74/72/402497472.db2.gz	IWAPLJOYNIGNDG-MSOLQXFVSA-N	0	3	318.461	2.217	10	0		DEAEHN
CCNc1ncc(C(=O)N2C[C@@H]3CCCN3C[C@H]2CC)s1	ZINC000245917849	402497684	/nfs/dbraw/zinc/49/76/84/402497684.db2.gz	FTYRLEPBVJZVRY-NEPJUHHUSA-N	0	3	308.451	2.274	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)NCc2cccc(F)c2)C1	ZINC000245934221	402498832	/nfs/dbraw/zinc/49/88/32/402498832.db2.gz	IRYFPNHPILAVEG-HOCLYGCPSA-N	0	3	305.397	2.451	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)[C@H]1C[C@H]1c1sccc1C	ZINC000245959687	402500952	/nfs/dbraw/zinc/50/09/52/402500952.db2.gz	RVJGSAMXSKMGQO-KFWWJZLASA-N	0	3	322.474	2.387	10	0		DEAEHN
Cc1ccccc1C(C)(C)C(=O)NC[C@H](O)CN1CCCCC1	ZINC000178517730	402506614	/nfs/dbraw/zinc/50/66/14/402506614.db2.gz	CJFBXUGOJQVBSO-INIZCTEOSA-N	0	3	318.461	2.236	10	0		DEAEHN
CC1(C)CC[C@H](CN[C@@H](Cc2ccc(Cl)cc2)C(N)=O)O1	ZINC000187648284	402507333	/nfs/dbraw/zinc/50/73/33/402507333.db2.gz	NBQKFJTXIFGQIN-KGLIPLIRSA-N	0	3	310.825	2.284	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NS(=O)(=O)c2ccc3c(c2)CCC3)C1	ZINC000246094037	402509332	/nfs/dbraw/zinc/50/93/32/402509332.db2.gz	GXUQRUFYWJBJFY-CXAGYDPISA-N	0	3	322.474	2.182	10	0		DEAEHN
CC(C)CO[C@@H]1CCN(C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)C1	ZINC000246961989	402550849	/nfs/dbraw/zinc/55/08/49/402550849.db2.gz	CHXBIRVKUROCRI-BZUAXINKSA-N	0	3	311.470	2.172	10	0		DEAEHN
CSCC[C@H](C)N(C)CC(=O)N1CCO[C@@H]2CCCC[C@H]21	ZINC000247208124	402560038	/nfs/dbraw/zinc/56/00/38/402560038.db2.gz	VJNAMUKEIJLYDC-RRFJBIMHSA-N	0	3	314.495	2.230	10	0		DEAEHN
COc1ccc(CN2CCN(C[C@@H](C)O)[C@@H](C)C2)cc1Cl	ZINC000178991413	402563085	/nfs/dbraw/zinc/56/30/85/402563085.db2.gz	CIGIRVVSYFZUOV-QWHCGFSZSA-N	0	3	312.841	2.236	10	0		DEAEHN
Cc1cccc(OC[C@H](C)NC(=O)NC[C@@H]2CCCN2C)c1	ZINC000171193328	402565841	/nfs/dbraw/zinc/56/58/41/402565841.db2.gz	KZXRKBKUGIRTJT-GJZGRUSLSA-N	0	3	305.422	2.156	10	0		DEAEHN
O=C(N[C@@H]1CCCOc2ccccc21)N1CCN2CCC[C@H]2C1	ZINC000247508897	402570300	/nfs/dbraw/zinc/57/03/00/402570300.db2.gz	PDGDUVSXXDWPAP-GOEBONIOSA-N	0	3	315.417	2.390	10	0		DEAEHN
CC(C)N1CCC[C@H](N2C[C@H](CO)[C@H](c3ccsc3)C2)C1=O	ZINC000188163129	402516065	/nfs/dbraw/zinc/51/60/65/402516065.db2.gz	HZRVZDXQGQIIRA-PMPSAXMXSA-N	0	3	322.474	2.155	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(C[C@@H](O)COC(C)C)C2)c1	ZINC000246191140	402517505	/nfs/dbraw/zinc/51/75/05/402517505.db2.gz	VJZXZTSRQZXGQO-GDBMZVCRSA-N	0	3	323.433	2.279	10	0		DEAEHN
C[C@H](C(=O)NCc1ccc(Cl)cc1)N1CCN2CCC[C@@H]2C1	ZINC000178626437	402518890	/nfs/dbraw/zinc/51/88/90/402518890.db2.gz	PIVXPNPRNFTMSG-CZUORRHYSA-N	0	3	321.852	2.125	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c(C)c1	ZINC000246266547	402522303	/nfs/dbraw/zinc/52/23/03/402522303.db2.gz	USOJKSONJWFZFQ-CABCVRRESA-N	0	3	310.463	2.310	10	0		DEAEHN
CCOCc1ccccc1CNC(=O)N1CC[C@H](N(C)C)C1	ZINC000170829436	402530515	/nfs/dbraw/zinc/53/05/15/402530515.db2.gz	OFXKJLVLOBWQHW-INIZCTEOSA-N	0	3	305.422	2.069	10	0		DEAEHN
Cc1cccc(OC[C@H](C)NC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000170833311	402530811	/nfs/dbraw/zinc/53/08/11/402530811.db2.gz	BHCWOQQNURXXAT-GJZGRUSLSA-N	0	3	305.422	2.108	10	0		DEAEHN
CC(C)Oc1ccccc1CNC(=O)N1CC[C@H](N(C)C)C1	ZINC000170832910	402531125	/nfs/dbraw/zinc/53/11/25/402531125.db2.gz	AQCKTQUMRAYKPV-HNNXBMFYSA-N	0	3	305.422	2.319	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)NC[C@@H](C)N(C)C3CC3)cc2c1	ZINC000189236379	402532289	/nfs/dbraw/zinc/53/22/89/402532289.db2.gz	BMKJWUBRHMCILH-LLVKDONJSA-N	0	3	301.390	2.389	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)C2(c3cccc(F)c3)CCOCC2)C1	ZINC000170855592	402533278	/nfs/dbraw/zinc/53/32/78/402533278.db2.gz	YKGFUHGZCMTBTG-INIZCTEOSA-N	0	3	320.408	2.036	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)[C@H]2COc3ccc(Cl)cc3C2)C1	ZINC000170858587	402533677	/nfs/dbraw/zinc/53/36/77/402533677.db2.gz	DQJGJVKASWPPOA-TZMCWYRMSA-N	0	3	308.809	2.054	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COc2ccc(C)cc2C)CC[C@@H]1C	ZINC000189323400	402534052	/nfs/dbraw/zinc/53/40/52/402534052.db2.gz	DVPLOTXCHIHEEF-YXJHDRRASA-N	0	3	307.434	2.400	10	0		DEAEHN
COc1cc(C(=O)N2CC[C@@H](N(C)C)C2)ccc1OC(C)C	ZINC000170862216	402534063	/nfs/dbraw/zinc/53/40/63/402534063.db2.gz	GZFLCRGBCFRXEZ-CQSZACIVSA-N	0	3	306.406	2.259	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)COc2ccc(C(F)(F)F)cc2)C1	ZINC000170865390	402535218	/nfs/dbraw/zinc/53/52/18/402535218.db2.gz	OOAVAFUIDAXHDN-GFCCVEGCSA-N	0	3	316.323	2.247	10	0		DEAEHN
COc1ccc(S[C@H](C)C(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170865034	402535254	/nfs/dbraw/zinc/53/52/54/402535254.db2.gz	AVSHZTLZAIYBOT-OLZOCXBDSA-N	0	3	308.447	2.338	10	0		DEAEHN
CCC[C@@H](C(=O)N(C)C[C@@H]1COc2ccccc2O1)N(C)C	ZINC000179186675	402578903	/nfs/dbraw/zinc/57/89/03/402578903.db2.gz	DWOQHWYUQSWKSL-KGLIPLIRSA-N	0	3	306.406	2.015	10	0		DEAEHN
CCOC(=O)c1ccccc1NC(=O)N1CCN2CCC[C@H]2C1	ZINC000179199198	402579926	/nfs/dbraw/zinc/57/99/26/402579926.db2.gz	FYDGOCKDUWJAOC-ZDUSSCGKSA-N	0	3	317.389	2.175	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCC(C)(C)c2ccc(F)cc2)C1	ZINC000171373352	402582090	/nfs/dbraw/zinc/58/20/90/402582090.db2.gz	LBXBZRRWIVSQRE-HNNXBMFYSA-N	0	3	307.413	2.449	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H](C)c2c(C)noc2C)C1	ZINC000179251930	402582925	/nfs/dbraw/zinc/58/29/25/402582925.db2.gz	YLOJNTHEJZYRDS-RISCZKNCSA-N	0	3	308.426	2.178	10	0		DEAEHN
C[C@@H]1CN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CCCO1	ZINC000248127009	402583222	/nfs/dbraw/zinc/58/32/22/402583222.db2.gz	VREATRBVZSKXNX-OIISXLGYSA-N	0	3	317.433	2.252	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)C(=O)Nc1cccc(C)c1	ZINC000190338208	402593691	/nfs/dbraw/zinc/59/36/91/402593691.db2.gz	CCKBGFAQAFNFNV-JKSUJKDBSA-N	0	3	315.417	2.019	10	0		DEAEHN
C[C@@H]1OCCC[C@H]1C(=O)N(CCN(C)C)Cc1ccccc1	ZINC000190475218	402604111	/nfs/dbraw/zinc/60/41/11/402604111.db2.gz	CJUHDITZZRNCIM-DOTOQJQBSA-N	0	3	304.434	2.392	10	0		DEAEHN
CCn1nccc1CN1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190478341	402604167	/nfs/dbraw/zinc/60/41/67/402604167.db2.gz	OJMDAGVYNWRFAC-KRWDZBQOSA-N	0	3	313.449	2.252	10	0		DEAEHN
CCCN(CC(=O)NCCN1CCc2ccccc21)C1CC1	ZINC000171679024	402608826	/nfs/dbraw/zinc/60/88/26/402608826.db2.gz	WUKVXGREGMPJCQ-UHFFFAOYSA-N	0	3	301.434	2.040	10	0		DEAEHN
CN1CC[C@H](NC(=O)CC[C@@H]2CCOC2)[C@@H]1c1ccccc1	ZINC000180166293	402608882	/nfs/dbraw/zinc/60/88/82/402608882.db2.gz	GDVJKJBAPXNWAN-HFTRVMKXSA-N	0	3	302.418	2.365	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@H]1CCCc2cccnc21	ZINC000248895029	402613506	/nfs/dbraw/zinc/61/35/06/402613506.db2.gz	XGTAZBUBTFITEE-HOTGVXAUSA-N	0	3	301.434	2.444	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000171768199	402620054	/nfs/dbraw/zinc/62/00/54/402620054.db2.gz	YGZRXJIZWKTVKL-NEPJUHHUSA-N	0	3	307.360	2.312	10	0		DEAEHN
O=C1C[C@@H](c2ccccc2)N(C[C@@H](O)C2CCCCC2)CCN1	ZINC000249152328	402622348	/nfs/dbraw/zinc/62/23/48/402622348.db2.gz	XYPNBXJHFGJJPW-ZWKOTPCHSA-N	0	3	316.445	2.491	10	0		DEAEHN
CC(=O)Nc1cccc2c1CCN(C(=O)[C@]1(C)CCCCN1)C2	ZINC000180932393	402630595	/nfs/dbraw/zinc/63/05/95/402630595.db2.gz	PAXLICJUTFSOBD-SFHVURJKSA-N	0	3	315.417	2.062	10	0		DEAEHN
Cc1ccc([C@H](C)NC(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000117036177	292243245	/nfs/dbraw/zinc/24/32/45/292243245.db2.gz	JTUCIAPJLLBRDU-GOEBONIOSA-N	0	3	305.422	2.028	10	0		DEAEHN
Cc1ccc(C)c(OC[C@H](O)CN2[C@@H](C)CC(O)C[C@@H]2C)c1	ZINC000191143108	402645237	/nfs/dbraw/zinc/64/52/37/402645237.db2.gz	QBACXPRUQIYJII-YQQAZPJKSA-N	0	3	307.434	2.277	10	0		DEAEHN
CC(C)[C@@H](C)C(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000172222948	402645877	/nfs/dbraw/zinc/64/58/77/402645877.db2.gz	RSMOSYTVRXTHFP-OAHLLOKOSA-N	0	3	318.465	2.084	10	0		DEAEHN
O=C(NC1CC1)[C@@H](c1ccccc1)N1CCCN(C2CC2)CC1	ZINC000172346845	402651861	/nfs/dbraw/zinc/65/18/61/402651861.db2.gz	UPJBELIGYOLJBS-GOSISDBHSA-N	0	3	313.445	2.176	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)Nc1ccc(F)cc1F	ZINC000172542401	402661866	/nfs/dbraw/zinc/66/18/66/402661866.db2.gz	WKZMUPTYVOEAIT-UHFFFAOYSA-N	0	3	309.360	2.073	10	0		DEAEHN
Cc1c([C@@H](C)N[C@H]2CCc3ncnn3C2)cnn1C(C)(C)C	ZINC000191357418	402663746	/nfs/dbraw/zinc/66/37/46/402663746.db2.gz	UPFGKPBMESKABJ-YPMHNXCESA-N	0	3	302.426	2.204	10	0		DEAEHN
Cc1ncc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c(C(C)C)n1	ZINC000172622404	402667045	/nfs/dbraw/zinc/66/70/45/402667045.db2.gz	ZXEJPKATRHPJLS-TZMCWYRMSA-N	0	3	304.438	2.463	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)c2snnc2C(C)(C)C)C1	ZINC000191457449	402671189	/nfs/dbraw/zinc/67/11/89/402671189.db2.gz	WVGFVPGZCLYSLB-RYUDHWBXSA-N	0	3	322.478	2.392	10	0		DEAEHN
O=C1O[C@@H](CN2C[C@H]3CCC[C@@H](C2)C3O)CN1c1ccccc1	ZINC000172822743	402677313	/nfs/dbraw/zinc/67/73/13/402677313.db2.gz	DSWGJVLSTHOBCA-IINVVDAPSA-N	0	3	316.401	2.105	10	0		DEAEHN
O=C([C@@H]1C[C@H]1c1cc(F)ccc1F)N1CCN2CCC[C@@H]2C1	ZINC000172907698	402679553	/nfs/dbraw/zinc/67/95/53/402679553.db2.gz	WFEUCGRNPOLRHD-VNHYZAJKSA-N	0	3	306.356	2.375	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)C[C@](C)(O)c2ccccc2)CCN1C	ZINC000182498557	402695194	/nfs/dbraw/zinc/69/51/94/402695194.db2.gz	FYOHIBWCZUKXDM-KYJSFNMBSA-N	0	3	304.434	2.225	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(C(C)C)n(C)n1	ZINC000173493165	402700120	/nfs/dbraw/zinc/70/01/20/402700120.db2.gz	BWZGFEXRYJTKJZ-UONOGXRCSA-N	0	3	304.438	2.242	10	0		DEAEHN
CCC[C@H](N)C(=O)N[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1	ZINC000262506635	402726625	/nfs/dbraw/zinc/72/66/25/402726625.db2.gz	AFFXPNUJFXILTI-KKUMJFAQSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1nc2cccnc2s1	ZINC000193969419	402780387	/nfs/dbraw/zinc/78/03/87/402780387.db2.gz	AQXOCBKOCQDECB-NWDGAFQWSA-N	0	3	316.430	2.390	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCC(N3CCCC3)CC2)c(C)o1	ZINC000183088604	402737920	/nfs/dbraw/zinc/73/79/20/402737920.db2.gz	LJEYUOUJDXVAJQ-UHFFFAOYSA-N	0	3	312.435	2.145	10	0		DEAEHN
C[C@@H](O)CN1CCN(CCSCc2ccccc2)C[C@H]1C	ZINC000192575000	402738046	/nfs/dbraw/zinc/73/80/46/402738046.db2.gz	BMKAORYSPCKVLK-HZPDHXFCSA-N	0	3	308.491	2.307	10	0		DEAEHN
COCc1csc(NC(=O)NCCN2CCCC[C@H]2C)n1	ZINC000174403493	402739488	/nfs/dbraw/zinc/73/94/88/402739488.db2.gz	LFMPKHQATCCMSF-LLVKDONJSA-N	0	3	312.439	2.285	10	0		DEAEHN
Cc1ccccc1CCNC(=O)[C@H](C)N[C@@H](C)[C@@H]1CCCO1	ZINC000183121773	402740598	/nfs/dbraw/zinc/74/05/98/402740598.db2.gz	KCWCXBOYYVMXRZ-ZOBUZTSGSA-N	0	3	304.434	2.199	10	0		DEAEHN
Cc1c([O-])ccc2c(C[NH2+][C@H](C)[C@@H]3CCCO3)cc(=O)oc12	ZINC000183140585	402742286	/nfs/dbraw/zinc/74/22/86/402742286.db2.gz	KJDJGOWVZWKGDK-ABAIWWIYSA-N	0	3	303.358	2.464	10	0		DEAEHN
CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@H](C)[C@H]2CCCO2)c1	ZINC000183142415	402742972	/nfs/dbraw/zinc/74/29/72/402742972.db2.gz	FVFSHXAHSBBSSM-BFQNTYOBSA-N	0	3	319.405	2.129	10	0		DEAEHN
C[C@@H]1CC[C@H](C)CN1C(=O)c1ccnc(OCCN(C)C)c1	ZINC000183221206	402748302	/nfs/dbraw/zinc/74/83/02/402748302.db2.gz	VFRYCNVPKXUIQV-UONOGXRCSA-N	0	3	305.422	2.283	10	0		DEAEHN
COC[C@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccccc1	ZINC000174625930	402749141	/nfs/dbraw/zinc/74/91/41/402749141.db2.gz	RWWDWHAGMJHUIG-SJORKVTESA-N	0	3	315.417	2.030	10	0		DEAEHN
CCc1cnc(CCNC(=O)NC[C@@H](C)N(C)C2CC2)s1	ZINC000174734430	402754356	/nfs/dbraw/zinc/75/43/56/402754356.db2.gz	IVUUYJVEZSWHQW-LLVKDONJSA-N	0	3	310.467	2.030	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cccc(C(=O)OC)c1	ZINC000174979638	402768492	/nfs/dbraw/zinc/76/84/92/402768492.db2.gz	VRRNYPMTZZTIQK-JKSUJKDBSA-N	0	3	316.401	2.172	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N(CC(=O)N2CCN(Cc3ccco3)CC2)C1	ZINC000174013759	402723521	/nfs/dbraw/zinc/72/35/21/402723521.db2.gz	UQSFVIZOCHBGCN-CVEARBPZSA-N	0	3	319.449	2.044	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)NCc1ccc(C)c(F)c1	ZINC000175333470	402797843	/nfs/dbraw/zinc/79/78/43/402797843.db2.gz	FHPJDXZREQAMLX-INIZCTEOSA-N	0	3	321.440	2.166	10	0		DEAEHN
CCOc1ccccc1NC(=O)CN(C)C[C@H]1CCCN1CC	ZINC000175357481	402799542	/nfs/dbraw/zinc/79/95/42/402799542.db2.gz	JAZQXBCBAMHCDF-OAHLLOKOSA-N	0	3	319.449	2.440	10	0		DEAEHN
CCCCOCCNC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000194506697	402801059	/nfs/dbraw/zinc/80/10/59/402801059.db2.gz	NDTFPZFJIYVUQG-MRXNPFEDSA-N	0	3	307.438	2.405	10	0		DEAEHN
COc1ccccc1[C@H](O)CNC(=O)[C@@H](C)N1CCCCCC1	ZINC000175375458	402801379	/nfs/dbraw/zinc/80/13/79/402801379.db2.gz	URSXZPMSRQJXNU-GDBMZVCRSA-N	0	3	320.433	2.109	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)S(=O)(=O)Cc1ccccc1F	ZINC000175391863	402802652	/nfs/dbraw/zinc/80/26/52/402802652.db2.gz	LWPQGBOLKATGAP-AWEZNQCLSA-N	0	3	314.426	2.072	10	0		DEAEHN
OC[C@H](NCCOCC1CC1)c1cccc(Br)c1	ZINC000183888354	402803596	/nfs/dbraw/zinc/80/35/96/402803596.db2.gz	BOXAQUHPDYZJAQ-AWEZNQCLSA-N	0	3	314.223	2.499	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N(C)C[C@@H]1CCCN(C)C1	ZINC000175471300	402809505	/nfs/dbraw/zinc/80/95/05/402809505.db2.gz	GGEIKQOZVRYRRR-OAHLLOKOSA-N	0	3	321.469	2.022	10	0		DEAEHN
O=C(N[C@H]1COc2ccccc21)NC1CCN(C2CC2)CC1	ZINC000194702243	402811220	/nfs/dbraw/zinc/81/12/20/402811220.db2.gz	OZNPSSUTXNDCHS-HNNXBMFYSA-N	0	3	301.390	2.046	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(C[C@H](O)COC(C)C)C2)c1	ZINC000175598019	402820701	/nfs/dbraw/zinc/82/07/01/402820701.db2.gz	VJZXZTSRQZXGQO-HOCLYGCPSA-N	0	3	323.433	2.279	10	0		DEAEHN
C[C@@H](O)C[C@H]1CCCN1Cc1ccc2c(c1)sc(=O)n2C	ZINC000195024988	402827440	/nfs/dbraw/zinc/82/74/40/402827440.db2.gz	IQUUBMDWZPDYML-DGCLKSJQSA-N	0	3	306.431	2.335	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H](c2cccs2)N(C)C)C1	ZINC000194137029	402785568	/nfs/dbraw/zinc/78/55/68/402785568.db2.gz	LAWVYGARWPNGLL-KBPBESRZSA-N	0	3	324.494	2.134	10	0		DEAEHN
Cc1cc(Cl)ccc1NC(=O)CN1CCN2CCC[C@@H]2C1	ZINC000175205743	402787915	/nfs/dbraw/zinc/78/79/15/402787915.db2.gz	QVFSQCFPFOUKKQ-CQSZACIVSA-N	0	3	307.825	2.367	10	0		DEAEHN
CCC[C@@H](C)CC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000176003878	402847149	/nfs/dbraw/zinc/84/71/49/402847149.db2.gz	KKJAMYVOKIQCLD-IAGOWNOFSA-N	0	3	309.498	2.441	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1cc(N(C)C)ccn1)c1ccccc1	ZINC000195488175	402847294	/nfs/dbraw/zinc/84/72/94/402847294.db2.gz	QDTGMXKEYGRLGF-QGZVFWFLSA-N	0	3	312.417	2.180	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CCc2c1cccc2F	ZINC000184507972	402847887	/nfs/dbraw/zinc/84/78/87/402847887.db2.gz	CIPBLHCGBZZMOW-ZDUSSCGKSA-N	0	3	321.396	2.009	10	0		DEAEHN
Cc1cc2c(cc1C)[C@H](C(=O)N1C[C@@H]3CCCN3C[C@@H]1C)CO2	ZINC000184525534	402849333	/nfs/dbraw/zinc/84/93/33/402849333.db2.gz	VCUYQHFILUWAAI-YQQAZPJKSA-N	0	3	314.429	2.475	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N(C)C[C@H]2CCCN(C)C2)cc1	ZINC000278964611	402891036	/nfs/dbraw/zinc/89/10/36/402891036.db2.gz	GYVHCODEMGZEPP-HNNXBMFYSA-N	0	3	317.433	2.083	10	0		DEAEHN
Cc1nnc2ccc(N[C@H]3CN(Cc4ccccc4)C[C@H]3C)nn12	ZINC000274133046	403029451	/nfs/dbraw/zinc/02/94/51/403029451.db2.gz	FOCJIUVDAWSENW-CJNGLKHVSA-N	0	3	322.416	2.365	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N[C@@H](c2nccn2C)C2CC2)C12CCOCC2	ZINC000187784986	286289410	/nfs/dbraw/zinc/28/94/10/286289410.db2.gz	MRDSCJAETMMQSD-BZUAXINKSA-N	0	3	319.449	2.435	10	0		DEAEHN
CC(=O)N(C[C@H]1CCCN1Cc1cnn2ccccc12)C1CC1	ZINC000275535359	403103129	/nfs/dbraw/zinc/10/31/29/403103129.db2.gz	DZTALABBNNEJCJ-QGZVFWFLSA-N	0	3	312.417	2.310	10	0		DEAEHN
O[C@H](CNCc1cccc(Cl)c1Cl)Cn1cccn1	ZINC000566733729	292264577	/nfs/dbraw/zinc/26/45/77/292264577.db2.gz	YCGTXMHKJPXGKL-LLVKDONJSA-N	0	3	300.189	2.341	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)[C@H](C)N[C@H]1CCOC[C@H]1C	ZINC000277544907	403229381	/nfs/dbraw/zinc/22/93/81/403229381.db2.gz	SHOGXOXSWKBXRO-XUJVJEKNSA-N	0	3	304.390	2.231	10	0		DEAEHN
CC(=O)N(C[C@@H]1CCCN1C[C@H](O)Cc1ccccc1)C1CC1	ZINC000276598377	403190309	/nfs/dbraw/zinc/19/03/09/403190309.db2.gz	VHMPSIYCEBJHRS-RBUKOAKNSA-N	0	3	316.445	2.065	10	0		DEAEHN
CN1CC[C@@H](C(=O)N2CCc3c2cccc3Br)C1	ZINC000566908743	292275882	/nfs/dbraw/zinc/27/58/82/292275882.db2.gz	CPNSUVKQONKEGF-SNVBAGLBSA-N	0	3	309.207	2.290	10	0		DEAEHN
C[C@@H]1[C@H](N(C)CCO)CCN1c1nc(C2CCCCC2)ns1	ZINC000333625596	403795784	/nfs/dbraw/zinc/79/57/84/403795784.db2.gz	AFUJAMYXWIFFJO-TZMCWYRMSA-N	0	3	324.494	2.477	10	0		DEAEHN
c1ncn2ccc(-c3noc(CCCCc4cn[nH]n4)n3)cc12	ZINC000289315154	403908340	/nfs/dbraw/zinc/90/83/40/403908340.db2.gz	XWMONTSFPWFRPZ-UHFFFAOYSA-N	0	3	309.333	2.068	10	0		DEAEHN
CC(C)c1nn(C)cc1NC(=O)N1CC[C@@H](N2CCCC2)C1	ZINC000373928131	404643099	/nfs/dbraw/zinc/64/30/99/404643099.db2.gz	IZDLFNJCGHRPGA-CYBMUJFWSA-N	0	3	305.426	2.246	10	0		DEAEHN
CC[C@@H](C)N(C)CCNC(=O)C(=O)N1CCC2(C1)CCCCC2	ZINC000359277797	404789083	/nfs/dbraw/zinc/78/90/83/404789083.db2.gz	SPRDWURYWSKPGD-OAHLLOKOSA-N	0	3	323.481	2.016	10	0		DEAEHN
CN1CCC2(CCN(CCOc3ccc(F)cc3)CC2)C1=O	ZINC000376035618	404792013	/nfs/dbraw/zinc/79/20/13/404792013.db2.gz	SQRILWBNMYMRDT-UHFFFAOYSA-N	0	3	306.381	2.149	10	0		DEAEHN
COCCSCCCN1C[C@]2(CCOC2)OC(C)(C)C1	ZINC000376136610	404807798	/nfs/dbraw/zinc/80/77/98/404807798.db2.gz	VFJCOXIEKHQRCH-HNNXBMFYSA-N	0	3	303.468	2.026	10	0		DEAEHN
c1nc(CN2CCC(CN3CCOCC3)CC2)oc1C1CC1	ZINC000366875251	404861825	/nfs/dbraw/zinc/86/18/25/404861825.db2.gz	BEVNGDGINAQRGM-UHFFFAOYSA-N	0	3	305.422	2.096	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ncccc1N	ZINC000398032045	405060170	/nfs/dbraw/zinc/06/01/70/405060170.db2.gz	GYWMUSRNFALGGQ-WMLDXEAASA-N	0	3	324.428	2.304	10	0		DEAEHN
CC(C)NC(=O)N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC000404162387	405068647	/nfs/dbraw/zinc/06/86/47/405068647.db2.gz	YXMHIVQBHZMZDQ-IAGOWNOFSA-N	0	3	317.433	2.080	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)[nH]1	ZINC000408025453	405092288	/nfs/dbraw/zinc/09/22/88/405092288.db2.gz	BWGAUTNWIQPZOO-SUMWQHHRSA-N	0	3	315.417	2.306	10	0		DEAEHN
Cc1c(C(=O)NCCNc2ccncc2)cnc2ccccc12	ZINC000361529369	405117148	/nfs/dbraw/zinc/11/71/48/405117148.db2.gz	DWAVUDLEBMLMLJ-UHFFFAOYSA-N	0	3	306.369	2.202	10	0		DEAEHN
CC(=O)CCc1ccc(OC[C@H](O)CN2CC[C@H]2C2CC2)cc1	ZINC000453043663	405278386	/nfs/dbraw/zinc/27/83/86/405278386.db2.gz	UNFQCBPTZZMYDE-MJGOQNOKSA-N	0	3	317.429	2.432	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)Nc2ccc(N3CCC3=O)cc2)CCN1C	ZINC000439970426	405298552	/nfs/dbraw/zinc/29/85/52/405298552.db2.gz	ZZSOSOQDCONBQR-GXTWGEPZSA-N	0	3	316.405	2.028	10	0		DEAEHN
c1cc(CN2CCOCC2)ccc1CN1C[C@@H]2C[C@H]1CS2	ZINC000420980223	405419460	/nfs/dbraw/zinc/41/94/60/405419460.db2.gz	WFKWFUMMKYBOHU-IRXDYDNUSA-N	0	3	304.459	2.209	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)N(C)C[C@H]2CCCN2C)c1	ZINC000421067303	405443272	/nfs/dbraw/zinc/44/32/72/405443272.db2.gz	MIOJJKFLDKBCEX-MRXNPFEDSA-N	0	3	318.421	2.227	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2ccc(C)cc2OC)CC12COC2	ZINC000449363838	405525794	/nfs/dbraw/zinc/52/57/94/405525794.db2.gz	MKPKUAIPHWXZNZ-OAHLLOKOSA-N	0	3	319.401	2.015	10	0		DEAEHN
COc1nsc(CNC[C@@]2(C)CCOC2)c1Br	ZINC000638610659	405571098	/nfs/dbraw/zinc/57/10/98/405571098.db2.gz	DJGIVMCXVDFKIJ-LLVKDONJSA-N	0	3	321.240	2.430	10	0		DEAEHN
CC(=O)[C@](C)(O)CN1CCN(Cc2ccccc2)[C@H](C(C)C)C1	ZINC000528643049	405695461	/nfs/dbraw/zinc/69/54/61/405695461.db2.gz	ZAICCXDYYYSHSA-RBUKOAKNSA-N	0	3	318.461	2.169	10	0		DEAEHN
Cn1cncc1[C@H]1[C@H](CNc2ccncc2Cl)CCCN1C	ZINC000583618240	405777067	/nfs/dbraw/zinc/77/70/67/405777067.db2.gz	XFDQKHSZBPJODV-BLLLJJGKSA-N	0	3	319.840	2.385	10	0		DEAEHN
C[C@H](CC1CCC1)NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638994802	405807786	/nfs/dbraw/zinc/80/77/86/405807786.db2.gz	OXYUMNWHIBQMRB-RHSMWYFYSA-N	0	3	303.450	2.141	10	0		DEAEHN
CO[C@@H](CNC[C@@H]1CCCCS1(=O)=O)C1CCCCC1	ZINC000639035634	405833080	/nfs/dbraw/zinc/83/30/80/405833080.db2.gz	FUINKMUMGYHYLX-GJZGRUSLSA-N	0	3	303.468	2.139	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)NCCN2CCC[C@H](C)C2)c1	ZINC000457466797	405854342	/nfs/dbraw/zinc/85/43/42/405854342.db2.gz	WAFLRMIGWKQSEO-ZDUSSCGKSA-N	0	3	318.417	2.243	10	0		DEAEHN
COc1cc(C)c(C(=O)NCCN2CC[C@@H](C)C2)cc1OC	ZINC000531267465	405934076	/nfs/dbraw/zinc/93/40/76/405934076.db2.gz	QWGVJUIAGMLWBC-GFCCVEGCSA-N	0	3	306.406	2.084	10	0		DEAEHN
c1ccc(N2CC[C@H](CN3CC[C@@H](Nc4ncccn4)C3)C2)cc1	ZINC000639282095	406019985	/nfs/dbraw/zinc/01/99/85/406019985.db2.gz	NDOBAGSYPDDHTE-IAGOWNOFSA-N	0	3	323.444	2.489	10	0		DEAEHN
CN(Cc1ncc(Br)s1)[C@H]1CN2CCC1CC2	ZINC000639399903	406083737	/nfs/dbraw/zinc/08/37/37/406083737.db2.gz	VCOMHIIBQWHQGP-JTQLQIEISA-N	0	3	316.268	2.432	10	0		DEAEHN
Cc1csc([C@H](C)NC(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)n1	ZINC000532060543	406039509	/nfs/dbraw/zinc/03/95/09/406039509.db2.gz	JSLFJKQGWFMXAO-SUZMYJTESA-N	0	3	308.451	2.294	10	0		DEAEHN
c1cnn(-c2ccc(CN3CC[C@H](Nc4ncccn4)C3)cc2)c1	ZINC000567905384	406158385	/nfs/dbraw/zinc/15/83/85/406158385.db2.gz	VLYZIMPZMHGNLM-INIZCTEOSA-N	0	3	320.400	2.349	10	0		DEAEHN
Cc1cccc2c1CC[C@@H]2NC(=O)NCCNc1ccncc1	ZINC000535263453	406217570	/nfs/dbraw/zinc/21/75/70/406217570.db2.gz	YIARGDRUDVDVND-KRWDZBQOSA-N	0	3	310.401	2.211	10	0		DEAEHN
Cc1ccc([C@H](C)NC(=O)CN2CC[C@@H](CO)[C@@H]2C)cc1C	ZINC000488732266	406342554	/nfs/dbraw/zinc/34/25/54/406342554.db2.gz	MMKDVOFCYDKEKD-ZOBUZTSGSA-N	0	3	304.434	2.183	10	0		DEAEHN
c1cc(-c2noc([C@H]3CCCN(Cc4cccnc4)C3)n2)no1	ZINC000546493210	406359088	/nfs/dbraw/zinc/35/90/88/406359088.db2.gz	MOKCNEQIPKXPEJ-ZDUSSCGKSA-N	0	3	311.345	2.499	10	0		DEAEHN
CC(C)CN(C(=O)[C@H](N)CN(C)Cc1ccccc1)C(C)C	ZINC000637931679	406482671	/nfs/dbraw/zinc/48/26/71/406482671.db2.gz	GEJAHBHMOYSMLL-QGZVFWFLSA-N	0	3	305.466	2.339	10	0		DEAEHN
CC[C@H]1CCCCN1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637869916	406455117	/nfs/dbraw/zinc/45/51/17/406455117.db2.gz	ZWBNTWZGCLPNDC-IRXDYDNUSA-N	0	3	303.450	2.237	10	0		DEAEHN
c1c(CN2CCN(CCC[C@H]3CCO3)CC2)nc2ccccn12	ZINC000637878127	406458656	/nfs/dbraw/zinc/45/86/56/406458656.db2.gz	DKONLWIBSTWXAK-KRWDZBQOSA-N	0	3	314.433	2.021	10	0		DEAEHN
c1ccc(N2CC[C@H](CN3CCOC4(CCOCC4)C3)C2)cc1	ZINC000638167744	406603251	/nfs/dbraw/zinc/60/32/51/406603251.db2.gz	HJGKQCSUHJEXLD-QGZVFWFLSA-N	0	3	316.445	2.394	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N1CCC[C@H](CCF)C1	ZINC000638420926	406761539	/nfs/dbraw/zinc/76/15/39/406761539.db2.gz	WKNXTOQJYBBGJV-IAGOWNOFSA-N	0	3	321.440	2.044	10	0		DEAEHN
CN1CCC(c2c(OC(F)(F)F)cccc2C(N)=O)CC1	ZINC000575448628	406811198	/nfs/dbraw/zinc/81/11/98/406811198.db2.gz	IHFYWCWRIKXHSM-UHFFFAOYSA-N	0	3	302.296	2.493	10	0		DEAEHN
COC[C@]1(C(=O)Nc2ccc(Br)cc2)CCCN1	ZINC000643613889	407016789	/nfs/dbraw/zinc/01/67/89/407016789.db2.gz	GAMHCVNJXXCPCO-ZDUSSCGKSA-N	0	3	313.195	2.156	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)[C@H]1OCCc2ccccc21	ZINC000129395760	196045262	/nfs/dbraw/zinc/04/52/62/196045262.db2.gz	OANVQDWGOWCYLI-YOEHRIQHSA-N	0	3	302.418	2.291	10	0		DEAEHN
COc1ccc(Oc2cnc(CN)cn2)c(Br)c1	ZINC000129494659	196052851	/nfs/dbraw/zinc/05/28/51/196052851.db2.gz	FMXYZVRVMMBWNP-UHFFFAOYSA-N	0	3	310.151	2.499	10	0		DEAEHN
CCO[C@@H](C)CNCc1cnc2cnc(Br)cn12	ZINC000129523658	196055213	/nfs/dbraw/zinc/05/52/13/196055213.db2.gz	DIWOVETVOATYLM-VIFPVBQESA-N	0	3	313.199	2.006	10	0		DEAEHN
CCCNc1cc(C)ncc1C(=O)N[C@H](C)CC[S@@](C)=O	ZINC000129660993	196065961	/nfs/dbraw/zinc/06/59/61/196065961.db2.gz	KSJNVKTVAKJDSL-FIKIJFGZSA-N	0	3	311.451	2.099	10	0		DEAEHN
C[C@@H](NC(=O)C(C)(C)N1CCNCC1)c1ccc(Cl)cc1	ZINC000129696597	196068776	/nfs/dbraw/zinc/06/87/76/196068776.db2.gz	JHLTUGZPBHUKKK-GFCCVEGCSA-N	0	3	309.841	2.201	10	0		DEAEHN
C[C@@H](CN1CCOCC1)NC1=NCC2(CCCCC2)CS1	ZINC000131120857	196141837	/nfs/dbraw/zinc/14/18/37/196141837.db2.gz	UAIGGJDLUWTKIS-AWEZNQCLSA-N	0	3	311.495	2.350	10	0		DEAEHN
CCN[C@H](CCCS(C)(=O)=O)c1cc(OC)ccc1OC	ZINC000131187142	196147427	/nfs/dbraw/zinc/14/74/27/196147427.db2.gz	ZFDMNZUFZDTAOM-CQSZACIVSA-N	0	3	315.435	2.179	10	0		DEAEHN
CC(C)[C@@](C)(C[NH3+])[N-]S(=O)(=O)c1ccc(Cl)cc1F	ZINC000131179198	196147537	/nfs/dbraw/zinc/14/75/37/196147537.db2.gz	WOUAFAJHYKPZRY-GFCCVEGCSA-N	0	3	308.806	2.131	10	0		DEAEHN
CCCN[C@H](Cc1ccc(F)cc1C)[C@@H](C)S(C)(=O)=O	ZINC000131921859	196209918	/nfs/dbraw/zinc/20/99/18/196209918.db2.gz	PCJHAVGKZLZCSE-IUODEOHRSA-N	0	3	301.427	2.478	10	0		DEAEHN
CCOC[C@@H]1CCCN(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)C1	ZINC000132395532	196252539	/nfs/dbraw/zinc/25/25/39/196252539.db2.gz	WAGCIAIRZZOZBT-XHSDSOJGSA-N	0	3	311.470	2.173	10	0		DEAEHN
CCCN[C@H](Cc1cc(C)ccc1OC)[C@H](C)S(C)(=O)=O	ZINC000133156242	196316842	/nfs/dbraw/zinc/31/68/42/196316842.db2.gz	XDPRCBMIBMWZLP-DZGCQCFKSA-N	0	3	313.463	2.347	10	0		DEAEHN
CCN[C@@H](Cc1ccc(Cl)cc1F)[C@@H](C)S(C)(=O)=O	ZINC000134214051	196370971	/nfs/dbraw/zinc/37/09/71/196370971.db2.gz	JUNGLHZLKAIRTN-RNCFNFMXSA-N	0	3	307.818	2.433	10	0		DEAEHN
CN1CCC[C@@H](Nc2ccc(NS(C)(=O)=O)c(Cl)c2)C1	ZINC000134267799	196375138	/nfs/dbraw/zinc/37/51/38/196375138.db2.gz	NYLMJEUYEPWWTE-LLVKDONJSA-N	0	3	317.842	2.218	10	0		DEAEHN
CCNc1nc(N[C@@H](CC)CSC)nc(N2CCCC2)n1	ZINC000134269950	196375218	/nfs/dbraw/zinc/37/52/18/196375218.db2.gz	FJFIPDOHTKKYOX-NSHDSACASA-N	0	3	310.471	2.457	10	0		DEAEHN
CCc1nn(C)cc1CN[C@H]1CCO[C@@H]1c1ccc(OC)nc1	ZINC000299744889	229384990	/nfs/dbraw/zinc/38/49/90/229384990.db2.gz	VFXDACGGFJUCGZ-DOTOQJQBSA-N	0	3	316.405	2.006	10	0		DEAEHN
Cc1nnc(NC[C@@H]2CCCCN2Cc2ccccc2)nc1C	ZINC000359523831	424830848	/nfs/dbraw/zinc/83/08/48/424830848.db2.gz	IMOSXZIZUHJEPC-KRWDZBQOSA-N	0	3	311.433	2.955	10	0		DEAEHN
CC(C)(N)c1cn(Cc2cc(Br)ccc2F)nn1	ZINC000070118842	424842170	/nfs/dbraw/zinc/84/21/70/424842170.db2.gz	SVCIFXSSOWVLHI-UHFFFAOYSA-N	0	3	313.174	2.422	10	0		DEAEHN
CCc1ccc([C@H](C)NC[C@@H](O)COC[C@@H]2CCCO2)cc1	ZINC000121494103	424853499	/nfs/dbraw/zinc/85/34/99/424853499.db2.gz	NWQCUBJYSTZQGE-QGTPRVQTSA-N	0	3	307.434	2.456	10	0		DEAEHN
COc1ccc(Cl)cc1CC(=O)N1CCN2CCC[C@H]2C1	ZINC000195321619	424882054	/nfs/dbraw/zinc/88/20/54/424882054.db2.gz	MRXOTEGNEUMTST-AWEZNQCLSA-N	0	3	308.809	2.198	10	0		DEAEHN
O[C@@]1(CCNCc2cc(F)cc(Br)c2)CCOC1	ZINC000404147984	424925330	/nfs/dbraw/zinc/92/53/30/424925330.db2.gz	NAKLKTXQHWLGTF-ZDUSSCGKSA-N	0	3	318.186	2.219	10	0		DEAEHN
O[C@@]1(CCNCc2cc(Br)cs2)CCOC1	ZINC000404180542	424925470	/nfs/dbraw/zinc/92/54/70/424925470.db2.gz	BNRXLFNMWWHECY-NSHDSACASA-N	0	3	306.225	2.142	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N(C)[C@@H]1CCN(C)C[C@H]1C	ZINC000249180543	424887347	/nfs/dbraw/zinc/88/73/47/424887347.db2.gz	HYWLNAKERHACBX-VNHYZAJKSA-N	0	3	320.437	2.133	10	0		DEAEHN
COc1ccc(O[C@H](C)C(=O)NC2CCN(C3CC3)CC2)cc1	ZINC000029094704	267362509	/nfs/dbraw/zinc/36/25/09/267362509.db2.gz	FPMDWIHGMKTYNY-CYBMUJFWSA-N	0	3	318.417	2.206	10	0		DEAEHN
CCN1CCN(CCC(=O)N[C@@H](C)c2ccc(C)c(F)c2)CC1	ZINC000088352689	267397888	/nfs/dbraw/zinc/39/78/88/267397888.db2.gz	VLHYHQYBQUMCDZ-HNNXBMFYSA-N	0	3	321.440	2.339	10	0		DEAEHN
CN(C(=O)c1cc(F)c(F)c(F)c1)[C@H](CN)C(F)(F)F	ZINC000662977696	425770129	/nfs/dbraw/zinc/77/01/29/425770129.db2.gz	BQHRUSHMSMOIFE-MRVPVSSYSA-N	0	3	300.202	2.066	10	0		DEAEHN
CN(C(=O)[C@@H]1Cc2ccccc2S1)[C@@H](CN)C(F)(F)F	ZINC000662979241	425770578	/nfs/dbraw/zinc/77/05/78/425770578.db2.gz	UUBXHFWZWKBDED-QWRGUYRKSA-N	0	3	304.337	2.051	10	0		DEAEHN
COC[C@@H](CN[C@@H](C)c1ccc(Br)cn1)OC	ZINC000516829973	269369578	/nfs/dbraw/zinc/36/95/78/269369578.db2.gz	JVNQPJDSDMAUAB-GXSJLCMTSA-N	0	3	303.200	2.156	10	0		DEAEHN
CC(C)c1ccc(NC(=O)CN[C@@H]2CCCC[C@@H]2C(N)=O)cc1	ZINC000184810021	273563456	/nfs/dbraw/zinc/56/34/56/273563456.db2.gz	OJMRKVOYOTUNGR-JKSUJKDBSA-N	0	3	317.433	2.382	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1nc(-c2ccco2)cs1)[C@H]1CCCO1	ZINC000183165974	274245806	/nfs/dbraw/zinc/24/58/06/274245806.db2.gz	YXKSQVGYCZCEGV-ZYHUDNBSSA-N	0	3	321.402	2.499	10	0		DEAEHN
CC(=O)Nc1ccc(N[C@@H]2CCC[C@H]2[C@@H]2COCCN2)cc1	ZINC000262031919	275794541	/nfs/dbraw/zinc/79/45/41/275794541.db2.gz	XQHOROMUEHSZAW-ZACQAIPSSA-N	0	3	303.406	2.214	10	0		DEAEHN
CC(C)N(CCN(C)C)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000178708205	275935988	/nfs/dbraw/zinc/93/59/88/275935988.db2.gz	PGJYOAQXGLKCGF-OAHLLOKOSA-N	0	3	305.422	2.492	10	0		DEAEHN
CN(C)[C@@H](Cc1ccccc1)C(=O)NCCN1CCCCCC1	ZINC000106457453	276828580	/nfs/dbraw/zinc/82/85/80/276828580.db2.gz	ABTFARALYHYFGW-SFHVURJKSA-N	0	3	317.477	2.152	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCc2ccncc2)[C@H]1c1ccccc1	ZINC000245630404	277136662	/nfs/dbraw/zinc/13/66/62/277136662.db2.gz	HOWOPGGBRJKFEN-IAGOWNOFSA-N	0	3	310.401	2.326	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)c2cnc3ccccc3n2)C1	ZINC000246749773	277181730	/nfs/dbraw/zinc/18/17/30/277181730.db2.gz	POWJSSSQUHPFFL-GUYCJALGSA-N	0	3	310.401	2.186	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1C[C@H](C)[C@H]2CCCC[C@@H]21	ZINC000248409788	277220635	/nfs/dbraw/zinc/22/06/35/277220635.db2.gz	CVDKKDNGWHQUCH-HZMVEIRTSA-N	0	3	323.481	2.317	10	0		DEAEHN
CC(C)(CNC(=O)[C@H]1CCCc2n[nH]cc21)N1CCCCC1	ZINC000132381354	277302391	/nfs/dbraw/zinc/30/23/91/277302391.db2.gz	ZRAXBDXZVJMATA-ZDUSSCGKSA-N	0	3	304.438	2.210	10	0		DEAEHN
C[C@@H](CN1CCCCCC1)NC(=O)c1cccc2c1OCO2	ZINC000185419417	278255574	/nfs/dbraw/zinc/25/55/74/278255574.db2.gz	XIVSRWUBVOKYSR-ZDUSSCGKSA-N	0	3	304.390	2.410	10	0		DEAEHN
C[C@@H](NCC(=O)N1CCSc2ccccc21)[C@H]1CCCO1	ZINC000183087067	278338197	/nfs/dbraw/zinc/33/81/97/278338197.db2.gz	WGLGVOSXLWHIEN-TZMCWYRMSA-N	0	3	306.431	2.282	10	0		DEAEHN
C[C@H]1CC[C@H](C)N1CC(=O)Nc1ccc2c(c1F)CCNC2	ZINC000261722318	278381810	/nfs/dbraw/zinc/38/18/10/278381810.db2.gz	LQLGKCKRCANCGX-RYUDHWBXSA-N	0	3	305.397	2.283	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCC[C@H]1c1cccn1C	ZINC000246485728	279332564	/nfs/dbraw/zinc/33/25/64/279332564.db2.gz	VZCSCHQXFNTMBC-HOCLYGCPSA-N	0	3	304.438	2.356	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1CCCCCS(=O)(=O)CC	ZINC000248967184	288316844	/nfs/dbraw/zinc/31/68/44/288316844.db2.gz	BUZFWIXPKQLPLW-HOTGVXAUSA-N	0	3	316.511	2.150	10	0		DEAEHN
CC[C@]1(C)C[C@H]1C(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000136948465	281338120	/nfs/dbraw/zinc/33/81/20/281338120.db2.gz	ZNXXKNYRBNFGCR-XYJFISCASA-N	0	3	307.482	2.051	10	0		DEAEHN
C[C@H](N[C@@H]1CCc2ncnn2C1)c1ccc(F)cc1N(C)C	ZINC000180594369	290026920	/nfs/dbraw/zinc/02/69/20/290026920.db2.gz	GCCRCVNPHYUXEW-WCQYABFASA-N	0	3	303.385	2.149	10	0		DEAEHN
O=C(CN[C@@H]1CCCC[C@H]1n1cccn1)N1CCCCCC1	ZINC000128695669	295521321	/nfs/dbraw/zinc/52/13/21/295521321.db2.gz	UMDHSBRQQSPXIR-HZPDHXFCSA-N	0	3	304.438	2.359	10	0		DEAEHN
Cc1ccc(N(C)C(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)cc1	ZINC000262549307	301619451	/nfs/dbraw/zinc/61/94/51/301619451.db2.gz	SCPCUPDXQQPULI-RLFYNMQTSA-N	0	3	302.418	2.490	10	0		DEAEHN
COC[C@H](C)CN1CCN(Cc2cc(F)ccc2OC)CC1	ZINC000189570257	333117744	/nfs/dbraw/zinc/11/77/44/333117744.db2.gz	ZQDJSAHBPBCDAT-CQSZACIVSA-N	0	3	310.413	2.234	10	0		DEAEHN
CCOc1ccc(CN2CCN(C[C@@H](C)COC)CC2)cc1	ZINC000189602141	333154925	/nfs/dbraw/zinc/15/49/25/333154925.db2.gz	LVHSRBYKWPYUJO-MRXNPFEDSA-N	0	3	306.450	2.485	10	0		DEAEHN
COC[C@H](C)CN1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000189640583	333190997	/nfs/dbraw/zinc/19/09/97/333190997.db2.gz	MAFYPEJQJAGGPS-CQSZACIVSA-N	0	3	308.397	2.256	10	0		DEAEHN
COc1ccc(C[C@@H](C)CNCc2cc(C(N)=O)co2)cc1F	ZINC000190010686	533749857	/nfs/dbraw/zinc/74/98/57/533749857.db2.gz	FKDGWNURSCQTAW-LLVKDONJSA-N	0	3	320.364	2.495	10	0		DEAEHN
CCO[C@@H]1C[C@@](N)(C(=O)N[C@@H](CC)c2nccs2)C1(C)C	ZINC000229572089	520396419	/nfs/dbraw/zinc/39/64/19/520396419.db2.gz	NEUFZBRCMQEDNR-FIXISWKDSA-N	0	3	311.451	2.243	10	0		DEAEHN
CCO[C@@H]1C[C@@](N)(C(=O)N[C@H](CC)c2nccs2)C1(C)C	ZINC000249112396	520396611	/nfs/dbraw/zinc/39/66/11/520396611.db2.gz	NEUFZBRCMQEDNR-UEKVPHQBSA-N	0	3	311.451	2.243	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)NCCN1CCC(C)CC1	ZINC000162082288	521175824	/nfs/dbraw/zinc/17/58/24/521175824.db2.gz	JHHILQKZESOXTG-UHFFFAOYSA-N	0	3	324.494	2.449	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000131235193	522052873	/nfs/dbraw/zinc/05/28/73/522052873.db2.gz	REZGAZSNHDKVBS-MRXNPFEDSA-N	0	3	301.434	2.355	10	0		DEAEHN
COCCN1CCN(CCCOc2ccc(OC)cc2)C[C@H]1C	ZINC000105832586	523852893	/nfs/dbraw/zinc/85/28/93/523852893.db2.gz	OSPDNGPKBRFHDX-MRXNPFEDSA-N	0	3	322.449	2.117	10	0		DEAEHN
Cc1ccc([C@@H](C)CNC(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000162209040	525680446	/nfs/dbraw/zinc/68/04/46/525680446.db2.gz	PUEFPJCYNURSSO-RDJZCZTQSA-N	0	3	319.449	2.071	10	0		DEAEHN
C[C@@]1(CNC(=O)C2(O)CCC2)CCCN1Cc1ccccc1	ZINC000154840662	525832328	/nfs/dbraw/zinc/83/23/28/525832328.db2.gz	CHYVUGDMRHKSDY-KRWDZBQOSA-N	0	3	302.418	2.072	10	0		DEAEHN
CC(=O)c1cccc(CN2CCCC[C@H]2[C@H]2CNC(=O)C2)c1	ZINC000450640207	534887917	/nfs/dbraw/zinc/88/79/17/534887917.db2.gz	GAOJLZBKTNOLAV-SJORKVTESA-N	0	3	300.402	2.380	10	0		DEAEHN
CCC[C@@]1(COC)CCCN1C(=O)N[C@H]1CCCN(CC)C1	ZINC000193471778	527958105	/nfs/dbraw/zinc/95/81/05/527958105.db2.gz	YPXWIVAFZDIVBD-RDJZCZTQSA-N	0	3	311.470	2.461	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N[C@H](c2nccn2C)C2CC2)C12CCOCC2	ZINC000251676666	535418648	/nfs/dbraw/zinc/41/86/48/535418648.db2.gz	MRDSCJAETMMQSD-OAGGEKHMSA-N	0	3	319.449	2.435	10	0		DEAEHN
CCCc1nc(CN2CCNC[C@H]2c2ccccc2OC)no1	ZINC000261668720	535527187	/nfs/dbraw/zinc/52/71/87/535527187.db2.gz	HMIVCPYAMOEKFM-AWEZNQCLSA-N	0	3	316.405	2.177	10	0		DEAEHN
CN(C)C[C@H](NC(=O)N[C@@H]1C[C@@H]2OCCC[C@@H]12)c1ccccc1	ZINC000251586911	535951741	/nfs/dbraw/zinc/95/17/41/535951741.db2.gz	FIYZYVNOGWBOLP-YVSFHVDLSA-N	0	3	317.433	2.156	10	0		DEAEHN
CC[C@H](Oc1ccccc1F)C(=O)NCCNc1ccncc1	ZINC000359089204	536054616	/nfs/dbraw/zinc/05/46/16/536054616.db2.gz	YHENPXSGCALLFX-HNNXBMFYSA-N	0	3	317.364	2.028	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)c2cnc[nH]2)[C@@H]1c1cccs1	ZINC000357219373	536386679	/nfs/dbraw/zinc/38/66/79/536386679.db2.gz	KXDBYVNUSVDRMS-BXUZGUMPSA-N	0	3	304.419	2.284	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2nc3cccnc3s2)C1	ZINC000248757930	536472838	/nfs/dbraw/zinc/47/28/38/536472838.db2.gz	XGDIBWNFCCMIRJ-WCQYABFASA-N	0	3	316.430	2.248	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)/C=C\c1ccc(F)cc1	ZINC000255069920	623371724	/nfs/dbraw/zinc/37/17/24/623371724.db2.gz	NABSMXJIBMPTNT-OEYXZAGESA-N	0	3	314.426	2.446	10	0		DEAEHN
CC(=O)N1CCC[C@H]1C(=O)C(C#N)c1nc2ccccc2s1	ZINC000041500965	641584988	/nfs/dbraw/zinc/58/49/88/641584988.db2.gz	USRZQIIJGHXVHS-YPMHNXCESA-N	0	3	313.382	2.483	10	0		DEAEHN
Cn1cncc1CCOC(=O)c1cccc(CN2CCCC2)c1	ZINC000805922916	643847012	/nfs/dbraw/zinc/84/70/12/643847012.db2.gz	YBQIXIFYGHFMDA-UHFFFAOYSA-N	0	3	313.401	2.415	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2ccc(Cl)nc2)C1	ZINC000119958933	684089587	/nfs/dbraw/zinc/08/95/87/684089587.db2.gz	MKVMPRVWYJLYED-ZDUSSCGKSA-N	0	3	310.829	2.061	10	0		DEAEHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@H]2CCOC[C@@H]2C)c1	ZINC000192510765	684451385	/nfs/dbraw/zinc/45/13/85/684451385.db2.gz	IJLVAIVLTKFKMO-AEGPPILISA-N	0	3	300.358	2.315	10	0		DEAEHN
CCOCCN1CCN(C[C@@H](O)c2cc(C)cc(C)c2)C[C@H]1C	ZINC000246696825	685134518	/nfs/dbraw/zinc/13/45/18/685134518.db2.gz	JBWJHKXRIXCOSJ-IEBWSBKVSA-N	0	3	320.477	2.379	10	0		DEAEHN
FC(F)(F)[C@@H]1CC[C@@H](CN2CCC[C@H](C3OCCO3)C2)O1	ZINC000721476218	777094512	/nfs/dbraw/zinc/09/45/12/777094512.db2.gz	LUEBMDCBRRFHFF-SRVKXCTJSA-N	0	3	309.328	2.181	10	0		DEAEHN
Cc1cn(C)nc1CN[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000723504964	777115596	/nfs/dbraw/zinc/11/55/96/777115596.db2.gz	JSUZOGQSNCNOCM-LBPRGKRZSA-N	0	3	308.426	2.074	10	0		DEAEHN
COC[C@@H]1CCCN(C[C@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724109843	777242083	/nfs/dbraw/zinc/24/20/83/777242083.db2.gz	ADGPJXCOVYYKPJ-ZJUUUORDSA-N	0	3	305.287	2.293	10	0		DEAEHN
O=C(/C=C\c1ccncn1)O[C@H]1CCN(Cc2ccccc2)C1	ZINC000588539064	777373634	/nfs/dbraw/zinc/37/36/34/777373634.db2.gz	YIFDDBMMAJGCEK-TUYSUELWSA-N	0	3	309.369	2.308	10	0		DEAEHN
COC[C@@H](CNCc1c(Br)cnn1C)C(C)C	ZINC000721835209	779345364	/nfs/dbraw/zinc/34/53/64/779345364.db2.gz	IJVKKEHAWPINLQ-SNVBAGLBSA-N	0	3	304.232	2.191	10	0		DEAEHN
Cc1csc(CCCNC(=O)N2CC[C@@H](N3CC=CC3)C2)n1	ZINC000174602865	783381312	/nfs/dbraw/zinc/38/13/12/783381312.db2.gz	SLIUZOSCPBOGPG-CQSZACIVSA-N	0	3	320.462	2.040	10	0		DEAEHN
Brc1c[nH]c(CN[C@H](C2CC2)[C@H]2CCCOC2)n1	ZINC000723979501	787346155	/nfs/dbraw/zinc/34/61/55/787346155.db2.gz	XWVQVRLIILSDTD-GXFFZTMASA-N	0	3	314.227	2.467	10	0		DEAEHN
Cn1cc(CNCCC[C@H]2CCOC2)c(Br)n1	ZINC000712403310	792187737	/nfs/dbraw/zinc/18/77/37/792187737.db2.gz	BKZDQWYFSWLXJM-JTQLQIEISA-N	0	3	302.216	2.089	10	0		DEAEHN
C[C@@H]1C[C@H](CNCc2cn(C)nc2Br)[C@@H](C)O1	ZINC000712499158	792190623	/nfs/dbraw/zinc/19/06/23/792190623.db2.gz	WHJFOYFZWHMAAX-OPRDCNLKSA-N	0	3	302.216	2.086	10	0		DEAEHN
C[C@H]1C[C@@H](NCc2ccnn2C)CN(C(=O)OC(C)(C)C)C1	ZINC000401709108	801845285	/nfs/dbraw/zinc/84/52/85/801845285.db2.gz	CTOYHHFNIHVQOO-QWHCGFSZSA-N	0	3	308.426	2.155	10	0		DEAEHN
C/C=C/C(=O)N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21	ZINC000404242466	802012965	/nfs/dbraw/zinc/01/29/65/802012965.db2.gz	XZYSINQTXSNGRG-FSBZLFFGSA-N	0	3	300.402	2.064	10	0		DEAEHN
c1ccc2c(c1)CN(CCNCc1cnc(N3CCCC3)nc1)C2	ZINC000067450411	1079890145	/nfs/dbraw/zinc/89/01/45/1079890145.db2.gz	HYIPIKNZPUOZGU-UHFFFAOYSA-N	0	3	323.444	2.182	10	0		DEAEHN
CN1CCOC[C@H]1CNCc1ccc(CSC(F)F)o1	ZINC000700143037	1086309305	/nfs/dbraw/zinc/30/93/05/1086309305.db2.gz	OCIRNKQEMDLKJQ-SNVBAGLBSA-N	0	3	306.378	2.156	10	0		DEAEHN
C[C@H](NCC12CC(C1)CN2C(=O)OC(C)(C)C)c1ccnn1C	ZINC000701864550	1086388549	/nfs/dbraw/zinc/38/85/49/1086388549.db2.gz	NZCOQMXAGAUVDD-POZPTJLLSA-N	0	3	320.437	2.470	10	0		DEAEHN
C[C@@H](CNC(=O)[C@@H](N)CN(C)Cc1ccccc1)C(C)(C)C	ZINC000702358480	1086423119	/nfs/dbraw/zinc/42/31/19/1086423119.db2.gz	SALLJVAOXSRNPB-HOCLYGCPSA-N	0	3	305.466	2.244	10	0		DEAEHN
COC1(OC)CC[C@@H]1NC[C@H](NC(=O)OC(C)(C)C)C1CC1	ZINC000710948454	1086691357	/nfs/dbraw/zinc/69/13/57/1086691357.db2.gz	RZVPWCYBENGNQU-STQMWFEESA-N	0	3	314.426	2.031	10	0		DEAEHN
COC1(OC)CC[C@H]1NC[C@@H](NC(=O)OC(C)(C)C)C1CC1	ZINC000710948448	1086691601	/nfs/dbraw/zinc/69/16/01/1086691601.db2.gz	RZVPWCYBENGNQU-CHWSQXEVSA-N	0	3	314.426	2.031	10	0		DEAEHN
CC1(C)C[NH2+]C[C@H]1C(=O)Nc1cc(Br)ccc1[O-]	ZINC000711328112	1087065800	/nfs/dbraw/zinc/06/58/00/1087065800.db2.gz	ATBNYOUEAFFUTJ-VIFPVBQESA-N	0	3	313.195	2.339	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCCc1c[nH]c2ccccc12	ZINC000139250682	282100419	/nfs/dbraw/zinc/10/04/19/282100419.db2.gz	PXLFRVOMKZGXTL-AWEZNQCLSA-N	0	3	300.406	2.104	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCc1coc(-c2cccs2)n1	ZINC000139469787	282100995	/nfs/dbraw/zinc/10/09/95/282100995.db2.gz	HCMIOKQSGNQFAR-LBPRGKRZSA-N	0	3	320.418	2.297	10	0		DEAEHN
CN[C@@H]1CCOC[C@H]1S(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000081930536	192341719	/nfs/dbraw/zinc/34/17/19/192341719.db2.gz	NUHQKGZXGQECRY-HUUCEWRRSA-N	0	3	311.447	2.135	10	0		DEAEHN
CC(C)(C)NCCS(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000081936168	192342244	/nfs/dbraw/zinc/34/22/44/192342244.db2.gz	AEURIJHQHLEDFU-UHFFFAOYSA-N	0	3	313.419	2.010	10	0		DEAEHN
CCN[C@@H]1CCOC[C@@H]1S(=O)(=O)c1ccc(F)c(Cl)c1	ZINC000081946431	192345890	/nfs/dbraw/zinc/34/58/90/192345890.db2.gz	YIJANIVFGXWEOL-OLZOCXBDSA-N	0	3	321.801	2.020	10	0		DEAEHN
CN1C[C@H](NCc2ccc(Br)s2)CCC1=O	ZINC000082756506	185202354	/nfs/dbraw/zinc/20/23/54/185202354.db2.gz	MDLHQYNJGSLTDN-MRVPVSSYSA-N	0	3	303.225	2.221	10	0		DEAEHN
CC[C@@H](NC(=O)N1CC[C@@H](N(C)C)C1)c1ccc(OC)cc1	ZINC000170826288	282180549	/nfs/dbraw/zinc/18/05/49/282180549.db2.gz	HKHMJPCZIRWQJJ-GDBMZVCRSA-N	0	3	305.422	2.492	10	0		DEAEHN
CC(C)[C@@H](C[NH3+])[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000087404447	185223893	/nfs/dbraw/zinc/22/38/93/185223893.db2.gz	AQFWZNSONZCRGS-SNVBAGLBSA-N	0	3	311.234	2.255	10	0		DEAEHN
CCCc1nnsc1C(=O)N1C[C@H](N)Cc2ccccc21	ZINC000087456073	185225662	/nfs/dbraw/zinc/22/56/62/185225662.db2.gz	WVSWRURXRPUSQF-LLVKDONJSA-N	0	3	302.403	2.021	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)c2cccc(C)c2)[C@H](C)C1	ZINC000173255294	282189651	/nfs/dbraw/zinc/18/96/51/282189651.db2.gz	YLPZDBAJDKJMTQ-ZBFHGGJFSA-N	0	3	310.463	2.346	10	0		DEAEHN
COc1ccc(Br)c(C[C@H](N)c2cnccn2)c1	ZINC000087791828	185232059	/nfs/dbraw/zinc/23/20/59/185232059.db2.gz	DCMRWEKOJFTQPB-LBPRGKRZSA-N	0	3	308.179	2.490	10	0		DEAEHN
Cc1cccc(OCCNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000173190317	282189047	/nfs/dbraw/zinc/18/90/47/282189047.db2.gz	WRQPVGRPABDGLX-HZPDHXFCSA-N	0	3	319.449	2.498	10	0		DEAEHN
COCCN(Cc1ccc(OC)c(C(N)=S)c1)CC(C)C	ZINC000087832547	185232557	/nfs/dbraw/zinc/23/25/57/185232557.db2.gz	RKSBARYUQXGSBG-UHFFFAOYSA-N	0	3	310.463	2.434	10	0		DEAEHN
COc1ccc(CSc2nnc(N(C)C)s2)cc1CN	ZINC000087827791	185232605	/nfs/dbraw/zinc/23/26/05/185232605.db2.gz	GUBYQVBWUMQPBZ-UHFFFAOYSA-N	0	3	310.448	2.364	10	0		DEAEHN
COCC[C@H](N)C(=O)Nc1c(F)cc(Br)cc1F	ZINC000088168572	185240924	/nfs/dbraw/zinc/24/09/24/185240924.db2.gz	MYCITJBNERNPHC-VIFPVBQESA-N	0	3	323.137	2.030	10	0		DEAEHN
CCN[C@@H]1CCCN(c2c3nsnc3ccc2Cl)C1=O	ZINC000088128036	185240352	/nfs/dbraw/zinc/24/03/52/185240352.db2.gz	ACNZVPANARROAR-SNVBAGLBSA-N	0	3	310.810	2.450	10	0		DEAEHN
CC[C@@H](CN)S(=O)(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000088471776	185251997	/nfs/dbraw/zinc/25/19/97/185251997.db2.gz	CCKQGMXETSTHSV-JTQLQIEISA-N	0	3	312.313	2.064	10	0		DEAEHN
NN=c1[nH]cc(C(=O)N2CCC(C(F)(F)F)CC2)cc1Cl	ZINC000088438657	185250632	/nfs/dbraw/zinc/25/06/32/185250632.db2.gz	GFXVEAPTMAFPEQ-UHFFFAOYSA-N	0	3	322.718	2.435	10	0		DEAEHN
CCCN[C@H]1c2ccccc2C[C@@H]1S(=O)(=O)CCCOC	ZINC000081985396	192348806	/nfs/dbraw/zinc/34/88/06/192348806.db2.gz	HTOVQRYAHNLWFC-HOTGVXAUSA-N	0	3	311.447	2.103	10	0		DEAEHN
CN[C@H](c1ccccc1)[C@@H](C(C)C)S(=O)(=O)CCCOC	ZINC000081985739	192348824	/nfs/dbraw/zinc/34/88/24/192348824.db2.gz	JPKPHCZEAQIEFK-HZPDHXFCSA-N	0	3	313.463	2.423	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-]C[C@@H](C)CSC)o1	ZINC000088551137	185257606	/nfs/dbraw/zinc/25/76/06/185257606.db2.gz	HWFGTCVOSFBORD-LLVKDONJSA-N	0	3	320.480	2.057	10	0		DEAEHN
CCn1ncnc1COc1c(Br)cccc1CN	ZINC000088585597	185258575	/nfs/dbraw/zinc/25/85/75/185258575.db2.gz	NHAKJBFSCLTGQB-UHFFFAOYSA-N	0	3	311.183	2.098	10	0		DEAEHN
CCOC(=O)[C@H]1CNCCN1[C@@H](C)c1ccc(F)cc1Cl	ZINC000088657835	185261811	/nfs/dbraw/zinc/26/18/11/185261811.db2.gz	HXHHONOMDVAWLE-IINYFYTJSA-N	0	3	314.788	2.377	10	0		DEAEHN
CC(C)(C)[C@H]1CC[C@H](N)[C@H](S(=O)(=O)C2CCOCC2)C1	ZINC000081989751	192350509	/nfs/dbraw/zinc/35/05/09/192350509.db2.gz	DVGSZUNWQQVWMD-FPMFFAJLSA-N	0	3	303.468	2.122	10	0		DEAEHN
CC[C@@H](NC[C@](C)(O)CO)c1ccc(Br)cc1	ZINC000090284255	185289349	/nfs/dbraw/zinc/28/93/49/185289349.db2.gz	YARJWJNPZNEAKJ-OLZOCXBDSA-N	0	3	302.212	2.233	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000090293356	185289809	/nfs/dbraw/zinc/28/98/09/185289809.db2.gz	QAMZPCXNTRRADK-UHFFFAOYSA-N	0	3	323.245	2.366	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1nc2ccc(Cl)cc2s1	ZINC000090431482	185295947	/nfs/dbraw/zinc/29/59/47/185295947.db2.gz	NEPZJJLRRDBYFM-PSASIEDQSA-N	0	3	311.794	2.123	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1cc(C(F)(F)F)ccc1F	ZINC000090437618	185296173	/nfs/dbraw/zinc/29/61/73/185296173.db2.gz	QDLQYSWVAPQGDF-KWQFWETISA-N	0	3	306.259	2.017	10	0		DEAEHN
C[C@]1(C(=O)Nc2c3ncsc3ccc2Cl)COC[C@@H]1N	ZINC000090585545	185305159	/nfs/dbraw/zinc/30/51/59/185305159.db2.gz	FYFJPIUUMPLDIJ-ZANVPECISA-N	0	3	311.794	2.252	10	0		DEAEHN
CC(C)N(Cc1cccc(Cl)c1)C(=O)[C@@]1(C)COC[C@H]1N	ZINC000090592337	185305787	/nfs/dbraw/zinc/30/57/87/185305787.db2.gz	DOIFDGDWDUDZHP-ZBFHGGJFSA-N	0	3	310.825	2.441	10	0		DEAEHN
Cc1cc(NC(=O)[C@@]2(C)COC[C@@H]2N)ccc1Br	ZINC000090580522	185304784	/nfs/dbraw/zinc/30/47/84/185304784.db2.gz	BVDHVVBTSSHWMF-AAEUAGOBSA-N	0	3	313.195	2.060	10	0		DEAEHN
O=C(c1ccncc1)N1CCCSC[C@@H]1CN1CCCC1	ZINC000090700850	185310391	/nfs/dbraw/zinc/31/03/91/185310391.db2.gz	JNUQBTDFZWYWMN-HNNXBMFYSA-N	0	3	305.447	2.125	10	0		DEAEHN
CCCCS(=O)(=O)N1CCCSC[C@H]1CN1CCCC1	ZINC000090701035	185310656	/nfs/dbraw/zinc/31/06/56/185310656.db2.gz	LXRQPYFNKHLFAD-CQSZACIVSA-N	0	3	320.524	2.020	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(Br)c[nH]1	ZINC000092632247	185330609	/nfs/dbraw/zinc/33/06/09/185330609.db2.gz	PVHPFJYVKNJBAJ-LLVKDONJSA-N	0	3	314.227	2.334	10	0		DEAEHN
O=C1C(=O)N(CCCN2CCCC2)c2cc(F)c(Cl)cc21	ZINC000092772007	185339878	/nfs/dbraw/zinc/33/98/78/185339878.db2.gz	INYGAFIRIHINMT-UHFFFAOYSA-N	0	3	310.756	2.494	10	0		DEAEHN
Cc1oc(C)c(S(=O)(=O)NCC2C(C)(C)C2(C)C)c1CN	ZINC000092833110	185344922	/nfs/dbraw/zinc/34/49/22/185344922.db2.gz	BTHZWRULBTZEHQ-UHFFFAOYSA-N	0	3	314.451	2.316	10	0		DEAEHN
CCN[C@H]1c2cc(OC)ccc2C[C@H]1Sc1nncn1C	ZINC000092860536	185347080	/nfs/dbraw/zinc/34/70/80/185347080.db2.gz	YRZXHKKBFXQRQU-KGLIPLIRSA-N	0	3	304.419	2.191	10	0		DEAEHN
COC[C@@H](NCc1cn2c(cccc2C)n1)C1CCOCC1	ZINC000187992362	282294695	/nfs/dbraw/zinc/29/46/95/282294695.db2.gz	XDSJGOPERARNKG-MRXNPFEDSA-N	0	3	303.406	2.174	10	0		DEAEHN
C[C@H]1C[C@H](NCc2cc(C(N)=O)co2)CN1Cc1ccccc1	ZINC000189411319	282309151	/nfs/dbraw/zinc/30/91/51/282309151.db2.gz	MPEBUXJYLNVPRL-BBRMVZONSA-N	0	3	313.401	2.131	10	0		DEAEHN
CN(C[C@H](O)Cc1ccccc1C(F)(F)F)CC1(CO)CC1	ZINC000190028092	529961881	/nfs/dbraw/zinc/96/18/81/529961881.db2.gz	BVIUVOSPPVJTGT-CYBMUJFWSA-N	0	3	317.351	2.313	10	0		DEAEHN
c1nc(CNCCCCN2CCN(c3ccccc3)CC2)co1	ZINC000192288644	282341338	/nfs/dbraw/zinc/34/13/38/282341338.db2.gz	YTUUGAOHWGLQHX-UHFFFAOYSA-N	0	3	314.433	2.367	10	0		DEAEHN
COc1ccc2c(c1)[C@H](NC[C@]1(CCO)CCOC1)CCCO2	ZINC000125477453	539472837	/nfs/dbraw/zinc/47/28/37/539472837.db2.gz	CYCPGQZTZYDUFY-AEFFLSMTSA-N	0	3	321.417	2.288	10	0		DEAEHN
CC(C)(C)c1ccc(CN2CCC3(CC2)NC(=O)NC3=O)s1	ZINC000272721146	210124203	/nfs/dbraw/zinc/12/42/03/210124203.db2.gz	FJXMVGFLPHCXRW-UHFFFAOYSA-N	0	3	321.446	2.220	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC[C@H](C)CS(C)(=O)=O)c1	ZINC000176954636	539628757	/nfs/dbraw/zinc/62/87/57/539628757.db2.gz	JOXUSZXQEKICCJ-RYUDHWBXSA-N	0	3	315.435	2.035	10	0		DEAEHN
OCC[C@@]1(CN[C@H]2CCCOc3cc(F)ccc32)CCOC1	ZINC000182122625	539655433	/nfs/dbraw/zinc/65/54/33/539655433.db2.gz	KTSGUZIPCCLMJK-RDJZCZTQSA-N	0	3	309.381	2.418	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)[C@H](C)N[C@@H](C)[C@@H]2CCCO2)cc1	ZINC000183223992	539660263	/nfs/dbraw/zinc/66/02/63/539660263.db2.gz	BHWHWLNAAIVXTN-MKBNYLNASA-N	0	3	304.390	2.373	10	0		DEAEHN
C[C@@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)C(C)(C)C	ZINC000185384455	539671668	/nfs/dbraw/zinc/67/16/68/539671668.db2.gz	PHCZERODPRJPEJ-CQSZACIVSA-N	0	3	312.502	2.136	10	0		DEAEHN
COC[C@H](C)CN1CCN(Cc2cnn(C(C)(C)C)c2)CC1	ZINC000187227709	539678471	/nfs/dbraw/zinc/67/84/71/539678471.db2.gz	CFQWYWXVLRSZDD-OAHLLOKOSA-N	0	3	308.470	2.038	10	0		DEAEHN
N[C@@H](C[S@](=O)c1ccccc1F)c1ccc2c(c1)OCO2	ZINC000084001286	192395304	/nfs/dbraw/zinc/39/53/04/192395304.db2.gz	BRLNHKWOLWZPJZ-LAJNKCICSA-N	0	3	307.346	2.362	10	0		DEAEHN
C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170866541	197841613	/nfs/dbraw/zinc/84/16/13/197841613.db2.gz	LMZDJDKLISRMSK-KCXAZCMYSA-N	0	3	315.417	2.057	10	0		DEAEHN
CC[NH+](CC)CCCCN[C@H](CC(=O)[O-])C(=O)c1ccccc1	ZINC000071660740	191000286	/nfs/dbraw/zinc/00/02/86/191000286.db2.gz	XRVOQUHUKUIVHB-MRXNPFEDSA-N	0	3	320.433	2.424	10	0		DEAEHN
CCO[C@@H](C)c1nc(CN(C)C(=O)C2(N)CCCC2)cs1	ZINC000237035017	539742516	/nfs/dbraw/zinc/74/25/16/539742516.db2.gz	IZCLUXSEBQOVSC-NSHDSACASA-N	0	3	311.451	2.471	10	0		DEAEHN
CCC[C@@H](C)N(C)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138529392	186017585	/nfs/dbraw/zinc/01/75/85/186017585.db2.gz	FZFWUJOPXKXEBC-SNVBAGLBSA-N	0	3	320.405	2.493	10	0		DEAEHN
CCNCc1cc(F)c(F)c(S(=O)(=O)N2CC[C@@H](C)C2)c1	ZINC000138653680	186018157	/nfs/dbraw/zinc/01/81/57/186018157.db2.gz	BTWHXVXJAOKFJS-SNVBAGLBSA-N	0	3	318.389	2.105	10	0		DEAEHN
CC[C@H](C)CN(CC)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000139185069	186020194	/nfs/dbraw/zinc/02/01/94/186020194.db2.gz	UFHQAZOYPDHJOO-JTQLQIEISA-N	0	3	320.405	2.480	10	0		DEAEHN
CCC[C@@H]1N[C@H](c2ccsc2)N(C2CCN(C)CC2)C1=O	ZINC000141186814	186029176	/nfs/dbraw/zinc/02/91/76/186029176.db2.gz	OAFJHUQGLUQZHS-GJZGRUSLSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCN1CCC[C@@H](N2C(=O)C3(CC3)N[C@H]2c2cccs2)C1	ZINC000144310199	186035151	/nfs/dbraw/zinc/03/51/51/186035151.db2.gz	RXZPVNDDSDPQQH-TZMCWYRMSA-N	0	3	305.447	2.195	10	0		DEAEHN
CC[C@@H]1N[C@H](c2ccsc2)N([C@@H]2CCN(C3CC3)C2)C1=O	ZINC000144697059	186035678	/nfs/dbraw/zinc/03/56/78/186035678.db2.gz	DRGDTOSTSCNDPX-ILXRZTDVSA-N	0	3	305.447	2.194	10	0		DEAEHN
CC(C)[C@@H](CN(C)C)N1C(=O)C2(CC2)N[C@@H]1c1cccs1	ZINC000145075008	186036358	/nfs/dbraw/zinc/03/63/58/186036358.db2.gz	KTSZAYYANHEFTA-OCCSQVGLSA-N	0	3	307.463	2.297	10	0		DEAEHN
CC(C)[C@H](CN(C)C)N1C(=O)C2(CC2)N[C@H]1c1cccs1	ZINC000145074856	186036586	/nfs/dbraw/zinc/03/65/86/186036586.db2.gz	KTSZAYYANHEFTA-GXTWGEPZSA-N	0	3	307.463	2.297	10	0		DEAEHN
CC(C)[C@@H](CN(C)C)N1C(=O)C2(CC2)N[C@H]1c1cccs1	ZINC000145074680	186036915	/nfs/dbraw/zinc/03/69/15/186036915.db2.gz	KTSZAYYANHEFTA-TZMCWYRMSA-N	0	3	307.463	2.297	10	0		DEAEHN
CCCN[C@H](c1cc(F)cc(F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000150179233	186055702	/nfs/dbraw/zinc/05/57/02/186055702.db2.gz	UBHUJNFKCPZDSS-YGRLFVJLSA-N	0	3	303.374	2.440	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1cc(C)ccc1Br	ZINC000163973867	186144457	/nfs/dbraw/zinc/14/44/57/186144457.db2.gz	ZLXGPSPSZSANEH-LLVKDONJSA-N	0	3	315.211	2.450	10	0		DEAEHN
CCNCc1cc(F)c(C)c(S(=O)(=O)NC2CC(C)C2)c1	ZINC000164003911	186145548	/nfs/dbraw/zinc/14/55/48/186145548.db2.gz	AQJXYPSHCDSZMZ-UHFFFAOYSA-N	0	3	314.426	2.320	10	0		DEAEHN
C[C@@H](CNCc1cc(Cl)c2c(c1)OCCCO2)[S@](C)=O	ZINC000159683960	186135360	/nfs/dbraw/zinc/13/53/60/186135360.db2.gz	WYYNIYOEMFWOHT-WVDJIFEKSA-N	0	3	317.838	2.358	10	0		DEAEHN
C[C@H]1CC[C@@](CO)(N(C)CC(=O)N(C)Cc2ccccc2)C1	ZINC000188004695	186242260	/nfs/dbraw/zinc/24/22/60/186242260.db2.gz	IAJFCDKJJJTVAJ-MAUKXSAKSA-N	0	3	304.434	2.128	10	0		DEAEHN
CC(C)N(C)C(=O)[C@@H](C)N[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000181911080	186217981	/nfs/dbraw/zinc/21/79/81/186217981.db2.gz	GZKNJHSIDXSXMV-UONOGXRCSA-N	0	3	315.421	2.173	10	0		DEAEHN
CCN1CC[C@H](N(C)C(=O)C(=O)c2ccccc2OC)[C@H](C)C1	ZINC000186047396	186234981	/nfs/dbraw/zinc/23/49/81/186234981.db2.gz	QILLFFVIINWFDK-HIFRSBDPSA-N	0	3	318.417	2.067	10	0		DEAEHN
CCCCc1nnc(NC(=O)N2CCN3CCC[C@@H]3C2)s1	ZINC000171886652	198001312	/nfs/dbraw/zinc/00/13/12/198001312.db2.gz	XYZYLMKSWYBPGR-LLVKDONJSA-N	0	3	309.439	2.193	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1OCCNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171901212	198004455	/nfs/dbraw/zinc/00/44/55/198004455.db2.gz	HOVGJAWRFSTUOY-BZUAXINKSA-N	0	3	309.454	2.071	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1Cc1nc(-c2cccs2)no1	ZINC000172082708	198037117	/nfs/dbraw/zinc/03/71/17/198037117.db2.gz	CIJAMAFPAMEPRC-VXGBXAGGSA-N	0	3	304.419	2.467	10	0		DEAEHN
O=C(C[C@H]1CCOc2ccccc21)N1CCN2CCC[C@@H]2C1	ZINC000172120148	198042279	/nfs/dbraw/zinc/04/22/79/198042279.db2.gz	VOYAFBZAROBMOK-HUUCEWRRSA-N	0	3	300.402	2.249	10	0		DEAEHN
CCn1cnnc1C1CCN(CCc2scnc2C)CC1	ZINC000172536064	198111762	/nfs/dbraw/zinc/11/17/62/198111762.db2.gz	JDDZYYHGNZXXRD-UHFFFAOYSA-N	0	3	305.451	2.485	10	0		DEAEHN
Cc1nc2ccccc2n1CC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000172620399	198125597	/nfs/dbraw/zinc/12/55/97/198125597.db2.gz	ZOKHPRNALUXJGG-HIFRSBDPSA-N	0	3	314.433	2.286	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2ccc(-n3ccnc3)cc2)CCN1C	ZINC000172620611	198127123	/nfs/dbraw/zinc/12/71/23/198127123.db2.gz	MJJDQNWHASYQOS-WMLDXEAASA-N	0	3	312.417	2.427	10	0		DEAEHN
CC1(C)CCCN1CC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000072605118	191200786	/nfs/dbraw/zinc/20/07/86/191200786.db2.gz	DTGIHAPKALGWBK-UHFFFAOYSA-N	0	3	319.424	2.349	10	0		DEAEHN
Cc1c(F)cccc1NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000072616911	191203508	/nfs/dbraw/zinc/20/35/08/191203508.db2.gz	LGZWGPUURGWXIE-ZDUSSCGKSA-N	0	3	323.412	2.165	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)Cc2ccccc2)[C@H](C)C1	ZINC000173259210	198202583	/nfs/dbraw/zinc/20/25/83/198202583.db2.gz	BFUKFUDAVWVSLD-GDBMZVCRSA-N	0	3	310.463	2.179	10	0		DEAEHN
C[C@H]1COCC[C@H]1C(=O)Nc1ccc(OCCN(C)C)cc1	ZINC000194069024	290973143	/nfs/dbraw/zinc/97/31/43/290973143.db2.gz	RNTMACNLDIFSID-XJKSGUPXSA-N	0	3	306.406	2.238	10	0		DEAEHN
C[C@H](CCc1cccc(F)c1)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000173522641	198223966	/nfs/dbraw/zinc/22/39/66/198223966.db2.gz	WSGJWZNLOFVSJF-RHSMWYFYSA-N	0	3	322.424	2.183	10	0		DEAEHN
Cc1nc(C)c(C(=O)N[C@H](Cc2ccccc2)CN(C)C)o1	ZINC000073010021	191268607	/nfs/dbraw/zinc/26/86/07/191268607.db2.gz	ZPTXYKVYUFMTLL-OAHLLOKOSA-N	0	3	301.390	2.194	10	0		DEAEHN
COCc1ccccc1CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000173812200	198256255	/nfs/dbraw/zinc/25/62/55/198256255.db2.gz	RNGZYMPZPYMXFC-RHSMWYFYSA-N	0	3	319.449	2.457	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NC[C@H]1CCCOC1)c1ccccc1	ZINC000057162125	354558840	/nfs/dbraw/zinc/55/88/40/354558840.db2.gz	DACZVJQWGRBFKM-ZBFHGGJFSA-N	0	3	305.422	2.015	10	0		DEAEHN
Cc1cccc(N2CCN(CCC(=O)N[C@@H]3C[C@@H]3C)CC2)c1	ZINC000073327894	191304965	/nfs/dbraw/zinc/30/49/65/191304965.db2.gz	OEDREVSACVVDQN-DOTOQJQBSA-N	0	3	301.434	2.032	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)C[C@@H](C)NC(=O)C2CCCCC2)C1	ZINC000067156326	354750305	/nfs/dbraw/zinc/75/03/05/354750305.db2.gz	DVOXMFMKDZMUAE-ZBFHGGJFSA-N	0	3	323.481	2.062	10	0		DEAEHN
Cc1nnc([C@H](C)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)o1	ZINC000069016749	354844817	/nfs/dbraw/zinc/84/48/17/354844817.db2.gz	HFPSEYRFWDXUQG-MCIONIFRSA-N	0	3	322.453	2.260	10	0		DEAEHN
CCC[C@H](C)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000180040812	356040666	/nfs/dbraw/zinc/04/06/66/356040666.db2.gz	XXIBPKSJRWKZTG-INIZCTEOSA-N	0	3	309.498	2.489	10	0		DEAEHN
CCN1CCC[C@H](N[C@@H](C)c2ccccc2OCC(=O)OC)C1	ZINC000183391831	356170536	/nfs/dbraw/zinc/17/05/36/356170536.db2.gz	ZTWPGGCGSOVHDF-GJZGRUSLSA-N	0	3	320.433	2.373	10	0		DEAEHN
NC[C@@H](O)c1cc(Br)c(Br)s1	ZINC000227972273	356281408	/nfs/dbraw/zinc/28/14/08/356281408.db2.gz	IUGNVQVPVCQWMV-SCSAIBSYSA-N	0	3	301.003	2.265	10	0		DEAEHN
C[C@@H](NCc1ccn(C)n1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000400499458	283157510	/nfs/dbraw/zinc/15/75/10/283157510.db2.gz	ICXWIJSDHBPEAF-OLZOCXBDSA-N	0	3	308.426	2.155	10	0		DEAEHN
CC(C)c1cc(C(=O)N(C)C[C@H]2CCc3nccn3C2)n[nH]1	ZINC000328628966	356464239	/nfs/dbraw/zinc/46/42/39/356464239.db2.gz	OGZYIZKQCMVWKI-GFCCVEGCSA-N	0	3	301.394	2.064	10	0		DEAEHN
c1cnc(N2CCC[C@H](NCc3ccc4c(n3)CCC4)C2)nc1	ZINC000578614756	356844298	/nfs/dbraw/zinc/84/42/98/356844298.db2.gz	HYJKCSKLAICUDC-INIZCTEOSA-N	0	3	309.417	2.119	10	0		DEAEHN
COc1cnccc1N1CCN(C(=O)C2CC3(CCC3)C2)CC1	ZINC000580835612	357088204	/nfs/dbraw/zinc/08/82/04/357088204.db2.gz	QGGRISFUYFTSHY-UHFFFAOYSA-N	0	3	315.417	2.319	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCc1c(C)cc(C)nc1OC	ZINC000589583911	357480493	/nfs/dbraw/zinc/48/04/93/357480493.db2.gz	WKUREANUYORABB-OAHLLOKOSA-N	0	3	305.422	2.198	10	0		DEAEHN
Cc1nc([C@@H](C)NC(=O)NC2CCN(C3CC3)CC2)cs1	ZINC000594083374	358203072	/nfs/dbraw/zinc/20/30/72/358203072.db2.gz	KKESBSKMKAGOPC-SNVBAGLBSA-N	0	3	308.451	2.439	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)NCc1ccc(Cl)cn1	ZINC000180757808	199205571	/nfs/dbraw/zinc/20/55/71/199205571.db2.gz	HWBVWBYLSFBNDA-CQSZACIVSA-N	0	3	310.829	2.409	10	0		DEAEHN
CCn1cc([C@H](C)N[C@H]2CCCN(c3cccnn3)C2)cn1	ZINC000180934997	199230798	/nfs/dbraw/zinc/23/07/98/199230798.db2.gz	KSCIFZCHRKYPNC-ZFWWWQNUSA-N	0	3	300.410	2.013	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)NC2(C)CCCCC2)cn1C	ZINC000089013158	192697149	/nfs/dbraw/zinc/69/71/49/192697149.db2.gz	QHCZSXPORQNWOQ-UHFFFAOYSA-N	0	3	313.467	2.136	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1ccnc2ccncc21	ZINC000187177382	200072718	/nfs/dbraw/zinc/07/27/18/200072718.db2.gz	NVUUBYJVBLQELN-ZDUSSCGKSA-N	0	3	300.406	2.336	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)CC(=O)N(C)Cc2cccs2)C1	ZINC000187963702	200183817	/nfs/dbraw/zinc/18/38/17/200183817.db2.gz	ZPPFRSGRTHSOKX-CJNGLKHVSA-N	0	3	310.463	2.189	10	0		DEAEHN
CO[C@H]1CN(CCC(=O)NC(=O)Nc2ccccc2)CC[C@@H]1C	ZINC000189263790	200372049	/nfs/dbraw/zinc/37/20/49/200372049.db2.gz	QLHIMNIHDIBBGO-ZFWWWQNUSA-N	0	3	319.405	2.082	10	0		DEAEHN
CCCCN(C)CCNC(=O)CN(C)c1ccc(Cl)cn1	ZINC000602176821	360301051	/nfs/dbraw/zinc/30/10/51/360301051.db2.gz	VPKJLYOOQGEFEA-UHFFFAOYSA-N	0	3	312.845	2.019	10	0		DEAEHN
CCSCC[C@H](C)NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000602457889	360382822	/nfs/dbraw/zinc/38/28/22/360382822.db2.gz	JIRGVGRCMSDVPQ-HOCLYGCPSA-N	0	3	323.506	2.094	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1Cc2ccc(C(=O)OC)cc2C1	ZINC000609308938	361298705	/nfs/dbraw/zinc/29/87/05/361298705.db2.gz	TXBMZPXJLQFWGI-MRXNPFEDSA-N	0	3	316.401	2.190	10	0		DEAEHN
COC(=O)[C@@H](NC1CCN([C@@H](C)c2ccncc2)CC1)C1CC1	ZINC000358844665	291264322	/nfs/dbraw/zinc/26/43/22/291264322.db2.gz	DTDUBDYHLNNVDS-GUYCJALGSA-N	0	3	317.433	2.148	10	0		DEAEHN
COC(=O)[C@@H](N[C@H](CN1CCCC1)c1ccccc1)C1CC1	ZINC000358810529	291266869	/nfs/dbraw/zinc/26/68/69/291266869.db2.gz	FZVCWNRIDFRULD-SJORKVTESA-N	0	3	302.418	2.365	10	0		DEAEHN
Cc1nc(C)c(CNC[C@@]2(O)CCN(Cc3ccccc3)C2)o1	ZINC000628219038	366772410	/nfs/dbraw/zinc/77/24/10/366772410.db2.gz	ZWVYHEBBJRJPTR-SFHVURJKSA-N	0	3	315.417	2.018	10	0		DEAEHN
COC(=O)[C@@H](O)C1CCN(Cc2ccccc2C2CC2)CC1	ZINC000611286384	361573222	/nfs/dbraw/zinc/57/32/22/361573222.db2.gz	XUMWGILUIQSUJJ-KRWDZBQOSA-N	0	3	303.402	2.310	10	0		DEAEHN
O=C(Cc1ccc(Cl)c(F)c1)NCCNc1ccncc1	ZINC000448036489	239235312	/nfs/dbraw/zinc/23/53/12/239235312.db2.gz	YLCCIRDWZUTSTQ-UHFFFAOYSA-N	0	3	307.756	2.067	10	0		DEAEHN
c1cc(CN[C@H]2CCc3n[nH]cc3C2)n(CCc2ccccc2)n1	ZINC000621337327	364359002	/nfs/dbraw/zinc/35/90/02/364359002.db2.gz	VJAXKWMGXFUQAL-KRWDZBQOSA-N	0	3	321.428	2.496	10	0		DEAEHN
CC(=O)N1CC[C@H](NCCO[C@@H]2CC2(F)F)c2ccccc21	ZINC000621765389	364539126	/nfs/dbraw/zinc/53/91/26/364539126.db2.gz	XUEQFXPSFKTGKG-DZGCQCFKSA-N	0	3	310.344	2.498	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)N[C@H]1CCCC[C@@H]1C(F)(F)F	ZINC000091135270	193001423	/nfs/dbraw/zinc/00/14/23/193001423.db2.gz	WCDISYWZMPAVQG-VWYCJHECSA-N	0	3	310.385	2.319	10	0		DEAEHN
O=C(C[C@H]1CSCCN1)Nc1cc2c(cc1Cl)OCO2	ZINC000091134862	193001874	/nfs/dbraw/zinc/00/18/74/193001874.db2.gz	PANRYCMDQDRHCZ-QMMMGPOBSA-N	0	3	314.794	2.102	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@@H]1O)c1ccc(Br)s1	ZINC000623767490	365167998	/nfs/dbraw/zinc/16/79/98/365167998.db2.gz	WVQHREDLDLGWAD-CIUDSAMLSA-N	0	3	306.225	2.311	10	0		DEAEHN
CN1CCOC[C@@H]1CNCc1ccc(Br)cc1F	ZINC000623710422	365140096	/nfs/dbraw/zinc/14/00/96/365140096.db2.gz	CDNIPLKGDUJPBY-LBPRGKRZSA-N	0	3	317.202	2.008	10	0		DEAEHN
CC[C@@H](C)NCC(=O)Nc1ccc(Br)c(C)n1	ZINC000091507214	193066854	/nfs/dbraw/zinc/06/68/54/193066854.db2.gz	APAWJSUZJMZIIA-MRVPVSSYSA-N	0	3	300.200	2.479	10	0		DEAEHN
Cc1cc([C@@H](CN)N2CCOC[C@@H]2C)ccc1Br	ZINC000091470580	193060634	/nfs/dbraw/zinc/06/06/34/193060634.db2.gz	QVZKKFPGGYHWFG-SMDDNHRTSA-N	0	3	313.239	2.478	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2cc(C(F)(F)F)ccc2C)C1	ZINC000091479781	193062148	/nfs/dbraw/zinc/06/21/48/193062148.db2.gz	FOSOSCSGSVSZGN-ZYHUDNBSSA-N	0	3	302.296	2.329	10	0		DEAEHN
C[C@H](NC[C@@H]1COCCN1C)c1sccc1Br	ZINC000624173044	365318813	/nfs/dbraw/zinc/31/88/13/365318813.db2.gz	ZKMZRSUHAUYSKW-VHSXEESVSA-N	0	3	319.268	2.492	10	0		DEAEHN
C=Cn1cc(CN(C)C2CCN(CC(F)(F)F)CC2)cn1	ZINC000449761477	241048711	/nfs/dbraw/zinc/04/87/11/241048711.db2.gz	XXOXHXXWCOOBQE-UHFFFAOYSA-N	0	3	302.344	2.442	10	0		DEAEHN
CCOc1ccccc1CN1CCN(CC[C@@H](C)O)[C@H](C)C1	ZINC000450907598	242380109	/nfs/dbraw/zinc/38/01/09/242380109.db2.gz	KXLDGVNTXNUGIN-HZPDHXFCSA-N	0	3	306.450	2.362	10	0		DEAEHN
CCCCN(C)S(=O)(=O)c1ccc(CNCC)cc1F	ZINC000092115512	193163178	/nfs/dbraw/zinc/16/31/78/193163178.db2.gz	NUFUQTRWLOBKIS-UHFFFAOYSA-N	0	3	302.415	2.356	10	0		DEAEHN
CC(C)[NH2+]Cc1ccc(S(=O)(=O)[N-][C@H]2C[C@H]2C)c(F)c1	ZINC000092116071	193164608	/nfs/dbraw/zinc/16/46/08/193164608.db2.gz	LHDXKYQOLRIVLY-MFKMUULPSA-N	0	3	300.399	2.010	10	0		DEAEHN
C[C@@H]1CCN(S(=O)(=O)c2ccc(CNC3CC3)cc2F)C1	ZINC000092115863	193164706	/nfs/dbraw/zinc/16/47/06/193164706.db2.gz	PHXNGFYBSBUSAH-LLVKDONJSA-N	0	3	312.410	2.108	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)CN[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)cc1	ZINC000528760184	284003032	/nfs/dbraw/zinc/00/30/32/284003032.db2.gz	WODNKDHWNTWBQD-XPZRHXQJSA-N	0	3	304.390	2.229	10	0		DEAEHN
c1cc(CN[C@H]2CCO[C@]3(CCOC3)C2)n(CC2CCC2)n1	ZINC000631105916	368019213	/nfs/dbraw/zinc/01/92/13/368019213.db2.gz	PGKHQPXCMPWSSP-DOTOQJQBSA-N	0	3	305.422	2.111	10	0		DEAEHN
[O-]c1cccc(C[NH2+]CC[C@@H](O)C(F)F)c1Br	ZINC000631216123	368085275	/nfs/dbraw/zinc/08/52/75/368085275.db2.gz	KGACUVFYZXQVKH-SECBINFHSA-N	0	3	310.138	2.260	10	0		DEAEHN
CO[C@@]1(C)C[C@@H](NCC(=O)Nc2ccc3c(c2)OCO3)C1(C)C	ZINC000451488785	243022227	/nfs/dbraw/zinc/02/22/27/243022227.db2.gz	NAUXMJBDRYHZPB-PBHICJAKSA-N	0	3	320.389	2.147	10	0		DEAEHN
Cc1ccc([C@H]2CCCC[N@@H+]2CCCOC(=O)N=C(N)[O-])o1	ZINC000093175957	193211667	/nfs/dbraw/zinc/21/16/67/193211667.db2.gz	MHPXEZPJTWWUGI-GFCCVEGCSA-N	0	3	309.366	2.310	10	0		DEAEHN
Cc1ccc([C@H]2CCCC[N@H+]2CCCOC(=O)N=C(N)[O-])o1	ZINC000093175957	193211668	/nfs/dbraw/zinc/21/16/68/193211668.db2.gz	MHPXEZPJTWWUGI-GFCCVEGCSA-N	0	3	309.366	2.310	10	0		DEAEHN
CN[C@H](Cc1cc(F)ccc1Br)C(OC)OC	ZINC000093304834	193227418	/nfs/dbraw/zinc/22/74/18/193227418.db2.gz	JJWLVFLLCQETON-LLVKDONJSA-N	0	3	306.175	2.338	10	0		DEAEHN
CN1CCC(NC(=O)c2sc3cccc(F)c3c2N)CC1	ZINC000093411968	193246083	/nfs/dbraw/zinc/24/60/83/193246083.db2.gz	OTTBIRFIKRIDOT-UHFFFAOYSA-N	0	3	307.394	2.447	10	0		DEAEHN
CC[NH2+][C@]1(C(=O)[O-])CCC[C@H]1CCN(C)CCC(F)(F)F	ZINC000093596071	193271048	/nfs/dbraw/zinc/27/10/48/193271048.db2.gz	ATNXNSYUBZAUKN-WCQYABFASA-N	0	3	310.360	2.494	10	0		DEAEHN
NC(=O)[C@]1(N)CCC[C@@H]1CCSc1cc(F)ccc1F	ZINC000093629595	193276785	/nfs/dbraw/zinc/27/67/85/193276785.db2.gz	CEOKZPRFLFASDL-OTYXRUKQSA-N	0	3	300.374	2.430	10	0		DEAEHN
C[C@]1(c2nc3cc(F)c(Br)cc3[nH]2)COC[C@H]1N	ZINC000093728891	193299042	/nfs/dbraw/zinc/29/90/42/193299042.db2.gz	GXPBDZPXMYQXRM-PWSUYJOCSA-N	0	3	314.158	2.080	10	0		DEAEHN
CC1(C)C([NH3+])C(C)(C)C1[N-]S(=O)(=O)c1ccc(F)cc1F	ZINC000094006523	193338602	/nfs/dbraw/zinc/33/86/02/193338602.db2.gz	KSOOGDIEBPWFFA-UHFFFAOYSA-N	0	3	318.389	2.005	10	0		DEAEHN
CCC[NH2+][C@]1(C(=O)[O-])CC[C@@H](N(CCOC)[C@@H](C)CC)C1	ZINC000093827664	193313139	/nfs/dbraw/zinc/31/31/39/193313139.db2.gz	YYCGAZNTZHUVDR-SQWLQELKSA-N	0	3	300.443	2.109	10	0		DEAEHN
CCOC[C@H]1CCN(Cc2cc(OC)c3c(c2)OCCO3)C1	ZINC000093838853	193314605	/nfs/dbraw/zinc/31/46/05/193314605.db2.gz	ARYAURAUOUNITE-ZDUSSCGKSA-N	0	3	307.390	2.325	10	0		DEAEHN
CCN[C@@]1(C(N)=O)CC[C@@H](Sc2nc3ccccc3o2)C1	ZINC000093850872	193319168	/nfs/dbraw/zinc/31/91/68/193319168.db2.gz	ARWSKPXZFKUNCV-BMIGLBTASA-N	0	3	305.403	2.306	10	0		DEAEHN
CN1CCC[C@H](Nc2nc(C(F)(F)F)ccc2C(N)=S)C1	ZINC000094336013	193360408	/nfs/dbraw/zinc/36/04/08/193360408.db2.gz	VPCKYFVOZNKTNQ-QMMMGPOBSA-N	0	3	318.368	2.241	10	0		DEAEHN
CN[C@H](c1ccc(F)c(Br)c1)[C@@H]1COCCO1	ZINC000094096375	193344764	/nfs/dbraw/zinc/34/47/64/193344764.db2.gz	NPZDHTVEPPURPK-NWDGAFQWSA-N	0	3	304.159	2.264	10	0		DEAEHN
CN[C@@H](c1ccc(F)c(Br)c1)[C@H]1COCCO1	ZINC000094096377	193344965	/nfs/dbraw/zinc/34/49/65/193344965.db2.gz	NPZDHTVEPPURPK-NEPJUHHUSA-N	0	3	304.159	2.264	10	0		DEAEHN
CCC(N)(CC)c1nc(-c2ccc(S(C)(=O)=O)cc2)c[nH]1	ZINC000094246091	193354470	/nfs/dbraw/zinc/35/44/70/193354470.db2.gz	IJBNXYJPXFQSCW-UHFFFAOYSA-N	0	3	307.419	2.454	10	0		DEAEHN
CCCN[C@H](c1ccn(C)n1)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094642594	193389215	/nfs/dbraw/zinc/38/92/15/193389215.db2.gz	PKEACHOWXMYBHN-YDHLFZDLSA-N	0	3	313.467	2.064	10	0		DEAEHN
CC[C@H](N)c1c(C)nn([C@H]2CCC[C@H](S(C)(=O)=O)C2)c1C	ZINC000094643963	193389416	/nfs/dbraw/zinc/38/94/16/193389416.db2.gz	NDEDJLQQHHSTJY-IHRRRGAJSA-N	0	3	313.467	2.438	10	0		DEAEHN
N[C@@H]1COC[C@@H]1C(=O)Nc1ccc(Cl)c(Br)c1	ZINC000094670425	193390729	/nfs/dbraw/zinc/39/07/29/193390729.db2.gz	FGYDPMAZCUCEQA-OIBJUYFYSA-N	0	3	319.586	2.015	10	0		DEAEHN
NC(=S)c1ccc(F)c(CN2CCN3CCCC[C@@H]3C2)c1	ZINC000094439533	193369353	/nfs/dbraw/zinc/36/93/53/193369353.db2.gz	UDFFPMZYAAOIBQ-CQSZACIVSA-N	0	3	307.438	2.130	10	0		DEAEHN
CN(CCN1CCCC1)c1nc(Br)cn2ccnc12	ZINC000094491006	193373748	/nfs/dbraw/zinc/37/37/48/193373748.db2.gz	BGGBPJAXCPDVCJ-UHFFFAOYSA-N	0	3	324.226	2.024	10	0		DEAEHN
CCN1CCC[C@@H]1CNc1nc2ccc(Br)cn2n1	ZINC000094602683	193384148	/nfs/dbraw/zinc/38/41/48/193384148.db2.gz	JCCZXDUPNQUKHX-LLVKDONJSA-N	0	3	324.226	2.388	10	0		DEAEHN
Cc1nn(C)c(C)c1CNC[C@H](C)N(C)C(=O)OC(C)(C)C	ZINC000282629473	217137227	/nfs/dbraw/zinc/13/72/27/217137227.db2.gz	GEGUEDXDYYERBJ-NSHDSACASA-N	0	3	310.442	2.382	10	0		DEAEHN
CC[C@@H](CO)N1CCN(c2ncnc3cc(Cl)ccc32)CC1	ZINC000266230630	205202619	/nfs/dbraw/zinc/20/26/19/205202619.db2.gz	UIBCFUCITYBEOB-ZDUSSCGKSA-N	0	3	320.824	2.176	10	0		DEAEHN
O=S(=O)([N-]c1cccc(OC(F)(F)F)c1)[C@@H]1CCC[NH2+]C1	ZINC000019995091	182175247	/nfs/dbraw/zinc/17/52/47/182175247.db2.gz	XGPWEFYLXJKVBV-LLVKDONJSA-N	0	3	324.324	2.079	10	0		DEAEHN
O=S(=O)(Nc1cccc(OC(F)(F)F)c1)[C@@H]1CCCNC1	ZINC000019995091	182175249	/nfs/dbraw/zinc/17/52/49/182175249.db2.gz	XGPWEFYLXJKVBV-LLVKDONJSA-N	0	3	324.324	2.079	10	0		DEAEHN
Cc1ccc(CNS(=O)(=O)c2ccc(F)c(CN)c2)cc1	ZINC000020189127	182195488	/nfs/dbraw/zinc/19/54/88/182195488.db2.gz	XNXLRVXFXUFHOJ-UHFFFAOYSA-N	0	3	308.378	2.071	10	0		DEAEHN
CC(C)OCCNCc1cnc2cnc(Br)cn12	ZINC000160042038	197382215	/nfs/dbraw/zinc/38/22/15/197382215.db2.gz	JMTJTWPRDRESRB-UHFFFAOYSA-N	0	3	313.199	2.006	10	0		DEAEHN
O=C(Nc1cc(Cl)c(Cl)cc1Cl)[C@@H]1C[C@H](O)CN1	ZINC000020434012	182216978	/nfs/dbraw/zinc/21/69/78/182216978.db2.gz	RAUWLOXWBXFHFD-RRAGMBSWSA-N	0	3	309.580	2.308	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1ccc(Br)c(F)c1	ZINC000159977589	197377981	/nfs/dbraw/zinc/37/79/81/197377981.db2.gz	SEARGINSCHJENE-NSHDSACASA-N	0	3	319.174	2.281	10	0		DEAEHN
COc1cc(Br)cc(CNC(C)(C)CO)c1OC	ZINC000020933640	182255087	/nfs/dbraw/zinc/25/50/87/182255087.db2.gz	YNAYUAOJMDAKJE-UHFFFAOYSA-N	0	3	318.211	2.327	10	0		DEAEHN
CCCn1cc(Br)cc1C(=O)NC[C@H](C)N(C)C	ZINC000038089369	182988130	/nfs/dbraw/zinc/98/81/30/182988130.db2.gz	PAOJKQQRERCSMG-JTQLQIEISA-N	0	3	316.243	2.341	10	0		DEAEHN
COc1ccc([C@H](NCC(C)C)C(N)=O)cc1Br	ZINC000038052296	182982715	/nfs/dbraw/zinc/98/27/15/182982715.db2.gz	RBLINXNPBOGIKU-LBPRGKRZSA-N	0	3	315.211	2.230	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)[C@H]1CCCO1)c1ccc(OC)cc1	ZINC000040614860	183108594	/nfs/dbraw/zinc/10/85/94/183108594.db2.gz	VKPGRWIDFKDRPM-IAGOWNOFSA-N	0	3	320.433	2.373	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2ccc(Br)c(C)c2)C1	ZINC000040630124	183110866	/nfs/dbraw/zinc/11/08/66/183110866.db2.gz	RFYJZWZTFPZQRK-JQWIXIFHSA-N	0	3	313.195	2.073	10	0		DEAEHN
COC(=O)c1c2c(sc1NC(=O)[C@@H](N)C(C)C)CCCC2	ZINC000040856020	183143341	/nfs/dbraw/zinc/14/33/41/183143341.db2.gz	QSXMQVAIQROHDC-LBPRGKRZSA-N	0	3	310.419	2.335	10	0		DEAEHN
COc1cc(CN2CCC[C@H]([NH3+])C2)cc(Br)c1[O-]	ZINC000041027548	183157347	/nfs/dbraw/zinc/15/73/47/183157347.db2.gz	JEJAUZSISJQWEZ-JTQLQIEISA-N	0	3	315.211	2.086	10	0		DEAEHN
CCOC(=O)COC[C@@H](N)c1ccc(OC(F)(F)F)cc1	ZINC000041071903	183163373	/nfs/dbraw/zinc/16/33/73/183163373.db2.gz	MTTWKAKRNYSRNU-LLVKDONJSA-N	0	3	307.268	2.165	10	0		DEAEHN
COC(=O)CCCOc1c(Br)cccc1CN	ZINC000042411417	183265447	/nfs/dbraw/zinc/26/54/47/183265447.db2.gz	YVGVVRYBKGXYDC-UHFFFAOYSA-N	0	3	302.168	2.240	10	0		DEAEHN
CCNCc1cccc(Br)c1O[C@H](C)C(=O)NC	ZINC000042411648	183265994	/nfs/dbraw/zinc/26/59/94/183265994.db2.gz	JOYCFVZQBAUUQH-SECBINFHSA-N	0	3	315.211	2.072	10	0		DEAEHN
CCNC(=O)CN(CC)c1ccc(C(F)(F)F)cc1CN	ZINC000042367111	183260007	/nfs/dbraw/zinc/26/00/07/183260007.db2.gz	AVZUTDMZYDQMTA-UHFFFAOYSA-N	0	3	303.328	2.127	10	0		DEAEHN
C[C@H](N)[C@H](c1ccc(Cl)s1)N1CCC(CC(N)=O)CC1	ZINC000043253806	183347941	/nfs/dbraw/zinc/34/79/41/183347941.db2.gz	JGILHOOHGFCPBL-LKFCYVNXSA-N	0	3	315.870	2.377	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccc(Cl)s1)N(C)CC(=O)N1CCCC1	ZINC000043253440	183348276	/nfs/dbraw/zinc/34/82/76/183348276.db2.gz	WCGXNWCUWRRZIW-YGRLFVJLSA-N	0	3	315.870	2.344	10	0		DEAEHN
CCCNC(=O)CN(C)[C@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043253534	183348325	/nfs/dbraw/zinc/34/83/25/183348325.db2.gz	VNDFMIUHZFVTCR-RNCFNFMXSA-N	0	3	303.859	2.248	10	0		DEAEHN
CC(C)CN(CC(N)=O)[C@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043254173	183348361	/nfs/dbraw/zinc/34/83/61/183348361.db2.gz	WAGYRESECDJENC-RNCFNFMXSA-N	0	3	303.859	2.233	10	0		DEAEHN
CN[C@@H](c1ccc(C(F)(F)F)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000043300512	183352053	/nfs/dbraw/zinc/35/20/53/183352053.db2.gz	UHZAGXBXDXEPGJ-PWSUYJOCSA-N	0	3	307.337	2.401	10	0		DEAEHN
CN[C@@H](c1cccc(Br)c1)[C@H]1CCS(=O)(=O)C1	ZINC000043300589	183352308	/nfs/dbraw/zinc/35/23/08/183352308.db2.gz	SRQFIDCGFGIHCR-JQWIXIFHSA-N	0	3	318.236	2.144	10	0		DEAEHN
CN[C@H](c1ccccc1OC(F)(F)F)[C@@H]1CCS(=O)(=O)C1	ZINC000043300630	183352707	/nfs/dbraw/zinc/35/27/07/183352707.db2.gz	BNFHYUBZMDNYNK-SKDRFNHKSA-N	0	3	323.336	2.280	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000043066829	183333798	/nfs/dbraw/zinc/33/37/98/183333798.db2.gz	NMWQUOMXHYVWHL-AWEZNQCLSA-N	0	3	307.438	2.471	10	0		DEAEHN
CNCc1cccc(Br)c1O[C@@H](C)C(=O)OC	ZINC000043641287	183376615	/nfs/dbraw/zinc/37/66/15/183376615.db2.gz	ZKMHBFRSALTXHZ-QMMMGPOBSA-N	0	3	302.168	2.109	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)Nc2ccc(F)c(F)c2)c1	ZINC000105881474	194156141	/nfs/dbraw/zinc/15/61/41/194156141.db2.gz	BTMWEFNVDUYESJ-NSHDSACASA-N	0	3	308.332	2.087	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cscc2Br)C1	ZINC000285316578	218378817	/nfs/dbraw/zinc/37/88/17/218378817.db2.gz	MMRMJSORFYZLNS-QMMMGPOBSA-N	0	3	303.225	2.287	10	0		DEAEHN
c1nc(-c2ccncc2)sc1CNCCOC[C@H]1CCCO1	ZINC000553473228	291743565	/nfs/dbraw/zinc/74/35/65/291743565.db2.gz	DPWBYGVNLMRNGF-CQSZACIVSA-N	0	3	319.430	2.490	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2ccc(C)c(Br)c2)C1	ZINC000109436563	194263309	/nfs/dbraw/zinc/26/33/09/194263309.db2.gz	ONSKYZZSVLGXBM-ZYHUDNBSSA-N	0	3	313.195	2.073	10	0		DEAEHN
NC(=S)CN1CCN(c2ccnc3cc(Cl)ccc32)CC1	ZINC000109442963	194263387	/nfs/dbraw/zinc/26/33/87/194263387.db2.gz	VZPMRCMSTVRKCJ-UHFFFAOYSA-N	0	3	320.849	2.296	10	0		DEAEHN
CCN([C@@H]1CCCNC1)S(=O)(=O)c1ccc(Cl)cc1C	ZINC000110941599	194372686	/nfs/dbraw/zinc/37/26/86/194372686.db2.gz	GYTRAOPWPJYFOP-CYBMUJFWSA-N	0	3	316.854	2.411	10	0		DEAEHN
CN[C@](C)(CCSc1cccc(Br)c1)C(N)=O	ZINC000055309551	183978709	/nfs/dbraw/zinc/97/87/09/183978709.db2.gz	FESIIKVSOOOXGX-GFCCVEGCSA-N	0	3	317.252	2.395	10	0		DEAEHN
CN[C@@](C)(CSc1cccc(Br)c1)C(N)=O	ZINC000055309545	183978808	/nfs/dbraw/zinc/97/88/08/183978808.db2.gz	RIZZNNZAIPGDAP-NSHDSACASA-N	0	3	303.225	2.005	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)CCc2ccc(F)cc2)C1	ZINC000056752798	184018943	/nfs/dbraw/zinc/01/89/43/184018943.db2.gz	KAGUOOFOOUPXBH-INIZCTEOSA-N	0	3	307.413	2.494	10	0		DEAEHN
O=C1NCCC[C@H]1N[C@H]1CCc2ccc(Br)cc21	ZINC000336785205	284886220	/nfs/dbraw/zinc/88/62/20/284886220.db2.gz	BVGATEDQXDNQQI-QWHCGFSZSA-N	0	3	309.207	2.305	10	0		DEAEHN
Cc1ccc2[nH]c(SC[C@@](C)(NC(C)C)C(N)=O)nc2c1	ZINC000061440845	184171053	/nfs/dbraw/zinc/17/10/53/184171053.db2.gz	AJPMYAWKZAYPOB-OAHLLOKOSA-N	0	3	306.435	2.205	10	0		DEAEHN
Cc1ccc2nc(SC[C@@](C)(NC(C)C)C(N)=O)[nH]c2c1	ZINC000061440845	184171055	/nfs/dbraw/zinc/17/10/55/184171055.db2.gz	AJPMYAWKZAYPOB-OAHLLOKOSA-N	0	3	306.435	2.205	10	0		DEAEHN
CCCOc1nc(Cl)nc(N[C@H](CN(C)C)C(C)C)n1	ZINC000061539286	184173693	/nfs/dbraw/zinc/17/36/93/184173693.db2.gz	AXGXYIIYVJWHRA-SNVBAGLBSA-N	0	3	301.822	2.312	10	0		DEAEHN
C[C@@H](CC(N)=O)C[C@@H](N)c1cc2c(cc1Cl)OCCCO2	ZINC000061830314	184188952	/nfs/dbraw/zinc/18/89/52/184188952.db2.gz	LXGLRGVYGQQIFM-BXKDBHETSA-N	0	3	312.797	2.403	10	0		DEAEHN
Cc1ccc(C)c(S(=O)(=O)NCc2ccccc2CN)c1	ZINC000061841260	184189179	/nfs/dbraw/zinc/18/91/79/184189179.db2.gz	UGHUPGQDWUOYKV-UHFFFAOYSA-N	0	3	304.415	2.241	10	0		DEAEHN
Nc1ccc(Cl)cc1NC(=O)CCCN1CCCOCC1	ZINC000061913843	184195171	/nfs/dbraw/zinc/19/51/71/184195171.db2.gz	PWXGUKDMDMHPAN-UHFFFAOYSA-N	0	3	311.813	2.363	10	0		DEAEHN
COc1ccc(Br)cc1C[C@@]1(O)CCN(C)C1	ZINC000061986831	184200076	/nfs/dbraw/zinc/20/00/76/184200076.db2.gz	QSVXXJUXTIQHFA-ZDUSSCGKSA-N	0	3	300.196	2.067	10	0		DEAEHN
CN[C@H](CCSc1ccccc1Br)C(N)=O	ZINC000062597131	184244751	/nfs/dbraw/zinc/24/47/51/184244751.db2.gz	KZTAQUXREDLOAL-SECBINFHSA-N	0	3	303.225	2.005	10	0		DEAEHN
CCCNc1cc(C(=O)N2CC[C@H](N(C)C)C2)cc(Cl)n1	ZINC000062984772	184265166	/nfs/dbraw/zinc/26/51/66/184265166.db2.gz	PDUGEJVRNXABFN-LBPRGKRZSA-N	0	3	310.829	2.333	10	0		DEAEHN
NC(=O)c1ccccc1NC(=O)CNCCC1=CCCCC1	ZINC000066214347	184397308	/nfs/dbraw/zinc/39/73/08/184397308.db2.gz	SPMDNPWWRCCUEP-UHFFFAOYSA-N	0	3	301.390	2.204	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCO[C@H](c3cccs3)C2)C1	ZINC000119960118	195070184	/nfs/dbraw/zinc/07/01/84/195070184.db2.gz	BMPNIOUUHAHZMO-KBPBESRZSA-N	0	3	323.462	2.315	10	0		DEAEHN
N[C@@H](CS(=O)(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1CCOC1	ZINC000159121013	197329555	/nfs/dbraw/zinc/32/95/55/197329555.db2.gz	WRGAHRXXGAWHOL-PELKAZGASA-N	0	3	324.229	2.131	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC2CCC2)cc(CNC(C)C)c1F	ZINC000159106597	197327413	/nfs/dbraw/zinc/32/74/13/197327413.db2.gz	GLOWQKZKYAXZGV-UHFFFAOYSA-N	0	3	314.426	2.463	10	0		DEAEHN
CC[C@H]1CCC[NH2+][C@H]1C[N-]S(=O)(=O)c1ccc(F)cc1F	ZINC000158999037	197318326	/nfs/dbraw/zinc/31/83/26/197318326.db2.gz	YNIPKEIWVQGVNJ-GWCFXTLKSA-N	0	3	318.389	2.021	10	0		DEAEHN
O=C1NCCCC[C@H]1N1CCC(Nc2ccccc2F)CC1	ZINC000120233390	195124077	/nfs/dbraw/zinc/12/40/77/195124077.db2.gz	PUEGCYUODPKSKD-MRXNPFEDSA-N	0	3	305.397	2.371	10	0		DEAEHN
CCN[C@@H](CS(=O)(=O)c1cc(C)ccc1C)[C@@H]1CCOC1	ZINC000158734007	197297114	/nfs/dbraw/zinc/29/71/14/197297114.db2.gz	BCPRLACFAZLSEP-CABCVRRESA-N	0	3	311.447	2.092	10	0		DEAEHN
CCn1ncc(Br)c1[C@H](C[C@@H]1CCCO1)NC	ZINC000158642472	197290535	/nfs/dbraw/zinc/29/05/35/197290535.db2.gz	CCLYVZPKIDGKAX-ONGXEEELSA-N	0	3	302.216	2.495	10	0		DEAEHN
Cc1ccc(C(=O)CCN2CCC(C(=O)N(C)C)CC2)cc1	ZINC000158381345	197267474	/nfs/dbraw/zinc/26/74/74/197267474.db2.gz	IMMMTHFAYXAYPC-UHFFFAOYSA-N	0	3	302.418	2.368	10	0		DEAEHN
CC(C)(C)[C@@H](N)C(=O)N[C@@H]1CCC[C@@H](OCC(F)(F)F)C1	ZINC000158238122	197256525	/nfs/dbraw/zinc/25/65/25/197256525.db2.gz	XGBRDLBRKKFTNB-MXWKQRLJSA-N	0	3	310.360	2.366	10	0		DEAEHN
CC[C@](C)([C@@H](O)c1c(Br)cnn1C)N1CCCC1	ZINC000157632265	197203516	/nfs/dbraw/zinc/20/35/16/197203516.db2.gz	SDQYLOMSJZSENV-QWHCGFSZSA-N	0	3	316.243	2.481	10	0		DEAEHN
CNc1cc(N2C[C@H]3CCCCN3C[C@@H]2C)nc(SC)n1	ZINC000157388933	197183664	/nfs/dbraw/zinc/18/36/64/197183664.db2.gz	CJVSQWSBLYJLCD-NWDGAFQWSA-N	0	3	307.467	2.303	10	0		DEAEHN
CCCNc1nc(Cl)nc(N2C[C@H]3CCCN3C[C@@H]2C)n1	ZINC000157400023	197184468	/nfs/dbraw/zinc/18/44/68/197184468.db2.gz	GHDDODJCBPIOQU-WDEREUQCSA-N	0	3	310.833	2.020	10	0		DEAEHN
CC[C@@H](N)c1cccc(S(=O)(=O)N(C)CCOC(C)C)c1	ZINC000157293665	197177211	/nfs/dbraw/zinc/17/72/11/197177211.db2.gz	GFIOMXGBHHNEHU-OAHLLOKOSA-N	0	3	314.451	2.142	10	0		DEAEHN
CSc1nsc(NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)n1	ZINC000157077515	197160393	/nfs/dbraw/zinc/16/03/93/197160393.db2.gz	ORFIRFDLPIEFLO-RKDXNWHRSA-N	0	3	315.468	2.206	10	0		DEAEHN
C[C@@](O)(Cc1ccccc1Br)C[C@H]1COCCN1	ZINC000156803073	197142511	/nfs/dbraw/zinc/14/25/11/197142511.db2.gz	MOLLLXGQRMEHAS-GXTWGEPZSA-N	0	3	314.223	2.121	10	0		DEAEHN
CC(C)C[C@H](C[NH+](C)C)NC(=O)NCc1ccc([O-])c(F)c1	ZINC000156763489	197138749	/nfs/dbraw/zinc/13/87/49/197138749.db2.gz	XZXJVRNHOVSBTE-CYBMUJFWSA-N	0	3	311.401	2.307	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)NCCN1CCCC[C@H]1C	ZINC000187819379	533145499	/nfs/dbraw/zinc/14/54/99/533145499.db2.gz	NUGAGYZWHXFKDV-KGLIPLIRSA-N	0	3	320.437	2.325	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCC(C)(C)[C@@H](O)C(C)C	ZINC000156148982	197089822	/nfs/dbraw/zinc/08/98/22/197089822.db2.gz	SOOLDUARFSIPBT-CABCVRRESA-N	0	3	315.502	2.305	10	0		DEAEHN
C[C@H](C(=O)Nc1ccccc1CN)[S@@](=O)c1cccs1	ZINC000155970954	197077905	/nfs/dbraw/zinc/07/79/05/197077905.db2.gz	WWWZUHBMIRATLO-SBKAZYGRSA-N	0	3	308.428	2.342	10	0		DEAEHN
Cc1ccc(CN2CC[C@@H]3C[C@@H](C(=O)N(C)C)O[C@@H]3C2)cc1	ZINC000248006317	257112000	/nfs/dbraw/zinc/11/20/00/257112000.db2.gz	OPYWWESFLLSLCI-IXDOHACOSA-N	0	3	302.418	2.063	10	0		DEAEHN
O=C(CC1CCCC1)N1C[C@H]2CN(CC3CC3)CCO[C@H]2C1	ZINC000247807017	257118128	/nfs/dbraw/zinc/11/81/28/257118128.db2.gz	BWINHHVYZLYGKW-SJORKVTESA-N	0	3	306.450	2.136	10	0		DEAEHN
CC[C@H]1CN(Cc2cccc(OC)c2OC)CCN1CCOC	ZINC000120945477	195268758	/nfs/dbraw/zinc/26/87/58/195268758.db2.gz	JDSFUWAFYBWQBK-INIZCTEOSA-N	0	3	322.449	2.246	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N(C[C@@H]1CCOC1)C1CC1	ZINC000121641240	195321814	/nfs/dbraw/zinc/32/18/14/195321814.db2.gz	GQLUEDDTYQSCSQ-GJZGRUSLSA-N	0	3	311.470	2.173	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C)c1	ZINC000121812696	195352339	/nfs/dbraw/zinc/35/23/39/195352339.db2.gz	NYLJVPKOWADFAN-OAHLLOKOSA-N	0	3	305.422	2.026	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@H](C)C(=O)N2CC2CCN(C)CC2)s1	ZINC000121980535	195385710	/nfs/dbraw/zinc/38/57/10/195385710.db2.gz	RCBGJNIICKPJJM-IUODEOHRSA-N	0	3	307.463	2.217	10	0		DEAEHN
CCN(C)c1ccc(CNCCc2cccc(OC)n2)cn1	ZINC000359771467	133143768	/nfs/dbraw/zinc/14/37/68/133143768.db2.gz	XHYULQZLFAPBJA-UHFFFAOYSA-N	0	3	300.406	2.274	10	0		DEAEHN
CN(CC1CCN(C)CC1)C(=O)NCc1ccc2cc[nH]c2n1	ZINC000360506102	133186256	/nfs/dbraw/zinc/18/62/56/133186256.db2.gz	YBWVAEMPYPMFPF-UHFFFAOYSA-N	0	3	315.421	2.046	10	0		DEAEHN
CC(=O)c1cc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(C)nc1C	ZINC000362761134	133249806	/nfs/dbraw/zinc/24/98/06/133249806.db2.gz	VPSXILKFKCHSMN-XHDPSFHLSA-N	0	3	317.433	2.456	10	0		DEAEHN
CC(=O)c1cc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c(C)nc1C	ZINC000362761132	133249924	/nfs/dbraw/zinc/24/99/24/133249924.db2.gz	VPSXILKFKCHSMN-IAQYHMDHSA-N	0	3	317.433	2.456	10	0		DEAEHN
Cc1cnc(C)c(N2CCC(N3CCN(C(C)C)CC3)CC2)n1	ZINC000368117233	133260796	/nfs/dbraw/zinc/26/07/96/133260796.db2.gz	FMWNVZZUPDAEHG-UHFFFAOYSA-N	0	3	317.481	2.088	10	0		DEAEHN
O=C(c1cccc(CN2CCCC2)c1)N1CC([C@H]2CCOC2)C1	ZINC000377060748	133317033	/nfs/dbraw/zinc/31/70/33/133317033.db2.gz	HWRJVSGHRWWSOT-KRWDZBQOSA-N	0	3	314.429	2.391	10	0		DEAEHN
c1sc(-c2ccccn2)nc1CN1CCN2CCC1CC2	ZINC000377385754	133328044	/nfs/dbraw/zinc/32/80/44/133328044.db2.gz	IYCUSDLJEZTKAI-UHFFFAOYSA-N	0	3	300.431	2.485	10	0		DEAEHN
O=[S@](C[C@@H]1CCCCN1)c1cccc(Br)n1	ZINC000095092393	296523024	/nfs/dbraw/zinc/52/30/24/296523024.db2.gz	MMLIHXRXBDAPCP-FVMDXXJSSA-N	0	3	303.225	2.094	10	0		DEAEHN
Cc1ccc(C2(C(=O)N3CC[C@H](N(C)C)C3)CCOCC2)cc1	ZINC000110702320	292089634	/nfs/dbraw/zinc/08/96/34/292089634.db2.gz	ZIRLYKUUQAQRSM-KRWDZBQOSA-N	0	3	316.445	2.206	10	0		DEAEHN
O=C(CCc1cnn(-c2ccccc2)c1)N1CCN2CCC1CC2	ZINC000188646451	145015159	/nfs/dbraw/zinc/01/51/59/145015159.db2.gz	OXOVROGWJQUZIK-UHFFFAOYSA-N	0	3	324.428	2.112	10	0		DEAEHN
O=C(NCc1ccc(Oc2ccccc2)nc1)[C@H]1C[C@H](F)CN1	ZINC000188752119	145016908	/nfs/dbraw/zinc/01/69/08/145016908.db2.gz	FQBNZSUBVKBQJQ-DZGCQCFKSA-N	0	3	315.348	2.190	10	0		DEAEHN
O=C(COc1ccc(F)cc1)NCc1ccc2c(c1)CNC2	ZINC000188764366	145017149	/nfs/dbraw/zinc/01/71/49/145017149.db2.gz	MKTZKPOLYYTUDI-UHFFFAOYSA-N	0	3	300.333	2.124	10	0		DEAEHN
CCC[C@@H](C(=O)OCC)N1CCC(c2nnc(CC)[nH]2)CC1	ZINC000190679738	145046494	/nfs/dbraw/zinc/04/64/94/145046494.db2.gz	AMNLOYSDWNZNHJ-ZDUSSCGKSA-N	0	3	308.426	2.278	10	0		DEAEHN
COCCN1CCC[C@H]1CNCc1nccn1-c1ccccc1	ZINC000190944132	145050704	/nfs/dbraw/zinc/05/07/04/145050704.db2.gz	IJSPVSPVCCXCBW-KRWDZBQOSA-N	0	3	314.433	2.073	10	0		DEAEHN
CCCOc1nc(C)ccc1C(=O)NC[C@H](C)N(C)C1CC1	ZINC000191149105	145053755	/nfs/dbraw/zinc/05/37/55/145053755.db2.gz	MPGFUALUNCYNRR-ZDUSSCGKSA-N	0	3	305.422	2.391	10	0		DEAEHN
c1cc(OCC2CC2)ccc1CN1CC[C@H](N2CCOCC2)C1	ZINC000191255676	145054764	/nfs/dbraw/zinc/05/47/64/145054764.db2.gz	QGCHTTDKPUJEJF-SFHVURJKSA-N	0	3	316.445	2.382	10	0		DEAEHN
CC[C@@H](CO)N1CCN(Cc2ccc(OCC3CC3)cc2)CC1	ZINC000191414427	145057978	/nfs/dbraw/zinc/05/79/78/145057978.db2.gz	FLDFVCBJZVAZJU-SFHVURJKSA-N	0	3	318.461	2.364	10	0		DEAEHN
COCc1ccc(NC(=O)[C@@H]2CCCN2C2CCOCC2)cc1	ZINC000193030429	145081455	/nfs/dbraw/zinc/08/14/55/145081455.db2.gz	FSMVUZKILJBCTO-KRWDZBQOSA-N	0	3	318.417	2.415	10	0		DEAEHN
CSCCC(=O)NCC1(N2CCSCC2)CCCC1	ZINC000193208327	145083759	/nfs/dbraw/zinc/08/37/59/145083759.db2.gz	UUJURGYIWYWUNV-UHFFFAOYSA-N	0	3	302.509	2.217	10	0		DEAEHN
C[C@H](C(=O)N(C)C)N1CCC[C@H]1C[C@H](O)c1ccc(F)cc1	ZINC000246273708	145096575	/nfs/dbraw/zinc/09/65/75/145096575.db2.gz	ALOJQFPOTUIABC-KCXAZCMYSA-N	0	3	308.397	2.190	10	0		DEAEHN
CCN(C(=O)[C@H](C)N1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000246304981	145098290	/nfs/dbraw/zinc/09/82/90/145098290.db2.gz	JJSPPBIOLGVUSG-RDJZCZTQSA-N	0	3	301.434	2.208	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCN(CC)C2)C12CCC2	ZINC000246336259	145099773	/nfs/dbraw/zinc/09/97/73/145099773.db2.gz	OQVFNNCIKYPKNP-RBSFLKMASA-N	0	3	309.454	2.118	10	0		DEAEHN
Cc1cc(S(=O)(=O)N[C@H]2CN(C(C)C)C[C@H]2C)ccc1F	ZINC000246494552	145104135	/nfs/dbraw/zinc/10/41/35/145104135.db2.gz	XJIJKOCGFHLKOG-DOMZBBRYSA-N	0	3	314.426	2.141	10	0		DEAEHN
Cn1c(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)nnc1C1CC1	ZINC000246532391	145105267	/nfs/dbraw/zinc/10/52/67/145105267.db2.gz	JMBZWOCHIFLMMB-HOCLYGCPSA-N	0	3	315.465	2.141	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCO[C@@H](c2ccsc2)C1	ZINC000246562409	145106632	/nfs/dbraw/zinc/10/66/32/145106632.db2.gz	KRJLVCCIPJCOGW-LSDHHAIUSA-N	0	3	323.462	2.315	10	0		DEAEHN
Cc1ccc([C@@H](O)CN2CCC[C@@H](Cn3ccnn3)C2)cc1	ZINC000246638000	145109337	/nfs/dbraw/zinc/10/93/37/145109337.db2.gz	JKBPTFIGXDOBOQ-WBVHZDCISA-N	0	3	300.406	2.032	10	0		DEAEHN
Cc1ccc(F)c(OCC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000246837438	145116407	/nfs/dbraw/zinc/11/64/07/145116407.db2.gz	ATHJNYNWIDWXBQ-KBPBESRZSA-N	0	3	308.397	2.454	10	0		DEAEHN
COC(=O)c1cccc(OCCN2CC[C@H]3OCCC[C@H]3C2)c1	ZINC000246925885	145119553	/nfs/dbraw/zinc/11/95/53/145119553.db2.gz	WJIOOXPBMBJDBE-DOTOQJQBSA-N	0	3	319.401	2.353	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)N3C[C@@H]4CCCN4C[C@H]3C)cc2)c1	ZINC000247066627	145125399	/nfs/dbraw/zinc/12/53/99/145125399.db2.gz	HKUKQUPTAHLDAL-QAPCUYQASA-N	0	3	324.428	2.489	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)[C@@H](C)N2CCN3CCC[C@H]3C2)c1	ZINC000247071698	145125777	/nfs/dbraw/zinc/12/57/77/145125777.db2.gz	GNMACHLQEXWEHN-CVEARBPZSA-N	0	3	301.434	2.410	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)NC[C@H]1CCCC[C@H]1O	ZINC000247204183	145128911	/nfs/dbraw/zinc/12/89/11/145128911.db2.gz	NBZWCXRDTINTBU-BZUAXINKSA-N	0	3	311.470	2.101	10	0		DEAEHN
Cc1csc([C@H](NC(=O)N2CCN3CCC[C@H]3C2)C2CC2)n1	ZINC000247230820	145129607	/nfs/dbraw/zinc/12/96/07/145129607.db2.gz	WYPNCUUZALVOQQ-UONOGXRCSA-N	0	3	320.462	2.392	10	0		DEAEHN
CC(C)(C)NC(=O)CN1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000247229957	145130097	/nfs/dbraw/zinc/13/00/97/145130097.db2.gz	DBVUSLRVJMBHAJ-JKSUJKDBSA-N	0	3	304.434	2.489	10	0		DEAEHN
CC(C)OC[C@H](O)CN1CCC[C@H]1C[C@H](O)c1cccs1	ZINC000247281547	145131518	/nfs/dbraw/zinc/13/15/18/145131518.db2.gz	XKMUMBJRMKHNGA-ZNMIVQPWSA-N	0	3	313.463	2.422	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@H](N[C@H]2Cc3ccccc3[C@H]2O)C1	ZINC000247356826	145134580	/nfs/dbraw/zinc/13/45/80/145134580.db2.gz	IMFMNSLGSKLTDQ-CWRNSKLLSA-N	0	3	318.417	2.244	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N2CCO[C@H](c3ccco3)C2)C1	ZINC000247486731	145139058	/nfs/dbraw/zinc/13/90/58/145139058.db2.gz	WORZEVZXSQIWKZ-FMKPAKJESA-N	0	3	321.421	2.091	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)C[C@H]2c3ccccc3NC2=O)CCN1C	ZINC000247537003	145140369	/nfs/dbraw/zinc/14/03/69/145140369.db2.gz	XTDORGBBFRFBGZ-NFAWXSAZSA-N	0	3	315.417	2.054	10	0		DEAEHN
CCOc1ccc(OCC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000247550768	145140930	/nfs/dbraw/zinc/14/09/30/145140930.db2.gz	YTQOCHDSQPPNFH-LSDHHAIUSA-N	0	3	320.433	2.405	10	0		DEAEHN
Cc1cc(C)n(CC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)n1	ZINC000248120500	145148571	/nfs/dbraw/zinc/14/85/71/145148571.db2.gz	UEFKTICFONUSDA-AEFFLSMTSA-N	0	3	312.417	2.062	10	0		DEAEHN
Cc1ccc(CC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cn1	ZINC000248144868	145149647	/nfs/dbraw/zinc/14/96/47/145149647.db2.gz	ZHKJDMDVVHJCCR-MJGOQNOKSA-N	0	3	309.413	2.494	10	0		DEAEHN
CN(CCN1CC[C@@](O)(C(F)(F)F)C1)Cc1ccc(F)cc1	ZINC000248558232	145158725	/nfs/dbraw/zinc/15/87/25/145158725.db2.gz	LTEKMSOLPJKOGK-AWEZNQCLSA-N	0	3	320.330	2.257	10	0		DEAEHN
C[C@@H](N[C@@H](C)C(=O)NC[C@@H](C)c1ccccc1)[C@@H]1CCCO1	ZINC000248862406	145171003	/nfs/dbraw/zinc/17/10/03/145171003.db2.gz	WHGWVCOTIXPIIR-AIANPOQGSA-N	0	3	304.434	2.452	10	0		DEAEHN
CC(=O)Nc1ccc(C)c(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000249078616	145177541	/nfs/dbraw/zinc/17/75/41/145177541.db2.gz	PASXRODKFRKWRZ-CJNGLKHVSA-N	0	3	315.417	2.262	10	0		DEAEHN
COc1ccc(S[C@@H](C)C(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000249839012	145191187	/nfs/dbraw/zinc/19/11/87/145191187.db2.gz	UXBFYWDTHXEREU-KBPBESRZSA-N	0	3	320.458	2.482	10	0		DEAEHN
CO[C@](C)(C(=O)N1C[C@H]2CCCN2C[C@H]1C)c1ccccc1F	ZINC000253335843	145201529	/nfs/dbraw/zinc/20/15/29/145201529.db2.gz	ASTYJHGGRBGPJB-LBTNJELSSA-N	0	3	320.408	2.382	10	0		DEAEHN
COc1ccccc1[C@@H]1CNCCN1Cc1nc(C2CC2)no1	ZINC000261681283	145216252	/nfs/dbraw/zinc/21/62/52/145216252.db2.gz	IKDHNYUEBBXZQL-AWEZNQCLSA-N	0	3	314.389	2.102	10	0		DEAEHN
c1nn(-c2ccccc2)cc1CN1CCNC[C@@H]1c1cccnc1	ZINC000261706561	145219204	/nfs/dbraw/zinc/21/92/04/145219204.db2.gz	KCGHOMMQPLCRRZ-LJQANCHMSA-N	0	3	319.412	2.414	10	0		DEAEHN
NC1(C(=O)Nc2ccc3nc(C4CC4)oc3c2)CCOCC1	ZINC000261799651	145227393	/nfs/dbraw/zinc/22/73/93/145227393.db2.gz	ITQMYZFAXFKJOH-UHFFFAOYSA-N	0	3	301.346	2.152	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)N[C@@H](C)C[C@H]2COCCN2)c1	ZINC000261822036	145230179	/nfs/dbraw/zinc/23/01/79/145230179.db2.gz	ASAQAJBUKBMMNN-IHRRRGAJSA-N	0	3	308.422	2.121	10	0		DEAEHN
Cc1ccc2nc(CN3CCNC[C@@H]3c3cccnc3)cn2c1	ZINC000261821697	145230568	/nfs/dbraw/zinc/23/05/68/145230568.db2.gz	SHAKYTRNEHNMMM-QGZVFWFLSA-N	0	3	307.401	2.184	10	0		DEAEHN
C[C@@H]1CCCN1C(=O)CCN1CCNC[C@H]1c1cccc(F)c1	ZINC000261829090	145231514	/nfs/dbraw/zinc/23/15/14/145231514.db2.gz	SUNKJJFFLQRJML-PBHICJAKSA-N	0	3	319.424	2.173	10	0		DEAEHN
C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)C1(N)CCOCC1	ZINC000261849489	145232941	/nfs/dbraw/zinc/23/29/41/145232941.db2.gz	MEYBBIOTEFMYAX-JSGCOSHPSA-N	0	3	306.381	2.038	10	0		DEAEHN
N[C@@H](C(=O)N1CCC(c2ccccc2)CC1)C1CCOCC1	ZINC000261923865	145242858	/nfs/dbraw/zinc/24/28/58/145242858.db2.gz	YZMFVOYATYSNIK-QGZVFWFLSA-N	0	3	302.418	2.147	10	0		DEAEHN
C[C@H](NC(=O)C1(N)CCOCC1)c1ncc(-c2ccccc2)o1	ZINC000261929973	145243229	/nfs/dbraw/zinc/24/32/29/145243229.db2.gz	WDDBEKRGNKDGRF-LBPRGKRZSA-N	0	3	315.373	2.027	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)N1Cc2ccccc2C1	ZINC000262544607	145292242	/nfs/dbraw/zinc/29/22/42/145292242.db2.gz	RPCQTKDBGKMILX-IIDMSEBBSA-N	0	3	300.402	2.061	10	0		DEAEHN
C[C@H](NC(=O)[C@@H]1NCCCC1(C)C)c1ccc2c(c1)OCO2	ZINC000262550206	145292264	/nfs/dbraw/zinc/29/22/64/145292264.db2.gz	SGPHYRYDJDPCEB-NHYWBVRUSA-N	0	3	304.390	2.371	10	0		DEAEHN
Cc1c(-c2nc([C@@H]3CNCCN3C)no2)cnc2ccccc21	ZINC000263147952	145329514	/nfs/dbraw/zinc/32/95/14/145329514.db2.gz	CWAIDMWZNOTWTK-HNNXBMFYSA-N	0	3	309.373	2.169	10	0		DEAEHN
C[C@@H]1CCc2sc(-c3nc([C@@H]4CNCCN4C)no3)cc2C1	ZINC000263200641	145335751	/nfs/dbraw/zinc/33/57/51/145335751.db2.gz	JAIRNQIPVDRXMR-PWSUYJOCSA-N	0	3	318.446	2.499	10	0		DEAEHN
Cc1cc(OCc2nc([C@H]3CNCCN3C)no2)ccc1Cl	ZINC000263228905	145338378	/nfs/dbraw/zinc/33/83/78/145338378.db2.gz	NCTBVHXYLJKMGB-CYBMUJFWSA-N	0	3	322.796	2.187	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2cncc(-c3ccccc3)c2)n1	ZINC000263225128	145338626	/nfs/dbraw/zinc/33/86/26/145338626.db2.gz	MQLLOGPMWFNPSD-MRXNPFEDSA-N	0	3	321.384	2.375	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2C[C@@]23CCCc2ccccc23)n1	ZINC000263228125	145338834	/nfs/dbraw/zinc/33/88/34/145338834.db2.gz	NCCNIDAIPYIBES-GPMSIDNRSA-N	0	3	324.428	2.407	10	0		DEAEHN
Cc1cc(CCNCc2ccc(-n3cncn3)c(F)c2)on1	ZINC000552200307	285950109	/nfs/dbraw/zinc/95/01/09/285950109.db2.gz	ULZWJZCFSQLLPQ-UHFFFAOYSA-N	0	3	301.325	2.035	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CC[C@@H](n2cc(Cl)cn2)C1	ZINC000358489504	147144195	/nfs/dbraw/zinc/14/41/95/147144195.db2.gz	YSWNEAOKAZEZBW-ZIAGYGMSSA-N	0	3	310.829	2.184	10	0		DEAEHN
C[C@H](CN(C)C)NC(=O)N1C[C@@H](c2ccccc2)O[C@@H](C)C1	ZINC000358509032	147148132	/nfs/dbraw/zinc/14/81/32/147148132.db2.gz	VTIMQGNROVCPKK-YCPHGPKFSA-N	0	3	305.422	2.108	10	0		DEAEHN
COc1cccc(CN(CCN(C)C)C(=O)NC[C@@H]2C[C@H]2C)c1	ZINC000358563799	147156996	/nfs/dbraw/zinc/15/69/96/147156996.db2.gz	QXXKDQLLLYHXKK-ZBFHGGJFSA-N	0	3	319.449	2.424	10	0		DEAEHN
CC(C)(CNC(=O)NCCNc1ccncc1)c1cccs1	ZINC000358644952	147171975	/nfs/dbraw/zinc/17/19/75/147171975.db2.gz	ZHFMBQCUCURRNF-UHFFFAOYSA-N	0	3	318.446	2.254	10	0		DEAEHN
CN(Cc1nc2ccccc2n1C)C(=O)CC1CCN(C)CC1	ZINC000358733070	147192389	/nfs/dbraw/zinc/19/23/89/147192389.db2.gz	AGKXBXSMNFEKTC-UHFFFAOYSA-N	0	3	314.433	2.264	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@H]2N(C)CCCC2(C)C)C1	ZINC000359040733	147251996	/nfs/dbraw/zinc/25/19/96/147251996.db2.gz	JKNRAHUXWIHIGX-CQSZACIVSA-N	0	3	311.470	2.175	10	0		DEAEHN
CCn1cc([C@H](C)NC[C@H]2CCC3(CCOCC3)[C@@H]2O)cn1	ZINC000374789993	148289736	/nfs/dbraw/zinc/28/97/36/148289736.db2.gz	ASMWFMOAJPSUHE-SQWLQELKSA-N	0	3	307.438	2.121	10	0		DEAEHN
CC[C@H]1c2ccsc2CCN1C[C@H](O)CN1CCCC1=O	ZINC000111683882	401720698	/nfs/dbraw/zinc/72/06/98/401720698.db2.gz	MNPXWTQCNWDQQA-JSGCOSHPSA-N	0	3	308.447	2.041	10	0		DEAEHN
CN(Cc1cccc2ccccc21)C[C@@H](O)CN1CCCC1=O	ZINC000111684060	401720902	/nfs/dbraw/zinc/72/09/02/401720902.db2.gz	VXLJUKRFPOAKPL-QGZVFWFLSA-N	0	3	312.413	2.255	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@H](C)c1ccccc1	ZINC000111790455	401723690	/nfs/dbraw/zinc/72/36/90/401723690.db2.gz	DPPUEZBSODKENM-GDBMZVCRSA-N	0	3	305.422	2.158	10	0		DEAEHN
CN1CCC(C(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)CC1	ZINC000074187701	401732625	/nfs/dbraw/zinc/73/26/25/401732625.db2.gz	AAPDAVKHJDBDEU-ZWKOTPCHSA-N	0	3	316.445	2.443	10	0		DEAEHN
COCCN1CCN(CCCCCn2cc(C)cn2)C[C@H]1C	ZINC000111227994	401701928	/nfs/dbraw/zinc/70/19/28/401701928.db2.gz	TVTSQEUKQJODMW-QGZVFWFLSA-N	0	3	308.470	2.014	10	0		DEAEHN
CCc1cnc(CCNC(=O)NCCN2CCC[C@H](C)C2)s1	ZINC000073659849	401719861	/nfs/dbraw/zinc/71/98/61/401719861.db2.gz	CBTYWARNGMIBRH-ZDUSSCGKSA-N	0	3	324.494	2.279	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)CCn2cnc3ccccc32)CCN1C	ZINC000127904277	401754924	/nfs/dbraw/zinc/75/49/24/401754924.db2.gz	FEXQLWLCEIQCEA-CABCVRRESA-N	0	3	314.433	2.368	10	0		DEAEHN
CCN(CC)CC(=O)N[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000075262720	401756434	/nfs/dbraw/zinc/75/64/34/401756434.db2.gz	QNUOWSWOADIWCE-AWEZNQCLSA-N	0	3	300.406	2.391	10	0		DEAEHN
CN(C)c1ccccc1CN1CCCC[C@@H]1CN1CCOCC1	ZINC000075969142	401775182	/nfs/dbraw/zinc/77/51/82/401775182.db2.gz	WWWGCBVYCJSTJR-GOSISDBHSA-N	0	3	317.477	2.439	10	0		DEAEHN
CNC(=O)c1cccc(CN2CCC(Cn3cccn3)CC2)c1	ZINC000113932632	401787974	/nfs/dbraw/zinc/78/79/74/401787974.db2.gz	AMPYCUYDZFXNKV-UHFFFAOYSA-N	0	3	312.417	2.155	10	0		DEAEHN
COc1ccc([C@@H]2C[C@H](C)N(CC(=O)N(C)C3CC3)C2)cc1	ZINC000076389132	401793613	/nfs/dbraw/zinc/79/36/13/401793613.db2.gz	IYOGAYVDXBVBHC-DZGCQCFKSA-N	0	3	302.418	2.494	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@H]1COc2ccccc2C1	ZINC000077729990	401827666	/nfs/dbraw/zinc/82/76/66/401827666.db2.gz	UISSMDHSUFKBJB-HZPDHXFCSA-N	0	3	304.434	2.330	10	0		DEAEHN
CCc1ccc([C@H]2CCCCN2C[C@H](O)CN2CCOCC2)o1	ZINC000130973312	401842410	/nfs/dbraw/zinc/84/24/10/401842410.db2.gz	OOQOSPVGCJNSBD-NVXWUHKLSA-N	0	3	322.449	2.062	10	0		DEAEHN
Cc1cc(C(=O)N2CCO[C@@H](CN(C)C)C2)c(C)n1C(C)C	ZINC000116792580	401858993	/nfs/dbraw/zinc/85/89/93/401858993.db2.gz	SOUFFZHUHZMOOC-HNNXBMFYSA-N	0	3	307.438	2.088	10	0		DEAEHN
Cc1ccc2[nH]c(C(=O)N3CCO[C@H](CN(C)C)C3)cc2c1C	ZINC000116792891	401859000	/nfs/dbraw/zinc/85/90/00/401859000.db2.gz	LGDAOZLLMYEMQD-CQSZACIVSA-N	0	3	315.417	2.187	10	0		DEAEHN
C[C@H](SCc1ccccc1)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000116793511	401859192	/nfs/dbraw/zinc/85/91/92/401859192.db2.gz	OCWMVFVJVPQTNG-GOEBONIOSA-N	0	3	322.474	2.097	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)C2(c3cccc(Cl)c3)CC2)CCO1	ZINC000116791672	401859292	/nfs/dbraw/zinc/85/92/92/401859292.db2.gz	JTKGZYYYLFOQBH-HNNXBMFYSA-N	0	3	322.836	2.161	10	0		DEAEHN
Cc1ccc(C)c(SCC(=O)N2CCO[C@@H](CN(C)C)C2)c1	ZINC000116798207	401859950	/nfs/dbraw/zinc/85/99/50/401859950.db2.gz	RFIVXVGUFCVXFV-HNNXBMFYSA-N	0	3	322.474	2.185	10	0		DEAEHN
CCOCCC1(CNC(=O)NCCN2CCCC[C@H]2C)CC1	ZINC000132086147	401861978	/nfs/dbraw/zinc/86/19/78/401861978.db2.gz	WXTCGOBHVIKKNV-OAHLLOKOSA-N	0	3	311.470	2.367	10	0		DEAEHN
CCc1cnccc1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1	ZINC000119106612	401926204	/nfs/dbraw/zinc/92/62/04/401926204.db2.gz	ZDPLCJRLVJYKAC-GJZGRUSLSA-N	0	3	319.449	2.263	10	0		DEAEHN
COc1ccc(CNC(=O)N[C@@H](CC(C)C)CN(C)C)cc1O	ZINC000079495848	401874531	/nfs/dbraw/zinc/87/45/31/401874531.db2.gz	RLVCXUWFRBKTKQ-AWEZNQCLSA-N	0	3	323.437	2.176	10	0		DEAEHN
Cc1nccn1-c1ccc([C@@H](C)NC(=O)NCCN(C)C)cc1	ZINC000133848854	401895129	/nfs/dbraw/zinc/89/51/29/401895129.db2.gz	VYSJQCKVDDIYIF-CYBMUJFWSA-N	0	3	315.421	2.103	10	0		DEAEHN
COCCN(Cc1ccc(C)s1)C[C@@H](O)COC(C)C	ZINC000036101016	401902557	/nfs/dbraw/zinc/90/25/57/401902557.db2.gz	AFWGTUUHTBSFIJ-CQSZACIVSA-N	0	3	301.452	2.291	10	0		DEAEHN
C[C@H](O)C1CCN(C(=O)[C@@H]2CCCN2Cc2ccccc2)CC1	ZINC000118729365	401905903	/nfs/dbraw/zinc/90/59/03/401905903.db2.gz	QYJSIMBSNCHAJX-YJBOKZPZSA-N	0	3	316.445	2.270	10	0		DEAEHN
CN(C)C(=O)CNC1CC(c2cccc(Br)c2)C1	ZINC000036846207	401908641	/nfs/dbraw/zinc/90/86/41/401908641.db2.gz	CJQVFWISIVPACG-UHFFFAOYSA-N	0	3	311.223	2.373	10	0		DEAEHN
O=C(c1csc(Br)c1)N1CCN2CCC[C@@H]2C1	ZINC000037845347	401917787	/nfs/dbraw/zinc/91/77/87/401917787.db2.gz	AKIPMZVAJNLAIS-SNVBAGLBSA-N	0	3	315.236	2.431	10	0		DEAEHN
C[C@@H](NCCCS(N)(=O)=O)c1ccc(Cl)c(Cl)c1	ZINC000045067142	401953515	/nfs/dbraw/zinc/95/35/15/401953515.db2.gz	ARPOUMSRBJMPJA-MRVPVSSYSA-N	0	3	311.234	2.323	10	0		DEAEHN
CC(C)CCOCCN[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000045094141	401954444	/nfs/dbraw/zinc/95/44/44/401954444.db2.gz	VHZQEQIGYVTAAI-CYBMUJFWSA-N	0	3	314.451	2.047	10	0		DEAEHN
CC(=O)c1cc(C(=O)NC[C@H]2CCCN2CC(C)C)n(C)c1	ZINC000119521487	401956047	/nfs/dbraw/zinc/95/60/47/401956047.db2.gz	IAAXVSMBOCOVEK-OAHLLOKOSA-N	0	3	305.422	2.078	10	0		DEAEHN
CC(C)(O)CNC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000119613864	401962206	/nfs/dbraw/zinc/96/22/06/401962206.db2.gz	CJZXLEQGWGCBOJ-SFHVURJKSA-N	0	3	319.449	2.111	10	0		DEAEHN
C[C@@H](NCC(=O)NC(=O)NC1CC1)c1ccc2ccccc2c1	ZINC000120451546	401990385	/nfs/dbraw/zinc/99/03/85/401990385.db2.gz	HHGFAFYHTNUMCN-GFCCVEGCSA-N	0	3	311.385	2.479	10	0		DEAEHN
COCCN1CCC[C@H]1CN[C@@H](C)c1nc2ccccc2n1C	ZINC000091318954	401996291	/nfs/dbraw/zinc/99/62/91/401996291.db2.gz	MVIZEKFTCVPOCF-GJZGRUSLSA-N	0	3	316.449	2.335	10	0		DEAEHN
CC[C@H](C(=O)NCc1ccccc1-n1ccc(C)n1)N(C)C	ZINC000121365748	402031765	/nfs/dbraw/zinc/03/17/65/402031765.db2.gz	KRDVALOVYKGZGO-OAHLLOKOSA-N	0	3	300.406	2.137	10	0		DEAEHN
COc1c(F)cc(NC(=O)C2(N)Cc3ccccc3C2)cc1F	ZINC000151728285	402053194	/nfs/dbraw/zinc/05/31/94/402053194.db2.gz	NEDRODSEEFSLSB-UHFFFAOYSA-N	0	3	318.323	2.408	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)COCCOc2ccccc2)CCN1C	ZINC000122776841	402093869	/nfs/dbraw/zinc/09/38/69/402093869.db2.gz	JBXGSOTVKASOLO-JKSUJKDBSA-N	0	3	320.433	2.023	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cccnc2N2CCCC2)CCN1C	ZINC000123024817	402106734	/nfs/dbraw/zinc/10/67/34/402106734.db2.gz	GLQZYJWXLHHSDR-HUUCEWRRSA-N	0	3	316.449	2.237	10	0		DEAEHN
CC[C@@](C)(O)C[NH+]1CCC(C(=O)Nc2ccccc2[O-])CC1	ZINC000123232835	402116827	/nfs/dbraw/zinc/11/68/27/402116827.db2.gz	DGLKUFULBLHCMH-QGZVFWFLSA-N	0	3	306.406	2.204	10	0		DEAEHN
CC(=O)Nc1cccc([C@H](C)NC[C@@H](C)N2CCOCC2)c1	ZINC000123251986	402118192	/nfs/dbraw/zinc/11/81/92/402118192.db2.gz	YQPZYEUZNPMDMO-KGLIPLIRSA-N	0	3	305.422	2.016	10	0		DEAEHN
CC(=O)N[C@@H](CC(=O)N(CCN(C)C)C(C)C)c1ccccc1	ZINC000151871290	402062397	/nfs/dbraw/zinc/06/23/97/402062397.db2.gz	VMDLSQPOEDWTLW-KRWDZBQOSA-N	0	3	319.449	2.053	10	0		DEAEHN
CCN(CC)C(=O)CCC1CCN(C[C@H](O)C(F)(F)F)CC1	ZINC000122127218	402063011	/nfs/dbraw/zinc/06/30/11/402063011.db2.gz	OXCJJURAKFMHAI-ZDUSSCGKSA-N	0	3	324.387	2.270	10	0		DEAEHN
C[C@@H](NC(=O)c1oc2ccccc2c1CN(C)C)[C@H](C)CO	ZINC000151902949	402064519	/nfs/dbraw/zinc/06/45/19/402064519.db2.gz	OYESNKMWNJKCAV-VXGBXAGGSA-N	0	3	304.390	2.241	10	0		DEAEHN
CN1CCO[C@@H]2CN(c3ccnc4cc(Cl)ccc43)C[C@@H]21	ZINC000153184057	402131992	/nfs/dbraw/zinc/13/19/92/402131992.db2.gz	MSAYLTYGPLSKAJ-JKSUJKDBSA-N	0	3	303.793	2.407	10	0		DEAEHN
CC(C)NC(=O)CCN1CCC(NC(=O)CC2CCCC2)CC1	ZINC000066875832	402145255	/nfs/dbraw/zinc/14/52/55/402145255.db2.gz	UHZPZVZIJVBWFT-UHFFFAOYSA-N	0	3	323.481	2.062	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H]1CCN(c2ccccc2OC)C1)N(C)C	ZINC000153932817	402181126	/nfs/dbraw/zinc/18/11/26/402181126.db2.gz	WQSGVBIAZSQMCV-HOCLYGCPSA-N	0	3	319.449	2.120	10	0		DEAEHN
COC[C@H](C)C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000103433015	402188034	/nfs/dbraw/zinc/18/80/34/402188034.db2.gz	YBRYMRXRNQGFER-KBPBESRZSA-N	0	3	310.463	2.359	10	0		DEAEHN
O=C(Nc1ccsc1)C(=O)N1CCCC[C@H](N2CCCC2)C1	ZINC000125319285	402225809	/nfs/dbraw/zinc/22/58/09/402225809.db2.gz	YQLLKOQKXRQTOA-AWEZNQCLSA-N	0	3	321.446	2.164	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc(-c2ncon2)cc1	ZINC000107230752	402227900	/nfs/dbraw/zinc/22/79/00/402227900.db2.gz	QQKUDVYYEKKLHJ-HNNXBMFYSA-N	0	3	316.405	2.443	10	0		DEAEHN
CCCn1cc(CN2CCC[C@H](C(=O)NCC3CC3)C2)cn1	ZINC000154824718	402234548	/nfs/dbraw/zinc/23/45/48/402234548.db2.gz	SCLFLGVVSTWCLD-INIZCTEOSA-N	0	3	304.438	2.031	10	0		DEAEHN
COC(=O)[C@@H]1CCN(CCC(=O)Nc2ccccc2Cl)C1	ZINC000107823903	402241384	/nfs/dbraw/zinc/24/13/84/402241384.db2.gz	QSZZZKPERICRFC-LLVKDONJSA-N	0	3	310.781	2.164	10	0		DEAEHN
CCCCNC(=O)C(C)S(=O)(=O)Cc1ccccc1F	ZINC000069806111	402244847	/nfs/dbraw/zinc/24/48/47/402244847.db2.gz	BIOHLCBNDDILMS-LLVKDONJSA-N	0	3	301.383	2.045	10	0		DEAEHN
CC(=O)CCN(Cc1ccccc1)[C@H](C)CN1CCOCC1	ZINC000155713815	402265422	/nfs/dbraw/zinc/26/54/22/402265422.db2.gz	NLBCNPJYXFGLFZ-MRXNPFEDSA-N	0	3	304.434	2.188	10	0		DEAEHN
CCc1ccc(-c2cc3c(N4CCNCC4)nccn3n2)cc1	ZINC000070459146	402261552	/nfs/dbraw/zinc/26/15/52/402261552.db2.gz	CDHRKVYOBXJOLZ-UHFFFAOYSA-N	0	3	307.401	2.368	10	0		DEAEHN
CNC(=O)[C@@H](NCc1cc(Br)cs1)C(C)C	ZINC000125024359	402208962	/nfs/dbraw/zinc/20/89/62/402208962.db2.gz	MWHDBNIUSFHIND-JTQLQIEISA-N	0	3	305.241	2.371	10	0		DEAEHN
CCc1ccccc1OCC(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000155812621	402267691	/nfs/dbraw/zinc/26/76/91/402267691.db2.gz	JNIGVYVSAMWDNV-HOCLYGCPSA-N	0	3	304.434	2.473	10	0		DEAEHN
C[C@H](N[C@H]1CCN(Cc2ccccn2)C[C@H]1C)c1cnccn1	ZINC000126198703	402268819	/nfs/dbraw/zinc/26/88/19/402268819.db2.gz	YSNRKOGUUCXRPV-VYDXJSESSA-N	0	3	311.433	2.433	10	0		DEAEHN
CC(C)CCNC(=O)N(C)C1CCN(CCn2cccn2)CC1	ZINC000109391090	402271940	/nfs/dbraw/zinc/27/19/40/402271940.db2.gz	MDITVMKLQLVSTG-UHFFFAOYSA-N	0	3	321.469	2.035	10	0		DEAEHN
COC[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000176104818	402279002	/nfs/dbraw/zinc/27/90/02/402279002.db2.gz	APTHQVOFGMOXPT-YQQAZPJKSA-N	0	3	304.434	2.438	10	0		DEAEHN
CCOc1ccc(NC(=O)NC[C@@H]2CCCN2CCOC)cc1	ZINC000110083691	402281248	/nfs/dbraw/zinc/28/12/48/402281248.db2.gz	DBHOYSQKXQQOBM-HNNXBMFYSA-N	0	3	321.421	2.318	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1cc(C)ccc1F	ZINC000110086057	402281308	/nfs/dbraw/zinc/28/13/08/402281308.db2.gz	CXTKTBXHAWHBFN-ZDUSSCGKSA-N	0	3	309.385	2.366	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NC[C@@H](c1ccco1)N(C)C	ZINC000176143744	402283608	/nfs/dbraw/zinc/28/36/08/402283608.db2.gz	CJWTXBPYLPPEQW-CABCVRRESA-N	0	3	322.453	2.008	10	0		DEAEHN
O=C(N[C@H]1CCOC2(CCCC2)C1)N1CC[C@H](N2CC=CC2)C1	ZINC000157251395	402293299	/nfs/dbraw/zinc/29/32/99/402293299.db2.gz	LBVFYFYIPUCSAI-HOTGVXAUSA-N	0	3	319.449	2.134	10	0		DEAEHN
O=C(c1c[nH]nc1-c1ccccc1F)N1CCN2CCC[C@H]2C1	ZINC000176298912	402297765	/nfs/dbraw/zinc/29/77/65/402297765.db2.gz	HCQQMABILKNNQJ-LBPRGKRZSA-N	0	3	314.364	2.136	10	0		DEAEHN
Cc1cccc2[nH]cc(CCNC(=O)N(C)CCN(C)C)c21	ZINC000176321950	402299292	/nfs/dbraw/zinc/29/92/92/402299292.db2.gz	IHDDDTRSYTULAT-UHFFFAOYSA-N	0	3	302.422	2.222	10	0		DEAEHN
CS(=O)(=O)N1CCC[C@@H](CN2CCCc3ccccc3C2)C1	ZINC000176333589	402300458	/nfs/dbraw/zinc/30/04/58/402300458.db2.gz	OAVBFEVNMLKAJX-HNNXBMFYSA-N	0	3	322.474	2.106	10	0		DEAEHN
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCC1(C)CCC1	ZINC000176357363	402302659	/nfs/dbraw/zinc/30/26/59/402302659.db2.gz	FUKJUHJOXNPIKW-UHFFFAOYSA-N	0	3	317.433	2.302	10	0		DEAEHN
CN(C)CCN(C)C(=O)NCc1ccccc1OC1CCC1	ZINC000176377520	402304300	/nfs/dbraw/zinc/30/43/00/402304300.db2.gz	NLRONNNAZKEQRW-UHFFFAOYSA-N	0	3	305.422	2.321	10	0		DEAEHN
CCN(CCNC(=O)N[C@@H](C)COCc1ccccc1)C1CC1	ZINC000176457787	402311124	/nfs/dbraw/zinc/31/11/24/402311124.db2.gz	VEDROXCLWBDKQS-HNNXBMFYSA-N	0	3	319.449	2.375	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)C/C=C/c1cccc(F)c1	ZINC000176494513	402314654	/nfs/dbraw/zinc/31/46/54/402314654.db2.gz	QLHVRGCHABGJNQ-ZVVFDCPKSA-N	0	3	320.408	2.456	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CCOC3(CCCCC3)C2)C1	ZINC000176838667	402341986	/nfs/dbraw/zinc/34/19/86/402341986.db2.gz	UVUHOSAREOMBQS-CVEARBPZSA-N	0	3	323.481	2.460	10	0		DEAEHN
Cc1c(CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cnn1C	ZINC000229810905	402345603	/nfs/dbraw/zinc/34/56/03/402345603.db2.gz	MQNQCPPTISPURD-CQSZACIVSA-N	0	3	308.426	2.218	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Cc1cc(OC)ccc1OC	ZINC000176978043	402356362	/nfs/dbraw/zinc/35/63/62/402356362.db2.gz	LLNHVJANVMLLIN-OAHLLOKOSA-N	0	3	320.433	2.189	10	0		DEAEHN
CCn1nc(C)c(C(=O)N(C)C[C@@H]2CCCN2CC)c1Cl	ZINC000176984067	402356720	/nfs/dbraw/zinc/35/67/20/402356720.db2.gz	XCPILTPJNXBJEJ-LBPRGKRZSA-N	0	3	312.845	2.421	10	0		DEAEHN
Clc1ccc(-n2cc(CN3CCN4CCC[C@@H]4C3)nn2)cc1	ZINC000176985642	402357161	/nfs/dbraw/zinc/35/71/61/402357161.db2.gz	ZUCHVWNKZGRFTE-MRXNPFEDSA-N	0	3	317.824	2.201	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@@H]1CC(=O)Nc2ccccc21	ZINC000177020406	402360416	/nfs/dbraw/zinc/36/04/16/402360416.db2.gz	BNCKJMCNLNUZSI-UKRRQHHQSA-N	0	3	315.417	2.055	10	0		DEAEHN
CN(C[C@@H]1CCCN(C)C1)C(=O)Nc1ccc([S@](C)=O)cc1	ZINC000177454889	402404326	/nfs/dbraw/zinc/40/43/26/402404326.db2.gz	HRCGNBHXJOLXCU-DMZKTXOQSA-N	0	3	323.462	2.230	10	0		DEAEHN
CCC[C@@H](C(=O)NCCOc1ccc(F)c(F)c1)N(C)C	ZINC000162033689	402407417	/nfs/dbraw/zinc/40/74/17/402407417.db2.gz	MYUSHQQXFRTNIR-AWEZNQCLSA-N	0	3	300.349	2.190	10	0		DEAEHN
CCOC(=O)c1nn(C)cc1CNCCCc1cccc(F)c1	ZINC000186337363	402422012	/nfs/dbraw/zinc/42/20/12/402422012.db2.gz	YYIMOYUQNZPMQT-UHFFFAOYSA-N	0	3	319.380	2.458	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCOc3ccccc32)CN1C1CC1	ZINC000177668704	402424872	/nfs/dbraw/zinc/42/48/72/402424872.db2.gz	PGZDBZXFYFXRKM-XJKCOSOUSA-N	0	3	315.417	2.435	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)Nc1ccc(Cl)cn1	ZINC000177697794	402428038	/nfs/dbraw/zinc/42/80/38/402428038.db2.gz	ZWUWSFJXAJFKJB-ZDUSSCGKSA-N	0	3	310.829	2.090	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)N(C)Cc1ccccc1	ZINC000177704668	402428425	/nfs/dbraw/zinc/42/84/25/402428425.db2.gz	UKQVFLJQFOPPRV-FUHWJXTLSA-N	0	3	317.477	2.450	10	0		DEAEHN
Cc1cc(=O)[nH]cc1C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000186472801	402433932	/nfs/dbraw/zinc/43/39/32/402433932.db2.gz	PVWHDSWTTDSTEL-GUYCJALGSA-N	0	3	313.401	2.105	10	0		DEAEHN
C[C@@H](c1nc(-c2cccnc2)no1)N1CCN2CCCC[C@@H]2C1	ZINC000177777395	402435420	/nfs/dbraw/zinc/43/54/20/402435420.db2.gz	WRIDYCPGCHQRMV-DZGCQCFKSA-N	0	3	313.405	2.363	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1cccc(N2CC=CC2)c1)N(C)C	ZINC000162932162	402436620	/nfs/dbraw/zinc/43/66/20/402436620.db2.gz	YMHFGPBZBMWKFB-KRWDZBQOSA-N	0	3	301.434	2.409	10	0		DEAEHN
COc1ccc([C@@H](C)NCCC(=O)NC(C)C)cc1NC(C)=O	ZINC000177867979	402441823	/nfs/dbraw/zinc/44/18/23/402441823.db2.gz	PQVCKOXRTXCHNG-GFCCVEGCSA-N	0	3	321.421	2.219	10	0		DEAEHN
C[C@H]1CN(C[C@@H](O)COCc2ccc(Cl)cc2)CCCO1	ZINC000245406093	402456969	/nfs/dbraw/zinc/45/69/69/402456969.db2.gz	WAHOWBXKZSCTSJ-XJKSGUPXSA-N	0	3	313.825	2.328	10	0		DEAEHN
CCO[C@@H]1C[C@](N)(C(=O)N(C)Cc2ccc(F)cc2)C1(C)C	ZINC000186706505	402457961	/nfs/dbraw/zinc/45/79/61/402457961.db2.gz	YAGZTUKXVIVYJX-PBHICJAKSA-N	0	3	308.397	2.317	10	0		DEAEHN
COC[C@@H](NC(=O)NCCN1CCCC[C@H]1C)c1ccco1	ZINC000245425047	402459234	/nfs/dbraw/zinc/45/92/34/402459234.db2.gz	DKFCWCHDWDFUAN-ZIAGYGMSSA-N	0	3	309.410	2.141	10	0		DEAEHN
COc1cccc([C@H]2C[C@H]2C(=O)N(C)CCN(C)C2CC2)c1	ZINC000186724976	402460464	/nfs/dbraw/zinc/46/04/64/402460464.db2.gz	DOOGIKLTQZKMJB-IAGOWNOFSA-N	0	3	302.418	2.351	10	0		DEAEHN
Cc1ccc(NC(=O)CN2CCN3CCC[C@H]3C2)cc1Cl	ZINC000245474141	402464502	/nfs/dbraw/zinc/46/45/02/402464502.db2.gz	QRCUQTBXLPNGNH-AWEZNQCLSA-N	0	3	307.825	2.367	10	0		DEAEHN
CN(C)c1ccc(NC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1	ZINC000245492428	402465274	/nfs/dbraw/zinc/46/52/74/402465274.db2.gz	JKVDKOBXISBJMG-CVEARBPZSA-N	0	3	302.422	2.453	10	0		DEAEHN
Cc1ccccc1O[C@@H](C)CNC(=O)N1CCN2CCC[C@H]2C1	ZINC000245496491	402466085	/nfs/dbraw/zinc/46/60/85/402466085.db2.gz	RMORKUUJKDPKNQ-HOTGVXAUSA-N	0	3	317.433	2.252	10	0		DEAEHN
CCS(=O)(=O)NCCCN1C[C@H](c2ccccc2)C[C@H]1C	ZINC000245530312	402468324	/nfs/dbraw/zinc/46/83/24/402468324.db2.gz	XCCJBPJMQPKGLA-GDBMZVCRSA-N	0	3	310.463	2.194	10	0		DEAEHN
COc1ccc([C@@H](C)N[C@@H](C(=O)N2CCOCC2)C(C)C)cc1	ZINC000164968273	402471258	/nfs/dbraw/zinc/47/12/58/402471258.db2.gz	HDTFRYVWHAWTIQ-RHSMWYFYSA-N	0	3	320.433	2.229	10	0		DEAEHN
O=C(NCc1nc(C2CC2)cs1)N1CCCN(C2CC2)CC1	ZINC000178229504	402474389	/nfs/dbraw/zinc/47/43/89/402474389.db2.gz	JOUVLIAKIUPLFW-UHFFFAOYSA-N	0	3	320.462	2.400	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N[C@H]2Cc3ccccc3[C@H]2O)c1	ZINC000178326379	402485212	/nfs/dbraw/zinc/48/52/12/402485212.db2.gz	IUQAXRSPSKXKJU-ZWKOTPCHSA-N	0	3	310.397	2.136	10	0		DEAEHN
Cc1ccc(CN2CCCC[C@H](N3CCN(C)CC3)C2)c(C)n1	ZINC000187297878	402492323	/nfs/dbraw/zinc/49/23/23/402492323.db2.gz	MVEPUYPYGLNSOI-IBGZPJMESA-N	0	3	316.493	2.300	10	0		DEAEHN
CN(Cc1ccccc1)C(=O)CN[C@@H]1[C@@H]2CCCO[C@H]2C1(C)C	ZINC000245884213	402494187	/nfs/dbraw/zinc/49/41/87/402494187.db2.gz	LGJPQAZXFHGTFJ-CGTJXYLNSA-N	0	3	316.445	2.438	10	0		DEAEHN
CC(=O)Nc1ccc(Cl)c(C(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000178576798	402513754	/nfs/dbraw/zinc/51/37/54/402513754.db2.gz	HHAFMTOSZSXHDI-ZDUSSCGKSA-N	0	3	321.808	2.219	10	0		DEAEHN
COCCO[C@H]1CCCN(CCN(C)Cc2ccc(F)cc2)C1	ZINC000187364452	402496262	/nfs/dbraw/zinc/49/62/62/402496262.db2.gz	QCRMDANDMZGWKX-SFHVURJKSA-N	0	3	324.440	2.385	10	0		DEAEHN
CC(C)(C)OC(=O)[C@H]1CCN(CCC(=O)NC2CCCC2)C1	ZINC000178510890	402505868	/nfs/dbraw/zinc/50/58/68/402505868.db2.gz	VVKTXCPLMSYQLX-ZDUSSCGKSA-N	0	3	310.438	2.099	10	0		DEAEHN
C[C@H](N[C@@H]1CCN(Cc2ccccn2)C[C@H]1C)c1nccn1C	ZINC000246078896	402507669	/nfs/dbraw/zinc/50/76/69/402507669.db2.gz	UQEYEYZFTTVHQV-HLLBOEOZSA-N	0	3	313.449	2.376	10	0		DEAEHN
CC(C)Oc1ccc(CN2CCN(C[C@@H](C)O)[C@@H](C)C2)cc1	ZINC000170936599	402543011	/nfs/dbraw/zinc/54/30/11/402543011.db2.gz	PMXMJJXZFFMKML-JKSUJKDBSA-N	0	3	306.450	2.361	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000170946058	402543637	/nfs/dbraw/zinc/54/36/37/402543637.db2.gz	OPJKOFKZTWKJEY-PVAVHDDUSA-N	0	3	300.402	2.105	10	0		DEAEHN
COC(C)(C)C(=O)Nc1ccc(N2CCCN(C)CC2)cc1	ZINC000170962160	402545490	/nfs/dbraw/zinc/54/54/90/402545490.db2.gz	CJENMOYBCJAMMZ-UHFFFAOYSA-N	0	3	305.422	2.192	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@H](N[C@@H]2Cc3ccccc3[C@@H]2O)C1	ZINC000178861524	402548073	/nfs/dbraw/zinc/54/80/73/402548073.db2.gz	IMFMNSLGSKLTDQ-IMJJTQAJSA-N	0	3	318.417	2.244	10	0		DEAEHN
Cc1ccc(C(=O)N2CCN3CCC[C@H]3C2)c(Br)n1	ZINC000178886956	402550755	/nfs/dbraw/zinc/55/07/55/402550755.db2.gz	XWIASVUBWMLEHT-NSHDSACASA-N	0	3	324.222	2.073	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(F)cc2nccnc21	ZINC000246995515	402552781	/nfs/dbraw/zinc/55/27/81/402552781.db2.gz	FIMHAGMBDUYWTM-AAEUAGOBSA-N	0	3	314.364	2.078	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NC(=O)N2CC[C@@H](N(C)C)C2)C1(CC)CC	ZINC000247081618	402556487	/nfs/dbraw/zinc/55/64/87/402556487.db2.gz	PGJGJVWSSYBFJQ-RBSFLKMASA-N	0	3	311.470	2.316	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2ccc(OC)c(F)c2)C1	ZINC000171104502	402558293	/nfs/dbraw/zinc/55/82/93/402558293.db2.gz	MGUKSYNLBPQJHO-CQSZACIVSA-N	0	3	323.412	2.160	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC[C@H]1CCCC[C@H]1C	ZINC000247222024	402560681	/nfs/dbraw/zinc/56/06/81/402560681.db2.gz	BYZUXKDTTXIOHA-BZUAXINKSA-N	0	3	311.470	2.223	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)N2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000247274496	402562217	/nfs/dbraw/zinc/56/22/17/402562217.db2.gz	YGZRXJIZWKTVKL-VXGBXAGGSA-N	0	3	307.360	2.312	10	0		DEAEHN
CC[C@@H](C)NC(=O)CN[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000189893272	402565056	/nfs/dbraw/zinc/56/50/56/402565056.db2.gz	BYLQKASTBASOEK-ZIAGYGMSSA-N	0	3	300.406	2.438	10	0		DEAEHN
CCc1noc(CC)c1CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000246177095	402515801	/nfs/dbraw/zinc/51/58/01/402515801.db2.gz	GLCWCLLBBMGVEU-QWHCGFSZSA-N	0	3	322.453	2.424	10	0		DEAEHN
CCc1noc(CC)c1CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000246177101	402515858	/nfs/dbraw/zinc/51/58/58/402515858.db2.gz	GLCWCLLBBMGVEU-STQMWFEESA-N	0	3	322.453	2.424	10	0		DEAEHN
CN(C)[C@@H](CNC(=O)c1cn2ccnc2s1)c1ccccc1	ZINC000188143890	402516420	/nfs/dbraw/zinc/51/64/20/402516420.db2.gz	HIWRSOOMFGNIES-ZDUSSCGKSA-N	0	3	314.414	2.429	10	0		DEAEHN
CO[C@H]1CN(Cc2cn(C)nc2-c2cccnc2)CC[C@@H]1C	ZINC000188298347	402518854	/nfs/dbraw/zinc/51/88/54/402518854.db2.gz	QCIKNQVDNLBTKY-BBRMVZONSA-N	0	3	300.406	2.339	10	0		DEAEHN
CCc1noc(CC)c1CC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000246226732	402519148	/nfs/dbraw/zinc/51/91/48/402519148.db2.gz	WMHMQVWEUIKXJE-QWHCGFSZSA-N	0	3	307.438	2.283	10	0		DEAEHN
C[C@H](C(=O)NC[C@@H](C)c1ccccc1)N1CCN2CCC[C@@H]2C1	ZINC000178629021	402519533	/nfs/dbraw/zinc/51/95/33/402519533.db2.gz	ZBHRVIDQJHKONQ-JFIYKMOQSA-N	0	3	315.461	2.075	10	0		DEAEHN
COC(=O)[C@@H]1C[C@H](c2ccccc2)CN(Cc2cncn2C)C1	ZINC000246248785	402520423	/nfs/dbraw/zinc/52/04/23/402520423.db2.gz	IZTUDPUKWSWPPB-JKSUJKDBSA-N	0	3	313.401	2.199	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@H](C)NC(=O)CC(C)(C)C	ZINC000188619061	402521693	/nfs/dbraw/zinc/52/16/93/402521693.db2.gz	WTLFEOLSCXUVCQ-KBPBESRZSA-N	0	3	313.486	2.020	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(C)cc1	ZINC000246281375	402522930	/nfs/dbraw/zinc/52/29/30/402522930.db2.gz	VPTUCRHYBXSBKM-CABCVRRESA-N	0	3	308.447	2.242	10	0		DEAEHN
CC(C)NC(=O)NC(=O)[C@@H](C)N1CCC[C@]2(CC=CCC2)C1	ZINC000246293043	402523637	/nfs/dbraw/zinc/52/36/37/402523637.db2.gz	BFMKHMWJGUNIIV-RHSMWYFYSA-N	0	3	307.438	2.431	10	0		DEAEHN
COc1cccc(OCCN2CCC[C@H](n3cncn3)C2)c1	ZINC000178674443	402524791	/nfs/dbraw/zinc/52/47/91/402524791.db2.gz	BPGLUINCRIFAQU-AWEZNQCLSA-N	0	3	302.378	2.003	10	0		DEAEHN
CCOC[C@@H](O)CN[C@@H](C)c1cnn(-c2ccc(F)cc2)c1C	ZINC000178710117	402529333	/nfs/dbraw/zinc/52/93/33/402529333.db2.gz	ILDWKTFKSMHFAI-LRDDRELGSA-N	0	3	321.396	2.368	10	0		DEAEHN
C[C@H](OCCCNC(=O)N1CC[C@@H](N(C)C)C1)c1ccccc1	ZINC000170826974	402529860	/nfs/dbraw/zinc/52/98/60/402529860.db2.gz	DLXLAZCPOOLRNG-DOTOQJQBSA-N	0	3	319.449	2.500	10	0		DEAEHN
C[C@H]1C[C@@H]1NC(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	ZINC000170823112	402529873	/nfs/dbraw/zinc/52/98/73/402529873.db2.gz	XFANSWLDYDGKMG-BBRMVZONSA-N	0	3	315.417	2.136	10	0		DEAEHN
Cc1cc(-n2c(C)cc(C(=O)N3CC[C@H](N(C)C)C3)c2C)no1	ZINC000170856787	402533591	/nfs/dbraw/zinc/53/35/91/402533591.db2.gz	HWZOPCDHBQPSBY-AWEZNQCLSA-N	0	3	316.405	2.167	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)[C@@H]2COc3ccc(Cl)cc3C2)C1	ZINC000170858594	402533611	/nfs/dbraw/zinc/53/36/11/402533611.db2.gz	DQJGJVKASWPPOA-GXTWGEPZSA-N	0	3	308.809	2.054	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)CCC(=O)c2ccc3c(c2)CCC3)C1	ZINC000170860207	402533626	/nfs/dbraw/zinc/53/36/26/402533626.db2.gz	YRURTJOVYQRVET-KRWDZBQOSA-N	0	3	314.429	2.301	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1[C@H](C)C[C@H]2CCCC[C@H]21	ZINC000246494244	402533857	/nfs/dbraw/zinc/53/38/57/402533857.db2.gz	IOONHVGEYUVELJ-QBPKDAKJSA-N	0	3	323.481	2.460	10	0		DEAEHN
Cc1cc(C)n(-c2ccc(C(=O)N3CC[C@@H](N(C)C)C3)cc2)n1	ZINC000170862381	402534451	/nfs/dbraw/zinc/53/44/51/402534451.db2.gz	PESYGZYFUHKFHV-QGZVFWFLSA-N	0	3	312.417	2.265	10	0		DEAEHN
CCCn1nc(C)c(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1C	ZINC000246600334	402538192	/nfs/dbraw/zinc/53/81/92/402538192.db2.gz	UJBDBCSHGZNPIC-WFASDCNBSA-N	0	3	306.454	2.465	10	0		DEAEHN
CC(C)n1cc(C(=O)N[C@H](Cc2ccccc2)CN(C)C)cn1	ZINC000190172804	402581137	/nfs/dbraw/zinc/58/11/37/402581137.db2.gz	BXZPBLZUNHLRGI-QGZVFWFLSA-N	0	3	314.433	2.367	10	0		DEAEHN
Cc1nn(C)c(C)c1CCNC(=O)[C@@H](C(C)C)N1CCCCC1	ZINC000171432012	402587197	/nfs/dbraw/zinc/58/71/97/402587197.db2.gz	KGHHMWXPHHTDOT-QGZVFWFLSA-N	0	3	320.481	2.206	10	0		DEAEHN
Cc1cc2c(cc1C)[C@H](C(=O)N1C[C@H]3CCCN3C[C@H]1C)CO2	ZINC000248584753	402597666	/nfs/dbraw/zinc/59/76/66/402597666.db2.gz	VCUYQHFILUWAAI-BFYDXBDKSA-N	0	3	314.429	2.475	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H]2CCCO[C@H]2CC(C)C)C1	ZINC000248612998	402598816	/nfs/dbraw/zinc/59/88/16/402598816.db2.gz	YDXULGSEOFAALO-JYJNAYRXSA-N	0	3	311.470	2.364	10	0		DEAEHN
Cn1cc(CN2CCCN(C3CC3)CC2)c(-c2ccncc2)n1	ZINC000179732777	402598954	/nfs/dbraw/zinc/59/89/54/402598954.db2.gz	VZFSXZITVIKPHR-UHFFFAOYSA-N	0	3	311.433	2.152	10	0		DEAEHN
CCSCc1cc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)no1	ZINC000248638233	402600509	/nfs/dbraw/zinc/60/05/09/402600509.db2.gz	MBADHQUAKGPNEK-RYUDHWBXSA-N	0	3	311.451	2.482	10	0		DEAEHN
CSCCC(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190584106	402611456	/nfs/dbraw/zinc/61/14/56/402611456.db2.gz	RMASFFLLHOJIMY-HNNXBMFYSA-N	0	3	307.463	2.115	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)NC2CCCC2)C1	ZINC000190678852	402617838	/nfs/dbraw/zinc/61/78/38/402617838.db2.gz	LXIUGVXXIIRDEN-INIZCTEOSA-N	0	3	316.449	2.488	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000249140131	402621731	/nfs/dbraw/zinc/62/17/31/402621731.db2.gz	FNITWOFKRXTLOX-XJKSGUPXSA-N	0	3	317.433	2.129	10	0		DEAEHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NC[C@H]1CCC(C)(C)O1	ZINC000249131229	402621734	/nfs/dbraw/zinc/62/17/34/402621734.db2.gz	DQWPMCVCUGXHMI-QLFBSQMISA-N	0	3	311.470	2.364	10	0		DEAEHN
CCc1nc2n(n1)C[C@H](N[C@H](C)c1cnn(C(C)C)c1)CC2	ZINC000180632788	402622186	/nfs/dbraw/zinc/62/21/86/402622186.db2.gz	QXVIYPHOMHHBJB-TZMCWYRMSA-N	0	3	302.426	2.284	10	0		DEAEHN
CCc1nc([C@@H](C)NC(=O)N2CCN3CCC[C@@H]3C2)cs1	ZINC000171780346	402622165	/nfs/dbraw/zinc/62/21/65/402622165.db2.gz	SXFGEBPVVPOZTJ-VXGBXAGGSA-N	0	3	308.451	2.256	10	0		DEAEHN
CCOCc1ccc(CNC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000171900749	402632750	/nfs/dbraw/zinc/63/27/50/402632750.db2.gz	NSPSRDNLVMKTCJ-KRWDZBQOSA-N	0	3	317.433	2.213	10	0		DEAEHN
Cc1csc2nc(CN(C)[C@@]3(CO)CC[C@@H](C)C3)cc(=O)n12	ZINC000249555827	402634736	/nfs/dbraw/zinc/63/47/36/402634736.db2.gz	JRMJLTSUFSGYTE-BZNIZROVSA-N	0	3	321.446	2.047	10	0		DEAEHN
Cc1cccc(CNC(=O)CN(C)[C@@]2(CO)CC[C@@H](C)C2)c1	ZINC000249600502	402636205	/nfs/dbraw/zinc/63/62/05/402636205.db2.gz	YAOUZNVINIJVRE-QAPCUYQASA-N	0	3	304.434	2.094	10	0		DEAEHN
CCOC(=O)[C@H](Cc1ccccc1)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000249852889	402643009	/nfs/dbraw/zinc/64/30/09/402643009.db2.gz	PSGIMLDIQOZFRR-NJAFHUGGSA-N	0	3	318.461	2.479	10	0		DEAEHN
C[C@@H](c1nc2ccccc2c(=O)[nH]1)N1CCCN(C2CC2)CC1	ZINC000172347708	402651508	/nfs/dbraw/zinc/65/15/08/402651508.db2.gz	ZLVOTUHCMPCTPD-ZDUSSCGKSA-N	0	3	312.417	2.154	10	0		DEAEHN
C[C@H](c1nc2ccccc2c(=O)[nH]1)N1CCCN(C2CC2)CC1	ZINC000172347709	402651547	/nfs/dbraw/zinc/65/15/47/402651547.db2.gz	ZLVOTUHCMPCTPD-CYBMUJFWSA-N	0	3	312.417	2.154	10	0		DEAEHN
COC(=O)CNC(=O)[C@@H](C)N[C@H](C)c1ccc(C(C)(C)C)cc1	ZINC000182608924	402703738	/nfs/dbraw/zinc/70/37/38/402703738.db2.gz	DWMHUKLSNMXXBY-CHWSQXEVSA-N	0	3	320.433	2.312	10	0		DEAEHN
CN1C(=O)C[C@@H](NCCn2cccn2)[C@@H]1c1ccc(Cl)cc1	ZINC000192151180	402714816	/nfs/dbraw/zinc/71/48/16/402714816.db2.gz	MSKMMKIUYDQVRC-ZBFHGGJFSA-N	0	3	318.808	2.098	10	0		DEAEHN
Cc1cc(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)ccc1F	ZINC000173886413	402716765	/nfs/dbraw/zinc/71/67/65/402716765.db2.gz	XJIJKOCGFHLKOG-SWLSCSKDSA-N	0	3	314.426	2.141	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H](C)[C@H]1CCCO1	ZINC000252733962	402660741	/nfs/dbraw/zinc/66/07/41/402660741.db2.gz	XPVSIBIWWVCYEY-HLLBOEOZSA-N	0	3	319.449	2.374	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CCCO[C@@H]1C	ZINC000253353937	402662510	/nfs/dbraw/zinc/66/25/10/402662510.db2.gz	XGKXYEMRBBIDPN-INMHGKMJSA-N	0	3	304.434	2.438	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N2CCCN(C3CC3)CC2)c1	ZINC000172619055	402666960	/nfs/dbraw/zinc/66/69/60/402666960.db2.gz	NVFMLJLXSMVMEZ-UHFFFAOYSA-N	0	3	301.434	2.059	10	0		DEAEHN
Cc1sc2[nH]c(CN3CCN4CCC[C@H]4C3)nc(=O)c2c1C	ZINC000253555853	402668600	/nfs/dbraw/zinc/66/86/00/402668600.db2.gz	YNRFBVACVZNULD-LBPRGKRZSA-N	0	3	318.446	2.294	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc([S@@](C)=O)cc1	ZINC000253550077	402668798	/nfs/dbraw/zinc/66/87/98/402668798.db2.gz	YNBUQIWYNUDOIW-DOQJBMMISA-N	0	3	320.458	2.123	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2snnc2C(C)(C)C)CCN1C	ZINC000191430453	402669106	/nfs/dbraw/zinc/66/91/06/402669106.db2.gz	WBLBSSHDQUHTGI-GHMZBOCLSA-N	0	3	310.467	2.390	10	0		DEAEHN
COc1cc([C@H](C)NCC(C)(C)C2(O)CCOCC2)ccn1	ZINC000566474752	292245626	/nfs/dbraw/zinc/24/56/26/292245626.db2.gz	HYJUAEFIYODFEO-ZDUSSCGKSA-N	0	3	308.422	2.309	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)C/C=C\c1cccc(F)c1	ZINC000255006659	402675084	/nfs/dbraw/zinc/67/50/84/402675084.db2.gz	QLHVRGCHABGJNQ-GPCFVJJQSA-N	0	3	320.408	2.456	10	0		DEAEHN
O=C(C/C=C\c1cccc(F)c1)NC[C@@H](O)CN1CCCCC1	ZINC000255017302	402675989	/nfs/dbraw/zinc/67/59/89/402675989.db2.gz	CKOOVHWEKAJQHX-XTKXOIQPSA-N	0	3	320.408	2.192	10	0		DEAEHN
COc1ccccc1CCCN1CCN(C[C@@H](C)O)[C@@H](C)C1	ZINC000182440962	402690509	/nfs/dbraw/zinc/69/05/09/402690509.db2.gz	ALXXJMDFQCFQNE-JKSUJKDBSA-N	0	3	306.450	2.015	10	0		DEAEHN
COCCCN(C)CCNC(=O)N1CCC[C@@H]1c1ccco1	ZINC000173373352	402694451	/nfs/dbraw/zinc/69/44/51/402694451.db2.gz	QWPRTOMIAFCSMT-CQSZACIVSA-N	0	3	309.410	2.094	10	0		DEAEHN
Clc1cccc(OCCN2CC[C@@H](N3CCOCC3)C2)c1	ZINC000173940520	402720624	/nfs/dbraw/zinc/72/06/24/402720624.db2.gz	UXDUMOJDMGMKPY-OAHLLOKOSA-N	0	3	310.825	2.125	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)NCCCCC2CCCC2)CCO1	ZINC000173460793	402698336	/nfs/dbraw/zinc/69/83/36/402698336.db2.gz	GAXYIAJCNBKHIE-INIZCTEOSA-N	0	3	311.470	2.319	10	0		DEAEHN
C[C@@H]1CN(CC2CCN(C(=O)NCCC3CC3)CC2)C[C@H](C)O1	ZINC000174057331	402725303	/nfs/dbraw/zinc/72/53/03/402725303.db2.gz	LCMWORUHLGZQPN-GASCZTMLSA-N	0	3	323.481	2.317	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(Cc3cccc(Cl)n3)C2)CC1	ZINC000182909682	402726416	/nfs/dbraw/zinc/72/64/16/402726416.db2.gz	ZPDORLPDECUTIJ-INIZCTEOSA-N	0	3	322.884	2.337	10	0		DEAEHN
CN1CCC(C(=O)NC[C@H]2CCN(C)c3ccccc32)CC1	ZINC000174189626	402731134	/nfs/dbraw/zinc/73/11/34/402731134.db2.gz	VWEXMCCRQCYGBY-OAHLLOKOSA-N	0	3	301.434	2.068	10	0		DEAEHN
Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N(C)C2CC2)cc1	ZINC000183147732	402742651	/nfs/dbraw/zinc/74/26/51/402742651.db2.gz	WMIXNIXRKBVHPD-CYBMUJFWSA-N	0	3	312.417	2.452	10	0		DEAEHN
COc1ccc(Cl)cc1NC(=O)CN[C@H](C)[C@H]1CCCO1	ZINC000183152677	402743407	/nfs/dbraw/zinc/74/34/07/402743407.db2.gz	KAFZJCUNAKNXIT-ZWNOBZJWSA-N	0	3	312.797	2.444	10	0		DEAEHN
C[C@@H](C(=O)N(CCN(C)C)Cc1ccccn1)c1cccnc1	ZINC000174687926	402752052	/nfs/dbraw/zinc/75/20/52/402752052.db2.gz	QWCOUIBBTQWITL-OAHLLOKOSA-N	0	3	312.417	2.171	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(C(C)(C)c2cccc(F)c2)n1	ZINC000263270722	402752535	/nfs/dbraw/zinc/75/25/35/402752535.db2.gz	SEHNYUDMINDVFA-CYBMUJFWSA-N	0	3	304.369	2.111	10	0		DEAEHN
C[C@H](O)CCN(C)C[C@H](O)COc1c(Cl)cccc1Cl	ZINC000174792966	402758075	/nfs/dbraw/zinc/75/80/75/402758075.db2.gz	MONFQVMHKPWQNC-QWRGUYRKSA-N	0	3	322.232	2.436	10	0		DEAEHN
COc1ccccc1N1CC[C@@H](N[C@H](C)c2ccnn2C)C1	ZINC000192952883	402758198	/nfs/dbraw/zinc/75/81/98/402758198.db2.gz	BVWNHYRVIXVGBL-ZIAGYGMSSA-N	0	3	300.406	2.358	10	0		DEAEHN
O=C(NC[C@@H]1CCc2ccccc21)N1CC[C@@H](N2CC=CC2)C1	ZINC000174836306	402759774	/nfs/dbraw/zinc/75/97/74/402759774.db2.gz	VLGFTNZNABXFLT-DLBZAZTESA-N	0	3	311.429	2.372	10	0		DEAEHN
CC(C)N1CCC[C@@H](N[C@@H](C)c2ccc3c(c2)OCO3)C1=O	ZINC000174986837	402769263	/nfs/dbraw/zinc/76/92/63/402769263.db2.gz	KKKIYKKKQKWWTD-GXTWGEPZSA-N	0	3	304.390	2.465	10	0		DEAEHN
CN(C)c1ccncc1C(=O)NC[C@H](c1ccccc1)N(C)C	ZINC000183466997	402769727	/nfs/dbraw/zinc/76/97/27/402769727.db2.gz	SIOLAJHOUUEJQC-QGZVFWFLSA-N	0	3	312.417	2.180	10	0		DEAEHN
COC(=O)c1ccc(NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000175000419	402770314	/nfs/dbraw/zinc/77/03/14/402770314.db2.gz	GWXVOZNAQUFPQQ-WFASDCNBSA-N	0	3	319.405	2.420	10	0		DEAEHN
COC[C@@H](NC[C@H](C)CS(C)(=O)=O)c1ccc(Cl)cc1	ZINC000193677664	402775483	/nfs/dbraw/zinc/77/54/83/402775483.db2.gz	OUBOCTUXUDMSDM-SMDDNHRTSA-N	0	3	319.854	2.298	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc3c(c2)N(C)CCO3)C1	ZINC000175094995	402778708	/nfs/dbraw/zinc/77/87/08/402778708.db2.gz	FJZNFCIVLBPBFY-CQSZACIVSA-N	0	3	318.421	2.121	10	0		DEAEHN
COc1cc(C(=O)N2CCN3CCC[C@H]3C2)ccc1OC(C)C	ZINC000195314361	402841867	/nfs/dbraw/zinc/84/18/67/402841867.db2.gz	PWFJBDVQEGTURB-HNNXBMFYSA-N	0	3	318.417	2.403	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccccc2-n2cccn2)C1	ZINC000194341345	402792848	/nfs/dbraw/zinc/79/28/48/402792848.db2.gz	LPDYDDZYBPIRTM-CQSZACIVSA-N	0	3	313.405	2.478	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc(OCCOC)cc2)C1	ZINC000194335964	402793079	/nfs/dbraw/zinc/79/30/79/402793079.db2.gz	IUAGBTDDEMVEHJ-OAHLLOKOSA-N	0	3	321.421	2.318	10	0		DEAEHN
COC[C@H](NC(=O)NCCN1CCCC[C@@H]1C)c1ccco1	ZINC000175278200	402793238	/nfs/dbraw/zinc/79/32/38/402793238.db2.gz	DKFCWCHDWDFUAN-KBPBESRZSA-N	0	3	309.410	2.141	10	0		DEAEHN
CCNC(=O)c1ccc(NC(=O)N[C@@H]2CCCN(CC)C2)cc1	ZINC000194344627	402793714	/nfs/dbraw/zinc/79/37/14/402793714.db2.gz	UDTAWLLEIYFHQG-OAHLLOKOSA-N	0	3	318.421	2.042	10	0		DEAEHN
Cc1cc(C)cc([C@H]2CCN(C(=O)C(C)S(C)(=O)=O)C2)c1	ZINC000183778331	402796995	/nfs/dbraw/zinc/79/69/95/402796995.db2.gz	YUJGBHJKABJRHC-KBPBESRZSA-N	0	3	309.431	2.052	10	0		DEAEHN
CCCN(CC)CCNS(=O)(=O)c1cc(C)sc1C	ZINC000175362414	402800371	/nfs/dbraw/zinc/80/03/71/402800371.db2.gz	YZJCARKEKPNGBG-UHFFFAOYSA-N	0	3	304.481	2.375	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cnn(Cc3ccccc3)c2)C1	ZINC000194640494	402807543	/nfs/dbraw/zinc/80/75/43/402807543.db2.gz	HCNLUXLGUZVGKK-QGZVFWFLSA-N	0	3	312.417	2.146	10	0		DEAEHN
C[C@@H](C(=O)NCc1cccnc1N(C)C)N1[C@H](C)CC[C@H]1C	ZINC000194666195	402809274	/nfs/dbraw/zinc/80/92/74/402809274.db2.gz	XYJPIEUFHKLRFM-MCIONIFRSA-N	0	3	304.438	2.025	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)[C@H](C)N1[C@H](C)CC[C@H]1C	ZINC000175925619	402843264	/nfs/dbraw/zinc/84/32/64/402843264.db2.gz	KDMCBYZXHDYMLM-KFWWJZLASA-N	0	3	306.454	2.417	10	0		DEAEHN
C[C@@H](NC[C@@H](O)COC(C)(C)C)c1ccc(-n2cncn2)cc1	ZINC000194894764	402821839	/nfs/dbraw/zinc/82/18/39/402821839.db2.gz	AVYYHTPMMGXLLG-CZUORRHYSA-N	0	3	318.421	2.094	10	0		DEAEHN
C[C@@H](N[C@@H]1CCCN(c2cnn(C)c2)C1)c1cccc(O)c1	ZINC000194901088	402821867	/nfs/dbraw/zinc/82/18/67/402821867.db2.gz	OWFWVWTXUWZTAG-UKRRQHHQSA-N	0	3	300.406	2.445	10	0		DEAEHN
c1ccc(-c2nnc(CN3CCN4CCC[C@@H]4C3)s2)cc1	ZINC000184208999	402827262	/nfs/dbraw/zinc/82/72/62/402827262.db2.gz	HNQKZGXXZVFRNL-CQSZACIVSA-N	0	3	300.431	2.485	10	0		DEAEHN
Cn1nccc1C1CCN(C[C@H](O)c2ccc(F)cc2)CC1	ZINC000195501926	402847578	/nfs/dbraw/zinc/84/75/78/402847578.db2.gz	GWBCFELSNKBONL-KRWDZBQOSA-N	0	3	303.381	2.472	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@H](C)N[C@@H]2CCOC[C@@H]2C)c1	ZINC000278046401	403282342	/nfs/dbraw/zinc/28/23/42/403282342.db2.gz	XURUPXNGVSGSIL-MQIPJXDCSA-N	0	3	304.390	2.231	10	0		DEAEHN
CC(=O)c1cccc(OCC(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000345785254	403483686	/nfs/dbraw/zinc/48/36/86/403483686.db2.gz	KXCXXJAHVYRMGZ-INIZCTEOSA-N	0	3	320.433	2.361	10	0		DEAEHN
CN(C)CC1(NC(=O)c2ncsc2Br)CCC1	ZINC000288050796	403715495	/nfs/dbraw/zinc/71/54/95/403715495.db2.gz	MYVMUBHQDOYYID-UHFFFAOYSA-N	0	3	318.240	2.120	10	0		DEAEHN
C/C=C\C[C@H](CO)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000351634659	403819506	/nfs/dbraw/zinc/81/95/06/403819506.db2.gz	RUIZNSDYMRKRSX-OTLMLMNOSA-N	0	3	317.433	2.058	10	0		DEAEHN
CC[C@H](C(=O)NCC[C@H]1COc2ccccc2O1)N(CC)CC	ZINC000361914980	403910018	/nfs/dbraw/zinc/91/00/18/403910018.db2.gz	GNDOUQPODHUWPS-LSDHHAIUSA-N	0	3	320.433	2.453	10	0		DEAEHN
CN(C)Cc1ccccc1C(=O)N[C@@H](CO)CC1CCCC1	ZINC000362996175	404038445	/nfs/dbraw/zinc/03/84/45/404038445.db2.gz	ICLJQICILYNBMB-MRXNPFEDSA-N	0	3	304.434	2.419	10	0		DEAEHN
CCOC(=O)[C@]1(C(C)C)CCN(C[C@H](O)CC(F)(F)F)C1	ZINC000373914248	404637251	/nfs/dbraw/zinc/63/72/51/404637251.db2.gz	XZNAUWDBBRKMLC-DGCLKSJQSA-N	0	3	311.344	2.211	10	0		DEAEHN
O=C(c1cccc(CN2CCCC2)c1)N1CC[C@@](O)(C2CC2)C1	ZINC000365880336	404738234	/nfs/dbraw/zinc/73/82/34/404738234.db2.gz	WNIFPGXRUJQDRU-IBGZPJMESA-N	0	3	314.429	2.269	10	0		DEAEHN
CCOC(=O)[C@H]1CN([C@H](C)c2ccc(F)cc2)CC12COC2	ZINC000451141766	404879343	/nfs/dbraw/zinc/87/93/43/404879343.db2.gz	VZYSQZPURXZUNX-IUODEOHRSA-N	0	3	307.365	2.398	10	0		DEAEHN
COC[C@@H](O)CN1CCC(c2nc(C(F)(F)F)cs2)CC1	ZINC000451294744	404943613	/nfs/dbraw/zinc/94/36/13/404943613.db2.gz	KXIKCLRTOFJLKK-JTQLQIEISA-N	0	3	324.368	2.349	10	0		DEAEHN
Cc1sc2nc(C)nc(N3CCCN(CCO)CC3)c2c1C	ZINC000389751581	405039174	/nfs/dbraw/zinc/03/91/74/405039174.db2.gz	VMMYTLVQVYOYPA-UHFFFAOYSA-N	0	3	320.462	2.121	10	0		DEAEHN
COC(=O)C(C)(C)N1CCN(C[C@H]2C[C@@H]2c2ccccc2)CC1	ZINC000361394039	405054116	/nfs/dbraw/zinc/05/41/16/405054116.db2.gz	CRYIGOSETWFWLJ-IAGOWNOFSA-N	0	3	316.445	2.359	10	0		DEAEHN
Cn1ncc(Cl)c1CNCC[C@H]1COc2ccccc2O1	ZINC000436316285	405069651	/nfs/dbraw/zinc/06/96/51/405069651.db2.gz	RRAVUBUXGAECIP-NSHDSACASA-N	0	3	307.781	2.393	10	0		DEAEHN
Cn1nnc2cc(CN3CC[C@]4(O)CCCC[C@@H]4C3)ccc21	ZINC000408073305	405105997	/nfs/dbraw/zinc/10/59/97/405105997.db2.gz	PZHKLUHRJLMVHY-RHSMWYFYSA-N	0	3	300.406	2.095	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@H]2CN1Cc1nc(-c2ccoc2)no1	ZINC000408183448	405132285	/nfs/dbraw/zinc/13/22/85/405132285.db2.gz	RTOAQGGBSXEMEB-OCCSQVGLSA-N	0	3	302.378	2.388	10	0		DEAEHN
Cc1cc(F)ccc1S(=O)(=O)NCCN1CCCC1(C)C	ZINC000452083830	405157339	/nfs/dbraw/zinc/15/73/39/405157339.db2.gz	HKJWYAPJPHZBPE-UHFFFAOYSA-N	0	3	314.426	2.287	10	0		DEAEHN
C[NH+]1CCC(CNC(=O)c2cc3c(cc2[O-])CCCC3)CC1	ZINC000408410420	405201080	/nfs/dbraw/zinc/20/10/80/405201080.db2.gz	QEVHMWPKLGQTOS-UHFFFAOYSA-N	0	3	302.418	2.343	10	0		DEAEHN
C[C@@H](CCc1ccccc1F)C(=O)NCCNc1ccncc1	ZINC000439036900	405263428	/nfs/dbraw/zinc/26/34/28/405263428.db2.gz	CJNGMGAYMAHRFF-AWEZNQCLSA-N	0	3	315.392	2.440	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)N2CCC[C@@H]2CN2CCCC2)nc1	ZINC000455153427	405381592	/nfs/dbraw/zinc/38/15/92/405381592.db2.gz	VXJYVIZKLMCMOU-OAHLLOKOSA-N	0	3	316.405	2.376	10	0		DEAEHN
CC=CC[C@H]1NC(=O)N(c2cccc(OCCN(C)C)c2)C1=O	ZINC000445912728	405362632	/nfs/dbraw/zinc/36/26/32/405362632.db2.gz	KWPBLQJVTRISIH-FOSCPCJNSA-N	0	3	317.389	2.018	10	0		DEAEHN
CC(C)CC(CC(C)C)C(=O)N1CCN(CCN(C)C)CC1	ZINC000448600639	405425657	/nfs/dbraw/zinc/42/56/57/405425657.db2.gz	JGUQLCVBXGBARJ-UHFFFAOYSA-N	0	3	311.514	2.401	10	0		DEAEHN
CN(C)CCn1nccc1NC(=O)N[C@@H]1CCCC(F)(F)C1	ZINC000455659784	405441514	/nfs/dbraw/zinc/44/15/14/405441514.db2.gz	RGSRSROELUVFPX-LLVKDONJSA-N	0	3	315.368	2.144	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2cccc3ccoc32)CC12COC2	ZINC000449363849	405525356	/nfs/dbraw/zinc/52/53/56/405525356.db2.gz	MMLLTDYLAGKVBO-HNNXBMFYSA-N	0	3	315.369	2.444	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NC[C@H]1CCCC12CC2	ZINC000638794584	405673308	/nfs/dbraw/zinc/67/33/08/405673308.db2.gz	FBDWWKFWEGLGTC-IAGOWNOFSA-N	0	3	315.461	2.142	10	0		DEAEHN
O=C(NC[C@@H]1CCCN1CCCO)NCC1CCCCCC1	ZINC000459030738	405704715	/nfs/dbraw/zinc/70/47/15/405704715.db2.gz	RDTUWAKQOUSAJL-INIZCTEOSA-N	0	3	311.470	2.103	10	0		DEAEHN
COC1(C[C@@H](C)N[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)CCC1	ZINC000583619499	405776339	/nfs/dbraw/zinc/77/63/39/405776339.db2.gz	SRXJTVGWCHHGTL-UNEWFSDZSA-N	0	3	317.433	2.291	10	0		DEAEHN
CCn1nccc1CNC[C@@H]1OCCN(C)[C@H]1c1ccccc1	ZINC000583616640	405773853	/nfs/dbraw/zinc/77/38/53/405773853.db2.gz	VXAYXBAVYVVJID-ROUUACIJSA-N	0	3	314.433	2.065	10	0		DEAEHN
CC(C)Oc1ccc2nccc(N3CC[C@@H](NC(N)=O)C3)c2c1	ZINC000450407457	405881444	/nfs/dbraw/zinc/88/14/44/405881444.db2.gz	IABLNYMCJYRABT-GFCCVEGCSA-N	0	3	314.389	2.269	10	0		DEAEHN
COc1cccc2c1ccnc2N1CCO[C@@H](CN(C)C)C1	ZINC000450321929	405833303	/nfs/dbraw/zinc/83/33/03/405833303.db2.gz	WCBCFJYHOKJAIB-ZDUSSCGKSA-N	0	3	301.390	2.010	10	0		DEAEHN
CN(C)C[C@](C)(O)CNC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450338876	405843814	/nfs/dbraw/zinc/84/38/14/405843814.db2.gz	ZGXNBSRKZGZLGD-LJQANCHMSA-N	0	3	316.445	2.443	10	0		DEAEHN
C[C@H]1C[C@@H]1c1ccc(CNC(=O)NCCNc2ccncc2)o1	ZINC000560752825	405867354	/nfs/dbraw/zinc/86/73/54/405867354.db2.gz	PVLSWUAFRSYZSL-WFASDCNBSA-N	0	3	314.389	2.131	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)c1	ZINC000457639971	405930231	/nfs/dbraw/zinc/93/02/31/405930231.db2.gz	YXWZMOXIGSNNKF-SWLSCSKDSA-N	0	3	316.401	2.137	10	0		DEAEHN
c1ccc(N2CC[C@@H](CN3CCO[C@@]4(CCCOC4)C3)C2)cc1	ZINC000639157390	405931917	/nfs/dbraw/zinc/93/19/17/405931917.db2.gz	NDTFHEPRWOPFQL-HKUYNNGSSA-N	0	3	316.445	2.394	10	0		DEAEHN
c1ccc(N2CC[C@@H](CN3CC[C@H](Nc4ncccn4)C3)C2)cc1	ZINC000639282097	406019614	/nfs/dbraw/zinc/01/96/14/406019614.db2.gz	NDOBAGSYPDDHTE-IRXDYDNUSA-N	0	3	323.444	2.489	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N(C)CC2(N(C)C)CCC2)c1	ZINC000457723881	405971665	/nfs/dbraw/zinc/97/16/65/405971665.db2.gz	DBBZQAHSSNHDFR-UHFFFAOYSA-N	0	3	318.417	2.338	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)N[C@H]3CN(C4CC4)C[C@H]3C)cc2)c1	ZINC000531567233	405979800	/nfs/dbraw/zinc/97/98/00/405979800.db2.gz	GPVLITRMSGIJIK-KDOFPFPSSA-N	0	3	324.428	2.393	10	0		DEAEHN
CN(C[C@@H]1CCN(C)C1)C(=O)c1cnc(-c2cccnc2)s1	ZINC000534207077	406172473	/nfs/dbraw/zinc/17/24/73/406172473.db2.gz	GFVGCITWRVBRRI-GFCCVEGCSA-N	0	3	316.430	2.229	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@@H]1SCCc2sccc21	ZINC000533815020	406163359	/nfs/dbraw/zinc/16/33/59/406163359.db2.gz	KJAJAALUGZNZOA-CQSZACIVSA-N	0	3	319.455	2.124	10	0		DEAEHN
Cn1ncc(Br)c1CNCCCc1ccccn1	ZINC000487579935	406249480	/nfs/dbraw/zinc/24/94/80/406249480.db2.gz	XWTTWQVZZGVQNO-UHFFFAOYSA-N	0	3	309.211	2.300	10	0		DEAEHN
CO[C@@H]1CCC[C@H]1CNCc1c(Br)cnn1C	ZINC000487552139	406244977	/nfs/dbraw/zinc/24/49/77/406244977.db2.gz	WRSDMRCVAPPKRB-JOYOIKCWSA-N	0	3	302.216	2.087	10	0		DEAEHN
c1ccc(-n2nnnc2CCN2CCC[C@@H]2c2ccncc2)cc1	ZINC000536608429	406269432	/nfs/dbraw/zinc/26/94/32/406269432.db2.gz	LERKJQWGKMLYCP-QGZVFWFLSA-N	0	3	320.400	2.437	10	0		DEAEHN
C[C@@H]1CCC[C@H](NC(=O)[C@H](N)CN(C)Cc2ccccc2)C1	ZINC000637919262	406477166	/nfs/dbraw/zinc/47/71/66/406477166.db2.gz	RIFCFJOWDJYYJH-HYVNUMGLSA-N	0	3	303.450	2.141	10	0		DEAEHN
CC(C)C[C@H]1CCCN1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637920000	406478337	/nfs/dbraw/zinc/47/83/37/406478337.db2.gz	KHGYWRYNEKQVEC-MSOLQXFVSA-N	0	3	317.477	2.483	10	0		DEAEHN
CN(Cc1cccc(Cl)c1Cl)C(=O)[C@@H]1OCC[C@@H]1N	ZINC000637880772	406459680	/nfs/dbraw/zinc/45/96/80/406459680.db2.gz	AHKYXJLIHKGJHU-CMPLNLGQSA-N	0	3	303.189	2.068	10	0		DEAEHN
CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@H](C)c1nnc([C@@H](C)CC)[n-]1	ZINC000490355865	406463176	/nfs/dbraw/zinc/46/31/76/406463176.db2.gz	WEGPIPHEDXZJJM-YNEHKIRRSA-N	0	3	307.442	2.370	10	0		DEAEHN
CCC[N@H+]1CCC[C@@H]1C(=O)N[C@H](C)c1nnc([C@@H](C)CC)[n-]1	ZINC000490355865	406463179	/nfs/dbraw/zinc/46/31/79/406463179.db2.gz	WEGPIPHEDXZJJM-YNEHKIRRSA-N	0	3	307.442	2.370	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@H](C)c1nnc([C@@H](C)CC)[nH]1	ZINC000490355865	406463183	/nfs/dbraw/zinc/46/31/83/406463183.db2.gz	WEGPIPHEDXZJJM-YNEHKIRRSA-N	0	3	307.442	2.370	10	0		DEAEHN
NC(=O)c1csc(CNCC[C@@H]2COc3ccccc3O2)c1	ZINC000571593204	406540695	/nfs/dbraw/zinc/54/06/95/406540695.db2.gz	BALWGDAJLFGFJS-GFCCVEGCSA-N	0	3	318.398	2.167	10	0		DEAEHN
O=C(c1ccccc1-c1cn[nH]c1)N1CC[C@H](N2CCCC2)C1	ZINC000635479866	406555547	/nfs/dbraw/zinc/55/55/47/406555547.db2.gz	LOERLMIDRHMDHG-HNNXBMFYSA-N	0	3	310.401	2.387	10	0		DEAEHN
CC(=O)N1CCN(C[C@H]2CCN(c3ccccc3)C2)[C@H](C)C1	ZINC000638094316	406566781	/nfs/dbraw/zinc/56/67/81/406566781.db2.gz	RBVVSGLSMLLGFG-NVXWUHKLSA-N	0	3	301.434	2.066	10	0		DEAEHN
C[C@H](NC(=O)[C@H](N)CN(C)Cc1ccccc1)C1CCCC1	ZINC000637990001	406512865	/nfs/dbraw/zinc/51/28/65/406512865.db2.gz	CPMCTOWDFFOGTR-WMLDXEAASA-N	0	3	303.450	2.141	10	0		DEAEHN
C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)NC[C@H]1CCCN(C)C1	ZINC000527224760	406599452	/nfs/dbraw/zinc/59/94/52/406599452.db2.gz	AEJTVZNBCPVPBC-UTUOFQBUSA-N	0	3	307.360	2.311	10	0		DEAEHN
CCn1nc(CNC2(COC)CCOCC2)c2ccccc21	ZINC000552083538	406682310	/nfs/dbraw/zinc/68/23/10/406682310.db2.gz	LFWJAHMUKZWJJK-UHFFFAOYSA-N	0	3	303.406	2.341	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N(C)CCC(C)(C)C	ZINC000638375316	406733424	/nfs/dbraw/zinc/73/34/24/406733424.db2.gz	XKLNWXHMIXRRJL-MRXNPFEDSA-N	0	3	305.466	2.340	10	0		DEAEHN
C[C@@H](N[C@@H](C)C(=O)N1CCc2sccc2C1)[C@H]1CCCO1	ZINC000183153754	287045915	/nfs/dbraw/zinc/04/59/15/287045915.db2.gz	XVRXXDFCQXYRSH-MBNYWOFBSA-N	0	3	308.447	2.178	10	0		DEAEHN
CC(C)CN1CCC[C@@H]1CNC(=O)C(=O)Nc1ccc(F)cc1	ZINC000129450166	196049402	/nfs/dbraw/zinc/04/94/02/196049402.db2.gz	GJBLUTKXDAQPQO-OAHLLOKOSA-N	0	3	321.396	2.001	10	0		DEAEHN
Cc1ccc(CN)cc1S(=O)(=O)NCCCCC(F)(F)F	ZINC000130553105	196090750	/nfs/dbraw/zinc/09/07/50/196090750.db2.gz	UQXZDRYUIGSQNZ-UHFFFAOYSA-N	0	3	324.368	2.465	10	0		DEAEHN
Cc1cccc(OCCN[C@H](C)C(=O)NCC(F)(F)F)c1	ZINC000130928602	196124553	/nfs/dbraw/zinc/12/45/53/196124553.db2.gz	WKJUSRKMYWISAX-LLVKDONJSA-N	0	3	304.312	2.030	10	0		DEAEHN
CCn1nccc1/C=C/C(=O)N1C[C@@H](N(C)C)Cc2ccccc21	ZINC000131885424	196206891	/nfs/dbraw/zinc/20/68/91/196206891.db2.gz	FTTYQBULIKVRQQ-FVNWOWOISA-N	0	3	324.428	2.436	10	0		DEAEHN
CCn1nccc1/C=C/C(=O)N1C[C@H](N(C)C)Cc2ccccc21	ZINC000131885227	196207200	/nfs/dbraw/zinc/20/72/00/196207200.db2.gz	FTTYQBULIKVRQQ-OAGJVSPASA-N	0	3	324.428	2.436	10	0		DEAEHN
CCN[C@H](CC)c1ccc(SCCS(C)(=O)=O)cn1	ZINC000131899235	196208549	/nfs/dbraw/zinc/20/85/49/196208549.db2.gz	HBQLNZQQLHJVKA-GFCCVEGCSA-N	0	3	302.465	2.279	10	0		DEAEHN
CN(Cc1cccc(Cl)c1Cl)C(=O)C1(N)CCOCC1	ZINC000132156828	196231824	/nfs/dbraw/zinc/23/18/24/196231824.db2.gz	USGZSZOLOPBNJE-UHFFFAOYSA-N	0	3	317.216	2.460	10	0		DEAEHN
CN(C[C@@H]1CCCN1C)C(=O)c1sc2cccnc2c1N	ZINC000132317757	196245504	/nfs/dbraw/zinc/24/55/04/196245504.db2.gz	VGOAVNXQOHVGNT-JTQLQIEISA-N	0	3	304.419	2.045	10	0		DEAEHN
C[C@H](N[C@H]1CCC(=O)N(C)C1)c1ccc2c(c1)OCCCO2	ZINC000132990297	196302777	/nfs/dbraw/zinc/30/27/77/196302777.db2.gz	YRKZEUYXURBFRN-JSGCOSHPSA-N	0	3	304.390	2.119	10	0		DEAEHN
CC[C@@H](CSC)NS(=O)(=O)c1cccc([C@H](C)N)c1	ZINC000133233530	196323664	/nfs/dbraw/zinc/32/36/64/196323664.db2.gz	XDPPHTBLPOZZPH-JQWIXIFHSA-N	0	3	302.465	2.126	10	0		DEAEHN
C[C@]1(C(=O)N(C[C@H]2CCCO2)[C@@H]2CCSC2)CCCCN1	ZINC000133244096	196324141	/nfs/dbraw/zinc/32/41/41/196324141.db2.gz	OHBGXEHNIDIUDL-IIAWOOMASA-N	0	3	312.479	2.032	10	0		DEAEHN
CC[C@H](CSC)Nc1nc(NC)nc(N2CCCCC2)n1	ZINC000134268128	196374337	/nfs/dbraw/zinc/37/43/37/196374337.db2.gz	SGRMTDPHFUHTTM-LLVKDONJSA-N	0	3	310.471	2.457	10	0		DEAEHN
CC[C@@H]1CCSC(NCc2ccc(S(C)(=O)=O)cc2)=N1	ZINC000134481318	196395528	/nfs/dbraw/zinc/39/55/28/196395528.db2.gz	YHPKUUOCXACPJZ-GFCCVEGCSA-N	0	3	312.460	2.451	10	0		DEAEHN
Cc1noc(CCCN2CC[C@@H](n3cnc4c3CCCC4)C2)n1	ZINC000299753882	229399486	/nfs/dbraw/zinc/39/94/86/229399486.db2.gz	ZQPKDDKSWGWRML-CQSZACIVSA-N	0	3	315.421	2.333	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1Nc1nccnc1N(C)C	ZINC000302211578	230167967	/nfs/dbraw/zinc/16/79/67/230167967.db2.gz	ZKKWSHOXQJGZOR-GOEBONIOSA-N	0	3	311.433	2.475	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NCCc1ccccn1)c1ccccc1	ZINC000047634247	424826828	/nfs/dbraw/zinc/82/68/28/424826828.db2.gz	WZEJONDDNBOTKO-QGZVFWFLSA-N	0	3	312.417	2.226	10	0		DEAEHN
CN(C)CCN(Cc1ccccc1)C(=O)Nc1nncs1	ZINC000043130106	424811529	/nfs/dbraw/zinc/81/15/29/424811529.db2.gz	ORNYXZMLNXXQSJ-UHFFFAOYSA-N	0	3	305.407	2.134	10	0		DEAEHN
Cc1ccc(NC(=O)Cn2cc(C(C)(C)N)nn2)cc1Cl	ZINC000070118484	424842124	/nfs/dbraw/zinc/84/21/24/424842124.db2.gz	QSMJOODXYSDHGT-UHFFFAOYSA-N	0	3	307.785	2.072	10	0		DEAEHN
CN(Cc1ccc(Cl)cc1)C[C@H](O)COC[C@@H]1CCCO1	ZINC000068047630	424842127	/nfs/dbraw/zinc/84/21/27/424842127.db2.gz	OIEWNYYCCLVVEW-HOTGVXAUSA-N	0	3	313.825	2.328	10	0		DEAEHN
O=C(NCCN1CCCC1)c1c[nH]nc1-c1ccc(F)cc1	ZINC000193152360	424867235	/nfs/dbraw/zinc/86/72/35/424867235.db2.gz	XQKUPHUZTOALDK-UHFFFAOYSA-N	0	3	302.353	2.041	10	0		DEAEHN
O[C@@]1(CCNCc2ccc(Br)cc2F)CCOC1	ZINC000404185711	424926120	/nfs/dbraw/zinc/92/61/20/424926120.db2.gz	CWXZBZMMTDNFAV-ZDUSSCGKSA-N	0	3	318.186	2.219	10	0		DEAEHN
COc1ncc(CNC[C@H]2CCN(CC(F)(F)F)C2)s1	ZINC000313199058	424895136	/nfs/dbraw/zinc/89/51/36/424895136.db2.gz	YHJROMLLAHKJSP-SECBINFHSA-N	0	3	309.357	2.126	10	0		DEAEHN
Nc1ccncc1C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000310102038	424895154	/nfs/dbraw/zinc/89/51/54/424895154.db2.gz	YFMADIPFOWGXHU-MRXNPFEDSA-N	0	3	324.428	2.306	10	0		DEAEHN
CN(C(=O)COc1ccc(Cl)cc1)[C@H](CN)C(F)(F)F	ZINC000662974863	425769218	/nfs/dbraw/zinc/76/92/18/425769218.db2.gz	BLDBTUQKHDWHQW-SNVBAGLBSA-N	0	3	310.703	2.067	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000194818221	268558842	/nfs/dbraw/zinc/55/88/42/268558842.db2.gz	WCUVZSMNTBZSOF-RHSMWYFYSA-N	0	3	317.433	2.087	10	0		DEAEHN
C[C@H](COCc1ccccc1)NC(=O)[C@@H]1NCCCC1(C)C	ZINC000390759549	269098171	/nfs/dbraw/zinc/09/81/71/269098171.db2.gz	YRKHMNXDWYXKEC-ZBFHGGJFSA-N	0	3	304.434	2.486	10	0		DEAEHN
C[C@@H](C(=O)NCC1(O)CCN(Cc2ccccc2)CC1)C1CC1	ZINC000397615560	269106532	/nfs/dbraw/zinc/10/65/32/269106532.db2.gz	GUROXWAUDHWCMB-OAHLLOKOSA-N	0	3	316.445	2.176	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1C[C@@H]2CC[C@H](O)C[C@@H]2C1	ZINC000398865690	269109733	/nfs/dbraw/zinc/10/97/33/269109733.db2.gz	SLABJUUSPZSMOD-KSZLIROESA-N	0	3	316.445	2.128	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1C[C@@H]2CC[C@@H](O)C[C@@H]2C1	ZINC000398865702	269109832	/nfs/dbraw/zinc/10/98/32/269109832.db2.gz	SLABJUUSPZSMOD-RCCFBDPRSA-N	0	3	316.445	2.128	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN1CC[C@H]([C@H]2CCOC2)C1	ZINC000430233213	269127182	/nfs/dbraw/zinc/12/71/82/269127182.db2.gz	KESQSMTUZVQUBS-IRXDYDNUSA-N	0	3	312.417	2.185	10	0		DEAEHN
CC(C)c1ccc([C@@H](C)N[C@@H](C)C(=O)N2CCNC2=O)cc1	ZINC000067127587	273563601	/nfs/dbraw/zinc/56/36/01/273563601.db2.gz	NZBBQCQUDLERIV-OLZOCXBDSA-N	0	3	303.406	2.401	10	0		DEAEHN
CC1(C)C[C@H](NC(=O)C2(N)CCOCC2)c2ccc(F)cc2O1	ZINC000261673284	275864303	/nfs/dbraw/zinc/86/43/03/275864303.db2.gz	CBZPVKVDUXLMRA-ZDUSSCGKSA-N	0	3	322.380	2.052	10	0		DEAEHN
CC(=O)[C@](C)(O)CN[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1	ZINC000451042818	277101333	/nfs/dbraw/zinc/10/13/33/277101333.db2.gz	DXOUHZZPFNVWGU-HRCADAONSA-N	0	3	310.825	2.015	10	0		DEAEHN
COC1([C@H](C)NCc2cn3ccc(C)cc3n2)CCOCC1	ZINC000453104732	277474363	/nfs/dbraw/zinc/47/43/63/277474363.db2.gz	GFQARIOGBLADTO-AWEZNQCLSA-N	0	3	303.406	2.316	10	0		DEAEHN
COc1cccc2c1CCN(C[C@@](C)(O)C(F)(F)F)CC2	ZINC000369714595	278028681	/nfs/dbraw/zinc/02/86/81/278028681.db2.gz	JSQPLMAPMMIGML-CQSZACIVSA-N	0	3	303.324	2.409	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N1CCCC[C@@H]1CN(C)C	ZINC000117788811	278108910	/nfs/dbraw/zinc/10/89/10/278108910.db2.gz	GRTSPARGCTUILT-CPUCHLNUSA-N	0	3	302.418	2.494	10	0		DEAEHN
C[C@H](C(=O)N1C[C@@H]2CCCCN2C[C@H]1C)[C@H](N)c1ccccc1	ZINC000261737736	278145058	/nfs/dbraw/zinc/14/50/58/278145058.db2.gz	NQEHMCIDXFYYSS-FZCLSBEQSA-N	0	3	315.461	2.408	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N[C@@H]1CCC[C@@H]2OCC[C@@H]21	ZINC000247470999	279128209	/nfs/dbraw/zinc/12/82/09/279128209.db2.gz	QGPVCBUCEBXUBM-FPCVCCKLSA-N	0	3	311.470	2.220	10	0		DEAEHN
CCN(CCNC(=O)N1CCCC[C@@H]1c1cn[nH]c1)C1CC1	ZINC000182631976	279194076	/nfs/dbraw/zinc/19/40/76/279194076.db2.gz	VWHMROCQSALSSC-OAHLLOKOSA-N	0	3	305.426	2.131	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1nncs1	ZINC000181028114	279282597	/nfs/dbraw/zinc/28/25/97/279282597.db2.gz	WBVFXSXVWDMSBR-LLVKDONJSA-N	0	3	305.407	2.180	10	0		DEAEHN
CCS(=O)(=O)C[C@H](C)N[C@H]1CCOC2(CCCCC2)C1	ZINC000408102872	280005794	/nfs/dbraw/zinc/00/57/94/280005794.db2.gz	DOHOZMIXKYMFNI-KBPBESRZSA-N	0	3	303.468	2.281	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCCOc1ccccc1	ZINC000079200550	281587724	/nfs/dbraw/zinc/58/77/24/281587724.db2.gz	OEINJZUAPNRGKF-HNNXBMFYSA-N	0	3	307.438	2.341	10	0		DEAEHN
CC1CCN(CCNC(=O)N2CC[C@@]3(O)CCCC[C@@H]3C2)CC1	ZINC000162772172	281816978	/nfs/dbraw/zinc/81/69/78/281816978.db2.gz	IRFIMPJCMUSVIY-AEFFLSMTSA-N	0	3	323.481	2.055	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000113305295	300316330	/nfs/dbraw/zinc/31/63/30/300316330.db2.gz	LNWJQFNZJUEBIU-WCQYABFASA-N	0	3	314.838	2.197	10	0		DEAEHN
C[C@H](N[C@H]1CCC(=O)N[C@H]1C)c1ccc(Br)cn1	ZINC000584270787	332178409	/nfs/dbraw/zinc/17/84/09/332178409.db2.gz	BBZGZABVOXMDPL-AUTRQRHGSA-N	0	3	312.211	2.162	10	0		DEAEHN
COC[C@@H](C)CN[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O	ZINC000188198214	333039283	/nfs/dbraw/zinc/03/92/83/333039283.db2.gz	PTEKHCRIKQWLJE-IINYFYTJSA-N	0	3	314.788	2.457	10	0		DEAEHN
COC[C@@H](C)CN1CCN(Cc2cc(F)ccc2OC)CC1	ZINC000189570238	333117789	/nfs/dbraw/zinc/11/77/89/333117789.db2.gz	ZQDJSAHBPBCDAT-AWEZNQCLSA-N	0	3	310.413	2.234	10	0		DEAEHN
CC(=O)c1ncc(C(=O)NC2C[C@H]3CCC[C@@H](C2)N3C)s1	ZINC000582472995	337095467	/nfs/dbraw/zinc/09/54/67/337095467.db2.gz	PFUDGDRZDNWSAS-YOGCLGLASA-N	0	3	307.419	2.091	10	0		DEAEHN
CC(C)c1nnc(CN2CCN(C3CCCCC3)CC2)n1C	ZINC000178745890	341963429	/nfs/dbraw/zinc/96/34/29/341963429.db2.gz	KAWPIGSJXYMFLN-UHFFFAOYSA-N	0	3	305.470	2.389	10	0		DEAEHN
C[C@@H]1CC[C@@](CO)(N(C)CC(=O)NCc2ccc(Cl)cc2)C1	ZINC000187954618	534202798	/nfs/dbraw/zinc/20/27/98/534202798.db2.gz	RVPKWBAXLPJOEN-CXAGYDPISA-N	0	3	324.852	2.439	10	0		DEAEHN
CCCC(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000112256070	519877455	/nfs/dbraw/zinc/87/74/55/519877455.db2.gz	JTNJVBCIEBSQHU-UHFFFAOYSA-N	0	3	303.406	2.251	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)N(C)[C@@H](C)CO)c1ccsc1	ZINC000129704674	520861369	/nfs/dbraw/zinc/86/13/69/520861369.db2.gz	LECKCAVNSSMSCP-GXTWGEPZSA-N	0	3	313.467	2.153	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H]1CCN(C(=O)C2CCCCC2)C1)N(C)C	ZINC000154897202	520985961	/nfs/dbraw/zinc/98/59/61/520985961.db2.gz	LDPDUXWIUCGEGW-JKSUJKDBSA-N	0	3	323.481	2.014	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C)N(C)C	ZINC000156614100	520987465	/nfs/dbraw/zinc/98/74/65/520987465.db2.gz	JCWCFFMQAVWUII-RYQLBKOJSA-N	0	3	317.477	2.353	10	0		DEAEHN
CCOc1ccc(CNC(=O)N2CCC[C@H](N(C)C)C2)cc1F	ZINC000106340222	520989096	/nfs/dbraw/zinc/98/90/96/520989096.db2.gz	FUVOIRBOFJMJHU-AWEZNQCLSA-N	0	3	323.412	2.460	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCCC[C@@H]1[C@@H](C)O	ZINC000106865473	521356804	/nfs/dbraw/zinc/35/68/04/521356804.db2.gz	KVUBOHAVADPFCQ-NVXWUHKLSA-N	0	3	304.434	2.270	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)NC[C@@H]1CCCN1CCOC	ZINC000111867808	521363312	/nfs/dbraw/zinc/36/33/12/521363312.db2.gz	KIGBMEZZYVCDDK-KRWDZBQOSA-N	0	3	319.449	2.329	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)[C@H](C)Cc2ccc(O)cc2)C1	ZINC000246095692	521644302	/nfs/dbraw/zinc/64/43/02/521644302.db2.gz	MHZVAHXDKYAUNS-ZBFHGGJFSA-N	0	3	319.449	2.449	10	0		DEAEHN
CCCN(C[C@H]1CCCCO1)C(=O)N[C@@H]1CCCN(CC)C1	ZINC000106541553	521677312	/nfs/dbraw/zinc/67/73/12/521677312.db2.gz	DQCAGTNJVCIEPF-HZPDHXFCSA-N	0	3	311.470	2.461	10	0		DEAEHN
COCCC1(CNC(=O)N[C@@H](CN(C)C)c2ccccc2)CC1	ZINC000131907968	523045299	/nfs/dbraw/zinc/04/52/99/523045299.db2.gz	QWMGOZKTNOKFCY-INIZCTEOSA-N	0	3	319.449	2.405	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1nncs1	ZINC000157774007	525011668	/nfs/dbraw/zinc/01/16/68/525011668.db2.gz	PVQVQAYBXBLLPS-YPMHNXCESA-N	0	3	317.418	2.180	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@@H](c2cnn(C)c2)C1)[C@H](N)c1ccccc1	ZINC000246221734	525992471	/nfs/dbraw/zinc/99/24/71/525992471.db2.gz	GTZUXTXDPUVEFZ-LXZKKBNFSA-N	0	3	312.417	2.072	10	0		DEAEHN
COC[C@H]1CCCN(Cc2ccc3c(c2)sc(=O)n3C)C1	ZINC000192624017	536529146	/nfs/dbraw/zinc/52/91/46/536529146.db2.gz	QLQMSLHZUMITDF-ZDUSSCGKSA-N	0	3	306.431	2.458	10	0		DEAEHN
CC(C)(C)n1cc(C(=O)N2CCCC[C@H](N3CCCC3)C2)nn1	ZINC000191463760	534945082	/nfs/dbraw/zinc/94/50/82/534945082.db2.gz	IVYDMRSAFCLSLQ-AWEZNQCLSA-N	0	3	319.453	2.124	10	0		DEAEHN
CCC(O)(CC)CNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248062699	535218703	/nfs/dbraw/zinc/21/87/03/535218703.db2.gz	PKAUSUYETFFABR-CVEARBPZSA-N	0	3	319.449	2.282	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)NCc1cnn(-c2ccccc2)c1	ZINC000261971141	535297988	/nfs/dbraw/zinc/29/79/88/535297988.db2.gz	ZATXHZOXKNQINM-MRXNPFEDSA-N	0	3	312.417	2.267	10	0		DEAEHN
CC(C)C(=O)N1CCC(NC(=O)[C@@H](N)CC2CCCCC2)CC1	ZINC000261894055	535372872	/nfs/dbraw/zinc/37/28/72/535372872.db2.gz	ODMFDAQHPVEEDB-INIZCTEOSA-N	0	3	323.481	2.047	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2CCCN(CC)C2)C12CCC2	ZINC000248043615	535389448	/nfs/dbraw/zinc/38/94/48/535389448.db2.gz	ULBGJKLRDCPLHG-BZUAXINKSA-N	0	3	323.481	2.460	10	0		DEAEHN
CCOc1ccccc1NC(=O)[C@@H](C)N1CCN2CCC[C@H]2C1	ZINC000247109562	535532377	/nfs/dbraw/zinc/53/23/77/535532377.db2.gz	IXYVPZORBUVXKI-CABCVRRESA-N	0	3	317.433	2.192	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccnn2[C@H](C)C2CC2)C1	ZINC000249462960	535578204	/nfs/dbraw/zinc/57/82/04/535578204.db2.gz	RIASGNARPSUPNH-OCCSQVGLSA-N	0	3	305.426	2.460	10	0		DEAEHN
CC[C@@H]1CN(CCc2ccc(OC)cc2)CCN1C[C@H](C)O	ZINC000247178751	535859975	/nfs/dbraw/zinc/85/99/75/535859975.db2.gz	NKGJYNLGUOBCMR-DOTOQJQBSA-N	0	3	306.450	2.015	10	0		DEAEHN
CCc1cccc(OCCN2CCN(C[C@H](C)O)[C@@H](C)C2)c1	ZINC000247120713	535906097	/nfs/dbraw/zinc/90/60/97/535906097.db2.gz	JRGFVHMHPYBXOR-HOTGVXAUSA-N	0	3	306.450	2.015	10	0		DEAEHN
CC[C@H](NC[C@H]1CCC2(CCOCC2)[C@@H]1O)c1nccn1C	ZINC000374791861	535911228	/nfs/dbraw/zinc/91/12/28/535911228.db2.gz	HZQCWLPTZLIJSX-QLFBSQMISA-N	0	3	307.438	2.029	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)[C@H]1Cc2ccccc2O1	ZINC000193402109	535939840	/nfs/dbraw/zinc/93/98/40/535939840.db2.gz	YYUNMDBVFVWXRP-IEBWSBKVSA-N	0	3	324.424	2.279	10	0		DEAEHN
CCn1c(C)nnc1CN1CC[C@H]2[C@@H](CCCN2C2CC2)C1	ZINC000246450957	535974957	/nfs/dbraw/zinc/97/49/57/535974957.db2.gz	DXNMMQQJNVZPBV-HOCLYGCPSA-N	0	3	303.454	2.055	10	0		DEAEHN
CN(Cc1cc2ccccc2o1)C(=O)[C@@H](N)C1CCOCC1	ZINC000261703791	536461654	/nfs/dbraw/zinc/46/16/54/536461654.db2.gz	BNSZVCOMPUIVGZ-INIZCTEOSA-N	0	3	302.374	2.145	10	0		DEAEHN
CN(Cc1ccccc1F)C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000261919713	536482631	/nfs/dbraw/zinc/48/26/31/536482631.db2.gz	RKQSDTUHEQFUCK-QIIPPGSGSA-N	0	3	320.408	2.317	10	0		DEAEHN
COc1ccc(CNC(=O)[C@H]2NCCCC2(C)C)cc1OC	ZINC000262489859	536888800	/nfs/dbraw/zinc/88/88/00/536888800.db2.gz	KWEFWRRNGJZKAD-OAHLLOKOSA-N	0	3	306.406	2.098	10	0		DEAEHN
CC(C)(C)OC(=O)NC[C@H]1CCC[C@@]2(C1)NCCc1nc[nH]c12	ZINC000724101887	563496417	/nfs/dbraw/zinc/49/64/17/563496417.db2.gz	RVRZWRHKXSIWJF-SJCJKPOMSA-N	0	3	320.437	2.466	10	0		DEAEHN
O=S(=O)(/C=C\c1ccccc1)N1CC[C@H](N2CCCC2)C1	ZINC000255494288	624845708	/nfs/dbraw/zinc/84/57/08/624845708.db2.gz	IQYBZMWXNVYLLI-OVHOFWQVSA-N	0	3	306.431	2.157	10	0		DEAEHN
COCC[C@@H](N)C(=O)N(C)Cc1cc(Cl)cc(Cl)c1	ZINC000052808808	625105898	/nfs/dbraw/zinc/10/58/98/625105898.db2.gz	YTFYKJYFWXMJGQ-GFCCVEGCSA-N	0	3	305.205	2.316	10	0		DEAEHN
O=C(Cc1ccc(Br)cc1)N[C@H]1CN2CCC1CC2	ZINC000222591459	636364015	/nfs/dbraw/zinc/36/40/15/636364015.db2.gz	ASSTUMJYNNPLSC-AWEZNQCLSA-N	0	3	323.234	2.202	10	0		DEAEHN
COC(=O)/C(C)=C/CN1CCCN(Cc2ccc(F)cc2)CC1	ZINC000746498982	638349273	/nfs/dbraw/zinc/34/92/73/638349273.db2.gz	AVNFJTNPKZPNHS-OVCLIPMQSA-N	0	3	320.408	2.453	10	0		DEAEHN
CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C/C=C(\C)C(=O)OC)C1	ZINC000746503937	638349906	/nfs/dbraw/zinc/34/99/06/638349906.db2.gz	QEJLPONOQLJZBM-IVBVFNMWSA-N	0	3	310.438	2.123	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@H]1CCCN(C/C=C(/C)C(=O)OC)C1	ZINC000746501444	638350117	/nfs/dbraw/zinc/35/01/17/638350117.db2.gz	LSHALLSWSXDMHK-FVIMBVCGSA-N	0	3	310.438	2.123	10	0		DEAEHN
COC(=O)/C(C)=C/CN(C)[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000746500334	638350315	/nfs/dbraw/zinc/35/03/15/638350315.db2.gz	SCDDIOJXNLVEBG-KADHNRKRSA-N	0	3	314.389	2.379	10	0		DEAEHN
COc1cc(C[NH2+]C2CC(OC)C2)cc(Br)c1[O-]	ZINC000230688993	646745206	/nfs/dbraw/zinc/74/52/06/646745206.db2.gz	UTMRQRAJYCSFPK-UHFFFAOYSA-N	0	3	316.195	2.430	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCc1nc2cc(F)ccc2n1C	ZINC000732108632	647542788	/nfs/dbraw/zinc/54/27/88/647542788.db2.gz	ACZQWWYRSSXQOU-OAHLLOKOSA-N	0	3	318.396	2.203	10	0		DEAEHN
COC(=O)CCNC(=O)CN[C@H](C)c1ccc(C(C)(C)C)cc1	ZINC000154370771	647995812	/nfs/dbraw/zinc/99/58/12/647995812.db2.gz	PNJSJKMHZVNWGX-CYBMUJFWSA-N	0	3	320.433	2.314	10	0		DEAEHN
O[C@H](CN[C@H]1COc2ccccc21)COCc1cccs1	ZINC000070529742	648943234	/nfs/dbraw/zinc/94/32/34/648943234.db2.gz	WBQUMRLSDUQZLV-DOMZBBRYSA-N	0	3	305.399	2.349	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@@H](CN[C@@H]2CCn3ccnc32)C1	ZINC000379176400	685390597	/nfs/dbraw/zinc/39/05/97/685390597.db2.gz	QRMFBHXDYMCFRN-QWHCGFSZSA-N	0	3	306.410	2.175	10	0		DEAEHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCCO[C@@H]2C)cc1	ZINC000192198698	684443986	/nfs/dbraw/zinc/44/39/86/684443986.db2.gz	AAGCBZHNUFUDSM-BYCMXARLSA-N	0	3	316.357	2.158	10	0		DEAEHN
O=C(CCOCC(F)F)O[C@H]1CCN(Cc2ccccc2)C1	ZINC000192234663	684445468	/nfs/dbraw/zinc/44/54/68/684445468.db2.gz	RXHFFSXXQVJJFN-AWEZNQCLSA-N	0	3	313.344	2.476	10	0		DEAEHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2ccnc(C#N)c2)cc1	ZINC000193530865	685042499	/nfs/dbraw/zinc/04/24/99/685042499.db2.gz	WKJLCNSMCPUBCR-INIZCTEOSA-N	0	3	318.336	2.477	10	0		DEAEHN
CC(C)(C)OC(=O)[C@@H]1CCN(C[C@H]2CC3(CCC3)C(=O)O2)C1	ZINC000248831723	685169096	/nfs/dbraw/zinc/16/90/96/685169096.db2.gz	ILAXHIZZXSOEIN-CHWSQXEVSA-N	0	3	309.406	2.136	10	0		DEAEHN
C[C@](O)(CN1CCC[C@@](C)(O)CC1)C(F)(F)C(F)(F)F	ZINC000724041751	777228957	/nfs/dbraw/zinc/22/89/57/777228957.db2.gz	OVVRXXACHZSVGY-ZJUUUORDSA-N	0	3	305.287	2.172	10	0		DEAEHN
C[C@H](O)[C@@H]1CCCN(C[C@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724061012	777233644	/nfs/dbraw/zinc/23/36/44/777233644.db2.gz	ICVYFHYHDVAJOS-AEJSXWLSSA-N	0	3	305.287	2.028	10	0		DEAEHN
COCC1CCN(C[C@](C)(O)C(F)(F)C(F)(F)F)CC1	ZINC000724110735	777243018	/nfs/dbraw/zinc/24/30/18/777243018.db2.gz	JLEHKKMQOGPOBY-JTQLQIEISA-N	0	3	305.287	2.293	10	0		DEAEHN
C[C@@H](N[C@H]1CON(C(=O)OC(C)(C)C)C1)[C@@H]1CCCCO1	ZINC000724660083	777442535	/nfs/dbraw/zinc/44/25/35/777442535.db2.gz	IPFHIHQPNSICER-UPJWGTAASA-N	0	3	300.399	2.085	10	0		DEAEHN
COC[C@H](C)OC(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000586474507	791871058	/nfs/dbraw/zinc/87/10/58/791871058.db2.gz	AGNVHNKOJXLFJA-AWEZNQCLSA-N	0	3	306.406	2.412	10	0		DEAEHN
COC1(CCNCc2cn(C)nc2Br)CCC1	ZINC000712482127	792190411	/nfs/dbraw/zinc/19/04/11/792190411.db2.gz	MOLJBNQZZSHIEZ-UHFFFAOYSA-N	0	3	302.216	2.231	10	0		DEAEHN
CC(C)(C)c1ncc(CNCC[C@@H]2CCCS2(=O)=O)s1	ZINC000714367896	792312067	/nfs/dbraw/zinc/31/20/67/792312067.db2.gz	WZFJRXRHWKKJDJ-LBPRGKRZSA-N	0	3	316.492	2.498	10	0		DEAEHN
C[C@@H](NCC1CC(NC(=O)OC(C)(C)C)C1)c1nccn1C	ZINC000715068025	792380471	/nfs/dbraw/zinc/38/04/71/792380471.db2.gz	RIGIFSUZKAHKCS-PNESKVBLSA-N	0	3	308.426	2.374	10	0		DEAEHN
c1ccc(-n2nnnc2CNC2C[C@H]3CC[C@@H](C2)S3)cc1	ZINC000403572445	801948133	/nfs/dbraw/zinc/94/81/33/801948133.db2.gz	RWRCDRDWOZKWNA-QXMXGUDHSA-N	0	3	301.419	2.179	10	0		DEAEHN
CCOC(CC(=O)N[C@H]1CCN(Cc2ccccc2)C1)OCC	ZINC000407421149	802216295	/nfs/dbraw/zinc/21/62/95/802216295.db2.gz	LLPCYWZHDQLGNC-INIZCTEOSA-N	0	3	320.433	2.166	10	0		DEAEHN
COC(C)(C)C[C@@H](C)NCc1cn(C)nc1Br	ZINC000720644462	1085807957	/nfs/dbraw/zinc/80/79/57/1085807957.db2.gz	CGMXMGSURZWBQB-SECBINFHSA-N	0	3	304.232	2.476	10	0		DEAEHN
C[C@@H](C[C@H]1CCOC1)NCc1cn(C)nc1Br	ZINC000720668138	1085836349	/nfs/dbraw/zinc/83/63/49/1085836349.db2.gz	AGRNURYHRWGNPL-VHSXEESVSA-N	0	3	302.216	2.087	10	0		DEAEHN
CO[C@@](C)(CNCc1cncnc1)COCc1ccccc1	ZINC000702798026	1086460541	/nfs/dbraw/zinc/46/05/41/1086460541.db2.gz	RISAKDPGWGFDEV-KRWDZBQOSA-N	0	3	301.390	2.188	10	0		DEAEHN
COC1(OC)CC[C@H]1NCCN(C(=O)OC(C)(C)C)C1CC1	ZINC000710948529	1086691771	/nfs/dbraw/zinc/69/17/71/1086691771.db2.gz	SNDRAXBIFHZBNR-CYBMUJFWSA-N	0	3	314.426	2.127	10	0		DEAEHN
CC1(C)C[NH2+]C[C@@H]1C(=O)Nc1cc(Br)ccc1[O-]	ZINC000711328109	1087065896	/nfs/dbraw/zinc/06/58/96/1087065896.db2.gz	ATBNYOUEAFFUTJ-SECBINFHSA-N	0	3	313.195	2.339	10	0		DEAEHN
Cn1cncc1CN[C@@]12CCC[C@@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000711640755	1087184688	/nfs/dbraw/zinc/18/46/88/1087184688.db2.gz	QHTOWTHFHGBVQK-WMLDXEAASA-N	0	3	320.437	2.442	10	0		DEAEHN
C[C@@H]1[C@@H](NC(=O)c2ccsc2Br)CCN1C	ZINC000719399077	1089086319	/nfs/dbraw/zinc/08/63/19/1089086319.db2.gz	YXJBYFNBIUOVFU-APPZFPTMSA-N	0	3	303.225	2.333	10	0		DEAEHN
O[C@H]1CCCC[C@@H]1N1CCN(c2nc3ccccc3o2)CC1	ZINC000179286514	1090496370	/nfs/dbraw/zinc/49/63/70/1090496370.db2.gz	RPTONQJAMOOVIQ-GJZGRUSLSA-N	0	3	301.390	2.253	10	0		DEAEHN
C[C@@H](O)[C@H](C)NCc1ccc(Br)cc1[N+](=O)[O-]	ZINC000387016613	1144509706	/nfs/dbraw/zinc/50/97/06/1144509706.db2.gz	ODIWEWFNMIPZGJ-JGVFFNPUSA-N	0	3	303.156	2.216	10	0		DEAEHN
CCN[C@@H](CSc1nnnn1C)c1ccccc1OCC	ZINC000081843745	192330469	/nfs/dbraw/zinc/33/04/69/192330469.db2.gz	WKBPVPNLPUOWTA-LBPRGKRZSA-N	0	3	307.423	2.052	10	0		DEAEHN
COC(=O)[C@](C)(NCCN(C)C)c1ccc(F)cc1Cl	ZINC000078901529	185126393	/nfs/dbraw/zinc/12/63/93/185126393.db2.gz	KVVUOKAFRBWZPT-CQSZACIVSA-N	0	3	302.777	2.019	10	0		DEAEHN
CCN[C@@H]1c2ccccc2CCC[C@H]1S(=O)(=O)CCOC	ZINC000081944016	192343943	/nfs/dbraw/zinc/34/39/43/192343943.db2.gz	FGZSHDCRALHLBK-HZPDHXFCSA-N	0	3	311.447	2.103	10	0		DEAEHN
CN[C@@H](CS(=O)(=O)CCOC)c1cccc2ccccc21	ZINC000081943610	192344741	/nfs/dbraw/zinc/34/47/41/192344741.db2.gz	BMTPBRNJQAWPRV-INIZCTEOSA-N	0	3	307.415	2.162	10	0		DEAEHN
C[C@@H](NCc1csc2ccccc12)C(=O)N1CCOCC1	ZINC000079304483	185164089	/nfs/dbraw/zinc/16/40/89/185164089.db2.gz	GZODROYOISQTNH-GFCCVEGCSA-N	0	3	304.415	2.238	10	0		DEAEHN
CS(=O)(=O)CCC[C@@H](N)c1cc(Br)cs1	ZINC000082720534	185196363	/nfs/dbraw/zinc/19/63/63/185196363.db2.gz	PXACEMULHNWJMX-MRVPVSSYSA-N	0	3	312.254	2.335	10	0		DEAEHN
COc1ccccc1CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000173189407	282188922	/nfs/dbraw/zinc/18/89/22/282188922.db2.gz	KCKNTWQRPAWTBM-DZGCQCFKSA-N	0	3	305.422	2.319	10	0		DEAEHN
C[C@H](N[C@@H]1CCC(=O)N[C@H]1C1CC1)C(=O)N1C[C@H](C)C[C@H](C)C1	ZINC000328861359	231369317	/nfs/dbraw/zinc/36/93/17/231369317.db2.gz	ARWLBJJDZYVCNF-CBAJHEILSA-N	0	3	321.465	2.367	10	0		DEAEHN
CCOCCN(C)[C@@H](CN)c1ccc(Br)s1	ZINC000087975926	185237527	/nfs/dbraw/zinc/23/75/27/185237527.db2.gz	YNFTXXGQFCWZHY-VIFPVBQESA-N	0	3	307.257	2.479	10	0		DEAEHN
O=S(=O)([N-]c1ccc(-c2ccccc2)cc1)[C@H]1CC[NH2+]C1	ZINC000088056700	185238427	/nfs/dbraw/zinc/23/84/27/185238427.db2.gz	UDQKNFAXZNTCFJ-INIZCTEOSA-N	0	3	302.399	2.457	10	0		DEAEHN
CC[C@@H](N)CS(=O)(=O)Cc1cc(Br)cs1	ZINC000088074847	185238805	/nfs/dbraw/zinc/23/88/05/185238805.db2.gz	PZUFLBBNXHFULP-MRVPVSSYSA-N	0	3	312.254	2.163	10	0		DEAEHN
C[C@@H](CNC(=O)N1CC[C@H](N(C)C)C1)c1ccc(F)cc1F	ZINC000173509822	282191077	/nfs/dbraw/zinc/19/10/77/282191077.db2.gz	CBNAZHHAXRIXBD-AAEUAGOBSA-N	0	3	311.376	2.414	10	0		DEAEHN
CN(Cc1ccccc1Br)c1ccnc(=NN)[nH]1	ZINC000087864160	185233885	/nfs/dbraw/zinc/23/38/85/185233885.db2.gz	MJVQUDNLGMTTHX-UHFFFAOYSA-N	0	3	308.183	2.161	10	0		DEAEHN
NN=c1cc(C(=O)Nc2c3nsnc3ccc2Cl)cc[nH]1	ZINC000088129548	185240335	/nfs/dbraw/zinc/24/03/35/185240335.db2.gz	GTJMJCOIGXDQMN-UHFFFAOYSA-N	0	3	320.765	2.278	10	0		DEAEHN
NNc1cc(C(=O)Nc2c3nsnc3ccc2Cl)ccn1	ZINC000088129548	185240336	/nfs/dbraw/zinc/24/03/36/185240336.db2.gz	GTJMJCOIGXDQMN-UHFFFAOYSA-N	0	3	320.765	2.278	10	0		DEAEHN
NNc1cc(C(=O)[N-]c2c3nsnc3ccc2Cl)cc[nH+]1	ZINC000088129548	185240337	/nfs/dbraw/zinc/24/03/37/185240337.db2.gz	GTJMJCOIGXDQMN-UHFFFAOYSA-N	0	3	320.765	2.278	10	0		DEAEHN
CCN[C@H]1CCN(c2cc(OC)ccc2Br)C1=O	ZINC000088320401	185245375	/nfs/dbraw/zinc/24/53/75/185245375.db2.gz	UYNWVSYRCVQLJF-NSHDSACASA-N	0	3	313.195	2.173	10	0		DEAEHN
CCn1ccnc1CN1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190471051	529569618	/nfs/dbraw/zinc/56/96/18/529569618.db2.gz	OCENMCMEKXKHBP-QGZVFWFLSA-N	0	3	313.449	2.252	10	0		DEAEHN
C[C@H](CN)S(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000088472085	185252335	/nfs/dbraw/zinc/25/23/35/185252335.db2.gz	UOEYRELWLFSHNH-LLVKDONJSA-N	0	3	302.399	2.347	10	0		DEAEHN
C[C@H](C(=O)Nc1ccccc1CN)N(C)CCC(F)(F)F	ZINC000088417637	185249323	/nfs/dbraw/zinc/24/93/23/185249323.db2.gz	GXLMTEVNDLYPMJ-SNVBAGLBSA-N	0	3	303.328	2.357	10	0		DEAEHN
C[NH2+][C@](C)(CCCCN1CCC[C@H](C(F)(F)F)C1)C(=O)[O-]	ZINC000088435388	185250430	/nfs/dbraw/zinc/25/04/30/185250430.db2.gz	NGCZHSXXQGPRKT-WCQYABFASA-N	0	3	310.360	2.494	10	0		DEAEHN
N[C@@](CO)(CN1CCC[C@H](C(F)(F)F)C1)c1ccccc1	ZINC000088439626	185250681	/nfs/dbraw/zinc/25/06/81/185250681.db2.gz	WXICJBTWNPPIBE-UONOGXRCSA-N	0	3	302.340	2.107	10	0		DEAEHN
CCN(C1CC1)S(=O)(=O)c1ccc(CNCC(C)C)o1	ZINC000088543619	185256856	/nfs/dbraw/zinc/25/68/56/185256856.db2.gz	GYJALAKMZINXBI-UHFFFAOYSA-N	0	3	300.424	2.198	10	0		DEAEHN
CN[C@H](Cc1ccc2ccccc2n1)C(C)(C)S(C)(=O)=O	ZINC000088519224	185254606	/nfs/dbraw/zinc/25/46/06/185254606.db2.gz	MHJUPTWJNKSWKR-OAHLLOKOSA-N	0	3	306.431	2.189	10	0		DEAEHN
CSCCC[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)(C)C)o1	ZINC000088551130	185257560	/nfs/dbraw/zinc/25/75/60/185257560.db2.gz	XCLAIAVLUDPXFJ-UHFFFAOYSA-N	0	3	320.480	2.199	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1sc2ncccc2c1N	ZINC000088643239	185261365	/nfs/dbraw/zinc/26/13/65/185261365.db2.gz	IVFHVQDUMURRME-SNVBAGLBSA-N	0	3	304.419	2.045	10	0		DEAEHN
Cc1ccc(C(N)=[NH2+])cc1[N-]S(=O)(=O)c1ccccc1C	ZINC000088716987	185263145	/nfs/dbraw/zinc/26/31/45/185263145.db2.gz	GRHZAFKYEANLAG-UHFFFAOYSA-N	0	3	303.387	2.388	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@@H]1S(=O)(=O)c1cccc(Cl)c1	ZINC000081982179	192349666	/nfs/dbraw/zinc/34/96/66/192349666.db2.gz	XPTQWDBTHQVZHO-KGLIPLIRSA-N	0	3	317.838	2.271	10	0		DEAEHN
CCCN[C@@H]1c2ccccc2C[C@@H]1S(=O)(=O)CCCOC	ZINC000081985394	192349788	/nfs/dbraw/zinc/34/97/88/192349788.db2.gz	HTOVQRYAHNLWFC-JKSUJKDBSA-N	0	3	311.447	2.103	10	0		DEAEHN
CCC[C@H](N)CS(=O)(=O)c1cccc(Br)c1	ZINC000081982564	192349936	/nfs/dbraw/zinc/34/99/36/192349936.db2.gz	DLJFDWCWKHSAQF-JTQLQIEISA-N	0	3	306.225	2.350	10	0		DEAEHN
c1ccc(C2(NCCOC3CCOCC3)CCOCC2)cc1	ZINC000625252714	365698567	/nfs/dbraw/zinc/69/85/67/365698567.db2.gz	WTVAOHGDHVIXDD-UHFFFAOYSA-N	0	3	305.418	2.478	10	0		DEAEHN
C[C@H](N[C@@H]1CCCS(=O)(=O)C1)c1ccccc1-n1cccn1	ZINC000090016374	185278133	/nfs/dbraw/zinc/27/81/33/185278133.db2.gz	MHVQAAQSVPAWPQ-UONOGXRCSA-N	0	3	319.430	2.100	10	0		DEAEHN
N[C@H]1COC[C@@H]1c1nc(-c2cc(Br)cs2)no1	ZINC000090364816	185292780	/nfs/dbraw/zinc/29/27/80/185292780.db2.gz	ZUDZIDCKPUASMF-BQBZGAKWSA-N	0	3	316.180	2.002	10	0		DEAEHN
CCN[C@H]1COC[C@H]1c1nc(Cc2ccc(Cl)cc2)no1	ZINC000090473348	185298476	/nfs/dbraw/zinc/29/84/76/185298476.db2.gz	QTBBVIFIGOYBNC-OLZOCXBDSA-N	0	3	307.781	2.406	10	0		DEAEHN
N[C@@H]1COC[C@@H]1C(=O)Nc1ccc(Cl)cc1C(F)(F)F	ZINC000090378667	185293503	/nfs/dbraw/zinc/29/35/03/185293503.db2.gz	CINDIXODOLJRCD-IONNQARKSA-N	0	3	308.687	2.271	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)C[C@@H]1CCCO1	ZINC000181335879	199282235	/nfs/dbraw/zinc/28/22/35/199282235.db2.gz	PQXRUPKQPZULHC-WBVHZDCISA-N	0	3	319.449	2.327	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)CSCC(F)(F)F	ZINC000090420374	185295289	/nfs/dbraw/zinc/29/52/89/185295289.db2.gz	BQHGZIZTWSBPQQ-SNVBAGLBSA-N	0	3	300.390	2.374	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1ccc2nc(SC)sc2c1	ZINC000090433008	185296134	/nfs/dbraw/zinc/29/61/34/185296134.db2.gz	YXPFUKYYRIFPKT-MWLCHTKSSA-N	0	3	323.443	2.191	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)N(C)Cc1cccc(Cl)c1Cl	ZINC000090434497	185296231	/nfs/dbraw/zinc/29/62/31/185296231.db2.gz	BDNIFCNOJVDLAZ-CMPLNLGQSA-N	0	3	317.216	2.186	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1ccc(F)c(C(F)(F)F)c1	ZINC000090436284	185296282	/nfs/dbraw/zinc/29/62/82/185296282.db2.gz	OKJBJMYJHIBZES-KCJUWKMLSA-N	0	3	306.259	2.017	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)N(C)Cc1cc(Cl)cc(Cl)c1	ZINC000090435296	185296421	/nfs/dbraw/zinc/29/64/21/185296421.db2.gz	GGFPMKRSCFOZFI-OLZOCXBDSA-N	0	3	317.216	2.186	10	0		DEAEHN
Cc1ccc(Br)cc1NC(=O)[C@]1(C)COC[C@@H]1N	ZINC000090588838	185305659	/nfs/dbraw/zinc/30/56/59/185305659.db2.gz	WTVOATUVHSNKHZ-WCQYABFASA-N	0	3	313.195	2.060	10	0		DEAEHN
Cc1ccc(NC(=O)[C@]2(C)COC[C@H]2N)cc1C(F)(F)F	ZINC000090601202	185306216	/nfs/dbraw/zinc/30/62/16/185306216.db2.gz	IKOCEQNUWKHGEL-DGCLKSJQSA-N	0	3	302.296	2.316	10	0		DEAEHN
C[C@@]1(c2nc(-c3cccc(Br)c3)no2)COC[C@@H]1N	ZINC000090573273	185304292	/nfs/dbraw/zinc/30/42/92/185304292.db2.gz	ASBOYPHYQXASTQ-GXFFZTMASA-N	0	3	324.178	2.114	10	0		DEAEHN
CN(C)C[C@@H]1CSCCCN1C(=O)c1ccc(F)c(F)c1	ZINC000090699866	185310335	/nfs/dbraw/zinc/31/03/35/185310335.db2.gz	DURZPAFHGSDVEC-GFCCVEGCSA-N	0	3	314.401	2.474	10	0		DEAEHN
CCN[C@H](Cc1c(C)nn(C)c1Cl)C(OCC)OCC	ZINC000167290451	197705966	/nfs/dbraw/zinc/70/59/66/197705966.db2.gz	AHMZYKUJMBRBKH-GFCCVEGCSA-N	0	3	303.834	2.302	10	0		DEAEHN
Nc1nc2cc(Br)cnc2n1[C@@H]1CN2CCC1CC2	ZINC000092575095	185326704	/nfs/dbraw/zinc/32/67/04/185326704.db2.gz	UOFXLGHDDNVCEM-LLVKDONJSA-N	0	3	322.210	2.043	10	0		DEAEHN
COCCC[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000181403934	199291699	/nfs/dbraw/zinc/29/16/99/199291699.db2.gz	XTFMNUHEARHJQS-WBVHZDCISA-N	0	3	306.450	2.338	10	0		DEAEHN
Cc1cc(CN[C@@H]2CN(C(C)C)C[C@@H]2C)ccc1S(C)(=O)=O	ZINC000095413094	185358002	/nfs/dbraw/zinc/35/80/02/185358002.db2.gz	BYVQXGCEJBHBSS-GOEBONIOSA-N	0	3	324.490	2.217	10	0		DEAEHN
C[C@H](NC[C@@H]1CCC(=O)N1)c1ccc(Br)s1	ZINC000070680156	539345394	/nfs/dbraw/zinc/34/53/94/539345394.db2.gz	MKHNRKMORWDBDX-YUMQZZPRSA-N	0	3	303.225	2.440	10	0		DEAEHN
CCN(CC)CC(=O)NCCN1CCc2c(Cl)cccc2C1	ZINC000189418434	282309107	/nfs/dbraw/zinc/30/91/07/282309107.db2.gz	BYKZTRLUGPVDLT-UHFFFAOYSA-N	0	3	323.868	2.156	10	0		DEAEHN
COC(=O)C(C)(C)[C@@H](NC[C@@H](O)CSC)c1ccccc1	ZINC000614567747	362410117	/nfs/dbraw/zinc/41/01/17/362410117.db2.gz	LJHWGIHIKOMXGL-KGLIPLIRSA-N	0	3	311.447	2.240	10	0		DEAEHN
CO[C@]1(C)C[C@H](NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)C1(C)C	ZINC000245481907	282391253	/nfs/dbraw/zinc/39/12/53/282391253.db2.gz	CVJNBOFXBANWPT-AYMQEEERSA-N	0	3	311.470	2.314	10	0		DEAEHN
COc1cc(C[NH2+]CC(C)(C)CO)cc(Br)c1[O-]	ZINC000124311315	539469124	/nfs/dbraw/zinc/46/91/24/539469124.db2.gz	FKOJRTDRJZLASK-UHFFFAOYSA-N	0	3	318.211	2.271	10	0		DEAEHN
COC(=O)[C@H](C)[C@H](NC[C@@H](O)COC(C)(C)C)c1ccccc1	ZINC000246894917	282468212	/nfs/dbraw/zinc/46/82/12/282468212.db2.gz	REIBRJGIBFJSBH-BMFZPTHFSA-N	0	3	323.433	2.302	10	0		DEAEHN
C[C@H]1CSCCN1c1ncc(Br)cc1CN	ZINC000069761623	190814383	/nfs/dbraw/zinc/81/43/83/190814383.db2.gz	FMSRVFYTUAIPJD-QMMMGPOBSA-N	0	3	302.241	2.245	10	0		DEAEHN
C[C@H](O)C(C)(C)NCc1cc2c(c(Br)c1)OCO2	ZINC000161141323	539589175	/nfs/dbraw/zinc/58/91/75/539589175.db2.gz	HALWYVGXXFLBDE-QMMMGPOBSA-N	0	3	316.195	2.427	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CC[C@@H](c2ccc(CO)cc2)C1	ZINC000616612008	362897958	/nfs/dbraw/zinc/89/79/58/362897958.db2.gz	LJNGSARUNODOIH-MRXNPFEDSA-N	0	3	320.433	2.493	10	0		DEAEHN
CC(C)(C)C(=O)N1CCC(c2nnc([C@H]3CCCN3)o2)CC1	ZINC000616575008	362893736	/nfs/dbraw/zinc/89/37/36/362893736.db2.gz	COXKLIIVOAHYMC-GFCCVEGCSA-N	0	3	306.410	2.246	10	0		DEAEHN
Cc1cc(C(C)C)nc(N2CCN(CC3CCOCC3)CC2)n1	ZINC000186552749	539676289	/nfs/dbraw/zinc/67/62/89/539676289.db2.gz	QLDHFTFYLCUEBJ-UHFFFAOYSA-N	0	3	318.465	2.457	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)c1coc(Br)c1	ZINC000186719866	539676471	/nfs/dbraw/zinc/67/64/71/539676471.db2.gz	LYWWSJZZMJXLKO-UHFFFAOYSA-N	0	3	301.184	2.208	10	0		DEAEHN
NC[C@@H](NC[C@@H]1CCCO1)c1ccc(Br)s1	ZINC000083774171	192383291	/nfs/dbraw/zinc/38/32/91/192383291.db2.gz	KMQFJYVDTSCPCA-DTWKUNHWSA-N	0	3	305.241	2.279	10	0		DEAEHN
CN1C[C@@H](NCc2ccc(Br)cc2F)CCC1=O	ZINC000084063325	192398751	/nfs/dbraw/zinc/39/87/51/192398751.db2.gz	KJSSBBCEWHCJJL-NSHDSACASA-N	0	3	315.186	2.299	10	0		DEAEHN
COc1cc2c(c(OC)c1)[C@H](CN)N(CCc1nccs1)C2	ZINC000071683948	191008000	/nfs/dbraw/zinc/00/80/00/191008000.db2.gz	UJCUSRZDNJYHQO-ZDUSSCGKSA-N	0	3	319.430	2.218	10	0		DEAEHN
Cn1c2cccc(S(C)(=O)=O)c2nc1C1(N)CCCCC1	ZINC000138213024	186015339	/nfs/dbraw/zinc/01/53/39/186015339.db2.gz	QKRGTBUIIWSPMH-UHFFFAOYSA-N	0	3	307.419	2.095	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)Nc2cnc(C3CC3)nc2)C1	ZINC000246569620	539765205	/nfs/dbraw/zinc/76/52/05/539765205.db2.gz	XJBXRMBMWQGPCQ-SMDDNHRTSA-N	0	3	303.410	2.204	10	0		DEAEHN
CCS(=O)(=O)CCC[C@H](N)c1ncccc1Br	ZINC000140363399	186026648	/nfs/dbraw/zinc/02/66/48/186026648.db2.gz	WQOVCYAHFGHSKK-JTQLQIEISA-N	0	3	321.240	2.059	10	0		DEAEHN
CC(C)CCCCNS(=O)(=O)c1c[nH]c(CNC2CC2)c1	ZINC000147921741	186042615	/nfs/dbraw/zinc/04/26/15/186042615.db2.gz	GCHQNFFRKFKNCK-UHFFFAOYSA-N	0	3	313.467	2.371	10	0		DEAEHN
CN(Cc1ccc(Cl)cc1Cl)C(=O)C1(N)CCOCC1	ZINC000149676834	186052008	/nfs/dbraw/zinc/05/20/08/186052008.db2.gz	XOYVHDACALXCPX-UHFFFAOYSA-N	0	3	317.216	2.460	10	0		DEAEHN
O=C1C[C@H](NC[C@H]2CCCS2)C(=O)N1C1CCCCCC1	ZINC000149831788	186052997	/nfs/dbraw/zinc/05/29/97/186052997.db2.gz	OIRIPVGWANOYJL-KGLIPLIRSA-N	0	3	310.463	2.322	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1	ZINC000150797605	186066327	/nfs/dbraw/zinc/06/63/27/186066327.db2.gz	GHTNVNBTGWJNEE-XJKSGUPXSA-N	0	3	317.433	2.032	10	0		DEAEHN
CCN(CCCN[C@@H]1CSc2ccccc21)S(C)(=O)=O	ZINC000155831887	186116183	/nfs/dbraw/zinc/11/61/83/186116183.db2.gz	IWQPJYUPSAFJOB-CYBMUJFWSA-N	0	3	314.476	2.095	10	0		DEAEHN
Fc1cccc(COC[C@@H]2CNCCO2)c1Br	ZINC000163958449	186143616	/nfs/dbraw/zinc/14/36/16/186143616.db2.gz	IQZDFMNKRAJCDP-JTQLQIEISA-N	0	3	304.159	2.093	10	0		DEAEHN
Cc1ccc(Br)c(NC(=O)[C@@]2(C)COC[C@@H]2N)c1	ZINC000163966609	186143968	/nfs/dbraw/zinc/14/39/68/186143968.db2.gz	FMSDPADXUWQUGQ-AAEUAGOBSA-N	0	3	313.195	2.060	10	0		DEAEHN
CCCNc1nc(N(C)C)nc(N2C[C@H](C)S[C@@H](C)C2)n1	ZINC000155889855	186120572	/nfs/dbraw/zinc/12/05/72/186120572.db2.gz	BRIANOLUFKVTSO-QWRGUYRKSA-N	0	3	310.471	2.090	10	0		DEAEHN
Cc1ccc([S@](=O)CC(=O)Nc2cccc(CN)c2)cc1	ZINC000155916083	186122816	/nfs/dbraw/zinc/12/28/16/186122816.db2.gz	KLSQQBWQOAIBKX-NRFANRHFSA-N	0	3	302.399	2.200	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1cccc(Br)c1	ZINC000159570078	186127973	/nfs/dbraw/zinc/12/79/73/186127973.db2.gz	OCSFZDSRVQIGKG-NSHDSACASA-N	0	3	301.184	2.142	10	0		DEAEHN
COc1cc(CNC[C@@H](C)[S@@](C)=O)c(SC)cc1OC	ZINC000159610313	186130531	/nfs/dbraw/zinc/13/05/31/186130531.db2.gz	HTLVTRIQQCIWKB-SBKAZYGRSA-N	0	3	317.476	2.282	10	0		DEAEHN
Cc1ccccc1CNC(=O)CN(C)[C@@]1(CO)CC[C@H](C)C1	ZINC000187990131	186240764	/nfs/dbraw/zinc/24/07/64/186240764.db2.gz	CCTGEXIOFKZYBH-KSSFIOAISA-N	0	3	304.434	2.094	10	0		DEAEHN
CCN1CC[C@@H](N(C)C(=O)C(=O)c2ccccc2OC)[C@H](C)C1	ZINC000186047414	186235246	/nfs/dbraw/zinc/23/52/46/186235246.db2.gz	QILLFFVIINWFDK-UKRRQHHQSA-N	0	3	318.417	2.067	10	0		DEAEHN
O=C(Nc1ccc2c(c1)CCCO2)N1CCN2CCC[C@H]2C1	ZINC000171892558	198003206	/nfs/dbraw/zinc/00/32/06/198003206.db2.gz	OOMSBIHIFGBSMV-HNNXBMFYSA-N	0	3	301.390	2.324	10	0		DEAEHN
CCOc1ccccc1CNC(=O)N1CCN2CCC[C@H]2C1	ZINC000171903839	198005174	/nfs/dbraw/zinc/00/51/74/198005174.db2.gz	KFYVXPRZLCNSSF-HNNXBMFYSA-N	0	3	303.406	2.075	10	0		DEAEHN
O=C(NCc1cccc2cccnc21)N1CCN2CCC[C@@H]2C1	ZINC000171905213	198005492	/nfs/dbraw/zinc/00/54/92/198005492.db2.gz	NIAHQOORSDUFKT-MRXNPFEDSA-N	0	3	310.401	2.224	10	0		DEAEHN
O=C(NC[C@@H]1CCOc2ccccc21)N1CCN2CCC[C@@H]2C1	ZINC000171908096	198006192	/nfs/dbraw/zinc/00/61/92/198006192.db2.gz	DHBRXNQQOMPBPE-LSDHHAIUSA-N	0	3	315.417	2.042	10	0		DEAEHN
O=C(NC[C@H]1CCOc2ccccc21)N1CCN2CCC[C@@H]2C1	ZINC000171908097	198006307	/nfs/dbraw/zinc/00/63/07/198006307.db2.gz	DHBRXNQQOMPBPE-HUUCEWRRSA-N	0	3	315.417	2.042	10	0		DEAEHN
CCc1nnc(CN2CCN(C3CCC(C)CC3)CC2)n1C	ZINC000172011217	198025459	/nfs/dbraw/zinc/02/54/59/198025459.db2.gz	HKHZPYPEALYUOJ-UHFFFAOYSA-N	0	3	305.470	2.074	10	0		DEAEHN
COCCOc1ccc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1	ZINC000172058205	198033363	/nfs/dbraw/zinc/03/33/63/198033363.db2.gz	RPKSANWGWUISAN-GDBMZVCRSA-N	0	3	318.417	2.021	10	0		DEAEHN
CC(=O)c1ccccc1OCCN1C[C@H]2CCCN2C[C@H]1C	ZINC000172081933	198036852	/nfs/dbraw/zinc/03/68/52/198036852.db2.gz	HGDGBSHEGUKFJG-GDBMZVCRSA-N	0	3	302.418	2.437	10	0		DEAEHN
C[C@H](NC(=O)C(=O)Nc1cccc(CN(C)C)c1)C1CCCC1	ZINC000172247951	198065146	/nfs/dbraw/zinc/06/51/46/198065146.db2.gz	MJHITJKLYITTGK-ZDUSSCGKSA-N	0	3	317.433	2.382	10	0		DEAEHN
COc1ccc(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000173189958	198193677	/nfs/dbraw/zinc/19/36/77/198193677.db2.gz	POTFUWOQRXJPBM-ZFWWWQNUSA-N	0	3	305.422	2.319	10	0		DEAEHN
COc1ccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1	ZINC000173189908	198194001	/nfs/dbraw/zinc/19/40/01/198194001.db2.gz	POTFUWOQRXJPBM-UKRRQHHQSA-N	0	3	305.422	2.319	10	0		DEAEHN
C[C@H](CNC(=O)N1CCN2CCC[C@@H]2C1)Cc1cccs1	ZINC000173505078	198221839	/nfs/dbraw/zinc/22/18/39/198221839.db2.gz	HGQSLFKSPBEKIY-UONOGXRCSA-N	0	3	307.463	2.416	10	0		DEAEHN
CC(=O)CCN(C)C[C@H](O)COc1ccccc1C(F)(F)F	ZINC000173531286	198224759	/nfs/dbraw/zinc/22/47/59/198224759.db2.gz	UXGVSOWZGKTGEX-LBPRGKRZSA-N	0	3	319.323	2.356	10	0		DEAEHN
CC(C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000174018391	198281763	/nfs/dbraw/zinc/28/17/63/198281763.db2.gz	MAEURIOJRYPCJE-KRWDZBQOSA-N	0	3	319.449	2.140	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCCOc2cccc(F)c2)CCN1C	ZINC000174046740	198284961	/nfs/dbraw/zinc/28/49/61/198284961.db2.gz	QKUKEUZEGNXCIF-DZGCQCFKSA-N	0	3	323.412	2.329	10	0		DEAEHN
O=C(NCCc1c(F)cccc1F)N1CC[C@@H](N2CC=CC2)C1	ZINC000174131662	198295679	/nfs/dbraw/zinc/29/56/79/198295679.db2.gz	KFUDXDRRZJQKGI-CYBMUJFWSA-N	0	3	321.371	2.163	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC(=O)C2CCN(C)CC2)c1	ZINC000174442221	198335496	/nfs/dbraw/zinc/33/54/96/198335496.db2.gz	XMKKJQCJERYCKF-LBPRGKRZSA-N	0	3	306.406	2.223	10	0		DEAEHN
COC[C@H](NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1)c1ccccc1	ZINC000174628116	198361248	/nfs/dbraw/zinc/36/12/48/198361248.db2.gz	DIXIQVKSMDXJOT-UAGQMJEPSA-N	0	3	319.449	2.498	10	0		DEAEHN
CCCN(C)CC(=O)N[C@H](C)Cc1ccc(OC)c(OC)c1	ZINC000359311829	535255212	/nfs/dbraw/zinc/25/52/12/535255212.db2.gz	NJVDIKDOTAZLMT-CYBMUJFWSA-N	0	3	308.422	2.093	10	0		DEAEHN
O=C1CC[C@@H](CN[C@@H]2CCc3sc(Br)cc32)N1	ZINC000384028237	540125449	/nfs/dbraw/zinc/12/54/49/540125449.db2.gz	KZDBJLOGBBSGKP-IONNQARKSA-N	0	3	315.236	2.366	10	0		DEAEHN
COc1c(C)cc(CN2CCC[C@H](N3CCNC3=O)C2)cc1C	ZINC000092188591	355619628	/nfs/dbraw/zinc/61/96/28/355619628.db2.gz	VKISIYSCKFWLRO-INIZCTEOSA-N	0	3	317.433	2.302	10	0		DEAEHN
C[C@@H](CO)[C@H](C)NCc1cc2c(c(Br)c1)OCO2	ZINC000077423441	191712423	/nfs/dbraw/zinc/71/24/23/191712423.db2.gz	BYNJJJNKVLQFRW-IUCAKERBSA-N	0	3	316.195	2.284	10	0		DEAEHN
COc1ccc(OC)c([C@@H](C)NC(=O)NC[C@H]2CCCN2C)c1	ZINC000139416448	355876918	/nfs/dbraw/zinc/87/69/18/355876918.db2.gz	OZBYDHYZSYCXGO-CHWSQXEVSA-N	0	3	321.421	2.158	10	0		DEAEHN
COCc1ccc(C(=O)N[C@H](Cc2ccccc2)CN(C)C)o1	ZINC000132202128	355851011	/nfs/dbraw/zinc/85/10/11/355851011.db2.gz	JJTRRRKSBAJYDY-OAHLLOKOSA-N	0	3	316.401	2.329	10	0		DEAEHN
CN(CCNC(=O)NCc1cscn1)Cc1ccccc1	ZINC000171169645	355997067	/nfs/dbraw/zinc/99/70/67/355997067.db2.gz	VEJFZGOTUXXYDF-UHFFFAOYSA-N	0	3	304.419	2.074	10	0		DEAEHN
CCC[C@H](C)CN1CCN([C@H](C)C(=O)NC2CCCC2)CC1	ZINC000180046540	356040927	/nfs/dbraw/zinc/04/09/27/356040927.db2.gz	KMJRNHWBRONHDG-JKSUJKDBSA-N	0	3	309.498	2.488	10	0		DEAEHN
C[C@H](CC(=O)N(C)Cc1ccccc1Cl)NC1(CO)CC1	ZINC000180053360	356041219	/nfs/dbraw/zinc/04/12/19/356041219.db2.gz	CPZIILJCPFZUJJ-GFCCVEGCSA-N	0	3	310.825	2.192	10	0		DEAEHN
COc1cccc(-c2ccc(=O)n(CCN3CCCCC3)n2)c1	ZINC000005400342	181239580	/nfs/dbraw/zinc/23/95/80/181239580.db2.gz	GJFUDYFKMXYCBY-UHFFFAOYSA-N	0	3	313.401	2.405	10	0		DEAEHN
CC(C)Oc1cccc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)n1	ZINC000179116445	356015268	/nfs/dbraw/zinc/01/52/68/356015268.db2.gz	QLIQHWXWZLEMJR-ZIAGYGMSSA-N	0	3	305.422	2.424	10	0		DEAEHN
CC(C)[C@H](C)CNC(=O)NCc1ccnc(OCCN(C)C)c1	ZINC000179375882	356024610	/nfs/dbraw/zinc/02/46/10/356024610.db2.gz	URNOHGCUPOSFPV-CQSZACIVSA-N	0	3	322.453	2.113	10	0		DEAEHN
CCC(CC)[C@@H]1C[C@@H](NC(=O)NC[C@@H]2CCCN2C)CCO1	ZINC000181412324	356080524	/nfs/dbraw/zinc/08/05/24/356080524.db2.gz	FILFITAQTFKLBM-JYJNAYRXSA-N	0	3	311.470	2.364	10	0		DEAEHN
CC(C)(C)OC(=O)CCCCN1CC[C@@](O)(C(F)(F)F)C1	ZINC000181965518	356102430	/nfs/dbraw/zinc/10/24/30/356102430.db2.gz	WZENSDAWXCLNKK-ZDUSSCGKSA-N	0	3	311.344	2.498	10	0		DEAEHN
COc1ccc([C@H](C)N[C@@H](C)C[S@@](C)=O)cc1NC(C)=O	ZINC000184307405	356189458	/nfs/dbraw/zinc/18/94/58/356189458.db2.gz	HHCZEVZYXNGXKS-ZPMVXHMNSA-N	0	3	312.435	2.071	10	0		DEAEHN
CC[C@@H](C)N1CCN(C[C@H](C(N)=S)c2ccccc2)CC1	ZINC000080797684	192192071	/nfs/dbraw/zinc/19/20/71/192192071.db2.gz	FTZHULBHXQHDCN-ZBFHGGJFSA-N	0	3	305.491	2.472	10	0		DEAEHN
CCOC(=O)[C@@]1(C(C)C)CCN(CC(=O)NC(C)(C)CC)C1	ZINC000194855757	356245599	/nfs/dbraw/zinc/24/55/99/356245599.db2.gz	YCRPINAXGUTAPZ-KRWDZBQOSA-N	0	3	312.454	2.202	10	0		DEAEHN
C[C@@H]1CCC[C@@](N)(C(=O)NC[C@@H](c2cccs2)N(C)C)C1	ZINC000080937355	192203794	/nfs/dbraw/zinc/20/37/94/192203794.db2.gz	JIVLGLAXPZTBQI-WWGRRREGSA-N	0	3	309.479	2.375	10	0		DEAEHN
NCc1cc(I)ncc1C(F)(F)F	ZINC000307011408	356406188	/nfs/dbraw/zinc/40/61/88/356406188.db2.gz	JVYHJHZDNYQVIS-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
CCN1CCC[C@H](Nc2ccc3nnc(C(F)(F)F)n3n2)C1	ZINC000319778480	356442526	/nfs/dbraw/zinc/44/25/26/356442526.db2.gz	RPFPYCOVKRKCPW-VIFPVBQESA-N	0	3	314.315	2.039	10	0		DEAEHN
Cc1nn(C)c(Cl)c1CN(C)C[C@H]1CCc2nccn2C1	ZINC000328655434	356466808	/nfs/dbraw/zinc/46/68/08/356466808.db2.gz	YKKOFDLJMSWSPB-GFCCVEGCSA-N	0	3	307.829	2.273	10	0		DEAEHN
CC[C@@H]([NH2+]Cc1cc(Br)c([O-])c(OC)c1)[C@@H](C)O	ZINC000386718958	356698019	/nfs/dbraw/zinc/69/80/19/356698019.db2.gz	RMXPUIUEVNTNPT-LDYMZIIASA-N	0	3	318.211	2.412	10	0		DEAEHN
CN(Cc1ccc(Br)cc1)C[C@H]1CN(C)CCO1	ZINC000404187783	356732396	/nfs/dbraw/zinc/73/23/96/356732396.db2.gz	BGAYRRQZCRAQOS-CQSZACIVSA-N	0	3	313.239	2.212	10	0		DEAEHN
CCC[C@@H](NC(=O)NCCNc1ccncc1)c1ccccn1	ZINC000591605779	357742621	/nfs/dbraw/zinc/74/26/21/357742621.db2.gz	UMPMCFOFVPQZOU-MRXNPFEDSA-N	0	3	313.405	2.151	10	0		DEAEHN
CN1CC[C@@H](NC(=O)c2ccc(NC=O)cc2)[C@@H]1c1ccccc1	ZINC000180120571	199119599	/nfs/dbraw/zinc/11/95/99/199119599.db2.gz	JOTUAVSWHCGFET-MSOLQXFVSA-N	0	3	323.396	2.430	10	0		DEAEHN
COc1cc([C@@H](C)NC[C@H]2CN(C)CCO2)ccc1SC	ZINC000180498474	199166937	/nfs/dbraw/zinc/16/69/37/199166937.db2.gz	CRCSMUQUTKBLJY-OCCSQVGLSA-N	0	3	310.463	2.398	10	0		DEAEHN
COc1cc(C)c([C@H](C)N[C@@H]2CCc3ncnn3C2)cc1OC	ZINC000180606176	199183466	/nfs/dbraw/zinc/18/34/66/199183466.db2.gz	RKHBFTAURRYPED-QWHCGFSZSA-N	0	3	316.405	2.269	10	0		DEAEHN
CC[C@@H](C)Oc1cc(CNC(=O)N2CC[C@H](N(C)C)C2)ccn1	ZINC000180668236	199193774	/nfs/dbraw/zinc/19/37/74/199193774.db2.gz	ANORSKXMOMAEAU-HIFRSBDPSA-N	0	3	320.437	2.104	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@@H](Cc2ccccc2)C1)N(C)C	ZINC000181181746	199261846	/nfs/dbraw/zinc/26/18/46/199261846.db2.gz	UJAUVSMJVBNHCZ-DLBZAZTESA-N	0	3	304.434	2.187	10	0		DEAEHN
CNCc1sc2ccccc2c1S(=O)(=O)N[C@@H]1C[C@H]1C	ZINC000089024290	192702760	/nfs/dbraw/zinc/70/27/60/192702760.db2.gz	QROWJLYKTZTCSP-MWLCHTKSSA-N	0	3	310.444	2.307	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N(S(=O)(=O)c2cc(CN)ccc2F)C1	ZINC000089050698	192721697	/nfs/dbraw/zinc/72/16/97/192721697.db2.gz	IUBKENOLOJRWPU-GHMZBOCLSA-N	0	3	300.399	2.094	10	0		DEAEHN
Cc1ccc(Cl)c(OC[C@@H](O)CN(C)CC2(CO)CC2)c1	ZINC000186758189	200005542	/nfs/dbraw/zinc/00/55/42/200005542.db2.gz	PARCDZLYAWWJJH-ZDUSSCGKSA-N	0	3	313.825	2.092	10	0		DEAEHN
NC(=O)c1ccc(CN2C[C@@H](c3ccsc3)[C@H](CO)C2)cc1	ZINC000188067731	200188685	/nfs/dbraw/zinc/18/86/85/200188685.db2.gz	ANJZEWUWDSTEQJ-HOTGVXAUSA-N	0	3	316.426	2.055	10	0		DEAEHN
CO[C@H](C)c1cccc(NC(=O)c2n[nH]c3c2CNCC3)c1	ZINC000188503370	200256978	/nfs/dbraw/zinc/25/69/78/200256978.db2.gz	BTMKZDORQLZOEW-SNVBAGLBSA-N	0	3	300.362	2.015	10	0		DEAEHN
COCc1cccc(CC(=O)N[C@H](CC(C)C)CN(C)C)c1	ZINC000188619387	200275998	/nfs/dbraw/zinc/27/59/98/200275998.db2.gz	MYOGQSSFTNCEIK-QGZVFWFLSA-N	0	3	306.450	2.468	10	0		DEAEHN
CC(C)n1cc(C(=O)N[C@H](CN(C)C)c2ccccc2)cn1	ZINC000188719122	200293080	/nfs/dbraw/zinc/29/30/80/200293080.db2.gz	ZUMHLEHNDTWPRH-MRXNPFEDSA-N	0	3	300.406	2.497	10	0		DEAEHN
CC(C)n1cc(C(=O)N[C@@H](CN(C)C)c2ccccc2)cn1	ZINC000188719100	200292686	/nfs/dbraw/zinc/29/26/86/200292686.db2.gz	ZUMHLEHNDTWPRH-INIZCTEOSA-N	0	3	300.406	2.497	10	0		DEAEHN
NCc1cc(I)cc(C(F)(F)F)n1	ZINC000095766790	283527430	/nfs/dbraw/zinc/52/74/30/283527430.db2.gz	IFVTYXICSYYUND-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)C1CCN(Cc2ccnc(N)c2)CC1	ZINC000193323457	201029927	/nfs/dbraw/zinc/02/99/27/201029927.db2.gz	USBLOGCBAZFOBN-ZDUSSCGKSA-N	0	3	304.438	2.037	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2nc3cccnc3s2)CCN1C	ZINC000193958823	201153362	/nfs/dbraw/zinc/15/33/62/201153362.db2.gz	WQSNDJRXJXVPHF-GHMZBOCLSA-N	0	3	304.419	2.246	10	0		DEAEHN
C=Cn1cc(CNC2CCN(C(=O)c3ccccc3)CC2)cn1	ZINC000194185934	201193414	/nfs/dbraw/zinc/19/34/14/201193414.db2.gz	HFUIVGUTWOXPEY-UHFFFAOYSA-N	0	3	310.401	2.378	10	0		DEAEHN
Cn1cncc1[C@@H]1C[C@H](NCc2cccc3c2OCO3)CCO1	ZINC000275399913	212309607	/nfs/dbraw/zinc/30/96/07/212309607.db2.gz	CLEHTMPPIBJAKN-CJNGLKHVSA-N	0	3	315.373	2.159	10	0		DEAEHN
O=C(C[C@H]1CNCCO1)Nc1cc(Cl)cc2cccnc21	ZINC000091299705	193034306	/nfs/dbraw/zinc/03/43/06/193034306.db2.gz	AJHIXBHDXCSKOL-LBPRGKRZSA-N	0	3	305.765	2.205	10	0		DEAEHN
CN(CC1CC(O)C1)[C@H](CN)c1cc(Br)cs1	ZINC000091450817	193057842	/nfs/dbraw/zinc/05/78/42/193057842.db2.gz	HVIJZDSYGXNBHD-BOBPJJCASA-N	0	3	319.268	2.213	10	0		DEAEHN
CC(C)(C)NCc1cnn([C@H]2CCS(=O)(=O)C2)c1C(F)F	ZINC000091336114	193042215	/nfs/dbraw/zinc/04/22/15/193042215.db2.gz	QCEJIMCCRIEXGW-JTQLQIEISA-N	0	3	321.393	2.068	10	0		DEAEHN
CCCc1c(CNC(C)(C)C)cnn1CCS(=O)(=O)CC	ZINC000091339760	193042927	/nfs/dbraw/zinc/04/29/27/193042927.db2.gz	MSABDLWJRBPUSN-UHFFFAOYSA-N	0	3	315.483	2.158	10	0		DEAEHN
CCCC(CCC)(C(N)=S)C(=O)N1CCC[C@@H](N(C)C)C1	ZINC000091392134	193050755	/nfs/dbraw/zinc/05/07/55/193050755.db2.gz	ATOHCNZTXUNEHU-CYBMUJFWSA-N	0	3	313.511	2.412	10	0		DEAEHN
COCCN1C(=O)[C@H]2CC[C@@H]1CN(CCCc1ccccc1)C2	ZINC000091586023	193075899	/nfs/dbraw/zinc/07/58/99/193075899.db2.gz	ZSMKHXUVTJHBOH-ZWKOTPCHSA-N	0	3	316.445	2.188	10	0		DEAEHN
Nc1nc2cc(Cl)ccc2n1C[C@@H]1CN2CCC[C@@H]2CO1	ZINC000091675130	193088846	/nfs/dbraw/zinc/08/88/46/193088846.db2.gz	KTXQRDZPAFJYGW-NEPJUHHUSA-N	0	3	306.797	2.135	10	0		DEAEHN
C(NC1=NC2(CS1)CCCCC2)[C@@H]1CN2CCC[C@@H]2CO1	ZINC000091675428	193089134	/nfs/dbraw/zinc/08/91/34/193089134.db2.gz	QLXXBDNCSDOVHX-ZIAGYGMSSA-N	0	3	309.479	2.245	10	0		DEAEHN
CC(C)CCCNC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000091845870	193116705	/nfs/dbraw/zinc/11/67/05/193116705.db2.gz	DCXUXKDPMDCDOS-QGZVFWFLSA-N	0	3	324.513	2.234	10	0		DEAEHN
CCCN(CCC)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115508	193163336	/nfs/dbraw/zinc/16/33/36/193163336.db2.gz	UQLZMMQSXOMMTO-UHFFFAOYSA-N	0	3	302.415	2.356	10	0		DEAEHN
CCN(C1CCCC1)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115670	193163343	/nfs/dbraw/zinc/16/33/43/193163343.db2.gz	RPURTZJLBZSZKA-UHFFFAOYSA-N	0	3	314.426	2.498	10	0		DEAEHN
CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092116033	193163891	/nfs/dbraw/zinc/16/38/91/193163891.db2.gz	UQVHZTYWWUPSCS-UHFFFAOYSA-N	0	3	312.341	2.249	10	0		DEAEHN
Cc1cccc(N(C)S(=O)(=O)c2ccc(CN)cc2F)c1	ZINC000092116035	193164579	/nfs/dbraw/zinc/16/45/79/193164579.db2.gz	KNWGKVSLRIUOOJ-UHFFFAOYSA-N	0	3	308.378	2.418	10	0		DEAEHN
c1c(CNCCCc2ccccc2)nnn1C[C@H]1CCOC1	ZINC000631031540	367977294	/nfs/dbraw/zinc/97/72/94/367977294.db2.gz	AATQWCUBKCHLKT-MRXNPFEDSA-N	0	3	300.406	2.037	10	0		DEAEHN
c1ccc([C@@H](C[C@@H]2CCOC2)NC2CN(c3ccncn3)C2)cc1	ZINC000631747331	368367541	/nfs/dbraw/zinc/36/75/41/368367541.db2.gz	FEKSICIEXTWAFL-MAUKXSAKSA-N	0	3	324.428	2.423	10	0		DEAEHN
C([NH2+]C1CCC2(CCCO2)CC1)c1nnc(C2CCOCC2)[n-]1	ZINC000631693292	368346052	/nfs/dbraw/zinc/34/60/52/368346052.db2.gz	KIESVROEQZFJSC-UHFFFAOYSA-N	0	3	320.437	2.280	10	0		DEAEHN
C(NC1CCC2(CCCO2)CC1)c1nnc(C2CCOCC2)[nH]1	ZINC000631693292	368346057	/nfs/dbraw/zinc/34/60/57/368346057.db2.gz	KIESVROEQZFJSC-UHFFFAOYSA-N	0	3	320.437	2.280	10	0		DEAEHN
COC[C@@H](O)CN(C)Cc1cc(C)c(Br)s1	ZINC000092256176	193182265	/nfs/dbraw/zinc/18/22/65/193182265.db2.gz	OMYSVBGYJYOOOJ-VIFPVBQESA-N	0	3	308.241	2.258	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)Nc1cccc(-c2nnc(C)n2C)c1	ZINC000262522678	203317662	/nfs/dbraw/zinc/31/76/62/203317662.db2.gz	FMAURVLZJTZLDF-MRXNPFEDSA-N	0	3	301.394	2.247	10	0		DEAEHN
Cc1c(CN)cccc1S(=O)(=O)N(C)CCc1cccs1	ZINC000093294829	193226892	/nfs/dbraw/zinc/22/68/92/193226892.db2.gz	PJXKBCNCUGYPNT-UHFFFAOYSA-N	0	3	324.471	2.378	10	0		DEAEHN
Nc1cnc(N2CCCN3CCC[C@@H]3C2)c(Br)c1	ZINC000093433134	193250832	/nfs/dbraw/zinc/25/08/32/193250832.db2.gz	DOPDZXUWDKBSBU-LLVKDONJSA-N	0	3	311.227	2.101	10	0		DEAEHN
CCN[C@]1(C(=O)[O-])CC[C@H]([N@H+](CCOC)C(CC)CC)C1	ZINC000093828207	193313604	/nfs/dbraw/zinc/31/36/04/193313604.db2.gz	WUFMGYKPQQEYHE-GOEBONIOSA-N	0	3	300.443	2.109	10	0		DEAEHN
CCN[C@]1(C(=O)[O-])CC[C@H]([N@@H+](CCOC)C(CC)CC)C1	ZINC000093828207	193313606	/nfs/dbraw/zinc/31/36/06/193313606.db2.gz	WUFMGYKPQQEYHE-GOEBONIOSA-N	0	3	300.443	2.109	10	0		DEAEHN
COc1ccccc1S[C@@H]1CC[C@](NC2CC2)(C(N)=O)C1	ZINC000093851853	193319158	/nfs/dbraw/zinc/31/91/58/193319158.db2.gz	IFOUAXFZJRBZAN-MLGOLLRUSA-N	0	3	306.431	2.316	10	0		DEAEHN
NC(=O)[C@]1(NC2CC2)CC[C@H](Sc2ccc(Cl)cn2)C1	ZINC000093854040	193319956	/nfs/dbraw/zinc/31/99/56/193319956.db2.gz	KIAYUTZGLCQHDU-FZMZJTMJSA-N	0	3	311.838	2.356	10	0		DEAEHN
CCCNCc1cc(F)c(OCCS(=O)(=O)CC)c(F)c1	ZINC000094347279	193363544	/nfs/dbraw/zinc/36/35/44/193363544.db2.gz	SOSIAZPDCSASGZ-UHFFFAOYSA-N	0	3	321.389	2.278	10	0		DEAEHN
CC(C)CNCc1cn([C@H]2CCO[C@@]3(CCSC3)C2)nn1	ZINC000094419121	193368769	/nfs/dbraw/zinc/36/87/69/193368769.db2.gz	AKJCFJCJPAVLMJ-GJZGRUSLSA-N	0	3	310.467	2.251	10	0		DEAEHN
CCC[C@H]1CN(CCCS(C)(=O)=O)c2ccccc2CN1	ZINC000094421009	193368918	/nfs/dbraw/zinc/36/89/18/193368918.db2.gz	LAOHKMAKFZCCGX-HNNXBMFYSA-N	0	3	310.463	2.200	10	0		DEAEHN
CN(c1nc(Br)cn2ccnc12)C1CCN(C)CC1	ZINC000094486228	193373048	/nfs/dbraw/zinc/37/30/48/193373048.db2.gz	HCKZHNIYDVILHM-UHFFFAOYSA-N	0	3	324.226	2.022	10	0		DEAEHN
C[C@H](CN1CCCC1)Nc1nc(Br)cn2ccnc12	ZINC000094488887	193373208	/nfs/dbraw/zinc/37/32/08/193373208.db2.gz	DOCNJKAAWZETCJ-SNVBAGLBSA-N	0	3	324.226	2.388	10	0		DEAEHN
CCOC(=O)C[C@@]1(N2CCN(C)CC2)CSCC(C)(C)C1	ZINC000094491545	193373237	/nfs/dbraw/zinc/37/32/37/193373237.db2.gz	BYAJIIHJWUDNMD-INIZCTEOSA-N	0	3	314.495	2.089	10	0		DEAEHN
CC[C@H](CN)S(=O)(=O)NC12CC3C[C@@](C)(C1)C[C@](C)(C3)C2	ZINC000094544501	193378590	/nfs/dbraw/zinc/37/85/90/193378590.db2.gz	OKUFKHVFRHFLHX-PQARUHEFSA-N	0	3	314.495	2.392	10	0		DEAEHN
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1CCCOCC(F)(F)F	ZINC000191214450	284206468	/nfs/dbraw/zinc/20/64/68/284206468.db2.gz	DNRMXQIAUOTHKM-UTUOFQBUSA-N	0	3	309.328	2.229	10	0		DEAEHN
NC(=O)C1CCC(NCc2cn3cc(Cl)ccc3n2)CC1	ZINC000096544078	193677759	/nfs/dbraw/zinc/67/77/59/193677759.db2.gz	HOEHDZPRWQKLDI-UHFFFAOYSA-N	0	3	306.797	2.121	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@@H]1NCc1csc(Br)c1	ZINC000282536098	217070071	/nfs/dbraw/zinc/07/00/71/217070071.db2.gz	ZKUSNDVMRPYGCL-CBAPKCEASA-N	0	3	303.225	2.267	10	0		DEAEHN
O=C(NCc1nccn1-c1ccccc1)[C@H](C1CC1)N1CCCC1	ZINC000282808906	217265131	/nfs/dbraw/zinc/26/51/31/217265131.db2.gz	PCOWPSFZXKVGLZ-SFHVURJKSA-N	0	3	324.428	2.363	10	0		DEAEHN
c1ccc(CN2CC[C@H](Sc3nnnn3C3CC3)C2)cc1	ZINC000282881617	217298365	/nfs/dbraw/zinc/29/83/65/217298365.db2.gz	CUNGIUOPFWUYJQ-AWEZNQCLSA-N	0	3	301.419	2.375	10	0		DEAEHN
CCN1CCN([C@H](CN)c2ccc(Br)s2)CC1	ZINC000019281787	182111713	/nfs/dbraw/zinc/11/17/13/182111713.db2.gz	APZHQJIOIFSWPJ-SNVBAGLBSA-N	0	3	318.284	2.148	10	0		DEAEHN
Cc1ccc(CN)cc1S(=O)(=O)N[C@@H](C)c1ccccc1	ZINC000020189408	182195288	/nfs/dbraw/zinc/19/52/88/182195288.db2.gz	BWCNUYBGNJCIJW-ZDUSSCGKSA-N	0	3	304.415	2.493	10	0		DEAEHN
C[C@@H](NS(=O)(=O)c1ccc(F)c(CN)c1)c1ccccc1	ZINC000020189129	182195384	/nfs/dbraw/zinc/19/53/84/182195384.db2.gz	KHKXXKRXZCQIJY-LLVKDONJSA-N	0	3	308.378	2.324	10	0		DEAEHN
CC(C)NC(=O)[C@H](C)Oc1ccc(Br)cc1CN	ZINC000020483350	182223121	/nfs/dbraw/zinc/22/31/21/182223121.db2.gz	IEPGCZXGVNSDCR-VIFPVBQESA-N	0	3	315.211	2.200	10	0		DEAEHN
CO[C@@]1(CN[C@H](C)c2ccc(Br)o2)CCOC1	ZINC000160086421	197384759	/nfs/dbraw/zinc/38/47/59/197384759.db2.gz	WZEPHUOBSUQNJI-BXKDBHETSA-N	0	3	304.184	2.498	10	0		DEAEHN
CCCNCc1cccc(OC)c1OCC(=O)NC(C)(C)C	ZINC000020872651	182251022	/nfs/dbraw/zinc/25/10/22/182251022.db2.gz	RIGCLRDKQUREBS-UHFFFAOYSA-N	0	3	308.422	2.488	10	0		DEAEHN
O=S(=O)(Nc1ccc(OC(F)(F)F)cc1)[C@H]1CCCNC1	ZINC000021813354	182292959	/nfs/dbraw/zinc/29/29/59/182292959.db2.gz	DRZCBRQSTLDXGF-NSHDSACASA-N	0	3	324.324	2.079	10	0		DEAEHN
C[C@@H](CN(C)C(=O)CC1CCN(C)CC1)C(=O)OC(C)(C)C	ZINC000458398850	248290276	/nfs/dbraw/zinc/29/02/76/248290276.db2.gz	SPKWDPFJACBYPA-ZDUSSCGKSA-N	0	3	312.454	2.155	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2ccc3nc(SC)sc3c2)C1	ZINC000040632874	183111662	/nfs/dbraw/zinc/11/16/62/183111662.db2.gz	DMRXGIXEPTWSJK-ONGXEEELSA-N	0	3	323.443	2.334	10	0		DEAEHN
CCOC(=O)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1	ZINC000040615942	183109569	/nfs/dbraw/zinc/10/95/69/183109569.db2.gz	XXJBGYLFSVBYBU-MRXNPFEDSA-N	0	3	318.417	2.139	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)NCCc1ccc(OC(F)F)cc1	ZINC000040832819	183139394	/nfs/dbraw/zinc/13/93/94/183139394.db2.gz	KYXSMQKXQYZKKA-ZWNOBZJWSA-N	0	3	300.349	2.320	10	0		DEAEHN
CCC[C@@H](N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2	ZINC000040856029	183142985	/nfs/dbraw/zinc/14/29/85/183142985.db2.gz	RLWZLJQAHBYMIR-SNVBAGLBSA-N	0	3	310.419	2.479	10	0		DEAEHN
COc1nc2sccn2c1CNCCc1ccc(O)cc1	ZINC000040736193	183126265	/nfs/dbraw/zinc/12/62/65/183126265.db2.gz	WWCFRGUNQOQWRS-UHFFFAOYSA-N	0	3	303.387	2.442	10	0		DEAEHN
O=S(=O)([N-]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(F)cc1Cl	ZINC000040740993	183127275	/nfs/dbraw/zinc/12/72/75/183127275.db2.gz	JXWSRKPDODLNDW-ZACCUICWSA-N	0	3	318.801	2.040	10	0		DEAEHN
COc1ccc2nc(C)cc(N(C)[C@H]3CCS(=O)(=O)C3)c2c1	ZINC000041478866	183193728	/nfs/dbraw/zinc/19/37/28/183193728.db2.gz	SGKUUKMGBQBWDE-LBPRGKRZSA-N	0	3	320.414	2.175	10	0		DEAEHN
CCNCc1cccc(Br)c1O[C@@H](C)C(=O)NC	ZINC000042411647	183265936	/nfs/dbraw/zinc/26/59/36/183265936.db2.gz	JOYCFVZQBAUUQH-VIFPVBQESA-N	0	3	315.211	2.072	10	0		DEAEHN
CC(C)N(CC(=O)Nc1ccccc1CN)CC(F)(F)F	ZINC000042741204	183303883	/nfs/dbraw/zinc/30/38/83/183303883.db2.gz	FNJKLMAGKLVNBG-UHFFFAOYSA-N	0	3	303.328	2.357	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)cc1)N1CCC[C@@H]1C(=O)NC	ZINC000042946414	183320657	/nfs/dbraw/zinc/32/06/57/183320657.db2.gz	TYUACKBSMNSQOG-RBSFLKMASA-N	0	3	309.841	2.329	10	0		DEAEHN
C[C@@H](N)[C@H](c1cccc(Cl)c1)N(C)CC(=O)N1CCCC1	ZINC000043015474	183327471	/nfs/dbraw/zinc/32/74/71/183327471.db2.gz	AWHKBPKHLYISHS-MLGOLLRUSA-N	0	3	309.841	2.283	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccc(Cl)s1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043252783	183347981	/nfs/dbraw/zinc/34/79/81/183347981.db2.gz	JIQRBIHCLCHNPY-CWSCBRNRSA-N	0	3	315.870	2.342	10	0		DEAEHN
C[C@H](N)[C@H](c1cc(Br)cs1)N1CCN(C)CC1	ZINC000043284397	183350598	/nfs/dbraw/zinc/35/05/98/183350598.db2.gz	UVZPUVAQXAQHLZ-JOYOIKCWSA-N	0	3	318.284	2.146	10	0		DEAEHN
CN[C@@H](c1ccc(OC(F)(F)F)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000043300611	183352045	/nfs/dbraw/zinc/35/20/45/183352045.db2.gz	XKYIMTOWHQBLNW-JQWIXIFHSA-N	0	3	323.336	2.280	10	0		DEAEHN
CN[C@@H](c1ccccc1C(F)(F)F)[C@H]1CCS(=O)(=O)C1	ZINC000043300414	183352229	/nfs/dbraw/zinc/35/22/29/183352229.db2.gz	HQXKFGXZUQWNFW-JOYOIKCWSA-N	0	3	307.337	2.401	10	0		DEAEHN
COCCN([C@H](C)COC)[C@@H](CN)c1ccc(Cl)c(F)c1	ZINC000043390623	183358649	/nfs/dbraw/zinc/35/86/49/183358649.db2.gz	JONXTGJDLYLXKU-ABAIWWIYSA-N	0	3	318.820	2.462	10	0		DEAEHN
CCC(CC)NC(=O)[C@H](C)N(CCC(N)=S)CC(C)C	ZINC000043418462	183361150	/nfs/dbraw/zinc/36/11/50/183361150.db2.gz	ZKFHCTXAIBZKDV-LBPRGKRZSA-N	0	3	301.500	2.314	10	0		DEAEHN
CCNCc1c(N2CCO[C@H]3CCC[C@@H]32)nc2sccn12	ZINC000043426638	183361964	/nfs/dbraw/zinc/36/19/64/183361964.db2.gz	OVCDSPDHGWPLNW-AAEUAGOBSA-N	0	3	306.435	2.263	10	0		DEAEHN
O=C1C[C@H](NCCc2ccccc2)C(=O)N1c1ccccc1F	ZINC000105610747	194115300	/nfs/dbraw/zinc/11/53/00/194115300.db2.gz	LQOLDDDBXLFJLJ-HNNXBMFYSA-N	0	3	312.344	2.290	10	0		DEAEHN
CC[C@@H]1CN(CCOc2c(C)cccc2C)CCN1C[C@@H](C)O	ZINC000105912966	194169174	/nfs/dbraw/zinc/16/91/74/194169174.db2.gz	LCICMSVQOPPRNS-QZTJIDSGSA-N	0	3	320.477	2.459	10	0		DEAEHN
CC(C)Oc1cccc(CN2CCN(C[C@@H](C)O)[C@H](C)C2)c1	ZINC000106098379	194185063	/nfs/dbraw/zinc/18/50/63/194185063.db2.gz	IMYDHTZKPBOAEC-HZPDHXFCSA-N	0	3	306.450	2.361	10	0		DEAEHN
CC(C)Oc1ccccc1CN1CCN(C[C@@H](C)O)[C@H](C)C1	ZINC000106097774	194185183	/nfs/dbraw/zinc/18/51/83/194185183.db2.gz	SODHEOOYKMBNFD-HZPDHXFCSA-N	0	3	306.450	2.361	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc(C(=O)OC)cc2)CCN1CCOC	ZINC000106114477	194188046	/nfs/dbraw/zinc/18/80/46/194188046.db2.gz	XOFICAFHMVBWKA-QGZVFWFLSA-N	0	3	320.433	2.016	10	0		DEAEHN
CC(C)Oc1cccc(CNC[C@@H]2CN(C3CC3)CCO2)c1	ZINC000106379568	194204569	/nfs/dbraw/zinc/20/45/69/194204569.db2.gz	HWJJHIWLMLFJEK-GOSISDBHSA-N	0	3	304.434	2.427	10	0		DEAEHN
CCOc1ccc(CNC(=O)N2CC[C@@H](N(C)C)C2)cc1F	ZINC000106340187	194198119	/nfs/dbraw/zinc/19/81/19/194198119.db2.gz	DBAGDLLJAQRPPO-CYBMUJFWSA-N	0	3	309.385	2.070	10	0		DEAEHN
CC[C@H](NC)c1ccccc1OCC(=O)NCC(F)(F)F	ZINC000049309588	183724896	/nfs/dbraw/zinc/72/48/96/183724896.db2.gz	IYQVEQQQLSDKRY-NSHDSACASA-N	0	3	304.312	2.414	10	0		DEAEHN
C[C@H](Cc1cccs1)N[C@@H]1CC(=O)N(C2CCCC2)C1=O	ZINC000109379760	194260585	/nfs/dbraw/zinc/26/05/85/194260585.db2.gz	FCRPHUGLEVAUNX-BXUZGUMPSA-N	0	3	306.431	2.339	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1ccccc1COC	ZINC000110088919	194308738	/nfs/dbraw/zinc/30/87/38/194308738.db2.gz	SNCQCOUSSWFUAZ-OAHLLOKOSA-N	0	3	321.421	2.065	10	0		DEAEHN
C[C@H]1Cc2ccccc2N(S(=O)(=O)C[C@@H]2CCCCN2)C1	ZINC000110389901	194327463	/nfs/dbraw/zinc/32/74/63/194327463.db2.gz	PPQZMOKGPXJXGS-ZFWWWQNUSA-N	0	3	308.447	2.157	10	0		DEAEHN
COCCC[C@@H](N)C(=O)N(C)[C@H](C)c1cc(F)ccc1F	ZINC000159321251	197345157	/nfs/dbraw/zinc/34/51/57/197345157.db2.gz	YWFZTTCTCSMBMQ-QMTHXVAHSA-N	0	3	300.349	2.238	10	0		DEAEHN
CSc1nsc(NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)n1	ZINC000157077663	197159836	/nfs/dbraw/zinc/15/98/36/197159836.db2.gz	ORFIRFDLPIEFLO-DTWKUNHWSA-N	0	3	315.468	2.206	10	0		DEAEHN
CCN[C@@H](Cc1ccc(C(F)(F)F)cc1)CS(C)(=O)=O	ZINC000060706158	184154369	/nfs/dbraw/zinc/15/43/69/184154369.db2.gz	OWCVQDGMNLATNO-LBPRGKRZSA-N	0	3	309.353	2.271	10	0		DEAEHN
COCCN(C)CCNCc1ccc(CSC(F)F)o1	ZINC000061376752	184169566	/nfs/dbraw/zinc/16/95/66/184169566.db2.gz	BPMWWFYXIPMRMQ-UHFFFAOYSA-N	0	3	308.394	2.403	10	0		DEAEHN
NC[C@@H](c1ccccc1OC(F)(F)F)N1CCCOCC1	ZINC000061916559	184195455	/nfs/dbraw/zinc/19/54/55/184195455.db2.gz	WVDRJTNKZWCTDD-LBPRGKRZSA-N	0	3	304.312	2.307	10	0		DEAEHN
CN[C@@H](C)c1cnc(N2CCN(CC(F)(F)F)CC2)s1	ZINC000061948519	184197906	/nfs/dbraw/zinc/19/79/06/184197906.db2.gz	YGGNFPKZBYKQAN-VIFPVBQESA-N	0	3	308.373	2.108	10	0		DEAEHN
CCNCCS(=O)(=O)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC000062027823	184202506	/nfs/dbraw/zinc/20/25/06/184202506.db2.gz	VSHIDNCPGQKYKO-NSHDSACASA-N	0	3	304.843	2.272	10	0		DEAEHN
COc1ccc(CNC(C)(C)C)c(OCCS(C)(=O)=O)c1	ZINC000062733072	184251157	/nfs/dbraw/zinc/25/11/57/184251157.db2.gz	XLRUVYZNUJZVIU-UHFFFAOYSA-N	0	3	315.435	2.007	10	0		DEAEHN
CCN[C@H](C)c1ccc(F)cc1OCCS(=O)(=O)CC	ZINC000062746905	184252250	/nfs/dbraw/zinc/25/22/50/184252250.db2.gz	FKKNUUQMTFNOQB-LLVKDONJSA-N	0	3	303.399	2.310	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccn(-c3cccc(F)c3)n2)C1	ZINC000063097699	184270541	/nfs/dbraw/zinc/27/05/41/184270541.db2.gz	NERFZEDGYHUMBG-CQSZACIVSA-N	0	3	316.380	2.226	10	0		DEAEHN
CC[NH2+][C@H](C)c1ccccc1[N-]S(=O)(=O)C[C@@H]1CCCO1	ZINC000063155744	184274587	/nfs/dbraw/zinc/27/45/87/184274587.db2.gz	COQQGIATUQZSGD-OLZOCXBDSA-N	0	3	312.435	2.278	10	0		DEAEHN
CCN(CC)C(=O)[C@H]1CCCN1CCCOCC(F)(F)F	ZINC000065296966	184323814	/nfs/dbraw/zinc/32/38/14/184323814.db2.gz	LKXBCUAICOIAIW-GFCCVEGCSA-N	0	3	310.360	2.288	10	0		DEAEHN
CC[C@H](C)NCC(=O)Nc1cccc(C(=O)N(CC)CC)c1	ZINC000066068123	184386593	/nfs/dbraw/zinc/38/65/93/184386593.db2.gz	CFESLRXYCJDFOT-ZDUSSCGKSA-N	0	3	305.422	2.495	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](CCO)C2CCCCC2)C1	ZINC000137209355	207357471	/nfs/dbraw/zinc/35/74/71/207357471.db2.gz	RMSFBNJZWHOOLP-HOTGVXAUSA-N	0	3	311.470	2.101	10	0		DEAEHN
CCCN[C@](C)(C[C@@H](C)N(CC)CCOCC)C(=O)OC	ZINC000068647078	184495859	/nfs/dbraw/zinc/49/58/59/184495859.db2.gz	WMDQHRYQZNDYJW-GDBMZVCRSA-N	0	3	302.459	2.055	10	0		DEAEHN
COCCNCc1cc(Cl)ccc1OCCC(=O)OC	ZINC000069317553	184506903	/nfs/dbraw/zinc/50/69/03/184506903.db2.gz	GZGMBKYZWZWSQM-UHFFFAOYSA-N	0	3	301.770	2.018	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@H]1CCCCC1(C)C	ZINC000150887203	285025143	/nfs/dbraw/zinc/02/51/43/285025143.db2.gz	VSURTZWEGWKBMH-CABCVRRESA-N	0	3	311.470	2.365	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(C(=O)[C@@H]3CCCCN3)C2)c1	ZINC000119788756	195037203	/nfs/dbraw/zinc/03/72/03/195037203.db2.gz	OZSDTCAOZVYYKJ-DYVFJYSZSA-N	0	3	318.417	2.162	10	0		DEAEHN
COC(=O)CCC1CCN(Cc2cnn3ccccc23)CC1	ZINC000538730556	285053757	/nfs/dbraw/zinc/05/37/57/285053757.db2.gz	UGDWFRNFWSFYGL-UHFFFAOYSA-N	0	3	301.390	2.500	10	0		DEAEHN
CC(C)NCc1cccc(Cl)c1OCCS(C)(=O)=O	ZINC000159300515	197343535	/nfs/dbraw/zinc/34/35/35/197343535.db2.gz	OOKJQIUKNDZXJE-UHFFFAOYSA-N	0	3	305.827	2.261	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1cc(OC)c(OC)cc1Cl	ZINC000159199255	197334463	/nfs/dbraw/zinc/33/44/63/197334463.db2.gz	DNQKAEAXXZHIRX-SNVBAGLBSA-N	0	3	316.785	2.050	10	0		DEAEHN
Cc1cc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)nn1C(C)(C)C	ZINC000159071538	197324920	/nfs/dbraw/zinc/32/49/20/197324920.db2.gz	MURWMMXXBXNGMB-SWLSCSKDSA-N	0	3	306.454	2.405	10	0		DEAEHN
CCCN(CCC)S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159053337	197322452	/nfs/dbraw/zinc/32/24/52/197322452.db2.gz	UXPAJYAYKFVAGY-UHFFFAOYSA-N	0	3	302.415	2.404	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)N(C)C	ZINC000158990812	197317454	/nfs/dbraw/zinc/31/74/54/197317454.db2.gz	DTXCLPIVPHQDPC-ROUUACIJSA-N	0	3	317.477	2.498	10	0		DEAEHN
CN(C)CCc1noc(-c2cc(N)cc(C(F)(F)F)c2)n1	ZINC000158683408	197294087	/nfs/dbraw/zinc/29/40/87/197294087.db2.gz	MVNYGPUBRXXRSZ-UHFFFAOYSA-N	0	3	300.284	2.442	10	0		DEAEHN
CNCc1ccc(C)c(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)c1	ZINC000158746878	197297834	/nfs/dbraw/zinc/29/78/34/197297834.db2.gz	RKBBTXXGYCQIAF-HUUCEWRRSA-N	0	3	308.447	2.135	10	0		DEAEHN
CC[C@@H]1CN(c2nc(NC)nc(N(CC)CC)n2)CCS1	ZINC000158510860	197279344	/nfs/dbraw/zinc/27/93/44/197279344.db2.gz	WNDIBYHVTVTRLE-LLVKDONJSA-N	0	3	310.471	2.091	10	0		DEAEHN
C[C@H](NCc1ccc(I)o1)[C@@H]1CCOC1	ZINC000158489781	197277796	/nfs/dbraw/zinc/27/77/96/197277796.db2.gz	FTPSWKZXZLHCQY-DTWKUNHWSA-N	0	3	321.158	2.399	10	0		DEAEHN
CCN[C@@H](C)c1cccc(S(=O)(=O)N(C)CCOCC)c1	ZINC000157290821	197176856	/nfs/dbraw/zinc/17/68/56/197176856.db2.gz	GKVGJDCUPKUFMJ-ZDUSSCGKSA-N	0	3	314.451	2.014	10	0		DEAEHN
COC[C@H](NC(=O)N[C@H](CN(C)C)c1ccccc1)C1CC1	ZINC000157208410	197170233	/nfs/dbraw/zinc/17/02/33/197170233.db2.gz	JZNMFHJOMWLISF-CVEARBPZSA-N	0	3	305.422	2.014	10	0		DEAEHN
CCCNc1nc(N(C)C)nc(N2CCS[C@@H](C)[C@@H]2C)n1	ZINC000157111664	197162919	/nfs/dbraw/zinc/16/29/19/197162919.db2.gz	TXONLLDLLZMYDF-QWRGUYRKSA-N	0	3	310.471	2.090	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCC(C)(C)[C@H](O)C(C)C	ZINC000156148760	197089630	/nfs/dbraw/zinc/08/96/30/197089630.db2.gz	SOOLDUARFSIPBT-HUUCEWRRSA-N	0	3	315.502	2.305	10	0		DEAEHN
C[C@@H](CO)[C@H](C)NCc1cc(Br)cc2c1OCC2	ZINC000156019580	197081153	/nfs/dbraw/zinc/08/11/53/197081153.db2.gz	OIOYUIDFALWOPL-UWVGGRQHSA-N	0	3	314.223	2.491	10	0		DEAEHN
C[C@H](C(=O)Nc1cccc(CN)c1)[S@](=O)c1cccs1	ZINC000155970715	197078062	/nfs/dbraw/zinc/07/80/62/197078062.db2.gz	DJOVQBNJWNYJCZ-CFMSYZGJSA-N	0	3	308.428	2.342	10	0		DEAEHN
NCc1cccc(NC(=O)CC[S@](=O)c2cccs2)c1	ZINC000155969466	197077288	/nfs/dbraw/zinc/07/72/88/197077288.db2.gz	XFGFVWMSGOGQLU-HXUWFJFHSA-N	0	3	308.428	2.343	10	0		DEAEHN
C[C@H](Cc1ccccc1Cl)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000155121326	197024427	/nfs/dbraw/zinc/02/44/27/197024427.db2.gz	RLAUWPMUZJQNTA-UKRRQHHQSA-N	0	3	324.852	2.308	10	0		DEAEHN
CC(=O)N1CCC[C@@H](CN[C@@H](C)c2cn3ccccc3n2)C1	ZINC000559903206	291919266	/nfs/dbraw/zinc/91/92/66/291919266.db2.gz	KJVZCTRJPGBWCD-ZFWWWQNUSA-N	0	3	300.406	2.243	10	0		DEAEHN
COC[C@@H]1CCCN(CC(=O)N2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000246733987	285271683	/nfs/dbraw/zinc/27/16/83/285271683.db2.gz	LKQHZTNPPBKRQF-CHWSQXEVSA-N	0	3	322.371	2.146	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)C(=O)Nc2ccccc2Cl)CCN1C	ZINC000120622219	195203451	/nfs/dbraw/zinc/20/34/51/195203451.db2.gz	KTHPQZRUKXNRRM-RYUDHWBXSA-N	0	3	323.824	2.220	10	0		DEAEHN
c1coc(CN2CC[C@]3(C2)CCC[C@@H](CN2CCOCC2)O3)c1	ZINC000249683555	257106897	/nfs/dbraw/zinc/10/68/97/257106897.db2.gz	CYMDEWUYSBCGPB-ROUUACIJSA-N	0	3	320.433	2.125	10	0		DEAEHN
Cc1cccc(CN2C[C@@H]3CCN(c4ncccn4)C[C@@H]3C2)n1	ZINC000247863387	257116041	/nfs/dbraw/zinc/11/60/41/257116041.db2.gz	HBYCNBKEGLEESX-HOTGVXAUSA-N	0	3	309.417	2.138	10	0		DEAEHN
COCCN1CCO[C@H]2CCN(Cc3ccc(F)cc3C)C[C@H]21	ZINC000503717318	257209960	/nfs/dbraw/zinc/20/99/60/257209960.db2.gz	SRCWWBGJGSHORH-MSOLQXFVSA-N	0	3	322.424	2.056	10	0		DEAEHN
CCn1cc(CN2CCCN(Cc3cccc(O)c3)CC2)cn1	ZINC000121642775	195321978	/nfs/dbraw/zinc/32/19/78/195321978.db2.gz	MOQBNSBZIKLMAK-UHFFFAOYSA-N	0	3	314.433	2.317	10	0		DEAEHN
C[C@@H](CN1CCCCC1)N1C(=O)[C@H](C)N[C@H]1c1ccsc1	ZINC000122779189	195500268	/nfs/dbraw/zinc/50/02/68/195500268.db2.gz	GHGQXXFZRGUDIM-KCQAQPDRSA-N	0	3	307.463	2.441	10	0		DEAEHN
Cc1cccc(OCCCC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000195315184	132546417	/nfs/dbraw/zinc/54/64/17/132546417.db2.gz	WQUDIZMHVOPEMK-MRXNPFEDSA-N	0	3	302.418	2.461	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)CN1CCCN(C2CC2)CC1	ZINC000195339745	132546629	/nfs/dbraw/zinc/54/66/29/132546629.db2.gz	JVMVBWXSARDWHI-UHFFFAOYSA-N	0	3	315.461	2.124	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCN(C2CCCCC2)CC1	ZINC000361877455	133197114	/nfs/dbraw/zinc/19/71/14/133197114.db2.gz	NQLWTLBBHBCACH-QGZVFWFLSA-N	0	3	307.482	2.338	10	0		DEAEHN
Cc1ccc(CN2CCC(CNC(=O)[C@@H](O)C(C)C)CC2)cc1	ZINC000368258635	133266534	/nfs/dbraw/zinc/26/65/34/133266534.db2.gz	LOKXUELWXVUTRJ-SFHVURJKSA-N	0	3	318.461	2.340	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@H]1CCO[C@@H](C2CC2)C1	ZINC000291703142	404485459	/nfs/dbraw/zinc/48/54/59/404485459.db2.gz	KIGZHONNIOJXQA-FUHWJXTLSA-N	0	3	312.417	2.374	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C	ZINC000187513433	145000040	/nfs/dbraw/zinc/00/00/40/145000040.db2.gz	RNQPYNQWKCWEOX-MJBXVCDLSA-N	0	3	318.421	2.029	10	0		DEAEHN
O=C(N1CCN2CCC[C@H]2C1)C1(Cc2ccccc2F)CC1	ZINC000188384332	145010987	/nfs/dbraw/zinc/01/09/87/145010987.db2.gz	JSSHHTWSMAXRAC-HNNXBMFYSA-N	0	3	302.393	2.455	10	0		DEAEHN
O=C(c1cn2ccnc2s1)N1CCC[C@@H]1CN1CCCCC1	ZINC000188431961	145012257	/nfs/dbraw/zinc/01/22/57/145012257.db2.gz	QZDAUFLMSSXJOF-CYBMUJFWSA-N	0	3	318.446	2.486	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)c1cn2ccnc2s1	ZINC000188493850	145012880	/nfs/dbraw/zinc/01/28/80/145012880.db2.gz	NAOFHEKJUGUPHY-GFCCVEGCSA-N	0	3	306.435	2.390	10	0		DEAEHN
CC(C)OC1CC(N[C@@H]2CCCN(c3cccnc3)C2=O)C1	ZINC000189569445	145030320	/nfs/dbraw/zinc/03/03/20/145030320.db2.gz	MKNNHWDCKBQBTF-AVVWSFFYSA-N	0	3	303.406	2.123	10	0		DEAEHN
FC(F)(F)C(F)(F)COCCN1CCN2CCCC[C@H]2C1	ZINC000189683404	145031846	/nfs/dbraw/zinc/03/18/46/145031846.db2.gz	NBUHBSQOEDKYPH-NSHDSACASA-N	0	3	316.314	2.371	10	0		DEAEHN
O[C@H](CC1CCCC1)CN1CCC[C@H](c2nnc3n2CCC3)C1	ZINC000191343530	145056847	/nfs/dbraw/zinc/05/68/47/145056847.db2.gz	LFFOJPDEFVOUGB-JKSUJKDBSA-N	0	3	318.465	2.345	10	0		DEAEHN
O=C(Nc1cc(C(F)(F)F)ccn1)N1CCN2CCC[C@@H]2C1	ZINC000192425472	145073770	/nfs/dbraw/zinc/07/37/70/145073770.db2.gz	SYGBTVWHMWOMMQ-LLVKDONJSA-N	0	3	314.311	2.412	10	0		DEAEHN
COC[C@@H]1CCCN(Cc2ccc3c(c2)sc(=O)n3C)C1	ZINC000192624033	145076539	/nfs/dbraw/zinc/07/65/39/145076539.db2.gz	QLQMSLHZUMITDF-CYBMUJFWSA-N	0	3	306.431	2.458	10	0		DEAEHN
COc1ccnc(NC2CCN(CCCOC(C)C)CC2)n1	ZINC000192869565	145079973	/nfs/dbraw/zinc/07/99/73/145079973.db2.gz	XIPYDRYJAVHDAT-UHFFFAOYSA-N	0	3	308.426	2.177	10	0		DEAEHN
Nc1cc(CN2CCC(C(=O)N3CCCCCC3)CC2)ccn1	ZINC000193298902	145084219	/nfs/dbraw/zinc/08/42/19/145084219.db2.gz	LNYCNKNKMLNHRO-UHFFFAOYSA-N	0	3	316.449	2.278	10	0		DEAEHN
C[C@H](CNC(=O)N1CCN2CCC[C@H]2C1)Oc1cccc(F)c1	ZINC000246139841	145093827	/nfs/dbraw/zinc/09/38/27/145093827.db2.gz	JKVUQSUKZHFTBM-HIFRSBDPSA-N	0	3	321.396	2.083	10	0		DEAEHN
CCOc1ccc(NC(=O)[C@H](C)N2CCN3CCC[C@H]3C2)cc1	ZINC000246275356	145096583	/nfs/dbraw/zinc/09/65/83/145096583.db2.gz	HKPAFACEAHXCML-HOCLYGCPSA-N	0	3	317.433	2.192	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@H](C)Oc2ccccc2)C1	ZINC000246333600	145099330	/nfs/dbraw/zinc/09/93/30/145099330.db2.gz	IINSANSEVXQTOC-LSDHHAIUSA-N	0	3	305.422	2.237	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)[C@H]1CSc2ccccc21	ZINC000246350658	145099577	/nfs/dbraw/zinc/09/95/77/145099577.db2.gz	JXHNVNBOTWQZEC-HIFRSBDPSA-N	0	3	320.458	2.103	10	0		DEAEHN
Cc1ccc(Cl)cc1NC(=O)CN1CCN2CCC[C@H]2C1	ZINC000246403893	145101581	/nfs/dbraw/zinc/10/15/81/145101581.db2.gz	QGAISVFBPMRVAJ-AWEZNQCLSA-N	0	3	307.825	2.367	10	0		DEAEHN
O=C(Nc1ccccc1)c1ccc(N2CCN3CCC[C@H]3C2)nn1	ZINC000246743286	145112535	/nfs/dbraw/zinc/11/25/35/145112535.db2.gz	ZHCFIAZCXBDCAC-HNNXBMFYSA-N	0	3	323.400	2.013	10	0		DEAEHN
CCO[C@@H](C)c1nc(CN2CCO[C@@H](CN(C)C)C2)cs1	ZINC000246814715	145115150	/nfs/dbraw/zinc/11/51/50/145115150.db2.gz	RXABHOUKVHCCHH-JSGCOSHPSA-N	0	3	313.467	2.003	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1Cc1nc(-c2cccs2)no1	ZINC000246817886	145115707	/nfs/dbraw/zinc/11/57/07/145115707.db2.gz	CIJAMAFPAMEPRC-NEPJUHHUSA-N	0	3	304.419	2.467	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cnn(C(C)(C)C)c1	ZINC000246846804	145116090	/nfs/dbraw/zinc/11/60/90/145116090.db2.gz	CASOFIADTFVKAN-GJZGRUSLSA-N	0	3	304.438	2.337	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CC(=O)N1CCCC[C@H]1C	ZINC000246837104	145116490	/nfs/dbraw/zinc/11/64/90/145116490.db2.gz	BLOGNWTZFMIPJV-GDBMZVCRSA-N	0	3	304.438	2.057	10	0		DEAEHN
CCC1(CC)[C@H](OC)C[C@H]1N(C)C[C@H](C)CS(C)(=O)=O	ZINC000246951385	145120538	/nfs/dbraw/zinc/12/05/38/145120538.db2.gz	NXFWVGJQCPDSRN-BFHYXJOUSA-N	0	3	305.484	2.193	10	0		DEAEHN
CC(C)CC[C@](C)(O)CNC(=O)NCCN1CCC[C@@H](C)C1	ZINC000246971856	145120893	/nfs/dbraw/zinc/12/08/93/145120893.db2.gz	GQWYQJJDLGGUID-WBVHZDCISA-N	0	3	313.486	2.205	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)CCC(=O)c2ccccc2)C1	ZINC000247369910	145135445	/nfs/dbraw/zinc/13/54/45/145135445.db2.gz	PBJGEKYDPFBUJU-GOEBONIOSA-N	0	3	302.418	2.494	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@H](Cc2ccccc2)N(C)C)C1	ZINC000247471587	145138435	/nfs/dbraw/zinc/13/84/35/145138435.db2.gz	VHNGWBXSNPEKPH-NJAFHUGGSA-N	0	3	317.477	2.004	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](C)c1ccccc1)N1CC[C@@]2(CCOC2)C1	ZINC000247503448	145139787	/nfs/dbraw/zinc/13/97/87/145139787.db2.gz	XTVQGGAHGARBST-HDMKZQKVSA-N	0	3	302.418	2.365	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2cccc(OC(F)F)c2)C[C@@H]1C	ZINC000247779596	145144251	/nfs/dbraw/zinc/14/42/51/145144251.db2.gz	RORGIVJUCCUBTF-STQMWFEESA-N	0	3	314.376	2.175	10	0		DEAEHN
COc1ccc(C)nc1NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000248767412	145167394	/nfs/dbraw/zinc/16/73/94/145167394.db2.gz	GZNZCHMZZRSZFT-STQMWFEESA-N	0	3	306.410	2.345	10	0		DEAEHN
OC[C@@H]1CN(CCO[C@@H]2CCCCO2)C[C@@H]1c1ccsc1	ZINC000248836689	145169290	/nfs/dbraw/zinc/16/92/90/145169290.db2.gz	OMHYBMUFXZQEDS-ARFHVFGLSA-N	0	3	311.447	2.299	10	0		DEAEHN
O[C@@H](CN1CCC[C@@H](c2nnc3n2CCC3)C1)C1CCCCC1	ZINC000248873170	145171523	/nfs/dbraw/zinc/17/15/23/145171523.db2.gz	DQVCGFQDYRNHIP-CVEARBPZSA-N	0	3	318.465	2.345	10	0		DEAEHN
CO[C@@H]1CN(CCC(=O)NC(=O)Nc2ccccc2)CC[C@@H]1C	ZINC000251893665	145197100	/nfs/dbraw/zinc/19/71/00/145197100.db2.gz	QLHIMNIHDIBBGO-DZGCQCFKSA-N	0	3	319.405	2.082	10	0		DEAEHN
CCc1nn(C)c(CC)c1CC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000253353656	145202069	/nfs/dbraw/zinc/20/20/69/145202069.db2.gz	WIQCPWPNAUEKNS-KBPBESRZSA-N	0	3	320.481	2.029	10	0		DEAEHN
COc1ccccc1/C=C\CN1CCN(C[C@H](C)O)[C@@H](C)C1	ZINC000254936214	145203513	/nfs/dbraw/zinc/20/35/13/145203513.db2.gz	IWKYTLZZFQYVAE-KXVKIKSLSA-N	0	3	304.434	2.095	10	0		DEAEHN
COc1ccc(OC)c(CN2CCNC[C@H]2c2cccnc2)c1	ZINC000261654054	145213866	/nfs/dbraw/zinc/21/38/66/145213866.db2.gz	HPEPDXNEDFXSDC-KRWDZBQOSA-N	0	3	313.401	2.245	10	0		DEAEHN
c1c(CN2CCNC[C@H]2c2cccnc2)[nH]nc1-c1cccnc1	ZINC000261778015	145225145	/nfs/dbraw/zinc/22/51/45/145225145.db2.gz	SYWZMMBCVCVCTO-SFHVURJKSA-N	0	3	320.400	2.013	10	0		DEAEHN
Cc1cccn2c(CN3CCNC[C@H]3c3cccnc3)cnc12	ZINC000261817657	145229477	/nfs/dbraw/zinc/22/94/77/145229477.db2.gz	XOPCYKSJVORGJQ-KRWDZBQOSA-N	0	3	307.401	2.184	10	0		DEAEHN
Cc1ccc(NC(=O)C2(N)CCOCC2)cc1OC(F)F	ZINC000261845765	145233308	/nfs/dbraw/zinc/23/33/08/145233308.db2.gz	LYLIFIQYBUOXBQ-UHFFFAOYSA-N	0	3	300.305	2.043	10	0		DEAEHN
COc1cc(N[C@@H]2CCC[C@H]2[C@@H]2COCCN2)cc(OC)c1	ZINC000261888057	145238071	/nfs/dbraw/zinc/23/80/71/145238071.db2.gz	GDQMBRSSCRDPSK-ZACQAIPSSA-N	0	3	306.406	2.273	10	0		DEAEHN
C[C@@]1(CN2CCC(C(=O)Nc3ccccc3[O-])CC2)CC[NH2+]C1	ZINC000261918645	145241920	/nfs/dbraw/zinc/24/19/20/145241920.db2.gz	BIYPYTAYSPYJPZ-GOSISDBHSA-N	0	3	317.433	2.042	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)NCc1ccc(F)cc1F	ZINC000261976920	145248732	/nfs/dbraw/zinc/24/87/32/145248732.db2.gz	ZSPXYLMLVOILGJ-DXCKQFNASA-N	0	3	324.371	2.114	10	0		DEAEHN
C[C@@H]1CN(CCN(C)Cc2cccc3c2NCC3)C[C@H](C)O1	ZINC000262000966	145252223	/nfs/dbraw/zinc/25/22/23/145252223.db2.gz	UDLSKVXBOZKVIA-GASCZTMLSA-N	0	3	303.450	2.196	10	0		DEAEHN
Cc1coc(-c2cccc(NC(=O)[C@H](N)C3CCOCC3)c2)n1	ZINC000262046447	145257258	/nfs/dbraw/zinc/25/72/58/145257258.db2.gz	QPSCZNZYLNBESN-OAHLLOKOSA-N	0	3	315.373	2.342	10	0		DEAEHN
CCCc1noc(CN2CCNC[C@H]2c2ccccc2OC)n1	ZINC000262135906	145265574	/nfs/dbraw/zinc/26/55/74/145265574.db2.gz	DMGUWAARZCAZOR-AWEZNQCLSA-N	0	3	316.405	2.177	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)CN1CCNC[C@H]1c1cccnc1	ZINC000262227337	145270370	/nfs/dbraw/zinc/27/03/70/145270370.db2.gz	NKRRLZGAFFTEDO-KRWDZBQOSA-N	0	3	324.428	2.283	10	0		DEAEHN
COc1ccc(OCCN2CCNC[C@@H]2c2cccnc2)cc1	ZINC000262263957	145272235	/nfs/dbraw/zinc/27/22/35/145272235.db2.gz	RRLHCBVATUQRLQ-GOSISDBHSA-N	0	3	313.401	2.116	10	0		DEAEHN
C[C@H](NC(=O)C1(N)CCOCC1)c1ccc(C(F)(F)F)cc1	ZINC000262290781	145273386	/nfs/dbraw/zinc/27/33/86/145273386.db2.gz	NENWVXPEZVORMD-JTQLQIEISA-N	0	3	316.323	2.391	10	0		DEAEHN
O=c1[nH]c2ccccc2cc1CN1CCNC[C@@H]1c1cccnc1	ZINC000262301116	145275203	/nfs/dbraw/zinc/27/52/03/145275203.db2.gz	XMVXGTVLXGGUPT-GOSISDBHSA-N	0	3	320.396	2.482	10	0		DEAEHN
CC(C)Oc1ccc([C@H](C)NC(=O)C2(N)CCOCC2)cc1	ZINC000262328566	145277201	/nfs/dbraw/zinc/27/72/01/145277201.db2.gz	SAKDKUJODMNXIA-ZDUSSCGKSA-N	0	3	306.406	2.159	10	0		DEAEHN
Cc1csc([C@H](C)NC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)n1	ZINC000262430860	145283272	/nfs/dbraw/zinc/28/32/72/145283272.db2.gz	FVFSPKVCQPMUNZ-CENBSLRLSA-N	0	3	323.462	2.161	10	0		DEAEHN
CNC(=O)c1cccc(NC(=O)[C@@H]2NCCCC2(C)C)c1C	ZINC000262484272	145286776	/nfs/dbraw/zinc/28/67/76/145286776.db2.gz	KETJAKPYGOCSRI-AWEZNQCLSA-N	0	3	303.406	2.071	10	0		DEAEHN
COc1ccc(NC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)cc1	ZINC000262486953	145287706	/nfs/dbraw/zinc/28/77/06/145287706.db2.gz	KNNOQPOFKBTEGX-GRDNDAEWSA-N	0	3	304.390	2.166	10	0		DEAEHN
Cc1cnc([C@H](C)NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)s1	ZINC000262495041	145288141	/nfs/dbraw/zinc/28/81/41/145288141.db2.gz	LGWOGNZSLRMLFV-XSUJLISDSA-N	0	3	323.462	2.161	10	0		DEAEHN
CSc1ccc(C)c(-c2nc([C@@H]3CNCCN3C)no2)c1	ZINC000263177704	145332793	/nfs/dbraw/zinc/33/27/93/145332793.db2.gz	GIWFLSQZYJHATH-ZDUSSCGKSA-N	0	3	304.419	2.343	10	0		DEAEHN
Cc1ccccc1SCc1nc([C@@H]2CNCCN2C)no1	ZINC000263204724	145336149	/nfs/dbraw/zinc/33/61/49/145336149.db2.gz	JOEISJNOCZYBOX-LBPRGKRZSA-N	0	3	304.419	2.246	10	0		DEAEHN
Cc1cc(CN2CCN(CC3(O)CCC(C)CC3)CC2)no1	ZINC000304308788	145340029	/nfs/dbraw/zinc/34/00/29/145340029.db2.gz	NBFKSUGCBPIHQD-UHFFFAOYSA-N	0	3	307.438	2.042	10	0		DEAEHN
NC(=O)CC1(NCc2csc(Br)c2)CCC1	ZINC000309580164	145349140	/nfs/dbraw/zinc/34/91/40/145349140.db2.gz	QBODMYVPYWBNRP-UHFFFAOYSA-N	0	3	303.225	2.398	10	0		DEAEHN
Cc1ccccc1CNC(=O)[C@H](C)N[C@H]1CCO[C@@H]1C1CC1	ZINC000332992641	145393428	/nfs/dbraw/zinc/39/34/28/145393428.db2.gz	LZGMAXZTOUKEDY-RRQGHBQHSA-N	0	3	302.418	2.157	10	0		DEAEHN
O[C@H](CCNCc1cn2cc(Cl)ccc2n1)C(F)(F)F	ZINC000349317152	146367717	/nfs/dbraw/zinc/36/77/17/146367717.db2.gz	PLLULTRMKQFNDL-SNVBAGLBSA-N	0	3	307.703	2.391	10	0		DEAEHN
CC[C@@H](Oc1ccccc1F)C(=O)NCCNc1ccncc1	ZINC000359089215	147260438	/nfs/dbraw/zinc/26/04/38/147260438.db2.gz	YHENPXSGCALLFX-OAHLLOKOSA-N	0	3	317.364	2.028	10	0		DEAEHN
NC(=O)c1ccc(CN2CC[C@H](c3nc(C4CC4)no3)C2)cc1	ZINC000375408114	148367854	/nfs/dbraw/zinc/36/78/54/148367854.db2.gz	BDUWXKXVDINRHR-AWEZNQCLSA-N	0	3	312.373	2.035	10	0		DEAEHN
CCc1ccccc1CNC(=O)NC[C@@H]1CCCN1CCOC	ZINC000127248037	401725789	/nfs/dbraw/zinc/72/57/89/401725789.db2.gz	AHZTWACZXRBSOI-KRWDZBQOSA-N	0	3	319.449	2.159	10	0		DEAEHN
COCCN(C)CCCNC(=O)NC1C2CC3CC(C2)CC1C3	ZINC000127274586	401727049	/nfs/dbraw/zinc/72/70/49/401727049.db2.gz	JGZVKOCIXDKETC-UHFFFAOYSA-N	0	3	323.481	2.079	10	0		DEAEHN
CC[C@@]1(C)CCCN(C(=O)NC[C@@H]2CCCN2CCOC)C1	ZINC000074167177	401731670	/nfs/dbraw/zinc/73/16/70/401731670.db2.gz	OIHRCVJKQNCVHI-RDJZCZTQSA-N	0	3	311.470	2.319	10	0		DEAEHN
C[C@H](C(=O)NCc1cccnc1N(C)C)N1CCCCCC1	ZINC000074218648	401733404	/nfs/dbraw/zinc/73/34/04/401733404.db2.gz	KMQFDBJTGHFOEQ-CQSZACIVSA-N	0	3	304.438	2.028	10	0		DEAEHN
C[C@@H](C(=O)NCc1cccnc1N(C)C)N1CCCCCC1	ZINC000074218643	401733692	/nfs/dbraw/zinc/73/36/92/401733692.db2.gz	KMQFDBJTGHFOEQ-AWEZNQCLSA-N	0	3	304.438	2.028	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1nc(C)ccc1OC	ZINC000127476168	401737006	/nfs/dbraw/zinc/73/70/06/401737006.db2.gz	HJQQCAOHQAVQRU-CYBMUJFWSA-N	0	3	306.410	2.347	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1nc(C)ccc1OC	ZINC000127476414	401737191	/nfs/dbraw/zinc/73/71/91/401737191.db2.gz	HJQQCAOHQAVQRU-ZDUSSCGKSA-N	0	3	306.410	2.347	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H](C)c1ccc(-n2ccnn2)cc1)N(C)C	ZINC000126546549	401699055	/nfs/dbraw/zinc/69/90/55/401699055.db2.gz	IGQUVRAVARLAIC-CZUORRHYSA-N	0	3	315.421	2.175	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1cccc(F)c1C	ZINC000072606102	401711172	/nfs/dbraw/zinc/71/11/72/401711172.db2.gz	MVZLRDREGYZPCR-CYBMUJFWSA-N	0	3	309.385	2.366	10	0		DEAEHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)NCC1(C)COC1	ZINC000112724033	401756347	/nfs/dbraw/zinc/75/63/47/401756347.db2.gz	MQCJFIVJXKCDGX-UHFFFAOYSA-N	0	3	319.449	2.316	10	0		DEAEHN
C[C@@H](Oc1ccc(F)cc1Cl)C(=O)N1CC[C@@H](N(C)C)C1	ZINC000112897503	401761131	/nfs/dbraw/zinc/76/11/31/401761131.db2.gz	IWMRFMHSUHPNRU-ZYHUDNBSSA-N	0	3	314.788	2.409	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Cc2coc(-c3ccc(F)cc3)n2)C1	ZINC000113170027	401768701	/nfs/dbraw/zinc/76/87/01/401768701.db2.gz	GQSHUAYMZSOPRD-OAHLLOKOSA-N	0	3	317.364	2.186	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(C(C)(C)C)nn1C	ZINC000113224377	401770734	/nfs/dbraw/zinc/77/07/34/401770734.db2.gz	KORLIDCZRCFTLX-QWHCGFSZSA-N	0	3	304.438	2.026	10	0		DEAEHN
Cc1cc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)nn1-c1ccccc1	ZINC000113225946	401770816	/nfs/dbraw/zinc/77/08/16/401770816.db2.gz	GFKBTVVWXFKVNK-DOTOQJQBSA-N	0	3	324.428	2.489	10	0		DEAEHN
Cn1cc([C@@H]2CCN(Cc3c[nH]nc3-c3cccnc3)C2)cn1	ZINC000128516018	401780780	/nfs/dbraw/zinc/78/07/80/401780780.db2.gz	AMIOPNNPADJNCC-CQSZACIVSA-N	0	3	308.389	2.195	10	0		DEAEHN
Cn1cc([C@@H]2CCN(Cc3cn(C)nc3-c3ccncc3)C2)cn1	ZINC000128521699	401780787	/nfs/dbraw/zinc/78/07/87/401780787.db2.gz	RREVWFPRSUTWRY-OAHLLOKOSA-N	0	3	322.416	2.205	10	0		DEAEHN
CCC[C@]1(C)CCCN([C@@H](C)C(=O)N(C)CC(=O)NC2CC2)C1	ZINC000076145513	401785105	/nfs/dbraw/zinc/78/51/05/401785105.db2.gz	ARUHFQGDSWHZMM-KBXCAEBGSA-N	0	3	323.481	2.014	10	0		DEAEHN
CN1CCC(NC(=O)N2CCC[C@H](c3nccs3)C2)CC1	ZINC000114819218	401811214	/nfs/dbraw/zinc/81/12/14/401811214.db2.gz	ZEQRPJUYDHBWCH-LBPRGKRZSA-N	0	3	308.451	2.126	10	0		DEAEHN
CN1C[C@H](NCc2ccccc2OC(F)(F)F)CCC1=O	ZINC000077900190	401835874	/nfs/dbraw/zinc/83/58/74/401835874.db2.gz	NYPSIIOCXGGIAO-LLVKDONJSA-N	0	3	302.296	2.296	10	0		DEAEHN
Cn1cc([C@H]2CCN(CCC(=O)N3CCc4ccccc43)C2)cn1	ZINC000116316037	401849527	/nfs/dbraw/zinc/84/95/27/401849527.db2.gz	VLKNNDFBFZPMEV-INIZCTEOSA-N	0	3	324.428	2.189	10	0		DEAEHN
COc1cccc(C(=O)NCCC[NH+]2CCC(C)CC2)c1[O-]	ZINC000078566543	401856166	/nfs/dbraw/zinc/85/61/66/401856166.db2.gz	OESYEBFYWPRAEM-UHFFFAOYSA-N	0	3	306.406	2.253	10	0		DEAEHN
Cc1c2cccc(C)c2oc1C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000116786916	401859334	/nfs/dbraw/zinc/85/93/34/401859334.db2.gz	XAPLASPUFZSOFK-AWEZNQCLSA-N	0	3	316.401	2.452	10	0		DEAEHN
CN(C)C(=N)c1ncc(Br)cc1Br	ZINC000133378941	401883621	/nfs/dbraw/zinc/88/36/21/401883621.db2.gz	OZIPFWSDVCDSIW-UHFFFAOYSA-N	0	3	306.989	2.494	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCC(C)(C)c2cccc(F)c2)C1	ZINC000118585467	401901343	/nfs/dbraw/zinc/90/13/43/401901343.db2.gz	VZIIKBIMFMSVBE-OAHLLOKOSA-N	0	3	307.413	2.449	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cnn(-c3ccccc3)c2)C1	ZINC000118964134	401915157	/nfs/dbraw/zinc/91/51/57/401915157.db2.gz	KOWRMPRVMBUABH-AWEZNQCLSA-N	0	3	313.405	2.478	10	0		DEAEHN
Cc1nnc(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)n1C1CC1	ZINC000134916248	401919293	/nfs/dbraw/zinc/91/92/93/401919293.db2.gz	CJGVWAAIYGSJNS-RHSMWYFYSA-N	0	3	315.465	2.370	10	0		DEAEHN
Cc1nccn1-c1ccc([C@H](C)N[C@H](C)CS(C)(=O)=O)cc1	ZINC000089633105	401954941	/nfs/dbraw/zinc/95/49/41/401954941.db2.gz	RHTMOVXOFDGJAB-OLZOCXBDSA-N	0	3	321.446	2.264	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCO[C@H](c2cccs2)C1	ZINC000136011599	401957788	/nfs/dbraw/zinc/95/77/88/401957788.db2.gz	CRTULYPVQFNUNX-KBPBESRZSA-N	0	3	323.462	2.315	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)[C@@H]1CC(=O)Nc2ccccc21	ZINC000046860854	401974089	/nfs/dbraw/zinc/97/40/89/401974089.db2.gz	BGEFMBHPDRVNAT-DZGCQCFKSA-N	0	3	315.417	2.103	10	0		DEAEHN
CC(C)Cc1ccc([C@H](C)NCC(=O)N2CCNC2=O)cc1	ZINC000120303374	401985541	/nfs/dbraw/zinc/98/55/41/401985541.db2.gz	HDUZGTOAJRAPNP-ZDUSSCGKSA-N	0	3	303.406	2.088	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cn(C)nc1-c1ccccc1	ZINC000089243236	401940228	/nfs/dbraw/zinc/94/02/28/401940228.db2.gz	UOQOAMLEGYOXGT-GOEBONIOSA-N	0	3	324.428	2.396	10	0		DEAEHN
C[C@@H](NC(=O)NCc1ccnc(OCCN(C)C)c1)C(C)(C)C	ZINC000135605458	401947615	/nfs/dbraw/zinc/94/76/15/401947615.db2.gz	REIPDNLAPGZKJA-CYBMUJFWSA-N	0	3	322.453	2.256	10	0		DEAEHN
CCC(CC)CN1CCN([C@@H](C)C(=O)NC2CCCC2)CC1	ZINC000093078219	402011025	/nfs/dbraw/zinc/01/10/25/402011025.db2.gz	XCZLXSMNIHDYLI-HNNXBMFYSA-N	0	3	309.498	2.488	10	0		DEAEHN
NC1(C(=O)Nc2ccc3nccnc3c2)Cc2ccccc2C1	ZINC000151092170	402015276	/nfs/dbraw/zinc/01/52/76/402015276.db2.gz	ZDVZKSPAEWFDKK-UHFFFAOYSA-N	0	3	304.353	2.065	10	0		DEAEHN
CCNC(=O)CCN1CCC[C@@H]1c1ccc(OC)c(OC)c1	ZINC000051283898	402033532	/nfs/dbraw/zinc/03/35/32/402033532.db2.gz	JMFOYDOGYNQGNZ-CQSZACIVSA-N	0	3	306.406	2.367	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2c[nH]c3ccccc23)C1	ZINC000052498454	402042973	/nfs/dbraw/zinc/04/29/73/402042973.db2.gz	HLGHFOQXOLETLK-HNNXBMFYSA-N	0	3	314.433	2.494	10	0		DEAEHN
COC(=O)C(C)(C)CN[C@@H](C)C(=O)N[C@H](C)c1ccccc1	ZINC000151802472	402057398	/nfs/dbraw/zinc/05/73/98/402057398.db2.gz	HQZCJKNUHOTBSE-OLZOCXBDSA-N	0	3	306.406	2.041	10	0		DEAEHN
COC(=O)C(C)(C)CN[C@H](C)C(=O)N[C@H](C)c1ccccc1	ZINC000151802338	402057632	/nfs/dbraw/zinc/05/76/32/402057632.db2.gz	HQZCJKNUHOTBSE-CHWSQXEVSA-N	0	3	306.406	2.041	10	0		DEAEHN
CC[C@@H]1CN(CCc2ccc(F)c(F)c2)CCN1C[C@@H](C)O	ZINC000152048887	402072821	/nfs/dbraw/zinc/07/28/21/402072821.db2.gz	WSRZAQCFVOWOJE-UKRRQHHQSA-N	0	3	312.404	2.284	10	0		DEAEHN
COCCOc1ccccc1C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000122758323	402093641	/nfs/dbraw/zinc/09/36/41/402093641.db2.gz	IPNMYASCMFJZLA-HUUCEWRRSA-N	0	3	320.433	2.267	10	0		DEAEHN
COC(=O)c1cccc(OCCN2CCCN(C3CC3)CC2)c1	ZINC000061040706	402106830	/nfs/dbraw/zinc/10/68/30/402106830.db2.gz	TUZQTKOMSBLNIF-UHFFFAOYSA-N	0	3	318.417	2.022	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccncc2Br)C1	ZINC000152821954	402111028	/nfs/dbraw/zinc/11/10/28/402111028.db2.gz	JWKLSRVFQLLVDR-JTQLQIEISA-N	0	3	312.211	2.058	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)N(C)CCc2nccs2)[C@@H](C)C1	ZINC000123243619	402117777	/nfs/dbraw/zinc/11/77/77/402117777.db2.gz	CBNXIDIDQPWHPC-STQMWFEESA-N	0	3	310.467	2.056	10	0		DEAEHN
CC[C@@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1c(C)noc1C	ZINC000123370515	402124676	/nfs/dbraw/zinc/12/46/76/402124676.db2.gz	LXFQHULINMYVCL-HUUCEWRRSA-N	0	3	318.421	2.398	10	0		DEAEHN
C[C@H](C(=O)NC1CCCC1)N1CCC[C@H](Cc2nccn2C)C1	ZINC000123727083	402143423	/nfs/dbraw/zinc/14/34/23/402143423.db2.gz	SBLJJZQPXMPCOL-HUUCEWRRSA-N	0	3	318.465	2.122	10	0		DEAEHN
COCCCNC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000067005048	402149675	/nfs/dbraw/zinc/14/96/75/402149675.db2.gz	HUZQZLHAYQDWKT-QGZVFWFLSA-N	0	3	319.449	2.377	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N1CC[C@]2(CCOC2)C1)c1ccccc1	ZINC000153476512	402147811	/nfs/dbraw/zinc/14/78/11/402147811.db2.gz	XTVQGGAHGARBST-MPGHIAIKSA-N	0	3	302.418	2.365	10	0		DEAEHN
Cc1cc(F)ccc1CN1CCC[C@@H](C(=O)N2CCOCC2)C1	ZINC000124485222	402182150	/nfs/dbraw/zinc/18/21/50/402182150.db2.gz	QGUJMIWUZIRVQU-MRXNPFEDSA-N	0	3	320.408	2.205	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)CCOc1ccc(C=O)cc1	ZINC000068279503	402190242	/nfs/dbraw/zinc/19/02/42/402190242.db2.gz	NURFOIZTULPMEY-HNNXBMFYSA-N	0	3	318.417	2.259	10	0		DEAEHN
O=C(Nc1ccc2n[nH]cc2c1)[C@H]1CCCN1C1CCOCC1	ZINC000154150614	402195281	/nfs/dbraw/zinc/19/52/81/402195281.db2.gz	LQIYLJAABXBONL-MRXNPFEDSA-N	0	3	314.389	2.145	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)C[C@@H]2c3ccccc3NC2=O)CCN1C	ZINC000124327061	402174957	/nfs/dbraw/zinc/17/49/57/402174957.db2.gz	XTDORGBBFRFBGZ-UMVBOHGHSA-N	0	3	315.417	2.054	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)C[C@@H]2c3ccccc3NC2=O)CCN1C	ZINC000124327493	402175118	/nfs/dbraw/zinc/17/51/18/402175118.db2.gz	XTDORGBBFRFBGZ-VNHYZAJKSA-N	0	3	315.417	2.054	10	0		DEAEHN
CCN(CC)CC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000154851749	402236093	/nfs/dbraw/zinc/23/60/93/402236093.db2.gz	QBFDYRBKHODUII-LJQANCHMSA-N	0	3	317.477	2.499	10	0		DEAEHN
CC1(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)CC1	ZINC000154924900	402238563	/nfs/dbraw/zinc/23/85/63/402238563.db2.gz	UDMJAAYNSWMKLI-UHFFFAOYSA-N	0	3	315.417	2.251	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cccc(-c2nc[nH]n2)c1	ZINC000154933876	402238969	/nfs/dbraw/zinc/23/89/69/402238969.db2.gz	GHWOSOVSJPHTGE-OAHLLOKOSA-N	0	3	313.405	2.028	10	0		DEAEHN
Cc1cc(C(=O)NC[C@@H]2CCCN(C)C2)nn1-c1ccccc1	ZINC000108333962	402250960	/nfs/dbraw/zinc/25/09/60/402250960.db2.gz	FXYYNYYOSTUCCE-HNNXBMFYSA-N	0	3	312.417	2.252	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(CC(=O)NC(C)(C)CC)C1	ZINC000105896802	402210719	/nfs/dbraw/zinc/21/07/19/402210719.db2.gz	WUSIGOHINSAAAC-AWEZNQCLSA-N	0	3	306.454	2.387	10	0		DEAEHN
COC[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000176104803	402279400	/nfs/dbraw/zinc/27/94/00/402279400.db2.gz	APTHQVOFGMOXPT-ZMSDIMECSA-N	0	3	304.434	2.438	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(F)c(F)c1	ZINC000110084919	402281456	/nfs/dbraw/zinc/28/14/56/402281456.db2.gz	MDTHVKCQTCCEDG-GFCCVEGCSA-N	0	3	313.348	2.197	10	0		DEAEHN
C[C@H]1CCCN(c2cc(N3CCN(CC4CC4)CC3)ncn2)C1	ZINC000110246841	402283875	/nfs/dbraw/zinc/28/38/75/402283875.db2.gz	FWTRVWWCKKWUJI-HNNXBMFYSA-N	0	3	315.465	2.245	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)C1CCCC1	ZINC000184654786	402288898	/nfs/dbraw/zinc/28/88/98/402288898.db2.gz	AANRQTFPOOAMCT-CYBMUJFWSA-N	0	3	317.433	2.495	10	0		DEAEHN
CC[C@@H](C(=O)NCc1nc2ccccc2n1C1CC1)N(C)C	ZINC000185105285	402324941	/nfs/dbraw/zinc/32/49/41/402324941.db2.gz	OGEDNRBANGIWTO-AWEZNQCLSA-N	0	3	300.406	2.328	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1ccc2c(c1)OCO2	ZINC000176243735	402294250	/nfs/dbraw/zinc/29/42/50/402294250.db2.gz	PAPNZBCUBUQTIH-CYBMUJFWSA-N	0	3	305.378	2.363	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000176263838	402295098	/nfs/dbraw/zinc/29/50/98/402295098.db2.gz	NCAMHGFEFYSKTJ-GOEBONIOSA-N	0	3	319.449	2.449	10	0		DEAEHN
Cc1oc2ccccc2c1C(=O)NC[C@H](O)CN1CCCCC1	ZINC000184727817	402295307	/nfs/dbraw/zinc/29/53/07/402295307.db2.gz	CSEHUHIDVARHNR-AWEZNQCLSA-N	0	3	316.401	2.318	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1cccc(C(=O)OC)c1	ZINC000176298459	402298101	/nfs/dbraw/zinc/29/81/01/402298101.db2.gz	DHPRIFHELAIBPC-OAHLLOKOSA-N	0	3	319.405	2.421	10	0		DEAEHN
Cc1ccn2c(c1)nnc2NC(=O)C1Oc2ccccc2O[C@@H]1C	ZINC000176307582	402298616	/nfs/dbraw/zinc/29/86/16/402298616.db2.gz	ZLQNNSRFTLKGER-ABAIWWIYSA-N	0	3	324.340	2.205	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1cc(C)cnc1OC	ZINC000176384669	402304714	/nfs/dbraw/zinc/30/47/14/402304714.db2.gz	PTUAMQQYWWMBHX-ZDUSSCGKSA-N	0	3	306.410	2.347	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2ccc3c(c2)C(=O)CCC3)C1	ZINC000177306132	402389194	/nfs/dbraw/zinc/38/91/94/402389194.db2.gz	KCBBACFVPDVZTK-CQSZACIVSA-N	0	3	301.390	2.373	10	0		DEAEHN
CN(C)S(=O)(=O)CCNCc1ccc(C(C)(C)C)s1	ZINC000230991128	402353493	/nfs/dbraw/zinc/35/34/93/402353493.db2.gz	AWIGONIXTPLLKN-UHFFFAOYSA-N	0	3	304.481	2.027	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1[nH]c(C)c(C(C)=O)c1C	ZINC000176963869	402354825	/nfs/dbraw/zinc/35/48/25/402354825.db2.gz	MQGHRRIYXBQNOH-AWEZNQCLSA-N	0	3	305.422	2.390	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1ccc(Cl)cc1	ZINC000177004874	402358667	/nfs/dbraw/zinc/35/86/67/402358667.db2.gz	NNWYOGIJTXQPRM-CQSZACIVSA-N	0	3	323.824	2.221	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)[C@H]1CSCCS1	ZINC000177009706	402359371	/nfs/dbraw/zinc/35/93/71/402359371.db2.gz	RABRVZAASNOWPP-LSDHHAIUSA-N	0	3	324.515	2.124	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@@H]1CC(=O)Nc2ccccc21	ZINC000177020418	402360210	/nfs/dbraw/zinc/36/02/10/402360210.db2.gz	BNCKJMCNLNUZSI-DZGCQCFKSA-N	0	3	315.417	2.055	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)NCc1ccn(C2CCCC2)n1	ZINC000185573928	402362577	/nfs/dbraw/zinc/36/25/77/402362577.db2.gz	WIERJDYZPAOZCW-UHFFFAOYSA-N	0	3	319.453	2.234	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1C(=O)c1cc(C(C)C)[nH]n1	ZINC000177165054	402377273	/nfs/dbraw/zinc/37/72/73/402377273.db2.gz	YIIMXFMDZBNACO-ZDUSSCGKSA-N	0	3	301.394	2.343	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCC[C@H]1CCCO	ZINC000161654980	402394710	/nfs/dbraw/zinc/39/47/10/402394710.db2.gz	ZVLOKXPUEAMKIK-KRWDZBQOSA-N	0	3	304.434	2.272	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCOc1ccccc1C	ZINC000177421869	402400607	/nfs/dbraw/zinc/40/06/07/402400607.db2.gz	YIJRNQDSPXFOLI-MRXNPFEDSA-N	0	3	319.449	2.500	10	0		DEAEHN
COCCNCCNC(=O)c1sc(C2CCCC2)nc1C	ZINC000237348819	402405329	/nfs/dbraw/zinc/40/53/29/402405329.db2.gz	NULGFJNPUGADDB-UHFFFAOYSA-N	0	3	311.451	2.075	10	0		DEAEHN
COc1cccc(N2CCC[C@H](NC(=O)C3(N)CCCC3)C2)c1	ZINC000237453896	402409164	/nfs/dbraw/zinc/40/91/64/402409164.db2.gz	YGBUAVHGEKCNMV-AWEZNQCLSA-N	0	3	317.433	2.052	10	0		DEAEHN
Cc1ccc(C[C@H](C)N(C)C(=O)C[C@@H]2CSCCN2)cc1	ZINC000237542457	402411881	/nfs/dbraw/zinc/41/18/81/402411881.db2.gz	JUCOHSBKDAHICH-GOEBONIOSA-N	0	3	306.475	2.480	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)Nc1ccc(OC)cc1	ZINC000177697168	402427909	/nfs/dbraw/zinc/42/79/09/402427909.db2.gz	RDCANSVCCYEUHE-OAHLLOKOSA-N	0	3	305.422	2.050	10	0		DEAEHN
CCn1cc(C2CCN([C@@H]3CCCN(C(C)C)C3=O)CC2)cn1	ZINC000177697968	402428077	/nfs/dbraw/zinc/42/80/77/402428077.db2.gz	LBYGWMUCSWIQER-QGZVFWFLSA-N	0	3	318.465	2.482	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2cccc(N(C)C)n2)C12CCOCC2	ZINC000186433406	402430752	/nfs/dbraw/zinc/43/07/52/402430752.db2.gz	JNRQUBGFSDYKGQ-HZPDHXFCSA-N	0	3	319.449	2.211	10	0		DEAEHN
CC1CCN(CCNC(=O)N2CC[C@]3(O)CCCC[C@@H]3C2)CC1	ZINC000162772044	402431322	/nfs/dbraw/zinc/43/13/22/402431322.db2.gz	IRFIMPJCMUSVIY-SJLPKXTDSA-N	0	3	323.481	2.055	10	0		DEAEHN
N[C@@H](CC(=O)N1CCn2c3ccccc3nc21)c1ccccc1	ZINC000163289908	402446266	/nfs/dbraw/zinc/44/62/66/402446266.db2.gz	ZFDGSTBRZNUVCP-AWEZNQCLSA-N	0	3	306.369	2.473	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nn1cnc2ccccc21	ZINC000177308828	402389763	/nfs/dbraw/zinc/38/97/63/402389763.db2.gz	OMZMDZRGLGDWDB-ZDUSSCGKSA-N	0	3	301.394	2.116	10	0		DEAEHN
CC(C)[C@H](C(=O)N[C@@H]1Cc2ccccc2[C@@H]1O)N1CCCCC1	ZINC000178561834	402511882	/nfs/dbraw/zinc/51/18/82/402511882.db2.gz	IXKTUBSMUAAWET-KURKYZTESA-N	0	3	316.445	2.271	10	0		DEAEHN
C[C@@H]1CCN(C[C@H](O)Cn2cccn2)[C@H]1c1cccc(F)c1	ZINC000245408046	402457310	/nfs/dbraw/zinc/45/73/10/402457310.db2.gz	FHWOSXPYLYQAPN-XOKHGSTOSA-N	0	3	303.381	2.466	10	0		DEAEHN
C[C@@H]1CCN(C[C@@H](O)Cn2cccn2)[C@H]1c1cccc(F)c1	ZINC000245408045	402457459	/nfs/dbraw/zinc/45/74/59/402457459.db2.gz	FHWOSXPYLYQAPN-KBRIMQKVSA-N	0	3	303.381	2.466	10	0		DEAEHN
COc1ccc(C(C)(C)C(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000178112911	402461738	/nfs/dbraw/zinc/46/17/38/402461738.db2.gz	LTFWFBUFSDJFJS-HNNXBMFYSA-N	0	3	302.418	2.279	10	0		DEAEHN
c1csc(-c2noc(CN3CCN4CCCC[C@H]4C3)n2)c1	ZINC000246127225	402512237	/nfs/dbraw/zinc/51/22/37/402512237.db2.gz	BPLQODKULZVHMM-LBPRGKRZSA-N	0	3	304.419	2.468	10	0		DEAEHN
CCc1cnc(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)s1	ZINC000245497032	402466115	/nfs/dbraw/zinc/46/61/15/402466115.db2.gz	SPWKBRVQBLVLBX-NWDGAFQWSA-N	0	3	310.467	2.330	10	0		DEAEHN
C[C@H](N[C@H]1CCCN(c2ncccn2)C1)c1cncc(F)c1	ZINC000178194818	402470033	/nfs/dbraw/zinc/47/00/33/402470033.db2.gz	KZWFDTKBQYDWOG-WFASDCNBSA-N	0	3	301.369	2.330	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N[C@H](C)COCc1ccccc1	ZINC000245592850	402472923	/nfs/dbraw/zinc/47/29/23/402472923.db2.gz	BFQOVZAUBBNZEL-NVXWUHKLSA-N	0	3	319.449	2.375	10	0		DEAEHN
CC[C@H](CSC)N(C)CC(=O)N1CCO[C@@H]2CCCC[C@@H]21	ZINC000245601457	402473836	/nfs/dbraw/zinc/47/38/36/402473836.db2.gz	PEBZNTODGYMDRU-QLFBSQMISA-N	0	3	314.495	2.230	10	0		DEAEHN
COCc1nc(C)c(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)s1	ZINC000245625457	402475390	/nfs/dbraw/zinc/47/53/90/402475390.db2.gz	GJUCSFOJYRZXBX-CMPLNLGQSA-N	0	3	311.451	2.153	10	0		DEAEHN
COC(=O)[C@@H]1C[C@H](c2ccccc2)CN(Cc2c[nH]nc2C)C1	ZINC000245698341	402480812	/nfs/dbraw/zinc/48/08/12/402480812.db2.gz	BHBNACHHOFJCDI-JKSUJKDBSA-N	0	3	313.401	2.497	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CC(=O)N1CCc2ccccc21	ZINC000178332632	402485723	/nfs/dbraw/zinc/48/57/23/402485723.db2.gz	JCEUHVKZOVULCL-QGZVFWFLSA-N	0	3	324.428	2.245	10	0		DEAEHN
Cc1cnn(CCCCCN2CCN(c3cc(C)[nH]n3)CC2)c1	ZINC000187206990	402488382	/nfs/dbraw/zinc/48/83/82/402488382.db2.gz	OMTJRPUGEKIWJI-UHFFFAOYSA-N	0	3	316.453	2.216	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1csc([C@H]2CCCO2)n1	ZINC000245881137	402494109	/nfs/dbraw/zinc/49/41/09/402494109.db2.gz	IARLFILKQYDICR-MBNYWOFBSA-N	0	3	321.446	2.303	10	0		DEAEHN
CC(C)(C)S(=O)(=O)CCN[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2	ZINC000245958299	402500770	/nfs/dbraw/zinc/50/07/70/402500770.db2.gz	XRGQRXGACPELQJ-BFHYXJOUSA-N	0	3	315.479	2.137	10	0		DEAEHN
C/C(=C\C(=O)NC[C@H](O)CN1CCCCC1)c1ccccc1	ZINC000178517473	402506632	/nfs/dbraw/zinc/50/66/32/402506632.db2.gz	SDNLWENAENUTPF-VMEIHUARSA-N	0	3	302.418	2.053	10	0		DEAEHN
CS[C@H](C(=O)NC[C@H](O)CN1CCCCC1)c1ccccc1	ZINC000178517923	402506881	/nfs/dbraw/zinc/50/68/81/402506881.db2.gz	AIIOFVKLFSKPTK-HOTGVXAUSA-N	0	3	322.474	2.054	10	0		DEAEHN
COc1c(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)c(C)nn1C	ZINC000246091299	402509029	/nfs/dbraw/zinc/50/90/29/402509029.db2.gz	IPBXHHZBYLBSBH-WMLDXEAASA-N	0	3	318.465	2.186	10	0		DEAEHN
COCC[C@H](Cc1cccc(F)c1)NCc1cc(C(N)=O)co1	ZINC000187706584	402509305	/nfs/dbraw/zinc/50/93/05/402509305.db2.gz	WZQVGARSFVBYSE-OAHLLOKOSA-N	0	3	320.364	2.255	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NC[C@H](CCO)CC(C)C	ZINC000246734043	402542506	/nfs/dbraw/zinc/54/25/06/402542506.db2.gz	XUGCIDRHJSLFME-CVEARBPZSA-N	0	3	313.486	2.157	10	0		DEAEHN
COC(=O)Nc1ccccc1C(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000246756083	402543768	/nfs/dbraw/zinc/54/37/68/402543768.db2.gz	AJWXBTWPTSTWNQ-OLZOCXBDSA-N	0	3	317.389	2.174	10	0		DEAEHN
CC[C@@H]1CN(Cc2cn3c(cccc3C)n2)CCN1CCOC	ZINC000170940367	402543892	/nfs/dbraw/zinc/54/38/92/402543892.db2.gz	MBVKWOOODPQEJT-QGZVFWFLSA-N	0	3	316.449	2.185	10	0		DEAEHN
CC[C@H]1CN(CCc2ccc(F)c(F)c2)CCN1C[C@H](C)O	ZINC000246937599	402550492	/nfs/dbraw/zinc/55/04/92/402550492.db2.gz	WSRZAQCFVOWOJE-ZFWWWQNUSA-N	0	3	312.404	2.284	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000246944996	402550521	/nfs/dbraw/zinc/55/05/21/402550521.db2.gz	HXEZMZLVPYHCEJ-JKIFEVAISA-N	0	3	324.490	2.469	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cncc(Br)c1	ZINC000246961053	402551133	/nfs/dbraw/zinc/55/11/33/402551133.db2.gz	DJSIFRIPTUMFCY-GWCFXTLKSA-N	0	3	324.222	2.153	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2ccccc2N2CCCC2)C1	ZINC000171071987	402554686	/nfs/dbraw/zinc/55/46/86/402554686.db2.gz	IVFCMCAKWZXVIY-CQSZACIVSA-N	0	3	302.422	2.455	10	0		DEAEHN
CN(C)C1(CN(C)C(=O)N[C@@H]2COc3ccccc32)CCC1	ZINC000189752051	402556755	/nfs/dbraw/zinc/55/67/55/402556755.db2.gz	JDYYWDMKJFMTIB-CQSZACIVSA-N	0	3	303.406	2.246	10	0		DEAEHN
C[C@H](O)CN1CCN(CCOc2cccc(Cl)c2)C[C@H]1C	ZINC000247161822	402558947	/nfs/dbraw/zinc/55/89/47/402558947.db2.gz	MJNJKQRTEWQQFM-KGLIPLIRSA-N	0	3	312.841	2.106	10	0		DEAEHN
COCCN(C)CCCNC(=O)Nc1cccc([C@@H](C)OC)c1	ZINC000171176412	402563618	/nfs/dbraw/zinc/56/36/18/402563618.db2.gz	JHPUVOONJMXWNI-CQSZACIVSA-N	0	3	323.437	2.484	10	0		DEAEHN
CC[C@@H](C)NC(=O)CN[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000189893230	402564898	/nfs/dbraw/zinc/56/48/98/402564898.db2.gz	BYLQKASTBASOEK-KGLIPLIRSA-N	0	3	300.406	2.438	10	0		DEAEHN
CN(C)C(=O)CN1CCCCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000246177200	402515545	/nfs/dbraw/zinc/51/55/45/402515545.db2.gz	GLHQSGMQPKKSTP-DLBZAZTESA-N	0	3	304.434	2.443	10	0		DEAEHN
Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)N1CCN2CCC[C@@H]2C1	ZINC000178626346	402519030	/nfs/dbraw/zinc/51/90/30/402519030.db2.gz	VYFRHOHSGLGZIM-GVDBMIGSSA-N	0	3	315.461	2.341	10	0		DEAEHN
CC[C@H](C(=O)NC1CCN(c2ccccc2OC)CC1)N(C)C	ZINC000178710531	402529133	/nfs/dbraw/zinc/52/91/33/402529133.db2.gz	XAABQTQIEFBQGI-OAHLLOKOSA-N	0	3	319.449	2.120	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NC[C@@H]2CCCc3ccccc32)C1	ZINC000170830483	402530220	/nfs/dbraw/zinc/53/02/20/402530220.db2.gz	GXQYAYUWIMKBLG-JKSUJKDBSA-N	0	3	301.434	2.452	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)N1CC[C@@H](N(C)C)C1)c1ccco1	ZINC000170834782	402530735	/nfs/dbraw/zinc/53/07/35/402530735.db2.gz	PTDQJDRBOBWUHJ-CABCVRRESA-N	0	3	322.453	2.008	10	0		DEAEHN
Cc1ccc(OCCCNC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170836129	402531449	/nfs/dbraw/zinc/53/14/49/402531449.db2.gz	HDGIUMPMMZAFQH-OAHLLOKOSA-N	0	3	305.422	2.109	10	0		DEAEHN
Cc1cc(-n2c(C)cc(C(=O)N3CC[C@@H](N(C)C)C3)c2C)no1	ZINC000170856791	402533596	/nfs/dbraw/zinc/53/35/96/402533596.db2.gz	HWZOPCDHBQPSBY-CQSZACIVSA-N	0	3	316.405	2.167	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(-n3cc[nH]c3=S)cc2)C1	ZINC000170865633	402534932	/nfs/dbraw/zinc/53/49/32/402534932.db2.gz	GILNHYSWTGMLHN-AWEZNQCLSA-N	0	3	316.430	2.311	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)COc2ccc(C(F)(F)F)cc2)C1	ZINC000170865391	402535306	/nfs/dbraw/zinc/53/53/06/402535306.db2.gz	OOAVAFUIDAXHDN-LBPRGKRZSA-N	0	3	316.323	2.247	10	0		DEAEHN
CCc1c(C(=O)N2CC[C@@H](N(C)C)C2)cnn1-c1ccccc1	ZINC000170867411	402535927	/nfs/dbraw/zinc/53/59/27/402535927.db2.gz	BTHOMBKQZINGOD-OAHLLOKOSA-N	0	3	312.417	2.211	10	0		DEAEHN
Cc1nc(CCNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)sc1C	ZINC000248025831	402580721	/nfs/dbraw/zinc/58/07/21/402580721.db2.gz	OZKLBNWRHOOGKI-SMDDNHRTSA-N	0	3	324.494	2.427	10	0		DEAEHN
C[C@H](O)C[C@H](C)CNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248047687	402581543	/nfs/dbraw/zinc/58/15/43/402581543.db2.gz	NFXNBXDIESAEOB-OTRWWLKZSA-N	0	3	319.449	2.138	10	0		DEAEHN
c1ccc(COc2ccnc(N3CCN4CCC[C@@H]4C3)n2)cc1	ZINC000179235017	402582193	/nfs/dbraw/zinc/58/21/93/402582193.db2.gz	LPDBVTURGVRUHU-MRXNPFEDSA-N	0	3	310.401	2.340	10	0		DEAEHN
CC(C)[C@](C)(O)CNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179471974	402591616	/nfs/dbraw/zinc/59/16/16/402591616.db2.gz	SYCWEBSCRHZHSK-LZLYRXPVSA-N	0	3	319.449	2.138	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H](C)c2ncc(C)s2)C1	ZINC000248543090	402594967	/nfs/dbraw/zinc/59/49/67/402594967.db2.gz	CHXBSWCAERPEIA-AAEUAGOBSA-N	0	3	310.467	2.339	10	0		DEAEHN
C[C@H](C(=O)Nc1ccc(F)cc1F)N1CCN2CCC[C@@H]2C1	ZINC000171639021	402604363	/nfs/dbraw/zinc/60/43/63/402604363.db2.gz	QZVSKRYDEWEFGC-DGCLKSJQSA-N	0	3	309.360	2.072	10	0		DEAEHN
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)Nc2ccon2)C1	ZINC000190509822	402606562	/nfs/dbraw/zinc/60/65/62/402606562.db2.gz	QKVBIFPLIJCVSO-CQSZACIVSA-N	0	3	315.377	2.055	10	0		DEAEHN
CN(Cc1cccc2nccn21)[C@H]1CCCN(c2cccnn2)C1	ZINC000180078921	402606883	/nfs/dbraw/zinc/60/68/83/402606883.db2.gz	FDPKSFGLKKWYGN-HNNXBMFYSA-N	0	3	322.416	2.225	10	0		DEAEHN
CCOc1ccc(OC[C@@H](O)CN2[C@H](C)C[C@@H](O)C[C@@H]2C)cc1	ZINC000248829896	402610001	/nfs/dbraw/zinc/61/00/01/402610001.db2.gz	LHPBWDWTPLPOEK-FZKCQIBNSA-N	0	3	323.433	2.059	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)[C@H]2CCOC[C@H]2C)CN1Cc1ccccc1	ZINC000248833259	402610045	/nfs/dbraw/zinc/61/00/45/402610045.db2.gz	MXPDGWRZQNSISH-ATLSCFEFSA-N	0	3	316.445	2.438	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000171768204	402620305	/nfs/dbraw/zinc/62/03/05/402620305.db2.gz	YGZRXJIZWKTVKL-RYUDHWBXSA-N	0	3	307.360	2.312	10	0		DEAEHN
CCn1cc([C@@H](C)N[C@H]2CCc3nc(C(C)C)nn3C2)cn1	ZINC000180653701	402622438	/nfs/dbraw/zinc/62/24/38/402622438.db2.gz	CLPTVXYYTRXSKJ-OCCSQVGLSA-N	0	3	302.426	2.284	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2cc(F)cc3cccnc32)[C@@H](C)C1	ZINC000249307737	402625482	/nfs/dbraw/zinc/62/54/82/402625482.db2.gz	UKQCRGIQJBLAOG-KBPBESRZSA-N	0	3	317.408	2.261	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@H]2COc3ccc(Cl)cc3C2)C1	ZINC000249611630	402636852	/nfs/dbraw/zinc/63/68/52/402636852.db2.gz	MGPZWGRDSJOJSQ-ZFWWWQNUSA-N	0	3	322.836	2.492	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NC[C@H](c2ccco2)N(C)C)CCN1C	ZINC000252537989	402658702	/nfs/dbraw/zinc/65/87/02/402658702.db2.gz	BWXKWESOHQCYLS-RBSFLKMASA-N	0	3	322.453	2.006	10	0		DEAEHN
Oc1cccc(N2CCN(C[C@H](O)CC3CCCC3)CC2)c1	ZINC000191270919	402656091	/nfs/dbraw/zinc/65/60/91/402656091.db2.gz	MNGRJLYITUWWEU-GOSISDBHSA-N	0	3	304.434	2.455	10	0		DEAEHN
COCCCN(C)CCNC(=O)N1CCC[C@]2(CC=CCC2)C1	ZINC000173585849	402704296	/nfs/dbraw/zinc/70/42/96/402704296.db2.gz	PFOLHMMOAHDEHF-GOSISDBHSA-N	0	3	323.481	2.487	10	0		DEAEHN
O=C(N[C@@H]1CCCc2occc21)N1CC[C@H](N2CC=CC2)C1	ZINC000173950909	402721215	/nfs/dbraw/zinc/72/12/15/402721215.db2.gz	GXKBNEOWEVVYRG-DZGCQCFKSA-N	0	3	301.390	2.313	10	0		DEAEHN
CCc1nc(CNC(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)cs1	ZINC000182766218	402714644	/nfs/dbraw/zinc/71/46/44/402714644.db2.gz	QRXBOWNELLXJMS-OCCSQVGLSA-N	0	3	322.478	2.331	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1C	ZINC000173883190	402717105	/nfs/dbraw/zinc/71/71/05/402717105.db2.gz	ARTBBOCNLZBALN-GOEBONIOSA-N	0	3	310.463	2.310	10	0		DEAEHN
Cc1cccc2[nH]cc(CCN[C@H]3CCCS(=O)(=O)C3)c21	ZINC000182807920	402717965	/nfs/dbraw/zinc/71/79/65/402717965.db2.gz	PBEYCGFEKFWEDE-AWEZNQCLSA-N	0	3	306.431	2.186	10	0		DEAEHN
CC[C@@H]1COCCN1C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000252801368	402661076	/nfs/dbraw/zinc/66/10/76/402661076.db2.gz	CQDUFDVWRIWYTH-IKGGRYGDSA-N	0	3	317.433	2.252	10	0		DEAEHN
CC(C)[C@@H](NCCNC(=O)c1ccn[nH]1)c1ccc(F)c(F)c1	ZINC000182224117	402674141	/nfs/dbraw/zinc/67/41/41/402674141.db2.gz	WAMPRLDDZFZYCV-OAHLLOKOSA-N	0	3	322.359	2.405	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N[C@@H]1CCc3ncnn3C1)CCS2	ZINC000191529730	402676564	/nfs/dbraw/zinc/67/65/64/402676564.db2.gz	SXZXYVGGKAQBBR-RISCZKNCSA-N	0	3	316.430	2.428	10	0		DEAEHN
COC(=O)c1ccccc1OCCN1CCN2CCCC[C@@H]2C1	ZINC000182340400	402682248	/nfs/dbraw/zinc/68/22/48/402682248.db2.gz	AYCKDFHGOVLYNR-OAHLLOKOSA-N	0	3	318.417	2.022	10	0		DEAEHN
C[C@H](CNC(=O)c1cnn(CCC(F)(F)F)c1)N(C)C1CC1	ZINC000182384127	402685639	/nfs/dbraw/zinc/68/56/39/402685639.db2.gz	PVQAJOJHUSJAJB-SNVBAGLBSA-N	0	3	318.343	2.048	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1N[C@@H]1CCN(c2ccccc2Cl)C1=O	ZINC000191694025	402686850	/nfs/dbraw/zinc/68/68/50/402686850.db2.gz	SOSVFFGYJDBMPV-KWCYVHTRSA-N	0	3	308.809	2.460	10	0		DEAEHN
Cc1ccccc1CS(=O)(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000173276685	402690912	/nfs/dbraw/zinc/69/09/12/402690912.db2.gz	FSTRGRURAJIGMD-GDBMZVCRSA-N	0	3	310.463	2.239	10	0		DEAEHN
Cc1cc(C)n(CCCNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)n1	ZINC000173338229	402693330	/nfs/dbraw/zinc/69/33/30/402693330.db2.gz	AMOPTIJKJPFUCE-ZBFHGGJFSA-N	0	3	321.469	2.014	10	0		DEAEHN
Cc1cccc(C)c1OCCN1CC[C@H](N2CCOCC2)C1	ZINC000173944049	402720727	/nfs/dbraw/zinc/72/07/27/402720727.db2.gz	RRKKNVVJDDHTCB-KRWDZBQOSA-N	0	3	304.434	2.089	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1n[nH]c2c1CCCCC2	ZINC000191928366	402699296	/nfs/dbraw/zinc/69/92/96/402699296.db2.gz	MRHCOFMXFHWCSV-ZIAGYGMSSA-N	0	3	316.449	2.377	10	0		DEAEHN
Cc1cccc(N(C)C(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000262412808	402725642	/nfs/dbraw/zinc/72/56/42/402725642.db2.gz	DHKLPTNHSQISPW-RLFYNMQTSA-N	0	3	302.418	2.490	10	0		DEAEHN
CCO[C@@H]1C[C@](N)(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)C1(C)C	ZINC000262541405	402727285	/nfs/dbraw/zinc/72/72/85/402727285.db2.gz	RDSZMKZWMWOVQX-ADAWSYLGSA-N	0	3	302.418	2.191	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000174233232	402732622	/nfs/dbraw/zinc/73/26/22/402732622.db2.gz	OUVPKARKLAMVEP-DOTOQJQBSA-N	0	3	319.449	2.375	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1ccc(N2CCCC2)cc1)[C@@H]1CCCO1	ZINC000183115860	402739866	/nfs/dbraw/zinc/73/98/66/402739866.db2.gz	OTEPQIISQWGXBA-PBHICJAKSA-N	0	3	317.433	2.382	10	0		DEAEHN
CC[C@@H](C)NC(=O)CN[C@@H](C)c1ccccc1-n1cccn1	ZINC000183156336	402743334	/nfs/dbraw/zinc/74/33/34/402743334.db2.gz	NVDPPLCQFRBJNJ-KGLIPLIRSA-N	0	3	300.406	2.438	10	0		DEAEHN
Cc1cccc(OCCNC(=O)[C@H](C)N[C@H](C)[C@@H]2CCCO2)c1	ZINC000183193771	402746197	/nfs/dbraw/zinc/74/61/97/402746197.db2.gz	JJPOIBKEVTXLBW-VYDXJSESSA-N	0	3	320.433	2.036	10	0		DEAEHN
CCCOc1cccc(CNC(=O)CN[C@H](C)[C@H]2CCCO2)c1	ZINC000183222235	402748480	/nfs/dbraw/zinc/74/84/80/402748480.db2.gz	GKJFHSFWWKIBND-RHSMWYFYSA-N	0	3	320.433	2.249	10	0		DEAEHN
COc1ccc(NC(=O)CN[C@@H](C)[C@@H]2CCCO2)cc1Cl	ZINC000183222835	402748747	/nfs/dbraw/zinc/74/87/47/402748747.db2.gz	MOCWKKFZMJPRDK-GWCFXTLKSA-N	0	3	312.797	2.444	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)c1cc(F)cc2nccnc21	ZINC000193991997	402781402	/nfs/dbraw/zinc/78/14/02/402781402.db2.gz	ZRHWKQXEIVGBGB-GFCCVEGCSA-N	0	3	316.380	2.373	10	0		DEAEHN
Cc1nc(CC(C)C)sc1-c1nc([C@H]2CNCCN2C)no1	ZINC000263266485	402751965	/nfs/dbraw/zinc/75/19/65/402751965.db2.gz	RQHNBYKIZQEXNN-LLVKDONJSA-N	0	3	321.450	2.276	10	0		DEAEHN
O=C(NCc1cc(F)ccc1F)N1CC[C@H](N2CC=CC2)C1	ZINC000174752219	402755225	/nfs/dbraw/zinc/75/52/25/402755225.db2.gz	QTXYMLGPANNNBW-AWEZNQCLSA-N	0	3	307.344	2.121	10	0		DEAEHN
O=C(NC[C@@H]1CCc2ccccc21)N1CC[C@H](N2CC=CC2)C1	ZINC000174836283	402759831	/nfs/dbraw/zinc/75/98/31/402759831.db2.gz	VLGFTNZNABXFLT-IRXDYDNUSA-N	0	3	311.429	2.372	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(Cc3ccccc3F)C2)CC1	ZINC000174887118	402761746	/nfs/dbraw/zinc/76/17/46/402761746.db2.gz	QRBATJVEYARDFY-QGZVFWFLSA-N	0	3	305.441	2.428	10	0		DEAEHN
CCN1CCN(C[C@@H](C)CNC(=O)N[C@H](C)C2CCCC2)CC1	ZINC000174920260	402763046	/nfs/dbraw/zinc/76/30/46/402763046.db2.gz	UKZHCWZZGOTSNF-JKSUJKDBSA-N	0	3	324.513	2.138	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cccc2c1OCO2	ZINC000174995783	402770401	/nfs/dbraw/zinc/77/04/01/402770401.db2.gz	UROCAYSMAGXILF-CHWSQXEVSA-N	0	3	302.374	2.114	10	0		DEAEHN
COC(=O)c1cccc(NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000175012241	402771440	/nfs/dbraw/zinc/77/14/40/402771440.db2.gz	GLEQNUSPFDQZLF-IUODEOHRSA-N	0	3	319.405	2.420	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc(OC)cc2OC)C1	ZINC000194318669	402792300	/nfs/dbraw/zinc/79/23/00/402792300.db2.gz	FDEMHCQPOCVVSF-GFCCVEGCSA-N	0	3	307.394	2.310	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cc(OC)cc(OC)c2)C1	ZINC000194317151	402792379	/nfs/dbraw/zinc/79/23/79/402792379.db2.gz	PHAIBTCVRSZGEL-LBPRGKRZSA-N	0	3	307.394	2.310	10	0		DEAEHN
CN1CCN(C(=O)CN[C@H](c2ccc(Cl)cc2)C2CC2)CC1	ZINC000183728417	402792915	/nfs/dbraw/zinc/79/29/15/402792915.db2.gz	SPOUBENZFDFWCP-KRWDZBQOSA-N	0	3	321.852	2.155	10	0		DEAEHN
O=C(CCCOCCc1ccccc1)N1CCN2CCC[C@H]2C1	ZINC000195335083	402842387	/nfs/dbraw/zinc/84/23/87/402842387.db2.gz	PITRVQQAQXTFNI-SFHVURJKSA-N	0	3	316.445	2.333	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)N(C)Cc1ccccc1	ZINC000175342211	402798465	/nfs/dbraw/zinc/79/84/65/402798465.db2.gz	PBYNZURMAMKFPR-QGZVFWFLSA-N	0	3	303.450	2.061	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCCC[C@@H]1c1ncc[nH]1	ZINC000175389356	402801809	/nfs/dbraw/zinc/80/18/09/402801809.db2.gz	SIWJAESCNSNILD-ZIAGYGMSSA-N	0	3	305.426	2.131	10	0		DEAEHN
CCOC(=O)CCN[C@H](CO)c1cccc(Br)c1	ZINC000183912272	402804735	/nfs/dbraw/zinc/80/47/35/402804735.db2.gz	TZRGFKMSSJLFBU-GFCCVEGCSA-N	0	3	316.195	2.025	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)Nc2cccc3c2OCCO3)CCN1C	ZINC000175415681	402804910	/nfs/dbraw/zinc/80/49/10/402804910.db2.gz	APRFKTKOJLHWPL-STQMWFEESA-N	0	3	319.405	2.404	10	0		DEAEHN
CC[C@H](Oc1ccccc1F)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000175455476	402807710	/nfs/dbraw/zinc/80/77/10/402807710.db2.gz	LKIPEYXRITYHDH-HIFRSBDPSA-N	0	3	306.381	2.290	10	0		DEAEHN
CC(C)c1noc2ncc(C(=O)NC[C@H]3CCCN3C)cc21	ZINC000194715563	402812382	/nfs/dbraw/zinc/81/23/82/402812382.db2.gz	GUJORWFFSPEMOQ-GFCCVEGCSA-N	0	3	302.378	2.170	10	0		DEAEHN
CC[C@H](CNC(=O)N1CC[C@@H](N(C)C)C1)Oc1ccccc1F	ZINC000175957028	402844878	/nfs/dbraw/zinc/84/48/78/402844878.db2.gz	AUTWEHLJCQEPFX-ZIAGYGMSSA-N	0	3	323.412	2.329	10	0		DEAEHN
COC(=O)[C@@H](c1ccccc1C)N1CCCN(C2CC2)CC1	ZINC000184487493	402846374	/nfs/dbraw/zinc/84/63/74/402846374.db2.gz	OKRQGKQCXTXXIC-QGZVFWFLSA-N	0	3	302.418	2.379	10	0		DEAEHN
CCOC(=O)CC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000195492390	402847519	/nfs/dbraw/zinc/84/75/19/402847519.db2.gz	IZNIDMJCFVQDAK-INIZCTEOSA-N	0	3	318.417	2.111	10	0		DEAEHN
Cc1cn(-c2ccccc2)nc1C(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000184525035	402848655	/nfs/dbraw/zinc/84/86/55/402848655.db2.gz	YCQFKYQMPXVFHS-RDJZCZTQSA-N	0	3	324.428	2.489	10	0		DEAEHN
CCCCNC(=O)[C@H](C)N1CC[C@H](CNc2cccc(C)n2)C1	ZINC000195516256	402849835	/nfs/dbraw/zinc/84/98/35/402849835.db2.gz	NTSGHNSMKFFUIM-JKSUJKDBSA-N	0	3	318.465	2.429	10	0		DEAEHN
CN1CC[C@H](NC(=O)C[C@@](C)(O)C2CC2)[C@H]1c1ccccc1	ZINC000270399063	403187680	/nfs/dbraw/zinc/18/76/80/403187680.db2.gz	CFFKAODSTQHPEO-CGTJXYLNSA-N	0	3	302.418	2.099	10	0		DEAEHN
CCn1cc(CCN2C[C@H](O)C[C@@H]2c2cccc(OC)c2)cn1	ZINC000286213563	403474386	/nfs/dbraw/zinc/47/43/86/403474386.db2.gz	QPWPLLSIJUXERO-SJLPKXTDSA-N	0	3	315.417	2.262	10	0		DEAEHN
Cc1cc(C)n(-c2cncc(NCCN3CCCCC3)n2)n1	ZINC000301140430	403594791	/nfs/dbraw/zinc/59/47/91/403594791.db2.gz	ATMZOJAWAKFDSX-UHFFFAOYSA-N	0	3	300.410	2.177	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)C12CCC2	ZINC000246109446	286347702	/nfs/dbraw/zinc/34/77/02/286347702.db2.gz	HREUFLGZELPWDJ-FXUDXRNXSA-N	0	3	323.481	2.458	10	0		DEAEHN
CN1CC[C@H](NC(=O)[C@H]2CCn3cncc3C2)[C@@H]1c1ccccc1	ZINC000332759188	403613566	/nfs/dbraw/zinc/61/35/66/403613566.db2.gz	ZEYJLAYZGWUORE-SZMVWBNQSA-N	0	3	324.428	2.007	10	0		DEAEHN
COc1nc(C)nc(NCCCCN2C[C@@H](C)O[C@H](C)C2)c1C	ZINC000301862615	403691659	/nfs/dbraw/zinc/69/16/59/403691659.db2.gz	CPYIRRXCVRTPIG-CHWSQXEVSA-N	0	3	322.453	2.403	10	0		DEAEHN
Cc1cccc2c1ncnc2N1CCN(CC(C)(C)O)C[C@@H]1C	ZINC000302567346	403711743	/nfs/dbraw/zinc/71/17/43/403711743.db2.gz	XCTLPMIVPVKQNM-AWEZNQCLSA-N	0	3	314.433	2.220	10	0		DEAEHN
COc1cc(OC)c2ncnc(N3CCN(C(C)C)CC3)c2c1	ZINC000302702520	403713473	/nfs/dbraw/zinc/71/34/73/403713473.db2.gz	BNDQNJHFALJCBT-UHFFFAOYSA-N	0	3	316.405	2.177	10	0		DEAEHN
COc1coc(CN(C)[C@@H](C)Cc2ccc(O)cc2)cc1=O	ZINC000361729986	403827873	/nfs/dbraw/zinc/82/78/73/403827873.db2.gz	WKVUQTBXHDWZEK-LBPRGKRZSA-N	0	3	303.358	2.417	10	0		DEAEHN
COc1ccc2cc(CN3C[C@@H](OC)C[C@H]3CO)ccc2c1	ZINC000343993112	403833046	/nfs/dbraw/zinc/83/30/46/403833046.db2.gz	WTNITFKCSCMNBV-WMZOPIPTSA-N	0	3	301.386	2.430	10	0		DEAEHN
C[C@H]1CC(CNCc2c(Br)cnn2C)C[C@H](C)O1	ZINC000341489049	403995309	/nfs/dbraw/zinc/99/53/09/403995309.db2.gz	QDMSTOJVYUZNOM-UWVGGRQHSA-N	0	3	316.243	2.476	10	0		DEAEHN
COC(C)(C)C(=O)N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000323650726	404091932	/nfs/dbraw/zinc/09/19/32/404091932.db2.gz	WRRGCAQHCQINGP-OAHLLOKOSA-N	0	3	304.434	2.392	10	0		DEAEHN
c1nc(C2OCCO2)sc1CNCCCc1ccccn1	ZINC000290325855	404127240	/nfs/dbraw/zinc/12/72/40/404127240.db2.gz	JVHOJUVFWWSXRG-UHFFFAOYSA-N	0	3	305.403	2.306	10	0		DEAEHN
CC(C)OC1CC(N[C@@H](c2nccn2C)C2CCOCC2)C1	ZINC000344508292	404192378	/nfs/dbraw/zinc/19/23/78/404192378.db2.gz	GBIJZDYRMQZLPB-UYSNPLJNSA-N	0	3	307.438	2.433	10	0		DEAEHN
C([C@H]1CCOC1)N1CCN(C[C@@H]2CCOC2)C2(CCCCC2)C1	ZINC000370086044	404329596	/nfs/dbraw/zinc/32/95/96/404329596.db2.gz	CXYJHCJMJCPBLD-MSOLQXFVSA-N	0	3	322.493	2.380	10	0		DEAEHN
CC1(C)CCC(=CC(=O)NC[C@H]2CN3CCC[C@H]3CO2)CC1	ZINC000370964552	404431002	/nfs/dbraw/zinc/43/10/02/404431002.db2.gz	DHZANKFZZZMZNT-HOTGVXAUSA-N	0	3	306.450	2.492	10	0		DEAEHN
CC(C(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1)S(C)(=O)=O	ZINC000373876547	404624566	/nfs/dbraw/zinc/62/45/66/404624566.db2.gz	QDEZDHIXZBXVNU-IRUJWGPZSA-N	0	3	315.822	2.135	10	0		DEAEHN
c1c(CN[C@H]2CCCN(Cc3ccccc3)C2)nc2ncccn12	ZINC000297822792	404633932	/nfs/dbraw/zinc/63/39/32/404633932.db2.gz	ZBTIJOLQVQUCKF-KRWDZBQOSA-N	0	3	321.428	2.484	10	0		DEAEHN
COc1ccc2c(c1)CCN(C[C@H](O)CC(F)(F)F)CC2	ZINC000375981587	404783133	/nfs/dbraw/zinc/78/31/33/404783133.db2.gz	RLYWGEUFXULDJG-CYBMUJFWSA-N	0	3	303.324	2.409	10	0		DEAEHN
CCOC(=O)[C@H]1CN([C@@H](C)c2ccc(F)cc2)CC12COC2	ZINC000451141768	404878954	/nfs/dbraw/zinc/87/89/54/404878954.db2.gz	VZYSQZPURXZUNX-SWLSCSKDSA-N	0	3	307.365	2.398	10	0		DEAEHN
CC(C)(C)OC(=O)c1ccc(CNC[C@H](O)C(F)F)cc1	ZINC000360973625	404866874	/nfs/dbraw/zinc/86/68/74/404866874.db2.gz	DPHMAGMJBLFBIF-LBPRGKRZSA-N	0	3	301.333	2.358	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCCc1nc2cc(F)ccc2[nH]1	ZINC000361130138	404934930	/nfs/dbraw/zinc/93/49/30/404934930.db2.gz	SHRABKUCFYPBJJ-HNNXBMFYSA-N	0	3	318.396	2.235	10	0		DEAEHN
CC(C)c1ccc(CCN2CCC[C@@]3(C2)NC(=O)NC3=O)cc1	ZINC000435026748	404950940	/nfs/dbraw/zinc/95/09/40/404950940.db2.gz	BPEOALTXUFZGPA-SFHVURJKSA-N	0	3	315.417	2.027	10	0		DEAEHN
Cc1scc(C(=O)N2CCN([C@@H]3CCCN(C)C3)CC2)c1C	ZINC000367372078	405028377	/nfs/dbraw/zinc/02/83/77/405028377.db2.gz	PJZIRDGBKHSSKR-OAHLLOKOSA-N	0	3	321.490	2.217	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ncccc1N	ZINC000382754554	405031801	/nfs/dbraw/zinc/03/18/01/405031801.db2.gz	GERLISVONLSCAM-OAHLLOKOSA-N	0	3	324.428	2.400	10	0		DEAEHN
C/C=C\CNC[C@@H](O)COc1ccc(Br)cc1	ZINC000385081486	405034422	/nfs/dbraw/zinc/03/44/22/405034422.db2.gz	WULSDYBXFVLIOZ-ZZKXABKFSA-N	0	3	300.196	2.355	10	0		DEAEHN
C[C@@H](C[S@@](C)=O)NCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000361270245	405001026	/nfs/dbraw/zinc/00/10/26/405001026.db2.gz	DKYKNLUIOMORJR-LAJNKCICSA-N	0	3	311.447	2.499	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)c2cc(F)ccc2Br)C1	ZINC000389975137	405043736	/nfs/dbraw/zinc/04/37/36/405043736.db2.gz	IQELDQOCGUMZIC-SNVBAGLBSA-N	0	3	315.186	2.412	10	0		DEAEHN
Brc1cnn(CCN[C@H]2CCCc3n[nH]cc32)c1	ZINC000367705938	405131084	/nfs/dbraw/zinc/13/10/84/405131084.db2.gz	IIUVSTGDIFBIMQ-NSHDSACASA-N	0	3	310.199	2.036	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)CNC(C)(C)CN2CCCC2)cc1	ZINC000452095884	405164764	/nfs/dbraw/zinc/16/47/64/405164764.db2.gz	MGONACRKFYUPAI-UHFFFAOYSA-N	0	3	317.433	2.292	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCC2(C[C@@H]2NCc2cncnc2)CC1	ZINC000368048160	405223029	/nfs/dbraw/zinc/22/30/29/405223029.db2.gz	WZBYKJFKQRRZGO-AWEZNQCLSA-N	0	3	318.421	2.356	10	0		DEAEHN
C[C@H](CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O)CS(C)(=O)=O	ZINC000368269123	405233809	/nfs/dbraw/zinc/23/38/09/405233809.db2.gz	FDWBLXGISSKIAZ-QKPAOTATSA-N	0	3	317.495	2.073	10	0		DEAEHN
COc1cccc([C@H](C)CC(=O)NCCNc2ccncc2)c1	ZINC000440048248	405300384	/nfs/dbraw/zinc/30/03/84/405300384.db2.gz	DFBZQECEJMZXGH-CQSZACIVSA-N	0	3	313.401	2.234	10	0		DEAEHN
CN(C)CCn1nccc1NC(=O)N(C)C[C@@H]1CC=CCC1	ZINC000455663398	405441900	/nfs/dbraw/zinc/44/19/00/405441900.db2.gz	XNFNCIJRPYVIBU-CQSZACIVSA-N	0	3	305.426	2.265	10	0		DEAEHN
Cc1nn(C)cc1CC(=O)N(CCN(C)C)CC1CCCCC1	ZINC000448773305	405446709	/nfs/dbraw/zinc/44/67/09/405446709.db2.gz	HFYOALPBJPQWKR-UHFFFAOYSA-N	0	3	320.481	2.242	10	0		DEAEHN
COc1nsc(CNCC[C@@H](C)OC)c1Br	ZINC000638486019	405501809	/nfs/dbraw/zinc/50/18/09/405501809.db2.gz	OGSALSZVYNZHIF-SSDOTTSWSA-N	0	3	309.229	2.429	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@H](NCc2ccc(-c3cc[nH]n3)o2)C1	ZINC000577816115	405517895	/nfs/dbraw/zinc/51/78/95/405517895.db2.gz	GAGWYPYHKLHPKA-WCQYABFASA-N	0	3	323.418	2.115	10	0		DEAEHN
CN(CCCO)C(=O)NCC1(N(C)Cc2ccccc2)CCC1	ZINC000458985342	405678276	/nfs/dbraw/zinc/67/82/76/405678276.db2.gz	XIUXBCGKMBIZKS-UHFFFAOYSA-N	0	3	319.449	2.065	10	0		DEAEHN
Cc1cc(NC(=O)[C@@H](N)CN(C)Cc2ccccc2)cs1	ZINC000638994061	405806102	/nfs/dbraw/zinc/80/61/02/405806102.db2.gz	HGQOCASCBAIJSF-HNNXBMFYSA-N	0	3	303.431	2.454	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)N[C@H]2CCCC(F)(F)C2)CN1C1CC1	ZINC000495063207	405809242	/nfs/dbraw/zinc/80/92/42/405809242.db2.gz	WVYBTVNWOSQGBP-GRYCIOLGSA-N	0	3	301.381	2.489	10	0		DEAEHN
COc1ccc([C@@H](CO)CNCc2cnn3ccccc23)cc1	ZINC000459727448	406022918	/nfs/dbraw/zinc/02/29/18/406022918.db2.gz	FFIHLSSKQLAJJG-MRXNPFEDSA-N	0	3	311.385	2.209	10	0		DEAEHN
CC(=O)[C@](C)(O)CN[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1	ZINC000451042819	406027945	/nfs/dbraw/zinc/02/79/45/406027945.db2.gz	DXOUHZZPFNVWGU-OWCLPIDISA-N	0	3	310.825	2.015	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCC([C@H](O)C(F)(F)F)CC1	ZINC000532533258	406083051	/nfs/dbraw/zinc/08/30/51/406083051.db2.gz	RPEQGJCPFDOXDL-STQMWFEESA-N	0	3	322.371	2.023	10	0		DEAEHN
Cc1ccsc1[C@H]1C[C@@H]1C(=O)NCCNc1ccncc1	ZINC000534530108	406190512	/nfs/dbraw/zinc/19/05/12/406190512.db2.gz	MQBOXZYXJPUMBL-KBPBESRZSA-N	0	3	301.415	2.205	10	0		DEAEHN
C(N[C@@H]1CCC[C@@H]([C@@H]2CCOC2)C1)c1nnc2n1CCCC2	ZINC000547397038	406406822	/nfs/dbraw/zinc/40/68/22/406406822.db2.gz	CLANFBNGDVIXST-RBSFLKMASA-N	0	3	304.438	2.299	10	0		DEAEHN
Cc1cccc(CC(=O)NCCNc2ccncc2)c1Cl	ZINC000489060371	406375063	/nfs/dbraw/zinc/37/50/63/406375063.db2.gz	ZBWFEWWNQVDMKB-UHFFFAOYSA-N	0	3	303.793	2.236	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N(C)Cc1cccs1	ZINC000637880042	406460242	/nfs/dbraw/zinc/46/02/42/406460242.db2.gz	AEZSTJDZGTUHJZ-MRXNPFEDSA-N	0	3	317.458	2.166	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)N1C[C@@H](C)N(C)C[C@@H]1C)CC2	ZINC000526010067	406532542	/nfs/dbraw/zinc/53/25/42/406532542.db2.gz	NFFYGVBIAGLKDH-HZSPNIEDSA-N	0	3	318.465	2.189	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N1C[C@@H](C)N(C)C[C@@H]1C)C2	ZINC000526010067	406532545	/nfs/dbraw/zinc/53/25/45/406532545.db2.gz	NFFYGVBIAGLKDH-HZSPNIEDSA-N	0	3	318.465	2.189	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H](N)CN(C)Cc1ccccc1)C1CCCC1	ZINC000637989999	406512556	/nfs/dbraw/zinc/51/25/56/406512556.db2.gz	CPMCTOWDFFOGTR-PBHICJAKSA-N	0	3	303.450	2.141	10	0		DEAEHN
CC(C)C[C@@H]1CCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)C1	ZINC000637992955	406514538	/nfs/dbraw/zinc/51/45/38/406514538.db2.gz	WIKGQGAJQYUMEJ-ZWKOTPCHSA-N	0	3	317.477	2.340	10	0		DEAEHN
CC[C@@H]1C[C@@H](C)CN1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638006996	406520540	/nfs/dbraw/zinc/52/05/40/406520540.db2.gz	JYQDPKVVNOAYFV-DJIMGWMZSA-N	0	3	303.450	2.093	10	0		DEAEHN
C[C@H](NC(=O)[C@H]1CNCCOC1)c1ccc(Cl)c(Cl)c1	ZINC000643619841	407017938	/nfs/dbraw/zinc/01/79/38/407017938.db2.gz	HRXVOBKNXBSCSB-ONGXEEELSA-N	0	3	317.216	2.407	10	0		DEAEHN
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)[C@H]1CNCCOC1	ZINC000643619041	407018062	/nfs/dbraw/zinc/01/80/62/407018062.db2.gz	JXJAKLWCSVLLTC-NSHDSACASA-N	0	3	317.216	2.188	10	0		DEAEHN
COc1cc2c(cc1CNCC[C@H](C)[S@](C)=O)O[C@@H](C)C2	ZINC000129396137	196044961	/nfs/dbraw/zinc/04/49/61/196044961.db2.gz	JEBUFYQRDAUQBC-QSRBQVKKSA-N	0	3	311.447	2.265	10	0		DEAEHN
COC[C@@H](C)NCCOc1ccc(OC)cc1Br	ZINC000129642305	196063765	/nfs/dbraw/zinc/06/37/65/196063765.db2.gz	GUAGEPGDZYZZRC-SNVBAGLBSA-N	0	3	318.211	2.461	10	0		DEAEHN
C[C@@H](CN1C(=O)C2(CC2)N[C@H]1c1ccsc1)N1CCCC1	ZINC000130755592	196107458	/nfs/dbraw/zinc/10/74/58/196107458.db2.gz	BDWBZDYJDFLQKI-GXTWGEPZSA-N	0	3	305.447	2.195	10	0		DEAEHN
Cc1nc(-c2ncccc2Br)nc2c1CNCC2	ZINC000130898918	196120699	/nfs/dbraw/zinc/12/06/99/196120699.db2.gz	LEKIYGMLEKFYMI-UHFFFAOYSA-N	0	3	305.179	2.255	10	0		DEAEHN
CCS(=O)(=O)CCC[C@H](NC)c1ccc(OC)cc1F	ZINC000131012828	196131598	/nfs/dbraw/zinc/13/15/98/196131598.db2.gz	KMMIDEMVCLXUFD-AWEZNQCLSA-N	0	3	303.399	2.310	10	0		DEAEHN
CN[C@H](CCCS(C)(=O)=O)c1cc(Cl)ccc1OC	ZINC000131078901	196138106	/nfs/dbraw/zinc/13/81/06/196138106.db2.gz	DFYCUEHJJXNLFG-GFCCVEGCSA-N	0	3	305.827	2.434	10	0		DEAEHN
CCc1nn([C@@H]2CCS(=O)(=O)C2)c(CC)c1[C@@H](CC)NC	ZINC000131084440	196138994	/nfs/dbraw/zinc/13/89/94/196138994.db2.gz	WOANRUYZTDRROE-VXGBXAGGSA-N	0	3	313.467	2.038	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)Nc1nc(N)ncc1Br	ZINC000131178137	196148006	/nfs/dbraw/zinc/14/80/06/196148006.db2.gz	UXIRWXXJJJDHSD-VIFPVBQESA-N	0	3	316.247	2.210	10	0		DEAEHN
CNCc1cccc(S(=O)(=O)NCCCC(F)(F)F)c1	ZINC000131229444	196152630	/nfs/dbraw/zinc/15/26/30/196152630.db2.gz	XMFCAUMKRTUAEC-UHFFFAOYSA-N	0	3	310.341	2.027	10	0		DEAEHN
COc1ccc2c(N)c(C(=O)N(C)CCN(C)C)sc2c1	ZINC000131256708	196153931	/nfs/dbraw/zinc/15/39/31/196153931.db2.gz	MMRXJLUUAGHADP-UHFFFAOYSA-N	0	3	307.419	2.126	10	0		DEAEHN
Cc1nc([C@H]2CCS(=O)(=O)C2)sc1CNC(C)(C)C	ZINC000131268896	196154804	/nfs/dbraw/zinc/15/48/04/196154804.db2.gz	KUCOQQUQKIFTBG-JTQLQIEISA-N	0	3	302.465	2.242	10	0		DEAEHN
CS(=O)(=O)CCC[C@H](N)c1cc(F)ccc1Br	ZINC000131322661	196159758	/nfs/dbraw/zinc/15/97/58/196159758.db2.gz	KPRFPYCPQXWTOS-NSHDSACASA-N	0	3	324.215	2.413	10	0		DEAEHN
CN[C@@H](c1ncccc1F)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000131548030	196178386	/nfs/dbraw/zinc/17/83/86/196178386.db2.gz	GYAPQBMIGZPOMF-GMXVVIOVSA-N	0	3	300.399	2.085	10	0		DEAEHN
CS[C@@H](C)CCNS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000131612760	196184261	/nfs/dbraw/zinc/18/42/61/196184261.db2.gz	IEAYTXIJWQZLJY-NSHDSACASA-N	0	3	320.480	2.198	10	0		DEAEHN
CS[C@@H](C)CC[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000131612760	196184263	/nfs/dbraw/zinc/18/42/63/196184263.db2.gz	IEAYTXIJWQZLJY-NSHDSACASA-N	0	3	320.480	2.198	10	0		DEAEHN
CC(C)n1cc(S(=O)(=O)N2CC[C@H](C)[C@@H](C)C2)cc1CN	ZINC000131749838	196196361	/nfs/dbraw/zinc/19/63/61/196196361.db2.gz	PAZWBKDZDVOTHU-STQMWFEESA-N	0	3	313.467	2.194	10	0		DEAEHN
NC1(C(=O)Nc2ccccc2SC(F)F)CCOCC1	ZINC000132060024	196222737	/nfs/dbraw/zinc/22/27/37/196222737.db2.gz	VMPWGESVUMHJRY-UHFFFAOYSA-N	0	3	302.346	2.448	10	0		DEAEHN
CCN[C@@H](C[C@H]1CCCN(S(C)(=O)=O)C1)c1ccoc1C	ZINC000132754408	196280825	/nfs/dbraw/zinc/28/08/25/196280825.db2.gz	JUOKRHYEFQHLPI-HIFRSBDPSA-N	0	3	314.451	2.300	10	0		DEAEHN
C[C@H]1CNC[C@H](COCc2ccc(F)cc2Br)O1	ZINC000132805515	196285122	/nfs/dbraw/zinc/28/51/22/196285122.db2.gz	BVTQDPFCPNCNHB-JOYOIKCWSA-N	0	3	318.186	2.482	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)N[C@@H]1CCC[C@@H]2OCC[C@@H]21	ZINC000245748380	287269747	/nfs/dbraw/zinc/26/97/47/287269747.db2.gz	AMJFGYXVTPPNLM-FPCVCCKLSA-N	0	3	309.454	2.118	10	0		DEAEHN
COc1cc(C)cc(CNC(=O)N2CC[C@H](N3CC=CC3)C2)c1	ZINC000132964841	196300099	/nfs/dbraw/zinc/30/00/99/196300099.db2.gz	DNRAVWFBAXPPHA-INIZCTEOSA-N	0	3	315.417	2.159	10	0		DEAEHN
COC(=O)c1ccc(Cl)cc1N[C@H](C)C[C@H]1COCCN1	ZINC000133569155	196331588	/nfs/dbraw/zinc/33/15/88/196331588.db2.gz	QGEOEQBCVIYAOL-PWSUYJOCSA-N	0	3	312.797	2.306	10	0		DEAEHN
CC(=O)NC1CCN([C@@H](c2ccc(Cl)s2)[C@@H](C)N)CC1	ZINC000133741815	196332805	/nfs/dbraw/zinc/33/28/05/196332805.db2.gz	GRCLYWMNXIZZMV-YMTOWFKASA-N	0	3	315.870	2.390	10	0		DEAEHN
CCN[C@H](c1c(Cl)cnn1CCOC)[C@@H]1CO[C@@H](C)C1	ZINC000134095731	196361123	/nfs/dbraw/zinc/36/11/23/196361123.db2.gz	MHJHLLMXAADIFD-GVXVVHGQSA-N	0	3	301.818	2.259	10	0		DEAEHN
N[C@H](Cc1ccc(Cl)cc1F)[C@H]1CCCCS1(=O)=O	ZINC000134222764	196372027	/nfs/dbraw/zinc/37/20/27/196372027.db2.gz	LGYXDICJTJWYQH-CHWSQXEVSA-N	0	3	305.802	2.316	10	0		DEAEHN
CN(C)CCN(C(=O)NC[C@H]1CCC(C)(C)O1)C1CCCC1	ZINC000188225207	225014372	/nfs/dbraw/zinc/01/43/72/225014372.db2.gz	ZARMQIQANWTFPD-OAHLLOKOSA-N	0	3	311.470	2.460	10	0		DEAEHN
COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)NC[C@@H]2CCCN2C)c1	ZINC000248948862	225241504	/nfs/dbraw/zinc/24/15/04/225241504.db2.gz	CUGCKDAOHSXBAI-DUVNUKRYSA-N	0	3	318.417	2.018	10	0		DEAEHN
CO[C@@H](C)[C@@H](C)N[C@@H](C)c1cccc(NS(C)(=O)=O)c1	ZINC000572083598	292593138	/nfs/dbraw/zinc/59/31/38/292593138.db2.gz	OVXJCGITDKOZDR-WOPDTQHZSA-N	0	3	300.424	2.132	10	0		DEAEHN
C[C@H](CC(=O)N1CCN(C2CCCC2)CC1)c1cnn(C)c1	ZINC000411330814	227388541	/nfs/dbraw/zinc/38/85/41/227388541.db2.gz	XQZOUGRDHCSOPE-CQSZACIVSA-N	0	3	304.438	2.001	10	0		DEAEHN
CC(C)C[C@@H](N)C(=O)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000037296281	424807197	/nfs/dbraw/zinc/80/71/97/424807197.db2.gz	XXBAEFFBHXKEMX-OAHLLOKOSA-N	0	3	309.841	2.362	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)Nc2ccc(C)c(C)c2)c1	ZINC000105881607	424849615	/nfs/dbraw/zinc/84/96/15/424849615.db2.gz	FEPIKBRKWVDICC-HNNXBMFYSA-N	0	3	300.406	2.425	10	0		DEAEHN
Cn1cc(CN2CCCN(CCOc3ccccc3)CC2)cn1	ZINC000105869035	424849693	/nfs/dbraw/zinc/84/96/93/424849693.db2.gz	NQBJOIINLNOXPU-UHFFFAOYSA-N	0	3	314.433	2.007	10	0		DEAEHN
CC(C)CCNC(=O)[C@H](C)N1CCC(Cc2nccn2C)CC1	ZINC000105876260	424849735	/nfs/dbraw/zinc/84/97/35/424849735.db2.gz	GHGLROMVLHOOQK-HNNXBMFYSA-N	0	3	320.481	2.225	10	0		DEAEHN
C(C1CC1)N1CCC(Nc2nnc(C3CCOCC3)s2)CC1	ZINC000549106366	424873391	/nfs/dbraw/zinc/87/33/91/424873391.db2.gz	XKHSWHVFYUHDID-UHFFFAOYSA-N	0	3	322.478	2.718	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cccnc2N2CCCC2)C1	ZINC000194341479	424874780	/nfs/dbraw/zinc/87/47/80/424874780.db2.gz	DEAYOBUMOUHLPM-AWEZNQCLSA-N	0	3	317.437	2.288	10	0		DEAEHN
O=C(CSc1nc2ccccc2o1)N1CCN2CCC[C@@H]2C1	ZINC000195327042	424882569	/nfs/dbraw/zinc/88/25/69/424882569.db2.gz	YZNHXBQRNZCMHZ-GFCCVEGCSA-N	0	3	317.414	2.227	10	0		DEAEHN
c1ccc2c(c1)oc1c2ncnc1NC[C@H]1CN2CCC[C@@H]2CO1	ZINC000363197131	424854792	/nfs/dbraw/zinc/85/47/92/424854792.db2.gz	HWTZBUIQVFSLFA-OLZOCXBDSA-N	0	3	324.384	2.651	10	0		DEAEHN
Brc1ccc2c(c1)CC[C@H]2NC1COCCOC1	ZINC000386320131	424911420	/nfs/dbraw/zinc/91/14/20/424911420.db2.gz	KRXXKAKRSZGNMZ-CQSZACIVSA-N	0	3	312.207	2.441	10	0		DEAEHN
Brc1ccc2c(c1)CC[C@@H]2NC1COCCOC1	ZINC000386320128	424911456	/nfs/dbraw/zinc/91/14/56/424911456.db2.gz	KRXXKAKRSZGNMZ-AWEZNQCLSA-N	0	3	312.207	2.441	10	0		DEAEHN
O[C@]1(CCNCc2ccccc2Br)CCOC1	ZINC000404196264	424925971	/nfs/dbraw/zinc/92/59/71/424925971.db2.gz	INNHSOLTTKPMDM-CYBMUJFWSA-N	0	3	300.196	2.080	10	0		DEAEHN
Brc1ccsc1CN1CC[C@@H]2OCCN[C@@H]2C1	ZINC000404248875	424926029	/nfs/dbraw/zinc/92/60/29/424926029.db2.gz	IAAQEXKYBAOGIW-MNOVXSKESA-N	0	3	317.252	2.073	10	0		DEAEHN
CC(C)(O)CCN1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21	ZINC000404215316	424926033	/nfs/dbraw/zinc/92/60/33/424926033.db2.gz	SRQFPUVPQLIDGJ-ZWKOTPCHSA-N	0	3	318.461	2.123	10	0		DEAEHN
CN1C[C@H](CNCc2ccc(F)cc2Br)CC1=O	ZINC000657697640	425387126	/nfs/dbraw/zinc/38/71/26/425387126.db2.gz	QTDPBLNCJHKLGC-VIFPVBQESA-N	0	3	315.186	2.156	10	0		DEAEHN
O=C1NCC[C@H]1NC1CC(c2cccc(Br)c2)C1	ZINC000658053915	425430948	/nfs/dbraw/zinc/43/09/48/425430948.db2.gz	ZVGIPBFZURDNFH-KGPNIALWSA-N	0	3	309.207	2.173	10	0		DEAEHN
C[C@H](NC[C@H](O)CC(F)(F)F)c1ccc2c(c1)OCCO2	ZINC000189343293	267693571	/nfs/dbraw/zinc/69/35/71/267693571.db2.gz	DSSTYQZTXPCALO-GXSJLCMTSA-N	0	3	305.296	2.422	10	0		DEAEHN
C[C@]1(F)CNCCN(c2cncc(OCC3CCCC3)n2)C1	ZINC000333919044	269004483	/nfs/dbraw/zinc/00/44/83/269004483.db2.gz	OSHNRIBSWKQCMJ-INIZCTEOSA-N	0	3	308.401	2.183	10	0		DEAEHN
CNCC(=O)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000237277639	273958585	/nfs/dbraw/zinc/95/85/85/273958585.db2.gz	BLYKBVCMFXRZAU-UHFFFAOYSA-N	0	3	301.312	2.464	10	0		DEAEHN
C[C@@H](CC(N)=O)N[C@@H]1CCOc2ccc(Br)cc21	ZINC000135720384	274207786	/nfs/dbraw/zinc/20/77/86/274207786.db2.gz	NRCUUTALIDQMPU-GZMMTYOYSA-N	0	3	313.195	2.126	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(Br)o1	ZINC000083550345	274374242	/nfs/dbraw/zinc/37/42/42/274374242.db2.gz	UISOAWGHZJELHW-NXEZZACHSA-N	0	3	313.195	2.351	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1cccc2c1OCCO2	ZINC000124095676	275584703	/nfs/dbraw/zinc/58/47/03/275584703.db2.gz	HJLRWNOICAMLDK-ZDUSSCGKSA-N	0	3	306.406	2.164	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](N[C@H](C)CS(=O)(=O)c2ccccc2)C1	ZINC000245921910	275650639	/nfs/dbraw/zinc/65/06/39/275650639.db2.gz	YAMUUOOIEFKCSK-ZMSDIMECSA-N	0	3	324.490	2.167	10	0		DEAEHN
C[C@H](CN1CCCCCC1)NC(=O)c1nnc2ccccc2n1	ZINC000329601120	278188454	/nfs/dbraw/zinc/18/84/54/278188454.db2.gz	XLDOGGCHKVLFAF-CYBMUJFWSA-N	0	3	313.405	2.019	10	0		DEAEHN
C[C@@H](C(=O)N[C@@H]1CCCC[C@H]1C)N1CCCN(C2CC2)CC1	ZINC000246223863	278209987	/nfs/dbraw/zinc/20/99/87/278209987.db2.gz	ZYHOOUHVXDWADJ-HLLBOEOZSA-N	0	3	307.482	2.240	10	0		DEAEHN
CC1(C)CC[C@H](NC(=O)C2(N)CCOCC2)c2ccccc21	ZINC000261829311	278280336	/nfs/dbraw/zinc/28/03/36/278280336.db2.gz	KSXUTAQYLGIOTK-HNNXBMFYSA-N	0	3	302.418	2.423	10	0		DEAEHN
C[C@H](NCC(=O)Nc1nc(-c2ccco2)cs1)[C@@H]1CCCO1	ZINC000183165920	279461217	/nfs/dbraw/zinc/46/12/17/279461217.db2.gz	YXKSQVGYCZCEGV-JQWIXIFHSA-N	0	3	321.402	2.499	10	0		DEAEHN
CC[C@@H](C(=O)N1CCCC[C@H]1c1nnc2n1CCCC2)N(C)C	ZINC000408472461	280069578	/nfs/dbraw/zinc/06/95/78/280069578.db2.gz	VJCXIVHJJCIYNO-KBPBESRZSA-N	0	3	319.453	2.008	10	0		DEAEHN
CC[C@H]1CCc2nc(NC(=O)C3(N)CCOCC3)sc2C1	ZINC000261909387	281122164	/nfs/dbraw/zinc/12/21/64/281122164.db2.gz	SVJQNTIYBQZCOD-JTQLQIEISA-N	0	3	309.435	2.104	10	0		DEAEHN
Cc1ccc2nccc(N3CCCN(S(C)(=O)=O)CC3)c2c1	ZINC000302170482	281168858	/nfs/dbraw/zinc/16/88/58/281168858.db2.gz	UHSGFFVVAKYDHP-UHFFFAOYSA-N	0	3	319.430	2.015	10	0		DEAEHN
Cc1c(CNC[C@@H](NC(=O)OC(C)(C)C)C2CC2)cnn1C	ZINC000133636108	282020689	/nfs/dbraw/zinc/02/06/89/282020689.db2.gz	MTHPIKGJQKPRLV-CQSZACIVSA-N	0	3	308.426	2.121	10	0		DEAEHN
CCC(C)(C)[C@H]1CCCN1CC(=O)NC(=O)NCC(F)(F)F	ZINC000156852751	282037921	/nfs/dbraw/zinc/03/79/21/282037921.db2.gz	QGWISKAWZCLEJP-SNVBAGLBSA-N	0	3	323.359	2.275	10	0		DEAEHN
CCc1ccc(S(=O)(=O)N2C[C@H](N)Cc3ccccc32)s1	ZINC000070196113	288545361	/nfs/dbraw/zinc/54/53/61/288545361.db2.gz	AMJWMPAVEWZSED-GFCCVEGCSA-N	0	3	322.455	2.389	10	0		DEAEHN
COc1cccc(CN(CCN(C)C)C(=O)[C@@H]2CC[C@@H](C)O2)c1	ZINC000191954673	295295585	/nfs/dbraw/zinc/29/55/85/295295585.db2.gz	QDECZRFCXFFWHL-PBHICJAKSA-N	0	3	320.433	2.153	10	0		DEAEHN
c1cncc([C@@H]2CNCCN2Cc2nnc(C3CC3)n2C2CC2)c1	ZINC000575059721	326214857	/nfs/dbraw/zinc/21/48/57/326214857.db2.gz	HHPLYIWMQKNYGW-INIZCTEOSA-N	0	3	324.432	2.032	10	0		DEAEHN
C[C@@H](CNC(=O)NCCOCC1CCC1)N1CCC(C)CC1	ZINC000583735458	337327465	/nfs/dbraw/zinc/32/74/65/337327465.db2.gz	GNFKFBIWNOBJQS-HNNXBMFYSA-N	0	3	311.470	2.223	10	0		DEAEHN
COc1ccc(O)cc1C(=O)N(CCN(C)C)Cc1ccco1	ZINC000188352501	534206548	/nfs/dbraw/zinc/20/65/48/534206548.db2.gz	VVQFGGSXIZCELN-UHFFFAOYSA-N	0	3	318.373	2.198	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC[C@@H](n3cc(C)cn3)C2)C1	ZINC000247487927	521644798	/nfs/dbraw/zinc/64/47/98/521644798.db2.gz	LBIMDHKDFNDUFF-JKSUJKDBSA-N	0	3	319.453	2.022	10	0		DEAEHN
COC[C@H](NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1)C(C)C	ZINC000157235112	522751102	/nfs/dbraw/zinc/75/11/02/522751102.db2.gz	NCXKSLUVZQXAKU-ZOBUZTSGSA-N	0	3	321.465	2.456	10	0		DEAEHN
CO[C@@H](C)c1cccc(NC(=O)N2CCO[C@@H](CN(C)C)C2)c1	ZINC000118816196	523446903	/nfs/dbraw/zinc/44/69/03/523446903.db2.gz	PXVSYMRWRXQSQL-BBRMVZONSA-N	0	3	321.421	2.188	10	0		DEAEHN
Cc1cc(C)nc(SCC(=O)N[C@H]2CN(C(C)C)C[C@H]2C)n1	ZINC000247373375	524599909	/nfs/dbraw/zinc/59/99/09/524599909.db2.gz	PHZIAALKIHAZOS-RISCZKNCSA-N	0	3	322.478	2.030	10	0		DEAEHN
COc1ccccc1OCCN1CCC[C@@H](n2cncn2)C1	ZINC000105899045	524674332	/nfs/dbraw/zinc/67/43/32/524674332.db2.gz	LRZHUHODDDMFKL-CQSZACIVSA-N	0	3	302.378	2.003	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)CSCc2ccncc2)CCN1C	ZINC000127503783	524899923	/nfs/dbraw/zinc/89/99/23/524899923.db2.gz	YZHTWVFGSRGBKW-DZGCQCFKSA-N	0	3	307.463	2.256	10	0		DEAEHN
Cc1ccccc1OCCCNC(=O)N1CC[C@H](N(C)C)C1	ZINC000105284980	525290130	/nfs/dbraw/zinc/29/01/30/525290130.db2.gz	MIIRBVYHMXAYLM-HNNXBMFYSA-N	0	3	305.422	2.109	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)C[C@H](N)c1ccccc1	ZINC000262914476	534911890	/nfs/dbraw/zinc/91/18/90/534911890.db2.gz	RBLCHSSKMRZHTL-HNNXBMFYSA-N	0	3	300.406	2.245	10	0		DEAEHN
O[C@H](CN1CCC(n2cc(Cl)cn2)CC1)CC(F)(F)F	ZINC000364278022	526271553	/nfs/dbraw/zinc/27/15/53/526271553.db2.gz	BAXKVTTZXVBTKM-NSHDSACASA-N	0	3	311.735	2.487	10	0		DEAEHN
CC(=O)[C@H](C)CCCCC(=O)Nc1ccnn1CCN(C)C	ZINC000294227412	527144168	/nfs/dbraw/zinc/14/41/68/527144168.db2.gz	WPLZGFOFGWQGGO-CYBMUJFWSA-N	0	3	308.426	2.169	10	0		DEAEHN
CC1CCN(C[C@@H](O)CNc2c(F)c(F)nc(F)c2F)CC1	ZINC000301614121	528249132	/nfs/dbraw/zinc/24/91/32/528249132.db2.gz	UKHREJGMMNSDKS-VIFPVBQESA-N	0	3	321.318	2.143	10	0		DEAEHN
CCCCCNC(=O)[C@H](C)N1CCC(c2n[nH]c(CC)n2)CC1	ZINC000190662593	535068481	/nfs/dbraw/zinc/06/84/81/535068481.db2.gz	MODORKIBZFYDBL-ZDUSSCGKSA-N	0	3	321.469	2.241	10	0		DEAEHN
CCCCCNC(=O)[C@H](C)N1CCC(c2nc(CC)n[nH]2)CC1	ZINC000190662593	535068484	/nfs/dbraw/zinc/06/84/84/535068484.db2.gz	MODORKIBZFYDBL-ZDUSSCGKSA-N	0	3	321.469	2.241	10	0		DEAEHN
CCCCCNC(=O)[C@H](C)N1CCC(c2nnc(CC)[nH]2)CC1	ZINC000190662593	535068490	/nfs/dbraw/zinc/06/84/90/535068490.db2.gz	MODORKIBZFYDBL-ZDUSSCGKSA-N	0	3	321.469	2.241	10	0		DEAEHN
CCCCN(C)CCNC(=O)NCc1ccc2cc[nH]c2n1	ZINC000358001761	535222036	/nfs/dbraw/zinc/22/20/36/535222036.db2.gz	KBPRXFLDOQONFJ-UHFFFAOYSA-N	0	3	303.410	2.094	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CC[C@H](OCc2ccncc2)C1	ZINC000360185999	535364463	/nfs/dbraw/zinc/36/44/63/535364463.db2.gz	YGSUJENHOMSRBV-IRXDYDNUSA-N	0	3	317.433	2.074	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CC[C@@H](O)[C@H](C2CCCC2)C1	ZINC000458319030	535364814	/nfs/dbraw/zinc/36/48/14/535364814.db2.gz	USIUCUYOLUFABT-YESZJQIVSA-N	0	3	308.466	2.260	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)CN(C)C(C)C)[C@H]1Oc1ccccc1	ZINC000251878383	535461971	/nfs/dbraw/zinc/46/19/71/535461971.db2.gz	ULIFRIKPXWEIBS-LZLYRXPVSA-N	0	3	320.433	2.068	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H](CCCO)c2ccccc2)C1	ZINC000247281565	535532253	/nfs/dbraw/zinc/53/22/53/535532253.db2.gz	SVQJRWOSNZHONT-IAGOWNOFSA-N	0	3	319.449	2.284	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1ccc2cc[nH]c2n1	ZINC000360490917	535586235	/nfs/dbraw/zinc/58/62/35/535586235.db2.gz	LNGAQFMYIGJAJB-HNNXBMFYSA-N	0	3	315.421	2.189	10	0		DEAEHN
CCNC(=O)CCN1[C@H](C(=O)OC(C)(C)C)C[C@H]2CCCC[C@@H]21	ZINC000249397988	535789466	/nfs/dbraw/zinc/78/94/66/535789466.db2.gz	BMIFDURBCUCIFD-ILXRZTDVSA-N	0	3	324.465	2.487	10	0		DEAEHN
CCc1ccccc1NC(=O)CN1CCNC[C@@H]1c1cccnc1	ZINC000261864834	535949288	/nfs/dbraw/zinc/94/92/88/535949288.db2.gz	WUZICXJRNUWQEA-GOSISDBHSA-N	0	3	324.428	2.229	10	0		DEAEHN
CN1CCC(CC(=O)N2CCC[C@@H]2C(=O)OC(C)(C)C)CC1	ZINC000362890485	536335448	/nfs/dbraw/zinc/33/54/48/536335448.db2.gz	GEKGWIGSFVRRST-CQSZACIVSA-N	0	3	310.438	2.051	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COc2ccc(Cl)cc2)CC[C@@H]1C	ZINC000252059643	536730907	/nfs/dbraw/zinc/73/09/07/536730907.db2.gz	ZPXJVMZYOYLCTO-DUVNUKRYSA-N	0	3	313.825	2.437	10	0		DEAEHN
Cc1cc(CN[C@H]2C[C@@H](O)[C@@H]2n2cccn2)cc2cccnc12	ZINC000888076314	625050115	/nfs/dbraw/zinc/05/01/15/625050115.db2.gz	YQZWQKDCKORFAD-LZLYRXPVSA-N	0	3	308.385	2.204	10	0		DEAEHN
CCCC1(c2noc(CN3CCCC[C@@H](N)C3=O)n2)CCC1	ZINC000888078239	625058074	/nfs/dbraw/zinc/05/80/74/625058074.db2.gz	CFMYFEYNTPLYLA-GFCCVEGCSA-N	0	3	306.410	2.131	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@H]1N(C)S(=O)(=O)/C=C\c1ccccc1	ZINC000255557837	625058296	/nfs/dbraw/zinc/05/82/96/625058296.db2.gz	OPCZEWDUSTZLTC-MITIMNCUSA-N	0	3	308.447	2.259	10	0		DEAEHN
C[C@@]1(CNC(=O)c2cnsn2)CCCN1Cc1ccccc1	ZINC000163399502	625229321	/nfs/dbraw/zinc/22/93/21/625229321.db2.gz	LEWWKYNQFZRQND-INIZCTEOSA-N	0	3	316.430	2.323	10	0		DEAEHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@H]2CCOC[C@H]2C)c1	ZINC000248873221	634456358	/nfs/dbraw/zinc/45/63/58/634456358.db2.gz	IJLVAIVLTKFKMO-VHDGCEQUSA-N	0	3	300.358	2.315	10	0		DEAEHN
c1nc2c(c(NC[C@@H]3CN4CCC[C@@H]4CO3)n1)CCCCC2	ZINC000317077678	635109111	/nfs/dbraw/zinc/10/91/11/635109111.db2.gz	NTIZLTADHOOWGH-ZIAGYGMSSA-N	0	3	302.422	2.021	10	0		DEAEHN
COc1ccc2c(CN(C)CC3(CO)CC3)cc(=O)oc2c1	ZINC000186812313	636570052	/nfs/dbraw/zinc/57/00/52/636570052.db2.gz	AQCXMMIPPRDSOX-UHFFFAOYSA-N	0	3	303.358	2.006	10	0		DEAEHN
O=C(CC/C=C\c1ccccc1)NC[C@@H]1CN2CCC[C@H]2CO1	ZINC000737819577	637366295	/nfs/dbraw/zinc/36/62/95/637366295.db2.gz	DFEIKOZASOMXPN-AFQHASOGSA-N	0	3	314.429	2.459	10	0		DEAEHN
COc1ccc([C@H](NC(C)C)C(=O)N2C[C@H](O)CC[C@H]2C)cc1	ZINC000897995610	640987299	/nfs/dbraw/zinc/98/72/99/640987299.db2.gz	GUUFGOUZNIGUMY-UNEWFSDZSA-N	0	3	320.433	2.106	10	0		DEAEHN
Nc1nc(C2CC2)nc(N2CCCN(Cc3ccccc3)CC2)n1	ZINC000323902311	646669238	/nfs/dbraw/zinc/66/92/38/646669238.db2.gz	KAKZEFXDVOIZPE-UHFFFAOYSA-N	0	3	324.432	2.044	10	0		DEAEHN
CN(CC1CC1)C(=O)CN1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000174384698	646808879	/nfs/dbraw/zinc/80/88/79/646808879.db2.gz	KNSZRAHQYMHYKY-MSOLQXFVSA-N	0	3	316.445	2.443	10	0		DEAEHN
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000183206523	649048292	/nfs/dbraw/zinc/04/82/92/649048292.db2.gz	XBEWPYBZFQOSDB-BZUAXINKSA-N	0	3	317.385	2.003	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@@H](CN[C@H]2CCn3ccnc32)C1	ZINC000379176401	685390406	/nfs/dbraw/zinc/39/04/06/685390406.db2.gz	QRMFBHXDYMCFRN-STQMWFEESA-N	0	3	306.410	2.175	10	0		DEAEHN
CCOC(CN[C@@H](C)c1ccc(-n2ccnn2)cc1)OCC	ZINC000125535875	684146264	/nfs/dbraw/zinc/14/62/64/684146264.db2.gz	CUPKKXIYHZSXBD-ZDUSSCGKSA-N	0	3	304.394	2.317	10	0		DEAEHN
C[C@@H]1[C@@H](NCc2ccnn2C)CCCN1C(=O)OC(C)(C)C	ZINC000189518003	684383288	/nfs/dbraw/zinc/38/32/88/684383288.db2.gz	YDYFUBHJTMTCQA-OCCSQVGLSA-N	0	3	308.426	2.298	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1ccn(CC(F)F)n1)c1ccccc1	ZINC000193718139	685047608	/nfs/dbraw/zinc/04/76/08/685047608.db2.gz	KNJDNZCBONJEMX-AWEZNQCLSA-N	0	3	322.359	2.181	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2ccc([C@H](C)O)cc2)C1	ZINC000249726978	685186536	/nfs/dbraw/zinc/18/65/36/685186536.db2.gz	QHLQSWOUEYNSJS-BBRMVZONSA-N	0	3	305.422	2.023	10	0		DEAEHN
O[C@@H]1C[C@H](N[C@H](c2ccc(F)cc2)C2CC2)[C@H]1n1cccn1	ZINC000886096792	692002980	/nfs/dbraw/zinc/00/29/80/692002980.db2.gz	FVVCVAWOWAGXJQ-VVLHAWIVSA-N	0	3	301.365	2.437	10	0		DEAEHN
CCOC[C@@H]1CCN(C[C@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724113661	777243669	/nfs/dbraw/zinc/24/36/69/777243669.db2.gz	GAAOOZWSTJBOBC-ZJUUUORDSA-N	0	3	305.287	2.293	10	0		DEAEHN
C[C@H](c1ccc(Cl)cc1Cl)N(C)S(=O)(=O)C1CNC1	ZINC000722218271	778510966	/nfs/dbraw/zinc/51/09/66/778510966.db2.gz	GCUWORCYEKOVFB-MRVPVSSYSA-N	0	3	323.245	2.288	10	0		DEAEHN
COCCC1(CNCc2cn(C)nc2Br)CC1	ZINC000712482120	792190678	/nfs/dbraw/zinc/19/06/78/792190678.db2.gz	MNUCBQBSPSEGJS-UHFFFAOYSA-N	0	3	302.216	2.089	10	0		DEAEHN
COc1cc([C@H](C)N[C@H]2C[C@H](S(C)(=O)=O)C2)ccc1F	ZINC000714252112	792306021	/nfs/dbraw/zinc/30/60/21/792306021.db2.gz	SYFYUOOWULPMKW-DLOVCJGASA-N	0	3	301.383	2.061	10	0		DEAEHN
Cc1nc([C@H](C)N[C@@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)n[nH]1	ZINC000401853358	801854556	/nfs/dbraw/zinc/85/45/56/801854556.db2.gz	ULJIKEDIUFCRBK-NTZNESFSSA-N	0	3	323.441	2.409	10	0		DEAEHN
CC(C)=CC(=O)N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC000404199735	802007712	/nfs/dbraw/zinc/00/77/12/802007712.db2.gz	HQNAEJVZBCKBRF-QZTJIDSGSA-N	0	3	314.429	2.455	10	0		DEAEHN
CCn1cc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2C)nn1	ZINC000404432531	802020174	/nfs/dbraw/zinc/02/01/74/802020174.db2.gz	OECXKLZYSASEBW-TZMCWYRMSA-N	0	3	323.441	2.033	10	0		DEAEHN
CN1CCC[C@H]2[C@H]1CCN2C(=O)c1cc(Br)c[nH]1	ZINC000720816607	1086168081	/nfs/dbraw/zinc/16/80/81/1086168081.db2.gz	OPWKYQCOMZFUGS-NEPJUHHUSA-N	0	3	312.211	2.086	10	0		DEAEHN
CN1CCC[C@@H]2[C@@H]1CCN2C(=O)c1ccnc(Br)c1	ZINC000720828900	1086183776	/nfs/dbraw/zinc/18/37/76/1086183776.db2.gz	JVDSXZVCWUCPPP-NWDGAFQWSA-N	0	3	324.222	2.153	10	0		DEAEHN
CC(C)(C)OC(=O)NCC1(NCc2cccnc2)CCOCC1	ZINC000707849237	1086676318	/nfs/dbraw/zinc/67/63/18/1086676318.db2.gz	NEQRXAIELQJBQF-UHFFFAOYSA-N	0	3	321.421	2.245	10	0		DEAEHN
CC[C@@H](CN[C@@H]1CCC1(OC)OC)NC(=O)OC(C)(C)C	ZINC000710959132	1086691448	/nfs/dbraw/zinc/69/14/48/1086691448.db2.gz	KXFVLOGWJKXYDQ-NWDGAFQWSA-N	0	3	302.415	2.031	10	0		DEAEHN
C[C@H]1[C@@H](NC(=O)c2ccc(F)cc2Br)CCN1C	ZINC000719387648	1089061821	/nfs/dbraw/zinc/06/18/21/1089061821.db2.gz	KYWAZBSTGXRJNV-UFBFGSQYSA-N	0	3	315.186	2.411	10	0		DEAEHN
COc1cncc(CNCCOC(F)(F)C(F)(F)F)c1	ZINC000720259758	1089546631	/nfs/dbraw/zinc/54/66/31/1089546631.db2.gz	ICBULSQQJNETBJ-UHFFFAOYSA-N	0	3	300.227	2.352	10	0		DEAEHN
NC(=O)c1csc(CNCCOC(F)(F)C(F)(F)F)c1	ZINC000720261574	1089547572	/nfs/dbraw/zinc/54/75/72/1089547572.db2.gz	RYQYNRFLFZTLAU-UHFFFAOYSA-N	0	3	318.267	2.108	10	0		DEAEHN
CN(C)c1nnc(S[C@H]2COc3ccccc3[C@@H]2N)s1	ZINC000081769341	192322455	/nfs/dbraw/zinc/32/24/55/192322455.db2.gz	GGEMDFAHLRWWQW-QWRGUYRKSA-N	0	3	308.432	2.157	10	0		DEAEHN
Cc1cccc(C)c1OCCNC(=O)NC[C@@H]1CCCN1C	ZINC000139674275	282101618	/nfs/dbraw/zinc/10/16/18/282101618.db2.gz	QLFPOEJAYQDNQC-HNNXBMFYSA-N	0	3	305.422	2.076	10	0		DEAEHN
CCC[C@@H]1CCCN(C(=O)NC[C@@H]2CCCN2CCOC)C1	ZINC000150887498	282107218	/nfs/dbraw/zinc/10/72/18/282107218.db2.gz	ILXSAYIESJIPJD-CVEARBPZSA-N	0	3	311.470	2.319	10	0		DEAEHN
N[C@H](CSc1cnccn1)c1ccc2c(c1)OCCCO2	ZINC000081885468	192334336	/nfs/dbraw/zinc/33/43/36/192334336.db2.gz	HMWUZOVHYZFLFW-GFCCVEGCSA-N	0	3	303.387	2.430	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@H]1S(=O)(=O)c1ccc(Cl)cc1	ZINC000081920245	192339007	/nfs/dbraw/zinc/33/90/07/192339007.db2.gz	USNOKJSILKTHLW-ZIAGYGMSSA-N	0	3	317.838	2.271	10	0		DEAEHN
N[C@H]1CCC[C@H]1S(=O)(=O)c1ccc(Br)cc1	ZINC000081934006	192341523	/nfs/dbraw/zinc/34/15/23/192341523.db2.gz	XIXAFHJXBRVKNB-WDEREUQCSA-N	0	3	304.209	2.103	10	0		DEAEHN
CCCN[C@H](C)[C@@H](C)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000081935175	192342758	/nfs/dbraw/zinc/34/27/58/192342758.db2.gz	UUXGNSZTZYKAKC-VXGBXAGGSA-N	0	3	313.419	2.008	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C)cc1	ZINC000078934568	185131317	/nfs/dbraw/zinc/13/13/17/185131317.db2.gz	VEJCEBHKPRHFGN-OAHLLOKOSA-N	0	3	305.422	2.026	10	0		DEAEHN
C[C@H](O)c1ccc(N2CCN(CC(C)(C)O)CC2)cc1Cl	ZINC000078944933	185133415	/nfs/dbraw/zinc/13/34/15/185133415.db2.gz	HTWKCRBAHVEYNK-LBPRGKRZSA-N	0	3	312.841	2.286	10	0		DEAEHN
CCCN[C@H](c1ccc(C)cc1)[C@@H](C)S(=O)(=O)CCOC	ZINC000081945010	192344878	/nfs/dbraw/zinc/34/48/78/192344878.db2.gz	PQFPZAQXYZUZSW-ZBFHGGJFSA-N	0	3	313.463	2.485	10	0		DEAEHN
CCC(CC)CS(=O)(=O)N1CCC(N2CCCC2)CC1	ZINC000113280017	282168089	/nfs/dbraw/zinc/16/80/89/282168089.db2.gz	ISQNFFAXWBLZGS-UHFFFAOYSA-N	0	3	302.484	2.313	10	0		DEAEHN
CC(C)(C)Oc1ccc(NC(=O)c2n[nH]c3c2CNCC3)cc1	ZINC000082807295	185205681	/nfs/dbraw/zinc/20/56/81/185205681.db2.gz	NMZRKNBEBBLJTP-UHFFFAOYSA-N	0	3	314.389	2.485	10	0		DEAEHN
CC(C)C(=O)Nc1ccc(C(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170867012	282180511	/nfs/dbraw/zinc/18/05/11/282180511.db2.gz	KEORTSDXERSVKQ-HNNXBMFYSA-N	0	3	303.406	2.057	10	0		DEAEHN
CN[C@H](c1sccc1Br)[C@H]1CCS(=O)(=O)C1	ZINC000087630650	185229544	/nfs/dbraw/zinc/22/95/44/185229544.db2.gz	QJQPSNIBVYANCE-CBAPKCEASA-N	0	3	324.265	2.206	10	0		DEAEHN
N[C@H]1CCCN(c2c(F)cc(Br)cc2F)C1=O	ZINC000088172864	185240969	/nfs/dbraw/zinc/24/09/69/185240969.db2.gz	LWZWBQHLRWXMTM-VIFPVBQESA-N	0	3	305.122	2.181	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)C2(c3ccc(F)cc3)CCOCC2)C1	ZINC000170855595	282196173	/nfs/dbraw/zinc/19/61/73/282196173.db2.gz	RJEQMIOTWJEEMR-MRXNPFEDSA-N	0	3	320.408	2.036	10	0		DEAEHN
CC(C)N[C@@H]1CCN(c2c3nsnc3ccc2Cl)C1=O	ZINC000088128055	185240446	/nfs/dbraw/zinc/24/04/46/185240446.db2.gz	IFGJDSIGHCNGRU-SNVBAGLBSA-N	0	3	310.810	2.448	10	0		DEAEHN
CC(C)(C)[NH2+]Cc1ccc(S(=O)(=O)[N-]C2CCCC2)o1	ZINC000088541906	185255938	/nfs/dbraw/zinc/25/59/38/185255938.db2.gz	LAMQOAMIQBTANA-UHFFFAOYSA-N	0	3	300.424	2.389	10	0		DEAEHN
CC(C)CC[N-]S(=O)(=O)c1ccc(C[NH2+]CC(C)C)o1	ZINC000088542025	185256448	/nfs/dbraw/zinc/25/64/48/185256448.db2.gz	QGAPTOXLOHRZIF-UHFFFAOYSA-N	0	3	302.440	2.350	10	0		DEAEHN
Cc1ccc2c(N)c(C(=O)NC3CCN(C)CC3)sc2n1	ZINC000088640355	185260733	/nfs/dbraw/zinc/26/07/33/185260733.db2.gz	KBWTTXVBIDESPO-UHFFFAOYSA-N	0	3	304.419	2.011	10	0		DEAEHN
N[C@H]1CCCC[C@@H]1S(=O)(=O)c1cccc(Br)c1	ZINC000081982815	192350038	/nfs/dbraw/zinc/35/00/38/192350038.db2.gz	VZGDCABSKIKGPB-RYUDHWBXSA-N	0	3	318.236	2.493	10	0		DEAEHN
N[C@H]1COC[C@H]1c1nc(Cc2ccc(Cl)c(Cl)c2)no1	ZINC000090364621	185292709	/nfs/dbraw/zinc/29/27/09/185292709.db2.gz	OXVMHKTZXOFAGF-KCJUWKMLSA-N	0	3	314.172	2.408	10	0		DEAEHN
N[C@@H]1COC[C@@H]1C(=O)Nc1ccccc1SCC(F)(F)F	ZINC000090380239	185293596	/nfs/dbraw/zinc/29/35/96/185293596.db2.gz	KGWLQTZXUIXIEL-DTWKUNHWSA-N	0	3	320.336	2.253	10	0		DEAEHN
Cc1nc(-c2cccc(NC(=O)[C@@H]3COC[C@H]3N)c2)cs1	ZINC000090380492	185293698	/nfs/dbraw/zinc/29/36/98/185293698.db2.gz	IUUZJELFJBDGMK-CHWSQXEVSA-N	0	3	303.387	2.031	10	0		DEAEHN
N[C@H]1COC[C@@H]1C(=O)Nc1ccc(Cl)cc1C(F)(F)F	ZINC000090378665	185293795	/nfs/dbraw/zinc/29/37/95/185293795.db2.gz	CINDIXODOLJRCD-CBAPKCEASA-N	0	3	308.687	2.271	10	0		DEAEHN
CN[C@H]1COC[C@H]1c1nc(Cc2ccc(F)cc2Cl)no1	ZINC000090423984	185295714	/nfs/dbraw/zinc/29/57/14/185295714.db2.gz	HZJRSJYYHBBCTP-PWSUYJOCSA-N	0	3	311.744	2.155	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)N(C)Cc1ccc(Cl)cc1Cl	ZINC000090434845	185296179	/nfs/dbraw/zinc/29/61/79/185296179.db2.gz	UHKJUOKRHNJBBQ-WCQYABFASA-N	0	3	317.216	2.186	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)N(C)Cc1ccc(Cl)cc1Cl	ZINC000090434847	185296332	/nfs/dbraw/zinc/29/63/32/185296332.db2.gz	UHKJUOKRHNJBBQ-DGCLKSJQSA-N	0	3	317.216	2.186	10	0		DEAEHN
C[C@]1(C(=O)Nc2cc(Cl)cc3cccnc32)COC[C@@H]1N	ZINC000090585361	185305257	/nfs/dbraw/zinc/30/52/57/185305257.db2.gz	BIBSTIDOIDKIJV-WFASDCNBSA-N	0	3	305.765	2.191	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)[C@@]1(C)COC[C@@H]1N	ZINC000090589946	185305485	/nfs/dbraw/zinc/30/54/85/185305485.db2.gz	DSARACRUQUVKLX-ZFWWWQNUSA-N	0	3	312.797	2.431	10	0		DEAEHN
Cc1ccc(Br)cc1NC(=O)[C@@]1(C)COC[C@H]1N	ZINC000090588845	185305525	/nfs/dbraw/zinc/30/55/25/185305525.db2.gz	WTVOATUVHSNKHZ-YPMHNXCESA-N	0	3	313.195	2.060	10	0		DEAEHN
C[C@@]1(C(=O)NCCc2ccc(Cl)cc2Cl)COC[C@@H]1N	ZINC000090581428	185304836	/nfs/dbraw/zinc/30/48/36/185304836.db2.gz	NWVKHHIVDMNWJV-GXTWGEPZSA-N	0	3	317.216	2.016	10	0		DEAEHN
Cc1cc(C(=O)N2CCCSC[C@@H]2CN2CCCCC2)no1	ZINC000090701632	185310648	/nfs/dbraw/zinc/31/06/48/185310648.db2.gz	JQHAQXWEFWODPB-AWEZNQCLSA-N	0	3	323.462	2.417	10	0		DEAEHN
COc1cc(CN2CCN3CCCC[C@@H]3C2)cc2c1OCCO2	ZINC000092616050	185329490	/nfs/dbraw/zinc/32/94/90/185329490.db2.gz	PNGAPIQFQXOBFY-OAHLLOKOSA-N	0	3	318.417	2.137	10	0		DEAEHN
C[NH2+][C@H]1C(=O)Nc2cc(Sc3nnc(C)[n-]3)c(Cl)cc21	ZINC000092770614	185339401	/nfs/dbraw/zinc/33/94/01/185339401.db2.gz	JPZLITWDKFCWTH-SNVBAGLBSA-N	0	3	309.782	2.130	10	0		DEAEHN
CN[C@H]1C(=O)Nc2cc(Sc3nnc(C)[nH]3)c(Cl)cc21	ZINC000092770614	185339402	/nfs/dbraw/zinc/33/94/02/185339402.db2.gz	JPZLITWDKFCWTH-SNVBAGLBSA-N	0	3	309.782	2.130	10	0		DEAEHN
CC(C)NCc1cc(S(=O)(=O)NC2C(C)(C)C2(C)C)c[nH]1	ZINC000092833228	185344978	/nfs/dbraw/zinc/34/49/78/185344978.db2.gz	JZIDQDDOLQLQGA-UHFFFAOYSA-N	0	3	313.467	2.226	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N)[C@H](Sc1nnc(N(C)C)s1)C2	ZINC000092860049	185346992	/nfs/dbraw/zinc/34/69/92/185346992.db2.gz	MRWOGIHTEYCPJI-NEPJUHHUSA-N	0	3	322.459	2.330	10	0		DEAEHN
CN1CCC[C@H](CNc2ccc3nnnn3n2)[C@@H]1c1ccccc1	ZINC000095396576	185352912	/nfs/dbraw/zinc/35/29/12/185352912.db2.gz	IYCRVFMRRVYHFZ-PBHICJAKSA-N	0	3	323.404	2.014	10	0		DEAEHN
C[C@@H](NCCN1C(=O)NC(C)(C)C1=O)c1cccc(Cl)c1	ZINC000181410317	199293260	/nfs/dbraw/zinc/29/32/60/199293260.db2.gz	JAQOBGXXIKQZSH-SNVBAGLBSA-N	0	3	309.797	2.321	10	0		DEAEHN
COC1(CNC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CCC1	ZINC000181495018	199306015	/nfs/dbraw/zinc/30/60/15/199306015.db2.gz	UILKUJBDLKPGMQ-CVEARBPZSA-N	0	3	317.433	2.300	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)CCc1ccccc1F	ZINC000036191034	539334040	/nfs/dbraw/zinc/33/40/40/539334040.db2.gz	PSLDUWJZYDUJBT-CYBMUJFWSA-N	0	3	316.442	2.018	10	0		DEAEHN
COc1ccc(NC(=O)[C@H](C)N[C@H](C)[C@@H]2CCCO2)cc1OC	ZINC000183181716	199551187	/nfs/dbraw/zinc/55/11/87/199551187.db2.gz	UZPQTHWIZAGDSE-DYEKYZERSA-N	0	3	322.405	2.188	10	0		DEAEHN
CCOCCN1CCC(N(CC)CC(=O)OC(C)(C)C)CC1	ZINC000190351435	282318551	/nfs/dbraw/zinc/31/85/51/282318551.db2.gz	NHSBXZMPHYECBW-UHFFFAOYSA-N	0	3	314.470	2.151	10	0		DEAEHN
CC[C@@H]1CN(C)CCCN1C(=O)c1cc(-c2ccoc2)n[nH]1	ZINC000614335504	362353026	/nfs/dbraw/zinc/35/30/26/362353026.db2.gz	PSWMGAWYZPSAEY-CYBMUJFWSA-N	0	3	302.378	2.226	10	0		DEAEHN
CCCC[C@H](C(=O)OC)N1CCC(c2nnc(CC)[nH]2)CC1	ZINC000190674285	534959489	/nfs/dbraw/zinc/95/94/89/534959489.db2.gz	YNYAMOHVCPVOTQ-CYBMUJFWSA-N	0	3	308.426	2.278	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000193800761	282357610	/nfs/dbraw/zinc/35/76/10/282357610.db2.gz	CDGOWDLYYCIRRF-OAHLLOKOSA-N	0	3	319.449	2.334	10	0		DEAEHN
CC(C)(C)OC(=O)CCCN1CCC(Nc2cccnn2)CC1	ZINC000181801604	199353565	/nfs/dbraw/zinc/35/35/65/199353565.db2.gz	FBUFSHVXJWBPIR-UHFFFAOYSA-N	0	3	320.437	2.475	10	0		DEAEHN
CC(C)CN(C(=O)CN1CC[C@]2(O)CCCC[C@H]2C1)C1CC1	ZINC000248064606	535003767	/nfs/dbraw/zinc/00/37/67/535003767.db2.gz	MDGJSSZKPFEURK-MAUKXSAKSA-N	0	3	308.466	2.260	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1cccnc1Br	ZINC000229614305	201842475	/nfs/dbraw/zinc/84/24/75/201842475.db2.gz	IGAFXTMOMSCLMO-SNVBAGLBSA-N	0	3	312.211	2.010	10	0		DEAEHN
CN[C@@H](C)c1cc(Br)ccc1OC[C@H](O)COC	ZINC000069053796	190795374	/nfs/dbraw/zinc/79/53/74/190795374.db2.gz	IETQFXGMORKRIP-GXSJLCMTSA-N	0	3	318.211	2.116	10	0		DEAEHN
Cc1ccc(-c2cc3c(N4CCNCC4)nccn3n2)cc1C	ZINC000070459154	190898002	/nfs/dbraw/zinc/89/80/02/190898002.db2.gz	OEKGQDJOYQUVFH-UHFFFAOYSA-N	0	3	307.401	2.423	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1ccc(OC(F)F)cc1)[C@@H]1CCCO1	ZINC000183179753	539660565	/nfs/dbraw/zinc/66/05/65/539660565.db2.gz	MEFJBAURILISTG-MFKMUULPSA-N	0	3	314.332	2.384	10	0		DEAEHN
Cc1cc(N2CCC[C@H](NCc3cccc(C)c3)C2=O)n(C)n1	ZINC000080526938	192165204	/nfs/dbraw/zinc/16/52/04/192165204.db2.gz	DZRFDAHWVTZLMK-INIZCTEOSA-N	0	3	312.417	2.322	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cccnc2SC(F)F)C1	ZINC000170856454	197837608	/nfs/dbraw/zinc/83/76/08/197837608.db2.gz	DYPNAXRGVYCVFX-VIFPVBQESA-N	0	3	301.362	2.172	10	0		DEAEHN
CC(C)CN(C(C)C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138812962	186019030	/nfs/dbraw/zinc/01/90/30/186019030.db2.gz	NFTDHLNPIMDEJT-UHFFFAOYSA-N	0	3	320.405	2.479	10	0		DEAEHN
C[C@@H]1CCCN(S(=O)(=O)c2cc(CN)cc(F)c2F)[C@@H]1C	ZINC000138930990	186019382	/nfs/dbraw/zinc/01/93/82/186019382.db2.gz	XZFZHMGBIQSZHC-NXEZZACHSA-N	0	3	318.389	2.233	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N(S(=O)(=O)c2cc(CN)cc(F)c2F)C1	ZINC000139158810	186020484	/nfs/dbraw/zinc/02/04/84/186020484.db2.gz	KFYMFLWHLAJQDP-ZJUUUORDSA-N	0	3	318.389	2.233	10	0		DEAEHN
O[C@@]12CCCC[C@@H]1CN(Cc1ccc(-n3ccnc3)nc1)CC2	ZINC000140544549	186026610	/nfs/dbraw/zinc/02/66/10/186026610.db2.gz	RCMJQSZYPGNLDI-SJLPKXTDSA-N	0	3	312.417	2.394	10	0		DEAEHN
COc1ccc(C)cc1NC(=O)[C@H](C)N[C@@H](C)[C@H]1CCCO1	ZINC000248574101	539774570	/nfs/dbraw/zinc/77/45/70/539774570.db2.gz	GUTMNIMSNXDERB-KCQAQPDRSA-N	0	3	306.406	2.488	10	0		DEAEHN
CC[C@H]1N[C@H](c2ccsc2)N(CCN2CCCCC2)C1=O	ZINC000144077175	186034825	/nfs/dbraw/zinc/03/48/25/186034825.db2.gz	COSRYUYNSMLUNG-CABCVRRESA-N	0	3	307.463	2.443	10	0		DEAEHN
CN1CCC[C@H](CN2C(=O)C3(CC3)N[C@H]2c2ccsc2)C1	ZINC000144213877	186034888	/nfs/dbraw/zinc/03/48/88/186034888.db2.gz	KUFSYTNKQLNYQU-GXTWGEPZSA-N	0	3	305.447	2.053	10	0		DEAEHN
O=C1N(CCN2CCCCC2)[C@@H](c2cccs2)NC12CC2	ZINC000144075399	186034911	/nfs/dbraw/zinc/03/49/11/186034911.db2.gz	KRCDUHYAXUWEJX-AWEZNQCLSA-N	0	3	305.447	2.197	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2cccs2)N(CCN2CCCCC2)C1=O	ZINC000144061345	186035264	/nfs/dbraw/zinc/03/52/64/186035264.db2.gz	OGCCOTZBVCQHBH-DZGCQCFKSA-N	0	3	307.463	2.443	10	0		DEAEHN
C[C@@H](CN1C(=O)C2(CCCC2)N[C@@H]1c1ccsc1)N(C)C	ZINC000144941478	186035726	/nfs/dbraw/zinc/03/57/26/186035726.db2.gz	FRLYSJCAYDKHBR-JSGCOSHPSA-N	0	3	307.463	2.441	10	0		DEAEHN
CNCc1ccc(Cl)c(S(=O)(=O)N(C)C2CCC2)c1	ZINC000144647012	186036028	/nfs/dbraw/zinc/03/60/28/186036028.db2.gz	ICHVLYHAHODZHF-UHFFFAOYSA-N	0	3	302.827	2.232	10	0		DEAEHN
CC[C@@H]1N[C@H](c2cccs2)N([C@@H](C)CN2CCCC2)C1=O	ZINC000145832413	186037785	/nfs/dbraw/zinc/03/77/85/186037785.db2.gz	JVPVZVQXGSPPST-YDHLFZDLSA-N	0	3	307.463	2.441	10	0		DEAEHN
Nc1nc(NCc2cccc(Cl)c2)nc(N2CCCC2)n1	ZINC000149029945	186046785	/nfs/dbraw/zinc/04/67/85/186046785.db2.gz	SBYUPKLQEVJSOM-UHFFFAOYSA-N	0	3	304.785	2.320	10	0		DEAEHN
O=C(c1ccc(-n2ccnc2)cc1)N1CCCN(C2CC2)CC1	ZINC000148948113	186047186	/nfs/dbraw/zinc/04/71/86/186047186.db2.gz	WJRIRPWUEIHFHA-UHFFFAOYSA-N	0	3	310.401	2.183	10	0		DEAEHN
N[C@H](Cc1csc([C@@H]2CCS(=O)(=O)C2)n1)c1ccccc1	ZINC000150260445	186056294	/nfs/dbraw/zinc/05/62/94/186056294.db2.gz	WPBIBYVLRYNNCF-TZMCWYRMSA-N	0	3	322.455	2.288	10	0		DEAEHN
Fc1ccc(COC[C@@H]2CNCCO2)c(Br)c1	ZINC000163979791	186144617	/nfs/dbraw/zinc/14/46/17/186144617.db2.gz	ZPKDEUGLNGYOEY-NSHDSACASA-N	0	3	304.159	2.093	10	0		DEAEHN
Cc1c(CNC2CC2)cccc1S(=O)(=O)NC1CC(C)C1	ZINC000164014618	186145968	/nfs/dbraw/zinc/14/59/68/186145968.db2.gz	DWGAUPLBGDTGHF-UHFFFAOYSA-N	0	3	308.447	2.324	10	0		DEAEHN
CCOc1cccnc1C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000164108088	186149251	/nfs/dbraw/zinc/14/92/51/186149251.db2.gz	DOHPOZZNTVFXNK-KGLIPLIRSA-N	0	3	303.406	2.037	10	0		DEAEHN
CCN(CC)c1nc(NC)nc(N2C[C@H](C)S[C@@H](C)C2)n1	ZINC000155891712	186120610	/nfs/dbraw/zinc/12/06/10/186120610.db2.gz	HAKGULYPYGYFGL-QWRGUYRKSA-N	0	3	310.471	2.090	10	0		DEAEHN
COCCNCc1cn(CC(=O)OC)c2cc(Cl)ccc12	ZINC000164132857	186149843	/nfs/dbraw/zinc/14/98/43/186149843.db2.gz	SRJLLCFPXLLKSO-UHFFFAOYSA-N	0	3	310.781	2.204	10	0		DEAEHN
Cc1ccccc1Cc1noc(CN2CCN3CCC[C@@H]3C2)n1	ZINC000175654126	186185069	/nfs/dbraw/zinc/18/50/69/186185069.db2.gz	HPKSBHLUCFXZKW-MRXNPFEDSA-N	0	3	312.417	2.249	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCc2ccc(OC(C)(C)C)nc2)C1	ZINC000183883879	186227623	/nfs/dbraw/zinc/22/76/23/186227623.db2.gz	FTHHNFXOHSYUBJ-AWEZNQCLSA-N	0	3	320.437	2.104	10	0		DEAEHN
CC(=O)Nc1cccc(NC(=O)N2CCN3CCC[C@@H]3C2)c1C	ZINC000171888294	198001707	/nfs/dbraw/zinc/00/17/07/198001707.db2.gz	SMDKAXFNNZKVDC-CQSZACIVSA-N	0	3	316.405	2.265	10	0		DEAEHN
CCOc1ccc(OC)cc1NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171894861	198002913	/nfs/dbraw/zinc/00/29/13/198002913.db2.gz	DYKVKOHREPBUJQ-CYBMUJFWSA-N	0	3	319.405	2.406	10	0		DEAEHN
C[C@H](O)C1CCN(C[C@H]2CN(c3ccccc3)C(=O)O2)CC1	ZINC000172801874	198151451	/nfs/dbraw/zinc/15/14/51/198151451.db2.gz	ANXRNLOPMTWBSW-BBRMVZONSA-N	0	3	304.390	2.105	10	0		DEAEHN
C[C@@H](CNC(=O)c1cnc(-c2ccncc2)s1)N(C)C1CC1	ZINC000172897264	198165024	/nfs/dbraw/zinc/16/50/24/198165024.db2.gz	NVOMSOPCGMJJSJ-NSHDSACASA-N	0	3	316.430	2.418	10	0		DEAEHN
COc1ccc(NC(=O)NC(=O)CN2C[C@@H](C)CC[C@@H]2C)cc1	ZINC000072897503	191249606	/nfs/dbraw/zinc/24/96/06/191249606.db2.gz	SXWYWASIEDJDFI-STQMWFEESA-N	0	3	319.405	2.464	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCCc2ccc(F)cc2)CCN1C	ZINC000173189885	198193595	/nfs/dbraw/zinc/19/35/95/198193595.db2.gz	JBDOOZUYFSGHAT-BBRMVZONSA-N	0	3	307.413	2.492	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCc2ccc3c(c2)OCO3)CCN1C	ZINC000173891985	198265107	/nfs/dbraw/zinc/26/51/07/198265107.db2.gz	WQXTWUVMHUCORK-GXTWGEPZSA-N	0	3	319.405	2.039	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)[C@H](O)c1ccccc1	ZINC000073010083	191268263	/nfs/dbraw/zinc/26/82/63/191268263.db2.gz	XAYTZGYVRJWYHM-ZWKOTPCHSA-N	0	3	312.413	2.009	10	0		DEAEHN
CC(C)OCCCC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000182304655	199416536	/nfs/dbraw/zinc/41/65/36/199416536.db2.gz	FMOODDMIGMPVIW-KRWDZBQOSA-N	0	3	306.450	2.481	10	0		DEAEHN
CCC(=O)C1(c2ccccc2)CCN(CCOCCO)CC1	ZINC000003623455	181042013	/nfs/dbraw/zinc/04/20/13/181042013.db2.gz	FVYYUBRKVVOOAV-UHFFFAOYSA-N	0	3	305.418	2.008	10	0	in-man	DEAEHN
C[C@@H](CSC(C)(C)C)N[C@H]1CCN(C2CCOCC2)C1=O	ZINC000367413106	283113596	/nfs/dbraw/zinc/11/35/96/283113596.db2.gz	PEEJIZBAPQFKHO-JSGCOSHPSA-N	0	3	314.495	2.276	10	0		DEAEHN
COc1ccc(CC2CCN(C(=O)CNC3CC3)CC2)cc1	ZINC000154361464	355942295	/nfs/dbraw/zinc/94/22/95/355942295.db2.gz	VROLTYVKLODXMQ-UHFFFAOYSA-N	0	3	302.418	2.228	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1cccc(C)c1F	ZINC000179940914	356037638	/nfs/dbraw/zinc/03/76/38/356037638.db2.gz	XITAYYGHILBTDE-CYBMUJFWSA-N	0	3	309.385	2.366	10	0		DEAEHN
CNC(=O)[C@H]1C[C@H](c2ccccc2OC(F)(F)F)CCN1	ZINC000080129556	192003597	/nfs/dbraw/zinc/00/35/97/192003597.db2.gz	XEHQKPNLUQMTAJ-MWLCHTKSSA-N	0	3	302.296	2.167	10	0		DEAEHN
c1cn(CCCNCc2ccccc2OCc2cccnc2)nn1	ZINC000184249338	356188591	/nfs/dbraw/zinc/18/85/91/356188591.db2.gz	SMSUAYLKVAYPFU-UHFFFAOYSA-N	0	3	323.400	2.432	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCCNc2cccc(F)c2)C1	ZINC000184935408	356199850	/nfs/dbraw/zinc/19/98/50/356199850.db2.gz	JDECZTQWWWUNKW-MRXNPFEDSA-N	0	3	322.428	2.411	10	0		DEAEHN
NCc1cnc(I)c(OC(F)(F)F)c1	ZINC000238568154	356304006	/nfs/dbraw/zinc/30/40/06/356304006.db2.gz	UXVVHNVTYSVWTO-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
NCc1cnc(OC(F)(F)F)c(I)c1	ZINC000238570085	356304031	/nfs/dbraw/zinc/30/40/31/356304031.db2.gz	PHJXDWCYRJTSAP-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
COC[C@@H]1CCN([C@@H](CN)c2ccccc2Br)C1	ZINC000081041529	192219023	/nfs/dbraw/zinc/21/90/23/192219023.db2.gz	MQCLEPOLKDISTE-RISCZKNCSA-N	0	3	313.239	2.417	10	0		DEAEHN
COC[C@@H]1CCN([C@@H](CN)c2ccc(Br)o2)C1	ZINC000081049402	192219201	/nfs/dbraw/zinc/21/92/01/192219201.db2.gz	WFUGOBSWHHPIKV-ZJUUUORDSA-N	0	3	303.200	2.010	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)CCN(c2nc(N)ns2)C1	ZINC000306503907	356403804	/nfs/dbraw/zinc/40/38/04/356403804.db2.gz	XPWONGXFLSGNLY-LBPRGKRZSA-N	0	3	303.435	2.079	10	0		DEAEHN
NCc1cnc(C(F)(F)F)c(I)c1	ZINC000306669915	356405198	/nfs/dbraw/zinc/40/51/98/356405198.db2.gz	BSVURRSGESFWOO-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
OCCN1CCC[C@@H](NCc2sccc2Br)C1	ZINC000384413509	356683405	/nfs/dbraw/zinc/68/34/05/356683405.db2.gz	XDTKOCCBYKFUCK-SNVBAGLBSA-N	0	3	319.268	2.057	10	0		DEAEHN
C[C@@H](NCc1cc2c(c(Br)c1)OCO2)C(C)(C)O	ZINC000393967061	356713829	/nfs/dbraw/zinc/71/38/29/356713829.db2.gz	RNKRQFLDOCFVPL-MRVPVSSYSA-N	0	3	316.195	2.427	10	0		DEAEHN
c1ccc(-c2nc3c(c(N4C[C@H]5CCC[C@@H](C4)N5)n2)CCC3)nc1	ZINC000579693804	357015420	/nfs/dbraw/zinc/01/54/20/357015420.db2.gz	SNOWGBGVLYAYMY-OKILXGFUSA-N	0	3	321.428	2.358	10	0		DEAEHN
CN(C)CCn1cc(NCc2cccc3c2OCCCO3)cn1	ZINC000589650906	357488537	/nfs/dbraw/zinc/48/85/37/357488537.db2.gz	IOFDJUKMTGKTHS-UHFFFAOYSA-N	0	3	316.405	2.218	10	0		DEAEHN
CCC[C@@H](C(=O)NCCCn1cnc2ccccc21)N(C)C	ZINC000179334333	199017809	/nfs/dbraw/zinc/01/78/09/199017809.db2.gz	UMDVSJPKNANCPD-INIZCTEOSA-N	0	3	302.422	2.273	10	0		DEAEHN
CNc1cc(N2CCC[C@H]2CN[C@@H](C)c2ccco2)ncn1	ZINC000180574753	199178985	/nfs/dbraw/zinc/17/89/85/199178985.db2.gz	GDSMTAPEGZDSIR-STQMWFEESA-N	0	3	301.394	2.431	10	0		DEAEHN
NC1(C(=O)N2CC3(CCCC3)c3ccccc32)CCOCC1	ZINC000261905171	283398178	/nfs/dbraw/zinc/39/81/78/283398178.db2.gz	SFFMCWPXSIJUNI-UHFFFAOYSA-N	0	3	300.402	2.353	10	0		DEAEHN
CC[C@@H]1CN(Cc2c(Br)c(C)nn2C)CCN1C	ZINC000089232782	192748086	/nfs/dbraw/zinc/74/80/86/192748086.db2.gz	UTUFZVRLBBRBKD-LLVKDONJSA-N	0	3	315.259	2.017	10	0		DEAEHN
Cc1csc([C@H](C)CNC(=O)N2CC[C@@H](N3CC=CC3)C2)n1	ZINC000186809638	200013912	/nfs/dbraw/zinc/01/39/12/200013912.db2.gz	IRJLPUOFCHHMEB-TZMCWYRMSA-N	0	3	320.462	2.211	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)NC[C@H](C)N(C)C1CC1	ZINC000187090689	200060528	/nfs/dbraw/zinc/06/05/28/200060528.db2.gz	YAFJVHSJWKCENE-NSHDSACASA-N	0	3	309.385	2.116	10	0		DEAEHN
C[C@H](CCNCc1c(Cl)cnn1C)NC(=O)OC(C)(C)C	ZINC000189156143	200357285	/nfs/dbraw/zinc/35/72/85/200357285.db2.gz	KKUVYLDGASVONK-SNVBAGLBSA-N	0	3	316.833	2.466	10	0		DEAEHN
CN(C)CCOC1CCN(Cc2nc3ccccc3o2)CC1	ZINC000601761797	360137609	/nfs/dbraw/zinc/13/76/09/360137609.db2.gz	MPLKDYSRVWKIMC-UHFFFAOYSA-N	0	3	303.406	2.370	10	0		DEAEHN
COc1ccc2c(c1)CCN2C(=O)C1CCN(C2CC2)CC1	ZINC000195393012	201386357	/nfs/dbraw/zinc/38/63/57/201386357.db2.gz	VCMAFUMFZIETCN-UHFFFAOYSA-N	0	3	300.402	2.459	10	0		DEAEHN
c1cc(CN[C@H]2CCn3ccnc3C2)n(CCc2ccccc2)n1	ZINC000621345280	364361135	/nfs/dbraw/zinc/36/11/35/364361135.db2.gz	HWSNGPZLVCVVJI-KRWDZBQOSA-N	0	3	321.428	2.427	10	0		DEAEHN
CCn1nc(C)c(CNC[C@@H]2CC[C@H](c3nc(C)no3)O2)c1C	ZINC000623164853	364904577	/nfs/dbraw/zinc/90/45/77/364904577.db2.gz	YYLHKLXADKEORZ-DZGCQCFKSA-N	0	3	319.409	2.221	10	0		DEAEHN
CS(=O)(=O)c1cccc(CNC[C@H](O)C2CCCCC2)c1	ZINC000449119027	240083876	/nfs/dbraw/zinc/08/38/76/240083876.db2.gz	VVDKYEMOWPDZHZ-INIZCTEOSA-N	0	3	311.447	2.121	10	0		DEAEHN
Cn1cc([C@@H]2NC(=O)CC[C@H]2NCc2cc3ccccc3o2)cn1	ZINC000275353166	212286662	/nfs/dbraw/zinc/28/66/62/212286662.db2.gz	AEGBSSGUKYZJHC-QAPCUYQASA-N	0	3	324.384	2.276	10	0		DEAEHN
O[C@H]1COCC[C@@H]1NCc1cc(Br)ccc1Cl	ZINC000623767575	365168274	/nfs/dbraw/zinc/16/82/74/365168274.db2.gz	YDJGIFXPAXLURF-RYUDHWBXSA-N	0	3	320.614	2.342	10	0		DEAEHN
Cc1ccc(CNC[C@@H]2COCCN2C)c(Br)c1	ZINC000623711320	365139480	/nfs/dbraw/zinc/13/94/80/365139480.db2.gz	APKXOBGVXPZIJQ-CYBMUJFWSA-N	0	3	313.239	2.178	10	0		DEAEHN
Cc1ccc(NC(=O)C[C@@H]2CNCCO2)c(Br)c1	ZINC000091298888	193034043	/nfs/dbraw/zinc/03/40/43/193034043.db2.gz	NPOSDTINEXEYOE-SNVBAGLBSA-N	0	3	313.195	2.075	10	0		DEAEHN
COc1cc(OC)c(C[C@H](C)NCc2ccnn2C)c(OC)c1	ZINC000449466317	240562365	/nfs/dbraw/zinc/56/23/65/240562365.db2.gz	FQLFCWKEUUAZOL-LBPRGKRZSA-N	0	3	319.405	2.167	10	0		DEAEHN
CC(C)NCc1cnn([C@]2(C)CCS(=O)(=O)C2)c1C(C)C	ZINC000091337241	193043182	/nfs/dbraw/zinc/04/31/82/193043182.db2.gz	OWDSPCAVLPICMT-OAHLLOKOSA-N	0	3	313.467	2.038	10	0		DEAEHN
Cc1ccc(C(F)(F)F)cc1NC(=O)[C@]1(C)COC[C@H]1N	ZINC000091479813	193061898	/nfs/dbraw/zinc/06/18/98/193061898.db2.gz	YURNFOKEQXUDOS-DGCLKSJQSA-N	0	3	302.296	2.316	10	0		DEAEHN
C[C@H](N[C@@H]1CCOC[C@@H]1O)c1cc(Br)ccc1F	ZINC000624236567	365345864	/nfs/dbraw/zinc/34/58/64/365345864.db2.gz	FREHELGYWAWVKX-CKLFPEKLSA-N	0	3	318.186	2.389	10	0		DEAEHN
CCCc1c(Cl)ncnc1NC[C@H]1CN2CCC[C@@H]2CO1	ZINC000091677239	193089501	/nfs/dbraw/zinc/08/95/01/193089501.db2.gz	PQEIFQVIYZGXGP-NEPJUHHUSA-N	0	3	310.829	2.358	10	0		DEAEHN
Nc1nc2cc(Cl)ccc2n1C[C@H]1CN2CCC[C@@H]2CO1	ZINC000091675131	193089555	/nfs/dbraw/zinc/08/95/55/193089555.db2.gz	KTXQRDZPAFJYGW-VXGBXAGGSA-N	0	3	306.797	2.135	10	0		DEAEHN
CCOc1ccccc1CN1CCN(CC[C@H](C)O)[C@H](C)C1	ZINC000450907596	242384779	/nfs/dbraw/zinc/38/47/79/242384779.db2.gz	KXLDGVNTXNUGIN-CVEARBPZSA-N	0	3	306.450	2.362	10	0		DEAEHN
COC[C@H](N)Cc1cn(Cc2ccc(Cl)cc2Cl)nn1	ZINC000630590825	367743760	/nfs/dbraw/zinc/74/37/60/367743760.db2.gz	OSQCRFATQXQOOX-LLVKDONJSA-N	0	3	315.204	2.149	10	0		DEAEHN
COCCNCc1c(N2C[C@H](C)[C@@H](C)C2)nc2sccn12	ZINC000092086542	193155338	/nfs/dbraw/zinc/15/53/38/193155338.db2.gz	HMDGVSVCJFYIRQ-RYUDHWBXSA-N	0	3	308.451	2.224	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2cccc(CNC3CC3)c2)C[C@@H]1C	ZINC000092113890	193161808	/nfs/dbraw/zinc/16/18/08/193161808.db2.gz	CXZPZQACGQSANJ-STQMWFEESA-N	0	3	308.447	2.215	10	0		DEAEHN
CC[C@H]1CCCN(S(=O)(=O)c2ccc(CN)cc2F)CC1	ZINC000092116235	193164064	/nfs/dbraw/zinc/16/40/64/193164064.db2.gz	NXYLWVFALKKOFK-LBPRGKRZSA-N	0	3	314.426	2.485	10	0		DEAEHN
CC1(C)C[C@H]1NS(=O)(=O)c1ccc(CNC2CC2)cc1F	ZINC000092116027	193164543	/nfs/dbraw/zinc/16/45/43/193164543.db2.gz	QBVDZAULKQUSFZ-CQSZACIVSA-N	0	3	312.410	2.155	10	0		DEAEHN
CCc1nn(C)cc1C(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000092247650	193179847	/nfs/dbraw/zinc/17/98/47/193179847.db2.gz	WSVPSCSDJKHVIV-MRXNPFEDSA-N	0	3	300.406	2.015	10	0		DEAEHN
CC(C)(O)CN1CCN(C[C@@H]2Cc3ccccc3S2)CC1	ZINC000092270275	193183812	/nfs/dbraw/zinc/18/38/12/193183812.db2.gz	FYSVEGHZBGWUCJ-HNNXBMFYSA-N	0	3	306.475	2.092	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)c2ccc(N)cc2)o1	ZINC000261862112	203137413	/nfs/dbraw/zinc/13/74/13/203137413.db2.gz	GBHBHFBEWYARBO-UHFFFAOYSA-N	0	3	301.390	2.374	10	0		DEAEHN
C[C@@H](N)C(=O)N[C@H](Cc1ccc(Cl)cc1)c1ccccn1	ZINC000262511018	203314693	/nfs/dbraw/zinc/31/46/93/203314693.db2.gz	BIQIBELNHRLDNI-IAQYHMDHSA-N	0	3	303.793	2.482	10	0		DEAEHN
COc1ccc([C@@H](C)NCC(C)(C)S(C)(=O)=O)cc1OC	ZINC000093520946	193263353	/nfs/dbraw/zinc/26/33/53/193263353.db2.gz	JUHIQZHOWJKMAD-LLVKDONJSA-N	0	3	315.435	2.178	10	0		DEAEHN
C[C@H](NC[C@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1F	ZINC000093696619	193291917	/nfs/dbraw/zinc/29/19/17/193291917.db2.gz	XYYOYEPISARAOK-QWHCGFSZSA-N	0	3	314.426	2.148	10	0		DEAEHN
COC(=O)C(C)(C)COc1ccc(Br)cc1CN	ZINC000093714176	193297150	/nfs/dbraw/zinc/29/71/50/193297150.db2.gz	LPLYDHGAOSVNOW-UHFFFAOYSA-N	0	3	316.195	2.486	10	0		DEAEHN
CN[C@]1(C(N)=O)CCC[C@H](Sc2nc3ccccc3o2)C1	ZINC000093777940	193305384	/nfs/dbraw/zinc/30/53/84/193305384.db2.gz	MAYSBZNLYIKTBH-ZUZCIYMTSA-N	0	3	305.403	2.306	10	0		DEAEHN
COCCOCCOc1c(F)cc(CNC2CC2)cc1F	ZINC000094347674	193363518	/nfs/dbraw/zinc/36/35/18/193363518.db2.gz	GJPVPAAHUAPWNG-UHFFFAOYSA-N	0	3	301.333	2.259	10	0		DEAEHN
CNCc1ccc(OCC(=O)Nc2ccc(Cl)cc2)cn1	ZINC000094209009	193349494	/nfs/dbraw/zinc/34/94/94/193349494.db2.gz	CNSOISAAEQCDAM-UHFFFAOYSA-N	0	3	305.765	2.472	10	0		DEAEHN
CCCN[C@H](C)c1cc(F)ccc1O[C@H]1CCS(=O)(=O)C1	ZINC000094620466	193385710	/nfs/dbraw/zinc/38/57/10/193385710.db2.gz	MTPOFSXQGAWRTM-YPMHNXCESA-N	0	3	315.410	2.452	10	0		DEAEHN
CCN[C@H](CC)c1cnn([C@H]2CCC[C@H](S(C)(=O)=O)C2)c1	ZINC000094644040	193389650	/nfs/dbraw/zinc/38/96/50/193389650.db2.gz	NHNRWTXEJJJBDP-SOUVJXGZSA-N	0	3	313.467	2.472	10	0		DEAEHN
CN[C@@H]1CCCc2sc(N3CCN4CCCC[C@@H]4C3)nc21	ZINC000094444124	193369689	/nfs/dbraw/zinc/36/96/89/193369689.db2.gz	CNVJAGCOBRBETR-CHWSQXEVSA-N	0	3	306.479	2.414	10	0		DEAEHN
C[C@@H](CN)S(=O)(=O)NC12CC3C[C@@](C)(C1)C[C@](C)(C3)C2	ZINC000094544502	193377967	/nfs/dbraw/zinc/37/79/67/193377967.db2.gz	WNWLJSJMWLYYSR-WQNPGBKJSA-N	0	3	300.468	2.002	10	0		DEAEHN
Clc1ccc2nc(N3CCNCC34CCCCC4)nn2c1	ZINC000094608686	193384357	/nfs/dbraw/zinc/38/43/57/193384357.db2.gz	LBKZDSHCLSTKQV-UHFFFAOYSA-N	0	3	305.813	2.495	10	0		DEAEHN
CNCc1ccc(Cn2nc(C)c(Br)c2C)nc1	ZINC000094759011	193395280	/nfs/dbraw/zinc/39/52/80/193395280.db2.gz	KCUCZCBYONHOMP-UHFFFAOYSA-N	0	3	309.211	2.425	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2CCC(C)(C)C2)cn1C(C)C	ZINC000094814838	193399857	/nfs/dbraw/zinc/39/98/57/193399857.db2.gz	YFFTUMOOQUSEHD-UHFFFAOYSA-N	0	3	313.467	2.209	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCC(C)(C)C2)s1	ZINC000094814820	193399994	/nfs/dbraw/zinc/39/99/94/193399994.db2.gz	GNMNMZJRXITNHI-UHFFFAOYSA-N	0	3	302.465	2.278	10	0		DEAEHN
Cc1ccc(NC(=O)N2C[C@H](O)C[C@@H]2CN(C)C)cc1Cl	ZINC000097253521	193699414	/nfs/dbraw/zinc/69/94/14/193699414.db2.gz	BQIBLDNUTODTRS-CHWSQXEVSA-N	0	3	311.813	2.177	10	0		DEAEHN
CC(C)N(CC(N)=S)Cc1ccc(Br)cn1	ZINC000160603314	197425943	/nfs/dbraw/zinc/42/59/43/197425943.db2.gz	YQNYJVRWHJHQQR-UHFFFAOYSA-N	0	3	302.241	2.341	10	0		DEAEHN
COc1ccc(S(=O)(=O)NC2CCCCCC2)cc1CN	ZINC000020189993	182195433	/nfs/dbraw/zinc/19/54/33/182195433.db2.gz	VCVMXXWPQCRRKD-UHFFFAOYSA-N	0	3	312.435	2.155	10	0		DEAEHN
CCN1CCN([C@@H](CN)c2cc(Br)cs2)CC1	ZINC000020475239	182221680	/nfs/dbraw/zinc/22/16/80/182221680.db2.gz	REUNDJSNOGXMBO-NSHDSACASA-N	0	3	318.284	2.148	10	0		DEAEHN
O=C1C(CNCCc2ccccc2)=CC2=CC=C[C@H]3CCN1[C@@H]23	ZINC000039287462	183016246	/nfs/dbraw/zinc/01/62/46/183016246.db2.gz	KLIANTXYBOVEAE-QFBILLFUSA-N	0	3	306.409	2.472	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2ccc(SC(F)F)cc2)C1	ZINC000040632699	183111499	/nfs/dbraw/zinc/11/14/99/183111499.db2.gz	CLTZUFLCIYQZQE-KOLCDFICSA-N	0	3	302.346	2.317	10	0		DEAEHN
CC[C@@H](C)[C@H](N)C(=O)Nc1sc2c(c1C(=O)OC)CCC2	ZINC000040858860	183142980	/nfs/dbraw/zinc/14/29/80/183142980.db2.gz	DUSJSOHXMZELNL-PELKAZGASA-N	0	3	310.419	2.335	10	0		DEAEHN
Cc1ccc(F)c(NC(=O)C(=O)NCCN2CCCC[C@@H]2C)c1	ZINC000041664515	183213333	/nfs/dbraw/zinc/21/33/33/183213333.db2.gz	YOCUXKHSLNYXKC-ZDUSSCGKSA-N	0	3	321.396	2.063	10	0		DEAEHN
NC[C@@H](c1ccc(Br)o1)N1CCCSCC1	ZINC000042443730	183271044	/nfs/dbraw/zinc/27/10/44/183271044.db2.gz	GDKNNQZJQZVGSE-VIFPVBQESA-N	0	3	305.241	2.481	10	0		DEAEHN
COCCN([C@H](C)COC)[C@@H](CN)c1cccc(Cl)c1	ZINC000042606662	183290594	/nfs/dbraw/zinc/29/05/94/183290594.db2.gz	OJSSPTQCOJXULU-DOMZBBRYSA-N	0	3	300.830	2.323	10	0		DEAEHN
CCN(C[C@H](N)c1ccc2c(c1)OCCO2)CC(F)(F)F	ZINC000042747879	183304774	/nfs/dbraw/zinc/30/47/74/183304774.db2.gz	XXVFNPPHICGOPF-NSHDSACASA-N	0	3	304.312	2.342	10	0		DEAEHN
CS(=O)(=O)c1cccc(O[C@@H](CN)c2ccc(F)cc2)c1	ZINC000042942555	183320003	/nfs/dbraw/zinc/32/00/03/183320003.db2.gz	DDYNZLZCBBALMH-HNNXBMFYSA-N	0	3	309.362	2.308	10	0		DEAEHN
C[C@H]1c2ccsc2CCN1S(=O)(=O)C[C@@H]1CCCCN1	ZINC000042782422	183309232	/nfs/dbraw/zinc/30/92/32/183309232.db2.gz	AEOMIIWHOFXPLG-RYUDHWBXSA-N	0	3	314.476	2.139	10	0		DEAEHN
Cn1cc([C@@H](CN)Oc2c(F)c(F)c(F)c(F)c2F)cn1	ZINC000043236401	183346135	/nfs/dbraw/zinc/34/61/35/183346135.db2.gz	KUZRAMZOBQLWKP-ZCFIWIBFSA-N	0	3	307.222	2.194	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(C)s1)N(C)CC(=O)N1CCCC1	ZINC000043242126	183346678	/nfs/dbraw/zinc/34/66/78/183346678.db2.gz	HLWJVIBSENESCM-CZUORRHYSA-N	0	3	309.479	2.389	10	0		DEAEHN
CCCN(CC(=O)NC)[C@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043253700	183348431	/nfs/dbraw/zinc/34/84/31/183348431.db2.gz	BAEMEFXRILWVNB-RNCFNFMXSA-N	0	3	303.859	2.248	10	0		DEAEHN
C[C@H](N)[C@H](c1cc(Br)cs1)N1CCC(O)CC1	ZINC000043284552	183350604	/nfs/dbraw/zinc/35/06/04/183350604.db2.gz	MLEHQINHMFWOSH-QPUJVOFHSA-N	0	3	319.268	2.356	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccco1)N1CCN(c2nccs2)CC1	ZINC000043334566	183355671	/nfs/dbraw/zinc/35/56/71/183355671.db2.gz	ORLQLYRPQCKOFA-OCCSQVGLSA-N	0	3	306.435	2.337	10	0		DEAEHN
CC(C)OC(=O)COc1ccc(Br)cc1CN	ZINC000043445927	183364525	/nfs/dbraw/zinc/36/45/25/183364525.db2.gz	KBSRMIWJVUFBQY-UHFFFAOYSA-N	0	3	302.168	2.238	10	0		DEAEHN
O=S1(=O)CC[C@H](Oc2ccc(CNC3CC3)cc2Cl)C1	ZINC000043488254	183366459	/nfs/dbraw/zinc/36/64/59/183366459.db2.gz	HZIOUAPIKUJYOB-LBPRGKRZSA-N	0	3	315.822	2.158	10	0		DEAEHN
CC(C)CN(CCC(N)=S)[C@H](C)C(=O)NC1CCCCC1	ZINC000043418486	183361186	/nfs/dbraw/zinc/36/11/86/183361186.db2.gz	RJXKDZGOBDRSAC-CYBMUJFWSA-N	0	3	313.511	2.458	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)Cc2ccccc2)C[C@H]1CC	ZINC000105838166	194144465	/nfs/dbraw/zinc/14/44/65/194144465.db2.gz	UABCTPMNXYBCIV-RTBURBONSA-N	0	3	320.477	2.023	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)N(C)Cc2ccccc2C)c1	ZINC000105881730	194156024	/nfs/dbraw/zinc/15/60/24/194156024.db2.gz	MSNZBOVUXWDNNZ-INIZCTEOSA-N	0	3	314.433	2.137	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)NCCC2=CCCCC2)c1	ZINC000105881346	194156030	/nfs/dbraw/zinc/15/60/30/194156030.db2.gz	VJZWDOSZBLLPDA-HNNXBMFYSA-N	0	3	304.438	2.176	10	0		DEAEHN
CCCCOC(=O)CCN1CCCN(c2ccc(C)nn2)CC1	ZINC000105909476	194166372	/nfs/dbraw/zinc/16/63/72/194166372.db2.gz	QRACTNUOOHZWJD-UHFFFAOYSA-N	0	3	320.437	2.031	10	0		DEAEHN
CCc1ccc(CN2CCN([C@H](CC)C(N)=S)CC2)s1	ZINC000109469660	194266451	/nfs/dbraw/zinc/26/64/51/194266451.db2.gz	CBEUYMDFOWVTSO-CQSZACIVSA-N	0	3	311.520	2.493	10	0		DEAEHN
CC[C@H]1CN(Cc2ncc(C)c(OC)c2C)CCN1CCOC	ZINC000110031117	194304337	/nfs/dbraw/zinc/30/43/37/194304337.db2.gz	LXUPZUXUHJENRS-INIZCTEOSA-N	0	3	321.465	2.250	10	0		DEAEHN
COCC[C@@H](N)C(=O)N(Cc1ccco1)Cc1cccs1	ZINC000052808239	183874269	/nfs/dbraw/zinc/87/42/69/183874269.db2.gz	SVBHUBOEOUFSHP-CQSZACIVSA-N	0	3	308.403	2.234	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)s1)N1CCNC(=O)C1(C)C	ZINC000110653442	194346755	/nfs/dbraw/zinc/34/67/55/194346755.db2.gz	VOGLDRVZSSVPFY-BXKDBHETSA-N	0	3	315.870	2.390	10	0		DEAEHN
C[C@@H]1CCCN(S(=O)(=O)c2cccc3c2CCNC3)CC1	ZINC000110815665	194361069	/nfs/dbraw/zinc/36/10/69/194361069.db2.gz	QHVINSCDCJZORR-CYBMUJFWSA-N	0	3	308.447	2.143	10	0		DEAEHN
CCOCCN(CC)[C@@H](CN)c1ccc(Br)o1	ZINC000111117425	194391794	/nfs/dbraw/zinc/39/17/94/194391794.db2.gz	YULPJYNLWVJQSF-JTQLQIEISA-N	0	3	305.216	2.400	10	0		DEAEHN
CCOCCN(CC)[C@H](CN)c1ccc(Br)o1	ZINC000111117428	194391993	/nfs/dbraw/zinc/39/19/93/194391993.db2.gz	YULPJYNLWVJQSF-SNVBAGLBSA-N	0	3	305.216	2.400	10	0		DEAEHN
C[C@](O)(Cc1cccc(Br)c1)C[C@@H]1COCCN1	ZINC000156888289	197147308	/nfs/dbraw/zinc/14/73/08/197147308.db2.gz	OHBMVMQNZXJTAL-KGLIPLIRSA-N	0	3	314.223	2.121	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1OCCNC(=O)N1CCCN(C2CC2)CC1	ZINC000057777165	184052492	/nfs/dbraw/zinc/05/24/92/184052492.db2.gz	CIPCDMIVPLZEFE-NVXWUHKLSA-N	0	3	323.481	2.461	10	0		DEAEHN
CC(C)NCCS(=O)(=O)c1ccc(Br)cc1	ZINC000059207740	184136016	/nfs/dbraw/zinc/13/60/16/184136016.db2.gz	WQAIXBUCXJWZNX-UHFFFAOYSA-N	0	3	306.225	2.221	10	0		DEAEHN
CCNCCS(=O)(=O)N(C)[C@@H](C)c1ccccc1Cl	ZINC000062027790	184201719	/nfs/dbraw/zinc/20/17/19/184201719.db2.gz	BROLHOPSEYONPX-NSHDSACASA-N	0	3	304.843	2.272	10	0		DEAEHN
CC1(C)Cc2nc(N3CCn4ccnc4C3)sc2[C@H](N)C1	ZINC000062327776	184231011	/nfs/dbraw/zinc/23/10/11/184231011.db2.gz	VIEYQWOIZGHOMD-SNVBAGLBSA-N	0	3	303.435	2.332	10	0		DEAEHN
CN(C)[C@@H](C(=O)NCC(C)(C)N1CCCC1)c1ccccc1	ZINC000062364311	184233239	/nfs/dbraw/zinc/23/32/39/184233239.db2.gz	VTDUQEYHCLXJBL-MRXNPFEDSA-N	0	3	303.450	2.280	10	0		DEAEHN
c1ccc(-c2nnc(CCN3CCC4(CC3)OCCO4)o2)cc1	ZINC000062653205	184246681	/nfs/dbraw/zinc/24/66/81/184246681.db2.gz	WWJYRVYOENDWBB-UHFFFAOYSA-N	0	3	315.373	2.118	10	0		DEAEHN
CNc1ncc(C(=O)N2CC[C@@H](N3CCCC3)C2)cc1Cl	ZINC000062984907	184264929	/nfs/dbraw/zinc/26/49/29/184264929.db2.gz	DGDUTMWVWQBHHJ-GFCCVEGCSA-N	0	3	308.813	2.087	10	0		DEAEHN
NCc1c(N2CCOc3ccccc3C2)nc2sccn12	ZINC000063013007	184266574	/nfs/dbraw/zinc/26/65/74/184266574.db2.gz	MBSXPDMJZIOWMM-UHFFFAOYSA-N	0	3	300.387	2.254	10	0		DEAEHN
CCCOc1ccc(CNC)c(OCCCS(C)(=O)=O)c1	ZINC000063014390	184266636	/nfs/dbraw/zinc/26/66/36/184266636.db2.gz	IKOARBSWJIEMTQ-UHFFFAOYSA-N	0	3	315.435	2.008	10	0		DEAEHN
N[C@H](CS(=O)(=O)c1c(Cl)cccc1Cl)[C@@H]1CCOC1	ZINC000158809765	197302583	/nfs/dbraw/zinc/30/25/83/197302583.db2.gz	ZPTPRYGDTUQWAO-LDYMZIIASA-N	0	3	324.229	2.131	10	0		DEAEHN
CCCNS(=O)(=O)c1ccc(F)c(CNC(C)(C)C)c1	ZINC000159078198	197325163	/nfs/dbraw/zinc/32/51/63/197325163.db2.gz	QIFWHBQKRHVPKG-UHFFFAOYSA-N	0	3	302.415	2.402	10	0		DEAEHN
CCCCNCC(=O)Nc1cccc(C(=O)N(CC)CC)c1	ZINC000066213904	184397056	/nfs/dbraw/zinc/39/70/56/184397056.db2.gz	XDAQFJHXZSBXLE-UHFFFAOYSA-N	0	3	305.422	2.497	10	0		DEAEHN
CCNCC(=O)Nc1cccc(C(=O)N2CCCCCC2)c1	ZINC000066225771	184397730	/nfs/dbraw/zinc/39/77/30/184397730.db2.gz	SRWZIUIMLVDWOC-UHFFFAOYSA-N	0	3	303.406	2.251	10	0		DEAEHN
CC(=O)N1C[C@@H]2CCC[C@H](N[C@H](C)c3cnc(C)cn3)[C@@H]2C1	ZINC000555625263	291800784	/nfs/dbraw/zinc/80/07/84/291800784.db2.gz	DJHMVUCRBCMMCQ-BVUBDWEXSA-N	0	3	302.422	2.083	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CCCC[C@@H]1C(C)C	ZINC000117495191	285032858	/nfs/dbraw/zinc/03/28/58/285032858.db2.gz	BVDSJTAIEHRLMF-JKSUJKDBSA-N	0	3	311.470	2.317	10	0		DEAEHN
COc1ccccc1N1CC[C@@H](N[C@H](C)c2cnn(C)c2)C1	ZINC000119664867	195013922	/nfs/dbraw/zinc/01/39/22/195013922.db2.gz	LJPTWPVWJAJBFV-UKRRQHHQSA-N	0	3	300.406	2.358	10	0		DEAEHN
c1nc(N2CCCC2)ncc1CN1CCC[C@@H]2COCC[C@H]21	ZINC000538790548	285056125	/nfs/dbraw/zinc/05/61/25/285056125.db2.gz	ITIOLBNPVZJFOV-HZPDHXFCSA-N	0	3	302.422	2.078	10	0		DEAEHN
CNC(=O)NC(=O)CN[C@@H](C)c1ccc(-c2ccccc2)cc1	ZINC000120051960	195088148	/nfs/dbraw/zinc/08/81/48/195088148.db2.gz	HCXCHDVFIZAHTM-ZDUSSCGKSA-N	0	3	311.385	2.460	10	0		DEAEHN
CCC[C@@H](C(=O)NCCCc1ccc(OC)c(OC)c1)N(C)C	ZINC000120108110	195098333	/nfs/dbraw/zinc/09/83/33/195098333.db2.gz	IAJVCBMDYUTQKT-HNNXBMFYSA-N	0	3	322.449	2.483	10	0		DEAEHN
NC[C@@H](Cc1cc(F)cc(C(F)(F)F)c1)C(=O)NC1CC1	ZINC000159198956	197334491	/nfs/dbraw/zinc/33/44/91/197334491.db2.gz	XLAZXRAIXJHQBQ-SECBINFHSA-N	0	3	304.287	2.241	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCC(C)(C)C2)cc(CN)c1F	ZINC000159126093	197329048	/nfs/dbraw/zinc/32/90/48/197329048.db2.gz	SHTBITYBEBYOLN-UHFFFAOYSA-N	0	3	300.399	2.013	10	0		DEAEHN
Cc1cc(S(=O)(=O)N[C@H]2C[C@@H]2C)cc(CNC(C)C)c1F	ZINC000159110198	197328083	/nfs/dbraw/zinc/32/80/83/197328083.db2.gz	SLRIBBTYAVBLIC-HZMBPMFUSA-N	0	3	314.426	2.319	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)CCC(C)C)cc(CN)c1F	ZINC000159095096	197326517	/nfs/dbraw/zinc/32/65/17/197326517.db2.gz	RPVPAOPOYADAFT-UHFFFAOYSA-N	0	3	302.415	2.259	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC(C2CC2)C2CC2)cc(CN)c1F	ZINC000159097949	197326206	/nfs/dbraw/zinc/32/62/06/197326206.db2.gz	RCQSQJFTLAKGDK-UHFFFAOYSA-N	0	3	312.410	2.060	10	0		DEAEHN
N[C@@H](CS(=O)(=O)c1c(Cl)cccc1Cl)[C@H]1CCOC1	ZINC000158809920	197302579	/nfs/dbraw/zinc/30/25/79/197302579.db2.gz	ZPTPRYGDTUQWAO-KWQFWETISA-N	0	3	324.229	2.131	10	0		DEAEHN
CNCc1sc(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)cc1C	ZINC000158768538	197300260	/nfs/dbraw/zinc/30/02/60/197300260.db2.gz	GXCVGXXNZLPMIL-RYUDHWBXSA-N	0	3	314.476	2.197	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)cs1	ZINC000158755919	197298633	/nfs/dbraw/zinc/29/86/33/197298633.db2.gz	MUULRSJBCGZXQN-TXEJJXNPSA-N	0	3	314.476	2.278	10	0		DEAEHN
CCN[C@H](c1cscn1)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000158593883	197287048	/nfs/dbraw/zinc/28/70/48/197287048.db2.gz	SRCAAKTVDJEEHX-GVXVVHGQSA-N	0	3	302.465	2.397	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000158445214	197272844	/nfs/dbraw/zinc/27/28/44/197272844.db2.gz	OZPWEQMDPHXRSU-HUUCEWRRSA-N	0	3	317.433	2.183	10	0		DEAEHN
COC(=O)c1c2c(sc1NC(=O)[C@H](N)C(C)(C)C)CCC2	ZINC000158298484	197260647	/nfs/dbraw/zinc/26/06/47/197260647.db2.gz	QMHNJFBQZCVEQS-NSHDSACASA-N	0	3	310.419	2.335	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)c1ccc(N(C)C)cc1F	ZINC000158023400	197237093	/nfs/dbraw/zinc/23/70/93/197237093.db2.gz	JHWWBVUGURLQCP-ZDUSSCGKSA-N	0	3	307.413	2.496	10	0		DEAEHN
C[C@@](O)(Cc1cccc(Br)c1)C[C@@H]1COCCN1	ZINC000156888140	197147344	/nfs/dbraw/zinc/14/73/44/197147344.db2.gz	OHBMVMQNZXJTAL-ZIAGYGMSSA-N	0	3	314.223	2.121	10	0		DEAEHN
COC[C@@H](C)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000163359972	285199848	/nfs/dbraw/zinc/19/98/48/285199848.db2.gz	RMSRAGYHVRZXAT-CRAIPNDOSA-N	0	3	304.434	2.440	10	0		DEAEHN
CCN(C)CCNC(=O)c1sc2cccc(OC)c2c1N	ZINC000156179791	197092984	/nfs/dbraw/zinc/09/29/84/197092984.db2.gz	PXLQWPXGMUIKPK-UHFFFAOYSA-N	0	3	307.419	2.174	10	0		DEAEHN
COc1ccc(OC)c(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000155533963	197063470	/nfs/dbraw/zinc/06/34/70/197063470.db2.gz	DIECCKWIPJUJDJ-WFASDCNBSA-N	0	3	306.406	2.162	10	0		DEAEHN
COc1cccc(OC)c1C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000155443547	197055505	/nfs/dbraw/zinc/05/55/05/197055505.db2.gz	YJKKFHUXBKBKDA-OLZOCXBDSA-N	0	3	306.406	2.162	10	0		DEAEHN
CNC(=O)CCCN(C)Cc1csc(Br)c1	ZINC000154946053	197007348	/nfs/dbraw/zinc/00/73/48/197007348.db2.gz	ZOMLYNKLXFFBPE-UHFFFAOYSA-N	0	3	305.241	2.469	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1F	ZINC000120580052	195195011	/nfs/dbraw/zinc/19/50/11/195195011.db2.gz	GVMSAQUFLBMQMC-TZMCWYRMSA-N	0	3	321.396	2.014	10	0		DEAEHN
O=C(NCc1cccs1)[C@@H]1C[C@H]2CCN(CC3CC3)C[C@@H]2O1	ZINC000247465664	257118729	/nfs/dbraw/zinc/11/87/29/257118729.db2.gz	CNTKCIYHSDUYEO-KBMXLJTQSA-N	0	3	320.458	2.254	10	0		DEAEHN
O=C(NC1CC1)[C@@H]1C[C@@H]2OCC[C@@H]2N(Cc2ccsc2)C1	ZINC000247730635	257119156	/nfs/dbraw/zinc/11/91/56/257119156.db2.gz	HGQVABQBBURZLI-SNPRPXQTSA-N	0	3	306.431	2.006	10	0		DEAEHN
Cc1cc(F)ccc1NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000121852057	195361107	/nfs/dbraw/zinc/36/11/07/195361107.db2.gz	WUIUCDNYPLREDX-AWEZNQCLSA-N	0	3	323.412	2.165	10	0		DEAEHN
CCc1ccccc1NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000121869121	195365892	/nfs/dbraw/zinc/36/58/92/195365892.db2.gz	OBYCFXIGFQSXHS-HNNXBMFYSA-N	0	3	319.449	2.280	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-]CC(CC)CC)o1	ZINC000125637164	195771491	/nfs/dbraw/zinc/77/14/91/195771491.db2.gz	KPRBVMAJHIRTJD-UHFFFAOYSA-N	0	3	302.440	2.494	10	0		DEAEHN
c1c2c(nn1-c1ccccc1)CCC[C@@H]2NC[C@H]1COCCO1	ZINC000358913794	285420834	/nfs/dbraw/zinc/42/08/34/285420834.db2.gz	JBXNIEKHUZYZIN-RDJZCZTQSA-N	0	3	313.401	2.255	10	0		DEAEHN
CC(C)[C@H](NC(=O)OC(C)(C)C)[C@@]1(C)NCCc2nc[nH]c21	ZINC000725242524	542769943	/nfs/dbraw/zinc/76/99/43/542769943.db2.gz	CCJUOAKBVXDUBX-BLLLJJGKSA-N	0	3	308.426	2.320	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCC[C@@](CN)(C(=O)OC(C)(C)C)C1	ZINC000725243959	542769977	/nfs/dbraw/zinc/76/99/77/542769977.db2.gz	BUVGPYGKTYFGAZ-INIZCTEOSA-N	0	3	314.426	2.304	10	0		DEAEHN
CC(C)[C@H](NC(=O)OC(C)(C)C)[C@@]1(C)NCCc2ncn(C)c21	ZINC000725242735	542770109	/nfs/dbraw/zinc/77/01/09/542770109.db2.gz	NYPJEEIYIPBFDI-SUMWQHHRSA-N	0	3	322.453	2.330	10	0		DEAEHN
CC(C)c1ccc(/C=C\CC(=O)NC[C@@]2(O)CCN(C)C2)cc1	ZINC000358068356	133119081	/nfs/dbraw/zinc/11/90/81/133119081.db2.gz	QZPPEVAKCRLTMK-HMECNJMJSA-N	0	3	316.445	2.396	10	0		DEAEHN
Cc1ccc2c(c1)[C@H](N[C@@H]1CCN(C3CCOCC3)C1=O)CC2	ZINC000358185235	133126521	/nfs/dbraw/zinc/12/65/21/133126521.db2.gz	XZPOZMJPOOOSNO-QZTJIDSGSA-N	0	3	314.429	2.352	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC[C@H](c2noc(C3CC3)n2)C1)N(C)C	ZINC000360692452	133195021	/nfs/dbraw/zinc/19/50/21/133195021.db2.gz	PQJZSFRZMVXYIS-UONOGXRCSA-N	0	3	320.437	2.383	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@@H](c2nccn2C)C2CC2)C12CCOCC2	ZINC000187784950	145003282	/nfs/dbraw/zinc/00/32/82/145003282.db2.gz	MRDSCJAETMMQSD-ARFHVFGLSA-N	0	3	319.449	2.435	10	0		DEAEHN
CCc1onc(C)c1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1	ZINC000187772555	145003372	/nfs/dbraw/zinc/00/33/72/145003372.db2.gz	SBPPNXWYUBPJKN-CHWSQXEVSA-N	0	3	323.437	2.165	10	0		DEAEHN
O=C([C@@H]1CCCO[C@H]1c1ccccc1)N1CCN2CCC1CC2	ZINC000188624124	145014582	/nfs/dbraw/zinc/01/45/82/145014582.db2.gz	QTXAOLDTFAJWMG-MSOLQXFVSA-N	0	3	314.429	2.461	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1cccc(-n2ccnc2)c1	ZINC000188679808	145015472	/nfs/dbraw/zinc/01/54/72/145015472.db2.gz	QICMEHZXNSWVDI-UHFFFAOYSA-N	0	3	318.380	2.406	10	0		DEAEHN
Cc1ccc2cccc(NC(=O)c3n[nH]c4c3CNCC4)c2n1	ZINC000188710191	145016368	/nfs/dbraw/zinc/01/63/68/145016368.db2.gz	XQDWFNJOXYNJRB-UHFFFAOYSA-N	0	3	307.357	2.164	10	0		DEAEHN
Cn1cc([C@H]2CCN(CCOCC(F)(F)C(F)F)C2)cn1	ZINC000189338777	145026359	/nfs/dbraw/zinc/02/63/59/145026359.db2.gz	PWPITOIXVAGGPX-JTQLQIEISA-N	0	3	309.307	2.126	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)c1n[nH]c2c1CCCCC2	ZINC000190256868	145040013	/nfs/dbraw/zinc/04/00/13/145040013.db2.gz	FAGKMKAWIFORSB-ZDUSSCGKSA-N	0	3	304.438	2.283	10	0		DEAEHN
CCc1nc(C2CCN(CCC(=O)OC(C)(C)C)CC2)n[nH]1	ZINC000190695098	145046665	/nfs/dbraw/zinc/04/66/65/145046665.db2.gz	ODTSNWIIIWONJR-UHFFFAOYSA-N	0	3	308.426	2.278	10	0		DEAEHN
CCc1n[nH]c(C2CCN(CCC(=O)OC(C)(C)C)CC2)n1	ZINC000190695098	145046667	/nfs/dbraw/zinc/04/66/67/145046667.db2.gz	ODTSNWIIIWONJR-UHFFFAOYSA-N	0	3	308.426	2.278	10	0		DEAEHN
NC(=O)[C@H]1CCC[C@@H](NCc2ccc(Br)o2)C1	ZINC000191148414	145053611	/nfs/dbraw/zinc/05/36/11/145053611.db2.gz	YMGMFKJANNSYBF-DTWKUNHWSA-N	0	3	301.184	2.176	10	0		DEAEHN
COC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1CCCOCC(F)(F)F	ZINC000191214490	145054197	/nfs/dbraw/zinc/05/41/97/145054197.db2.gz	DNRMXQIAUOTHKM-WOPDTQHZSA-N	0	3	309.328	2.229	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)C2CCCCC2)C[C@H]1CC	ZINC000191335906	145056636	/nfs/dbraw/zinc/05/66/36/145056636.db2.gz	XOEHZBBZFAVTOS-MSOLQXFVSA-N	0	3	312.498	2.360	10	0		DEAEHN
CCOC1CC(CCNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)C1	ZINC000191716646	145063571	/nfs/dbraw/zinc/06/35/71/145063571.db2.gz	BKMIGLBZIISAKM-YHNBSYBMSA-N	0	3	311.470	2.316	10	0		DEAEHN
O=C1O[C@H](CN2CC[C@@H](Oc3cccnc3)C2)CC12CCC2	ZINC000192078750	145070894	/nfs/dbraw/zinc/07/08/94/145070894.db2.gz	HPXGJGKAUMHQLG-CABCVRRESA-N	0	3	302.374	2.021	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2ccccc2O1	ZINC000193402093	145085530	/nfs/dbraw/zinc/08/55/30/145085530.db2.gz	YYUNMDBVFVWXRP-HKUYNNGSSA-N	0	3	324.424	2.279	10	0		DEAEHN
Cc1ccc(C)c(OCCN2C[C@H](N3CCOCC3)[C@@H](C)C2)c1	ZINC000246428930	145102872	/nfs/dbraw/zinc/10/28/72/145102872.db2.gz	LCYRHPFHUYGMFI-ROUUACIJSA-N	0	3	318.461	2.335	10	0		DEAEHN
C[C@H](NC(=O)N1CCC[C@H]1CN1CCCCC1)[C@H]1CCCO1	ZINC000246484177	145103842	/nfs/dbraw/zinc/10/38/42/145103842.db2.gz	RUZJGLVQZKBYRY-HRCADAONSA-N	0	3	309.454	2.214	10	0		DEAEHN
CCc1cccc(NC(=O)C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000246497091	145105124	/nfs/dbraw/zinc/10/51/24/145105124.db2.gz	RXJJENMIXUQEPP-CJNGLKHVSA-N	0	3	317.433	2.032	10	0		DEAEHN
CN(C)c1ccc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c(F)c1	ZINC000246669203	145109706	/nfs/dbraw/zinc/10/97/06/145109706.db2.gz	LGMCIPQUFOEUPM-SUMWQHHRSA-N	0	3	319.424	2.448	10	0		DEAEHN
C[C@H](Sc1ccccn1)C(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000246728571	145111822	/nfs/dbraw/zinc/11/18/22/145111822.db2.gz	XHRSJIPTNSYHRS-MELADBBJSA-N	0	3	305.447	2.257	10	0		DEAEHN
C[C@H](C(=O)NCc1ccccc1Cl)N1CCN2CCC[C@H]2C1	ZINC000246730221	145112118	/nfs/dbraw/zinc/11/21/18/145112118.db2.gz	VXBVUWNLERUPGE-HIFRSBDPSA-N	0	3	321.852	2.125	10	0		DEAEHN
C[C@H](NC(=O)CN1CCN2CCC[C@H]2C1)c1ccc(Cl)cc1	ZINC000246751547	145112986	/nfs/dbraw/zinc/11/29/86/145112986.db2.gz	XMEFICWUWBLAFF-BBRMVZONSA-N	0	3	321.852	2.297	10	0		DEAEHN
O=C(C[C@H]1CCOc2ccccc21)N1CCN2CCC[C@H]2C1	ZINC000246776111	145113660	/nfs/dbraw/zinc/11/36/60/145113660.db2.gz	VOYAFBZAROBMOK-CABCVRRESA-N	0	3	300.402	2.249	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cccc(OC)c1OC	ZINC000246907189	145118906	/nfs/dbraw/zinc/11/89/06/145118906.db2.gz	ICCZUPFKQBWUHI-KBPBESRZSA-N	0	3	318.417	2.403	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)[C@H](C)Sc2ccccn2)[C@@H](C)C1	ZINC000247044833	145124635	/nfs/dbraw/zinc/12/46/35/145124635.db2.gz	IDAMVOPVYAMWHF-IHRRRGAJSA-N	0	3	307.463	2.407	10	0		DEAEHN
Cc1cnn([C@@H]2CCCN(C[C@@H](O)COc3ccccc3)C2)c1	ZINC000247039770	145124688	/nfs/dbraw/zinc/12/46/88/145124688.db2.gz	DRCNGAILOVAOHO-IAGOWNOFSA-N	0	3	315.417	2.268	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)CCC(=O)c1cccs1	ZINC000247108865	145126400	/nfs/dbraw/zinc/12/64/00/145126400.db2.gz	IQXBFBZVYKXFFZ-STQMWFEESA-N	0	3	306.431	2.406	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(C(C)(C)C)nn1C	ZINC000247166604	145128444	/nfs/dbraw/zinc/12/84/44/145128444.db2.gz	KORLIDCZRCFTLX-OLZOCXBDSA-N	0	3	304.438	2.026	10	0		DEAEHN
C[C@@H](C(=O)N1CCC(C)CC1)N1CC[C@@]2(O)CCCC[C@@H]2C1	ZINC000248162048	145149343	/nfs/dbraw/zinc/14/93/43/145149343.db2.gz	SHWCIHJTAOYMBF-JZXOWHBKSA-N	0	3	308.466	2.260	10	0		DEAEHN
C[C@@H]1CC[C@H](C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)O1	ZINC000248226884	145150394	/nfs/dbraw/zinc/15/03/94/145150394.db2.gz	PTFGBKQSRPMNKL-HDEZJCGLSA-N	0	3	302.418	2.333	10	0		DEAEHN
COC(=O)c1cccc(OCCN2CCN3CCCC[C@H]3C2)c1	ZINC000248329365	145150838	/nfs/dbraw/zinc/15/08/38/145150838.db2.gz	DCRFFWRHMRBJNK-INIZCTEOSA-N	0	3	318.417	2.022	10	0		DEAEHN
CCn1ncnc1CN1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000248821748	145168650	/nfs/dbraw/zinc/16/86/50/145168650.db2.gz	XGNSKOYIZHEXCD-MRXNPFEDSA-N	0	3	313.449	2.394	10	0		DEAEHN
CCOCCN1CCN(C[C@@H](O)CC2CCCC2)C[C@H]1CC	ZINC000248879959	145171716	/nfs/dbraw/zinc/17/17/16/145171716.db2.gz	GBSGSMQRSVKYNS-MSOLQXFVSA-N	0	3	312.498	2.360	10	0		DEAEHN
COC(=O)c1ccccc1OCCN1CC[C@@H](C)[C@H](OC)C1	ZINC000249576795	145186968	/nfs/dbraw/zinc/18/69/68/145186968.db2.gz	AHFPASWXBHKKFL-CZUORRHYSA-N	0	3	307.390	2.209	10	0		DEAEHN
C[C@H](C(=O)N1CCCCCC1)N1CC[C@@]2(O)CCCC[C@H]2C1	ZINC000252643942	145198857	/nfs/dbraw/zinc/19/88/57/145198857.db2.gz	HWQSJOKEJUOZNK-RYRKJORJSA-N	0	3	308.466	2.405	10	0		DEAEHN
C[C@H](C(=O)N1CCCCCC1)N1CC[C@]2(O)CCCC[C@H]2C1	ZINC000252643944	145199346	/nfs/dbraw/zinc/19/93/46/145199346.db2.gz	HWQSJOKEJUOZNK-SOLBZPMBSA-N	0	3	308.466	2.405	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)Nc2ccc3c(c2F)CCNC3)n1	ZINC000261626612	145211693	/nfs/dbraw/zinc/21/16/93/145211693.db2.gz	AMNLWHHQNXATAC-GFCCVEGCSA-N	0	3	316.380	2.484	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)NCc1cc(F)ccc1F	ZINC000261649237	145213555	/nfs/dbraw/zinc/21/35/55/145213555.db2.gz	FPZRADJOHIRLQE-MRRJBJDNSA-N	0	3	324.371	2.114	10	0		DEAEHN
Cn1nc(C2CCCCC2)cc1NC(=O)[C@@H](N)C1CCOCC1	ZINC000261777056	145225166	/nfs/dbraw/zinc/22/51/66/145225166.db2.gz	FYYJTPYWEDMCLR-INIZCTEOSA-N	0	3	320.437	2.160	10	0		DEAEHN
Cc1ccc(NC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)c(C)c1O	ZINC000261944489	145244671	/nfs/dbraw/zinc/24/46/71/145244671.db2.gz	VGPMDZOMPXEPFP-XLWVJDPXSA-N	0	3	318.417	2.480	10	0		DEAEHN
c1sc(CN[C@@H]2CCC[C@@H]2[C@H]2COCCN2)nc1C1CC1	ZINC000261995500	145250656	/nfs/dbraw/zinc/25/06/56/145250656.db2.gz	TZCUMPKSJBHTDZ-BFHYXJOUSA-N	0	3	307.463	2.267	10	0		DEAEHN
N[C@H](C(=O)N1CCC[C@@H](Cc2ccccc2)C1)C1CCOCC1	ZINC000262003289	145252044	/nfs/dbraw/zinc/25/20/44/145252044.db2.gz	NPUMZBNMUMJHHC-WMZOPIPTSA-N	0	3	316.445	2.222	10	0		DEAEHN
c1cn(-c2ccccc2)c(CN2CCNC[C@@H]2c2cccnc2)n1	ZINC000262012381	145253023	/nfs/dbraw/zinc/25/30/23/145253023.db2.gz	VEUPXMAVGGOMAK-GOSISDBHSA-N	0	3	319.412	2.414	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000262141810	145265438	/nfs/dbraw/zinc/26/54/38/145265438.db2.gz	PJDJAGBYMJQAFX-CORIIIEPSA-N	0	3	309.841	2.408	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)N1CCc2sccc2C1	ZINC000262573125	145294550	/nfs/dbraw/zinc/29/45/50/145294550.db2.gz	XQCOPBZJAOVVRO-MRRJBJDNSA-N	0	3	320.458	2.165	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(C2(c3cccc(Cl)c3)CC2)n1	ZINC000263110278	145325991	/nfs/dbraw/zinc/32/59/91/145325991.db2.gz	AFEXXSYOLFQQCK-ZDUSSCGKSA-N	0	3	318.808	2.379	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2C[C@H]2c2ccc(F)c(F)c2)n1	ZINC000263223071	145338058	/nfs/dbraw/zinc/33/80/58/145338058.db2.gz	MGHFAIICEMJNQK-COPLHBTASA-N	0	3	320.343	2.195	10	0		DEAEHN
Cc1nc(CC2CC2)oc1C(=O)N1CC[C@@]2(CCN(C)C2)C1	ZINC000346289834	146055008	/nfs/dbraw/zinc/05/50/08/146055008.db2.gz	HAHRRKPEJYDYQH-QGZVFWFLSA-N	0	3	303.406	2.103	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@H](C)N2CCC(C)CC2)C1	ZINC000358582193	147160146	/nfs/dbraw/zinc/16/01/46/147160146.db2.gz	SOPRURKIHKGKIZ-HNNXBMFYSA-N	0	3	311.470	2.175	10	0		DEAEHN
O=C(Cc1coc2cc(F)ccc12)NCCNc1ccncc1	ZINC000359086129	147259929	/nfs/dbraw/zinc/25/99/29/147259929.db2.gz	VDRQORCQZRDXOY-UHFFFAOYSA-N	0	3	313.332	2.160	10	0		DEAEHN
CC(C)(C)OC(=O)CCN1CC[C@H](c2nc(C3CC3)no2)C1	ZINC000375464419	148375993	/nfs/dbraw/zinc/37/59/93/148375993.db2.gz	CUHUSMSSUOQHOX-LBPRGKRZSA-N	0	3	307.394	2.468	10	0		DEAEHN
Cc1cc(NC(=O)NCCN2CCCC[C@@H]2C)ccc1C(N)=O	ZINC000111759930	401723287	/nfs/dbraw/zinc/72/32/87/401723287.db2.gz	MZEWJFYKXLZCBS-ZDUSSCGKSA-N	0	3	318.421	2.090	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@H](C)c1ccccc1C	ZINC000111789308	401723950	/nfs/dbraw/zinc/72/39/50/401723950.db2.gz	CLKCJFVWCABAAE-HZPDHXFCSA-N	0	3	319.449	2.466	10	0		DEAEHN
O=C(c1cnn2c1CCCC2)N1CCC[C@H]1CN1CCCCC1	ZINC000127257140	401726372	/nfs/dbraw/zinc/72/63/72/401726372.db2.gz	KIYUJIIRMUXPNB-HNNXBMFYSA-N	0	3	316.449	2.310	10	0		DEAEHN
CN1CCC(C(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)CC1	ZINC000074187691	401732656	/nfs/dbraw/zinc/73/26/56/401732656.db2.gz	AAPDAVKHJDBDEU-MSOLQXFVSA-N	0	3	316.445	2.443	10	0		DEAEHN
CCc1cc(C)c(C(=O)N(CCN(C)C)C[C@@H]2CCCO2)o1	ZINC000127396167	401732829	/nfs/dbraw/zinc/73/28/29/401732829.db2.gz	ZIKNEEPUAVUHAG-HNNXBMFYSA-N	0	3	308.422	2.333	10	0		DEAEHN
CCOCCN1CCN(Cc2ccc3c(c2)CCO3)C[C@@H]1C	ZINC000111228074	401702242	/nfs/dbraw/zinc/70/22/42/401702242.db2.gz	XPVHPTPXXIJKKB-HNNXBMFYSA-N	0	3	304.434	2.164	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCO[C@H](c2ccco2)C1	ZINC000126731495	401706129	/nfs/dbraw/zinc/70/61/29/401706129.db2.gz	KWOCMUOAFTUUGF-ZBFHGGJFSA-N	0	3	323.437	2.339	10	0		DEAEHN
CN(CCn1cccn1)C[C@H](O)COCc1ccc(Cl)cc1	ZINC000111278952	401707332	/nfs/dbraw/zinc/70/73/32/401707332.db2.gz	MMWVGVSLBHJDAU-INIZCTEOSA-N	0	3	323.824	2.046	10	0		DEAEHN
C[C@@H](CNC(=O)NC1CCN(C)CC1)c1ccc(F)cc1F	ZINC000073485285	401718208	/nfs/dbraw/zinc/71/82/08/401718208.db2.gz	FJTAJUODBHEVKC-NSHDSACASA-N	0	3	311.376	2.462	10	0		DEAEHN
CC(C)CCC(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000114414202	401798537	/nfs/dbraw/zinc/79/85/37/401798537.db2.gz	ZYQQWOHRRASNPA-UHFFFAOYSA-N	0	3	318.465	2.228	10	0		DEAEHN
CN(C)[C@@H](CNC(=O)N(C)C[C@H]1CCCO1)c1ccccc1	ZINC000076996472	401802092	/nfs/dbraw/zinc/80/20/92/401802092.db2.gz	AFZXXGJQKORIDC-CVEARBPZSA-N	0	3	305.422	2.110	10	0		DEAEHN
COC(=O)Nc1ccccc1C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000127815171	401750802	/nfs/dbraw/zinc/75/08/02/401750802.db2.gz	GSQRMDPLJHTKKF-OLZOCXBDSA-N	0	3	319.405	2.420	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(-c2cccnc2)on1	ZINC000113226095	401770842	/nfs/dbraw/zinc/77/08/42/401770842.db2.gz	QVNQTKMGCLSMDY-GXTWGEPZSA-N	0	3	312.373	2.045	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cnn(Cc2ccccc2)c1	ZINC000113226565	401770850	/nfs/dbraw/zinc/77/08/50/401770850.db2.gz	KGTXFJUMULAJRC-CRAIPNDOSA-N	0	3	324.428	2.240	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)CCC(=O)c1ccccc1	ZINC000113225179	401770901	/nfs/dbraw/zinc/77/09/01/401770901.db2.gz	FVNOZAMDVZOSLW-GDBMZVCRSA-N	0	3	300.402	2.345	10	0		DEAEHN
CC[S@@](=O)c1ccccc1C(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000113225122	401770930	/nfs/dbraw/zinc/77/09/30/401770930.db2.gz	IFBOKQXTFLURDG-OKHZJLECSA-N	0	3	320.458	2.123	10	0		DEAEHN
COC(=O)Nc1ccccc1C(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000113231348	401771493	/nfs/dbraw/zinc/77/14/93/401771493.db2.gz	AJWXBTWPTSTWNQ-QWHCGFSZSA-N	0	3	317.389	2.174	10	0		DEAEHN
COc1ccc(CN2CC[C@H](c3cnn(C)c3)C2)c(OC)c1	ZINC000128351323	401772861	/nfs/dbraw/zinc/77/28/61/401772861.db2.gz	ICUCYDRAGDEWFU-ZDUSSCGKSA-N	0	3	301.390	2.427	10	0		DEAEHN
Cc1ccn2ncc(C(=O)N(CCN(C)C)c3ccccc3)c2n1	ZINC000114252804	401795258	/nfs/dbraw/zinc/79/52/58/401795258.db2.gz	IADTZQPLECNKBR-UHFFFAOYSA-N	0	3	323.400	2.246	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)C(C)(C)c1cccs1	ZINC000115370225	401825938	/nfs/dbraw/zinc/82/59/38/401825938.db2.gz	HTMCCDCOKJGKLX-CYBMUJFWSA-N	0	3	310.463	2.253	10	0		DEAEHN
O=C(CN1CCN2CCC[C@@H]2C1)Nc1nc2ccccc2s1	ZINC000023249650	401827810	/nfs/dbraw/zinc/82/78/10/401827810.db2.gz	IRKBTBYTNANLHG-GFCCVEGCSA-N	0	3	316.430	2.015	10	0		DEAEHN
C[C@@H](C(=O)N1CC[C@H](c2cnn(C)c2)C1)N1CCCCCC1	ZINC000116116534	401842446	/nfs/dbraw/zinc/84/24/46/401842446.db2.gz	UWCHPLJAAYBREW-GJZGRUSLSA-N	0	3	304.438	2.001	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@H](c2cnn(C)c2)C1)N1CCCCCC1	ZINC000116116536	401842471	/nfs/dbraw/zinc/84/24/71/401842471.db2.gz	UWCHPLJAAYBREW-CABCVRRESA-N	0	3	304.438	2.001	10	0		DEAEHN
COc1ccccc1OCCN1CC[C@@H](c2cnn(C)c2)C1	ZINC000116313641	401849614	/nfs/dbraw/zinc/84/96/14/401849614.db2.gz	SMQBQZBYBHHGBC-CQSZACIVSA-N	0	3	301.390	2.297	10	0		DEAEHN
CN(CCN1CCC(Nc2cccnn2)CC1)c1ccccc1	ZINC000131442941	401850693	/nfs/dbraw/zinc/85/06/93/401850693.db2.gz	DAIZTACYVNYKCV-UHFFFAOYSA-N	0	3	311.433	2.489	10	0		DEAEHN
Cc1ccc(N2CCCC2)c(C(=O)NC[C@@H]2CCCN2C)c1	ZINC000116763090	401858306	/nfs/dbraw/zinc/85/83/06/401858306.db2.gz	FDJGDQOFJDWAIG-HNNXBMFYSA-N	0	3	301.434	2.419	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)CCc2ccc(Cl)cc2)CCO1	ZINC000116793857	401858981	/nfs/dbraw/zinc/85/89/81/401858981.db2.gz	YTGAXJQGKNWVCN-HNNXBMFYSA-N	0	3	310.825	2.062	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2cccc(C(F)(F)F)c2)CCO1	ZINC000116786525	401859166	/nfs/dbraw/zinc/85/91/66/401859166.db2.gz	LYSUFMOPAGDESO-ZDUSSCGKSA-N	0	3	316.323	2.108	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)C2(c3cccc(F)c3)CCC2)CCO1	ZINC000116787857	401859309	/nfs/dbraw/zinc/85/93/09/401859309.db2.gz	HKLBRYQFIIAGHL-MRXNPFEDSA-N	0	3	320.408	2.036	10	0		DEAEHN
Cc1cc(F)cc2[nH]c(C(=O)N3CCO[C@@H](CN(C)C)C3)cc21	ZINC000116797040	401859937	/nfs/dbraw/zinc/85/99/37/401859937.db2.gz	AIGQQMZNCBDBRN-ZDUSSCGKSA-N	0	3	319.380	2.018	10	0		DEAEHN
C[C@@H](CCNCc1ccc(Br)cn1)[S@@](C)=O	ZINC000132542417	401869103	/nfs/dbraw/zinc/86/91/03/401869103.db2.gz	KPOTUHMHVDEVHJ-FVMDXXJSSA-N	0	3	305.241	2.091	10	0		DEAEHN
C[C@@H](NCc1cc2c(c(Br)c1)OCO2)[C@H](C)CO	ZINC000077423438	401815134	/nfs/dbraw/zinc/81/51/34/401815134.db2.gz	BYNJJJNKVLQFRW-RKDXNWHRSA-N	0	3	316.195	2.284	10	0		DEAEHN
CCCN(CC)CCNC(=O)C(=O)Nc1ccc(CC)c(F)c1	ZINC000119122746	401927433	/nfs/dbraw/zinc/92/74/33/401927433.db2.gz	NFJSXGGGXWYZBS-UHFFFAOYSA-N	0	3	323.412	2.175	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1cccnc1OCC(F)F)N(C)C	ZINC000135245569	401931926	/nfs/dbraw/zinc/93/19/26/401931926.db2.gz	NZRWFEMXZYLNSG-LBPRGKRZSA-N	0	3	315.364	2.072	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)NCCN1CCCC[C@H]1C	ZINC000079531303	401875150	/nfs/dbraw/zinc/87/51/50/401875150.db2.gz	CZBNHFYNIVKNJA-CQSZACIVSA-N	0	3	305.422	2.473	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1cccc(Cl)c1	ZINC000032072949	401876025	/nfs/dbraw/zinc/87/60/25/401876025.db2.gz	HTPQSSWRHVDMAF-LLVKDONJSA-N	0	3	304.843	2.349	10	0		DEAEHN
CCOC(=O)CCCCN1CCCN(c2ccc(C)nn2)CC1	ZINC000132946003	401876906	/nfs/dbraw/zinc/87/69/06/401876906.db2.gz	XVIGCEXRPMAQED-UHFFFAOYSA-N	0	3	320.437	2.031	10	0		DEAEHN
C[C@H](N[C@@H]1CCC(=O)N(C)C1)c1ccc2c(c1)OCCCO2	ZINC000132989905	401877547	/nfs/dbraw/zinc/87/75/47/401877547.db2.gz	YRKZEUYXURBFRN-GXTWGEPZSA-N	0	3	304.390	2.119	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)NCc3ccncc3)cc2)CC1	ZINC000118757227	401907008	/nfs/dbraw/zinc/90/70/08/401907008.db2.gz	JWORJIVHSGLLMC-UHFFFAOYSA-N	0	3	324.428	2.154	10	0		DEAEHN
CCn1c(C)nnc1CN1CC[C@H]2[C@H](CCCN2C2CC2)C1	ZINC000134916004	401919315	/nfs/dbraw/zinc/91/93/15/401919315.db2.gz	DXNMMQQJNVZPBV-ZBFHGGJFSA-N	0	3	303.454	2.055	10	0		DEAEHN
CC(C)CN1CCC[C@@H]1CNC(=O)COc1ccccc1C=O	ZINC000119457015	401951354	/nfs/dbraw/zinc/95/13/54/401951354.db2.gz	SYSJUQAHDTVPIG-MRXNPFEDSA-N	0	3	318.417	2.115	10	0		DEAEHN
CC[C@H](CO)NC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000119583639	401959938	/nfs/dbraw/zinc/95/99/38/401959938.db2.gz	VNTCDWUGFMSDQQ-SJLPKXTDSA-N	0	3	319.449	2.111	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCN(C3CCCCC3)CC2)C1	ZINC000137209122	401980916	/nfs/dbraw/zinc/98/09/16/401980916.db2.gz	ZVYZJGCEZDIIIH-INIZCTEOSA-N	0	3	322.497	2.131	10	0		DEAEHN
CCO[C@H](C)c1noc(CN2CCC(c3ccn[nH]3)CC2)n1	ZINC000120607617	401995411	/nfs/dbraw/zinc/99/54/11/401995411.db2.gz	UQZBDQDUUFHOJJ-LLVKDONJSA-N	0	3	305.382	2.270	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCCc2ccc(Cl)nc2)CCN1C	ZINC000119305636	401939988	/nfs/dbraw/zinc/93/99/88/401939988.db2.gz	XJNRHRJCCBAYGO-JSGCOSHPSA-N	0	3	324.856	2.402	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cccc(Oc3cnccn3)c2)C1	ZINC000135449368	401940307	/nfs/dbraw/zinc/94/03/07/401940307.db2.gz	WCZSWYYBKHSBOS-AWEZNQCLSA-N	0	3	312.373	2.045	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)Nc2nnc(C(F)F)s2)[C@@H](C)C1	ZINC000121245848	402023163	/nfs/dbraw/zinc/02/31/63/402023163.db2.gz	IMHBDZYACUAPNA-YUMQZZPRSA-N	0	3	319.381	2.326	10	0		DEAEHN
C[C@@H](NC[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cnccn1	ZINC000095089256	402025328	/nfs/dbraw/zinc/02/53/28/402025328.db2.gz	QPFLGWDLIKXQCY-CHWSQXEVSA-N	0	3	306.410	2.384	10	0		DEAEHN
CN(C)C(=O)[C@H]1CCCN1CCCOCCc1ccccc1	ZINC000051591380	402034996	/nfs/dbraw/zinc/03/49/96/402034996.db2.gz	DAHYLRDFEVLZGQ-QGZVFWFLSA-N	0	3	304.434	2.188	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)N1CC[C@@]2(O)CCCC[C@@H]2C1	ZINC000151478971	402038599	/nfs/dbraw/zinc/03/85/99/402038599.db2.gz	JRXCZZBWMUGOBP-NUJGCVRESA-N	0	3	323.481	2.197	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC[C@@H]2c2ccncc2)C1	ZINC000052592765	402044387	/nfs/dbraw/zinc/04/43/87/402044387.db2.gz	XVOPTNGZAKRZRH-JKSUJKDBSA-N	0	3	302.422	2.412	10	0		DEAEHN
COC(=O)c1cccc(NC(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000150860084	402000967	/nfs/dbraw/zinc/00/09/67/402000967.db2.gz	PEHPKIVQSAXLIX-DOMZBBRYSA-N	0	3	319.405	2.323	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)CSCc1ccncc1	ZINC000120955265	402007932	/nfs/dbraw/zinc/00/79/32/402007932.db2.gz	JNZYAZHJSAMFNY-HNNXBMFYSA-N	0	3	309.479	2.407	10	0		DEAEHN
C[C@@H]1CC[C@H](C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)O1	ZINC000153005804	402121757	/nfs/dbraw/zinc/12/17/57/402121757.db2.gz	QILBKAMRGOCVNV-IUODEOHRSA-N	0	3	319.405	2.061	10	0		DEAEHN
Cc1nn(CC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c(C)c1Cl	ZINC000123279808	402119236	/nfs/dbraw/zinc/11/92/36/402119236.db2.gz	OWXXZVMGIKRTNI-MFKMUULPSA-N	0	3	312.845	2.094	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCCN(C)c1ccccc1	ZINC000097413455	402124565	/nfs/dbraw/zinc/12/45/65/402124565.db2.gz	OUVRRXDVYHIBEP-MRXNPFEDSA-N	0	3	320.481	2.398	10	0		DEAEHN
COc1cccc(Cl)c1CC(=O)N1CCC[C@@H](N(C)C)C1	ZINC000153135553	402128913	/nfs/dbraw/zinc/12/89/13/402128913.db2.gz	NQVPOVLCUQUORB-GFCCVEGCSA-N	0	3	310.825	2.444	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cc3c(s2)CCOC3)CCN1C	ZINC000123770757	402145231	/nfs/dbraw/zinc/14/52/31/402145231.db2.gz	YEULMPPJNDHROU-DGCLKSJQSA-N	0	3	308.447	2.376	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)Cc1ccccc1O	ZINC000101649938	402153324	/nfs/dbraw/zinc/15/33/24/402153324.db2.gz	KEKGYWGROZHOOP-KRWDZBQOSA-N	0	3	312.413	2.224	10	0		DEAEHN
COc1cccc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1OC	ZINC000124819618	402198593	/nfs/dbraw/zinc/19/85/93/402198593.db2.gz	ACKVZFUPFCFRQV-STQMWFEESA-N	0	3	306.406	2.259	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2ccc3c(c2)OCCO3)CCN1C	ZINC000124826488	402199252	/nfs/dbraw/zinc/19/92/52/402199252.db2.gz	KDBFSSYKXQFSKA-OCCSQVGLSA-N	0	3	304.390	2.013	10	0		DEAEHN
C[C@@H]1NC(=S)N(C[C@H]2CCCCN2Cc2ccccc2)C1=O	ZINC000067507292	402161002	/nfs/dbraw/zinc/16/10/02/402161002.db2.gz	MFFDYRUZQZYPEZ-DZGCQCFKSA-N	0	3	317.458	2.146	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1cccc(C(=O)N(C)C)c1	ZINC000103074737	402177708	/nfs/dbraw/zinc/17/77/08/402177708.db2.gz	ZNFNWQMWTZUHGX-MRXNPFEDSA-N	0	3	319.449	2.095	10	0		DEAEHN
Cc1nccn1CCCN(C)[C@@H]1CCN(c2ccccc2)C1=O	ZINC000125161406	402216809	/nfs/dbraw/zinc/21/68/09/402216809.db2.gz	VOVQNGTTWIAUEQ-QGZVFWFLSA-N	0	3	312.417	2.319	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1Cc1nc(N)c2ccccc2n1	ZINC000154571047	402218949	/nfs/dbraw/zinc/21/89/49/402218949.db2.gz	OMDWDUAUYDDDTE-AWEZNQCLSA-N	0	3	322.416	2.382	10	0		DEAEHN
O[C@@H](COc1ccccc1Cl)CN1CCN2CCCC[C@@H]2C1	ZINC000125281222	402223473	/nfs/dbraw/zinc/22/34/73/402223473.db2.gz	KDZSNJVMUTXLBD-HUUCEWRRSA-N	0	3	324.852	2.250	10	0		DEAEHN
CC[C@@H](C(=O)N[C@@H](C)c1cccc(-n2ccnc2)c1)N(C)C	ZINC000125366453	402227838	/nfs/dbraw/zinc/22/78/38/402227838.db2.gz	VOQDMVIAMOGQHU-BBRMVZONSA-N	0	3	300.406	2.390	10	0		DEAEHN
CC(C)[C@@H](O)CNC(=O)NCC(C)(C)N[C@@H](C)c1ccccc1	ZINC000155075461	402244263	/nfs/dbraw/zinc/24/42/63/402244263.db2.gz	XECOWYNVTJSOQY-HOCLYGCPSA-N	0	3	321.465	2.432	10	0		DEAEHN
CCn1cnnc1C1CCN(CCCOCC(F)(F)F)CC1	ZINC000105928334	402211130	/nfs/dbraw/zinc/21/11/30/402211130.db2.gz	VRMDEJVMMRXPTM-UHFFFAOYSA-N	0	3	320.359	2.446	10	0		DEAEHN
CC(C)CCOCCN1CCC(N(C)c2cccnn2)CC1	ZINC000105910304	402211397	/nfs/dbraw/zinc/21/13/97/402211397.db2.gz	GNVFAXYTTBGUKB-UHFFFAOYSA-N	0	3	306.454	2.440	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ncccc1OC(C)C	ZINC000176075431	402276194	/nfs/dbraw/zinc/27/61/94/402276194.db2.gz	LODHZUWBOTVPGU-CQSZACIVSA-N	0	3	305.422	2.425	10	0		DEAEHN
CCc1ccccc1NC(=O)NC[C@H]1CCCN1CCOC	ZINC000110086508	402281348	/nfs/dbraw/zinc/28/13/48/402281348.db2.gz	OMOZFDOHEOTBFI-OAHLLOKOSA-N	0	3	305.422	2.481	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(F)cc1C	ZINC000110086665	402281427	/nfs/dbraw/zinc/28/14/27/402281427.db2.gz	QBYJNCBNZGYRQC-CQSZACIVSA-N	0	3	309.385	2.366	10	0		DEAEHN
O=C(N[C@@H]1CCOC2(CCCC2)C1)N1CC[C@@H](N2CC=CC2)C1	ZINC000157251565	402293587	/nfs/dbraw/zinc/29/35/87/402293587.db2.gz	LBVFYFYIPUCSAI-HZPDHXFCSA-N	0	3	319.449	2.134	10	0		DEAEHN
Cn1cc(CCC(=O)N2CCN3CCC[C@H]3C2)c2ccccc21	ZINC000176298954	402297821	/nfs/dbraw/zinc/29/78/21/402297821.db2.gz	ALDTUPILFPILJF-INIZCTEOSA-N	0	3	311.429	2.418	10	0		DEAEHN
Cc1ccn2c(c1)nnc2NC(=O)C1Oc2ccccc2O[C@H]1C	ZINC000176307546	402298643	/nfs/dbraw/zinc/29/86/43/402298643.db2.gz	ZLQNNSRFTLKGER-NHYWBVRUSA-N	0	3	324.340	2.205	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCc2ccc(Cl)cn2)C1	ZINC000222205971	402306295	/nfs/dbraw/zinc/30/62/95/402306295.db2.gz	ORURRGCYUBTQKT-SWLSCSKDSA-N	0	3	322.840	2.361	10	0		DEAEHN
CN(C)CCN(Cc1cccs1)C(=O)NCc1cscn1	ZINC000176468163	402312761	/nfs/dbraw/zinc/31/27/61/402312761.db2.gz	CDXPCAOVRSBNDZ-UHFFFAOYSA-N	0	3	324.475	2.478	10	0		DEAEHN
Cc1ccsc1[C@H](Cc1ccccc1)NCC(=O)NC(N)=O	ZINC000184960419	402312912	/nfs/dbraw/zinc/31/29/12/402312912.db2.gz	MZLSMAPXMOAYKO-ZDUSSCGKSA-N	0	3	317.414	2.125	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1c(C)cccc1C	ZINC000176905490	402348851	/nfs/dbraw/zinc/34/88/51/402348851.db2.gz	KLGLCYXETWLOBC-OAHLLOKOSA-N	0	3	317.433	2.185	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CSC[C@@H]1CCCCO1	ZINC000177033616	402361636	/nfs/dbraw/zinc/36/16/36/402361636.db2.gz	DKPBRKHZHTXXSO-GJZGRUSLSA-N	0	3	314.495	2.231	10	0		DEAEHN
C[C@@H]1CN(C[C@H](O)c2cccc(Cl)c2)C[C@@H]1N1CCOCC1	ZINC000177214320	402382382	/nfs/dbraw/zinc/38/23/82/402382382.db2.gz	WBWZPDRFBOHUJV-COXVUDFISA-N	0	3	324.852	2.026	10	0		DEAEHN
CC(C)[C@@H](CO)NCc1nc2cc(Br)ccc2[nH]1	ZINC000161712573	402397175	/nfs/dbraw/zinc/39/71/75/402397175.db2.gz	BAHMHAIQRVEBDC-GFCCVEGCSA-N	0	3	312.211	2.432	10	0		DEAEHN
CC(C)[C@@H](CO)NCc1nc2ccc(Br)cc2[nH]1	ZINC000161712573	402397177	/nfs/dbraw/zinc/39/71/77/402397177.db2.gz	BAHMHAIQRVEBDC-GFCCVEGCSA-N	0	3	312.211	2.432	10	0		DEAEHN
C[C@H](NC(=O)C1(N)CCCCC1)c1cn(-c2ccccc2)nn1	ZINC000237553662	402412925	/nfs/dbraw/zinc/41/29/25/402412925.db2.gz	KXRQOSXDGOKNAE-ZDUSSCGKSA-N	0	3	313.405	2.106	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@H](CO)c2ccccc2)C12CCOCC2	ZINC000186341180	402422716	/nfs/dbraw/zinc/42/27/16/402422716.db2.gz	JNLJITDDJNDKLH-IXDOHACOSA-N	0	3	305.418	2.284	10	0		DEAEHN
NC1(C(=O)N[C@@H]2CCN(c3ncccc3Cl)C2)CCCCC1	ZINC000237945185	402427462	/nfs/dbraw/zinc/42/74/62/402427462.db2.gz	PSUDZZFKKNUHPP-GFCCVEGCSA-N	0	3	322.840	2.092	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN([C@@H]2CCCN(C(C)C)C2=O)C1	ZINC000177713277	402429539	/nfs/dbraw/zinc/42/95/39/402429539.db2.gz	NLBMRGDFIXLMAD-HZPDHXFCSA-N	0	3	318.465	2.482	10	0		DEAEHN
O=C(C[C@H]1CSCCN1)Nc1nc(-c2ccccn2)cs1	ZINC000238098342	402437625	/nfs/dbraw/zinc/43/76/25/402437625.db2.gz	NPZXQHUIFZNCKI-JTQLQIEISA-N	0	3	320.443	2.239	10	0		DEAEHN
CCS(=O)(=O)C[C@H](C)N[C@@H](C)c1ccccc1-n1cccn1	ZINC000177332437	402391883	/nfs/dbraw/zinc/39/18/83/402391883.db2.gz	CNFDDSJXDLRMEA-KBPBESRZSA-N	0	3	321.446	2.346	10	0		DEAEHN
CCOc1ncccc1CNC(=O)N(C)C[C@H]1CCCN1CC	ZINC000177348722	402393871	/nfs/dbraw/zinc/39/38/71/402393871.db2.gz	ILAJYKKSJVWJOV-OAHLLOKOSA-N	0	3	320.437	2.106	10	0		DEAEHN
COC(=O)[C@H](N[C@H]1CN(C(C)C)C[C@@H]1C)c1ccccc1F	ZINC000246166631	402514654	/nfs/dbraw/zinc/51/46/54/402514654.db2.gz	FBPHUIJPTLRWSV-VBNZEHGJSA-N	0	3	308.397	2.358	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)NCc1ccccc1C	ZINC000245463885	402463197	/nfs/dbraw/zinc/46/31/97/402463197.db2.gz	HLTJSZOGULQDJK-SJLPKXTDSA-N	0	3	317.477	2.416	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)N(C)Cc1ccccc1	ZINC000245477399	402464688	/nfs/dbraw/zinc/46/46/88/402464688.db2.gz	UKQVFLJQFOPPRV-SJLPKXTDSA-N	0	3	317.477	2.450	10	0		DEAEHN
O=C([C@H]1CCCn2ccnc21)N1CCN(C2CCCCC2)CC1	ZINC000178195418	402470154	/nfs/dbraw/zinc/47/01/54/402470154.db2.gz	BQLZJWKGZAPXTG-INIZCTEOSA-N	0	3	316.449	2.237	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2	ZINC000245564221	402471709	/nfs/dbraw/zinc/47/17/09/402471709.db2.gz	WEGOXVASBRBSHQ-FPCVCCKLSA-N	0	3	321.465	2.118	10	0		DEAEHN
CN1CC[C@H](NC(=O)N2CCOC(C)(C)C2)[C@@H]1c1ccccc1	ZINC000245672396	402477552	/nfs/dbraw/zinc/47/75/52/402477552.db2.gz	SJPDDIOABZMFNI-HOTGVXAUSA-N	0	3	317.433	2.252	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CC(=O)N1CCCC[C@@H]1C	ZINC000178314654	402484177	/nfs/dbraw/zinc/48/41/77/402484177.db2.gz	BLOGNWTZFMIPJV-GOEBONIOSA-N	0	3	304.438	2.057	10	0		DEAEHN
COC[C@H](C)n1ccc(NC(=O)NCCN2CCCC[C@H]2C)n1	ZINC000187176626	402486196	/nfs/dbraw/zinc/48/61/96/402486196.db2.gz	POWMZZGQLCBKTH-KGLIPLIRSA-N	0	3	323.441	2.086	10	0		DEAEHN
C[C@H](C(=O)N1CCCC[C@H]1c1nc[nH]n1)[C@@H](N)c1ccccc1	ZINC000245776960	402487003	/nfs/dbraw/zinc/48/70/03/402487003.db2.gz	YFYSXOINBMRISR-AEGPPILISA-N	0	3	313.405	2.194	10	0		DEAEHN
CCCn1nc(C)c(CN2CCN(C[C@@H](C)O)[C@@H](CC)C2)c1C	ZINC000245781248	402487910	/nfs/dbraw/zinc/48/79/10/402487910.db2.gz	UHHJMFYPAGPBQK-PBHICJAKSA-N	0	3	322.497	2.187	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](C)c1ccccc1)N1CCC[C@@H](N(C)C)C1	ZINC000245793829	402488296	/nfs/dbraw/zinc/48/82/96/402488296.db2.gz	DPTSQMFSZHHHBW-ZMSDIMECSA-N	0	3	303.450	2.278	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc(COC)cc2)CCN1C[C@H](C)O	ZINC000245801714	402489059	/nfs/dbraw/zinc/48/90/59/402489059.db2.gz	XWMJDVBCBAHSRB-MAUKXSAKSA-N	0	3	306.450	2.110	10	0		DEAEHN
CCC(CC)[C@@H]1C[C@@H](NC(=O)N2CC[C@@H](N(C)C)C2)CCO1	ZINC000245901366	402495515	/nfs/dbraw/zinc/49/55/15/402495515.db2.gz	DQZBXTCPJBKQEW-XHSDSOJGSA-N	0	3	311.470	2.316	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc(OC(F)F)c(F)c1	ZINC000168472257	402496539	/nfs/dbraw/zinc/49/65/39/402496539.db2.gz	RJRPOMOWASRLQN-AWEZNQCLSA-N	0	3	307.312	2.304	10	0		DEAEHN
CCOC(=O)[C@H](Cc1ccccc1)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000187406315	402499100	/nfs/dbraw/zinc/49/91/00/402499100.db2.gz	PSGIMLDIQOZFRR-RYQLBKOJSA-N	0	3	318.461	2.479	10	0		DEAEHN
C[C@H]1CC[C@](CO)(N(C)CC(=O)NCCC2=CCCCC2)C1	ZINC000187968078	402514103	/nfs/dbraw/zinc/51/41/03/402514103.db2.gz	UXQKZTYOLMOLQO-YJBOKZPZSA-N	0	3	308.466	2.476	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NC[C@@H](C)N2CCC(C)CC2)CC[C@@H]1C	ZINC000187621681	402506680	/nfs/dbraw/zinc/50/66/80/402506680.db2.gz	ZUXHJLAULCCRDL-ARFHVFGLSA-N	0	3	311.470	2.173	10	0		DEAEHN
Cc1cc2ncn(C[C@H](O)CN3CCS[C@@H](C)C3)c2cc1C	ZINC000246086360	402508369	/nfs/dbraw/zinc/50/83/69/402508369.db2.gz	FHLHDAMWQIXCJK-LSDHHAIUSA-N	0	3	319.474	2.451	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)N1CC[C@H]2OCCC[C@H]2C1	ZINC000246710181	402541685	/nfs/dbraw/zinc/54/16/85/402541685.db2.gz	NSDSHQXQJSRTBK-OWCLPIDISA-N	0	3	309.454	2.071	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCc2nccs2)[C@@H]1c1ccccc1	ZINC000179128879	402574782	/nfs/dbraw/zinc/57/47/82/402574782.db2.gz	UQHKUCRQWVHTPA-HIFRSBDPSA-N	0	3	316.430	2.388	10	0		DEAEHN
CCOc1ccccc1OCCN1C[C@@H](C(N)=O)CC[C@H]1C	ZINC000247708282	402575155	/nfs/dbraw/zinc/57/51/55/402575155.db2.gz	ZMQKLQVRFSNWED-KGLIPLIRSA-N	0	3	306.406	2.050	10	0		DEAEHN
COc1ccc(OC)c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000247227162	402560892	/nfs/dbraw/zinc/56/08/92/402560892.db2.gz	MNLQKGUHHIFNOB-STQMWFEESA-N	0	3	304.390	2.013	10	0		DEAEHN
CC(=O)Nc1ccc(CN2CCS[C@@H]3COCC[C@H]32)cc1	ZINC000247303308	402563282	/nfs/dbraw/zinc/56/32/82/402563282.db2.gz	ZTVZDINJEXGOBA-HZPDHXFCSA-N	0	3	306.431	2.351	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@H]2Oc3ccccc3[C@@H]2C)C1	ZINC000247366502	402565117	/nfs/dbraw/zinc/56/51/17/402565117.db2.gz	OWIRHZDBLYOESL-RMRKRWHISA-N	0	3	302.418	2.396	10	0		DEAEHN
O=C1[C@@H](N2CCN3CCC[C@H]3C2)CCN1c1ccccc1Cl	ZINC000247484537	402568664	/nfs/dbraw/zinc/56/86/64/402568664.db2.gz	GBTWDLDCAIEKIH-BBRMVZONSA-N	0	3	319.836	2.225	10	0		DEAEHN
Cc1c(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cnn1-c1ccccc1	ZINC000247482289	402568823	/nfs/dbraw/zinc/56/88/23/402568823.db2.gz	SUECECRERBXQJL-PBHICJAKSA-N	0	3	324.428	2.489	10	0		DEAEHN
Cc1ncc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c(C(C)C)n1	ZINC000247565102	402572487	/nfs/dbraw/zinc/57/24/87/402572487.db2.gz	ZXEJPKATRHPJLS-JSGCOSHPSA-N	0	3	304.438	2.463	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCc2ccc(OC(F)F)cc2)C1	ZINC000170826385	402529760	/nfs/dbraw/zinc/52/97/60/402529760.db2.gz	NTGWMGQYPXSUQX-LBPRGKRZSA-N	0	3	313.348	2.134	10	0		DEAEHN
CCN(CCCNC(=O)N1CC[C@H](N(C)C)C1)c1ccccc1	ZINC000170826874	402529786	/nfs/dbraw/zinc/52/97/86/402529786.db2.gz	MIVVACKLZGCYHZ-KRWDZBQOSA-N	0	3	318.465	2.249	10	0		DEAEHN
Cc1csc(CCCCNC(=O)N2CC[C@@H](N(C)C)C2)n1	ZINC000170836885	402531464	/nfs/dbraw/zinc/53/14/64/402531464.db2.gz	JVKPFQFMRSDVEE-CYBMUJFWSA-N	0	3	310.467	2.120	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)CCc2ncc(-c3ccccc3)o2)C1	ZINC000170856724	402533658	/nfs/dbraw/zinc/53/36/58/402533658.db2.gz	KSNYGXCCXYVWCQ-OAHLLOKOSA-N	0	3	313.401	2.437	10	0		DEAEHN
CCOc1ccc(C(=O)N2CC[C@@H](N(C)C)C2)cc1OCC	ZINC000170863309	402534394	/nfs/dbraw/zinc/53/43/94/402534394.db2.gz	DFVLWQTVTYSVGB-CQSZACIVSA-N	0	3	306.406	2.260	10	0		DEAEHN
Cc1ccc(-c2nc(C(=O)N3CC[C@@H](N(C)C)C3)cs2)o1	ZINC000170866391	402534959	/nfs/dbraw/zinc/53/49/59/402534959.db2.gz	MINPCFRHPCSNAE-LLVKDONJSA-N	0	3	305.403	2.488	10	0		DEAEHN
CCOC(=O)c1ccc(NC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170874832	402536202	/nfs/dbraw/zinc/53/62/02/402536202.db2.gz	RBNRZSHVDPXBSU-CQSZACIVSA-N	0	3	305.378	2.031	10	0		DEAEHN
C[C@H](CNC(=O)N1CC[C@H]2OCCC[C@H]2C1)N1CCC[C@@H](C)C1	ZINC000246695432	402540898	/nfs/dbraw/zinc/54/08/98/402540898.db2.gz	NBDQDRDSMDRZEY-WCXIOVBPSA-N	0	3	323.481	2.317	10	0		DEAEHN
Cc1cccc2[nH]cc(CCNC(=O)NC[C@H]3CCCN3C)c21	ZINC000171356329	402580335	/nfs/dbraw/zinc/58/03/35/402580335.db2.gz	HRJXWUZUMNMUQL-OAHLLOKOSA-N	0	3	314.433	2.412	10	0		DEAEHN
CCN1CCN(c2ccc(NC(=O)[C@@H](C)COC)c(C)c2)CC1	ZINC000171429162	402586573	/nfs/dbraw/zinc/58/65/73/402586573.db2.gz	MKHMNQMBCAJXBS-HNNXBMFYSA-N	0	3	319.449	2.358	10	0		DEAEHN
CCOc1cccnc1C(=O)N[C@H](C)CN1CCC[C@@H](C)C1	ZINC000248370099	402587923	/nfs/dbraw/zinc/58/79/23/402587923.db2.gz	XBAYJTXAWQXISI-ZIAGYGMSSA-N	0	3	305.422	2.331	10	0		DEAEHN
COc1c(CN2C[C@@H](c3ccsc3)[C@H](CO)C2)c(C)nn1C	ZINC000190282881	402589916	/nfs/dbraw/zinc/58/99/16/402589916.db2.gz	IEBANTCJYIMXMA-ZFWWWQNUSA-N	0	3	321.446	2.007	10	0		DEAEHN
CCCCOC[C@@H](O)CN(CC)C[C@H]1COc2ccccc2O1	ZINC000248637508	402600492	/nfs/dbraw/zinc/60/04/92/402600492.db2.gz	AIENHRJEQPEMLI-HOTGVXAUSA-N	0	3	323.433	2.326	10	0		DEAEHN
CCCCOC[C@H](O)CN(CC)C[C@H]1COc2ccccc2O1	ZINC000248637503	402600572	/nfs/dbraw/zinc/60/05/72/402600572.db2.gz	AIENHRJEQPEMLI-CVEARBPZSA-N	0	3	323.433	2.326	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)[C@H](C)N1CCN2CCC[C@@H]2C1	ZINC000171639081	402604626	/nfs/dbraw/zinc/60/46/26/402604626.db2.gz	AHRDPCPOTLJSRJ-JKSUJKDBSA-N	0	3	301.434	2.410	10	0		DEAEHN
COCCCCC(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190578903	402610970	/nfs/dbraw/zinc/61/09/70/402610970.db2.gz	QNNKGCTXPKUQEY-QGZVFWFLSA-N	0	3	319.449	2.179	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CCOC[C@H]1C	ZINC000248867538	402612317	/nfs/dbraw/zinc/61/23/17/402612317.db2.gz	NQUFVBNRHQSOBF-LMSBXDPUSA-N	0	3	316.445	2.296	10	0		DEAEHN
C[C@H](CO)N(Cc1ccc(Br)c(F)c1)C[C@H](C)O	ZINC000248915878	402614729	/nfs/dbraw/zinc/61/47/29/402614729.db2.gz	JWFAHGHUKVHWBO-ZJUUUORDSA-N	0	3	320.202	2.152	10	0		DEAEHN
CCc1nc2n(n1)C[C@@H](N[C@H](C)c1cnn(C(C)C)c1)CC2	ZINC000180632808	402622245	/nfs/dbraw/zinc/62/22/45/402622245.db2.gz	QXVIYPHOMHHBJB-OCCSQVGLSA-N	0	3	302.426	2.284	10	0		DEAEHN
Cc1ccc(OCCCN2CCN(CCO)[C@@H](C)C2)cc1C	ZINC000249591932	402635851	/nfs/dbraw/zinc/63/58/51/402635851.db2.gz	VPUVSCPUXIYFBG-KRWDZBQOSA-N	0	3	306.450	2.071	10	0		DEAEHN
C[C@@H]1CC(O)C[C@@H](C)N1C[C@H](O)COc1ccc(Cl)cc1	ZINC000191134417	402644708	/nfs/dbraw/zinc/64/47/08/402644708.db2.gz	FWLAHVHGNZINCG-JMSVASOKSA-N	0	3	313.825	2.313	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2Cc1nnc(C2CCC2)n1C	ZINC000181418158	402644922	/nfs/dbraw/zinc/64/49/22/402644922.db2.gz	ICJQLQMDUFROAN-CABCVRRESA-N	0	3	303.454	2.141	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N1CCCN(C2CC2)CC1)c1ccccc1	ZINC000172347181	402651741	/nfs/dbraw/zinc/65/17/41/402651741.db2.gz	SLBYRUJKYZOTBH-HOTGVXAUSA-N	0	3	315.461	2.422	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COc2cc(C)ccc2C)CC[C@H]1C	ZINC000252002643	402652246	/nfs/dbraw/zinc/65/22/46/402652246.db2.gz	WSRRTAPQAGLSRK-JFIYKMOQSA-N	0	3	307.434	2.400	10	0		DEAEHN
CC(C)N(C)c1ccc(CN2C[C@@H](C(N)=O)CC[C@H]2C)cn1	ZINC000191239331	402653671	/nfs/dbraw/zinc/65/36/71/402653671.db2.gz	LZLWRYURHVCVGS-HIFRSBDPSA-N	0	3	304.438	2.012	10	0		DEAEHN
Cc1ccc(Br)nc1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000191264783	402655671	/nfs/dbraw/zinc/65/56/71/402655671.db2.gz	GXTISYXVPRHGRM-LLVKDONJSA-N	0	3	324.222	2.073	10	0		DEAEHN
COC(=O)CNC(=O)[C@@H](C)N[C@@H](C)c1ccc(C(C)(C)C)cc1	ZINC000182608901	402703414	/nfs/dbraw/zinc/70/34/14/402703414.db2.gz	DWMHUKLSNMXXBY-QWHCGFSZSA-N	0	3	320.433	2.312	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)N1C[C@@H](N(C)C)Cc2ccccc21	ZINC000253276274	402661981	/nfs/dbraw/zinc/66/19/81/402661981.db2.gz	JSVZSLOPWSWHTG-BPUTZDHNSA-N	0	3	302.418	2.321	10	0		DEAEHN
Cc1ccc(Cl)c(OC[C@H](O)CN(C)C[C@@H]2CCCO2)c1	ZINC000182247736	402675653	/nfs/dbraw/zinc/67/56/53/402675653.db2.gz	ZBAPCJWVYHNCLV-KGLIPLIRSA-N	0	3	313.825	2.499	10	0		DEAEHN
COc1cccc(CCN[C@H]2CCCC[C@H]2S(C)(=O)=O)c1	ZINC000182464111	402692146	/nfs/dbraw/zinc/69/21/46/402692146.db2.gz	YOEXFWBCAJTGLG-JKSUJKDBSA-N	0	3	311.447	2.183	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCCOc2ccccc2)CCN1C	ZINC000173366455	402694321	/nfs/dbraw/zinc/69/43/21/402694321.db2.gz	PAEAGZFPTCVBOD-LSDHHAIUSA-N	0	3	305.422	2.190	10	0		DEAEHN
C[C@H](C(=O)N[C@H](Cc1ccccc1)CN(C)C)c1cccnc1	ZINC000174171104	402729870	/nfs/dbraw/zinc/72/98/70/402729870.db2.gz	OHESIYXNOXXJKO-MAUKXSAKSA-N	0	3	311.429	2.474	10	0		DEAEHN
CCc1ccc([C@@H](COC)NC(=O)N[C@H]2CCCN(CC)C2)o1	ZINC000174236538	402733327	/nfs/dbraw/zinc/73/33/27/402733327.db2.gz	SPWVCAUDILRVDZ-DZGCQCFKSA-N	0	3	323.437	2.313	10	0		DEAEHN
Cc1nccn1-c1ccc([C@H](C)NCC(=O)N(C)C2CC2)cc1	ZINC000183147752	402743019	/nfs/dbraw/zinc/74/30/19/402743019.db2.gz	WMIXNIXRKBVHPD-ZDUSSCGKSA-N	0	3	312.417	2.452	10	0		DEAEHN
C[C@H](Oc1ccccc1Cl)c1nc([C@H]2CNCCN2C)no1	ZINC000263257046	402751141	/nfs/dbraw/zinc/75/11/41/402751141.db2.gz	QOZIDOCOGHEQOV-CMPLNLGQSA-N	0	3	322.796	2.439	10	0		DEAEHN
CN1CCNC[C@H]1c1noc([C@@H]2CCSc3ccccc32)n1	ZINC000263298551	402755935	/nfs/dbraw/zinc/75/59/35/402755935.db2.gz	WSYQYZPVDRFMCU-OLZOCXBDSA-N	0	3	316.430	2.273	10	0		DEAEHN
CC[C@H](Oc1cccc(C)c1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263298570	402755957	/nfs/dbraw/zinc/75/59/57/402755957.db2.gz	WTWGZLQLDDGYDN-GJZGRUSLSA-N	0	3	316.405	2.484	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(CSc2ccc(F)cc2)n1	ZINC000263307524	402756810	/nfs/dbraw/zinc/75/68/10/402756810.db2.gz	YDGBTMVQGUKWRR-GFCCVEGCSA-N	0	3	308.382	2.077	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NC(=O)NC[C@@H]1CCCN(C)C1	ZINC000174805763	402757791	/nfs/dbraw/zinc/75/77/91/402757791.db2.gz	MRBNXBIBSLTMBW-RDJZCZTQSA-N	0	3	319.449	2.233	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2c(C3CC3)nc3sccn23)CCO1	ZINC000183399239	402763197	/nfs/dbraw/zinc/76/31/97/402763197.db2.gz	AQUYQGPCNSPNNT-ZDUSSCGKSA-N	0	3	320.462	2.036	10	0		DEAEHN
O=C(Cc1ccccc1)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000183463011	402769721	/nfs/dbraw/zinc/76/97/21/402769721.db2.gz	YITOSVWZBVPJSQ-LJQANCHMSA-N	0	3	324.424	2.112	10	0		DEAEHN
Cc1cc(COCC(=O)N(CCN(C)C)c2ccccc2)on1	ZINC000193526363	402771976	/nfs/dbraw/zinc/77/19/76/402771976.db2.gz	QPVSCVQJTJAILB-UHFFFAOYSA-N	0	3	317.389	2.094	10	0		DEAEHN
Cc1nc(C(F)(F)F)c(CN2CCO[C@H](CN(C)C)C2)s1	ZINC000183582068	402778271	/nfs/dbraw/zinc/77/82/71/402778271.db2.gz	YSPNIYBJRBHBKX-SNVBAGLBSA-N	0	3	323.384	2.233	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CC(C)(C)OC2(C)C)CCN1C	ZINC000183588278	402778951	/nfs/dbraw/zinc/77/89/51/402778951.db2.gz	AMLUKMCYSFVIIJ-MGPQQGTHSA-N	0	3	311.470	2.457	10	0		DEAEHN
Cc1cnn(CCN[C@@H]2CCN(c3cccc(Cl)c3)C2=O)c1	ZINC000175224578	402789259	/nfs/dbraw/zinc/78/92/59/402789259.db2.gz	INNWAXYALNGIMS-OAHLLOKOSA-N	0	3	318.808	2.240	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCOc2cccc(C)c2)C1	ZINC000194311467	402791721	/nfs/dbraw/zinc/79/17/21/402791721.db2.gz	XYLSHMNVNDZUQK-OAHLLOKOSA-N	0	3	305.422	2.157	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cccnc2OC(C)C)C1	ZINC000194344765	402793198	/nfs/dbraw/zinc/79/31/98/402793198.db2.gz	HSBBJWOMNKEJFQ-CYBMUJFWSA-N	0	3	306.410	2.475	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)N(CCN(C)C)Cc1cccc(F)c1	ZINC000194354760	402793348	/nfs/dbraw/zinc/79/33/48/402793348.db2.gz	XRXYUFVWDDFEMB-PBHICJAKSA-N	0	3	322.424	2.389	10	0		DEAEHN
COc1cccc2cc([C@H](C)NC[C@@H]3CN(C)CCO3)oc21	ZINC000175424480	402805982	/nfs/dbraw/zinc/80/59/82/402805982.db2.gz	BXRBPTORODVYKP-GXTWGEPZSA-N	0	3	304.390	2.423	10	0		DEAEHN
CC(=O)c1ccc(OCCCC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000194711138	402811700	/nfs/dbraw/zinc/81/17/00/402811700.db2.gz	JPBYYNWXMUISOF-INIZCTEOSA-N	0	3	318.417	2.259	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)[C@H](C)N1[C@H](C)CC[C@@H]1C	ZINC000175925587	402843134	/nfs/dbraw/zinc/84/31/34/402843134.db2.gz	KDMCBYZXHDYMLM-ZNMIVQPWSA-N	0	3	306.454	2.417	10	0		DEAEHN
C[C@H]1COCC[C@H]1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000194818235	402816979	/nfs/dbraw/zinc/81/69/79/402816979.db2.gz	WCUVZSMNTBZSOF-WMLDXEAASA-N	0	3	317.433	2.087	10	0		DEAEHN
Cc1oc(-c2ccco2)nc1CC(=O)N1CCN2CCC[C@@H]2C1	ZINC000195190451	402835916	/nfs/dbraw/zinc/83/59/16/402835916.db2.gz	MLAMCUQZSYGBHH-CYBMUJFWSA-N	0	3	315.373	2.092	10	0		DEAEHN
CC(C)[C@@H](CNC(=O)N1CC[C@H](N(C)C)C1)c1cccnc1	ZINC000175897794	402841138	/nfs/dbraw/zinc/84/11/38/402841138.db2.gz	MYPWHGKTWLTAAT-JKSUJKDBSA-N	0	3	304.438	2.167	10	0		DEAEHN
C[C@H](NC[C@H]1CN(C)CCO1)c1cc(Br)cs1	ZINC000194091887	402783903	/nfs/dbraw/zinc/78/39/03/402783903.db2.gz	LPPYRBFTWYWLNW-ONGXEEELSA-N	0	3	319.268	2.492	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N[C@@H]1COc2ccccc2C1	ZINC000194191798	402787345	/nfs/dbraw/zinc/78/73/45/402787345.db2.gz	FDIYVHRYIHPQJP-CVEARBPZSA-N	0	3	319.449	2.266	10	0		DEAEHN
CNC(=O)[C@H](NCc1ccc(C(=O)OC(C)C)cc1)C(C)C	ZINC000183675093	402787524	/nfs/dbraw/zinc/78/75/24/402787524.db2.gz	CSKRBBRDAVFDQE-OAHLLOKOSA-N	0	3	306.406	2.112	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN(Cc3cn4cccnc4n3)C2)n1	ZINC000195516234	402849420	/nfs/dbraw/zinc/84/94/20/402849420.db2.gz	MJHCUOZNQOCONF-HNNXBMFYSA-N	0	3	322.416	2.367	10	0		DEAEHN
Cn1cc([C@H]2OCCC[C@@H]2NCc2cnn(C(C)(C)C)c2)cn1	ZINC000275563575	403106088	/nfs/dbraw/zinc/10/60/88/403106088.db2.gz	OACGBMVZOPTFLG-JKSUJKDBSA-N	0	3	317.437	2.382	10	0		DEAEHN
Cn1nccc1[C@@H]1OCC[C@H]1CNCc1cccc2c1OCO2	ZINC000275625053	403110204	/nfs/dbraw/zinc/11/02/04/403110204.db2.gz	RVRZLERAKMFGEQ-XJKSGUPXSA-N	0	3	315.373	2.016	10	0		DEAEHN
c1ccc(Cn2nnnc2SCCN2CCCCC2)cc1	ZINC000269728625	403161456	/nfs/dbraw/zinc/16/14/56/403161456.db2.gz	WYLNQLMEQLPUSI-UHFFFAOYSA-N	0	3	303.435	2.299	10	0		DEAEHN
COCC[C@@H](CO)NCc1ccc(Br)c(F)c1	ZINC000282265098	403137935	/nfs/dbraw/zinc/13/79/35/403137935.db2.gz	PNIJVMQSEIIJNY-JTQLQIEISA-N	0	3	306.175	2.075	10	0		DEAEHN
CN1CC[C@H](NC(=O)C[C@](C)(O)C2CC2)[C@@H]1c1ccccc1	ZINC000270399069	403187690	/nfs/dbraw/zinc/18/76/90/403187690.db2.gz	CFFKAODSTQHPEO-SZMVWBNQSA-N	0	3	302.418	2.099	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)[C@H](C)N[C@H]2CCOC[C@@H]2C)cc1	ZINC000277890520	403268286	/nfs/dbraw/zinc/26/82/86/403268286.db2.gz	OMXNVHMATHCWJD-MKBNYLNASA-N	0	3	304.390	2.231	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)N[C@@H]2CCOC[C@H]2C)c1C	ZINC000277963941	403275239	/nfs/dbraw/zinc/27/52/39/403275239.db2.gz	SFLXYWJATIITPU-LJWDBELGSA-N	0	3	306.406	2.420	10	0		DEAEHN
CC[C@H](NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21)c1c(C)noc1C	ZINC000332842165	403624114	/nfs/dbraw/zinc/62/41/14/403624114.db2.gz	NXZSWSCVANQGGU-ILXRZTDVSA-N	0	3	320.437	2.478	10	0		DEAEHN
CN1CCO[C@@H]2CN(c3ccnc4ccc(Cl)cc43)C[C@H]21	ZINC000301628863	403656252	/nfs/dbraw/zinc/65/62/52/403656252.db2.gz	BUFOYLRWCHLRBA-HZPDHXFCSA-N	0	3	303.793	2.407	10	0		DEAEHN
C[C@H]1CC[C@H](NC(=O)N2CCOC3(CNC3)C2)c2ccccc21	ZINC000333454504	403755199	/nfs/dbraw/zinc/75/51/99/403755199.db2.gz	YAWPGRLLVHBUCB-BBRMVZONSA-N	0	3	315.417	2.009	10	0		DEAEHN
O=C(CN1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O)NCc1ccccc1	ZINC000303678952	403756292	/nfs/dbraw/zinc/75/62/92/403756292.db2.gz	RGZFSBJEOYKMJH-KSZLIROESA-N	0	3	316.445	2.318	10	0		DEAEHN
Cc1cc(-n2ccnc2)ccc1CN1CCSC[C@@H]1CCO	ZINC000361829850	403892112	/nfs/dbraw/zinc/89/21/12/403892112.db2.gz	IVTMKEDLEGTDIG-KRWDZBQOSA-N	0	3	317.458	2.481	10	0		DEAEHN
Cc1c(C(=O)N[C@@H]2CC[C@H](N(C)C)C2)[nH]c2c1C(=O)CCC2	ZINC000337156983	403969721	/nfs/dbraw/zinc/96/97/21/403969721.db2.gz	PXYAKXSLBCMMEP-NEPJUHHUSA-N	0	3	303.406	2.055	10	0		DEAEHN
CN(C)c1cccc(NC(=O)N2CC[C@]3(C2)CCCN(C)C3)n1	ZINC000296104062	404094689	/nfs/dbraw/zinc/09/46/89/404094689.db2.gz	AWYUZPNBFQZYIF-QGZVFWFLSA-N	0	3	317.437	2.097	10	0		DEAEHN
C/C(=C\c1ccc(F)cc1)C(=O)N[C@H]1CCCN(CCCO)C1	ZINC000296356840	404211572	/nfs/dbraw/zinc/21/15/72/404211572.db2.gz	FMUYKBOZOMTCMY-VSOYFRJCSA-N	0	3	320.408	2.192	10	0		DEAEHN
Cn1nccc1[C@H]1CCC[C@H](NCc2nnc3ccccn32)C1	ZINC000363923428	404252888	/nfs/dbraw/zinc/25/28/88/404252888.db2.gz	GUKAJKACEGJKLP-KBPBESRZSA-N	0	3	310.405	2.279	10	0		DEAEHN
CC(C)N1CC[C@@H](N2CCC(COc3ccccn3)CC2)C1=O	ZINC000370167465	404357592	/nfs/dbraw/zinc/35/75/92/404357592.db2.gz	PARAHVQTHZEGEA-MRXNPFEDSA-N	0	3	317.433	2.182	10	0		DEAEHN
c1cc(CN[C@H]2CCO[C@@]3(CCOC3)C2)c2c(c1)OCCCO2	ZINC000356293993	404429835	/nfs/dbraw/zinc/42/98/35/404429835.db2.gz	XZXZNKNXAMCRER-YJBOKZPZSA-N	0	3	319.401	2.276	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@H]1CCCc2cn[nH]c21	ZINC000291782799	404518693	/nfs/dbraw/zinc/51/86/93/404518693.db2.gz	VCSCLMTYYBPMQP-INIZCTEOSA-N	0	3	308.389	2.217	10	0		DEAEHN
CCOC(=O)[C@H]1CN(CCc2ccc(C)cc2)CC12COC2	ZINC000451143007	404879616	/nfs/dbraw/zinc/87/96/16/404879616.db2.gz	WTISJXNYGGDKTG-MRXNPFEDSA-N	0	3	303.402	2.049	10	0		DEAEHN
c1cc(-c2ccc(CN[C@H]3CCO[C@@]4(CCOC4)C3)o2)n[nH]1	ZINC000366822978	404853491	/nfs/dbraw/zinc/85/34/91/404853491.db2.gz	HBSSDFSOSBMNRS-LRDDRELGSA-N	0	3	303.362	2.097	10	0		DEAEHN
CON(C)C(=O)CCN1CCC(c2nc3ccccc3o2)CC1	ZINC000366843917	404856744	/nfs/dbraw/zinc/85/67/44/404856744.db2.gz	HPPIHHRNRWRZMB-UHFFFAOYSA-N	0	3	317.389	2.417	10	0		DEAEHN
CC(C)(C)OC(=O)c1ccc(CN[C@H]2CCC(=O)NC2)cc1	ZINC000360952660	404860418	/nfs/dbraw/zinc/86/04/18/404860418.db2.gz	ASDPTTGCHFDPNY-AWEZNQCLSA-N	0	3	304.390	2.010	10	0		DEAEHN
CN(C)[C@@H](CNC(=O)N1CCC12CCC2)Cc1ccccc1	ZINC000435580041	404991249	/nfs/dbraw/zinc/99/12/49/404991249.db2.gz	OKBIVWQHYUINOD-MRXNPFEDSA-N	0	3	301.434	2.497	10	0		DEAEHN
OCCN1CCC[C@@H](NCc2ccsc2Br)C1	ZINC000388981928	405036179	/nfs/dbraw/zinc/03/61/79/405036179.db2.gz	PMYKQBDMSQRSLL-LLVKDONJSA-N	0	3	319.268	2.057	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CCC(N3CCCCC3)CC2)o1	ZINC000408096745	405111325	/nfs/dbraw/zinc/11/13/25/405111325.db2.gz	GBLSSRXSADWYSU-UHFFFAOYSA-N	0	3	312.435	2.227	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CC[C@H](CN3CCCCC3)C2)o1	ZINC000408097809	405111632	/nfs/dbraw/zinc/11/16/32/405111632.db2.gz	NVMTVGLBXWKDHL-CQSZACIVSA-N	0	3	312.435	2.085	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(NC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000408135263	405119577	/nfs/dbraw/zinc/11/95/77/405119577.db2.gz	XCWZVDZMWURKFN-ZDUSSCGKSA-N	0	3	320.368	2.096	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)Nc1cccc([S@@](C)=O)c1	ZINC000408296963	405165423	/nfs/dbraw/zinc/16/54/23/405165423.db2.gz	FBPHBXOCUJOMBQ-UZRORNOBSA-N	0	3	321.446	2.124	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1ccc2c(c1O)OC(C)(C)C2	ZINC000408407143	405198020	/nfs/dbraw/zinc/19/80/20/405198020.db2.gz	KESKFMUPRVCSMU-CYBMUJFWSA-N	0	3	318.417	2.272	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)CN[C@]2(CO)C[C@@H](C)CC(C)(C)C2)C1	ZINC000408423497	405203489	/nfs/dbraw/zinc/20/34/89/405203489.db2.gz	PESMDPSCTNQYMY-RVKKMQEKSA-N	0	3	310.482	2.412	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@H]1C[C@@H]1c1cc(F)ccc1F	ZINC000439042170	405263543	/nfs/dbraw/zinc/26/35/43/405263543.db2.gz	JUAHLCKECSCABA-HIFRSBDPSA-N	0	3	317.339	2.114	10	0		DEAEHN
Cc1ccsc1CCCC(=O)N1CCN(CCN(C)C)CC1	ZINC000439053835	405264495	/nfs/dbraw/zinc/26/44/95/405264495.db2.gz	HVGCTWIVVFAAON-UHFFFAOYSA-N	0	3	323.506	2.085	10	0		DEAEHN
CC(=O)N1CC[C@@H](CN(C)Cc2ccc(-c3ccccn3)nc2)C1	ZINC000425414985	405287083	/nfs/dbraw/zinc/28/70/83/405287083.db2.gz	DVIVKHKFTQEZKE-KRWDZBQOSA-N	0	3	324.428	2.444	10	0		DEAEHN
CN(CC[C@H]1CCOC1)[C@H]1CCN(c2ccccc2F)C1=O	ZINC000438118804	405233331	/nfs/dbraw/zinc/23/33/31/405233331.db2.gz	YBOWCKZCUXYVHL-BBRMVZONSA-N	0	3	306.381	2.289	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NC[C@H](Cc1ccccc1)OC	ZINC000452834668	405249323	/nfs/dbraw/zinc/24/93/23/405249323.db2.gz	YXERAWKRKZBKJD-IRXDYDNUSA-N	0	3	304.434	2.235	10	0		DEAEHN
O=C(CNC1(CCO)CCCCC1)N1CCc2ccccc21	ZINC000440905315	405330367	/nfs/dbraw/zinc/33/03/67/405330367.db2.gz	FGJRDBLUYYNQHI-UHFFFAOYSA-N	0	3	302.418	2.251	10	0		DEAEHN
CN(C)CCn1nccc1NC(=O)N[C@H]1CCC12CCCC2	ZINC000455656791	405440860	/nfs/dbraw/zinc/44/08/60/405440860.db2.gz	LFJZVIQIYVSIBN-ZDUSSCGKSA-N	0	3	305.426	2.289	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)[C@@H]2NCCCC2(C)C)c1	ZINC000423211382	405725104	/nfs/dbraw/zinc/72/51/04/405725104.db2.gz	HBWKRNNJJOAKKM-HNNXBMFYSA-N	0	3	303.406	2.386	10	0		DEAEHN
CC(C)n1cc(CN2CCC[C@@H]2[C@@H]2COCC[C@]2(C)O)cn1	ZINC000583618798	405776195	/nfs/dbraw/zinc/77/61/95/405776195.db2.gz	NRHGXMNLSYMAAH-BBWFWOEESA-N	0	3	307.438	2.216	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)NC2CCN(C3CC3)CC2)c1	ZINC000457401054	405827256	/nfs/dbraw/zinc/82/72/56/405827256.db2.gz	KLFSXFYIYAJUAP-UHFFFAOYSA-N	0	3	316.401	2.138	10	0		DEAEHN
CN1CCC(CC(=O)N2CC[C@](C)(C(=O)OC(C)(C)C)C2)CC1	ZINC000457241060	405765440	/nfs/dbraw/zinc/76/54/40/405765440.db2.gz	SAEYUGXTFNBWRF-SFHVURJKSA-N	0	3	324.465	2.299	10	0		DEAEHN
COc1ccc(C(=O)C[C@@H](C)C(=O)NC(C)(C)CN(C)C)cc1	ZINC000457257463	405769484	/nfs/dbraw/zinc/76/94/84/405769484.db2.gz	ZURHJCIUZMTANM-CYBMUJFWSA-N	0	3	320.433	2.361	10	0		DEAEHN
COC(=O)[C@@H](O)C1CCN(Cc2ccc(C3CC3)cc2)CC1	ZINC000459355413	405869831	/nfs/dbraw/zinc/86/98/31/405869831.db2.gz	MSWUBHFNIHQYQA-KRWDZBQOSA-N	0	3	303.402	2.310	10	0		DEAEHN
COc1cc(C)c(C(=O)NCCN2CC[C@H](C)C2)cc1OC	ZINC000531267466	405935182	/nfs/dbraw/zinc/93/51/82/405935182.db2.gz	QWGVJUIAGMLWBC-LBPRGKRZSA-N	0	3	306.406	2.084	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@H]1C[C@]12CCCc1ccccc12	ZINC000562450597	406013016	/nfs/dbraw/zinc/01/30/16/406013016.db2.gz	RQTUZAQEYVUIRW-QUCCMNQESA-N	0	3	321.424	2.326	10	0		DEAEHN
COc1nsc(CNCC2(N(C)C)CC2)c1Br	ZINC000639273601	406014391	/nfs/dbraw/zinc/01/43/91/406014391.db2.gz	XNLWSEOMEYMQOH-UHFFFAOYSA-N	0	3	320.256	2.098	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N[C@H]2CCCN(C(C)C)C2)c1	ZINC000457729213	405974151	/nfs/dbraw/zinc/97/41/51/405974151.db2.gz	HLNWFKNIWHUFEO-INIZCTEOSA-N	0	3	318.417	2.384	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N1CC(=O)NCc1cccc2c1CCOC2	ZINC000634315592	406094480	/nfs/dbraw/zinc/09/44/80/406094480.db2.gz	OQTOTPQUJLCGEK-ZIAGYGMSSA-N	0	3	302.418	2.248	10	0		DEAEHN
c1nc2n(n1)[C@H](CN(Cc1ccccc1)C[C@H]1CCCO1)CC2	ZINC000639460029	406098810	/nfs/dbraw/zinc/09/88/10/406098810.db2.gz	QSAXDXQJHURARD-DLBZAZTESA-N	0	3	312.417	2.447	10	0		DEAEHN
c1c2c(nnc1N1CCCC1)CCN(CCC[C@H]1CCO1)C2	ZINC000639341742	406057055	/nfs/dbraw/zinc/05/70/55/406057055.db2.gz	ZWGKYPNHQATIAT-HNNXBMFYSA-N	0	3	302.422	2.004	10	0		DEAEHN
CC[C@@H](CNCc1c(Br)cnn1C)N1CCCC1	ZINC000486980445	406195078	/nfs/dbraw/zinc/19/50/78/406195078.db2.gz	JBTPQTUVGUUMFN-NSHDSACASA-N	0	3	315.259	2.147	10	0		DEAEHN
C[C@@]1(CO)CCCN1C(=O)c1cccc(CN2CCCC2)c1	ZINC000546115105	406351228	/nfs/dbraw/zinc/35/12/28/406351228.db2.gz	ITXIECYHVIVKJT-SFHVURJKSA-N	0	3	302.418	2.269	10	0		DEAEHN
C[C@@H](O)CCN(Cc1ccc(C(=O)NC2CC2)cc1)C1CC1	ZINC000570355126	406381128	/nfs/dbraw/zinc/38/11/28/406381128.db2.gz	IXPIDICKIYQGMR-CYBMUJFWSA-N	0	3	302.418	2.314	10	0		DEAEHN
CC[C@@H]1CCC[C@@H]1NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638032770	406533560	/nfs/dbraw/zinc/53/35/60/406533560.db2.gz	APJPZPUZDLQUMG-ZACQAIPSSA-N	0	3	303.450	2.141	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NCC1(C)CCCC1	ZINC000637990476	406513189	/nfs/dbraw/zinc/51/31/89/406513189.db2.gz	XOGPEMQCAPQJPX-MRXNPFEDSA-N	0	3	303.450	2.142	10	0		DEAEHN
C[C@H](NC(=O)c1cn2cccnc2n1)[C@@H](c1ccccc1)N(C)C	ZINC000548432754	406514417	/nfs/dbraw/zinc/51/44/17/406514417.db2.gz	XMOUUJGKVLTFOT-BBRMVZONSA-N	0	3	323.400	2.151	10	0		DEAEHN
COc1nsc(CNCC(C)(C)N(C)C)c1Br	ZINC000638290304	406674967	/nfs/dbraw/zinc/67/49/67/406674967.db2.gz	FLUXZIPAYYIHOS-UHFFFAOYSA-N	0	3	322.272	2.344	10	0		DEAEHN
C[C@@H](CCC1CC1)NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638308747	406689442	/nfs/dbraw/zinc/68/94/42/406689442.db2.gz	XHIDMJGZBQSAMY-YOEHRIQHSA-N	0	3	303.450	2.141	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NCC1(C2CC2)CCC1	ZINC000638310169	406689818	/nfs/dbraw/zinc/68/98/18/406689818.db2.gz	OKHIGEMCGNFSEE-QGZVFWFLSA-N	0	3	315.461	2.142	10	0		DEAEHN
C[C@@H]1CCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)[C@H](C)C1	ZINC000638404732	406752471	/nfs/dbraw/zinc/75/24/71/406752471.db2.gz	LJSUAUSXWXLDDL-INMHGKMJSA-N	0	3	303.450	2.093	10	0		DEAEHN
CN(Cc1cc(Cl)cc(Cl)c1)C(=O)[C@@H]1CNCCOC1	ZINC000643645310	407021618	/nfs/dbraw/zinc/02/16/18/407021618.db2.gz	JCBNVVBSLHLFFD-LLVKDONJSA-N	0	3	317.216	2.188	10	0		DEAEHN
C[C@@H]1CCN(S(=O)(=O)c2ccc(CN)cc2Cl)C[C@@H]1C	ZINC000129714621	196070411	/nfs/dbraw/zinc/07/04/11/196070411.db2.gz	WBWLBAHIUZXINY-MNOVXSKESA-N	0	3	316.854	2.465	10	0		DEAEHN
C[C@H](N[C@@H]1CCc2ccccc2C1)C(=O)NCC(F)(F)F	ZINC000130503174	196085344	/nfs/dbraw/zinc/08/53/44/196085344.db2.gz	QSBMEDHYRJRALH-GXFFZTMASA-N	0	3	300.324	2.201	10	0		DEAEHN
O=C1C[C@@H](NCCCC(F)(F)F)C(=O)N1c1ccccc1	ZINC000130548167	196090063	/nfs/dbraw/zinc/09/00/63/196090063.db2.gz	KTWPDEBVIRGIIP-LLVKDONJSA-N	0	3	300.280	2.251	10	0		DEAEHN
CS[C@@H](C)CCNS(=O)(=O)c1cccc([C@@H](C)N)c1	ZINC000130935085	196124427	/nfs/dbraw/zinc/12/44/27/196124427.db2.gz	OPQUMDDVVXFXDQ-WDEREUQCSA-N	0	3	302.465	2.126	10	0		DEAEHN
CN[C@@H](CCCS(C)(=O)=O)c1cc(Cl)ccc1OC	ZINC000131078716	196137451	/nfs/dbraw/zinc/13/74/51/196137451.db2.gz	DFYCUEHJJXNLFG-LBPRGKRZSA-N	0	3	305.827	2.434	10	0		DEAEHN
NN=c1[nH]cc(C(=O)NCCCCC(F)(F)F)cc1Cl	ZINC000131120018	196141748	/nfs/dbraw/zinc/14/17/48/196141748.db2.gz	CBVOKIYUQCDCGR-UHFFFAOYSA-N	0	3	310.707	2.483	10	0		DEAEHN
CS(=O)(=O)CCC[C@H](N)c1cccc(F)c1Br	ZINC000131341254	196161274	/nfs/dbraw/zinc/16/12/74/196161274.db2.gz	DIDLRMHVOXWVID-JTQLQIEISA-N	0	3	324.215	2.413	10	0		DEAEHN
N[C@H]1COC[C@@H]1C(=O)Nc1cc(Cl)ccc1Br	ZINC000131636917	196186085	/nfs/dbraw/zinc/18/60/85/196186085.db2.gz	JFQBHFBYNGAKCF-CBAPKCEASA-N	0	3	319.586	2.015	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CC[C@@H](C)[C@@H](C)C2)c(F)c1	ZINC000131759853	196196428	/nfs/dbraw/zinc/19/64/28/196196428.db2.gz	UPRPPHDRACHXJC-NEPJUHHUSA-N	0	3	314.426	2.212	10	0		DEAEHN
COc1cc(Br)ccc1[C@@H](N)Cc1cnn(C)c1	ZINC000131804119	196200388	/nfs/dbraw/zinc/20/03/88/196200388.db2.gz	GUVIMJPIETUYAN-LBPRGKRZSA-N	0	3	310.195	2.434	10	0		DEAEHN
NCc1ccc(Cl)c(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)c1	ZINC000132209066	196235645	/nfs/dbraw/zinc/23/56/45/196235645.db2.gz	IFGQPHAUVIOSNP-VXGBXAGGSA-N	0	3	314.838	2.219	10	0		DEAEHN
CCCN(CCN(C)C)c1nc(NC)ncc1Br	ZINC000132349482	196247883	/nfs/dbraw/zinc/24/78/83/196247883.db2.gz	NXLMHLXSLXDZPY-UHFFFAOYSA-N	0	3	316.247	2.059	10	0		DEAEHN
CCN[C@@H](C[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccoc1C	ZINC000132753977	196280509	/nfs/dbraw/zinc/28/05/09/196280509.db2.gz	JUOKRHYEFQHLPI-ZFWWWQNUSA-N	0	3	314.451	2.300	10	0		DEAEHN
CCNc1ncc(Br)c(NCCN(C)C2CC2)n1	ZINC000133067121	196308997	/nfs/dbraw/zinc/30/89/97/196308997.db2.gz	QCSNRZMGDGWVNQ-UHFFFAOYSA-N	0	3	314.231	2.177	10	0		DEAEHN
CN[C@H](Cc1cc(C)ccc1OC)[C@@H]1CCCCS1(=O)=O	ZINC000133306903	196329747	/nfs/dbraw/zinc/32/97/47/196329747.db2.gz	KYGICFOWIPPZCC-ZBFHGGJFSA-N	0	3	311.447	2.101	10	0		DEAEHN
CCN(CC)Cc1cc(C(F)(F)F)cc(S(N)(=O)=O)c1	ZINC000133943543	196347650	/nfs/dbraw/zinc/34/76/50/196347650.db2.gz	ICJISHUHUJYGMO-UHFFFAOYSA-N	0	3	310.341	2.195	10	0		DEAEHN
CC[C@@](C)(C(=O)c1c(Cl)cnn1CCN(C)C)N(C)C	ZINC000134100511	196361478	/nfs/dbraw/zinc/36/14/78/196361478.db2.gz	CWZVDHFIFNXXCI-AWEZNQCLSA-N	0	3	300.834	2.011	10	0		DEAEHN
N[C@H]1C[C@@H]1NC(=O)c1ccc2cc(Br)ccc2c1	ZINC000134984914	196437271	/nfs/dbraw/zinc/43/72/71/196437271.db2.gz	DBABETIZHPOWPS-STQMWFEESA-N	0	3	305.175	2.432	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1CNC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C	ZINC000262579222	287286596	/nfs/dbraw/zinc/28/65/96/287286596.db2.gz	YQKXFFZVOJJTRG-VFCJXBEMSA-N	0	3	308.466	2.461	10	0		DEAEHN
CCS(=O)(=O)c1ccc(NC(=O)C[C@@H](N)C(C)(C)C)cc1	ZINC000136830872	196554169	/nfs/dbraw/zinc/55/41/69/196554169.db2.gz	NAYMBTXTEZMKJH-CYBMUJFWSA-N	0	3	312.435	2.182	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC[C@H](c2cc(N)n[nH]2)CC1	ZINC000616628760	422517556	/nfs/dbraw/zinc/51/75/56/422517556.db2.gz	QTGHZLONXFIWCB-LBPRGKRZSA-N	0	3	323.441	2.086	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)Nc2ccc(C)c(F)c2)c1	ZINC000105881488	424849617	/nfs/dbraw/zinc/84/96/17/424849617.db2.gz	GIDUOWUCPCXFDI-ZDUSSCGKSA-N	0	3	304.369	2.256	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Cc2ccc(OC(F)F)cc2)C1	ZINC000194638006	424877432	/nfs/dbraw/zinc/87/74/32/424877432.db2.gz	OEGPYATVRVJVLQ-CYBMUJFWSA-N	0	3	312.360	2.431	10	0		DEAEHN
c1cc(CN[C@H]2CO[C@H](C3CC3)C2)cc(N2CCSCC2)n1	ZINC000639386455	424857860	/nfs/dbraw/zinc/85/78/60/424857860.db2.gz	IVMHOZRRDYLZFP-CVEARBPZSA-N	0	3	319.474	2.292	10	0		DEAEHN
Brc1ccc2c(c1)[C@H](NC1COCCOC1)CC2	ZINC000386259024	424911596	/nfs/dbraw/zinc/91/15/96/424911596.db2.gz	FFHGYYDDMMBHCA-CQSZACIVSA-N	0	3	312.207	2.441	10	0		DEAEHN
[NH3+]CC1(CC[N-]S(=O)(=O)c2cccc(Cl)c2Cl)CC1	ZINC000404633190	424927958	/nfs/dbraw/zinc/92/79/58/424927958.db2.gz	HJNFSMDNVOKXEU-UHFFFAOYSA-N	0	3	323.245	2.401	10	0		DEAEHN
CCN1CC[C@H](NC(=O)c2ccc(Br)cc2F)C1	ZINC000390021463	269097083	/nfs/dbraw/zinc/09/70/83/269097083.db2.gz	WRHMZMATZAYXDH-JTQLQIEISA-N	0	3	315.186	2.412	10	0		DEAEHN
COC[C@H](Cc1ccccc1)NCc1cccnc1-n1cncn1	ZINC000178052813	274049613	/nfs/dbraw/zinc/04/96/13/274049613.db2.gz	PHDPENUAMUICTH-KRWDZBQOSA-N	0	3	323.400	2.010	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(C(=O)C3(N)CCCC3)C2)c1	ZINC000178167397	274098506	/nfs/dbraw/zinc/09/85/06/274098506.db2.gz	HCHMZVNTHYFJSF-CYBMUJFWSA-N	0	3	318.417	2.291	10	0		DEAEHN
CC(C)c1nn(C)c(Cl)c1C(=O)N1CCN2CCC[C@H]2C1	ZINC000172907673	276071129	/nfs/dbraw/zinc/07/11/29/276071129.db2.gz	SXEASPMMVWQCPN-NSHDSACASA-N	0	3	310.829	2.117	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H](C)c1cn(-c2ccccc2)nn1)N(C)C	ZINC000155134083	276269178	/nfs/dbraw/zinc/26/91/78/276269178.db2.gz	ZHQQRNLRZKZYFG-BBRMVZONSA-N	0	3	315.421	2.175	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)N(C)C	ZINC000179338707	276282650	/nfs/dbraw/zinc/28/26/50/276282650.db2.gz	XZKPBOPYTUYKHC-GVDBMIGSSA-N	0	3	303.450	2.278	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccccc1NC(=O)OC	ZINC000176992320	276377400	/nfs/dbraw/zinc/37/74/00/276377400.db2.gz	PAEBDCAWUBLGFO-ZDUSSCGKSA-N	0	3	319.405	2.421	10	0		DEAEHN
CN(C)C(=O)Sc1ccc(CNC(C)(C)CC(N)=O)cc1	ZINC000186217136	276756309	/nfs/dbraw/zinc/75/63/09/276756309.db2.gz	QTMCKXSIAHWTOK-UHFFFAOYSA-N	0	3	309.435	2.204	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1C	ZINC000246758732	277101796	/nfs/dbraw/zinc/10/17/96/277101796.db2.gz	ALTVEQVMPLTLHN-YGRLFVJLSA-N	0	3	303.406	2.143	10	0		DEAEHN
COc1ccc2nc(C(=O)N3CCN4CCC[C@@H]4C3)ccc2c1	ZINC000171585554	278001448	/nfs/dbraw/zinc/00/14/48/278001448.db2.gz	JKKJVWHJUGYNJD-CQSZACIVSA-N	0	3	311.385	2.164	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@H]2CCCOC2)c2ccc(F)cc2C1	ZINC000184510672	278057148	/nfs/dbraw/zinc/05/71/48/278057148.db2.gz	VKDLVBYQVINCRL-RDJZCZTQSA-N	0	3	306.381	2.388	10	0		DEAEHN
C[C@@H](N[C@@H](C)CC(F)(F)F)c1ccc(S(N)(=O)=O)cc1	ZINC000231791492	278362696	/nfs/dbraw/zinc/36/26/96/278362696.db2.gz	IYBVUUSOUGSVSP-DTWKUNHWSA-N	0	3	310.341	2.326	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@H]1OCCc2ccccc21	ZINC000129602810	278973881	/nfs/dbraw/zinc/97/38/81/278973881.db2.gz	ZVIXOEVIPKQABE-RDJZCZTQSA-N	0	3	304.434	2.393	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCSC[C@@H](C)C1	ZINC000192344259	279125038	/nfs/dbraw/zinc/12/50/38/279125038.db2.gz	KOROKSJVFNFTLV-UONOGXRCSA-N	0	3	301.500	2.357	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1cn(C)nc1C(C)(C)C	ZINC000092246345	279132874	/nfs/dbraw/zinc/13/28/74/279132874.db2.gz	YWMZBBNSGXTGMF-CYBMUJFWSA-N	0	3	308.470	2.424	10	0		DEAEHN
C[C@](C[NH3+])([N-]S(=O)(=O)c1c(Cl)cccc1Cl)C1CC1	ZINC000130369189	280140479	/nfs/dbraw/zinc/14/04/79/280140479.db2.gz	XMZLPQOTZUIDEY-GFCCVEGCSA-N	0	3	323.245	2.399	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cccnc1Br	ZINC000246140408	288312679	/nfs/dbraw/zinc/31/26/79/288312679.db2.gz	XFTKYJIGORPUIJ-MNOVXSKESA-N	0	3	324.222	2.153	10	0		DEAEHN
CCN(C)C(=O)CCN1CCC(NC(=O)CC2CCCC2)CC1	ZINC000130389246	281938704	/nfs/dbraw/zinc/93/87/04/281938704.db2.gz	CAHXDAXCGPRTAS-UHFFFAOYSA-N	0	3	323.481	2.016	10	0		DEAEHN
C[C@@H]1OCCC[C@H]1C(=O)Nc1ccc(OCCN(C)C)cc1	ZINC000188956767	288870843	/nfs/dbraw/zinc/87/08/43/288870843.db2.gz	AFFQPCJQJBQKIE-XJKSGUPXSA-N	0	3	306.406	2.381	10	0		DEAEHN
CN(C(=O)c1cc2n(n1)CCCC2)C(C)(C)CN1CCCC1	ZINC000416108532	288919921	/nfs/dbraw/zinc/91/99/21/288919921.db2.gz	QDEYHKJDQXPMJT-UHFFFAOYSA-N	0	3	304.438	2.166	10	0		DEAEHN
COc1cccc(CN(CCN(C)C)C(=O)[C@H]2CC[C@H](C)O2)c1	ZINC000191954665	295295698	/nfs/dbraw/zinc/29/56/98/295295698.db2.gz	QDECZRFCXFFWHL-WMLDXEAASA-N	0	3	320.433	2.153	10	0		DEAEHN
Cc1cc(CCNC(=O)NC[C@H]2CCCN(C)C2)cc(C)c1O	ZINC000189488819	333093868	/nfs/dbraw/zinc/09/38/68/333093868.db2.gz	MBOQTKRLKGTQEB-MRXNPFEDSA-N	0	3	319.449	2.193	10	0		DEAEHN
CC1(C)CN(CCNCc2cc(-c3ccccc3)n[nH]2)CCO1	ZINC000178622436	341960208	/nfs/dbraw/zinc/96/02/08/341960208.db2.gz	ZYDQQXZYSBHAMD-UHFFFAOYSA-N	0	3	314.433	2.277	10	0		DEAEHN
COC[C@@](C)(O)CN[C@H]1CCCc2ncc(C(F)(F)F)cc21	ZINC000547659426	500625821	/nfs/dbraw/zinc/62/58/21/500625821.db2.gz	HQRYSWIIWMXCQY-KBPBESRZSA-N	0	3	318.339	2.465	10	0		DEAEHN
COc1ccc(O)cc1C(=O)NC[C@@H](C)N1CCC(C)CC1	ZINC000188942796	534211684	/nfs/dbraw/zinc/21/16/84/534211684.db2.gz	GHKPKUHLMFPZFV-CYBMUJFWSA-N	0	3	306.406	2.251	10	0		DEAEHN
Cn1nccc1[C@@H]1OCC[C@H]1CNCc1nc2c(s1)CCC2	ZINC000328646145	534318262	/nfs/dbraw/zinc/31/82/62/534318262.db2.gz	SKPAQHFYWPKKOQ-MEDUHNTESA-N	0	3	318.446	2.233	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H](C)Oc1ccccc1OC)N(C)C	ZINC000162332969	520980435	/nfs/dbraw/zinc/98/04/35/520980435.db2.gz	KCLCTFDTRKUUKZ-UONOGXRCSA-N	0	3	308.422	2.309	10	0		DEAEHN
Cc1nnc([C@@H]2CCCCN2C(=O)CN2[C@@H](C)CC[C@@H]2C)[nH]1	ZINC000328703920	534552524	/nfs/dbraw/zinc/55/25/24/534552524.db2.gz	YCDVQXBSZSHOBP-OBJOEFQTSA-N	0	3	305.426	2.040	10	0		DEAEHN
CCc1nc(CNC(=O)N(C)C[C@H]2CCCN(C)C2)cs1	ZINC000115824662	522329784	/nfs/dbraw/zinc/32/97/84/522329784.db2.gz	KQQDCKOVVXDOBN-LBPRGKRZSA-N	0	3	310.467	2.189	10	0		DEAEHN
CCc1nc(CNC(=O)N(C)C[C@@H]2CCCN(C)C2)cs1	ZINC000115824659	522331425	/nfs/dbraw/zinc/33/14/25/522331425.db2.gz	KQQDCKOVVXDOBN-GFCCVEGCSA-N	0	3	310.467	2.189	10	0		DEAEHN
CCc1nc(CNC(=O)NC[C@@H]2CCCCN2CC)cs1	ZINC000111498296	522334208	/nfs/dbraw/zinc/33/42/08/522334208.db2.gz	SYGVGWPSRNDBMQ-ZDUSSCGKSA-N	0	3	310.467	2.379	10	0		DEAEHN
COC[C@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)C(C)C	ZINC000157234962	522751515	/nfs/dbraw/zinc/75/15/15/522751515.db2.gz	NCXKSLUVZQXAKU-UXLLHSPISA-N	0	3	321.465	2.456	10	0		DEAEHN
COCCCNC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000157434609	523338395	/nfs/dbraw/zinc/33/83/95/523338395.db2.gz	NJPDNEKANDNMFD-SFHVURJKSA-N	0	3	319.449	2.377	10	0		DEAEHN
Cc1cc(C)cc(OCCCN2CCN(C[C@@H](C)O)[C@H](C)C2)c1	ZINC000105912047	524445425	/nfs/dbraw/zinc/44/54/25/524445425.db2.gz	PYXGSKRNQVNDFM-QZTJIDSGSA-N	0	3	320.477	2.459	10	0		DEAEHN
C[C@H](NC(C)(C)CNC(=O)[C@H]1CSC(=O)N1)c1ccccc1	ZINC000155776268	525275306	/nfs/dbraw/zinc/27/53/06/525275306.db2.gz	FESGACUJDONZFV-WCQYABFASA-N	0	3	321.446	2.057	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)s1	ZINC000246493582	536503992	/nfs/dbraw/zinc/50/39/92/536503992.db2.gz	RJCJQXJTPRFDHE-RTXFEEFZSA-N	0	3	323.462	2.468	10	0		DEAEHN
CCN1CCC[C@@H](Nc2ccc3nnc(C(C)(C)C)n3n2)C1	ZINC000302569704	529059450	/nfs/dbraw/zinc/05/94/50/529059450.db2.gz	OXOQILHTRCZWPF-GFCCVEGCSA-N	0	3	302.426	2.318	10	0		DEAEHN
CCCOc1cc(OC)ccc1C(=O)NC[C@@H]1CCCN1C	ZINC000191413827	535249717	/nfs/dbraw/zinc/24/97/17/535249717.db2.gz	WPYRCZAWLJCVBK-ZDUSSCGKSA-N	0	3	306.406	2.308	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000261862042	535296628	/nfs/dbraw/zinc/29/66/28/535296628.db2.gz	KKLNNVDSAHHAHM-MRXNPFEDSA-N	0	3	319.424	2.253	10	0		DEAEHN
CC(C)OC[C@@H]1CN(C(=O)c2ccccc2CN(C)C)CCO1	ZINC000368281353	535347781	/nfs/dbraw/zinc/34/77/81/535347781.db2.gz	VNOLGOGMEKIQIR-INIZCTEOSA-N	0	3	320.433	2.014	10	0		DEAEHN
CCO[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCCN(CC)C2)C1(C)C	ZINC000247079206	535452267	/nfs/dbraw/zinc/45/22/67/535452267.db2.gz	VIJNQHWPNOSAMW-SOUVJXGZSA-N	0	3	311.470	2.316	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)N1CC[C@@H]2OCCC[C@H]2C1	ZINC000246780567	535483932	/nfs/dbraw/zinc/48/39/32/535483932.db2.gz	QTWMJXCJZGSUGK-XHSDSOJGSA-N	0	3	309.454	2.071	10	0		DEAEHN
CC[C@H](Oc1ccccc1C)c1nc([C@H]2CNCCN2C)no1	ZINC000263131020	536051993	/nfs/dbraw/zinc/05/19/93/536051993.db2.gz	BRHGCWRGEWLRQL-KGLIPLIRSA-N	0	3	316.405	2.484	10	0		DEAEHN
CC[C@H](CC1CCCC1)C(=O)N1CCN(CCN(C)C)CC1	ZINC000358802249	536088319	/nfs/dbraw/zinc/08/83/19/536088319.db2.gz	BVXSDCMNPCJAKZ-QGZVFWFLSA-N	0	3	309.498	2.299	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COc2ccccc2Cl)CC[C@H]1C	ZINC000251903576	536730497	/nfs/dbraw/zinc/73/04/97/536730497.db2.gz	RDSQIJBDQLDGSU-DVOMOZLQSA-N	0	3	313.825	2.437	10	0		DEAEHN
CO[C@@H]1CN(Cc2ccccc2OCC(=O)N(C)C)CC[C@H]1C	ZINC000249225248	536731951	/nfs/dbraw/zinc/73/19/51/536731951.db2.gz	UWLRDJXDCIFIHM-RHSMWYFYSA-N	0	3	320.433	2.010	10	0		DEAEHN
COC(=O)[C@H](c1ccccc1)N(C)C(=O)CC1CCN(C)CC1	ZINC000362808813	536759914	/nfs/dbraw/zinc/75/99/14/536759914.db2.gz	MLDHCMBVJNUVCW-KRWDZBQOSA-N	0	3	318.417	2.091	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)/C(C)=C\c1ccc(F)cc1	ZINC000255632109	625572018	/nfs/dbraw/zinc/57/20/18/625572018.db2.gz	PARUWCLXTIYWCT-BHEFUSTPSA-N	0	3	320.408	2.456	10	0		DEAEHN
COC[C@@H](C)NC(=S)N[C@@H](C)CN(C)Cc1ccccc1	ZINC000309907779	625596941	/nfs/dbraw/zinc/59/69/41/625596941.db2.gz	QZYBHASBFBAYKC-UONOGXRCSA-N	0	3	309.479	2.006	10	0		DEAEHN
COc1cccc(CC(=O)N2CCN([C@@H](C)C3CC3)CC2)c1	ZINC000074766955	624167071	/nfs/dbraw/zinc/16/70/71/624167071.db2.gz	FVIHMFREWVHMFX-AWEZNQCLSA-N	0	3	302.418	2.180	10	0		DEAEHN
Cc1c(CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cnn1C	ZINC000090201215	635999169	/nfs/dbraw/zinc/99/91/69/635999169.db2.gz	MQNQCPPTISPURD-AWEZNQCLSA-N	0	3	308.426	2.218	10	0		DEAEHN
c1cn(-c2ncccc2CNCc2ccc3[nH]cnc3c2)cn1	ZINC000727466469	637953611	/nfs/dbraw/zinc/95/36/11/637953611.db2.gz	UCJHKFHFNVYSDG-UHFFFAOYSA-N	0	3	304.357	2.433	10	0		DEAEHN
O[C@@H](CN1CCC(Nc2ccccn2)CC1)CC(F)(F)F	ZINC000526057020	639568925	/nfs/dbraw/zinc/56/89/25/639568925.db2.gz	WMZFXXZKQSTCOO-GFCCVEGCSA-N	0	3	303.328	2.271	10	0		DEAEHN
CCNC(=O)N1CC[C@H](N[C@H]2CCc3nc(Cl)ccc32)C1	ZINC000806148926	645803399	/nfs/dbraw/zinc/80/33/99/645803399.db2.gz	ZPAYBDGIERNDBD-JQWIXIFHSA-N	0	3	308.813	2.116	10	0		DEAEHN
CC(=O)N(C)C1CCN(C[C@@H](O)c2cc(C)cc(C)c2)CC1	ZINC000075676034	646603221	/nfs/dbraw/zinc/60/32/21/646603221.db2.gz	QMTVOZRBPTZUPK-GOSISDBHSA-N	0	3	304.434	2.280	10	0		DEAEHN
CN1CC[C@H]2C[N@H+](C/C=C\c3ccc(F)cc3)C[C@@]2(C(=O)[O-])C1	ZINC000229850076	646703617	/nfs/dbraw/zinc/70/36/17/646703617.db2.gz	RIRFLUOLNQJVAP-BVBZKVNYSA-N	0	3	318.392	2.177	10	0		DEAEHN
CN1CC[C@H]2C[N@@H+](C/C=C\c3ccc(F)cc3)C[C@@]2(C(=O)[O-])C1	ZINC000229850076	646703620	/nfs/dbraw/zinc/70/36/20/646703620.db2.gz	RIRFLUOLNQJVAP-BVBZKVNYSA-N	0	3	318.392	2.177	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)NCC2CCCCCCC2)CCO1	ZINC000172126101	646723845	/nfs/dbraw/zinc/72/38/45/646723845.db2.gz	BPXDFBJNHUVWQJ-INIZCTEOSA-N	0	3	311.470	2.319	10	0		DEAEHN
C[C@@H](NCc1ccc(S(=O)(=O)N(C)C)o1)C1CCCC1	ZINC000088540828	646892410	/nfs/dbraw/zinc/89/24/10/646892410.db2.gz	VFSVQMSGCUWFJX-LLVKDONJSA-N	0	3	300.424	2.198	10	0		DEAEHN
COC(=O)c1ccc2c(cnn2CN(C)C[C@@H]2CCCOC2)c1	ZINC000730807811	647408462	/nfs/dbraw/zinc/40/84/62/647408462.db2.gz	YTCRLNWFCAMXET-ZDUSSCGKSA-N	0	3	317.389	2.139	10	0		DEAEHN
O[C@@H](CN[C@H]1COc2ccccc21)COCc1cccs1	ZINC000070529740	648943242	/nfs/dbraw/zinc/94/32/42/648943242.db2.gz	WBQUMRLSDUQZLV-WFASDCNBSA-N	0	3	305.399	2.349	10	0		DEAEHN
CCc1nn(C)cc1CN[C@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000381596683	685401312	/nfs/dbraw/zinc/40/13/12/685401312.db2.gz	KGEHXNYHRCNYQD-NEPJUHHUSA-N	0	3	310.442	2.374	10	0		DEAEHN
CN(C[C@@H]1CCN(Cc2ccccc2)C1)c1ncc(C=O)cn1	ZINC000383150508	685406763	/nfs/dbraw/zinc/40/67/63/685406763.db2.gz	IJDVOHONVZYPSZ-INIZCTEOSA-N	0	3	310.401	2.247	10	0		DEAEHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1cn(C)cn1	ZINC000389805948	685436168	/nfs/dbraw/zinc/43/61/68/685436168.db2.gz	BMMFJJJOGFXARF-JSGCOSHPSA-N	0	3	308.426	2.155	10	0		DEAEHN
COCCN1CCN(Cn2cnc3cc(C)c(C)cc32)C[C@H]1C	ZINC000117322987	684068375	/nfs/dbraw/zinc/06/83/75/684068375.db2.gz	YAUNQGZFUKBEDT-MRXNPFEDSA-N	0	3	316.449	2.263	10	0		DEAEHN
CN(Cc1cc(=O)oc2cc3c(cc12)CCC3)CC1(CO)CC1	ZINC000190016113	684394776	/nfs/dbraw/zinc/39/47/76/684394776.db2.gz	XSAOBOGCMOOIBP-UHFFFAOYSA-N	0	3	313.397	2.486	10	0		DEAEHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2ccnc(C#N)c2)c1	ZINC000193530249	685042557	/nfs/dbraw/zinc/04/25/57/685042557.db2.gz	QZTSFMRSINTNDU-OAHLLOKOSA-N	0	3	304.309	2.223	10	0		DEAEHN
NC(=O)CC1CC(NCc2sccc2Br)C1	ZINC000718425339	777606242	/nfs/dbraw/zinc/60/62/42/777606242.db2.gz	HVYSZJISWHATQK-UHFFFAOYSA-N	0	3	303.225	2.254	10	0		DEAEHN
NC(=O)c1csc(CNC[C@@H]2CC[C@H](C(F)(F)F)O2)c1	ZINC000722402701	778707720	/nfs/dbraw/zinc/70/77/20/778707720.db2.gz	JLUBCPZLUNYECA-WCBMZHEXSA-N	0	3	308.325	2.047	10	0		DEAEHN
CCc1ccc([C@@H](C)NC[C@@]2(OC)CCS(=O)(=O)C2)s1	ZINC000721262336	781074972	/nfs/dbraw/zinc/07/49/72/781074972.db2.gz	TUKCETQQPZUGRQ-RISCZKNCSA-N	0	3	317.476	2.165	10	0		DEAEHN
C[C@H](N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C)c1ccnn1C	ZINC000721869171	787324336	/nfs/dbraw/zinc/32/43/36/787324336.db2.gz	WUDMDWOXNGXKFG-FRRDWIJNSA-N	0	3	308.426	2.326	10	0		DEAEHN
CN(CCOCC1CC1)C[C@@](C)(O)C(F)(F)C(F)(F)F	ZINC000724112641	787349939	/nfs/dbraw/zinc/34/99/39/787349939.db2.gz	VQOOQFWNCYHWTO-SNVBAGLBSA-N	0	3	305.287	2.293	10	0		DEAEHN
CS(=O)(=O)[C@H]1C[C@H](NCc2ccc(Br)cc2)C1	ZINC000714248695	792306561	/nfs/dbraw/zinc/30/65/61/792306561.db2.gz	NZWZTDYJILTZOR-HAQNSBGRSA-N	0	3	318.236	2.114	10	0		DEAEHN
C[C@@H](NCC1CC(NC(=O)OC(C)(C)C)C1)c1cnccn1	ZINC000715068771	792379781	/nfs/dbraw/zinc/37/97/81/792379781.db2.gz	ZBYXGZKYLWSHBF-PNESKVBLSA-N	0	3	306.410	2.431	10	0		DEAEHN
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C)c1cn(C)nn1	ZINC000715841130	792513309	/nfs/dbraw/zinc/51/33/09/792513309.db2.gz	ZDNYACMKGLTBBU-RWMBFGLXSA-N	0	3	323.441	2.111	10	0		DEAEHN
NC(=O)C1CC(NCc2ccc(Br)c(F)c2F)C1	ZINC000716769300	793006215	/nfs/dbraw/zinc/00/62/15/793006215.db2.gz	INOKEQUVMALPRI-UHFFFAOYSA-N	0	3	319.149	2.081	10	0		DEAEHN
C[C@@H]1C[C@@H](NCc2ccnn2C)CN(C(=O)OC(C)(C)C)C1	ZINC000401709106	801844613	/nfs/dbraw/zinc/84/46/13/801844613.db2.gz	CTOYHHFNIHVQOO-CHWSQXEVSA-N	0	3	308.426	2.155	10	0		DEAEHN
Cc1c(CN[C@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)cnn1C	ZINC000401717218	801845341	/nfs/dbraw/zinc/84/53/41/801845341.db2.gz	YTOAYCSSIFFGPI-WFASDCNBSA-N	0	3	322.453	2.464	10	0		DEAEHN
CCC1(O)CCC(NCc2cn(C)nc2Br)CC1	ZINC000720668720	1085838148	/nfs/dbraw/zinc/83/81/48/1085838148.db2.gz	GXLCCENPQNEXPI-UHFFFAOYSA-N	0	3	316.243	2.356	10	0		DEAEHN
C[C@H](N[C@@H]1CON(C(=O)OC(C)(C)C)C1)[C@H]1CCCCO1	ZINC000703289518	1086492076	/nfs/dbraw/zinc/49/20/76/1086492076.db2.gz	IPFHIHQPNSICER-RWMBFGLXSA-N	0	3	300.399	2.085	10	0		DEAEHN
COC[C@H](C)OC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000704405064	1086579457	/nfs/dbraw/zinc/57/94/57/1086579457.db2.gz	OBPINPPBUCUPOZ-IJEWVQPXSA-N	0	3	306.406	2.268	10	0		DEAEHN
C[C@@H]1[C@@H](NC(=O)c2cc(Cl)c(N)c(Cl)c2)CCN1C	ZINC000719391753	1089082706	/nfs/dbraw/zinc/08/27/06/1089082706.db2.gz	IRFRERKUNJPENT-HQJQHLMTSA-N	0	3	302.205	2.398	10	0		DEAEHN
c1cc2cc(-c3nc([C@H]4CN5CCC4CC5)no3)cnc2cn1	ZINC000350081272	1143030685	/nfs/dbraw/zinc/03/06/85/1143030685.db2.gz	YZZHHXBSCRLDKQ-AWEZNQCLSA-N	0	3	307.357	2.489	10	0		DEAEHN
CN(C)c1nnc(S[C@@H]2COc3ccccc3[C@@H]2N)s1	ZINC000081769340	192322347	/nfs/dbraw/zinc/32/23/47/192322347.db2.gz	GGEMDFAHLRWWQW-MNOVXSKESA-N	0	3	308.432	2.157	10	0		DEAEHN
CCN[C@H](CSCC(=O)OC)c1ccc(OC)cc1OC	ZINC000081793168	192323772	/nfs/dbraw/zinc/32/37/72/192323772.db2.gz	NGUJIGMVECKJFE-CYBMUJFWSA-N	0	3	313.419	2.261	10	0		DEAEHN
CCOCc1ccccc1CNC(=O)NC[C@@H]1CCCN1C	ZINC000139565389	282101638	/nfs/dbraw/zinc/10/16/38/282101638.db2.gz	KISLZLCYDAYRDW-INIZCTEOSA-N	0	3	305.422	2.117	10	0		DEAEHN
COCCN1CCC(NC(=O)N(C)Cc2ccc(F)cc2)CC1	ZINC000140206364	282102195	/nfs/dbraw/zinc/10/21/95/282102195.db2.gz	HODOXWZYJHJHJE-UHFFFAOYSA-N	0	3	323.412	2.078	10	0		DEAEHN
COCCN(CCOC)Cc1ccc(N)c(Br)c1	ZINC000078896972	185124927	/nfs/dbraw/zinc/12/49/27/185124927.db2.gz	NLQXEEGNYNYNJV-UHFFFAOYSA-N	0	3	317.227	2.126	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N(C)CC2(N(C)C)CCC2)cc1	ZINC000278715999	214349730	/nfs/dbraw/zinc/34/97/30/214349730.db2.gz	GZVAHUFFNBPKJS-UHFFFAOYSA-N	0	3	317.433	2.226	10	0		DEAEHN
C[C@@H]1CN(c2cccc(I)c2)CCN1	ZINC000083061323	185212325	/nfs/dbraw/zinc/21/23/25/185212325.db2.gz	VDURCNIVPAKKHK-SECBINFHSA-N	0	3	302.159	2.089	10	0		DEAEHN
COc1ccc(Br)c(C[C@@H](N)c2ccncn2)c1	ZINC000087795550	185232256	/nfs/dbraw/zinc/23/22/56/185232256.db2.gz	IMHLESGUYCBLRR-GFCCVEGCSA-N	0	3	308.179	2.490	10	0		DEAEHN
NC[C@H](NC[C@@H]1CCCO1)c1ccccc1OC(F)(F)F	ZINC000087928559	185237764	/nfs/dbraw/zinc/23/77/64/185237764.db2.gz	PXOMHDBGJNOACU-JQWIXIFHSA-N	0	3	304.312	2.354	10	0		DEAEHN
O=S(=O)([N-]c1ccc(-c2ccccc2)cc1)[C@@H]1CC[NH2+]C1	ZINC000088056699	185238466	/nfs/dbraw/zinc/23/84/66/185238466.db2.gz	UDQKNFAXZNTCFJ-MRXNPFEDSA-N	0	3	302.399	2.457	10	0		DEAEHN
CCN[C@H]1CCN(c2ccc(Br)c(F)c2)C1=O	ZINC000088084422	185239065	/nfs/dbraw/zinc/23/90/65/185239065.db2.gz	QDFQEBHDUVGMHJ-NSHDSACASA-N	0	3	301.159	2.303	10	0		DEAEHN
CN[C@H]1CCN(c2c(F)cc(Br)cc2F)C1=O	ZINC000088171602	185240899	/nfs/dbraw/zinc/24/08/99/185240899.db2.gz	HJGSOTXJFZIOOP-VIFPVBQESA-N	0	3	305.122	2.052	10	0		DEAEHN
CC[C@@H](CN)S(=O)(=O)N[C@H](C)C12CC3CC(CC(C3)C1)C2	ZINC000088471906	185251957	/nfs/dbraw/zinc/25/19/57/185251957.db2.gz	ASVDHEULBKBTQO-OMBAJQCTSA-N	0	3	314.495	2.248	10	0		DEAEHN
CCN[C@](C)(CCN1CCC(C(F)(F)F)CC1)C(=O)OC	ZINC000088435590	185250327	/nfs/dbraw/zinc/25/03/27/185250327.db2.gz	SQQBETFIJDVGJP-CYBMUJFWSA-N	0	3	310.360	2.192	10	0		DEAEHN
C[N-]S(=O)(=O)c1ccc(C[NH2+]C2C[C@@H](C)C[C@H](C)C2)o1	ZINC000088540908	185255910	/nfs/dbraw/zinc/25/59/10/185255910.db2.gz	JZNVSBUZXPCGEP-QWRGUYRKSA-N	0	3	300.424	2.102	10	0		DEAEHN
CC(C)C[C@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000088542299	185256328	/nfs/dbraw/zinc/25/63/28/185256328.db2.gz	SWZOCRUWJOQAMM-LBPRGKRZSA-N	0	3	302.440	2.491	10	0		DEAEHN
CC(C)C[C@H](C)NS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000088542299	185256329	/nfs/dbraw/zinc/25/63/29/185256329.db2.gz	SWZOCRUWJOQAMM-LBPRGKRZSA-N	0	3	302.440	2.491	10	0		DEAEHN
CCc1nc(CC)n(-c2ncc(Br)cc2CNC)n1	ZINC000088743811	185263615	/nfs/dbraw/zinc/26/36/15/185263615.db2.gz	IQKZVHXAAAQLGR-UHFFFAOYSA-N	0	3	324.226	2.269	10	0		DEAEHN
CC(C)[C@@H]1CCCN1S(=O)(=O)c1cccc2c1CCNC2	ZINC000088845423	185266881	/nfs/dbraw/zinc/26/68/81/185266881.db2.gz	IVNDBXCVIZULKA-HNNXBMFYSA-N	0	3	308.447	2.141	10	0		DEAEHN
CC(C)[C@@H]1CCCN1CC(=O)Nc1cccc(C(N)=S)c1	ZINC000088836973	185266887	/nfs/dbraw/zinc/26/68/87/185266887.db2.gz	XXHWFMYQAZXKFC-AWEZNQCLSA-N	0	3	305.447	2.380	10	0		DEAEHN
CCCN(c1ccccc1S(=O)(=O)C(F)(F)F)C1CNC1	ZINC000090294208	185289866	/nfs/dbraw/zinc/28/98/66/185289866.db2.gz	QAANVXUCSPZEID-UHFFFAOYSA-N	0	3	322.352	2.168	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1ccccc1C(F)(F)F	ZINC000090293336	185289871	/nfs/dbraw/zinc/28/98/71/185289871.db2.gz	WQUDWBADWVSHHG-UHFFFAOYSA-N	0	3	322.352	2.078	10	0		DEAEHN
C[C@@H]1OCCN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)[C@H]1C	ZINC000179259974	282221584	/nfs/dbraw/zinc/22/15/84/282221584.db2.gz	WDBPVGRITHZDFY-XJNFMUPTSA-N	0	3	317.433	2.251	10	0		DEAEHN
Cc1ccc(NC(=O)[C@]2(C)COC[C@H]2N)c(Br)c1	ZINC000090580189	185304983	/nfs/dbraw/zinc/30/49/83/185304983.db2.gz	KOLSQVAFSHXDLP-DGCLKSJQSA-N	0	3	313.195	2.060	10	0		DEAEHN
C[C@@]1(C(=O)Nc2cc(Cl)cc3cccnc32)COC[C@@H]1N	ZINC000090585362	185305209	/nfs/dbraw/zinc/30/52/09/185305209.db2.gz	BIBSTIDOIDKIJV-SWLSCSKDSA-N	0	3	305.765	2.191	10	0		DEAEHN
C[C@@]1(C(=O)Nc2ccc(Cl)c3ncccc23)COC[C@H]1N	ZINC000090588955	185305413	/nfs/dbraw/zinc/30/54/13/185305413.db2.gz	FMFDPSNHDSRVHH-IUODEOHRSA-N	0	3	305.765	2.191	10	0		DEAEHN
Cc1oc(CNC(C)C)cc1S(=O)(=O)NC1(C)CCC1	ZINC000168597279	197725563	/nfs/dbraw/zinc/72/55/63/197725563.db2.gz	FHCGULROJHQLJU-UHFFFAOYSA-N	0	3	300.424	2.307	10	0		DEAEHN
COc1cc(C[C@H]2[C@H](O)C3CCN2CC3)ccc1OC(C)C	ZINC000169966631	197762604	/nfs/dbraw/zinc/76/26/04/197762604.db2.gz	XCEDCTHOFMVHPW-MAUKXSAKSA-N	0	3	305.418	2.480	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cc(F)ccc1Br	ZINC000194722270	530063821	/nfs/dbraw/zinc/06/38/21/530063821.db2.gz	RNRKROMRCBGRPY-JTQLQIEISA-N	0	3	315.186	2.412	10	0		DEAEHN
Cc1ccc(NC(=O)COC2(C)CNC2)cc1C(F)(F)F	ZINC000098060634	539435879	/nfs/dbraw/zinc/43/58/79/539435879.db2.gz	PDEUAKBZTQTCFA-UHFFFAOYSA-N	0	3	302.296	2.331	10	0		DEAEHN
CC1(OCC(=O)Nc2ccc(F)c(C(F)(F)F)c2)CNC1	ZINC000098060807	539436040	/nfs/dbraw/zinc/43/60/40/539436040.db2.gz	XRKLSYWZAMNMIS-UHFFFAOYSA-N	0	3	306.259	2.162	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](NC[C@@]1(CCO)CCOC1)CCCO2	ZINC000125478141	539472563	/nfs/dbraw/zinc/47/25/63/539472563.db2.gz	CYCPGQZTZYDUFY-FUHWJXTLSA-N	0	3	321.417	2.288	10	0		DEAEHN
NCc1ccc(Br)cc1N1[C@@H]2CC[C@H]1CC(O)C2	ZINC000111392756	185591593	/nfs/dbraw/zinc/59/15/93/185591593.db2.gz	LNKQIUHBXSPGCA-FUNVUKJBSA-N	0	3	311.223	2.400	10	0		DEAEHN
c1ccc(Cc2nnc(N3CCN4CCC[C@@H]4C3)s2)cc1	ZINC000181891212	199364609	/nfs/dbraw/zinc/36/46/09/199364609.db2.gz	SPOUATFOSQEZNG-CQSZACIVSA-N	0	3	300.431	2.413	10	0		DEAEHN
CCOc1ccc(OC[C@H](O)CN2[C@H](C)CC(O)C[C@H]2C)cc1	ZINC000248829900	282530793	/nfs/dbraw/zinc/53/07/93/282530793.db2.gz	LHPBWDWTPLPOEK-IIAWOOMASA-N	0	3	323.433	2.059	10	0		DEAEHN
CCN[C@H](c1ccc(OC)c(OC)c1)C(C)(C)S(C)(=O)=O	ZINC000070128756	190860633	/nfs/dbraw/zinc/86/06/33/190860633.db2.gz	SOEBZUIDVYQSJW-CQSZACIVSA-N	0	3	315.435	2.178	10	0		DEAEHN
CN[C@H]1Cc2ccccc2N(S(=O)(=O)c2ccccc2)C1	ZINC000616689238	362910082	/nfs/dbraw/zinc/91/00/82/362910082.db2.gz	CCLFVZSZMJQDEB-AWEZNQCLSA-N	0	3	302.399	2.026	10	0		DEAEHN
O=C1[C@@H](N[C@@H]2CCCOC2)CCCN1Cc1ccc(F)cc1F	ZINC000191647604	539702898	/nfs/dbraw/zinc/70/28/98/539702898.db2.gz	OXQFOWKLQRIYQN-ZBFHGGJFSA-N	0	3	324.371	2.224	10	0		DEAEHN
CC(C)c1ccc([C@H](C)NCc2cc(=O)n(C)c(=O)n2C)cc1	ZINC000192479927	539707154	/nfs/dbraw/zinc/70/71/54/539707154.db2.gz	FLMWRGFTVSKNDN-ZDUSSCGKSA-N	0	3	315.417	2.058	10	0		DEAEHN
CCc1nnsc1C(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000192933755	539710276	/nfs/dbraw/zinc/71/02/76/539710276.db2.gz	BBXDJMPIHPNDIT-ZDUSSCGKSA-N	0	3	304.419	2.133	10	0		DEAEHN
NC[C@H](NC[C@H]1CCCO1)c1cc(Br)cs1	ZINC000083774354	192383251	/nfs/dbraw/zinc/38/32/51/192383251.db2.gz	NBSGKZQJYLGWFH-ZJUUUORDSA-N	0	3	305.241	2.279	10	0		DEAEHN
CN(CC(N)=S)Cc1ccc(I)cc1	ZINC000083849633	192386865	/nfs/dbraw/zinc/38/68/65/192386865.db2.gz	ITIRZXOJQDHIFN-UHFFFAOYSA-N	0	3	320.199	2.009	10	0		DEAEHN
CNC(=O)c1ccc(Cl)c(NC(=O)[C@H]2CCCCCN2)c1	ZINC000083896781	192390316	/nfs/dbraw/zinc/39/03/16/192390316.db2.gz	PEIBZFDXVFUCCV-GFCCVEGCSA-N	0	3	309.797	2.170	10	0		DEAEHN
CC(=O)N1C[C@@H](C(C)C)Oc2ccc(C(=O)[C@H]3CCCN3)cc21	ZINC000071664389	191000506	/nfs/dbraw/zinc/00/05/06/191000506.db2.gz	DYCUWUCVWCNVPL-PBHICJAKSA-N	0	3	316.401	2.391	10	0		DEAEHN
Cc1nn(C)c(C)c1CN1Cc2c(cccc2N(C)C)[C@H]1CN	ZINC000071683404	191007033	/nfs/dbraw/zinc/00/70/33/191007033.db2.gz	SEUBENHWWAXAFH-GOSISDBHSA-N	0	3	313.449	2.119	10	0		DEAEHN
COc1cc2c(c(OC)c1)[C@@H](CN)N(CCCOC(C)C)C2	ZINC000071683939	191008081	/nfs/dbraw/zinc/00/80/81/191008081.db2.gz	RPSLCDDMWFTJRC-OAHLLOKOSA-N	0	3	308.422	2.334	10	0		DEAEHN
CC(=O)Nc1ccc(N[C@@H](C)C[C@H]2COCCN2)cc1Cl	ZINC000133611312	186000029	/nfs/dbraw/zinc/00/00/29/186000029.db2.gz	RHCSJOXHFOQNKZ-GWCFXTLKSA-N	0	3	311.813	2.477	10	0		DEAEHN
C[C@H](CNC(=O)[C@@H]1CCCc2n[nH]cc21)N1CCC(C)CC1	ZINC000133736259	186010559	/nfs/dbraw/zinc/01/05/59/186010559.db2.gz	XMRZJSYSZMVKRB-ZIAGYGMSSA-N	0	3	304.438	2.066	10	0		DEAEHN
CC[C@H](C)CN(C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138471224	186017148	/nfs/dbraw/zinc/01/71/48/186017148.db2.gz	JGYYRCAPPMLDNF-VIFPVBQESA-N	0	3	306.378	2.090	10	0		DEAEHN
CC(C)C[C@H](C)N(C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138809644	186019042	/nfs/dbraw/zinc/01/90/42/186019042.db2.gz	JBKOUMMNDMRLKD-JTQLQIEISA-N	0	3	320.405	2.479	10	0		DEAEHN
CC[C@@H]1CN(c2ncnc3c(C)cccc32)CCN1C[C@H](C)O	ZINC000246446146	539764410	/nfs/dbraw/zinc/76/44/10/539764410.db2.gz	BPRIPESMJMOFLS-LSDHHAIUSA-N	0	3	314.433	2.220	10	0		DEAEHN
CCS(=O)(=O)CCC[C@H](N)c1ccc(Br)cn1	ZINC000140189016	186026428	/nfs/dbraw/zinc/02/64/28/186026428.db2.gz	AELRWRDLAIZMFS-JTQLQIEISA-N	0	3	321.240	2.059	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)Nc2cnn(CC3CC3)c2)C1	ZINC000246601481	539765495	/nfs/dbraw/zinc/76/54/95/539765495.db2.gz	ZNCXPJNEUHEROA-IUODEOHRSA-N	0	3	305.426	2.143	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)N2CCCN(C3CC3)CC2)c1	ZINC000143850620	186034232	/nfs/dbraw/zinc/03/42/32/186034232.db2.gz	FWXWMJXSIOFLRD-UHFFFAOYSA-N	0	3	316.449	2.450	10	0		DEAEHN
CN1CC[C@H](N2C(=O)C3(CCCC3)N[C@H]2c2ccsc2)C1	ZINC000145216096	186036646	/nfs/dbraw/zinc/03/66/46/186036646.db2.gz	HRKOFVPIQOKVGI-UONOGXRCSA-N	0	3	305.447	2.195	10	0		DEAEHN
CCCN[C@@H](c1cc(F)cc(F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000150179416	186055422	/nfs/dbraw/zinc/05/54/22/186055422.db2.gz	UBHUJNFKCPZDSS-IINYFYTJSA-N	0	3	303.374	2.440	10	0		DEAEHN
CCc1cccc(NC(=O)C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000150795920	186066204	/nfs/dbraw/zinc/06/62/04/186066204.db2.gz	RXJJENMIXUQEPP-BBRMVZONSA-N	0	3	317.433	2.032	10	0		DEAEHN
Brc1ccc2c(c1)CC[C@@H]2NCCn1cncn1	ZINC000268793883	282690604	/nfs/dbraw/zinc/69/06/04/282690604.db2.gz	CVLOKORILSOSPT-ZDUSSCGKSA-N	0	3	307.195	2.318	10	0		DEAEHN
Fc1ccc(Br)cc1COC[C@@H]1CNCCO1	ZINC000163992260	186145202	/nfs/dbraw/zinc/14/52/02/186145202.db2.gz	SCZVLCKDWSQTPU-NSHDSACASA-N	0	3	304.159	2.093	10	0		DEAEHN
CC1CC([N-]S(=O)(=O)c2ccc(CC[NH2+]C3CC3)s2)C1	ZINC000163996951	186145528	/nfs/dbraw/zinc/14/55/28/186145528.db2.gz	XZHGZDWPYKITDY-UHFFFAOYSA-N	0	3	314.476	2.119	10	0		DEAEHN
CC(C)Cn1ncc(C(=O)N2CC[C@@H](N(C)C)C2)c1C1CC1	ZINC000155871018	186119700	/nfs/dbraw/zinc/11/97/00/186119700.db2.gz	CSVUBHBMIKUVTP-CQSZACIVSA-N	0	3	304.438	2.193	10	0		DEAEHN
C[C@H](C(=O)Nc1ccccc1CN)[S@@](=O)c1ccccc1	ZINC000155907961	186122300	/nfs/dbraw/zinc/12/23/00/186122300.db2.gz	QCAWBIDARBZNTF-GTJPDFRWSA-N	0	3	302.399	2.280	10	0		DEAEHN
C[C@H](C(=O)Nc1cccc(CN)c1)[S@](=O)c1ccccc1	ZINC000155907475	186122425	/nfs/dbraw/zinc/12/24/25/186122425.db2.gz	OXCHWMGOONADTG-XUSGNXJCSA-N	0	3	302.399	2.280	10	0		DEAEHN
CCc1nnc(NC(=O)N2CCC[C@H]2CN2CCCC2)s1	ZINC000171504118	186169898	/nfs/dbraw/zinc/16/98/98/186169898.db2.gz	RTRGCSKQFYZKJN-NSHDSACASA-N	0	3	309.439	2.193	10	0		DEAEHN
Cc1ccc([C@@H](N)[C@@H]2CCS(=O)(=O)C2)c(Br)c1	ZINC000164264541	186153912	/nfs/dbraw/zinc/15/39/12/186153912.db2.gz	FGRTUWVHYSDVJD-SKDRFNHKSA-N	0	3	318.236	2.192	10	0		DEAEHN
CC(C(=O)NCc1ccc(OC(F)(F)F)cc1)=C1CNC1	ZINC000164411682	186158467	/nfs/dbraw/zinc/15/84/67/186158467.db2.gz	WXTVIKGTJRYZIC-UHFFFAOYSA-N	0	3	300.280	2.121	10	0		DEAEHN
C[C@@H]1C[C@@H](Nc2ccccc2SCC(N)=O)CN1C1CC1	ZINC000164409719	186158709	/nfs/dbraw/zinc/15/87/09/186158709.db2.gz	BKFJPDJFWMLFJV-VXGBXAGGSA-N	0	3	305.447	2.301	10	0		DEAEHN
CCC(=O)Nc1ccc(NC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000171889983	198001661	/nfs/dbraw/zinc/00/16/61/198001661.db2.gz	CXNSUSHQZHSZDS-OAHLLOKOSA-N	0	3	316.405	2.347	10	0		DEAEHN
Cc1nc2ccc(NC(=O)N3CCN4CCC[C@@H]4C3)cc2o1	ZINC000171888279	198002451	/nfs/dbraw/zinc/00/24/51/198002451.db2.gz	FHZXGNRWOVRMEN-CYBMUJFWSA-N	0	3	300.362	2.448	10	0		DEAEHN
O=C(N[C@H]1CCc2cc(F)ccc21)N1CCN2CCC[C@@H]2C1	ZINC000171904233	198004976	/nfs/dbraw/zinc/00/49/76/198004976.db2.gz	FPNLBTLPWYMIEN-ZBFHGGJFSA-N	0	3	303.381	2.303	10	0		DEAEHN
CC(C)(C)c1csc(CNC(=O)N2CCN3CCC[C@@H]3C2)n1	ZINC000171907491	198005896	/nfs/dbraw/zinc/00/58/96/198005896.db2.gz	MXOBEHGTUYHTLN-GFCCVEGCSA-N	0	3	322.478	2.430	10	0		DEAEHN
CC(C)(O)CN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000171917673	198008293	/nfs/dbraw/zinc/00/82/93/198008293.db2.gz	UAGRYTSHYSHFTG-UHFFFAOYSA-N	0	3	309.385	2.183	10	0		DEAEHN
Cc1cccc(NC(=O)CN[C@@H](CC(N)=O)C2CCCCC2)c1	ZINC000182045769	199378728	/nfs/dbraw/zinc/37/87/28/199378728.db2.gz	WFAVMNBFCDLSDQ-INIZCTEOSA-N	0	3	317.433	2.347	10	0		DEAEHN
O=C(Nc1cnn(-c2ccccc2)c1)N1CCN2CCC[C@@H]2C1	ZINC000172641776	198130857	/nfs/dbraw/zinc/13/08/57/198130857.db2.gz	CBLZJFWTFKPUON-MRXNPFEDSA-N	0	3	311.389	2.184	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)CCCS(=O)(=O)c2ccccc2)CCN1C	ZINC000172846453	198157634	/nfs/dbraw/zinc/15/76/34/198157634.db2.gz	NQTFLDASUJODRU-HZPDHXFCSA-N	0	3	324.490	2.265	10	0		DEAEHN
Cc1cc(NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)ccc1C(N)=O	ZINC000173081195	198183852	/nfs/dbraw/zinc/18/38/52/198183852.db2.gz	XEXVHGQLWOIKRL-TZMCWYRMSA-N	0	3	318.421	2.040	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCc2cccc(F)c2)CCN1C	ZINC000173541711	198225427	/nfs/dbraw/zinc/22/54/27/198225427.db2.gz	HOULPRGPKIUSMX-CJNGLKHVSA-N	0	3	307.413	2.492	10	0		DEAEHN
CCn1nc(C)c(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1Cl	ZINC000173744222	198247573	/nfs/dbraw/zinc/24/75/73/198247573.db2.gz	SGDWTZWXWYUQDG-CMPLNLGQSA-N	0	3	310.829	2.174	10	0		DEAEHN
Cc1cccc(O[C@@H](C)CNC(=O)NC[C@@H]2CCCN2C)c1	ZINC000174351312	198323005	/nfs/dbraw/zinc/32/30/05/198323005.db2.gz	ISCNMCCSUJWQHQ-GJZGRUSLSA-N	0	3	305.422	2.156	10	0		DEAEHN
CC[NH+](CC)C[C@@H]1CCN(C(=O)c2cccc(OC)c2[O-])C1	ZINC000174757703	198380755	/nfs/dbraw/zinc/38/07/55/198380755.db2.gz	UVDYFMIMPDJCKM-ZDUSSCGKSA-N	0	3	306.406	2.205	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)c2ccc(C)cc2)C[C@@H]1CC	ZINC000174782750	198384272	/nfs/dbraw/zinc/38/42/72/198384272.db2.gz	DKOQXZQHVYEOIB-OALUTQOASA-N	0	3	320.477	2.461	10	0		DEAEHN
C[C@H]1CS(=O)(=O)C[C@H]1NC1CC(C)(c2ccc(F)cc2)C1	ZINC000367720495	291006898	/nfs/dbraw/zinc/00/68/98/291006898.db2.gz	MBKYXXXLPYATIB-WVYASWFKSA-N	0	3	311.422	2.269	10	0		DEAEHN
c1ccc(OCCOCCN2CCN(CC3CC3)CC2)cc1	ZINC000052165654	354396794	/nfs/dbraw/zinc/39/67/94/354396794.db2.gz	JIGJMFPCVZTBKW-UHFFFAOYSA-N	0	3	304.434	2.110	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)c1c[nH]nc1-c1ccc(F)cc1	ZINC000055209294	354488716	/nfs/dbraw/zinc/48/87/16/354488716.db2.gz	SXVJLMOCSYVHCZ-CQSZACIVSA-N	0	3	316.380	2.430	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)[C@H]1CC(=O)Nc2ccccc21	ZINC000060524422	354617296	/nfs/dbraw/zinc/61/72/96/354617296.db2.gz	BGEFMBHPDRVNAT-ZFWWWQNUSA-N	0	3	315.417	2.103	10	0		DEAEHN
CC(C)[C@@H]1C[C@@H](NCc2cccc(S(C)(=O)=O)c2)CCO1	ZINC000449251211	535268672	/nfs/dbraw/zinc/26/86/72/535268672.db2.gz	NWKWUYGHPLIQHE-HOCLYGCPSA-N	0	3	311.447	2.383	10	0		DEAEHN
Cc1ccc2c(c1C)OC[C@@H]2NC(=O)NC1CCN(C)CC1	ZINC000077511093	355210130	/nfs/dbraw/zinc/21/01/30/355210130.db2.gz	VDWOBLWLUBHFAB-HNNXBMFYSA-N	0	3	303.406	2.130	10	0		DEAEHN
O=S1(=O)CC(CCNCc2sccc2Br)C1	ZINC000381407495	540122939	/nfs/dbraw/zinc/12/29/39/540122939.db2.gz	RVGDDLXEIMSBKU-UHFFFAOYSA-N	0	3	324.265	2.035	10	0		DEAEHN
CC[C@H]1CN(C(=O)N[C@@H](CC(C)C)CN(C)C)CCS1	ZINC000073722561	191348621	/nfs/dbraw/zinc/34/86/21/191348621.db2.gz	AMOOEQZTKPHACV-KBPBESRZSA-N	0	3	301.500	2.500	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)NC2CCN(C3CC3)CC2)c1	ZINC000074908689	191383793	/nfs/dbraw/zinc/38/37/93/191383793.db2.gz	LUWAZQSBLZKVMS-UHFFFAOYSA-N	0	3	301.390	2.002	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1ccc2c(c1)CCC2	ZINC000110086389	355741301	/nfs/dbraw/zinc/74/13/01/355741301.db2.gz	BSVUXLKAVBGTLY-KRWDZBQOSA-N	0	3	317.433	2.408	10	0		DEAEHN
CCOC(=O)C(CCN(C)C)(Cc1ccccc1)C(=O)OCC	ZINC000138345298	355871066	/nfs/dbraw/zinc/87/10/66/355871066.db2.gz	ACKPFPBDEOFVIN-UHFFFAOYSA-N	0	3	321.417	2.293	10	0		DEAEHN
COc1ccc([C@@H](C)NC(=O)NC[C@H]2CCCN2C)cc1OC	ZINC000139681972	355880032	/nfs/dbraw/zinc/88/00/32/355880032.db2.gz	JIVQUUWISMBGOD-TZMCWYRMSA-N	0	3	321.421	2.158	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)NCCN(C)C(C)C)cc1CC	ZINC000180047807	356040316	/nfs/dbraw/zinc/04/03/16/356040316.db2.gz	OISIPXXLTDPMBP-UHFFFAOYSA-N	0	3	319.449	2.206	10	0		DEAEHN
COCCN(C)CCNC(=O)CC1CCC(C(F)(F)F)CC1	ZINC000183052150	356157571	/nfs/dbraw/zinc/15/75/71/356157571.db2.gz	FVGDNJFMCNTSHF-UHFFFAOYSA-N	0	3	324.387	2.440	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)NC1CCSCC1	ZINC000195470536	356254594	/nfs/dbraw/zinc/25/45/94/356254594.db2.gz	XQVDQQBSMKWNBP-MRXNPFEDSA-N	0	3	321.490	2.354	10	0		DEAEHN
NCc1ccc(I)c(OC(F)(F)F)n1	ZINC000238680977	356305281	/nfs/dbraw/zinc/30/52/81/356305281.db2.gz	VAKMWVAESCGJPB-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
C[C@H]1CCC[C@](N)(C(=O)Nc2cc(C(N)=O)ccc2Cl)C1	ZINC000080913788	192200374	/nfs/dbraw/zinc/20/03/74/192200374.db2.gz	SLNXIHLMQYOUNL-BJOHPYRUSA-N	0	3	309.797	2.285	10	0		DEAEHN
O=C(NCC1CCN(CCO)CC1)[C@@H]1CC[C@H]2CCCC[C@H]2C1	ZINC000248144096	356321258	/nfs/dbraw/zinc/32/12/58/356321258.db2.gz	ZCYPLXGQFWYTQB-FGTMMUONSA-N	0	3	322.493	2.413	10	0		DEAEHN
COC[C@@H]1CCN(c2nc3sccn3c2CNC(C)C)C1	ZINC000081080510	192223769	/nfs/dbraw/zinc/22/37/69/192223769.db2.gz	GMLMWUJPOBPCNR-GFCCVEGCSA-N	0	3	308.451	2.367	10	0		DEAEHN
CN(CC1CC1)C[C@@H]1CN(C(=O)CC2=CCCCC2)CCO1	ZINC000328629494	356464190	/nfs/dbraw/zinc/46/41/90/356464190.db2.gz	IHRXCLBVCOGNDL-QGZVFWFLSA-N	0	3	306.450	2.446	10	0		DEAEHN
NC[C@H](c1cccc(Cl)c1Cl)N1CCn2cnnc2C1	ZINC000081532931	192284675	/nfs/dbraw/zinc/28/46/75/192284675.db2.gz	HZGSFJRZHLBZLT-LLVKDONJSA-N	0	3	312.204	2.101	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)Nc1ccc(C(=O)NC(C)C)c(C)c1	ZINC000237005486	202118840	/nfs/dbraw/zinc/11/88/40/202118840.db2.gz	FBJQOEDSDYEXTE-IAQYHMDHSA-N	0	3	305.422	2.445	10	0		DEAEHN
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CSC2(C)C)c1	ZINC000578642547	356849987	/nfs/dbraw/zinc/84/99/87/356849987.db2.gz	PUDXGCMIIOCILF-DZGCQCFKSA-N	0	3	309.431	2.113	10	0		DEAEHN
c1cnn(Cc2noc([C@@H]3CCN(Cc4ccccc4)C3)n2)c1	ZINC000579614261	357005877	/nfs/dbraw/zinc/00/58/77/357005877.db2.gz	XHBQHKSMOOAXGP-OAHLLOKOSA-N	0	3	309.373	2.304	10	0		DEAEHN
NCc1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000088913402	192654340	/nfs/dbraw/zinc/65/43/40/192654340.db2.gz	QCKQZBOXLRDZKL-UHFFFAOYSA-N	0	3	302.827	2.363	10	0		DEAEHN
O=C(NCCNc1ccncc1)Nc1ccc2c(c1)CCCO2	ZINC000584803839	357312341	/nfs/dbraw/zinc/31/23/41/357312341.db2.gz	BYXSVUMZJQOAHA-UHFFFAOYSA-N	0	3	312.373	2.062	10	0		DEAEHN
CCc1ccc(CN)cc1S(=O)(=O)NCc1ccccc1	ZINC000088983124	192681559	/nfs/dbraw/zinc/68/15/59/192681559.db2.gz	XFDWAVABGYOKBQ-UHFFFAOYSA-N	0	3	304.415	2.186	10	0		DEAEHN
CC[C@@H](Nc1ccccc1)C(=O)Nc1cnn(CCN(C)C)c1	ZINC000588763917	357421903	/nfs/dbraw/zinc/42/19/03/357421903.db2.gz	AJKJACVORRROOH-MRXNPFEDSA-N	0	3	315.421	2.274	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCC2CCOCC2)[C@@H]1c1ccccc1	ZINC000179189648	198996623	/nfs/dbraw/zinc/99/66/23/198996623.db2.gz	OMPVQDHBBIBCHM-SJORKVTESA-N	0	3	317.433	2.158	10	0		DEAEHN
CN1CC[C@H](NC(=O)Cc2ccccc2O)[C@@H]1c1ccccc1	ZINC000179223445	199001661	/nfs/dbraw/zinc/00/16/61/199001661.db2.gz	IRLIQGDVYKHYPY-LPHOPBHVSA-N	0	3	310.397	2.496	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccc(Cn2cccn2)cc1)N(C)C	ZINC000179436719	199035461	/nfs/dbraw/zinc/03/54/61/199035461.db2.gz	LBGDAZHSSFXXET-KRWDZBQOSA-N	0	3	314.433	2.278	10	0		DEAEHN
CCn1cc(S(=O)(=O)N(CC(C)C)C2CC2)cc1CNC	ZINC000089004381	192692136	/nfs/dbraw/zinc/69/21/36/192692136.db2.gz	QCWNARRNEYBPRU-UHFFFAOYSA-N	0	3	313.467	2.037	10	0		DEAEHN
O[C@@H](COC[C@@H]1CCCO1)CN1CCCc2sccc2C1	ZINC000593439697	358079257	/nfs/dbraw/zinc/07/92/57/358079257.db2.gz	BLZHSROVTVDHDV-CABCVRRESA-N	0	3	311.447	2.053	10	0		DEAEHN
COCCN1CCN(C[C@@H](C)c2ccc(OC)cc2)C[C@H]1C	ZINC000180086171	199115689	/nfs/dbraw/zinc/11/56/89/199115689.db2.gz	HHKKTGWKZJRMAV-HZPDHXFCSA-N	0	3	306.450	2.451	10	0		DEAEHN
Cc1cc(C(=O)NC[C@@H]2CCCN2C)nn1-c1ccc(C)cc1	ZINC000180397495	199153313	/nfs/dbraw/zinc/15/33/13/199153313.db2.gz	DXWVPBQQGGPHKD-INIZCTEOSA-N	0	3	312.417	2.313	10	0		DEAEHN
[NH3+]C[C@@H]1CCCC[C@@H]1C[N-]S(=O)(=O)c1ccc(F)c(F)c1	ZINC000089532103	192812211	/nfs/dbraw/zinc/81/22/11/192812211.db2.gz	MAVPTEAWTHRFLP-WDEREUQCSA-N	0	3	318.389	2.008	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1ccnc2ccncc21	ZINC000187177395	200072983	/nfs/dbraw/zinc/07/29/83/200072983.db2.gz	NVUUBYJVBLQELN-CYBMUJFWSA-N	0	3	300.406	2.336	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N(C)C[C@H]1CCCN(C)C1	ZINC000187484277	200118258	/nfs/dbraw/zinc/11/82/58/200118258.db2.gz	CGWOBPILTOMMPQ-KBPBESRZSA-N	0	3	320.437	2.134	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N(C)[C@H]1CCN(C)C[C@@H]1C	ZINC000187910883	200174943	/nfs/dbraw/zinc/17/49/43/200174943.db2.gz	CSKJYRJADICPIT-WFASDCNBSA-N	0	3	323.412	2.316	10	0		DEAEHN
O=C(c1cccc(CN2CCCC2)c1)N1CC(n2ccnc2)C1	ZINC000603917108	360873039	/nfs/dbraw/zinc/87/30/39/360873039.db2.gz	BVNZVBULQWCUPP-UHFFFAOYSA-N	0	3	310.401	2.176	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1Cc2ccc(C(=O)OC)cc2C1	ZINC000609308934	361298514	/nfs/dbraw/zinc/29/85/14/361298514.db2.gz	TXBMZPXJLQFWGI-INIZCTEOSA-N	0	3	316.401	2.190	10	0		DEAEHN
O=C(c1cc(O)ccc1C(F)(F)F)N1CCN2CCC[C@@H]2C1	ZINC000193174715	201002828	/nfs/dbraw/zinc/00/28/28/201002828.db2.gz	JSYBHISJKJEUKU-SNVBAGLBSA-N	0	3	314.307	2.331	10	0		DEAEHN
COC(=O)[C@@H](NC1CCN([C@H](C)c2ccncc2)CC1)C1CC1	ZINC000358844664	291264119	/nfs/dbraw/zinc/26/41/19/291264119.db2.gz	DTDUBDYHLNNVDS-DYVFJYSZSA-N	0	3	317.433	2.148	10	0		DEAEHN
C[C@@H]1CCNC(=O)[C@@H]1NCc1ccc(SC(=O)N(C)C)cc1	ZINC000193635498	201091856	/nfs/dbraw/zinc/09/18/56/201091856.db2.gz	LQSKTXNBPINNBC-BXUZGUMPSA-N	0	3	321.446	2.075	10	0		DEAEHN
Cc1cnc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)o1	ZINC000195292716	201376026	/nfs/dbraw/zinc/37/60/26/201376026.db2.gz	BSONVYDYCLPMHP-MRXNPFEDSA-N	0	3	300.406	2.332	10	0		DEAEHN
C[C@H](C(=O)Nc1nc2ccccc2s1)N1CC[C@H](N(C)C)C1	ZINC000623014928	364855406	/nfs/dbraw/zinc/85/54/06/364855406.db2.gz	AGLQTYVRXWXCHA-NEPJUHHUSA-N	0	3	318.446	2.259	10	0		DEAEHN
Cc1ccc(CN(C)CCN(C)CCO)cc1Br	ZINC000623091060	364881819	/nfs/dbraw/zinc/88/18/19/364881819.db2.gz	MWLSAVLZZQSFKZ-UHFFFAOYSA-N	0	3	315.255	2.113	10	0		DEAEHN
c1cc(CN[C@H]2CCOC3(CCC3)C2)nc(N2CCOCC2)c1	ZINC000449258962	240267538	/nfs/dbraw/zinc/26/75/38/240267538.db2.gz	RREPUTMAVCBQFV-HNNXBMFYSA-N	0	3	317.433	2.110	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2cccc(C)c2C)CC12COC2	ZINC000449357511	240396330	/nfs/dbraw/zinc/39/63/30/240396330.db2.gz	DPBUXZCYKOMTOW-MRXNPFEDSA-N	0	3	303.402	2.315	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2cc3ccccc3o2)CC12COC2	ZINC000449356688	240399893	/nfs/dbraw/zinc/39/98/93/240399893.db2.gz	CMMJXCGHAGJQGZ-OAHLLOKOSA-N	0	3	315.369	2.444	10	0		DEAEHN
c1cc(CNC[C@@H]2CCN2C2CCCC2)n(-c2ccccn2)n1	ZINC000623728846	365152382	/nfs/dbraw/zinc/15/23/82/365152382.db2.gz	BYBVOTPNYWALAV-INIZCTEOSA-N	0	3	311.433	2.374	10	0		DEAEHN
CCCc1c(CNC(C)(C)C)cnn1[C@@H]1CCS(=O)(=O)C1	ZINC000091336107	193041920	/nfs/dbraw/zinc/04/19/20/193041920.db2.gz	ARVNSFAFRQRTOI-CYBMUJFWSA-N	0	3	313.467	2.083	10	0		DEAEHN
CCNc1ccc(Cl)c(C(=O)N2CCC[C@H](N(C)C)C2)n1	ZINC000091432077	193054691	/nfs/dbraw/zinc/05/46/91/193054691.db2.gz	IALSIQVWEBBCRQ-NSHDSACASA-N	0	3	310.829	2.333	10	0		DEAEHN
Cc1cc([C@@H](N)[C@@H]2CCS(=O)(=O)C2)ccc1Br	ZINC000091474285	193061385	/nfs/dbraw/zinc/06/13/85/193061385.db2.gz	GHIDKBRZSYKJKC-ZYHUDNBSSA-N	0	3	318.236	2.192	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@H]1O)c1cc(Br)cs1	ZINC000624238180	365347392	/nfs/dbraw/zinc/34/73/92/365347392.db2.gz	LWEYOMCZQINJLP-UJNFCWOMSA-N	0	3	306.225	2.311	10	0		DEAEHN
O[C@@H]1COCC[C@@H]1N[C@H]1CCc2sc(Br)cc21	ZINC000624239145	365347481	/nfs/dbraw/zinc/34/74/81/365347481.db2.gz	FGAYVLPKVNFOHB-LPEHRKFASA-N	0	3	318.236	2.237	10	0		DEAEHN
c1ccc2sc(CNC[C@@H]3CN4CCC[C@@H]4CO3)nc2c1	ZINC000091668826	193088616	/nfs/dbraw/zinc/08/86/16/193088616.db2.gz	VMEXGQDPHLBFGZ-CHWSQXEVSA-N	0	3	303.431	2.249	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(N)=O)CN1CCOc1ccc(F)cc1Cl	ZINC000091741667	193100432	/nfs/dbraw/zinc/10/04/32/193100432.db2.gz	XRKWUTXBPVQMSN-GHMZBOCLSA-N	0	3	314.788	2.444	10	0		DEAEHN
c1cc2c(c(-c3ccc(N4CCNCC4)nc3)c1)OCCCO2	ZINC000629739178	367322209	/nfs/dbraw/zinc/32/22/09/367322209.db2.gz	NHDJLFZCXLOYGV-UHFFFAOYSA-N	0	3	311.385	2.320	10	0		DEAEHN
c1ccc([C@H](NCCN2C[C@H]3CC[C@@H](C2)O3)C2CCC2)nc1	ZINC000528658559	283966290	/nfs/dbraw/zinc/96/62/90/283966290.db2.gz	NFZDLPCCEHWHNY-SOLBZPMBSA-N	0	3	301.434	2.376	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2ccc(CNC(C)(C)C)o2)C[C@H]1C	ZINC000092113109	193160915	/nfs/dbraw/zinc/16/09/15/193160915.db2.gz	OGHKTYCSLBXDJT-TXEJJXNPSA-N	0	3	314.451	2.444	10	0		DEAEHN
CNCc1cc(C)c(C)c(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)c1	ZINC000092113950	193161669	/nfs/dbraw/zinc/16/16/69/193161669.db2.gz	ZYUVRHXWWLUXOS-CHWSQXEVSA-N	0	3	310.463	2.299	10	0		DEAEHN
CC[C@@H](C)CN(C)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115651	193162902	/nfs/dbraw/zinc/16/29/02/193162902.db2.gz	YQICBIJIVOXPFE-LLVKDONJSA-N	0	3	302.415	2.212	10	0		DEAEHN
C[C@H]1CCC[C@H](C)N1S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115551	193162948	/nfs/dbraw/zinc/16/29/48/193162948.db2.gz	SZUIRZGPIKNCHB-QWRGUYRKSA-N	0	3	300.399	2.236	10	0		DEAEHN
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115594	193163635	/nfs/dbraw/zinc/16/36/35/193163635.db2.gz	HBEHSOBMYIWIRC-CYBMUJFWSA-N	0	3	314.426	2.498	10	0		DEAEHN
C[C@@H]1CCC[C@H](N(C)S(=O)(=O)c2ccc(CN)cc2F)C1	ZINC000092115912	193163885	/nfs/dbraw/zinc/16/38/85/193163885.db2.gz	CXZHYXCBNDTAMZ-YPMHNXCESA-N	0	3	314.426	2.484	10	0		DEAEHN
CC1(C)C[C@@H]1NS(=O)(=O)c1ccc(CNC2CC2)cc1F	ZINC000092116026	193164031	/nfs/dbraw/zinc/16/40/31/193164031.db2.gz	QBVDZAULKQUSFZ-AWEZNQCLSA-N	0	3	312.410	2.155	10	0		DEAEHN
C[C@H]1CCN(S(=O)(=O)c2ccc(CNC3CC3)cc2F)C1	ZINC000092115864	193164464	/nfs/dbraw/zinc/16/44/64/193164464.db2.gz	PHXNGFYBSBUSAH-NSHDSACASA-N	0	3	312.410	2.108	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N(C)CCC(C)C)c(F)c1	ZINC000092115883	193164477	/nfs/dbraw/zinc/16/44/77/193164477.db2.gz	PTGBCZKUTVIDBY-UHFFFAOYSA-N	0	3	302.415	2.212	10	0		DEAEHN
c1c(CNC[C@@H]2CCC[C@H]2C2CC2)nnn1C[C@H]1CCOC1	ZINC000631162428	368053314	/nfs/dbraw/zinc/05/33/14/368053314.db2.gz	VYOJPBQABWJAKS-KMFMINBZSA-N	0	3	304.438	2.231	10	0		DEAEHN
C[C@H]1c2ccccc2C[C@H]1NCc1cn(C[C@H]2CCOC2)nn1	ZINC000631171495	368059378	/nfs/dbraw/zinc/05/93/78/368059378.db2.gz	JXVDFZRXJCWUMM-PMUMKWKESA-N	0	3	312.417	2.133	10	0		DEAEHN
c1cc(CN[C@@H]2CCN(c3ccccn3)C2)n(CC2CCC2)n1	ZINC000631106788	368019995	/nfs/dbraw/zinc/01/99/95/368019995.db2.gz	QSQLJERUVREDNN-MRXNPFEDSA-N	0	3	311.433	2.447	10	0		DEAEHN
Brc1ccc(CNC2CN(c3ccncn3)C2)cc1	ZINC000631258657	368106846	/nfs/dbraw/zinc/10/68/46/368106846.db2.gz	COXVDZVMFHEMSS-UHFFFAOYSA-N	0	3	319.206	2.218	10	0		DEAEHN
c1cc2c(c(CN3CCCC[C@H]3CN3CCOCC3)c1)OCO2	ZINC000093011357	193193213	/nfs/dbraw/zinc/19/32/13/193193213.db2.gz	HOKPUGKFFCLFIE-INIZCTEOSA-N	0	3	318.417	2.102	10	0		DEAEHN
Cc1cc(C)n(CC(=O)N[C@@H](CC(C)C)CN2CCCC2)n1	ZINC000452343632	244177618	/nfs/dbraw/zinc/17/76/18/244177618.db2.gz	XDUSELYHGOFHOJ-INIZCTEOSA-N	0	3	306.454	2.127	10	0		DEAEHN
CCC[C@](C)(N)C(=O)N(C)CC(=O)Nc1ccccc1SC	ZINC000262304200	203254958	/nfs/dbraw/zinc/25/49/58/203254958.db2.gz	LPHCIYCBVROGLE-INIZCTEOSA-N	0	3	323.462	2.323	10	0		DEAEHN
O=C(Nc1ccc(OC2CCCC2)c(Cl)c1)[C@@H]1C[C@H](O)CN1	ZINC000262555328	203328840	/nfs/dbraw/zinc/32/88/40/203328840.db2.gz	UTIKHSALXRFPMM-FZMZJTMJSA-N	0	3	324.808	2.323	10	0		DEAEHN
C[C@H](Cc1cccs1)N(C)S(=O)(=O)C[C@@H]1CCCCN1	ZINC000093292165	193225835	/nfs/dbraw/zinc/22/58/35/193225835.db2.gz	RDLZNSOMHLZQGZ-OLZOCXBDSA-N	0	3	316.492	2.083	10	0		DEAEHN
CCC[C@](C)(N)C(=O)NCc1cc(OC)nc2ccccc12	ZINC000262705833	203387071	/nfs/dbraw/zinc/38/70/71/203387071.db2.gz	MHBYBSMSQUNPIF-KRWDZBQOSA-N	0	3	301.390	2.377	10	0		DEAEHN
COc1ccc([C@H](C)NCC(C)(C)S(C)(=O)=O)cc1OC	ZINC000093520945	193263383	/nfs/dbraw/zinc/26/33/83/193263383.db2.gz	JUHIQZHOWJKMAD-NSHDSACASA-N	0	3	315.435	2.178	10	0		DEAEHN
N[C@@]1(c2nc3cc(Br)c(F)cc3[nH]2)CCOC1	ZINC000093728932	193297946	/nfs/dbraw/zinc/29/79/46/193297946.db2.gz	VOAKQISUTPQPKW-NSHDSACASA-N	0	3	300.131	2.039	10	0		DEAEHN
CCN[C@]1(C(N)=O)CCC[C@@H](N(CC(F)(F)F)C(C)C)C1	ZINC000093751259	193300156	/nfs/dbraw/zinc/30/01/56/193300156.db2.gz	RZWJRVIPBHTFBH-DGCLKSJQSA-N	0	3	309.376	2.035	10	0		DEAEHN
Clc1cnc(Cl)nc1NC[C@H]1CN2CCC[C@@H]2CO1	ZINC000093800358	193309049	/nfs/dbraw/zinc/30/90/49/193309049.db2.gz	NFCMSHBUAKFOGV-BDAKNGLRSA-N	0	3	303.193	2.059	10	0		DEAEHN
COc1ccccc1S[C@H]1CC[C@](NC2CC2)(C(N)=O)C1	ZINC000093851854	193319051	/nfs/dbraw/zinc/31/90/51/193319051.db2.gz	IFOUAXFZJRBZAN-BLLLJJGKSA-N	0	3	306.431	2.316	10	0		DEAEHN
CN[C@H](c1ccccc1C(F)(F)F)[C@@H]1CN(C)CCN1C	ZINC000093894704	193324755	/nfs/dbraw/zinc/32/47/55/193324755.db2.gz	QACYFNSDJBGOEE-UONOGXRCSA-N	0	3	301.356	2.212	10	0		DEAEHN
CC[C@H](N)[C@@H](c1cccc(Cl)c1)N(C)CCS(C)(=O)=O	ZINC000094297250	193357235	/nfs/dbraw/zinc/35/72/35/193357235.db2.gz	RWVZWHUZVKZQCL-UONOGXRCSA-N	0	3	318.870	2.095	10	0		DEAEHN
CC[C@@H]1CN(c2nc(C(F)(F)F)ccc2CN)CCN1C	ZINC000094334301	193360564	/nfs/dbraw/zinc/36/05/64/193360564.db2.gz	VZOPEUBIPDCGRL-LLVKDONJSA-N	0	3	302.344	2.090	10	0		DEAEHN
NC(=S)c1ccc(C(F)(F)F)nc1NCCN1CCCC1	ZINC000094336159	193360978	/nfs/dbraw/zinc/36/09/78/193360978.db2.gz	GYOVZMWVNMEIPF-UHFFFAOYSA-N	0	3	318.368	2.242	10	0		DEAEHN
CC(C)NCc1cc(F)c(O[C@H]2CCS(=O)(=O)C2)c(F)c1	ZINC000094347469	193363659	/nfs/dbraw/zinc/36/36/59/193363659.db2.gz	JLSWNRGBFYONAR-NSHDSACASA-N	0	3	319.373	2.029	10	0		DEAEHN
CCCCNC(=O)[C@H](C)Oc1c(F)cc(CNC)cc1F	ZINC000094346635	193363737	/nfs/dbraw/zinc/36/37/37/193363737.db2.gz	WPALHNCVSNDCCR-JTQLQIEISA-N	0	3	300.349	2.368	10	0		DEAEHN
C[C@]1(c2nc(-c3ncc(Cl)cc3Cl)no2)COC[C@H]1N	ZINC000094199329	193348533	/nfs/dbraw/zinc/34/85/33/193348533.db2.gz	HYMMURRUEZVWMM-PELKAZGASA-N	0	3	315.160	2.054	10	0		DEAEHN
CCN[C@H](c1cc(F)c(C)cc1F)[C@@H]1CCS(=O)(=O)C1	ZINC000094707856	193392978	/nfs/dbraw/zinc/39/29/78/193392978.db2.gz	ALOKMSGXEYTSFO-YGRLFVJLSA-N	0	3	303.374	2.359	10	0		DEAEHN
Cc1ccc(NS(=O)(=O)Cc2ccccc2CN)c(C)n1	ZINC000094664993	193390512	/nfs/dbraw/zinc/39/05/12/193390512.db2.gz	AZGHQIOVQCXCQC-UHFFFAOYSA-N	0	3	305.403	2.099	10	0		DEAEHN
CC[C@@H]1CN(CCCS(=O)(=O)CC)c2ccccc2CN1	ZINC000094421311	193368860	/nfs/dbraw/zinc/36/88/60/193368860.db2.gz	KAONSLPOTAINEG-OAHLLOKOSA-N	0	3	310.463	2.200	10	0		DEAEHN
Brc1ccc2nc(N[C@@H]3CCN(C4CC4)C3)nn2c1	ZINC000094604925	193383649	/nfs/dbraw/zinc/38/36/49/193383649.db2.gz	FKPLXUZSNQFWTD-SNVBAGLBSA-N	0	3	322.210	2.140	10	0		DEAEHN
Brc1ccc2nc(N[C@H]3CCN(C4CC4)C3)nn2c1	ZINC000094604926	193384131	/nfs/dbraw/zinc/38/41/31/193384131.db2.gz	FKPLXUZSNQFWTD-JTQLQIEISA-N	0	3	322.210	2.140	10	0		DEAEHN
COC1([C@H](C)NCc2ccnc(OC(F)F)c2)CCOCC1	ZINC000453221666	245003192	/nfs/dbraw/zinc/00/31/92/245003192.db2.gz	YEDORIIRVJSRHT-NSHDSACASA-N	0	3	316.348	2.357	10	0		DEAEHN
c1nn(-c2ccccc2)nc1CN1CC[C@@H](N2CCCCC2)C1	ZINC000264589166	204013071	/nfs/dbraw/zinc/01/30/71/204013071.db2.gz	LGMUVQWIMKEBEL-GOSISDBHSA-N	0	3	311.433	2.328	10	0		DEAEHN
CCc1nnsc1[C@@H](Cc1nc2ccccc2n1C)NC	ZINC000097303322	193706262	/nfs/dbraw/zinc/70/62/62/193706262.db2.gz	BDFAFHHFLANBLH-GFCCVEGCSA-N	0	3	301.419	2.490	10	0		DEAEHN
COc1ccc(Cl)cc1C[C@H](N)[C@H]1CCCCS1(=O)=O	ZINC000161950134	197532590	/nfs/dbraw/zinc/53/25/90/197532590.db2.gz	KHWKWQKMIAZPPR-GXTWGEPZSA-N	0	3	317.838	2.186	10	0		DEAEHN
C[C@@H](NCCN1CCOCC1)c1ccccc1Br	ZINC000019954328	182170179	/nfs/dbraw/zinc/17/01/79/182170179.db2.gz	HSHGIQDHEXODBZ-GFCCVEGCSA-N	0	3	313.239	2.432	10	0		DEAEHN
C[C@H](NS(=O)(=O)c1ccc(F)c(CN)c1)c1ccccc1	ZINC000020189131	182195640	/nfs/dbraw/zinc/19/56/40/182195640.db2.gz	KHKXXKRXZCQIJY-NSHDSACASA-N	0	3	308.378	2.324	10	0		DEAEHN
CC[C@@H](C)NC(=O)COc1ccc(Br)cc1CN	ZINC000020483479	182223126	/nfs/dbraw/zinc/22/31/26/182223126.db2.gz	DZKAHRWPGWORFP-SECBINFHSA-N	0	3	315.211	2.201	10	0		DEAEHN
O=C(Nc1cc(Cl)c(Cl)cc1Cl)[C@H]1C[C@H](O)CN1	ZINC000020434010	182216969	/nfs/dbraw/zinc/21/69/69/182216969.db2.gz	RAUWLOXWBXFHFD-XUOSJQGZSA-N	0	3	309.580	2.308	10	0		DEAEHN
Nc1ccc(NC(=O)CCCN2CCC(O)CC2)c(Cl)c1	ZINC000020562760	182232488	/nfs/dbraw/zinc/23/24/88/182232488.db2.gz	KFDZDRFOGYWASB-UHFFFAOYSA-N	0	3	311.813	2.098	10	0		DEAEHN
O=C(Nc1c(Cl)cc(Cl)cc1Cl)[C@H]1C[C@@H](O)CN1	ZINC000020505405	182225538	/nfs/dbraw/zinc/22/55/38/182225538.db2.gz	DYHXQBLYUDCING-HZGVNTEJSA-N	0	3	309.580	2.308	10	0		DEAEHN
CCCC[C@@H](NCCNS(C)(=O)=O)c1ccc(F)cc1	ZINC000021013793	182260568	/nfs/dbraw/zinc/26/05/68/182260568.db2.gz	BFVXFIZORLNKJH-CQSZACIVSA-N	0	3	302.415	2.196	10	0		DEAEHN
NC[C@H](c1cccc(F)c1)N1CCN(c2nccs2)CC1	ZINC000021022954	182261675	/nfs/dbraw/zinc/26/16/75/182261675.db2.gz	QICBVXVFGNSQJH-CQSZACIVSA-N	0	3	306.410	2.104	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2cc(Br)ccc2F)CCO1	ZINC000022218048	182313637	/nfs/dbraw/zinc/31/36/37/182313637.db2.gz	RVBNBQPMPDEYGR-RNCFNFMXSA-N	0	3	317.202	2.309	10	0		DEAEHN
CC(C)C[C@H]([NH3+])C[N-]S(=O)(=O)c1cc(F)ccc1Cl	ZINC000097896624	193765775	/nfs/dbraw/zinc/76/57/75/193765775.db2.gz	PHRICNYAMSXIDW-JTQLQIEISA-N	0	3	308.806	2.131	10	0		DEAEHN
CN(C)CCN(C(=O)c1nnc(Cl)s1)C1CCCC1	ZINC000159823866	197367420	/nfs/dbraw/zinc/36/74/20/197367420.db2.gz	XBMSSDAWPYITEX-UHFFFAOYSA-N	0	3	302.831	2.138	10	0		DEAEHN
Cc1cc(Br)cc(C)c1NC[C@H](O)CN(C)C	ZINC000037883577	182934060	/nfs/dbraw/zinc/93/40/60/182934060.db2.gz	OPMVPNJYTSXVHB-LBPRGKRZSA-N	0	3	301.228	2.400	10	0		DEAEHN
CN(C)CCn1c2c(c(SC3CCCC3)nc1=O)CCC2	ZINC000038786399	183010585	/nfs/dbraw/zinc/01/05/85/183010585.db2.gz	YIXZUNWAYPRRFQ-UHFFFAOYSA-N	0	3	307.463	2.328	10	0		DEAEHN
COC(=O)c1sc(OCC[C@H]2CCCN2C)nc1Cl	ZINC000040240554	183048625	/nfs/dbraw/zinc/04/86/25/183048625.db2.gz	RQWPQBDVCMJWLY-MRVPVSSYSA-N	0	3	304.799	2.446	10	0		DEAEHN
CCOC(=O)COC[C@@H](N)c1ccc(Br)s1	ZINC000041044556	183159370	/nfs/dbraw/zinc/15/93/70/183159370.db2.gz	OJDCELDRMKGDPP-SSDOTTSWSA-N	0	3	308.197	2.090	10	0		DEAEHN
COc1ccc2c(c1)nc(C)cc2N[C@H]1CCS(=O)(=O)C1	ZINC000041474116	183193988	/nfs/dbraw/zinc/19/39/88/183193988.db2.gz	LRVVSIASKGQKOI-NSHDSACASA-N	0	3	306.387	2.151	10	0		DEAEHN
CNCc1cc2c(cc1OCCOCC(F)(F)F)OCO2	ZINC000042874327	183316223	/nfs/dbraw/zinc/31/62/23/183316223.db2.gz	URKLZMWJUNVISR-UHFFFAOYSA-N	0	3	307.268	2.092	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccccc1Cl)N(C)CC(=O)N1CCCC1	ZINC000043052100	183332526	/nfs/dbraw/zinc/33/25/26/183332526.db2.gz	DPXIIRZEMCRZRG-LRDDRELGSA-N	0	3	309.841	2.283	10	0		DEAEHN
O=C(NCCCN1CCc2ccccc2C1)Nc1nncs1	ZINC000043128846	183340086	/nfs/dbraw/zinc/34/00/86/183340086.db2.gz	MPIUNMOQQVLVIL-UHFFFAOYSA-N	0	3	317.418	2.108	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)s1)N1CCC[C@@H]1C(N)=O	ZINC000043252237	183347365	/nfs/dbraw/zinc/34/73/65/183347365.db2.gz	PCPVIGAHYJYSNN-KBVBSXBZSA-N	0	3	301.843	2.130	10	0		DEAEHN
NC[C@@H](c1ccc(Cl)s1)N(CC(N)=O)C1CCCC1	ZINC000043253826	183347716	/nfs/dbraw/zinc/34/77/16/183347716.db2.gz	CUQCYNQNCGVAHJ-JTQLQIEISA-N	0	3	301.843	2.131	10	0		DEAEHN
CCN(CC(=O)N(C)C)[C@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043252922	183348027	/nfs/dbraw/zinc/34/80/27/183348027.db2.gz	ZRKFJTOABHSWAO-RNCFNFMXSA-N	0	3	303.859	2.200	10	0		DEAEHN
C[C@H](N)[C@@H](c1cc(Br)cs1)N1CCOCC1	ZINC000043284349	183350224	/nfs/dbraw/zinc/35/02/24/183350224.db2.gz	IVFYRNSAYKRKLU-KWQFWETISA-N	0	3	305.241	2.231	10	0		DEAEHN
N[C@@H](c1cc(Br)ccc1F)[C@H]1CCS(=O)(=O)C1	ZINC000043299755	183351514	/nfs/dbraw/zinc/35/15/14/183351514.db2.gz	XLFFUEWUIFDXEZ-WRWORJQWSA-N	0	3	322.199	2.023	10	0		DEAEHN
N[C@@H](c1ccccc1OC(F)(F)F)[C@H]1CCS(=O)(=O)C1	ZINC000043300043	183352386	/nfs/dbraw/zinc/35/23/86/183352386.db2.gz	VCLCQEYSXYHCJV-GZMMTYOYSA-N	0	3	309.309	2.020	10	0		DEAEHN
CCCN(CCO)[C@@H](CN)c1ccccc1Br	ZINC000043092674	183335986	/nfs/dbraw/zinc/33/59/86/183335986.db2.gz	PTGWFVMJPCKFJL-ZDUSSCGKSA-N	0	3	301.228	2.153	10	0		DEAEHN
NC[C@@H](c1ccccc1Br)N1CCCC[C@@H]1CO	ZINC000043092495	183336083	/nfs/dbraw/zinc/33/60/83/183336083.db2.gz	UQZLKVDNOHLUKD-RISCZKNCSA-N	0	3	313.239	2.296	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1C(=O)c1ccc2cncn2c1	ZINC000285233533	218343610	/nfs/dbraw/zinc/34/36/10/218343610.db2.gz	KSPNGPIEUXMNCM-MRXNPFEDSA-N	0	3	309.373	2.144	10	0		DEAEHN
CC(C)(C(N)=S)N1CCN(CCCc2ccccc2)CC1	ZINC000109470690	194267626	/nfs/dbraw/zinc/26/76/26/194267626.db2.gz	KHWVWFPHMCVNKR-UHFFFAOYSA-N	0	3	305.491	2.302	10	0		DEAEHN
COC[C@H](N)Cc1nc(-c2cccc(C(F)(F)F)c2)no1	ZINC000109496397	194269178	/nfs/dbraw/zinc/26/91/78/194269178.db2.gz	NLYPOADNMIFLSH-SNVBAGLBSA-N	0	3	301.268	2.272	10	0		DEAEHN
O=S(=O)(C[C@@H]1CCCCN1)N[C@@H]1CCCc2ccccc21	ZINC000051633306	183832712	/nfs/dbraw/zinc/83/27/12/183832712.db2.gz	IPQWHEPLIFFKFI-GOEBONIOSA-N	0	3	308.447	2.126	10	0		DEAEHN
c1ccc(OCCN2CCCC[C@@H]2CN2CCOCC2)cc1	ZINC000109820992	194290447	/nfs/dbraw/zinc/29/04/47/194290447.db2.gz	WEBMDLTZYWPUEL-QGZVFWFLSA-N	0	3	304.434	2.252	10	0		DEAEHN
CN1CC[C@H](CNC(=O)c2ccn(-c3cccc(Cl)c3)n2)C1	ZINC000109849158	194292997	/nfs/dbraw/zinc/29/29/97/194292997.db2.gz	HYXBOKRMLWHACD-GFCCVEGCSA-N	0	3	318.808	2.207	10	0		DEAEHN
CCCN([C@H]1CCCNC1)S(=O)(=O)Cc1ccc(F)cc1	ZINC000110942038	194372727	/nfs/dbraw/zinc/37/27/27/194372727.db2.gz	HGIXCMKODODVRL-HNNXBMFYSA-N	0	3	314.426	2.120	10	0		DEAEHN
CN(CC(=O)Nc1ccc(Cl)cc1N)CC1CCOCC1	ZINC000111156120	194396578	/nfs/dbraw/zinc/39/65/78/194396578.db2.gz	KFQZEPWQAAFSII-UHFFFAOYSA-N	0	3	311.813	2.219	10	0		DEAEHN
CN(C[C@@H]1CCCOC1)[C@@H](CN)c1cc(F)c(F)c(F)c1	ZINC000111158295	194397772	/nfs/dbraw/zinc/39/77/72/194397772.db2.gz	XFBQQRRTOBCBAS-HZMBPMFUSA-N	0	3	302.340	2.462	10	0		DEAEHN
C[C@](O)(Cc1ccc(Br)cc1)C[C@@H]1COCCN1	ZINC000156909406	197149253	/nfs/dbraw/zinc/14/92/53/197149253.db2.gz	ZHXGFDPHHCLFOX-KGLIPLIRSA-N	0	3	314.223	2.121	10	0		DEAEHN
COCCC[C@@H](N)C(=O)N(C)[C@@H](C)c1cc(F)ccc1F	ZINC000159321116	197344604	/nfs/dbraw/zinc/34/46/04/197344604.db2.gz	YWFZTTCTCSMBMQ-IINYFYTJSA-N	0	3	300.349	2.238	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)/C=C/c2ccc(OC)c(OC)c2)C1	ZINC000060416662	184149196	/nfs/dbraw/zinc/14/91/96/184149196.db2.gz	IOOCDQOVUZDFOV-HQPKTYMTSA-N	0	3	318.417	2.318	10	0		DEAEHN
CNC(C)(C)C(=O)Nc1cc(Br)ccc1N(C)C	ZINC000061316348	184168433	/nfs/dbraw/zinc/16/84/33/184168433.db2.gz	OVSLIAQCZRJFBT-UHFFFAOYSA-N	0	3	314.227	2.452	10	0		DEAEHN
CNc1nc(CN2CCC[C@H]2CN(C)C)nc2sccc21	ZINC000061653196	184181165	/nfs/dbraw/zinc/18/11/65/184181165.db2.gz	GMPZEFKETRURET-NSHDSACASA-N	0	3	305.451	2.259	10	0		DEAEHN
CCc1ccc(S(=O)(=O)NCc2ccccc2CN)cc1	ZINC000061841298	184189251	/nfs/dbraw/zinc/18/92/51/184189251.db2.gz	BNQMPBVSMJGCJM-UHFFFAOYSA-N	0	3	304.415	2.186	10	0		DEAEHN
NC[C@@H](c1cc(Br)cs1)N1CCCOCC1	ZINC000061914531	184195475	/nfs/dbraw/zinc/19/54/75/184195475.db2.gz	ZQDZZVHUJYRPEI-JTQLQIEISA-N	0	3	305.241	2.233	10	0		DEAEHN
CC(C)NCc1cnc(N2CCN(CC(F)(F)F)CC2)s1	ZINC000061948516	184197764	/nfs/dbraw/zinc/19/77/64/184197764.db2.gz	BEWWBRRRJWSALA-UHFFFAOYSA-N	0	3	322.400	2.325	10	0		DEAEHN
COC(=O)[C@@]1(Nc2cccc(Br)c2)CCN(C)C1	ZINC000061991480	184200070	/nfs/dbraw/zinc/20/00/70/184200070.db2.gz	LRRXDDOMNFAKGX-CYBMUJFWSA-N	0	3	313.195	2.108	10	0		DEAEHN
C[C@@H](C(=O)N(C)[C@@H](C)c1cccc(Cl)c1)N1CCNCC1	ZINC000062028187	184202289	/nfs/dbraw/zinc/20/22/89/184202289.db2.gz	KTIPMSKIGSSRFJ-STQMWFEESA-N	0	3	309.841	2.153	10	0		DEAEHN
CCCN1C(=O)CC[C@H](N)[C@H]1c1ccc(Br)o1	ZINC000062212211	184221390	/nfs/dbraw/zinc/22/13/90/184221390.db2.gz	KWBZKJRJHADFQA-UFBFGSQYSA-N	0	3	301.184	2.443	10	0		DEAEHN
CC(C)(C)NCc1nc(CN2CCn3ccnc3C2)cs1	ZINC000062325496	184230545	/nfs/dbraw/zinc/23/05/45/184230545.db2.gz	UUHVMQAJMFDPAC-UHFFFAOYSA-N	0	3	305.451	2.244	10	0		DEAEHN
COc1ccc(OCCS(C)(=O)=O)c(CNC(C)(C)C)c1	ZINC000062727504	184250866	/nfs/dbraw/zinc/25/08/66/184250866.db2.gz	WDUHNEWMHCGHOU-UHFFFAOYSA-N	0	3	315.435	2.007	10	0		DEAEHN
COCCCOc1c(Cl)cc(CNCCOC)cc1OC	ZINC000062727860	184250869	/nfs/dbraw/zinc/25/08/69/184250869.db2.gz	HNMURQMQKZJYCN-UHFFFAOYSA-N	0	3	317.813	2.500	10	0		DEAEHN
CS(=O)(=O)c1ccccc1N1CCNCc2ccccc21	ZINC000062819157	184253923	/nfs/dbraw/zinc/25/39/23/184253923.db2.gz	RZVMNEGRRFFRBW-UHFFFAOYSA-N	0	3	302.399	2.331	10	0		DEAEHN
CCN(CC)c1ccc(NS(=O)(=O)CCNC(C)C)cc1	ZINC000062996935	184264748	/nfs/dbraw/zinc/26/47/48/184264748.db2.gz	WHZOWCUGYHCUSI-UHFFFAOYSA-N	0	3	313.467	2.273	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1ccc(Br)c(F)c1	ZINC000159977733	197377571	/nfs/dbraw/zinc/37/75/71/197377571.db2.gz	SEARGINSCHJENE-LLVKDONJSA-N	0	3	319.174	2.281	10	0		DEAEHN
COc1ccc(C(=O)CCC(=O)N(C)CCCN(C)C)cc1F	ZINC000537214593	284987262	/nfs/dbraw/zinc/98/72/62/284987262.db2.gz	MELBXZZDOPOINA-UHFFFAOYSA-N	0	3	324.396	2.207	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC1[C@H](C)CCC[C@H]1C	ZINC000246277793	285023790	/nfs/dbraw/zinc/02/37/90/285023790.db2.gz	WNUXLICGJAWUCJ-RBSFLKMASA-N	0	3	311.470	2.221	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CC[C@@H](C)C[C@@H]1C	ZINC000247535456	285025303	/nfs/dbraw/zinc/02/53/03/285025303.db2.gz	XXTIGUDCYZBRHA-QKPAOTATSA-N	0	3	311.470	2.221	10	0		DEAEHN
C[C@H](CO)N(C)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000119620052	195003902	/nfs/dbraw/zinc/00/39/02/195003902.db2.gz	LLCUJBTUUREBKI-QAPCUYQASA-N	0	3	319.449	2.063	10	0		DEAEHN
COC(=O)c1ccc(NC(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1	ZINC000120142072	195104850	/nfs/dbraw/zinc/10/48/50/195104850.db2.gz	ULMHOIYPQUKFNN-DOMZBBRYSA-N	0	3	319.405	2.323	10	0		DEAEHN
C[C@@H]1C[C@H]1NS(=O)(=O)c1ccc(F)c(CNC(C)(C)C)c1	ZINC000159109775	197328452	/nfs/dbraw/zinc/32/84/52/197328452.db2.gz	NUIWRCSDVBIPLI-QMTHXVAHSA-N	0	3	314.426	2.401	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N[C@H](C)CC)cc(C)c1F	ZINC000159081653	197325703	/nfs/dbraw/zinc/32/57/03/197325703.db2.gz	ZRMUAFFQACWLKY-LLVKDONJSA-N	0	3	302.415	2.320	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2CCC[C@H]2C)cc(C)c1F	ZINC000159075060	197324413	/nfs/dbraw/zinc/32/44/13/197324413.db2.gz	RNPPAAPCFGNNSY-GFCCVEGCSA-N	0	3	314.426	2.417	10	0		DEAEHN
CCCN(C(C)C)S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159063500	197323426	/nfs/dbraw/zinc/32/34/26/197323426.db2.gz	XTHFQLFXXFAZFE-UHFFFAOYSA-N	0	3	302.415	2.402	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N(CC)CC)cc(C)c1F	ZINC000159049331	197321893	/nfs/dbraw/zinc/32/18/93/197321893.db2.gz	FNBVQTVEHOVXJZ-UHFFFAOYSA-N	0	3	302.415	2.274	10	0		DEAEHN
CCN[C@@H]1CCCN(c2c(F)c(F)c(F)c(F)c2F)C1=O	ZINC000159002326	197318128	/nfs/dbraw/zinc/31/81/28/197318128.db2.gz	OBHKCDFTRFVQQB-ZCFIWIBFSA-N	0	3	308.250	2.487	10	0		DEAEHN
Cc1c(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cnn1C(C)(C)C	ZINC000158925185	197311027	/nfs/dbraw/zinc/31/10/27/197311027.db2.gz	GGNMHVRBIQCQPY-SWLSCSKDSA-N	0	3	306.454	2.405	10	0		DEAEHN
CCc1ccc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)cc1CN	ZINC000158756901	197298837	/nfs/dbraw/zinc/29/88/37/197298837.db2.gz	CJYZZWULWDMROO-ZIAGYGMSSA-N	0	3	308.447	2.128	10	0		DEAEHN
CCOCCN(C)c1ncc(Br)cc1CNC	ZINC000158339338	197264373	/nfs/dbraw/zinc/26/43/73/197264373.db2.gz	KCQOOFQWYPHNLH-UHFFFAOYSA-N	0	3	302.216	2.036	10	0		DEAEHN
CC(C)[C@H](O)CC(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000158301146	197260803	/nfs/dbraw/zinc/26/08/03/197260803.db2.gz	RCYASUZMHNWXOT-GOEBONIOSA-N	0	3	324.490	2.483	10	0		DEAEHN
COc1ccc([C@@H](C)NC[C@]2(O)CCSC2)cc1NC(C)=O	ZINC000158247631	197257034	/nfs/dbraw/zinc/25/70/34/197257034.db2.gz	SBOOZNREZDOGCG-BDJLRTHQSA-N	0	3	324.446	2.172	10	0		DEAEHN
CN(CCc1nccs1)C[C@@H](O)COCc1ccccc1	ZINC000157708525	197209640	/nfs/dbraw/zinc/20/96/40/197209640.db2.gz	WCDGOGVNIUFOSO-OAHLLOKOSA-N	0	3	306.431	2.195	10	0		DEAEHN
CCOCCN(C)[C@@H](CN)c1ccccc1Br	ZINC000157696215	197209012	/nfs/dbraw/zinc/20/90/12/197209012.db2.gz	YRKRMLYGEOHODB-ZDUSSCGKSA-N	0	3	301.228	2.417	10	0		DEAEHN
CCCN[C@](C)(CCN(C)CCOC(C)C)C(=O)OCC	ZINC000157513372	197192975	/nfs/dbraw/zinc/19/29/75/197192975.db2.gz	VOGOYASLFAAYLL-MRXNPFEDSA-N	0	3	302.459	2.055	10	0		DEAEHN
CCCNc1nc(Cl)nc(N2C[C@@H]3CCCN3C[C@@H]2C)n1	ZINC000157399867	197184885	/nfs/dbraw/zinc/18/48/85/197184885.db2.gz	GHDDODJCBPIOQU-QWRGUYRKSA-N	0	3	310.833	2.020	10	0		DEAEHN
CC(C)OCCN(C)[C@@H](CN)c1cc2c(c(Cl)c1)OCO2	ZINC000157122271	197164166	/nfs/dbraw/zinc/16/41/66/197164166.db2.gz	BBVRANBYISMMHD-ZDUSSCGKSA-N	0	3	314.813	2.425	10	0		DEAEHN
C[C@](O)(Cc1ccc(Br)s1)C[C@H]1COCCN1	ZINC000156804904	197142296	/nfs/dbraw/zinc/14/22/96/197142296.db2.gz	NSPDCQQVNNTSJZ-JOYOIKCWSA-N	0	3	320.252	2.183	10	0		DEAEHN
O=C1C[C@@H](NC[C@@H]2CCCCS2)C(=O)N1c1ccccc1	ZINC000156412719	197110986	/nfs/dbraw/zinc/11/09/86/197110986.db2.gz	JJAFUSXANNMFAB-UONOGXRCSA-N	0	3	304.415	2.194	10	0		DEAEHN
COC(=O)CCCCCNC(=O)c1cccc(CN(C)C)c1	ZINC000155550552	197065771	/nfs/dbraw/zinc/06/57/71/197065771.db2.gz	AISGBQCBIMIXRN-UHFFFAOYSA-N	0	3	306.406	2.211	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000155572370	197068727	/nfs/dbraw/zinc/06/87/27/197068727.db2.gz	SMUVGUJAYHRBCO-ZBEGNZNMSA-N	0	3	321.396	2.243	10	0		DEAEHN
Cc1cc2c(cc1C)O[C@H](C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C)C2	ZINC000155427329	197053826	/nfs/dbraw/zinc/05/38/26/197053826.db2.gz	DGQGPIYRKMNENP-LESCRADOSA-N	0	3	316.445	2.452	10	0		DEAEHN
COc1cc(C)cc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1O	ZINC000155422066	197052741	/nfs/dbraw/zinc/05/27/41/197052741.db2.gz	BQJJQLXYCAMHBC-GXTWGEPZSA-N	0	3	306.406	2.168	10	0		DEAEHN
COc1ccc([C@@H]2C[C@H](C)N(CCN3CCCC3=O)C2)cc1	ZINC000155257889	197038139	/nfs/dbraw/zinc/03/81/39/197038139.db2.gz	OZVKEUYTJIVQOW-GOEBONIOSA-N	0	3	302.418	2.495	10	0		DEAEHN
Cc1ccc(CN2CC[C@@H]3O[C@H](C(=O)N(C)C)CC[C@@H]32)s1	ZINC000247967375	257112984	/nfs/dbraw/zinc/11/29/84/257112984.db2.gz	GUPGIOWPJQVQDN-KKUMJFAQSA-N	0	3	308.447	2.267	10	0		DEAEHN
CCc1cc(=O)[n-]c(CN2CC[C@H]3CC[C@@H](C2)[N@@H+]3C(C)C)n1	ZINC000121623211	195318220	/nfs/dbraw/zinc/31/82/20/195318220.db2.gz	WNGSFTXKESQDIN-CABCVRRESA-N	0	3	304.438	2.192	10	0		DEAEHN
CCc1cc(=O)[n-]c(CN2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)n1	ZINC000121623211	195318221	/nfs/dbraw/zinc/31/82/21/195318221.db2.gz	WNGSFTXKESQDIN-CABCVRRESA-N	0	3	304.438	2.192	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2ccsc2)N([C@@H](C)CN2CCCC2)C1=O	ZINC000121957556	195380965	/nfs/dbraw/zinc/38/09/65/195380965.db2.gz	VCQLWEQCKZRVJS-AEGPPILISA-N	0	3	307.463	2.441	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)[C@@H](C)N)[C@H]1c1ccc(Cl)c(F)c1	ZINC000261880223	285375308	/nfs/dbraw/zinc/37/53/08/285375308.db2.gz	SZUYHMYZKJBIJM-OWYVNGRQSA-N	0	3	313.804	2.078	10	0		DEAEHN
CNCc1cc(O[C@@H](C)C(=O)OC)ccc1Br	ZINC000128075842	195933854	/nfs/dbraw/zinc/93/38/54/195933854.db2.gz	XFXKFZRRCIOAEU-QMMMGPOBSA-N	0	3	302.168	2.109	10	0		DEAEHN
COc1ccc2cc(CN3CCN(CCO)[C@@H](C)C3)ccc2c1	ZINC000190252079	533327555	/nfs/dbraw/zinc/32/75/55/533327555.db2.gz	CMQAOFBWYQFPCI-HNNXBMFYSA-N	0	3	314.429	2.347	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@H]1C[C@H](c2ccccc2)C1	ZINC000562492333	291988330	/nfs/dbraw/zinc/98/83/30/291988330.db2.gz	FHAQRHOZQPVDKJ-JCNLHEQBSA-N	0	3	310.401	2.161	10	0		DEAEHN
COC[C@@H](NC(=O)NCCN1CCCC[C@@H]1C)c1ccc(C)o1	ZINC000175278135	132513281	/nfs/dbraw/zinc/51/32/81/132513281.db2.gz	CZQIUUZIVFYAHZ-DZGCQCFKSA-N	0	3	323.437	2.449	10	0		DEAEHN
Cc1cc(C)cc(OCCCN2CCO[C@@H](CN(C)C)C2)c1	ZINC000177713611	132529126	/nfs/dbraw/zinc/52/91/26/132529126.db2.gz	SHYWVDGDSNWMBT-SFHVURJKSA-N	0	3	306.450	2.335	10	0		DEAEHN
CC[C@]1(C2CN(C(=O)OC(C)(C)C)C2)NCCc2ncn(C)c21	ZINC000725242596	542770090	/nfs/dbraw/zinc/77/00/90/542770090.db2.gz	JXHIJKXYFLRJGF-QGZVFWFLSA-N	0	3	320.437	2.038	10	0		DEAEHN
COc1cc(C)c(C(=O)N[C@@H](C)C2=CCN(C)CC2)cc1OC	ZINC000357923461	133109923	/nfs/dbraw/zinc/10/99/23/133109923.db2.gz	VTWVITCDOZBFJK-ZDUSSCGKSA-N	0	3	318.417	2.392	10	0		DEAEHN
c1ccc2c(c1)CC[C@H](CN1CCN(C[C@@H]3CCOC3)CC1)C2	ZINC000359591335	133132806	/nfs/dbraw/zinc/13/28/06/133132806.db2.gz	WCBLOZHLBSGXPX-ROUUACIJSA-N	0	3	314.473	2.446	10	0		DEAEHN
Cc1nn(C)c(C)c1CNCC[C@@H]1COc2ccccc2O1	ZINC000360273118	133172834	/nfs/dbraw/zinc/17/28/34/133172834.db2.gz	FUTRQTJBDVNFQN-CQSZACIVSA-N	0	3	301.390	2.357	10	0		DEAEHN
Cc1nccn1CCCCN1C[C@]2(CCOC2)OC(C)(C)C1	ZINC000368445452	133273464	/nfs/dbraw/zinc/27/34/64/133273464.db2.gz	GVHKFUJHDBYTCN-KRWDZBQOSA-N	0	3	307.438	2.242	10	0		DEAEHN
CCS(=O)(=O)NCCN[C@@H](C)c1ccc2ccccc2c1	ZINC000112540679	144632573	/nfs/dbraw/zinc/63/25/73/144632573.db2.gz	QLCOOJIPFDRHKX-ZDUSSCGKSA-N	0	3	306.431	2.430	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@H]1CCO[C@H](C2CC2)C1	ZINC000291703147	404485802	/nfs/dbraw/zinc/48/58/02/404485802.db2.gz	KIGZHONNIOJXQA-WMZOPIPTSA-N	0	3	312.417	2.374	10	0		DEAEHN
O=C(Cc1c[nH]c2cc(F)ccc12)N1CCN2CCC1CC2	ZINC000188854227	145018232	/nfs/dbraw/zinc/01/82/32/145018232.db2.gz	NTYRWPPXCBTCGS-UHFFFAOYSA-N	0	3	301.365	2.156	10	0		DEAEHN
CCc1nc(C2CCN([C@@H](C)C(=O)NC(CC)CC)CC2)n[nH]1	ZINC000190662669	145045483	/nfs/dbraw/zinc/04/54/83/145045483.db2.gz	MSQDOHYGLLIGIF-LBPRGKRZSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCc1n[nH]c(C2CCN([C@@H](C)C(=O)NC(CC)CC)CC2)n1	ZINC000190662669	145045484	/nfs/dbraw/zinc/04/54/84/145045484.db2.gz	MSQDOHYGLLIGIF-LBPRGKRZSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCc1nnc(C2CCN([C@@H](C)C(=O)NC(CC)CC)CC2)[nH]1	ZINC000190662669	145045485	/nfs/dbraw/zinc/04/54/85/145045485.db2.gz	MSQDOHYGLLIGIF-LBPRGKRZSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCn1cnnc1C1CCN(C[C@H](O)CC2CCCC2)CC1	ZINC000191342990	145056616	/nfs/dbraw/zinc/05/66/16/145056616.db2.gz	LBXJJJLABOPERS-MRXNPFEDSA-N	0	3	306.454	2.419	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2ccc(C3CCC3)cc2)CCO1	ZINC000191870849	145066205	/nfs/dbraw/zinc/06/62/05/145066205.db2.gz	KGSHGXRPVQUPDE-KRWDZBQOSA-N	0	3	302.418	2.357	10	0		DEAEHN
FC(F)(F)Cn1ccnc1CN1CCN2CCCC[C@H]2C1	ZINC000246239250	145095743	/nfs/dbraw/zinc/09/57/43/145095743.db2.gz	UPEWLKDUPCFISM-LBPRGKRZSA-N	0	3	302.344	2.116	10	0		DEAEHN
COCc1csc(NC(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)n1	ZINC000246404605	145101334	/nfs/dbraw/zinc/10/13/34/145101334.db2.gz	LPPDFRBEGVSJDY-CMPLNLGQSA-N	0	3	312.439	2.140	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H](c2ccccc2)CN(Cc2ccnn2C)C1	ZINC000246888409	145118618	/nfs/dbraw/zinc/11/86/18/145118618.db2.gz	TYRXHTMOUCGKOM-HZPDHXFCSA-N	0	3	313.401	2.199	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cccc(OC)c1OC	ZINC000246907203	145119334	/nfs/dbraw/zinc/11/93/34/145119334.db2.gz	ICCZUPFKQBWUHI-KGLIPLIRSA-N	0	3	318.417	2.403	10	0		DEAEHN
c1c(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)nc2ncccn12	ZINC000247056600	145125164	/nfs/dbraw/zinc/12/51/64/145125164.db2.gz	ZMYFPNMAZGZBDN-WMLDXEAASA-N	0	3	311.433	2.178	10	0		DEAEHN
O=C([C@@H]1C[C@H]1c1cccc(F)c1F)N1CCN2CCC[C@H]2C1	ZINC000247314567	145132779	/nfs/dbraw/zinc/13/27/79/145132779.db2.gz	HRSBPRRBUWCVPO-FPMFFAJLSA-N	0	3	306.356	2.375	10	0		DEAEHN
O=C([C@@H]1C[C@@H]1c1cccc(F)c1F)N1CCN2CCC[C@H]2C1	ZINC000247314581	145132894	/nfs/dbraw/zinc/13/28/94/145132894.db2.gz	HRSBPRRBUWCVPO-IACUBPJLSA-N	0	3	306.356	2.375	10	0		DEAEHN
COC(=O)COc1ccccc1[C@H](C)NC[C@H]1CCCC[C@H]1O	ZINC000248491752	145156739	/nfs/dbraw/zinc/15/67/39/145156739.db2.gz	OEOIGGVMDQNUFD-SQWLQELKSA-N	0	3	321.417	2.440	10	0		DEAEHN
Cc1c(-c2cc(CN3CCN4CCCC[C@H]4C3)on2)cnn1C	ZINC000248619527	145161731	/nfs/dbraw/zinc/16/17/31/145161731.db2.gz	MBIILBGBGCPDGG-AWEZNQCLSA-N	0	3	315.421	2.054	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H](O)c1ccccc1	ZINC000248798883	145168084	/nfs/dbraw/zinc/16/80/84/145168084.db2.gz	JLVSAYNDWNSUGE-LZQZEXGQSA-N	0	3	324.424	2.357	10	0		DEAEHN
COc1ccc(C)nc1NC(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000248833711	145169145	/nfs/dbraw/zinc/16/91/45/145169145.db2.gz	MUWJUESTESNEMO-CHWSQXEVSA-N	0	3	304.394	2.099	10	0		DEAEHN
Cc1nc(CC(C)C)oc1C(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000248876580	145171161	/nfs/dbraw/zinc/17/11/61/145171161.db2.gz	CVMFDUUSOUVZTA-OCCSQVGLSA-N	0	3	305.422	2.490	10	0		DEAEHN
Cn1ccnc1C[C@H]1CCCN(C[C@H]2CC3(CCC3)C(=O)O2)C1	ZINC000248877683	145171542	/nfs/dbraw/zinc/17/15/42/145171542.db2.gz	OLJWULHSMVFJMQ-HUUCEWRRSA-N	0	3	317.433	2.160	10	0		DEAEHN
CN(C)C1(CN(C)C(=O)N[C@@H]2[C@H]3Cc4ccccc4[C@@H]23)CCC1	ZINC000249413130	145184069	/nfs/dbraw/zinc/18/40/69/145184069.db2.gz	YLTHHKADKRTCGY-GVDBMIGSSA-N	0	3	313.445	2.450	10	0		DEAEHN
CCN1CCC[C@H](N[C@H](C)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000249614643	145188165	/nfs/dbraw/zinc/18/81/65/145188165.db2.gz	QCVZVKVBYADPJQ-HIFRSBDPSA-N	0	3	310.463	2.225	10	0		DEAEHN
CO[C@@H]1CN([C@H](C)C(=O)N(C)Cc2ccccc2)CC[C@H]1C	ZINC000252059674	145198551	/nfs/dbraw/zinc/19/85/51/145198551.db2.gz	ZQLJPTHFNGKEGJ-BFYDXBDKSA-N	0	3	304.434	2.390	10	0		DEAEHN
Cc1cc(=O)[nH]cc1C(=O)Nc1ccc2c(c1F)CCNC2	ZINC000261713265	145219069	/nfs/dbraw/zinc/21/90/69/145219069.db2.gz	KUHMGYNQARTPBR-UHFFFAOYSA-N	0	3	301.321	2.133	10	0		DEAEHN
Cc1cccn2c(CN3CCNC[C@@H]3c3cccnc3)cnc12	ZINC000261817662	145230091	/nfs/dbraw/zinc/23/00/91/145230091.db2.gz	XOPCYKSJVORGJQ-QGZVFWFLSA-N	0	3	307.401	2.184	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)Nc1ccc2c[nH]nc2c1	ZINC000261823502	145230352	/nfs/dbraw/zinc/23/03/52/145230352.db2.gz	HOMYKGBMAMUOKU-MRRJBJDNSA-N	0	3	314.389	2.034	10	0		DEAEHN
NC1(C(=O)Nc2cccc(SC(F)F)c2)CCOCC1	ZINC000261919493	145242081	/nfs/dbraw/zinc/24/20/81/145242081.db2.gz	UTWLFSSHFBNMOE-UHFFFAOYSA-N	0	3	302.346	2.448	10	0		DEAEHN
NC1(C(=O)Nc2ccc(OC3CCC3)c(F)c2)CCOCC1	ZINC000261933293	145244114	/nfs/dbraw/zinc/24/41/14/145244114.db2.gz	WOVGKTGWWCEWSD-UHFFFAOYSA-N	0	3	308.353	2.203	10	0		DEAEHN
COc1ccc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)cc1F	ZINC000261956884	145246761	/nfs/dbraw/zinc/24/67/61/145246761.db2.gz	XGLMHRZWPRDUNM-HYSWKAIVSA-N	0	3	322.380	2.305	10	0		DEAEHN
Cc1cc(F)cc(C)c1S(=O)(=O)NC[C@H](N)c1ccccc1	ZINC000262395756	145281168	/nfs/dbraw/zinc/28/11/68/145281168.db2.gz	BVNYBEIDATTWBK-HNNXBMFYSA-N	0	3	322.405	2.421	10	0		DEAEHN
COc1cccc(NC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)c1	ZINC000262504449	145288705	/nfs/dbraw/zinc/28/87/05/145288705.db2.gz	MIGXXBWNARESKH-JJRVBVJISA-N	0	3	304.390	2.166	10	0		DEAEHN
C[C@@H]1C[NH2+]CC[C@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000262790516	145304810	/nfs/dbraw/zinc/30/48/10/145304810.db2.gz	ROEAUSOFEHEFKH-LDYMZIIASA-N	0	3	323.245	2.270	10	0		DEAEHN
CC[C@@H](Oc1ccccc1C)c1nc([C@@H]2CNCCN2C)no1	ZINC000263131022	145328551	/nfs/dbraw/zinc/32/85/51/145328551.db2.gz	BRHGCWRGEWLRQL-UONOGXRCSA-N	0	3	316.405	2.484	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2c[nH]cc2-c2ccccc2)n1	ZINC000263164863	145331680	/nfs/dbraw/zinc/33/16/80/145331680.db2.gz	FDDJGSQQLQEPBG-OAHLLOKOSA-N	0	3	309.373	2.308	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(/C=C/c2c(F)cccc2F)n1	ZINC000263179022	145333181	/nfs/dbraw/zinc/33/31/81/145333181.db2.gz	GNLMYTDYAMMADX-URWSZGRFSA-N	0	3	306.316	2.094	10	0		DEAEHN
COc1cccc([C@H](C)Cc2nc([C@H]3CNCCN3C)no2)c1	ZINC000263199773	145335671	/nfs/dbraw/zinc/33/56/71/145335671.db2.gz	IWEWKGHTSQDFMG-IUODEOHRSA-N	0	3	316.405	2.001	10	0		DEAEHN
Cc1ccccc1[C@@H](C)Cc1nc([C@H]2CNCCN2C)no1	ZINC000263201416	145335702	/nfs/dbraw/zinc/33/57/02/145335702.db2.gz	JCISNKGATXQNAQ-DZGCQCFKSA-N	0	3	300.406	2.300	10	0		DEAEHN
Cc1cc(-c2nc([C@@H]3CNCCN3C)no2)c(C)n1C(C)C	ZINC000263224604	145338513	/nfs/dbraw/zinc/33/85/13/145338513.db2.gz	MOLHXQFXTYLWGM-AWEZNQCLSA-N	0	3	303.410	2.312	10	0		DEAEHN
c1ccc(N2CCO[C@@H](CN3CCC[C@@]4(CCOC4)C3)C2)cc1	ZINC000565174496	292140835	/nfs/dbraw/zinc/14/08/35/292140835.db2.gz	WYWRRLKRWHXHDN-RBUKOAKNSA-N	0	3	316.445	2.394	10	0		DEAEHN
CCOc1ccccc1-n1nnnc1SC[C@@H](C)N(C)C	ZINC000358848292	147218434	/nfs/dbraw/zinc/21/84/34/147218434.db2.gz	AOEJPPRYIBPYOP-LLVKDONJSA-N	0	3	307.423	2.103	10	0		DEAEHN
COc1ccc(C)cc1-n1nnnc1SC[C@@H](C)N(C)C	ZINC000358863860	147220647	/nfs/dbraw/zinc/22/06/47/147220647.db2.gz	SOXPWQCLVYBKOR-LLVKDONJSA-N	0	3	307.423	2.022	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)NC[C@](C)(O)C2CCCCC2)CCN1C	ZINC000358924198	147232261	/nfs/dbraw/zinc/23/22/61/147232261.db2.gz	DCCSANPGIXERQH-UNEWFSDZSA-N	0	3	311.470	2.100	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@@H]2CCCCN2C2CC2)C1	ZINC000359064886	147255866	/nfs/dbraw/zinc/25/58/66/147255866.db2.gz	XRLCJPKQUCPSKU-HNNXBMFYSA-N	0	3	309.454	2.071	10	0		DEAEHN
CO[C@@H](C)[C@H](C)NC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000359530577	147344910	/nfs/dbraw/zinc/34/49/10/147344910.db2.gz	QZYBFHWKWQZYAP-GJZGRUSLSA-N	0	3	304.434	2.438	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)NCc1ccc2cc[nH]c2n1	ZINC000360712964	147372597	/nfs/dbraw/zinc/37/25/97/147372597.db2.gz	KUZYVWGBOARAIX-DOMZBBRYSA-N	0	3	315.421	2.045	10	0		DEAEHN
COC[C@H](CNCc1ccc(C(=O)OC(C)(C)C)cc1)OC	ZINC000361272907	147479801	/nfs/dbraw/zinc/47/98/01/147479801.db2.gz	QLUFMRPVZFOYQE-HNNXBMFYSA-N	0	3	309.406	2.393	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)N2CCO[C@H](c3ccsc3)C2)C1	ZINC000127116859	401721193	/nfs/dbraw/zinc/72/11/93/401721193.db2.gz	SDHLQWQQPZKRIB-ZFWWWQNUSA-N	0	3	323.462	2.173	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cn(C)nc1C(C)(C)C	ZINC000127533723	401738651	/nfs/dbraw/zinc/73/86/51/401738651.db2.gz	HGWSJZPWAURYCO-CYBMUJFWSA-N	0	3	306.454	2.274	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@@H](c2ccccc2)N(C)C)CCN1C	ZINC000127565348	401740581	/nfs/dbraw/zinc/74/05/81/401740581.db2.gz	JHGJCWURZSQCDH-DJIMGWMZSA-N	0	3	303.450	2.230	10	0		DEAEHN
C[C@H](CNC(=O)NC1CCC(C)(C)CC1)CN1CCN(C)CC1	ZINC000074524368	401740968	/nfs/dbraw/zinc/74/09/68/401740968.db2.gz	YFABXETZIRAVFA-OAHLLOKOSA-N	0	3	324.513	2.138	10	0		DEAEHN
COc1cc(F)c(C(=O)N2CC[C@@H](N3CCCC3)C2)cc1OC	ZINC000126365494	401690987	/nfs/dbraw/zinc/69/09/87/401690987.db2.gz	CFELVNJIQAGMMN-GFCCVEGCSA-N	0	3	322.380	2.153	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)NC1CCN(CCc2ccncc2)CC1	ZINC000072075211	401703003	/nfs/dbraw/zinc/70/30/03/401703003.db2.gz	UMNQQZPNTKAKTR-OAHLLOKOSA-N	0	3	318.465	2.432	10	0		DEAEHN
CN(C)CCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O	ZINC000013473136	401800006	/nfs/dbraw/zinc/80/00/06/401800006.db2.gz	CZNDSRXWIOPAEE-UHFFFAOYSA-N	0	3	323.396	2.044	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@H](Cc1ccccc1)N(C)C	ZINC000112881636	401760551	/nfs/dbraw/zinc/76/05/51/401760551.db2.gz	FUVZWEQIFNOUGK-ROUUACIJSA-N	0	3	319.493	2.252	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2c(F)cccc2N2CCCC2)CCO1	ZINC000128049900	401760797	/nfs/dbraw/zinc/76/07/97/401760797.db2.gz	SXNMZFXZLSRENQ-HNNXBMFYSA-N	0	3	321.440	2.188	10	0		DEAEHN
COc1cc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc(OC)c1C	ZINC000113226769	401770349	/nfs/dbraw/zinc/77/03/49/401770349.db2.gz	ZXXLPMYFNMEIJJ-WFASDCNBSA-N	0	3	318.417	2.321	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)COc1ccc(Cl)cc1	ZINC000113226761	401770657	/nfs/dbraw/zinc/77/06/57/401770657.db2.gz	OCFZSKLGRPSHEB-GXTWGEPZSA-N	0	3	308.809	2.414	10	0		DEAEHN
CC(C)N(CC(=O)N1CCO[C@H]2CCCC[C@@H]21)C1CCOCC1	ZINC000077323689	401810206	/nfs/dbraw/zinc/81/02/06/401810206.db2.gz	FXLNCGSRWBMUKN-IRXDYDNUSA-N	0	3	324.465	2.046	10	0		DEAEHN
Cn1cc([C@H]2CCN(CCC(=O)Nc3cccc(F)c3)C2)cn1	ZINC000116313469	401849587	/nfs/dbraw/zinc/84/95/87/401849587.db2.gz	ZTQLEEIJSVVPLO-ZDUSSCGKSA-N	0	3	316.380	2.377	10	0		DEAEHN
CCOCCN1CCN(CCN(C)c2ccccc2)C[C@@H]1C	ZINC000131459895	401851072	/nfs/dbraw/zinc/85/10/72/401851072.db2.gz	HQZPOQLTQDMPCF-KRWDZBQOSA-N	0	3	305.466	2.165	10	0		DEAEHN
C[C@H]1CCc2sc(C(=O)N3CCO[C@@H](CN(C)C)C3)cc2C1	ZINC000116788334	401859104	/nfs/dbraw/zinc/85/91/04/401859104.db2.gz	JIWKOLUQXDXXSD-JSGCOSHPSA-N	0	3	322.474	2.276	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CCO1	ZINC000116797981	401859861	/nfs/dbraw/zinc/85/98/61/401859861.db2.gz	AUBQIMAVGAKMMH-NSHDSACASA-N	0	3	317.216	2.396	10	0		DEAEHN
C[C@H](CCNCc1ccc(Br)cn1)[S@@](C)=O	ZINC000132542598	401869298	/nfs/dbraw/zinc/86/92/98/401869298.db2.gz	KPOTUHMHVDEVHJ-ABKXIKBNSA-N	0	3	305.241	2.091	10	0		DEAEHN
COc1cccc(CCCN2CCN(C[C@@H](C)O)[C@H](C)C2)c1	ZINC000119140040	401928121	/nfs/dbraw/zinc/92/81/21/401928121.db2.gz	HCWGASYMENBYFI-HZPDHXFCSA-N	0	3	306.450	2.015	10	0		DEAEHN
CC(C)N1CCO[C@H](CN2CCN(CCC3CCCC3)CC2)C1	ZINC000119180079	401931646	/nfs/dbraw/zinc/93/16/46/401931646.db2.gz	NEZSLQLMLJABJV-LJQANCHMSA-N	0	3	323.525	2.294	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc(-n2nc(C)cc2C)cc1	ZINC000079921493	401883829	/nfs/dbraw/zinc/88/38/29/401883829.db2.gz	DXBWMCKECKBBIS-GOSISDBHSA-N	0	3	317.433	2.366	10	0		DEAEHN
Cc1ccc(F)c(OCC(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000133407883	401884834	/nfs/dbraw/zinc/88/48/34/401884834.db2.gz	IIWRKIKAEQXADF-KBPBESRZSA-N	0	3	306.381	2.208	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)NCCN1CCCC[C@H]1C	ZINC000080564223	401889975	/nfs/dbraw/zinc/88/99/75/401889975.db2.gz	DUUARLIXEVFPBG-OAHLLOKOSA-N	0	3	321.469	2.213	10	0		DEAEHN
Cc1cc(CN2CCC[C@H](n3cncn3)C2)ccc1-n1cncn1	ZINC000119484099	401953549	/nfs/dbraw/zinc/95/35/49/401953549.db2.gz	CUKZYTGLVUGOJE-INIZCTEOSA-N	0	3	323.404	2.004	10	0		DEAEHN
CC[C@@H](CO)NC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000119583495	401960337	/nfs/dbraw/zinc/96/03/37/401960337.db2.gz	VNTCDWUGFMSDQQ-FUHWJXTLSA-N	0	3	319.449	2.111	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)N[C@H]1CCCN(CC)C1	ZINC000119781835	401966338	/nfs/dbraw/zinc/96/63/38/401966338.db2.gz	APDXGNINLKXCQQ-ZDUSSCGKSA-N	0	3	310.467	2.201	10	0		DEAEHN
NC(=O)C1CCC(NCc2cc(Cl)cc3c2OCC3)CC1	ZINC000136400550	401967298	/nfs/dbraw/zinc/96/72/98/401967298.db2.gz	YRXYMIUDZYNHND-UHFFFAOYSA-N	0	3	308.809	2.409	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)N[C@@H]2CCCc3sccc32)CCO1	ZINC000136621875	401970181	/nfs/dbraw/zinc/97/01/81/401970181.db2.gz	HBUFQKFJUOQOCD-GXTWGEPZSA-N	0	3	323.462	2.098	10	0		DEAEHN
CC[C@]1(C)C[C@@H]1C(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000136948372	401976166	/nfs/dbraw/zinc/97/61/66/401976166.db2.gz	ZNXXKNYRBNFGCR-LZLYRXPVSA-N	0	3	307.482	2.051	10	0		DEAEHN
COc1cccc(C(=O)N(CCN(C)C)C[C@@H]2CCCO2)c1F	ZINC000090552979	401985070	/nfs/dbraw/zinc/98/50/70/401985070.db2.gz	XQQYAOZBRSWNIR-ZDUSSCGKSA-N	0	3	324.396	2.017	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H]1CCN(C)c2ccccc21)N(C)C	ZINC000137717424	401985134	/nfs/dbraw/zinc/98/51/34/401985134.db2.gz	FECJXLLRYQLVAX-RHSMWYFYSA-N	0	3	303.450	2.457	10	0		DEAEHN
C[C@H](NCC(=O)NC(=O)NC1CC1)c1ccc2ccccc2c1	ZINC000120451413	401990378	/nfs/dbraw/zinc/99/03/78/401990378.db2.gz	HHGFAFYHTNUMCN-LBPRGKRZSA-N	0	3	311.385	2.479	10	0		DEAEHN
Cc1ccc([C@@H](C)N(C)CCn2nc3ccccn3c2=O)cc1	ZINC000047965067	401991410	/nfs/dbraw/zinc/99/14/10/401991410.db2.gz	KKSQFRRSUPRBOK-OAHLLOKOSA-N	0	3	310.401	2.497	10	0		DEAEHN
Cc1cccc(F)c1NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000120533497	401992801	/nfs/dbraw/zinc/99/28/01/401992801.db2.gz	UAVIWJBQBKKOBK-CHWSQXEVSA-N	0	3	321.396	2.014	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000150776081	401995126	/nfs/dbraw/zinc/99/51/26/401995126.db2.gz	ZJZSSEQDAHHQPL-LSDHHAIUSA-N	0	3	317.433	2.087	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)Nc1cc(COC)ncn1	ZINC000093312196	402013715	/nfs/dbraw/zinc/01/37/15/402013715.db2.gz	SMQRFBYPBWTMBZ-AWEZNQCLSA-N	0	3	321.425	2.009	10	0		DEAEHN
Cc1ccccc1[C@@H](C)NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000049172802	402013905	/nfs/dbraw/zinc/01/39/05/402013905.db2.gz	DEKSCPILBCYQFF-CVEARBPZSA-N	0	3	319.449	2.202	10	0		DEAEHN
C[C@@H]1CCCCN1C(=O)CN1CC[C@H](CNc2ccccn2)C1	ZINC000151105551	402016542	/nfs/dbraw/zinc/01/65/42/402016542.db2.gz	LKGNTYSBQUBZKA-HZPDHXFCSA-N	0	3	316.449	2.216	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(N(C)C)cc1F	ZINC000151314247	402028914	/nfs/dbraw/zinc/02/89/14/402028914.db2.gz	HMBMYJQFTILHQX-GXTWGEPZSA-N	0	3	305.397	2.200	10	0		DEAEHN
Cc1cnc(CCN(C)C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)s1	ZINC000121352342	402030146	/nfs/dbraw/zinc/03/01/46/402030146.db2.gz	ZREJXTLYHFTKNG-AAEUAGOBSA-N	0	3	322.478	2.261	10	0		DEAEHN
CSc1ccc(O[C@@H](C)C(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000151601467	402045858	/nfs/dbraw/zinc/04/58/58/402045858.db2.gz	CEZCGSIKLQPWIH-STQMWFEESA-N	0	3	308.447	2.338	10	0		DEAEHN
CCO[C@H](C)c1nc(CN2CCO[C@H](CN(C)C)C2)cs1	ZINC000120736821	402000211	/nfs/dbraw/zinc/00/02/11/402000211.db2.gz	RXABHOUKVHCCHH-TZMCWYRMSA-N	0	3	313.467	2.003	10	0		DEAEHN
COc1cccc(Cl)c1CC(=O)NCCN1CCCCC1	ZINC000152984474	402120172	/nfs/dbraw/zinc/12/01/72/402120172.db2.gz	DMFBXJMUOQZEII-UHFFFAOYSA-N	0	3	310.825	2.493	10	0		DEAEHN
COc1cccc(OCC(=O)NCCN2CCCC[C@H]2C)c1	ZINC000055377124	402080825	/nfs/dbraw/zinc/08/08/25/402080825.db2.gz	GYJMJSLUHANJIB-CQSZACIVSA-N	0	3	306.406	2.065	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)CCc2ccc(F)cc2)C1	ZINC000056752799	402090343	/nfs/dbraw/zinc/09/03/43/402090343.db2.gz	KAGUOOFOOUPXBH-MRXNPFEDSA-N	0	3	307.413	2.494	10	0		DEAEHN
Cc1ccc(C)c(OC[C@@H](O)CN2CCCN(C3CC3)CC2)c1	ZINC000061041166	402106838	/nfs/dbraw/zinc/10/68/38/402106838.db2.gz	KKVJSAGKSMLZOG-SFHVURJKSA-N	0	3	318.461	2.213	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)NC[C@H](O)C(C)C)c1ccccc1	ZINC000152951960	402118952	/nfs/dbraw/zinc/11/89/52/402118952.db2.gz	RJSWKOJVCZBERV-IRXDYDNUSA-N	0	3	321.465	2.386	10	0		DEAEHN
Cc1ccc2c(c1)[C@@H](NCC1(C(N)=O)CCOCC1)CCCO2	ZINC000153162974	402130278	/nfs/dbraw/zinc/13/02/78/402130278.db2.gz	IXBOFTRZGYCWJI-HNNXBMFYSA-N	0	3	318.417	2.080	10	0		DEAEHN
Cc1cc(S(=O)(=O)NCc2ccc3c(c2)CNC3)c(C)s1	ZINC000097829559	402133243	/nfs/dbraw/zinc/13/32/43/402133243.db2.gz	LTKDJNNANYXPQR-UHFFFAOYSA-N	0	3	322.455	2.447	10	0		DEAEHN
CC[C@H](NCC1(C(N)=O)CCOCC1)c1ccccc1OC	ZINC000153211723	402133605	/nfs/dbraw/zinc/13/36/05/402133605.db2.gz	XAZVDWFIQSWMGG-AWEZNQCLSA-N	0	3	306.406	2.018	10	0		DEAEHN
Cc1nc(C)c(CN[C@H]2CCCN(c3cccnn3)C2)s1	ZINC000123665747	402140763	/nfs/dbraw/zinc/14/07/63/402140763.db2.gz	ZKZZIPOYKQMMMF-ZDUSSCGKSA-N	0	3	303.435	2.309	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1cc(C)cc(F)c1	ZINC000153431799	402144369	/nfs/dbraw/zinc/14/43/69/402144369.db2.gz	DSVCFFAWBSCEQT-HNNXBMFYSA-N	0	3	321.396	2.015	10	0		DEAEHN
COC[C@@H](C)C(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000103387368	402186467	/nfs/dbraw/zinc/18/64/67/402186467.db2.gz	DPDBKCXJXTWQBB-WBVHZDCISA-N	0	3	304.434	2.440	10	0		DEAEHN
COC[C@H](C)C(=O)N(CCN(C)C)Cc1ccc(F)cc1F	ZINC000103432738	402188149	/nfs/dbraw/zinc/18/81/49/402188149.db2.gz	CQXMZTVIPKHFEM-LBPRGKRZSA-N	0	3	314.376	2.138	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N[C@H](CC(C)C)CN(C)C)ccc1F	ZINC000068224460	402188214	/nfs/dbraw/zinc/18/82/14/402188214.db2.gz	NDJFCJFXSWURDA-CQSZACIVSA-N	0	3	323.412	2.490	10	0		DEAEHN
COc1cccc(CNC(=O)N[C@H](C)CN2CCC[C@@H](C)C2)n1	ZINC000101993179	402160608	/nfs/dbraw/zinc/16/06/08/402160608.db2.gz	JETUSIHNEWLTMG-ZIAGYGMSSA-N	0	3	320.437	2.010	10	0		DEAEHN
COc1ccc2oc(CNC[C@@H]3CN(C4CC4)CCO3)cc2c1	ZINC000125173685	402217238	/nfs/dbraw/zinc/21/72/38/402217238.db2.gz	LSPPVYHRJSIRRT-QGZVFWFLSA-N	0	3	316.401	2.394	10	0		DEAEHN
CCC(CC)(CC)CNC(=O)NC[C@H](O)CN1CCCCC1	ZINC000154719479	402227363	/nfs/dbraw/zinc/22/73/63/402227363.db2.gz	JZNWJDVLBXVMRW-HNNXBMFYSA-N	0	3	313.486	2.349	10	0		DEAEHN
COc1ccc([O-])c(C(=O)N2CCC([NH+]3CCCC3)CC2)c1	ZINC000108894927	402264013	/nfs/dbraw/zinc/26/40/13/402264013.db2.gz	BKCCLVLGYFPGMC-UHFFFAOYSA-N	0	3	304.390	2.101	10	0		DEAEHN
COc1ccccc1C[C@@H](C)CC(=O)N1CC[C@H](N(C)C)C1	ZINC000107246899	402228921	/nfs/dbraw/zinc/22/89/21/402228921.db2.gz	MOESILUBBVKFAJ-ZBFHGGJFSA-N	0	3	304.434	2.426	10	0		DEAEHN
Cc1noc(C)c1CCNC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000107389070	402232034	/nfs/dbraw/zinc/23/20/34/402232034.db2.gz	ZRKACKBDCQCMHB-AWEZNQCLSA-N	0	3	310.442	2.109	10	0		DEAEHN
COc1ncccc1C(=O)N1CCCC[C@@H](N2CCCC2)C1	ZINC000107529985	402234554	/nfs/dbraw/zinc/23/45/54/402234554.db2.gz	IUJRFQFSHDFWDY-CQSZACIVSA-N	0	3	303.406	2.181	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H](C)N(C)Cc1ccccc1)N(C)C	ZINC000154878108	402236978	/nfs/dbraw/zinc/23/69/78/402236978.db2.gz	CRTALKUFTSYMPK-WBVHZDCISA-N	0	3	305.466	2.353	10	0		DEAEHN
Cc1ccc([C@@H](CNC(=O)c2c[nH]c(=O)cc2C)N(C)C)cc1	ZINC000125944080	402257718	/nfs/dbraw/zinc/25/77/18/402257718.db2.gz	XCXDVGLBRQWPPE-MRXNPFEDSA-N	0	3	313.401	2.024	10	0		DEAEHN
CC(=O)CCN(Cc1ccccc1)[C@@H](C)CN1CCOCC1	ZINC000155713698	402265439	/nfs/dbraw/zinc/26/54/39/402265439.db2.gz	NLBCNPJYXFGLFZ-INIZCTEOSA-N	0	3	304.434	2.188	10	0		DEAEHN
CN(C[C@H]1CCN(C)C1)C(=O)c1ccc(Br)o1	ZINC000071190455	402271393	/nfs/dbraw/zinc/27/13/93/402271393.db2.gz	JUVRFTMZNWZTEH-VIFPVBQESA-N	0	3	301.184	2.066	10	0		DEAEHN
COCCC1(CNC(=O)NCCN2CCCC[C@@H]2C)CCC1	ZINC000156513962	402283719	/nfs/dbraw/zinc/28/37/19/402283719.db2.gz	JCBRUWHERZSWLX-HNNXBMFYSA-N	0	3	311.470	2.367	10	0		DEAEHN
CN(CCN1CCC[C@@H]1C(=O)NC1CC1)Cc1ccc(F)cc1	ZINC000158651145	402309885	/nfs/dbraw/zinc/30/98/85/402309885.db2.gz	FLJNWVDLRXSLPA-QGZVFWFLSA-N	0	3	319.424	2.001	10	0		DEAEHN
Cn1cc(-c2cc(CN3CCN(C4CCCC4)CC3)on2)cn1	ZINC000184980275	402314100	/nfs/dbraw/zinc/31/41/00/402314100.db2.gz	LACIFUXERWQTEZ-UHFFFAOYSA-N	0	3	315.421	2.135	10	0		DEAEHN
Cc1c2ccccc2[nH]c(=O)c1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000176519940	402316897	/nfs/dbraw/zinc/31/68/97/402316897.db2.gz	CJAYAKPDPDHJGP-CYBMUJFWSA-N	0	3	311.385	2.169	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1cc(F)ccc1C	ZINC000176900772	402348068	/nfs/dbraw/zinc/34/80/68/402348068.db2.gz	KXLKWFKQWMTPER-AWEZNQCLSA-N	0	3	321.396	2.015	10	0		DEAEHN
C[C@H](CC(F)(F)F)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000231791489	402356265	/nfs/dbraw/zinc/35/62/65/402356265.db2.gz	IYBVUUSOUGSVSP-BDAKNGLRSA-N	0	3	310.341	2.326	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)c1ccc(Cl)cc1	ZINC000176992509	402357529	/nfs/dbraw/zinc/35/75/29/402357529.db2.gz	CVEMSSSLQCJHLS-CQSZACIVSA-N	0	3	308.809	2.465	10	0		DEAEHN
COCCOC[C@@H](O)CN(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000234683685	402360246	/nfs/dbraw/zinc/36/02/46/402360246.db2.gz	JJLRXMUMAJFMTL-WFASDCNBSA-N	0	3	301.814	2.357	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(C)nc2onc(C)c21	ZINC000177025557	402360604	/nfs/dbraw/zinc/36/06/04/402360604.db2.gz	GVRYHOSMBYHQFR-ZDUSSCGKSA-N	0	3	316.405	2.396	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc2c(c1)OCCO2	ZINC000177035787	402362331	/nfs/dbraw/zinc/36/23/31/402362331.db2.gz	SCDNSZDOWQSMCK-CQSZACIVSA-N	0	3	304.390	2.014	10	0		DEAEHN
CN1CCN(CCC(C)(C)NC(=O)NCCC2=CCCC2)CC1	ZINC000185595994	402363749	/nfs/dbraw/zinc/36/37/49/402363749.db2.gz	MGQUIDBDRNQUNO-UHFFFAOYSA-N	0	3	322.497	2.202	10	0		DEAEHN
COCCOc1ccc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc1	ZINC000177056963	402364845	/nfs/dbraw/zinc/36/48/45/402364845.db2.gz	PEFKZBGMILZTSB-YOEHRIQHSA-N	0	3	320.433	2.170	10	0		DEAEHN
CC(C)NC(=O)CCN[C@@H](C)c1ccccc1-n1cccn1	ZINC000177206459	402381737	/nfs/dbraw/zinc/38/17/37/402381737.db2.gz	SCCVGTGMXWUKIV-AWEZNQCLSA-N	0	3	300.406	2.438	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1c(F)cccc1Br	ZINC000226644534	402329643	/nfs/dbraw/zinc/32/96/43/402329643.db2.gz	YBXAYJDGHCUEGB-VIFPVBQESA-N	0	3	315.186	2.412	10	0		DEAEHN
CC(C)[C@@H]1OCCC[C@H]1CNC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000176799523	402338344	/nfs/dbraw/zinc/33/83/44/402338344.db2.gz	XKGSCWFHLTYDOY-ULQDDVLXSA-N	0	3	321.465	2.093	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCc1cccc(OC)c1	ZINC000177369303	402395601	/nfs/dbraw/zinc/39/56/01/402395601.db2.gz	QRFRKEVNYDFHAB-MRXNPFEDSA-N	0	3	319.449	2.363	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)NC1CCN(C2CC2)CC1	ZINC000186093274	402400827	/nfs/dbraw/zinc/40/08/27/402400827.db2.gz	NTNURGLDOVGGIC-UHFFFAOYSA-N	0	3	321.396	2.260	10	0		DEAEHN
Cc1c(Cl)cc(S(=O)(=O)N2CCCNCC2)cc1Cl	ZINC000237611486	402415328	/nfs/dbraw/zinc/41/53/28/402415328.db2.gz	IABOHCAGADQPJM-UHFFFAOYSA-N	0	3	323.245	2.286	10	0		DEAEHN
CC(C)Cc1ncc(CNC[C@H]2CN(C3CC3)CCO2)s1	ZINC000162552779	402423856	/nfs/dbraw/zinc/42/38/56/402423856.db2.gz	RPMBZNQDIFHGNV-AWEZNQCLSA-N	0	3	309.479	2.294	10	0		DEAEHN
CCO[C@H]1C[C@H](NCc2cccc(N(C)C)n2)C12CCOCC2	ZINC000186433394	402430828	/nfs/dbraw/zinc/43/08/28/402430828.db2.gz	JNRQUBGFSDYKGQ-HOTGVXAUSA-N	0	3	319.449	2.211	10	0		DEAEHN
Cc1c(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cnn1CC(C)C	ZINC000162813075	402432697	/nfs/dbraw/zinc/43/26/97/402432697.db2.gz	MUQABUXFFRSHRI-DZGCQCFKSA-N	0	3	304.438	2.156	10	0		DEAEHN
Cc1ccc(OC[C@@H](O)CN2CCN3CCCC[C@@H]3C2)c(C)c1	ZINC000177765728	402434048	/nfs/dbraw/zinc/43/40/48/402434048.db2.gz	DSNCTBSWERTCTO-MSOLQXFVSA-N	0	3	318.461	2.213	10	0		DEAEHN
O=C1O[C@H](CN2CCN3CCCC[C@@H]3C2)CN1c1ccccc1	ZINC000177775391	402435239	/nfs/dbraw/zinc/43/52/39/402435239.db2.gz	WIBMHZSSINHHDO-IAGOWNOFSA-N	0	3	315.417	2.182	10	0		DEAEHN
NC1(C(=O)NCc2ccc(Cl)cc2)Cc2ccccc2C1	ZINC000163352793	402448070	/nfs/dbraw/zinc/44/80/70/402448070.db2.gz	MCPGVLJJIRHYDS-UHFFFAOYSA-N	0	3	300.789	2.453	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H]1CCCN(Cc2ccccc2)C1)N(C)C	ZINC000161540324	402390876	/nfs/dbraw/zinc/39/08/76/402390876.db2.gz	QZPUQQBJZLHLGS-ROUUACIJSA-N	0	3	317.477	2.498	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H]1CCN(c2ccccc2)C1)N(C)C	ZINC000161554808	402391597	/nfs/dbraw/zinc/39/15/97/402391597.db2.gz	AWQWOXSQSITVOH-DOTOQJQBSA-N	0	3	303.450	2.359	10	0		DEAEHN
NC(=O)[C@@H](Cc1ccc(Cl)cc1)NCCCc1ccccn1	ZINC000185953440	402392500	/nfs/dbraw/zinc/39/25/00/402392500.db2.gz	NAKSZXMMPUJIJY-MRXNPFEDSA-N	0	3	317.820	2.354	10	0		DEAEHN
O=C1[C@@H](N2CCN3CCC[C@H]3C2)CCN1c1cccc(Cl)c1	ZINC000246114422	402511203	/nfs/dbraw/zinc/51/12/03/402511203.db2.gz	CPWXJBAJDZLONJ-HOTGVXAUSA-N	0	3	319.836	2.225	10	0		DEAEHN
COC[C@@H](C)CN[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000187795618	402511294	/nfs/dbraw/zinc/51/12/94/402511294.db2.gz	WOMGQSOTRNWMNF-DOTOQJQBSA-N	0	3	304.434	2.092	10	0		DEAEHN
CSc1nsc(NC(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)n1	ZINC000246121294	402511725	/nfs/dbraw/zinc/51/17/25/402511725.db2.gz	YOWYYLISMNJBHV-DTWKUNHWSA-N	0	3	315.468	2.110	10	0		DEAEHN
COCCOc1ccc(CN2CCS[C@@H]3COCC[C@H]32)cc1	ZINC000246122751	402511771	/nfs/dbraw/zinc/51/17/71/402511771.db2.gz	KKSALMINTMAXJP-IAGOWNOFSA-N	0	3	323.458	2.418	10	0		DEAEHN
C[C@@H]1CCN(C[C@@H](O)Cn2cccn2)[C@@H]1c1cccc(F)c1	ZINC000245408047	402457509	/nfs/dbraw/zinc/45/75/09/402457509.db2.gz	FHWOSXPYLYQAPN-XYPHTWIQSA-N	0	3	303.381	2.466	10	0		DEAEHN
CC[C@@H]1CN(CC(=O)N2CCNC2=O)CC[C@H]1c1ccccc1	ZINC000245411336	402457658	/nfs/dbraw/zinc/45/76/58/402457658.db2.gz	WKMZJFCYNQDUEL-GDBMZVCRSA-N	0	3	315.417	2.054	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C)C(=O)NCc1ccccc1	ZINC000245456705	402462446	/nfs/dbraw/zinc/46/24/46/402462446.db2.gz	BOAIQYAPXRYMEO-WBVHZDCISA-N	0	3	303.450	2.107	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)NCc1ccccc1F	ZINC000245471605	402463880	/nfs/dbraw/zinc/46/38/80/402463880.db2.gz	OCTOAVGJXSAKDF-GDBMZVCRSA-N	0	3	321.440	2.247	10	0		DEAEHN
CC(C)(N)C(=O)NCc1ccc(Oc2ccc(F)cc2)nc1	ZINC000164763488	402468210	/nfs/dbraw/zinc/46/82/10/402468210.db2.gz	FVEOLSURXIISRR-UHFFFAOYSA-N	0	3	303.337	2.367	10	0		DEAEHN
Cc1cc(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc(=O)[nH]1	ZINC000245560030	402470645	/nfs/dbraw/zinc/47/06/45/402470645.db2.gz	IYWQTAGYMLRPBH-WBVHZDCISA-N	0	3	311.385	2.271	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCc2ccncc2)[C@H]1c1ccccc1	ZINC000245630402	402475401	/nfs/dbraw/zinc/47/54/01/402475401.db2.gz	HOWOPGGBRJKFEN-DLBZAZTESA-N	0	3	310.401	2.326	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCc2cscn2)[C@H]1c1ccccc1	ZINC000245648755	402476838	/nfs/dbraw/zinc/47/68/38/402476838.db2.gz	MFUGWOWUHVGXES-HUUCEWRRSA-N	0	3	316.430	2.388	10	0		DEAEHN
COC(=O)c1occc1CN1CCC[C@@H]1Cn1ccnc1C	ZINC000178306845	402482727	/nfs/dbraw/zinc/48/27/27/402482727.db2.gz	LUGOTQOBPAXXAG-CQSZACIVSA-N	0	3	303.362	2.236	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N[C@H]2Cc3ccccc3[C@@H]2O)c1	ZINC000178326353	402485308	/nfs/dbraw/zinc/48/53/08/402485308.db2.gz	IUQAXRSPSKXKJU-ROUUACIJSA-N	0	3	310.397	2.136	10	0		DEAEHN
COc1cc(CN2CC[C@H]3OCCC[C@H]3C2)cc2c1OCCO2	ZINC000245771278	402486849	/nfs/dbraw/zinc/48/68/49/402486849.db2.gz	RUFLZGPBMMQVPR-LSDHHAIUSA-N	0	3	319.401	2.467	10	0		DEAEHN
CN1CC[C@@H](NC(=O)Cc2cccc(O)c2)[C@H]1c1ccccc1	ZINC000245916369	402497066	/nfs/dbraw/zinc/49/70/66/402497066.db2.gz	RXOWNMHDBKNGEV-IEBWSBKVSA-N	0	3	310.397	2.496	10	0		DEAEHN
CCNc1ncc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2CC)s1	ZINC000245917858	402497581	/nfs/dbraw/zinc/49/75/81/402497581.db2.gz	FTYRLEPBVJZVRY-RYUDHWBXSA-N	0	3	308.451	2.274	10	0		DEAEHN
CC(C)[C@@H](O)CC(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1	ZINC000187456001	402501884	/nfs/dbraw/zinc/50/18/84/402501884.db2.gz	YWQKCQGQRAXPOT-ROUUACIJSA-N	0	3	318.461	2.420	10	0		DEAEHN
Cc1ccc(OCCCN2CCN(CCO)[C@H](C)C2)cc1C	ZINC000187677873	402508031	/nfs/dbraw/zinc/50/80/31/402508031.db2.gz	VPUVSCPUXIYFBG-QGZVFWFLSA-N	0	3	306.450	2.071	10	0		DEAEHN
C[C@@H]1CN(CCCSCc2ccccc2)CCN1CCO	ZINC000187695242	402508583	/nfs/dbraw/zinc/50/85/83/402508583.db2.gz	IOQCISHLFXFFRQ-MRXNPFEDSA-N	0	3	308.491	2.308	10	0		DEAEHN
COc1cccc(C[C@@H](NCc2cc(C(N)=O)co2)C2CC2)c1	ZINC000187713334	402509285	/nfs/dbraw/zinc/50/92/85/402509285.db2.gz	DFJKVBVBEDUZCX-QGZVFWFLSA-N	0	3	314.385	2.498	10	0		DEAEHN
C[C@@H](O)CCN(C)C[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000246726715	402542830	/nfs/dbraw/zinc/54/28/30/402542830.db2.gz	MONFQVMHKPWQNC-GHMZBOCLSA-N	0	3	322.232	2.436	10	0		DEAEHN
CCc1nc(CNC(=O)N(C)[C@H]2CCN(C)C[C@H]2C)cs1	ZINC000246753083	402543246	/nfs/dbraw/zinc/54/32/46/402543246.db2.gz	ZMQAXXMTCJKVHW-YPMHNXCESA-N	0	3	310.467	2.187	10	0		DEAEHN
Cc1cccc2[nH]c(CCC(=O)N(C)C3CCN(C)CC3)nc21	ZINC000178847400	402546322	/nfs/dbraw/zinc/54/63/22/402546322.db2.gz	VOQAMGTWLOQHLY-UHFFFAOYSA-N	0	3	314.433	2.357	10	0		DEAEHN
Cc1csc(CCCCNC(=O)NC[C@@H]2CCCN2C)n1	ZINC000171053066	402552920	/nfs/dbraw/zinc/55/29/20/402552920.db2.gz	ITQMXVSVVUHRRN-ZDUSSCGKSA-N	0	3	310.467	2.168	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)ccc1F	ZINC000247046324	402554776	/nfs/dbraw/zinc/55/47/76/402554776.db2.gz	GUZUTMGWBAYIFB-FZMZJTMJSA-N	0	3	319.380	2.093	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)COc1ccccc1Cl	ZINC000247252805	402561536	/nfs/dbraw/zinc/56/15/36/402561536.db2.gz	NQJVNJJIMUDVOI-STQMWFEESA-N	0	3	308.809	2.414	10	0		DEAEHN
Cc1nnc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)s1	ZINC000179016194	402565392	/nfs/dbraw/zinc/56/53/92/402565392.db2.gz	MIOZWWRYSWYJNG-QWHCGFSZSA-N	0	3	317.418	2.413	10	0		DEAEHN
CC(C)COC[C@@H](NC(=O)NC[C@@H]1CCCN1C)c1ccco1	ZINC000171191646	402565478	/nfs/dbraw/zinc/56/54/78/402565478.db2.gz	KMIHLOYVARHBTD-LSDHHAIUSA-N	0	3	323.437	2.387	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(Br)c[nH]1	ZINC000247469598	402568351	/nfs/dbraw/zinc/56/83/51/402568351.db2.gz	RNMMSMJOTSEJAI-ONGXEEELSA-N	0	3	312.211	2.086	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(Br)cn1	ZINC000247494843	402569633	/nfs/dbraw/zinc/56/96/33/402569633.db2.gz	UORFEHKHFAXYTN-JQWIXIFHSA-N	0	3	324.222	2.153	10	0		DEAEHN
COC(=O)c1ccc(CNC(=O)[C@H](C)N2[C@@H](C)CC[C@@H]2C)cc1	ZINC000171235783	402569918	/nfs/dbraw/zinc/56/99/18/402569918.db2.gz	WKFIOSVJKAYODN-IHRRRGAJSA-N	0	3	318.417	2.351	10	0		DEAEHN
COc1cc(C)cc(CNC(=O)N2CCCN(C3CC3)CC2)c1	ZINC000179098525	402572637	/nfs/dbraw/zinc/57/26/37/402572637.db2.gz	BJJCYGGBMPLFAM-UHFFFAOYSA-N	0	3	317.433	2.383	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1cn2ccnc2s1)c1ccccc1	ZINC000188184066	402516976	/nfs/dbraw/zinc/51/69/76/402516976.db2.gz	MEMYYGDCXCPNKP-ZDUSSCGKSA-N	0	3	314.414	2.429	10	0		DEAEHN
C[C@@H](C(=O)Nc1cccc(Cl)c1)N1CCN2CCC[C@@H]2C1	ZINC000178623335	402518268	/nfs/dbraw/zinc/51/82/68/402518268.db2.gz	IDONSLSDIJYFQS-SWLSCSKDSA-N	0	3	307.825	2.447	10	0		DEAEHN
C[C@H](C(=O)NCCC1=CCCCC1)N1CCN2CCC[C@@H]2C1	ZINC000178629103	402519645	/nfs/dbraw/zinc/51/96/45/402519645.db2.gz	QEVDKCXORKOWLJ-NVXWUHKLSA-N	0	3	305.466	2.162	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N1CC[C@H](N2CCCC2)C1)c1ccccc1	ZINC000170746548	402519973	/nfs/dbraw/zinc/51/99/73/402519973.db2.gz	PZBJNHGLJCOYKL-BQFCYCMXSA-N	0	3	315.461	2.422	10	0		DEAEHN
O=C(CN1CCN2CCC[C@@H]2C1)Nc1ccc(F)cc1Cl	ZINC000178640796	402520899	/nfs/dbraw/zinc/52/08/99/402520899.db2.gz	FQQNTZUVAXGCKI-GFCCVEGCSA-N	0	3	311.788	2.198	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)C1	ZINC000246278801	402522714	/nfs/dbraw/zinc/52/27/14/402522714.db2.gz	ZVOQBHLFIXVWIF-XOYOTBSWSA-N	0	3	313.445	2.498	10	0		DEAEHN
O=C([C@H]1C[C@H](F)CN1)N1CCC[C@H](c2nc3ccccc3o2)C1	ZINC000188710874	402524772	/nfs/dbraw/zinc/52/47/72/402524772.db2.gz	FIDLJNPOXYGLAU-SGMGOOAPSA-N	0	3	317.364	2.234	10	0		DEAEHN
O=C(Cc1cccc(Br)c1)N1CCN2CCC[C@@H]2C1	ZINC000171279047	402573844	/nfs/dbraw/zinc/57/38/44/402573844.db2.gz	RTCRQQLUHVSCJK-CQSZACIVSA-N	0	3	323.234	2.298	10	0		DEAEHN
Cc1cccc(OC[C@H](C)NC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000170833316	402530959	/nfs/dbraw/zinc/53/09/59/402530959.db2.gz	BHCWOQQNURXXAT-LSDHHAIUSA-N	0	3	305.422	2.108	10	0		DEAEHN
CC(C)c1nc(CCNC(=O)N2CC[C@@H](N(C)C)C2)cs1	ZINC000170836596	402531627	/nfs/dbraw/zinc/53/16/27/402531627.db2.gz	QZTWQYWRGAFEIW-CYBMUJFWSA-N	0	3	310.467	2.155	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCCCCOCc2ccccc2)C1	ZINC000170835510	402531630	/nfs/dbraw/zinc/53/16/30/402531630.db2.gz	VZWNTZCRBGJRSN-KRWDZBQOSA-N	0	3	319.449	2.329	10	0		DEAEHN
CCN1CCN(C[C@H](C)CNC(=O)N2C[C@H](C)CC[C@H]2C)CC1	ZINC000246485480	402533316	/nfs/dbraw/zinc/53/33/16/402533316.db2.gz	VYQSFPDJMRIYJR-BRWVUGGUSA-N	0	3	324.513	2.090	10	0		DEAEHN
Cc1cc(C(=O)CCC(=O)N2CC[C@@H](N(C)C)C2)c(C)s1	ZINC000170860653	402534520	/nfs/dbraw/zinc/53/45/20/402534520.db2.gz	KBVBNCXZKACTAJ-CYBMUJFWSA-N	0	3	308.447	2.490	10	0		DEAEHN
C[C@@H]1CC[C@@H](NC(=O)NC[C@@](C)(O)CN(C)C)c2ccccc21	ZINC000246527078	402535500	/nfs/dbraw/zinc/53/55/00/402535500.db2.gz	JJBAXKYOMMQCOV-MZMPZRCHSA-N	0	3	319.449	2.237	10	0		DEAEHN
COCCc1ccccc1NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000189457153	402538932	/nfs/dbraw/zinc/53/89/32/402538932.db2.gz	DEWOQNDDCGCZNH-OAHLLOKOSA-N	0	3	303.406	2.187	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)CSC[C@@H]1CCCCO1	ZINC000171396906	402584202	/nfs/dbraw/zinc/58/42/02/402584202.db2.gz	FQFYRJUKYKIXLW-CABCVRRESA-N	0	3	316.511	2.381	10	0		DEAEHN
CCOC(=O)[C@H](c1ccccc1)N1CCN2CCCC[C@H]2C1	ZINC000248358074	402587374	/nfs/dbraw/zinc/58/73/74/402587374.db2.gz	QHRZDQKNJVLVBK-IRXDYDNUSA-N	0	3	302.418	2.461	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)NC2Cc3ccccc3C2)C1	ZINC000248394748	402589013	/nfs/dbraw/zinc/58/90/13/402589013.db2.gz	IHTJAMMBNTZFEI-WMZOPIPTSA-N	0	3	313.445	2.280	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)CCc2ccccc2)C[C@H]1C	ZINC000248564107	402596055	/nfs/dbraw/zinc/59/60/55/402596055.db2.gz	KFYKMZBYYAGOED-IEBWSBKVSA-N	0	3	320.477	2.023	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)N[C@H]1CCCC[C@H]1n1cccn1	ZINC000248567644	402596184	/nfs/dbraw/zinc/59/61/84/402596184.db2.gz	JTVBVRPNBWHAGG-JKSUJKDBSA-N	0	3	319.453	2.102	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000248581829	402597290	/nfs/dbraw/zinc/59/72/90/402597290.db2.gz	OWPZBEASMDLZDI-ZJIFWQFVSA-N	0	3	311.470	2.221	10	0		DEAEHN
O=C(N[C@H]1CCCOC1)N1CCCN(Cc2ccccc2)CC1	ZINC000171618908	402602309	/nfs/dbraw/zinc/60/23/09/402602309.db2.gz	XHSRMDAKZVFWJG-KRWDZBQOSA-N	0	3	317.433	2.083	10	0		DEAEHN
CCc1nsc(N2CC[C@H](CN(C)Cc3cccnc3)C2)n1	ZINC000190451371	402602530	/nfs/dbraw/zinc/60/25/30/402602530.db2.gz	JMOZLLKOYUWQJT-CQSZACIVSA-N	0	3	317.462	2.454	10	0		DEAEHN
CCN(C(=O)[C@@H](C)NCCn1cc(C)cn1)C1CCCCC1	ZINC000171632897	402603950	/nfs/dbraw/zinc/60/39/50/402603950.db2.gz	VZJUKSAESNNBPQ-OAHLLOKOSA-N	0	3	306.454	2.351	10	0		DEAEHN
C[C@H](O)CN1CCN(CCSCc2ccccc2)C[C@@H]1C	ZINC000248708326	402604936	/nfs/dbraw/zinc/60/49/36/402604936.db2.gz	BMKAORYSPCKVLK-HOTGVXAUSA-N	0	3	308.491	2.307	10	0		DEAEHN
CCC[C@@H](C)CN1CCN(C[C@@H]2CN(C(C)C)CCO2)CC1	ZINC000180089862	402606951	/nfs/dbraw/zinc/60/69/51/402606951.db2.gz	WQMJBMTYURUQPX-QZTJIDSGSA-N	0	3	311.514	2.149	10	0		DEAEHN
C[C@@H]1C[C@@H](O)C[C@H](C)N1C[C@@H](O)COc1ccc(Cl)cc1	ZINC000248748836	402607185	/nfs/dbraw/zinc/60/71/85/402607185.db2.gz	FWLAHVHGNZINCG-AYRXBEOTSA-N	0	3	313.825	2.313	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](NC[C@H]1CN(C)CCO1)CCS2	ZINC000248775388	402608256	/nfs/dbraw/zinc/60/82/56/402608256.db2.gz	AZMXPCDQMABJFZ-ZFWWWQNUSA-N	0	3	308.447	2.152	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000248834866	402610519	/nfs/dbraw/zinc/61/05/19/402610519.db2.gz	CNMQMUXIIDIKCN-NJAFHUGGSA-N	0	3	316.445	2.440	10	0		DEAEHN
OC[C@@H]1CN(CCO[C@@H]2CCCCO2)C[C@H]1c1ccsc1	ZINC000248836692	402610595	/nfs/dbraw/zinc/61/05/95/402610595.db2.gz	OMHYBMUFXZQEDS-HRCADAONSA-N	0	3	311.447	2.299	10	0		DEAEHN
CC(C)Cc1ncc(CN2C[C@@H](C)[C@@H](N3CCOCC3)C2)s1	ZINC000180237112	402610826	/nfs/dbraw/zinc/61/08/26/402610826.db2.gz	UKNKZCMHFZIEIW-ZBFHGGJFSA-N	0	3	323.506	2.494	10	0		DEAEHN
O=C(CCN1CCC[C@H](n2cncn2)C1)Nc1cccc(F)c1	ZINC000171701880	402612025	/nfs/dbraw/zinc/61/20/25/402612025.db2.gz	LYWIFMQZPLAYFF-HNNXBMFYSA-N	0	3	317.368	2.083	10	0		DEAEHN
O=C(NCc1cc(F)ccc1F)N1CCCN(C2CC2)CC1	ZINC000171708094	402612774	/nfs/dbraw/zinc/61/27/74/402612774.db2.gz	ZMAPDDBTBJIEDF-UHFFFAOYSA-N	0	3	309.360	2.345	10	0		DEAEHN
CC(C)[C@H](C)CNC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000180461564	402617405	/nfs/dbraw/zinc/61/74/05/402617405.db2.gz	VSMHVUJYNJZFGL-IAGOWNOFSA-N	0	3	324.513	2.090	10	0		DEAEHN
CN1CCO[C@@H](CN[C@@H]2CC3(CCC3)Oc3ccccc32)C1	ZINC000180501277	402618533	/nfs/dbraw/zinc/61/85/33/402618533.db2.gz	LGKLUTUVDXKYLE-GOEBONIOSA-N	0	3	302.418	2.353	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@H](C)N2CCc3ccccc3C2)C1	ZINC000171865611	402629833	/nfs/dbraw/zinc/62/98/33/402629833.db2.gz	DKDKSSCQDFJUDL-QAPCUYQASA-N	0	3	315.461	2.034	10	0		DEAEHN
COC(=O)[C@H](C)CN(Cc1ccccc1)C[C@@H](O)CSC	ZINC000249451389	402629958	/nfs/dbraw/zinc/62/99/58/402629958.db2.gz	MGTNWLOZWRILAB-UKRRQHHQSA-N	0	3	311.447	2.022	10	0		DEAEHN
Cc1ccc(NC(=O)CNC(=O)[C@]2(C)CCCCN2)c(Cl)c1	ZINC000180941565	402630398	/nfs/dbraw/zinc/63/03/98/402630398.db2.gz	HKXDJXULLUHRFW-INIZCTEOSA-N	0	3	323.824	2.235	10	0		DEAEHN
C[C@@]1(C(=O)NCCCc2nc3ccccc3[nH]2)CCCCN1	ZINC000180981807	402631657	/nfs/dbraw/zinc/63/16/57/402631657.db2.gz	FMVJSWYUHXZXLR-KRWDZBQOSA-N	0	3	300.406	2.144	10	0		DEAEHN
Cc1cccc(CN(CCN(C)C)C(=O)N[C@@H]2CCCOC2)c1	ZINC000172029652	402637442	/nfs/dbraw/zinc/63/74/42/402637442.db2.gz	LKHGJPJCYAQJOV-QGZVFWFLSA-N	0	3	319.449	2.247	10	0		DEAEHN
O=C(NCCOC1CCCCCC1)N1CCN2CCC[C@@H]2C1	ZINC000172478972	402658507	/nfs/dbraw/zinc/65/85/07/402658507.db2.gz	CYVOOYGGJHLTDU-OAHLLOKOSA-N	0	3	309.454	2.215	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2cccnc2-n2cncn2)C12CCC2	ZINC000181504908	402647969	/nfs/dbraw/zinc/64/79/69/402647969.db2.gz	OZSASDDBKIFKJE-HUUCEWRRSA-N	0	3	313.405	2.100	10	0		DEAEHN
O=S1(=O)CC[C@H](N[C@@H]2C[C@@H]3OCCC[C@H]23)c2ccccc21	ZINC000252059634	402652717	/nfs/dbraw/zinc/65/27/17/402652717.db2.gz	ZPSFZKWCOSUPEV-BEAPCOKYSA-N	0	3	307.415	2.062	10	0		DEAEHN
Cc1nc(C)n(C[C@H]2CCCN(Cc3ccc(CO)cc3)C2)n1	ZINC000182756822	402713977	/nfs/dbraw/zinc/71/39/77/402713977.db2.gz	HXEXPFYDPDIPKS-SFHVURJKSA-N	0	3	314.433	2.299	10	0		DEAEHN
CCc1nc(CNC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cs1	ZINC000182766235	402714817	/nfs/dbraw/zinc/71/48/17/402714817.db2.gz	QRXBOWNELLXJMS-GXTWGEPZSA-N	0	3	322.478	2.331	10	0		DEAEHN
Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000173884325	402716961	/nfs/dbraw/zinc/71/69/61/402716961.db2.gz	GHXZRRHBLGDMSA-LSDHHAIUSA-N	0	3	310.463	2.310	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CC[C@]3(O)CCCC[C@H]3C2)C1	ZINC000252696017	402660831	/nfs/dbraw/zinc/66/08/31/402660831.db2.gz	LQQFMKYKLGLPNK-MUQADHOPSA-N	0	3	323.481	2.052	10	0		DEAEHN
O=C(c1cccc(Oc2cnccn2)c1)N1CCN2CCC[C@@H]2C1	ZINC000172570865	402663138	/nfs/dbraw/zinc/66/31/38/402663138.db2.gz	MGBJPQBPPWVCKJ-OAHLLOKOSA-N	0	3	324.384	2.189	10	0		DEAEHN
COc1cccc(F)c1[C@@H](C)NC(=O)NC1CCN(C)CC1	ZINC000173393614	402695604	/nfs/dbraw/zinc/69/56/04/402695604.db2.gz	FQDQWNOCAQNASH-LLVKDONJSA-N	0	3	309.385	2.289	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NCCCC(C)(C)CO)c1ccccc1	ZINC000173562723	402703006	/nfs/dbraw/zinc/70/30/06/402703006.db2.gz	MXYKADAYFXSDHD-INIZCTEOSA-N	0	3	321.465	2.387	10	0		DEAEHN
COc1ccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1O	ZINC000174072231	402725840	/nfs/dbraw/zinc/72/58/40/402725840.db2.gz	KYBGYKBBGMPANU-GXTWGEPZSA-N	0	3	321.421	2.025	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)N1CCc2sccc2C1	ZINC000262573127	402727195	/nfs/dbraw/zinc/72/71/95/402727195.db2.gz	XQCOPBZJAOVVRO-SUYBPPKGSA-N	0	3	320.458	2.165	10	0		DEAEHN
CCC(CC)N1C[C@H](C(=O)NCCN2CCCC[C@@H]2C)CC1=O	ZINC000192528594	402734888	/nfs/dbraw/zinc/73/48/88/402734888.db2.gz	CDOWFMVMFSSYBX-LSDHHAIUSA-N	0	3	323.481	2.014	10	0		DEAEHN
Cc1cnc([C@H](NC(=O)NC[C@@H]2CCCN2C)C2CC2)s1	ZINC000174350561	402737434	/nfs/dbraw/zinc/73/74/34/402737434.db2.gz	MYYWWTNZYMSEMT-QWHCGFSZSA-N	0	3	308.451	2.296	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCCOC2CCCC2)CCN1C	ZINC000174454855	402741976	/nfs/dbraw/zinc/74/19/76/402741976.db2.gz	UXQLQRWTRHDEBH-CABCVRRESA-N	0	3	311.470	2.460	10	0		DEAEHN
CC(C)(C)OC(=O)NC[C@@H]1CCCN1CCCn1ccnc1	ZINC000183182621	402744948	/nfs/dbraw/zinc/74/49/48/402744948.db2.gz	WOCBDHRQXYFUTN-AWEZNQCLSA-N	0	3	308.426	2.262	10	0		DEAEHN
Cc1ccc2cccc(-c3nc([C@@H]4CNCCN4C)no3)c2n1	ZINC000263232492	402748464	/nfs/dbraw/zinc/74/84/64/402748464.db2.gz	NOKSYLVMDHFBPQ-AWEZNQCLSA-N	0	3	309.373	2.169	10	0		DEAEHN
C[C@@H](Cc1nc([C@H]2CNCCN2C)no1)c1ccccc1F	ZINC000263247486	402750228	/nfs/dbraw/zinc/75/02/28/402750228.db2.gz	PLSZMYOYGYYKIK-SMDDNHRTSA-N	0	3	304.369	2.131	10	0		DEAEHN
CCc1noc(C)c1NC(=O)c1ccnc(OCCN(C)C)c1	ZINC000183247762	402750445	/nfs/dbraw/zinc/75/04/45/402750445.db2.gz	OMPPYRFBDZYTIU-UHFFFAOYSA-N	0	3	318.377	2.133	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(CCc2ccc(Cl)cc2)n1	ZINC000263252648	402750826	/nfs/dbraw/zinc/75/08/26/402750826.db2.gz	QCJBKGAMZKRVFC-ZDUSSCGKSA-N	0	3	306.797	2.084	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(Cc2csc3ccccc23)n1	ZINC000263254416	402751071	/nfs/dbraw/zinc/75/10/71/402751071.db2.gz	QJOTYNSTXBMQJZ-ZDUSSCGKSA-N	0	3	314.414	2.451	10	0		DEAEHN
Cc1cccc(O[C@H](C)c2nc([C@@H]3CNCCN3C)no2)c1	ZINC000263263011	402751755	/nfs/dbraw/zinc/75/17/55/402751755.db2.gz	RECJTIYTFDRTFW-OCCSQVGLSA-N	0	3	302.378	2.094	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2Cc3ccccc3S2)n1	ZINC000263269678	402752687	/nfs/dbraw/zinc/75/26/87/402752687.db2.gz	SARWOIBWJNQOAP-DGCLKSJQSA-N	0	3	302.403	2.035	10	0		DEAEHN
COc1ccc(C)cc1/C=C/c1nc([C@@H]2CNCCN2C)no1	ZINC000263297468	402755911	/nfs/dbraw/zinc/75/59/11/402755911.db2.gz	WOSYFZZBIPIFPC-DYLGSBMWSA-N	0	3	314.389	2.133	10	0		DEAEHN
C[C@@H](Sc1ccccc1)c1nc([C@H]2CNCCN2C)no1	ZINC000263316185	402757892	/nfs/dbraw/zinc/75/78/92/402757892.db2.gz	ZMSIYDIPCOBOJB-DGCLKSJQSA-N	0	3	304.419	2.499	10	0		DEAEHN
COC(=O)c1coc(C(=O)N2CCC[C@H]2CN2CCCCC2)c1	ZINC000183520993	402773656	/nfs/dbraw/zinc/77/36/56/402773656.db2.gz	NHXOXMNNIPMIHW-AWEZNQCLSA-N	0	3	320.389	2.157	10	0		DEAEHN
COc1cc(C)cc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1O	ZINC000175098545	402778955	/nfs/dbraw/zinc/77/89/55/402778955.db2.gz	UCFOPZREHDYVDU-OLZOCXBDSA-N	0	3	306.406	2.264	10	0		DEAEHN
COc1cc(CNCc2cccnc2-n2cncn2)ccc1C	ZINC000194239315	402788884	/nfs/dbraw/zinc/78/88/84/402788884.db2.gz	JYRJXBPCLWXUCB-UHFFFAOYSA-N	0	3	309.373	2.269	10	0		DEAEHN
CN1CCN(C(=O)CN[C@@H](c2ccc(Cl)cc2)C2CC2)CC1	ZINC000183728392	402792573	/nfs/dbraw/zinc/79/25/73/402792573.db2.gz	SPOUBENZFDFWCP-QGZVFWFLSA-N	0	3	321.852	2.155	10	0		DEAEHN
O[C@@H](Cc1ccccc1)CN1CCCN(c2ccccn2)CC1	ZINC000183779256	402796823	/nfs/dbraw/zinc/79/68/23/402796823.db2.gz	FDMLNXVYLYFIIG-SFHVURJKSA-N	0	3	311.429	2.197	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)N[C@@H](C)c1cccs1	ZINC000175337393	402798480	/nfs/dbraw/zinc/79/84/80/402798480.db2.gz	KALIUFOVRIZWSM-KBPBESRZSA-N	0	3	309.479	2.341	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCC[C@H](C(F)(F)F)C1	ZINC000175365654	402800824	/nfs/dbraw/zinc/80/08/24/402800824.db2.gz	BZSNJWFGPVOXJU-RYUDHWBXSA-N	0	3	307.360	2.455	10	0		DEAEHN
COc1ccccc1[C@@H](O)CNC(=O)[C@H](C)N1CCCCCC1	ZINC000175375402	402801508	/nfs/dbraw/zinc/80/15/08/402801508.db2.gz	URSXZPMSRQJXNU-HOCLYGCPSA-N	0	3	320.433	2.109	10	0		DEAEHN
CCN(CCO)CCNC(=O)[C@H]1C[C@@H]1c1ccc(C(C)C)cc1	ZINC000183955788	402808369	/nfs/dbraw/zinc/80/83/69/402808369.db2.gz	QZFBBDPSFCLRLT-MSOLQXFVSA-N	0	3	318.461	2.344	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1c[nH]nc1-c1ccc(F)cc1	ZINC000194714054	402811824	/nfs/dbraw/zinc/81/18/24/402811824.db2.gz	IGHGNFOOLRKAKP-ZDUSSCGKSA-N	0	3	302.353	2.040	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)[C@H](C)N1[C@@H](C)CC[C@@H]1C	ZINC000175925608	402843234	/nfs/dbraw/zinc/84/32/34/402843234.db2.gz	KDMCBYZXHDYMLM-KKUMJFAQSA-N	0	3	306.454	2.417	10	0		DEAEHN
COc1cc(CN2CCSC3(CCOCC3)C2)ccc1O	ZINC000194995604	402825743	/nfs/dbraw/zinc/82/57/43/402825743.db2.gz	HYOJAHOQIFGXLF-UHFFFAOYSA-N	0	3	309.431	2.499	10	0		DEAEHN
COCCCN(CCOC)Cc1ccc2c(c1)sc(=O)n2C	ZINC000194993963	402825747	/nfs/dbraw/zinc/82/57/47/402825747.db2.gz	NTQBKDJROQKQHO-UHFFFAOYSA-N	0	3	324.446	2.085	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)Nc1ccc([S@@](C)=O)cc1	ZINC000175787782	402832902	/nfs/dbraw/zinc/83/29/02/402832902.db2.gz	PJLAWZLDQUJMTB-MCMMXHMISA-N	0	3	323.462	2.420	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)CC[C@H]1CCOC1	ZINC000175834701	402836922	/nfs/dbraw/zinc/83/69/22/402836922.db2.gz	CCHKUCRVYZONLZ-DLBZAZTESA-N	0	3	304.434	2.092	10	0		DEAEHN
C[C@H]1CCN(CCCN2C(=O)CNC2=O)[C@@H]1c1cccc(F)c1	ZINC000175149458	402783385	/nfs/dbraw/zinc/78/33/85/402783385.db2.gz	RDQBVVBVLRPGML-LRDDRELGSA-N	0	3	319.380	2.151	10	0		DEAEHN
COc1ccc(SCC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000195318451	402841732	/nfs/dbraw/zinc/84/17/32/402841732.db2.gz	FJXXRVNGEDVPOW-CYBMUJFWSA-N	0	3	306.431	2.094	10	0		DEAEHN
Cc1cc(C)n(-c2ccc(C(=O)N3CCN4CCC[C@@H]4C3)cc2)n1	ZINC000195313398	402841785	/nfs/dbraw/zinc/84/17/85/402841785.db2.gz	XYZCBWCTVPXARY-GOSISDBHSA-N	0	3	324.428	2.409	10	0		DEAEHN
CN(C)C[C@H]1CN(CCc2c(F)cccc2Cl)CCO1	ZINC000175204759	402787527	/nfs/dbraw/zinc/78/75/27/402787527.db2.gz	JJWVIPDUSABLHH-LBPRGKRZSA-N	0	3	300.805	2.284	10	0		DEAEHN
C[C@@H]1CCC[C@@H](C(=O)N2CCCC[C@H](N3CCN(C)CC3)C2)C1	ZINC000175981719	402845856	/nfs/dbraw/zinc/84/58/56/402845856.db2.gz	JWWSWOHHAIITGT-KURKYZTESA-N	0	3	321.509	2.441	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2ccc(F)c(Cl)c2F)CCO1	ZINC000184515648	402848455	/nfs/dbraw/zinc/84/84/55/402848455.db2.gz	CJQMNTFETZGBMV-VIFPVBQESA-N	0	3	318.751	2.021	10	0		DEAEHN
O=C(c1cscc1Br)N1CCN2CCC[C@H]2C1	ZINC000285288323	403280316	/nfs/dbraw/zinc/28/03/16/403280316.db2.gz	GDWKYUNVCOQMDN-VIFPVBQESA-N	0	3	315.236	2.431	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CCO1	ZINC000271266514	403283821	/nfs/dbraw/zinc/28/38/21/403283821.db2.gz	NMMIMCIDCPRUIW-SIXLDLHFSA-N	0	3	317.433	2.299	10	0		DEAEHN
c1c(CN[C@@H]2CCCN(c3ccccc3)C2)nc2ncccn12	ZINC000298530147	403406081	/nfs/dbraw/zinc/40/60/81/403406081.db2.gz	SAHQOXCMLGMXBY-OAHLLOKOSA-N	0	3	307.401	2.488	10	0		DEAEHN
Cc1cc(N2CCN([C@@H]3CCCN(C)C3)CC2)nc(C(C)C)n1	ZINC000301252123	403606157	/nfs/dbraw/zinc/60/61/57/403606157.db2.gz	CKTQTKXQEFNZCZ-MRXNPFEDSA-N	0	3	317.481	2.125	10	0		DEAEHN
Cc1cc(N2CCN([C@H]3CCCN(C)C3)CC2)nc(C(C)C)n1	ZINC000301252121	403606588	/nfs/dbraw/zinc/60/65/88/403606588.db2.gz	CKTQTKXQEFNZCZ-INIZCTEOSA-N	0	3	317.481	2.125	10	0		DEAEHN
CN1CCC[C@@]2(CCN(C(=O)c3csc(NC4CC4)n3)C2)C1	ZINC000294369580	403716138	/nfs/dbraw/zinc/71/61/38/403716138.db2.gz	ZIAFBPDXXHCAMN-MRXNPFEDSA-N	0	3	320.462	2.275	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCC[C@@H]1C[C@H](C)O	ZINC000305212496	403879977	/nfs/dbraw/zinc/87/99/77/403879977.db2.gz	GLPNAVOSOWUSCO-DOTOQJQBSA-N	0	3	304.434	2.270	10	0		DEAEHN
Cn1cnc(CC[NH2+]Cc2cccc([O-])c2Br)c1	ZINC000315213344	404009096	/nfs/dbraw/zinc/00/90/96/404009096.db2.gz	GLNXNBYSFFKGHD-UHFFFAOYSA-N	0	3	310.195	2.221	10	0		DEAEHN
c1cc(-c2ccc(CN3CCS[C@@H]4COCC[C@@H]43)o2)n[nH]1	ZINC000369485709	404112826	/nfs/dbraw/zinc/11/28/26/404112826.db2.gz	RWQPBNVOUFJFOI-DZGCQCFKSA-N	0	3	305.403	2.376	10	0		DEAEHN
C[C@@H]1CN(C2CCOCC2)CCN1Cc1ncc(C2CC2)o1	ZINC000369662927	404183292	/nfs/dbraw/zinc/18/32/92/404183292.db2.gz	JOOOUYHLFPSTDV-CYBMUJFWSA-N	0	3	305.422	2.237	10	0		DEAEHN
CC[C@H](C)Oc1cc(-c2nc([C@@H]3CC(=O)N(C)C3)no2)ccn1	ZINC000329744118	404439177	/nfs/dbraw/zinc/43/91/77/404439177.db2.gz	XPZHFSFRTKQZLD-CMPLNLGQSA-N	0	3	316.361	2.255	10	0		DEAEHN
C[C@@H]1CCOCCN1CCC(=O)N1CCCc2ccccc21	ZINC000375701770	404730971	/nfs/dbraw/zinc/73/09/71/404730971.db2.gz	DXFINBSKJYITGE-OAHLLOKOSA-N	0	3	302.418	2.467	10	0		DEAEHN
O=c1[nH]c2ccccc2cc1CN1CCC[C@H]1Cn1cncn1	ZINC000375788120	404746802	/nfs/dbraw/zinc/74/68/02/404746802.db2.gz	HSFJOBRJXSMMKL-HNNXBMFYSA-N	0	3	309.373	2.197	10	0		DEAEHN
CO[C@@H](C)[C@H](C)NC(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000376094252	404801440	/nfs/dbraw/zinc/80/14/40/404801440.db2.gz	FUNAYOQMIFLLKA-ZOBUZTSGSA-N	0	3	319.449	2.231	10	0		DEAEHN
CO[C@@H](C)[C@H](C)NC(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000376094248	404801645	/nfs/dbraw/zinc/80/16/45/404801645.db2.gz	FUNAYOQMIFLLKA-YQQAZPJKSA-N	0	3	319.449	2.231	10	0		DEAEHN
CCOCCO[C@H]1CCN(Cc2ccc(-c3cc[nH]n3)o2)C1	ZINC000435124930	404958205	/nfs/dbraw/zinc/95/82/05/404958205.db2.gz	UAPYZODRYCHJEX-ZDUSSCGKSA-N	0	3	305.378	2.297	10	0		DEAEHN
c1ccc(OCC2CC2)c(CNCC2(N3CCOCC3)CC2)c1	ZINC000434793209	404936390	/nfs/dbraw/zinc/93/63/90/404936390.db2.gz	KHPSLLWBDJFBPL-UHFFFAOYSA-N	0	3	316.445	2.430	10	0		DEAEHN
CCn1cnnc1[C@H]1CCC[N@H+](Cc2nc(C)ccc2[O-])C1	ZINC000378349179	404937849	/nfs/dbraw/zinc/93/78/49/404937849.db2.gz	NZXMIDHFFALUCR-ZDUSSCGKSA-N	0	3	301.394	2.087	10	0		DEAEHN
CCn1cnnc1[C@H]1CCC[N@@H+](Cc2nc(C)ccc2[O-])C1	ZINC000378349179	404937851	/nfs/dbraw/zinc/93/78/51/404937851.db2.gz	NZXMIDHFFALUCR-ZDUSSCGKSA-N	0	3	301.394	2.087	10	0		DEAEHN
CN(CC1CC1)C(=O)CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000361379326	405047151	/nfs/dbraw/zinc/04/71/51/405047151.db2.gz	USFOEQNRRUFAOF-BBWFWOEESA-N	0	3	308.466	2.260	10	0		DEAEHN
CCn1ncnc1CNC[C@]1(C)CCCN1Cc1ccccc1	ZINC000398104609	405060743	/nfs/dbraw/zinc/06/07/43/405060743.db2.gz	OHQWVOPIPNVTJA-SFHVURJKSA-N	0	3	313.449	2.442	10	0		DEAEHN
Cn1c2ccc(CN3CC[C@@H](C(C)(C)C)[C@H](O)C3)cc2oc1=O	ZINC000408012415	405089525	/nfs/dbraw/zinc/08/95/25/405089525.db2.gz	IPKINMQXXJSETI-UKRRQHHQSA-N	0	3	318.417	2.360	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CC[C@H]3[C@H](CCCN3C3CC3)C2)o1	ZINC000408097821	405111460	/nfs/dbraw/zinc/11/14/60/405111460.db2.gz	NYOVWBJERWLAPF-HIFRSBDPSA-N	0	3	324.446	2.225	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCC[C@@H](Cc2nccn2C)C1	ZINC000361543072	405123719	/nfs/dbraw/zinc/12/37/19/405123719.db2.gz	KBECMPNFRHWDCT-JKSUJKDBSA-N	0	3	318.465	2.076	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)c2ccc3c(c2[O-])CCCC3)CC[N@@H+]1C	ZINC000408414990	405201818	/nfs/dbraw/zinc/20/18/18/405201818.db2.gz	MTBHLELBONOMSI-JSGCOSHPSA-N	0	3	302.418	2.484	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)c2ccc3c(c2[O-])CCCC3)CC[N@H+]1C	ZINC000408414990	405201820	/nfs/dbraw/zinc/20/18/20/405201820.db2.gz	MTBHLELBONOMSI-JSGCOSHPSA-N	0	3	302.418	2.484	10	0		DEAEHN
CCN1C[C@H](C)N(C(=O)c2cc3[nH]cnc3cc2F)C[C@H]1C	ZINC000408471566	405214419	/nfs/dbraw/zinc/21/44/19/405214419.db2.gz	STFQBDMHEBCHFB-MNOVXSKESA-N	0	3	304.369	2.257	10	0		DEAEHN
Cc1cccc2c(CCC(=O)NCCNc3ccncc3)c[nH]c21	ZINC000439044730	405263650	/nfs/dbraw/zinc/26/36/50/405263650.db2.gz	ZMVCWDOGVMRYDM-UHFFFAOYSA-N	0	3	322.412	2.454	10	0		DEAEHN
COc1ccccc1/C=C\CN1CCN(CC(C)(C)O)[C@H](C)C1	ZINC000438328773	405243099	/nfs/dbraw/zinc/24/30/99/405243099.db2.gz	OHKHDECTMDJAAP-DZFYGRHCSA-N	0	3	318.461	2.485	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@H](C)N2C[C@H]3CCC[C@@H](C2)N3)c1	ZINC000420351416	405329082	/nfs/dbraw/zinc/32/90/82/405329082.db2.gz	WZZGKXSNDLLWNZ-AFAVFJNCSA-N	0	3	315.417	2.043	10	0		DEAEHN
COc1ccc2c(c1)C1(CC1)CN(C(=O)NC[C@H](C)N(C)C)C2	ZINC000455423350	405407596	/nfs/dbraw/zinc/40/75/96/405407596.db2.gz	BTEZAPVQOPVWJV-ZDUSSCGKSA-N	0	3	317.433	2.202	10	0		DEAEHN
O[C@@H](COC[C@@H]1CCCO1)CN1CCC=C(c2ccccc2)C1	ZINC000556505999	405485583	/nfs/dbraw/zinc/48/55/83/405485583.db2.gz	SORQBDZVIGSERC-MOPGFXCFSA-N	0	3	317.429	2.332	10	0		DEAEHN
c1cn(Cc2ccccc2)c(CN[C@H]2CCn3ccnc3C2)n1	ZINC000494423043	405694790	/nfs/dbraw/zinc/69/47/90/405694790.db2.gz	DHNSAURXRRRFOX-INIZCTEOSA-N	0	3	307.401	2.233	10	0		DEAEHN
CN(CCCCNC(=O)C(=O)c1ccc2c(c1)CCC2)C1CC1	ZINC000457195204	405746014	/nfs/dbraw/zinc/74/60/14/405746014.db2.gz	GQFSQDVJKUSIIX-UHFFFAOYSA-N	0	3	314.429	2.349	10	0		DEAEHN
Cc1nn(C)cc1CC(=O)Nc1cc(C)cc(CN(C)C)c1	ZINC000450270616	405810673	/nfs/dbraw/zinc/81/06/73/405810673.db2.gz	NLHROCPYZQWUNI-UHFFFAOYSA-N	0	3	300.406	2.280	10	0		DEAEHN
CC1(C)CN(C[C@H](O)Cc2ccccc2C(F)(F)F)C[C@H]1O	ZINC000562618004	406045082	/nfs/dbraw/zinc/04/50/82/406045082.db2.gz	ZDHOZNHVDSFHAP-TZMCWYRMSA-N	0	3	317.351	2.312	10	0		DEAEHN
CO[C@@H](C)[C@H](C)N[C@H](C)c1cc(S(N)(=O)=O)c(C)cc1C	ZINC000479440643	406165708	/nfs/dbraw/zinc/16/57/08/406165708.db2.gz	XDJYOMPTPWKHLK-XQQFMLRXSA-N	0	3	314.451	2.025	10	0		DEAEHN
CN(C[C@H]1CCN(C)C1)C(=O)c1cnc(-c2cccnc2)s1	ZINC000534207095	406171833	/nfs/dbraw/zinc/17/18/33/406171833.db2.gz	GFVGCITWRVBRRI-LBPRGKRZSA-N	0	3	316.430	2.229	10	0		DEAEHN
Cc1cc(C)c([C@@H](C)[N@@H+]2CCC[C@@]3(C2)NC(=O)[N-]C3=O)c(C)c1	ZINC000568160815	406199792	/nfs/dbraw/zinc/19/97/92/406199792.db2.gz	SOHSLSNPXMAYFD-KDOFPFPSSA-N	0	3	315.417	2.347	10	0		DEAEHN
Cc1cc(C)c([C@@H](C)[N@H+]2CCC[C@@]3(C2)NC(=O)[N-]C3=O)c(C)c1	ZINC000568160815	406199797	/nfs/dbraw/zinc/19/97/97/406199797.db2.gz	SOHSLSNPXMAYFD-KDOFPFPSSA-N	0	3	315.417	2.347	10	0		DEAEHN
c1ccc(CN2CC[C@H](N3CCO[C@]4(CCSC4)C3)C2)cc1	ZINC000569238720	406226571	/nfs/dbraw/zinc/22/65/71/406226571.db2.gz	PUMWHBWYWBGTOE-ZWKOTPCHSA-N	0	3	318.486	2.469	10	0		DEAEHN
c1ccc(-n2nnnc2CCN2CCC[C@H]2c2ccncc2)cc1	ZINC000536608428	406269734	/nfs/dbraw/zinc/26/97/34/406269734.db2.gz	LERKJQWGKMLYCP-KRWDZBQOSA-N	0	3	320.400	2.437	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000521253577	406339998	/nfs/dbraw/zinc/33/99/98/406339998.db2.gz	DBRJCVZPMGWSAN-CQSZACIVSA-N	0	3	317.437	2.145	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)Nc1ccc(OC2COC2)cc1	ZINC000547739717	406441000	/nfs/dbraw/zinc/44/10/00/406441000.db2.gz	UKXHPGGMLLIDAQ-INIZCTEOSA-N	0	3	304.390	2.277	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N(C)Cc1ccccc1	ZINC000637867329	406453669	/nfs/dbraw/zinc/45/36/69/406453669.db2.gz	GXFZIOZWYIEMMF-SFHVURJKSA-N	0	3	311.429	2.104	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N1CC(=O)Nc1cccc(N2CCOCC2)c1	ZINC000524797246	406462243	/nfs/dbraw/zinc/46/22/43/406462243.db2.gz	XYVSVGQDVOLDDZ-GASCZTMLSA-N	0	3	317.433	2.335	10	0		DEAEHN
C[C@H](NC(=O)[C@@H]1OCC[C@@H]1N)c1ccc(Cl)c(Cl)c1	ZINC000637884895	406462707	/nfs/dbraw/zinc/46/27/07/406462707.db2.gz	UWOKJIVDPYJOCU-CQFDHEJISA-N	0	3	303.189	2.287	10	0		DEAEHN
c1nn(-c2ccccc2)c2ncnc(N3CCN4CCC3CC4)c12	ZINC000526045516	406538443	/nfs/dbraw/zinc/53/84/43/406538443.db2.gz	SCZUYECJWKWZRW-UHFFFAOYSA-N	0	3	320.400	2.100	10	0		DEAEHN
c1nc(CN2CCC[C@@H]([C@@H]3CCOC3)C2)cc2c1OCCO2	ZINC000638182535	406611185	/nfs/dbraw/zinc/61/11/85/406611185.db2.gz	RFENCKGYHPQVIF-ZIAGYGMSSA-N	0	3	304.390	2.101	10	0		DEAEHN
Cc1ccc([O-])c(C[N@@H+]2CC[C@H](c3nc(C4CC4)no3)C2)n1	ZINC000551795660	406636965	/nfs/dbraw/zinc/63/69/65/406636965.db2.gz	OZOMHDFEIDORAB-LBPRGKRZSA-N	0	3	300.362	2.346	10	0		DEAEHN
Cc1ccc([O-])c(C[N@H+]2CC[C@H](c3nc(C4CC4)no3)C2)n1	ZINC000551795660	406636966	/nfs/dbraw/zinc/63/69/66/406636966.db2.gz	OZOMHDFEIDORAB-LBPRGKRZSA-N	0	3	300.362	2.346	10	0		DEAEHN
C1CCN([C@@H]2CCN(c3nnc(C4CCOCC4)s3)C2)C1	ZINC000549489289	406586330	/nfs/dbraw/zinc/58/63/30/406586330.db2.gz	VLDBRILIQFOIPJ-CYBMUJFWSA-N	0	3	308.451	2.107	10	0		DEAEHN
Cc1cc(CNC[C@H]2CN(Cc3ccccc3)CCO2)ccn1	ZINC000527631217	406696648	/nfs/dbraw/zinc/69/66/48/406696648.db2.gz	KMEGBZYJHTYPDM-IBGZPJMESA-N	0	3	311.429	2.381	10	0		DEAEHN
CC(C)CC1(NC(=O)[C@H](N)CN(C)Cc2ccccc2)CC1	ZINC000638431281	406768417	/nfs/dbraw/zinc/76/84/17/406768417.db2.gz	SNMFMTASWXPYOW-MRXNPFEDSA-N	0	3	303.450	2.141	10	0		DEAEHN
COC[C@@]1(C(=O)Nc2cccc(Br)c2)CCCN1	ZINC000643614768	407016754	/nfs/dbraw/zinc/01/67/54/407016754.db2.gz	KPMVCYBAYQSLPJ-CYBMUJFWSA-N	0	3	313.195	2.156	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1cccc2ncccc21	ZINC000129310426	196038589	/nfs/dbraw/zinc/03/85/89/196038589.db2.gz	TZAKXCCJRHKDJS-CYBMUJFWSA-N	0	3	321.446	2.243	10	0		DEAEHN
C[C@@H](N[C@@H]1CCc2ccccc2C1)C(=O)NCC(F)(F)F	ZINC000130503345	196085407	/nfs/dbraw/zinc/08/54/07/196085407.db2.gz	QSBMEDHYRJRALH-ZWNOBZJWSA-N	0	3	300.324	2.201	10	0		DEAEHN
COc1ccc(C(N)=S)c(N(CCN(C)C)CC(C)C)c1	ZINC000130601335	196093838	/nfs/dbraw/zinc/09/38/38/196093838.db2.gz	TXBLYRDOFZYPBJ-UHFFFAOYSA-N	0	3	309.479	2.353	10	0		DEAEHN
CN[C@@H](CCCS(C)(=O)=O)c1ccc(Cl)cc1OC	ZINC000130987425	196129998	/nfs/dbraw/zinc/12/99/98/196129998.db2.gz	ZLUZVWKYSWWUCW-LBPRGKRZSA-N	0	3	305.827	2.434	10	0		DEAEHN
C[C@@H](CNS(=O)(=O)c1ccccc1CN)c1ccccc1	ZINC000131161632	196145154	/nfs/dbraw/zinc/14/51/54/196145154.db2.gz	NEXDZLHWJAGCRF-ZDUSSCGKSA-N	0	3	304.415	2.227	10	0		DEAEHN
CC(C)(CNC1=NCC2(CCCCC2)CS1)S(C)(=O)=O	ZINC000131169929	196147066	/nfs/dbraw/zinc/14/70/66/196147066.db2.gz	LHKXCVXIKLZGEP-UHFFFAOYSA-N	0	3	318.508	2.453	10	0		DEAEHN
CSCC[C@@H](C)NS(=O)(=O)c1cccc([C@H](C)N)c1	ZINC000131234465	196152650	/nfs/dbraw/zinc/15/26/50/196152650.db2.gz	NDKKMWSMANDMEF-MNOVXSKESA-N	0	3	302.465	2.126	10	0		DEAEHN
COCC[C@@H](N)C(=O)Nc1ccc(Cl)cc1Br	ZINC000131545250	196178567	/nfs/dbraw/zinc/17/85/67/196178567.db2.gz	CRUPUTOQVXHSAE-SECBINFHSA-N	0	3	321.602	2.405	10	0		DEAEHN
NC1(C(=O)Nc2cccc(OC(F)(F)F)c2)CCOCC1	ZINC000132066219	196223195	/nfs/dbraw/zinc/22/31/95/196223195.db2.gz	XGQRQPAHHWPGIF-UHFFFAOYSA-N	0	3	304.268	2.032	10	0		DEAEHN
CCNCc1cc(Cl)cc(OC)c1O[C@H]1CCN(C)C1=O	ZINC000132110847	196226376	/nfs/dbraw/zinc/22/63/76/196226376.db2.gz	YCBYWYTYARFYGS-LBPRGKRZSA-N	0	3	312.797	2.068	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)c1sc2cccnc2c1N	ZINC000132146427	196230410	/nfs/dbraw/zinc/23/04/10/196230410.db2.gz	HQDLRNDMWHNQKE-SNVBAGLBSA-N	0	3	304.419	2.093	10	0		DEAEHN
CCN[C@H](c1ccnc(C)n1)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000132430003	196255412	/nfs/dbraw/zinc/25/54/12/196255412.db2.gz	WIBYFNWVUQFFHN-YDHLFZDLSA-N	0	3	311.451	2.039	10	0		DEAEHN
C[C@H]1CNC[C@H](COCc2ccc(F)c(Br)c2)O1	ZINC000132448403	196257332	/nfs/dbraw/zinc/25/73/32/196257332.db2.gz	CHWNLSVEDMSCJH-GXSJLCMTSA-N	0	3	318.186	2.482	10	0		DEAEHN
Cc1ccc([C@H](CN)N[C@@H](C)CCO)c(Br)c1	ZINC000132684250	196276006	/nfs/dbraw/zinc/27/60/06/196276006.db2.gz	QLAOUAJDTVLABQ-GWCFXTLKSA-N	0	3	301.228	2.118	10	0		DEAEHN
CCCN[C@@H](Cc1cc(C)ccc1OC)[C@H](C)S(C)(=O)=O	ZINC000133156039	196316747	/nfs/dbraw/zinc/31/67/47/196316747.db2.gz	XDPRCBMIBMWZLP-ZFWWWQNUSA-N	0	3	313.463	2.347	10	0		DEAEHN
CN[C@H](CSCCS(C)(=O)=O)c1cc(C)cc(C)c1	ZINC000134081525	196359869	/nfs/dbraw/zinc/35/98/69/196359869.db2.gz	ZJKRBLXHVUTOFG-CQSZACIVSA-N	0	3	301.477	2.342	10	0		DEAEHN
C[C@H]1CN(C)CC[C@@H]1NC(=O)c1cnc(Cl)c(Cl)c1	ZINC000134354542	196381186	/nfs/dbraw/zinc/38/11/86/196381186.db2.gz	DBEMMUHGPYYMKO-KWQFWETISA-N	0	3	302.205	2.458	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N[C@](C)(CN)c2ccccc2)cc1	ZINC000134473847	196394479	/nfs/dbraw/zinc/39/44/79/196394479.db2.gz	VIYNUANQSPCAHR-MRXNPFEDSA-N	0	3	304.415	2.147	10	0		DEAEHN
CCS(=O)(=O)c1ccc(NC(=O)C[C@H](N)C(C)(C)C)cc1	ZINC000136830822	196554588	/nfs/dbraw/zinc/55/45/88/196554588.db2.gz	NAYMBTXTEZMKJH-ZDUSSCGKSA-N	0	3	312.435	2.182	10	0		DEAEHN
COC[C@H](NCc1cccc(OC)c1OC)C1CCOCC1	ZINC000187799087	225000401	/nfs/dbraw/zinc/00/04/01/225000401.db2.gz	UDAXLXLNCIAFQP-HNNXBMFYSA-N	0	3	309.406	2.235	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)NCCCN1CCc2ccccc2C1	ZINC000193989705	225171604	/nfs/dbraw/zinc/17/16/04/225171604.db2.gz	FLCWRSQHHRGETE-CRAIPNDOSA-N	0	3	316.445	2.224	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)Nc2cc(F)ccc2C)c1	ZINC000105881631	424849535	/nfs/dbraw/zinc/84/95/35/424849535.db2.gz	ACFMPDXJSKPQBD-CYBMUJFWSA-N	0	3	304.369	2.256	10	0		DEAEHN
Fc1ccc(OCCN2CCC[C@H](Cn3cncn3)C2)cc1	ZINC000105882789	424849652	/nfs/dbraw/zinc/84/96/52/424849652.db2.gz	IPIHLHPCUJHKJH-AWEZNQCLSA-N	0	3	304.369	2.208	10	0		DEAEHN
Fc1ccccc1OCCN1CCC[C@H](Cn2cncn2)C1	ZINC000105882899	424849714	/nfs/dbraw/zinc/84/97/14/424849714.db2.gz	VUEDXJOHMMXTMP-AWEZNQCLSA-N	0	3	304.369	2.208	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NCc1nccs1)c1ccccc1	ZINC000194363816	424876292	/nfs/dbraw/zinc/87/62/92/424876292.db2.gz	KZFWQQHNPVKLLM-CYBMUJFWSA-N	0	3	304.419	2.245	10	0		DEAEHN
O=C(c1sccc1-n1cccc1)N1CCN2CCC[C@@H]2C1	ZINC000195326364	424882321	/nfs/dbraw/zinc/88/23/21/424882321.db2.gz	RGKCRGUUZVKCPG-CYBMUJFWSA-N	0	3	301.415	2.459	10	0		DEAEHN
COc1ccc(Cl)cc1CC(=O)N1CCN2CCC[C@@H]2C1	ZINC000195321609	424882702	/nfs/dbraw/zinc/88/27/02/424882702.db2.gz	MRXOTEGNEUMTST-CQSZACIVSA-N	0	3	308.809	2.198	10	0		DEAEHN
O=C(CCc1cnn(-c2ccccc2)c1)N1CCN2CCC[C@H]2C1	ZINC000195321745	424882788	/nfs/dbraw/zinc/88/27/88/424882788.db2.gz	SGORZWWVKVLGFJ-SFHVURJKSA-N	0	3	324.428	2.112	10	0		DEAEHN
O=C(c1sccc1-n1cccc1)N1CCN2CCC[C@H]2C1	ZINC000195326372	424883011	/nfs/dbraw/zinc/88/30/11/424883011.db2.gz	RGKCRGUUZVKCPG-ZDUSSCGKSA-N	0	3	301.415	2.459	10	0		DEAEHN
CCc1ccc([C@H](C)NCCN2C(=O)NC(C)(C)C2=O)cc1	ZINC000129943458	424857662	/nfs/dbraw/zinc/85/76/62/424857662.db2.gz	XZVOINNLUYKLHF-LBPRGKRZSA-N	0	3	303.406	2.230	10	0		DEAEHN
Cc1cc(C(=O)N(C)C2CCN(C)CC2)nn1-c1ccccc1	ZINC000192656875	424864633	/nfs/dbraw/zinc/86/46/33/424864633.db2.gz	LCWRYJWFUVWCMW-UHFFFAOYSA-N	0	3	312.417	2.347	10	0		DEAEHN
CCc1ccc([C@@H](C)N[C@H](C)C(=O)N2CCN(CC)CC2)cc1	ZINC000192662011	424864813	/nfs/dbraw/zinc/86/48/13/424864813.db2.gz	DHFOZTCVDDHQHJ-HZPDHXFCSA-N	0	3	317.477	2.452	10	0		DEAEHN
CC[C@](C)(N)c1cn(Cc2ccc(Br)cn2)nn1	ZINC000384166078	424910176	/nfs/dbraw/zinc/91/01/76/424910176.db2.gz	LIVPFYHKNRRVNK-LBPRGKRZSA-N	0	3	310.199	2.068	10	0		DEAEHN
CC(C)(O)CCN1CCO[C@H]2CCN(Cc3ccccc3)C[C@@H]21	ZINC000404214982	424926109	/nfs/dbraw/zinc/92/61/09/424926109.db2.gz	SRQFPUVPQLIDGJ-ROUUACIJSA-N	0	3	318.461	2.123	10	0		DEAEHN
NCc1cc(-c2ccc(I)cc2)ncn1	ZINC000409436537	424935114	/nfs/dbraw/zinc/93/51/14/424935114.db2.gz	FZHBNYIAOOYYHJ-UHFFFAOYSA-N	0	3	311.126	2.207	10	0		DEAEHN
CCCNC(=O)N1CCCCC[C@H]1CN1CCC(OC)CC1	ZINC000257194663	424888995	/nfs/dbraw/zinc/88/89/95/424888995.db2.gz	UMKSCUUNVNZYQB-HNNXBMFYSA-N	0	3	311.470	2.461	10	0		DEAEHN
CN1C[C@@H](CNCc2cc(F)ccc2Br)CC1=O	ZINC000657695952	425387694	/nfs/dbraw/zinc/38/76/94/425387694.db2.gz	QWJQIILFORSJSA-SECBINFHSA-N	0	3	315.186	2.156	10	0		DEAEHN
Cc1ccccc1[C@H](CN1CCOCC1)N[C@H]1CCCOC1	ZINC000183563449	267627565	/nfs/dbraw/zinc/62/75/65/267627565.db2.gz	LTIOEUVJPIHBSC-WMZOPIPTSA-N	0	3	304.434	2.137	10	0		DEAEHN
CC(C)c1nc([C@H](C)N[C@H]2CCc3nnnn3CC2)cs1	ZINC000333714877	268981723	/nfs/dbraw/zinc/98/17/23/268981723.db2.gz	IWEWIGNBJLPQJU-QWRGUYRKSA-N	0	3	306.439	2.309	10	0		DEAEHN
CNC(=O)[C@H]1CCN(Cc2cc(Br)ccc2C)C1	ZINC000398478355	269108980	/nfs/dbraw/zinc/10/89/80/269108980.db2.gz	KJIRRZPZDADWNI-NSHDSACASA-N	0	3	311.223	2.325	10	0		DEAEHN
Cc1ccc(CCNCc2c(Br)cnn2C)cn1	ZINC000518040773	269395750	/nfs/dbraw/zinc/39/57/50/269395750.db2.gz	XUAHDGKSOJGAIV-UHFFFAOYSA-N	0	3	309.211	2.218	10	0		DEAEHN
O=c1[nH]c2ccccc2n1C1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000028234714	275042889	/nfs/dbraw/zinc/04/28/89/275042889.db2.gz	QJCCAWADLGRXFF-DLBZAZTESA-N	0	3	315.417	2.270	10	0		DEAEHN
O[C@H]1c2ccccc2C[C@@H]1N1CCC(Nc2cccnn2)CC1	ZINC000182753379	275059510	/nfs/dbraw/zinc/05/95/10/275059510.db2.gz	TVGVXLCCLRANMQ-WMZOPIPTSA-N	0	3	310.401	2.011	10	0		DEAEHN
c1c2c(nn1-c1ccccc1)CCC[C@H]2NC[C@@H]1COCCO1	ZINC000358913793	275063419	/nfs/dbraw/zinc/06/34/19/275063419.db2.gz	JBXNIEKHUZYZIN-NVXWUHKLSA-N	0	3	313.401	2.255	10	0		DEAEHN
c1cc(N2CCCC2)ncc1N[C@@H]1CCC[C@H]1[C@@H]1COCCN1	ZINC000261887951	275064450	/nfs/dbraw/zinc/06/44/50/275064450.db2.gz	GAZIXYUDMGELFW-ZACQAIPSSA-N	0	3	316.449	2.251	10	0		DEAEHN
c1ccc2c(c1)OCC[C@H]2CN1CCN(c2cccnn2)CC1	ZINC000372409479	275070620	/nfs/dbraw/zinc/07/06/20/275070620.db2.gz	GEGLEOZLIVGBOO-HNNXBMFYSA-N	0	3	310.401	2.165	10	0		DEAEHN
CCC[C@@H](C(=O)N(C)Cc1cn(C)nc1C(F)(F)F)N(C)C	ZINC000164740990	276020444	/nfs/dbraw/zinc/02/04/44/276020444.db2.gz	ZWBLFVMWXCKSFF-NSHDSACASA-N	0	3	320.359	2.128	10	0		DEAEHN
CC(C)c1nnc(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)n1C	ZINC000246471938	276074286	/nfs/dbraw/zinc/07/42/86/276074286.db2.gz	FZAJQYZKQOJHEN-GOEBONIOSA-N	0	3	317.481	2.387	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC(Oc2ccc(C)cn2)CC1)N(C)C	ZINC000181563219	276281634	/nfs/dbraw/zinc/28/16/34/276281634.db2.gz	LMBUXLXUSQRNPG-MRXNPFEDSA-N	0	3	319.449	2.490	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)N1CCc2sccc2C1	ZINC000175362102	276370548	/nfs/dbraw/zinc/37/05/48/276370548.db2.gz	ZTDQMHMRGQYSHK-OAHLLOKOSA-N	0	3	321.490	2.049	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(C(=O)CC3CCCC3)C2)CC1	ZINC000173295088	277111456	/nfs/dbraw/zinc/11/14/56/277111456.db2.gz	MUDIIPSTJGJPHD-KRWDZBQOSA-N	0	3	307.482	2.195	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2C[NH3+])c(Cl)cc1F	ZINC000237790955	278739739	/nfs/dbraw/zinc/73/97/39/278739739.db2.gz	XPRKIYBJADTARY-BXKDBHETSA-N	0	3	320.817	2.193	10	0		DEAEHN
CCC[C@H](C(=O)N(C)Cc1cn(C)nc1C(F)(F)F)N(C)C	ZINC000164741111	278917962	/nfs/dbraw/zinc/91/79/62/278917962.db2.gz	ZWBLFVMWXCKSFF-LLVKDONJSA-N	0	3	320.359	2.128	10	0		DEAEHN
CC(C)C[C@H](C)NC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000091889029	279105407	/nfs/dbraw/zinc/10/54/07/279105407.db2.gz	OSLUCVNOGMFLAW-IRXDYDNUSA-N	0	3	324.513	2.233	10	0		DEAEHN
C[C@@H]1[C@H](CO)CCN1CC(=O)N(C)[C@@H]1CCCc2ccccc21	ZINC000488731366	279110753	/nfs/dbraw/zinc/11/07/53/279110753.db2.gz	JKKOTMDAEWWFQU-UWWQBHOKSA-N	0	3	316.445	2.225	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)CCC(=O)OC(C)(C)C	ZINC000191913024	279121778	/nfs/dbraw/zinc/12/17/78/279121778.db2.gz	GIVBLONRQASLDZ-CYBMUJFWSA-N	0	3	300.443	2.201	10	0		DEAEHN
CCN(CC)Cc1cccc(NC(=O)[C@H]2CSC(=O)N2)c1	ZINC000154953741	279138331	/nfs/dbraw/zinc/13/83/31/279138331.db2.gz	CCQLGEVJRLPLFH-CYBMUJFWSA-N	0	3	307.419	2.292	10	0		DEAEHN
CC[C@@H](C(=O)N[C@@H](C)c1ccccc1-n1cccn1)N(C)C	ZINC000157468854	280080114	/nfs/dbraw/zinc/08/01/14/280080114.db2.gz	RUJUVMUXEHDGQO-ZFWWWQNUSA-N	0	3	300.406	2.390	10	0		DEAEHN
COc1cccc(CN(CCN(C)C)C(=O)[C@H]2CC[C@@H](C)O2)c1	ZINC000191954658	295295522	/nfs/dbraw/zinc/29/55/22/295295522.db2.gz	QDECZRFCXFFWHL-RHSMWYFYSA-N	0	3	320.433	2.153	10	0		DEAEHN
COc1cccc([C@@H]2[C@H](N[C@@H]3CCNC3=O)CCN2C2CC2)c1	ZINC000328721876	295322316	/nfs/dbraw/zinc/32/23/16/295322316.db2.gz	XDQZAHKDOYQLOG-BRWVUGGUSA-N	0	3	315.417	2.291	10	0		DEAEHN
Fc1cc(CNCCOCC2CCC2)ccc1-n1cncn1	ZINC000573772105	326089293	/nfs/dbraw/zinc/08/92/93/326089293.db2.gz	CBXHVLCIHDRCJH-UHFFFAOYSA-N	0	3	304.369	2.313	10	0		DEAEHN
C[C@H](N[C@H]1CCC(=O)N(C)C1)c1ccc(Br)cn1	ZINC000576522203	326299993	/nfs/dbraw/zinc/29/99/93/326299993.db2.gz	ZJINVSOUQMDPLA-ONGXEEELSA-N	0	3	312.211	2.116	10	0		DEAEHN
COC[C@H](C)CN1CCN(c2ncnc3sccc32)CC1	ZINC000189621495	333164741	/nfs/dbraw/zinc/16/47/41/333164741.db2.gz	DGKIQPDOYVKHLV-GFCCVEGCSA-N	0	3	306.435	2.096	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)S(=O)(=O)CCc2cccs2)CCN1C	ZINC000195384100	533897097	/nfs/dbraw/zinc/89/70/97/533897097.db2.gz	ZCPWSSPSNHCOFM-CHWSQXEVSA-N	0	3	316.492	2.035	10	0		DEAEHN
NC(=O)c1ccc(CN2CC[C@H](n3cnc4c3CCCC4)C2)cc1	ZINC000299744094	534481204	/nfs/dbraw/zinc/48/12/04/534481204.db2.gz	QVPDCKRHDVSDLA-INIZCTEOSA-N	0	3	324.428	2.308	10	0		DEAEHN
CCCOc1ccc(CN2CCO[C@@H](CN(C)C)C2)cc1OC	ZINC000128078050	520352592	/nfs/dbraw/zinc/35/25/92/520352592.db2.gz	XIYWHGHLKPCXNJ-INIZCTEOSA-N	0	3	322.449	2.246	10	0		DEAEHN
Cc1ccc2nccc(NC3CCN(S(C)(=O)=O)CC3)c2c1	ZINC000302139303	534522947	/nfs/dbraw/zinc/52/29/47/534522947.db2.gz	CXTVYNIKLNIMRA-UHFFFAOYSA-N	0	3	319.430	2.379	10	0		DEAEHN
CCN(CC)c1ncc(CN2C[C@H](C(N)=O)CC[C@H]2C)s1	ZINC000245542479	520934413	/nfs/dbraw/zinc/93/44/13/520934413.db2.gz	PVLHSIHOLNYJPV-VXGBXAGGSA-N	0	3	310.467	2.075	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)NCCN(CC)C1CC1	ZINC000163336020	521177073	/nfs/dbraw/zinc/17/70/73/521177073.db2.gz	LHOSQUIUILOJLI-UHFFFAOYSA-N	0	3	310.467	2.201	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@](C)(CO)C2CCCCC2)C1	ZINC000245848598	521620776	/nfs/dbraw/zinc/62/07/76/521620776.db2.gz	ANIVHSATGJOUDB-NVXWUHKLSA-N	0	3	311.470	2.101	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(CC(=O)N2CCC[C@H](C)C2)C1	ZINC000105896904	522591624	/nfs/dbraw/zinc/59/16/24/522591624.db2.gz	XOBWFMNUWIAWJA-JKSUJKDBSA-N	0	3	318.465	2.341	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)[C@H](C)c1ccccc1	ZINC000111866019	523825940	/nfs/dbraw/zinc/82/59/40/523825940.db2.gz	BPTQFANMFQTAGB-NVXWUHKLSA-N	0	3	319.449	2.500	10	0		DEAEHN
COc1ccc(O)cc1C(=O)N[C@@H](C)CN1CCC[C@H](C)C1	ZINC000249121024	524779603	/nfs/dbraw/zinc/77/96/03/524779603.db2.gz	PVXMWTJWPFACOG-STQMWFEESA-N	0	3	306.406	2.251	10	0		DEAEHN
CSCC[C@@H](N)C(=O)NCc1cccc(-c2ccccn2)c1	ZINC000157910445	525546555	/nfs/dbraw/zinc/54/65/55/525546555.db2.gz	DRFYVCBBKRIPOP-OAHLLOKOSA-N	0	3	315.442	2.445	10	0		DEAEHN
C[C@H](C(=O)NC1CCCC1)N1CCN(CC2CCCC2)CC1	ZINC000103491760	526031952	/nfs/dbraw/zinc/03/19/52/526031952.db2.gz	RZTGGKGENHYDKF-OAHLLOKOSA-N	0	3	307.482	2.242	10	0		DEAEHN
CCOc1cc(NC[C@@H]2CCN(C)[C@H]2c2cccnc2)ncn1	ZINC000328622658	528327797	/nfs/dbraw/zinc/32/77/97/528327797.db2.gz	IPOVWNWKURAYLR-YOEHRIQHSA-N	0	3	313.405	2.375	10	0		DEAEHN
CCN(CCO)CCNc1ncnc2sc3c(c21)CCCC3	ZINC000302227892	528552613	/nfs/dbraw/zinc/55/26/13/528552613.db2.gz	VAHDZHNVKONXQR-UHFFFAOYSA-N	0	3	320.462	2.296	10	0		DEAEHN
CCCn1cc(CN[C@H]2CCCO[C@@H]2c2cnn(C)c2)cn1	ZINC000328648473	528846559	/nfs/dbraw/zinc/84/65/59/528846559.db2.gz	UPXCIKGOAHVJBL-JKSUJKDBSA-N	0	3	303.410	2.037	10	0		DEAEHN
CC(C)Oc1cccc(CN2CCN(C[C@H](C)O)[C@@H](C)C2)c1	ZINC000247582100	535039198	/nfs/dbraw/zinc/03/91/98/535039198.db2.gz	IMYDHTZKPBOAEC-HOTGVXAUSA-N	0	3	306.450	2.361	10	0		DEAEHN
CC(C)(C)[C@@H](C[NH3+])[N-]S(=O)(=O)c1ccc(Cl)cc1F	ZINC000261559795	535042178	/nfs/dbraw/zinc/04/21/78/535042178.db2.gz	VTWCQZJJYUXUKD-LLVKDONJSA-N	0	3	308.806	2.131	10	0		DEAEHN
CCOCc1nc([C@@H](C)NC(=O)[C@@H](C)N2CCCCCC2)no1	ZINC000359490964	535722010	/nfs/dbraw/zinc/72/20/10/535722010.db2.gz	BYPBCICYEKRKBS-CHWSQXEVSA-N	0	3	324.425	2.048	10	0		DEAEHN
CC[C@H](NC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C)c1nccs1	ZINC000262433849	535856595	/nfs/dbraw/zinc/85/65/95/535856595.db2.gz	GCAYZPXWAXGODV-AZKPJATDSA-N	0	3	323.462	2.243	10	0		DEAEHN
CCc1cccc(OCCN2CCN(C[C@H](C)O)[C@H](CC)C2)c1	ZINC000247240344	535906793	/nfs/dbraw/zinc/90/67/93/535906793.db2.gz	SGUNKCIWXCFYLF-FUHWJXTLSA-N	0	3	320.477	2.405	10	0		DEAEHN
CC[C@H](C)N1CCN(c2nnc(CCc3ccco3)n2C)CC1	ZINC000453447955	536148332	/nfs/dbraw/zinc/14/83/32/536148332.db2.gz	MOQZOLOMOBUJDY-AWEZNQCLSA-N	0	3	317.437	2.114	10	0		DEAEHN
CO[C@@H]1CC[C@@H]2OCCN(C[C@H](O)CCc3ccccc3)[C@H]2C1	ZINC000248564087	536700124	/nfs/dbraw/zinc/70/01/24/536700124.db2.gz	KFBICOVQQYDEEV-YRXWBPOGSA-N	0	3	319.445	2.248	10	0		DEAEHN
COCCN(C)CCCNC(=O)NCc1ccc(C2CC2)cc1	ZINC000191115889	536788283	/nfs/dbraw/zinc/78/82/83/536788283.db2.gz	YSJCBEIELOOZFV-UHFFFAOYSA-N	0	3	319.449	2.332	10	0		DEAEHN
Cc1cc(F)ccc1-c1noc(CN2CCCC[C@@H](N)C2=O)n1	ZINC000888078390	625059091	/nfs/dbraw/zinc/05/90/91/625059091.db2.gz	NGYBXRAUWNWSHO-CYBMUJFWSA-N	0	3	318.352	2.024	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)[C@@H](N)CCOC	ZINC000052808129	625105740	/nfs/dbraw/zinc/10/57/40/625105740.db2.gz	GBBRHEWHMOSMBN-NSHDSACASA-N	0	3	300.786	2.431	10	0		DEAEHN
COCC[C@@H](N)C(=O)Nc1ccc(-c2csc(C)n2)cc1	ZINC000052809739	625106530	/nfs/dbraw/zinc/10/65/30/625106530.db2.gz	KENVILQHLPIFJU-CYBMUJFWSA-N	0	3	305.403	2.421	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)Nc1cccc(-c2nncn2CC)c1	ZINC000237020614	636252829	/nfs/dbraw/zinc/25/28/29/636252829.db2.gz	IFHRPYDNAIFKRQ-BXUZGUMPSA-N	0	3	301.394	2.277	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(N)=O)CN1C[C@H](O)c1ccc(F)cc1Cl	ZINC000186949371	636643395	/nfs/dbraw/zinc/64/33/95/636643395.db2.gz	ZDDXCSDIRRMEOC-RULNRJAQSA-N	0	3	314.788	2.098	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN[C@@H](CCO)c1cccs1	ZINC000740899636	637915461	/nfs/dbraw/zinc/91/54/61/637915461.db2.gz	BLQXCBZLMCWANO-NSHDSACASA-N	0	3	300.424	2.286	10	0		DEAEHN
COC1CCN(CCNC(=O)/C=C(\C)c2cccc(F)c2)CC1	ZINC000750860579	639035322	/nfs/dbraw/zinc/03/53/22/639035322.db2.gz	BOVMZDQNYZYGAD-WYMLVPIESA-N	0	3	320.408	2.456	10	0		DEAEHN
CC(=O)N(C)C1CCN(C[C@H](O)c2cc(C)cc(C)c2)CC1	ZINC000075676036	646602826	/nfs/dbraw/zinc/60/28/26/646602826.db2.gz	QMTVOZRBPTZUPK-SFHVURJKSA-N	0	3	304.434	2.280	10	0		DEAEHN
NC(=O)CC[C@H]1CCCN(C[C@H](O)c2ccccc2Cl)C1	ZINC000170733339	646663543	/nfs/dbraw/zinc/66/35/43/646663543.db2.gz	FHDDZLHFSMVFNE-DOMZBBRYSA-N	0	3	310.825	2.351	10	0		DEAEHN
CC[C@H]1CN(C[C@H](O)c2cc(C)cc(C)c2)CCN1CCOC	ZINC000174782680	647346295	/nfs/dbraw/zinc/34/62/95/647346295.db2.gz	WJVQDVJSGAHRFM-OALUTQOASA-N	0	3	320.477	2.379	10	0		DEAEHN
C/C(=C/C(=O)NC[C@@H]1CN2CCC[C@H]2CO1)c1cccc(F)c1	ZINC000732064765	647537640	/nfs/dbraw/zinc/53/76/40/647537640.db2.gz	FSZKSUUWFXVWGL-LUXXUUORSA-N	0	3	318.392	2.208	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CN1C(=O)C(C)(C)C1(C)C	ZINC000176073422	684332632	/nfs/dbraw/zinc/33/26/32/684332632.db2.gz	BBZAVMCIXNCGMS-CQSZACIVSA-N	0	3	304.438	2.260	10	0		DEAEHN
C[C@H](NCC1(C)OCCCO1)c1ccc(N2CCOC2=O)cc1	ZINC000190663167	684411501	/nfs/dbraw/zinc/41/15/01/684411501.db2.gz	WFSUYPKCKITPIF-ZDUSSCGKSA-N	0	3	320.389	2.447	10	0		DEAEHN
CC[C@@H]1CN(C[C@@H](O)c2cc(C)cc(C)c2)CCN1C[C@H](C)O	ZINC000246797647	685136893	/nfs/dbraw/zinc/13/68/93/685136893.db2.gz	VEFCEHRBAXHPQE-QXAKKESOSA-N	0	3	320.477	2.114	10	0		DEAEHN
CC[C@]1(O)CCCN(C[C@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724060305	777233233	/nfs/dbraw/zinc/23/32/33/777233233.db2.gz	UMAXAHWFCWJCMQ-UWVGGRQHSA-N	0	3	305.287	2.172	10	0		DEAEHN
CC[C@@]1(O)CCCN(C[C@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724060306	777233540	/nfs/dbraw/zinc/23/35/40/777233540.db2.gz	UMAXAHWFCWJCMQ-VHSXEESVSA-N	0	3	305.287	2.172	10	0		DEAEHN
COC[C@@H]1CCCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724109836	777243187	/nfs/dbraw/zinc/24/31/87/777243187.db2.gz	ADGPJXCOVYYKPJ-NXEZZACHSA-N	0	3	305.287	2.293	10	0		DEAEHN
C[C@@H]1CC(CNCc2nc(Br)c[nH]2)C[C@@H](C)O1	ZINC000724286391	777271887	/nfs/dbraw/zinc/27/18/87/777271887.db2.gz	DPYLHVRHDONAFA-RKDXNWHRSA-N	0	3	302.216	2.465	10	0		DEAEHN
Brc1cc(CNC[C@@H]2C[C@@H]3COC[C@@H]3O2)cs1	ZINC000724651937	777433390	/nfs/dbraw/zinc/43/33/90/777433390.db2.gz	BZTBWPRRLMKFBY-VWYCJHECSA-N	0	3	318.236	2.404	10	0		DEAEHN
C[C@@H](N[C@@H]1CON(C(=O)OC(C)(C)C)C1)[C@@H]1CCCCO1	ZINC000724664084	777443833	/nfs/dbraw/zinc/44/38/33/777443833.db2.gz	IPFHIHQPNSICER-AGIUHOORSA-N	0	3	300.399	2.085	10	0		DEAEHN
OCC[C@@H](NCc1nc(Br)c[nH]1)C1CCCC1	ZINC000725090691	777582646	/nfs/dbraw/zinc/58/26/46/777582646.db2.gz	XFFQNGRFZFENDU-SNVBAGLBSA-N	0	3	302.216	2.203	10	0		DEAEHN
COC[C@H](CNCc1c(Br)cnn1C)C(C)C	ZINC000721835208	779344432	/nfs/dbraw/zinc/34/44/32/779344432.db2.gz	IJVKKEHAWPINLQ-JTQLQIEISA-N	0	3	304.232	2.191	10	0		DEAEHN
CO[C@@]1(CN[C@H](C)c2cccc(Cl)c2)CCS(=O)(=O)C1	ZINC000721261831	781074536	/nfs/dbraw/zinc/07/45/36/781074536.db2.gz	SIDDKWWAUAJCFG-BXUZGUMPSA-N	0	3	317.838	2.194	10	0		DEAEHN
COC[C@]1(C)CCN(C[C@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724074660	787348234	/nfs/dbraw/zinc/34/82/34/787348234.db2.gz	QJRBRTNELZIKFT-ZJUUUORDSA-N	0	3	305.287	2.293	10	0		DEAEHN
CC/C=C(/C)C(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000397658883	790209251	/nfs/dbraw/zinc/20/92/51/790209251.db2.gz	ZKOHMYYQDJHQHE-APSNUPSMSA-N	0	3	316.445	2.486	10	0		DEAEHN
C[C@@H](CNCc1cn(C)nc1Br)c1ccccn1	ZINC000712432309	792187575	/nfs/dbraw/zinc/18/75/75/792187575.db2.gz	ARBFPQALPHDONO-JTQLQIEISA-N	0	3	309.211	2.471	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@@H](N[C@@H]2CCCc3n[nH]cc32)C1	ZINC000401684938	801840488	/nfs/dbraw/zinc/84/04/88/801840488.db2.gz	MUECVJLDTOIXQG-DGCLKSJQSA-N	0	3	306.410	2.386	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)CCCc1ccccc1	ZINC000036076833	1078197570	/nfs/dbraw/zinc/19/75/70/1078197570.db2.gz	IXFQPYNYYPCRBY-OAHLLOKOSA-N	0	3	312.479	2.269	10	0		DEAEHN
CCN(C(C)=O)c1nc(CNC[C@H]2CCCCN2C)cs1	ZINC000044561266	1078341314	/nfs/dbraw/zinc/34/13/14/1078341314.db2.gz	QFKQLIZOGOOZAB-CQSZACIVSA-N	0	3	310.467	2.090	10	0		DEAEHN
COc1cncc(CN[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)c1	ZINC000700056115	1086308448	/nfs/dbraw/zinc/30/84/48/1086308448.db2.gz	JQDOCQPVCRRZHB-VXGBXAGGSA-N	0	3	309.410	2.482	10	0		DEAEHN
Cc1ncc(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)n1C	ZINC000700742677	1086333157	/nfs/dbraw/zinc/33/31/57/1086333157.db2.gz	NGOKKCUEQLFXOY-RISCZKNCSA-N	0	3	308.426	2.216	10	0		DEAEHN
COC(=O)N(C)CCNCc1ccc(Br)c(F)c1	ZINC000701686282	1086376848	/nfs/dbraw/zinc/37/68/48/1086376848.db2.gz	DFFUZDLEVOIFTD-UHFFFAOYSA-N	0	3	319.174	2.376	10	0		DEAEHN
C[C@@H](NCC12CC(C1)CN2C(=O)OC(C)(C)C)c1ccnn1C	ZINC000701864553	1086388716	/nfs/dbraw/zinc/38/87/16/1086388716.db2.gz	NZCOQMXAGAUVDD-SFYCDEOASA-N	0	3	320.437	2.470	10	0		DEAEHN
CC(=O)CCC(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@]2(C)C1	ZINC000702259010	1086416715	/nfs/dbraw/zinc/41/67/15/1086416715.db2.gz	XZAUQGKLKWBMEX-PKOBYXMFSA-N	0	3	314.429	2.336	10	0		DEAEHN
COc1cncc(CNC[C@H](C)N(C)C(=O)OC(C)(C)C)c1	ZINC000704209356	1086574807	/nfs/dbraw/zinc/57/48/07/1086574807.db2.gz	UQNLOXKMJTWJPS-LBPRGKRZSA-N	0	3	309.410	2.435	10	0		DEAEHN
COC1(OC)CC[C@@H]1NC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000710947384	1086691745	/nfs/dbraw/zinc/69/17/45/1086691745.db2.gz	NYFFRAPUQGLUTG-OLZOCXBDSA-N	0	3	316.442	2.277	10	0		DEAEHN
COC1(OC)CC[C@@H]1NC[C@@H](NC(=O)OC(C)(C)C)C1CC1	ZINC000710948450	1086691789	/nfs/dbraw/zinc/69/17/89/1086691789.db2.gz	RZVPWCYBENGNQU-OLZOCXBDSA-N	0	3	314.426	2.031	10	0		DEAEHN
C[C@@H]1[C@@H](NC(=O)c2cccc(Br)c2F)CCN1C	ZINC000719388418	1089070656	/nfs/dbraw/zinc/07/06/56/1089070656.db2.gz	PUNULPKRVUODET-KCJUWKMLSA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@H]1[C@@H](NC(=O)c2cscc2Br)CCN1C	ZINC000719399052	1089084987	/nfs/dbraw/zinc/08/49/87/1089084987.db2.gz	YNWWZCRNISESIF-XVKPBYJWSA-N	0	3	303.225	2.333	10	0		DEAEHN
Cc1noc(C)c1CNC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000148229637	282103818	/nfs/dbraw/zinc/10/38/18/282103818.db2.gz	TVISKIZFGRYKNU-MRXNPFEDSA-N	0	3	316.405	2.394	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)N(C)[C@H]1CCSC1	ZINC000123368387	282130736	/nfs/dbraw/zinc/13/07/36/282130736.db2.gz	JMPGMOCHNWCWQE-HOTGVXAUSA-N	0	3	321.490	2.306	10	0		DEAEHN
CN(C)CCN(C[C@@H]1CCCO1)C(=O)NCCC1=CCCC1	ZINC000152070363	282134031	/nfs/dbraw/zinc/13/40/31/282134031.db2.gz	DTLXFDLOFSIWJI-INIZCTEOSA-N	0	3	309.454	2.239	10	0		DEAEHN
N[C@@H]1CCC[C@@H]1S(=O)(=O)c1ccccc1Br	ZINC000081932227	192341402	/nfs/dbraw/zinc/34/14/02/192341402.db2.gz	ZRJMOIDTZCOAHG-KOLCDFICSA-N	0	3	304.209	2.103	10	0		DEAEHN
CC[C@H](N)[C@@H](C)S(=O)(=O)c1ccccc1Br	ZINC000081931507	192341429	/nfs/dbraw/zinc/34/14/29/192341429.db2.gz	HYTQGPJMFATWTD-SCZZXKLOSA-N	0	3	306.225	2.349	10	0		DEAEHN
CCN[C@@H](CC)CS(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000081936080	192342872	/nfs/dbraw/zinc/34/28/72/192342872.db2.gz	RRYZPUOCMSZZMO-LBPRGKRZSA-N	0	3	313.419	2.010	10	0		DEAEHN
CCN[C@H](CC)CS(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000081936084	192343287	/nfs/dbraw/zinc/34/32/87/192343287.db2.gz	RRYZPUOCMSZZMO-GFCCVEGCSA-N	0	3	313.419	2.010	10	0		DEAEHN
CCCN[C@@H](c1ccc(C)cc1)[C@H](C)S(=O)(=O)CCOC	ZINC000081961899	192345347	/nfs/dbraw/zinc/34/53/47/192345347.db2.gz	PQFPZAQXYZUZSW-GOEBONIOSA-N	0	3	313.463	2.485	10	0		DEAEHN
CC(C)NCc1sc(CS(C)(=O)=O)nc1C(C)(C)C	ZINC000082439815	185182807	/nfs/dbraw/zinc/18/28/07/185182807.db2.gz	BJJOAKDNIWISBX-UHFFFAOYSA-N	0	3	304.481	2.483	10	0		DEAEHN
Cn1cc([C@H]2OCCC[C@@H]2NCc2cnc3ccccn23)cn1	ZINC000328638533	231274699	/nfs/dbraw/zinc/27/46/99/231274699.db2.gz	PCTKTQMFIPWBEE-DOTOQJQBSA-N	0	3	311.389	2.078	10	0		DEAEHN
O=C(C[C@H]1CCCCC(=O)N1)N1CC[C@@H](N2CCCCC2)C1	ZINC000328681155	231304648	/nfs/dbraw/zinc/30/46/48/231304648.db2.gz	UYIDTHSYOOMTHX-HUUCEWRRSA-N	0	3	307.438	2.362	10	0		DEAEHN
Cc1cc([C@@H]2CCCN(C(=O)[C@H](C3CC3)N3CCCC3)C2)[nH]n1	ZINC000328704825	231316220	/nfs/dbraw/zinc/31/62/20/231316220.db2.gz	YKQOQANOLRQFQT-WBVHZDCISA-N	0	3	316.449	2.299	10	0		DEAEHN
COc1ccccc1CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000173189434	282189015	/nfs/dbraw/zinc/18/90/15/282189015.db2.gz	KCKNTWQRPAWTBM-ZFWWWQNUSA-N	0	3	305.422	2.319	10	0		DEAEHN
NCc1cc(S(=O)(=O)N2CCC[C@@H]3CCC[C@@H]32)ccc1F	ZINC000087768774	185231421	/nfs/dbraw/zinc/23/14/21/185231421.db2.gz	SGNXZYZPWCPHBS-NHYWBVRUSA-N	0	3	312.410	2.238	10	0		DEAEHN
CS(=O)(=O)[C@H]1CCC[C@]1(CN)Nc1ccc(Cl)cc1	ZINC000087914285	185237435	/nfs/dbraw/zinc/23/74/35/185237435.db2.gz	KSFCWLZBWULAKX-QWHCGFSZSA-N	0	3	302.827	2.047	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccc3nc(N)sc3c2)C1	ZINC000087847433	185233327	/nfs/dbraw/zinc/23/33/27/185233327.db2.gz	HHEGWLSKAZVNRM-NSHDSACASA-N	0	3	304.419	2.093	10	0		DEAEHN
CCCNCC(=O)Nc1cc(OC)ccc1Br	ZINC000088321457	185245544	/nfs/dbraw/zinc/24/55/44/185245544.db2.gz	TXKBLTYACIIIHZ-UHFFFAOYSA-N	0	3	301.184	2.396	10	0		DEAEHN
CC[NH2+][C@](C)(CCCN1CCC[C@H](C(F)(F)F)C1)C(=O)[O-]	ZINC000088435284	185250365	/nfs/dbraw/zinc/25/03/65/185250365.db2.gz	WIGKFVYBLSYTQA-WCQYABFASA-N	0	3	310.360	2.494	10	0		DEAEHN
C[C@@H]1CCC[C@@](N)(C(=O)Nc2cnc(Br)cn2)C1	ZINC000088446384	185251231	/nfs/dbraw/zinc/25/12/31/185251231.db2.gz	VAJOOEOHERGNSX-PELKAZGASA-N	0	3	313.199	2.085	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCc1ccc(OC)cc1	ZINC000177294591	282203402	/nfs/dbraw/zinc/20/34/02/282203402.db2.gz	JIWFYNMVBLAVIX-MRXNPFEDSA-N	0	3	319.449	2.363	10	0		DEAEHN
CN1CCC(NC(=O)c2sc3ccc(F)cc3c2N)CC1	ZINC000088640357	185260729	/nfs/dbraw/zinc/26/07/29/185260729.db2.gz	PFAVYIGJOUVNIU-UHFFFAOYSA-N	0	3	307.394	2.447	10	0		DEAEHN
CC[C@@H](N)[C@@H](C)S(=O)(=O)c1cccc(Br)c1	ZINC000081982632	192349620	/nfs/dbraw/zinc/34/96/20/192349620.db2.gz	HVJBLQIAEUEZQY-LDYMZIIASA-N	0	3	306.225	2.349	10	0		DEAEHN
CCCN[C@H]1CCOC[C@@H]1S(=O)(=O)Cc1cccc(C)c1	ZINC000081984205	192349626	/nfs/dbraw/zinc/34/96/26/192349626.db2.gz	KQIAAIGUNMCLRT-HOTGVXAUSA-N	0	3	311.447	2.067	10	0		DEAEHN
CCN[C@H](c1ccccc1)[C@H](C)S(=O)(=O)C1CCOCC1	ZINC000081989526	192351305	/nfs/dbraw/zinc/35/13/05/192351305.db2.gz	MMRFEZFNCDIPFR-BBRMVZONSA-N	0	3	311.447	2.320	10	0		DEAEHN
CCC[C@@H](C(=O)NCCOc1ccc(F)cc1F)N(C)C	ZINC000179232276	282219660	/nfs/dbraw/zinc/21/96/60/282219660.db2.gz	RTLZWLWRXTYXEN-ZDUSSCGKSA-N	0	3	300.349	2.190	10	0		DEAEHN
CN1CCO[C@@H](CN)[C@@H]1c1cc(Cl)ccc1Br	ZINC000090250735	185288149	/nfs/dbraw/zinc/28/81/49/185288149.db2.gz	XSZMFIAPVHMZBN-RYUDHWBXSA-N	0	3	319.630	2.433	10	0		DEAEHN
N[C@H]1COC[C@H]1c1nc(-c2cc(Br)cs2)no1	ZINC000090364815	185292883	/nfs/dbraw/zinc/29/28/83/185292883.db2.gz	ZUDZIDCKPUASMF-RQJHMYQMSA-N	0	3	316.180	2.002	10	0		DEAEHN
N[C@H]1COC[C@@H]1c1nc(Cc2ccc(Cl)c(Cl)c2)no1	ZINC000090364622	185292898	/nfs/dbraw/zinc/29/28/98/185292898.db2.gz	OXVMHKTZXOFAGF-KWQFWETISA-N	0	3	314.172	2.408	10	0		DEAEHN
CN[C@H](C[S@@](=O)c1ccccc1)c1ccc2c(c1)OCO2	ZINC000082000991	192353935	/nfs/dbraw/zinc/35/39/35/192353935.db2.gz	UDXAHIFXYZRDNW-SZNDQCEHSA-N	0	3	303.383	2.484	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1nc2ccc(Cl)cc2s1	ZINC000090431481	185295854	/nfs/dbraw/zinc/29/58/54/185295854.db2.gz	NEPZJJLRRDBYFM-WPRPVWTQSA-N	0	3	311.794	2.123	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)N[C@@H](c1cccs1)C1CCCC1	ZINC000090432780	185296003	/nfs/dbraw/zinc/29/60/03/185296003.db2.gz	AWJLRBYTGJTIIV-UMVBOHGHSA-N	0	3	308.447	2.330	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1cc(C(F)(F)F)ccc1F	ZINC000090437619	185296112	/nfs/dbraw/zinc/29/61/12/185296112.db2.gz	QDLQYSWVAPQGDF-LDYMZIIASA-N	0	3	306.259	2.017	10	0		DEAEHN
N[C@H](C[S@@](=O)c1ccc(F)cc1)c1ccc2c(c1)OCO2	ZINC000082003194	192353873	/nfs/dbraw/zinc/35/38/73/192353873.db2.gz	PSBLMGVTILAOBQ-ASSNKEHSSA-N	0	3	307.346	2.362	10	0		DEAEHN
C[C@]1(C(=O)N2CCC[C@@H]2c2ccccc2Cl)COC[C@H]1N	ZINC000090593808	185305892	/nfs/dbraw/zinc/30/58/92/185305892.db2.gz	SLVCWBYRXSLDJQ-FMKPAKJESA-N	0	3	308.809	2.367	10	0		DEAEHN
C[C@@]1(c2nnc3c(Cl)cc(C(F)(F)F)cn32)COC[C@@H]1N	ZINC000090573053	185304295	/nfs/dbraw/zinc/30/42/95/185304295.db2.gz	SXZCFRIPFSVOCX-GZMMTYOYSA-N	0	3	320.702	2.017	10	0		DEAEHN
C[C@@H]1CNC[C@H](COCc2ccc(Br)s2)O1	ZINC000166711135	197696628	/nfs/dbraw/zinc/69/66/28/197696628.db2.gz	NRFUTTDTTKWRGT-RKDXNWHRSA-N	0	3	306.225	2.404	10	0		DEAEHN
CN(C)C[C@@H]1CSCCCN1C(=O)c1c(F)cccc1F	ZINC000090699864	185310702	/nfs/dbraw/zinc/31/07/02/185310702.db2.gz	USDOWVJHASMWLF-LLVKDONJSA-N	0	3	314.401	2.474	10	0		DEAEHN
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)/C=C/c1cncc([O-])c1	ZINC000179548385	282228726	/nfs/dbraw/zinc/22/87/26/282228726.db2.gz	CEQJTQCFMLHSHT-LLYBFZRZSA-N	0	3	303.406	2.037	10	0		DEAEHN
CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)/C=C/c1cncc([O-])c1	ZINC000179548385	282228730	/nfs/dbraw/zinc/22/87/30/282228730.db2.gz	CEQJTQCFMLHSHT-LLYBFZRZSA-N	0	3	303.406	2.037	10	0		DEAEHN
C[NH2+][C@H](C)c1cccc(S(=O)(=O)[N-]c2ccnc(C)c2)c1	ZINC000092364742	185314009	/nfs/dbraw/zinc/31/40/09/185314009.db2.gz	RKOVUYISWGCUFX-GFCCVEGCSA-N	0	3	305.403	2.471	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1nc(NC)ccc1Cl	ZINC000092674442	185333154	/nfs/dbraw/zinc/33/31/54/185333154.db2.gz	RXUKQSJWXZOGIT-LLVKDONJSA-N	0	3	310.829	2.333	10	0		DEAEHN
Cc1c(CN)cccc1S(=O)(=O)NCC1C(C)(C)C1(C)C	ZINC000092833137	185345045	/nfs/dbraw/zinc/34/50/45/185345045.db2.gz	OETLXUVLJPBVLO-UHFFFAOYSA-N	0	3	310.463	2.414	10	0		DEAEHN
CC(C)[C@@]1(C)CNC[C@]2(CCS(=O)(=O)c3ccccc32)O1	ZINC000168261819	197720058	/nfs/dbraw/zinc/72/00/58/197720058.db2.gz	UGPNPYVBCBPASX-CVEARBPZSA-N	0	3	309.431	2.094	10	0		DEAEHN
C[C@@H](NC[C@@H]1CCC(=O)N1)c1ccc(Br)s1	ZINC000070680158	539345256	/nfs/dbraw/zinc/34/52/56/539345256.db2.gz	MKHNRKMORWDBDX-SFYZADRCSA-N	0	3	303.225	2.440	10	0		DEAEHN
CN1C[C@@H](NCc2cccc(Br)c2F)CCC1=O	ZINC000294927622	529821344	/nfs/dbraw/zinc/82/13/44/529821344.db2.gz	BACBQSSTVSBDLO-JTQLQIEISA-N	0	3	315.186	2.299	10	0		DEAEHN
Cn1cc(CNCC2(C)OCCCO2)c(-c2ccccc2)n1	ZINC000192247948	282340275	/nfs/dbraw/zinc/34/02/75/282340275.db2.gz	ANJJGPXWBRJTFP-UHFFFAOYSA-N	0	3	301.390	2.330	10	0		DEAEHN
CNC(=O)NC(=O)CCN1CC[C@@H](C)[C@@H]1c1cccc(F)c1	ZINC000245407712	282385604	/nfs/dbraw/zinc/38/56/04/282385604.db2.gz	CMILKCKWHBIZKQ-IAQYHMDHSA-N	0	3	307.369	2.054	10	0		DEAEHN
COC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H](CC(C)C)CN(C)C)C1	ZINC000245452578	282389478	/nfs/dbraw/zinc/38/94/78/282389478.db2.gz	DRBPXTJZDFDKSM-ZNMIVQPWSA-N	0	3	312.454	2.058	10	0		DEAEHN
CC[C@H](C)CS(=O)(=O)N1CC[C@H]2CC[C@@H](C1)N2C(C)C	ZINC000245496994	282391988	/nfs/dbraw/zinc/39/19/88/282391988.db2.gz	SODSJGFNQKDIBY-ZNMIVQPWSA-N	0	3	302.484	2.309	10	0		DEAEHN
Cc1ccc(OC[C@H](O)CN(C)CCc2nccs2)cc1	ZINC000157964907	539574925	/nfs/dbraw/zinc/57/49/25/539574925.db2.gz	CWRLSHABXPNMIS-CQSZACIVSA-N	0	3	306.431	2.366	10	0		DEAEHN
CC(C)N1C(=O)C[C@@H](N)[C@@H]1c1cc(Cl)c2c(c1)OCCO2	ZINC000070293676	190878455	/nfs/dbraw/zinc/87/84/55/190878455.db2.gz	CSSNRJCUTFDGFU-RISCZKNCSA-N	0	3	310.781	2.120	10	0		DEAEHN
C[C@H](c1cccnc1)N1CCN(C(=O)c2ccccc2CN)CC1	ZINC000071700475	191009697	/nfs/dbraw/zinc/00/96/97/191009697.db2.gz	GSZPFCFMEDKIRN-OAHLLOKOSA-N	0	3	324.428	2.059	10	0		DEAEHN
C[C@@H](NC(=O)NC[C@@H]1CCCN1C)c1nc2ccccc2[nH]1	ZINC000139812327	186024076	/nfs/dbraw/zinc/02/40/76/186024076.db2.gz	KTZZONGPCUHEMS-NEPJUHHUSA-N	0	3	301.394	2.017	10	0		DEAEHN
CCN1CCC[C@@H]1CN1C(=O)C2(CC2)N[C@H]1c1cccs1	ZINC000140309217	186026045	/nfs/dbraw/zinc/02/60/45/186026045.db2.gz	APWOKNWNNWPVEB-TZMCWYRMSA-N	0	3	305.447	2.195	10	0		DEAEHN
Cc1cccc(C)c1OC[C@@H](O)CN1CCCN(C2CC2)CC1	ZINC000145740074	186037729	/nfs/dbraw/zinc/03/77/29/186037729.db2.gz	NCDMKDYAWVIQMF-SFHVURJKSA-N	0	3	318.461	2.213	10	0		DEAEHN
CCN([C@@H]1CCCNC1)S(=O)(=O)C[C@@H](C)c1ccccc1	ZINC000149314785	186049172	/nfs/dbraw/zinc/04/91/72/186049172.db2.gz	SPGHTVXZTKRPAK-GDBMZVCRSA-N	0	3	310.463	2.194	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000164135458	186150155	/nfs/dbraw/zinc/15/01/55/186150155.db2.gz	LJIJUGNQBBDCNE-LSDHHAIUSA-N	0	3	317.433	2.425	10	0		DEAEHN
C[C@H]1CCC[C@](N)(C(=O)c2c(Cl)cnn2CCN(C)C)C1	ZINC000164351416	186156675	/nfs/dbraw/zinc/15/66/75/186156675.db2.gz	YCPCJGDNVMJZCH-XHDPSFHLSA-N	0	3	312.845	2.188	10	0		DEAEHN
CS(=O)(=O)CCSc1ccc(C(F)(F)F)c(CN)c1	ZINC000164352157	186157070	/nfs/dbraw/zinc/15/70/70/186157070.db2.gz	CYNROMPUAFYKPE-UHFFFAOYSA-N	0	3	313.366	2.301	10	0		DEAEHN
CN(C)Cc1c2ccccc2oc1C(=O)NC[C@@H]1CCCN1C	ZINC000175710097	186191116	/nfs/dbraw/zinc/19/11/16/186191116.db2.gz	IDIZBRQDVWRLBI-ZDUSSCGKSA-N	0	3	315.417	2.318	10	0		DEAEHN
CC(C)NC(=O)CCN[C@H](C)c1cccc(N2CCCC2=O)c1	ZINC000177867173	186195601	/nfs/dbraw/zinc/19/56/01/186195601.db2.gz	PNDRJKIOIMFKCM-CQSZACIVSA-N	0	3	317.433	2.379	10	0		DEAEHN
COc1cc(NC(=O)N2CCN3CCC[C@H]3C2)cc(OC)c1	ZINC000171886148	198001158	/nfs/dbraw/zinc/00/11/58/198001158.db2.gz	ZDUVMKHHQLPHAD-ZDUSSCGKSA-N	0	3	305.378	2.016	10	0		DEAEHN
CCCCc1nnc(NC(=O)N2CCN3CCC[C@H]3C2)s1	ZINC000171886653	198001227	/nfs/dbraw/zinc/00/12/27/198001227.db2.gz	XYZYLMKSWYBPGR-NSHDSACASA-N	0	3	309.439	2.193	10	0		DEAEHN
COc1ccc(F)cc1[C@H](C)NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171901774	198005332	/nfs/dbraw/zinc/00/53/32/198005332.db2.gz	KTQGKJOAIFYJED-GXTWGEPZSA-N	0	3	321.396	2.385	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1[C@H](N[C@H]2CCC23CCC3)CC(=O)N1C	ZINC000328655872	539909273	/nfs/dbraw/zinc/90/92/73/539909273.db2.gz	NFKHCTICBOOHJF-JKIFEVAISA-N	0	3	316.449	2.231	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCN2CCC[C@@H]2C1)Oc1ccc(F)cc1	ZINC000173275805	198205830	/nfs/dbraw/zinc/20/58/30/198205830.db2.gz	DSGKYNNMIXLUKD-DZGCQCFKSA-N	0	3	321.396	2.083	10	0		DEAEHN
CSc1ccc(OCCN2CCN(C[C@@H](C)O)[C@H](C)C2)cc1	ZINC000173675976	198238942	/nfs/dbraw/zinc/23/89/42/198238942.db2.gz	DIZMGQGRQCCEMY-HUUCEWRRSA-N	0	3	324.490	2.174	10	0		DEAEHN
CCC(CC)c1cc(CNC(=O)N2CC[C@H](N(C)C)C2)on1	ZINC000173914805	198268557	/nfs/dbraw/zinc/26/85/57/198268557.db2.gz	MFANKSRRFDALGS-ZDUSSCGKSA-N	0	3	308.426	2.424	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCCNc2ccccn2)CCN1C	ZINC000173955099	198272756	/nfs/dbraw/zinc/27/27/56/198272756.db2.gz	HHFWIJJOOFECOF-CABCVRRESA-N	0	3	319.453	2.008	10	0		DEAEHN
CCc1ccc(CNC(=O)N2CC[C@@H](N3CC=CC3)C2)s1	ZINC000173955931	198273437	/nfs/dbraw/zinc/27/34/37/198273437.db2.gz	RCAWDRSTQCRVIO-CYBMUJFWSA-N	0	3	305.447	2.466	10	0		DEAEHN
CC[C@@H](O)CN1CCN(CCCOCCc2ccccc2)CC1	ZINC000174094737	198291195	/nfs/dbraw/zinc/29/11/95/198291195.db2.gz	QVXKVJISCQSBOP-LJQANCHMSA-N	0	3	320.477	2.024	10	0		DEAEHN
C[C@@H]1CCN(CC(=O)NC(C)(C)C)CCN1Cc1ccccc1	ZINC000174434389	198334491	/nfs/dbraw/zinc/33/44/91/198334491.db2.gz	UVDNUZOKGBTHBO-MRXNPFEDSA-N	0	3	317.477	2.498	10	0		DEAEHN
Cc1cnc([C@H](C)NC(=O)N2CC[C@@H](N3CC=CC3)C2)s1	ZINC000174922627	198403027	/nfs/dbraw/zinc/40/30/27/198403027.db2.gz	ZQXZPQOHKQCTLA-QWHCGFSZSA-N	0	3	306.435	2.168	10	0		DEAEHN
CN(C)C(=O)CC1CCN(C[C@](C)(O)c2ccccc2)CC1	ZINC000182226297	199406620	/nfs/dbraw/zinc/40/66/20/199406620.db2.gz	BXHSDHFYNXVKAY-SFHVURJKSA-N	0	3	304.434	2.084	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)[C@@H](C)Oc1ccc(OC)cc1	ZINC000055105834	354484539	/nfs/dbraw/zinc/48/45/39/354484539.db2.gz	LYRHMVXCDUWQJF-KGLIPLIRSA-N	0	3	306.406	2.063	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NC2(CO)CCCC2)[C@@H]1c1ccccc1	ZINC000179482591	283050333	/nfs/dbraw/zinc/05/03/33/283050333.db2.gz	ONQFJPXQUSTUTO-CVEARBPZSA-N	0	3	317.433	2.036	10	0		DEAEHN
COC(C)(C)C[C@@H](C)NC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000073722367	191345959	/nfs/dbraw/zinc/34/59/59/191345959.db2.gz	ZIBUHHXAMDBZRA-ZIAGYGMSSA-N	0	3	301.475	2.466	10	0		DEAEHN
NC[C@H](NC(=O)c1ccccc1Br)C(F)(F)F	ZINC000401872498	540143142	/nfs/dbraw/zinc/14/31/42/540143142.db2.gz	LPOIVXLDJAEBCD-QMMMGPOBSA-N	0	3	311.101	2.069	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)Nc1cnc(C2CC2)nc1	ZINC000103240222	355715498	/nfs/dbraw/zinc/71/54/98/355715498.db2.gz	MMHURZOJTHZXFT-LBPRGKRZSA-N	0	3	303.410	2.350	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](NCc2ccccc2)C1	ZINC000114084037	355761634	/nfs/dbraw/zinc/76/16/34/355761634.db2.gz	FJUUTKFGNMTODZ-HUUCEWRRSA-N	0	3	306.406	2.147	10	0		DEAEHN
CCN1CCO[C@H](CNCc2ccc(OC(F)F)cc2)C1	ZINC000134437447	355860072	/nfs/dbraw/zinc/86/00/72/355860072.db2.gz	KYTVWUARUBHPBG-CQSZACIVSA-N	0	3	300.349	2.098	10	0		DEAEHN
CN1CCC(N(C[C@@H]2CCOC2)C(=O)Cc2cccs2)CC1	ZINC000169749123	355980283	/nfs/dbraw/zinc/98/02/83/355980283.db2.gz	CGSMFUMZDLWIAD-AWEZNQCLSA-N	0	3	322.474	2.250	10	0		DEAEHN
CCC[C@@H](C)CN1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000180040799	356040362	/nfs/dbraw/zinc/04/03/62/356040362.db2.gz	XXIBPKSJRWKZTG-MRXNPFEDSA-N	0	3	309.498	2.489	10	0		DEAEHN
C[C@H](CNC(C)(C)c1ccc(F)c(F)c1)CS(C)(=O)=O	ZINC000180874472	356064693	/nfs/dbraw/zinc/06/46/93/356064693.db2.gz	CTTYMFGBSPBODM-SNVBAGLBSA-N	0	3	305.390	2.470	10	0		DEAEHN
CCc1cnc(CCN[C@H]2CCCC[C@H]2S(C)(=O)=O)s1	ZINC000183046520	356157581	/nfs/dbraw/zinc/15/75/81/356157581.db2.gz	NFAURWGSFHMRJY-QWHCGFSZSA-N	0	3	316.492	2.193	10	0		DEAEHN
CCS(=O)(=O)C[C@H](C)N[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000183050865	356158204	/nfs/dbraw/zinc/15/82/04/356158204.db2.gz	RLABPUUJUNVLGV-KBPBESRZSA-N	0	3	321.446	2.346	10	0		DEAEHN
Cc1ccccc1NC(=O)CN(CC(N)=S)C1CCCC1	ZINC000080223052	192013883	/nfs/dbraw/zinc/01/38/83/192013883.db2.gz	RKVBPQJDYKHZOP-UHFFFAOYSA-N	0	3	305.447	2.464	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2cccc(Br)c2C)C1	ZINC000228501626	356280918	/nfs/dbraw/zinc/28/09/18/356280918.db2.gz	IULDXDUEOJBBJI-BXKDBHETSA-N	0	3	313.195	2.073	10	0		DEAEHN
NCc1cnc(OC(F)(F)F)cc1I	ZINC000238570287	356304227	/nfs/dbraw/zinc/30/42/27/356304227.db2.gz	IHUAYHDLNVODTF-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
O=C(NCC1CCN(CCO)CC1)[C@@H]1CC[C@H]2CCCC[C@@H]2C1	ZINC000248144100	356321271	/nfs/dbraw/zinc/32/12/71/356321271.db2.gz	ZCYPLXGQFWYTQB-KZNAEPCWSA-N	0	3	322.493	2.413	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2[C@H]1NCc1ccccc1	ZINC000300227982	356390349	/nfs/dbraw/zinc/39/03/49/356390349.db2.gz	ZVXRDYBDPDMHIX-FZKCQIBNSA-N	0	3	318.417	2.457	10	0		DEAEHN
COC[C@H]1CCN(c2nc3sccn3c2CNC(C)C)C1	ZINC000081080506	192223356	/nfs/dbraw/zinc/22/33/56/192223356.db2.gz	GMLMWUJPOBPCNR-LBPRGKRZSA-N	0	3	308.451	2.367	10	0		DEAEHN
C[C@@H]1CC[C@](N)(c2ncncc2I)C1	ZINC000306153612	356403007	/nfs/dbraw/zinc/40/30/07/356403007.db2.gz	BAMRFPVGNRERRF-GMSGAONNSA-N	0	3	303.147	2.055	10	0		DEAEHN
CN(Cc1cc(N)cc(I)c1)C1CC1	ZINC000306722702	356405383	/nfs/dbraw/zinc/40/53/83/356405383.db2.gz	FYWSRFNESXEBLB-UHFFFAOYSA-N	0	3	302.159	2.468	10	0		DEAEHN
NCc1ccc(I)c(C(F)(F)F)n1	ZINC000307016694	356406478	/nfs/dbraw/zinc/40/64/78/356406478.db2.gz	PGKKSFQCOKOVOB-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
Cc1ccc(C(=O)N2CCO[C@@H](CN(C)CC3CC3)C2)c(F)c1	ZINC000328639033	356466101	/nfs/dbraw/zinc/46/61/01/356466101.db2.gz	PITQMBQTOMYLNI-HNNXBMFYSA-N	0	3	320.408	2.317	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@H]1CN(C)Cc2ccccc21	ZINC000536036051	540241148	/nfs/dbraw/zinc/24/11/48/540241148.db2.gz	PZANPNWSEXRRQF-DLBZAZTESA-N	0	3	301.434	2.164	10	0		DEAEHN
NC[C@H](c1ccc(Cl)cc1Cl)N1CCn2cnnc2C1	ZINC000081533194	192285372	/nfs/dbraw/zinc/28/53/72/192285372.db2.gz	OYYMHSPWVSDZDO-GFCCVEGCSA-N	0	3	312.204	2.101	10	0		DEAEHN
CC[C@@H](C)[C@H](N)C(=O)N(C)CC(=O)Nc1ccccc1SC	ZINC000236881692	202050194	/nfs/dbraw/zinc/05/01/94/202050194.db2.gz	URAGUVNMUKQMCX-ABAIWWIYSA-N	0	3	323.462	2.179	10	0		DEAEHN
COCC[C@H](C)NCC(=O)Nc1ccccc1Br	ZINC000081713154	192316173	/nfs/dbraw/zinc/31/61/73/192316173.db2.gz	REXALIWLBCEBCN-JTQLQIEISA-N	0	3	315.211	2.402	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)Nc1nc2cc3c(cc2s1)OCCO3	ZINC000236925368	202074797	/nfs/dbraw/zinc/07/47/97/202074797.db2.gz	UTKJVBGQTNGOJC-ISVAXAHUSA-N	0	3	321.402	2.379	10	0		DEAEHN
CC[C@H]([NH2+]Cc1cc(Br)c([O-])c(OC)c1)[C@@H](C)O	ZINC000386718953	356698321	/nfs/dbraw/zinc/69/83/21/356698321.db2.gz	RMXPUIUEVNTNPT-KCJUWKMLSA-N	0	3	318.211	2.412	10	0		DEAEHN
CN(C)C(=O)CCCNCc1ccsc1Br	ZINC000388516376	356705863	/nfs/dbraw/zinc/70/58/63/356705863.db2.gz	UPMBPUIVNMDQQA-UHFFFAOYSA-N	0	3	305.241	2.469	10	0		DEAEHN
c1cnc(-c2ccnc(NC[C@@H]3CCCCN3C3CC3)n2)cn1	ZINC000581112840	357131491	/nfs/dbraw/zinc/13/14/91/357131491.db2.gz	YQAGSAWNLLTFHV-AWEZNQCLSA-N	0	3	310.405	2.362	10	0		DEAEHN
CCNCc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000088905540	192651416	/nfs/dbraw/zinc/65/14/16/192651416.db2.gz	LNPSDXFPNGQGIX-UHFFFAOYSA-N	0	3	302.827	2.234	10	0		DEAEHN
CCN(C)S(=O)(=O)c1ccc(Cl)c(CNC(C)C)c1	ZINC000088940332	192662024	/nfs/dbraw/zinc/66/20/24/192662024.db2.gz	JKOKDQQKNCAPTQ-UHFFFAOYSA-N	0	3	304.843	2.478	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCCCOc1ccccc1OC	ZINC000591213328	357691091	/nfs/dbraw/zinc/69/10/91/357691091.db2.gz	QKYBPXBYPFCAIV-OAHLLOKOSA-N	0	3	320.433	2.455	10	0		DEAEHN
CC(C)N(CC(=O)NC12CC3CC(CC(C3)C1)C2)C[C@@H](C)O	ZINC000592976816	357980905	/nfs/dbraw/zinc/98/09/05/357980905.db2.gz	WILAOBPRZIXIJK-ZZFFKQLHSA-N	0	3	308.466	2.163	10	0		DEAEHN
COCCC[C@@H](C)[NH2+][C@@H](CC(C)C)c1nc(-c2nc[n-]n2)no1	ZINC000179809945	199083436	/nfs/dbraw/zinc/08/34/36/199083436.db2.gz	AIIOABZRUHLABR-NEPJUHHUSA-N	0	3	322.413	2.347	10	0		DEAEHN
COCCC[C@@H](C)N[C@@H](CC(C)C)c1nc(-c2nc[nH]n2)no1	ZINC000179809945	199083438	/nfs/dbraw/zinc/08/34/38/199083438.db2.gz	AIIOABZRUHLABR-NEPJUHHUSA-N	0	3	322.413	2.347	10	0		DEAEHN
O=C(C[C@H](O)c1ccc(Cl)cc1)N1CCN2CCC[C@@H]2C1	ZINC000179816852	199084182	/nfs/dbraw/zinc/08/41/82/199084182.db2.gz	JDQSBDUVJMJHFV-CABCVRRESA-N	0	3	308.809	2.070	10	0		DEAEHN
O[C@@H](COC[C@H]1CCCO1)CN1CCCc2sccc2C1	ZINC000593439711	358079044	/nfs/dbraw/zinc/07/90/44/358079044.db2.gz	BLZHSROVTVDHDV-HUUCEWRRSA-N	0	3	311.447	2.053	10	0		DEAEHN
C[C@H]1CN(CC2=Cc3ccccc3OC2)C[C@@H]1N1CCOCC1	ZINC000180230516	199132926	/nfs/dbraw/zinc/13/29/26/199132926.db2.gz	RBLDZNUEKZXJEF-YJBOKZPZSA-N	0	3	314.429	2.115	10	0		DEAEHN
CN(C(=O)CCCCC(=O)OC(C)(C)C)[C@@H]1CN2CCC1CC2	ZINC000594287916	358239592	/nfs/dbraw/zinc/23/95/92/358239592.db2.gz	CAWMCCKIEVVNBV-OAHLLOKOSA-N	0	3	324.465	2.441	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1cccc(C)c1F	ZINC000180660247	199192447	/nfs/dbraw/zinc/19/24/47/199192447.db2.gz	IYWOJNPOJDWJOW-CYBMUJFWSA-N	0	3	321.396	2.015	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)Nc2ccc3ncsc3c2)CCO1	ZINC000181166941	199259219	/nfs/dbraw/zinc/25/92/19/199259219.db2.gz	KBXDPMNUULCOBX-GFCCVEGCSA-N	0	3	320.418	2.091	10	0		DEAEHN
COc1cccc(Cl)c1CC(=O)N(C)CCN(C)C1CC1	ZINC000186778987	200009718	/nfs/dbraw/zinc/00/97/18/200009718.db2.gz	PCESHRRZMDGGEB-UHFFFAOYSA-N	0	3	310.825	2.444	10	0		DEAEHN
Cc1csc([C@@H](C)CNC(=O)N2CC[C@H](N3CC=CC3)C2)n1	ZINC000186809582	200014608	/nfs/dbraw/zinc/01/46/08/200014608.db2.gz	IRJLPUOFCHHMEB-JSGCOSHPSA-N	0	3	320.462	2.211	10	0		DEAEHN
CN(C[C@H](O)c1ccccc1C(F)(F)F)CC1(CO)CC1	ZINC000186764969	200006315	/nfs/dbraw/zinc/00/63/15/200006315.db2.gz	OHKZLBCMHRSYGO-ZDUSSCGKSA-N	0	3	303.324	2.443	10	0		DEAEHN
CCCCOc1ccc(NC(=O)N2CC[C@@H](N(C)C)C2)cn1	ZINC000187874498	200170150	/nfs/dbraw/zinc/17/01/50/200170150.db2.gz	OHHLBONSONGNDQ-CQSZACIVSA-N	0	3	306.410	2.428	10	0		DEAEHN
COC(=O)[C@H](C)Oc1ccc(CN2CC[C@@H](C)[C@@H](OC)C2)cc1	ZINC000188331976	200229455	/nfs/dbraw/zinc/22/94/55/200229455.db2.gz	YWDCRUAWZDHZHQ-KEYYUXOJSA-N	0	3	321.417	2.484	10	0		DEAEHN
NCc1cc(I)nc(C(F)(F)F)c1	ZINC000095766950	283527414	/nfs/dbraw/zinc/52/74/14/283527414.db2.gz	RNHIJFFOGSJDLA-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
C[C@@H](NC[C@H](O)CC(F)(F)F)c1ccc2c(c1)OCCO2	ZINC000189343317	200385243	/nfs/dbraw/zinc/38/52/43/200385243.db2.gz	DSSTYQZTXPCALO-MWLCHTKSSA-N	0	3	305.296	2.422	10	0		DEAEHN
COC(=O)[C@@H](C)[C@@H](NCCC(=O)NC(C)C)c1ccccc1	ZINC000152095377	291238814	/nfs/dbraw/zinc/23/88/14/291238814.db2.gz	HZPHAGUGZQODFR-XJKSGUPXSA-N	0	3	306.406	2.041	10	0		DEAEHN
C[C@H](C(=O)Nc1cnn(CCN(C)C)c1)c1cccc(F)c1	ZINC000607821312	361114039	/nfs/dbraw/zinc/11/40/39/361114039.db2.gz	SIOMIMJKSXHTSX-LBPRGKRZSA-N	0	3	304.369	2.326	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCCCCC(=O)OC(C)(C)C	ZINC000611354207	361584923	/nfs/dbraw/zinc/58/49/23/361584923.db2.gz	WWEQIHAUXHQDBS-CQSZACIVSA-N	0	3	312.454	2.489	10	0		DEAEHN
C[C@@H](NC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1)C(C)(C)C	ZINC000091855230	296060724	/nfs/dbraw/zinc/06/07/24/296060724.db2.gz	RHZKTHUFIWSLAK-HZPDHXFCSA-N	0	3	324.513	2.233	10	0		DEAEHN
CC(C)[C@@H]1C[C@H](NCc2cccc(S(C)(=O)=O)c2)CCO1	ZINC000449251212	240251402	/nfs/dbraw/zinc/25/14/02/240251402.db2.gz	NWKWUYGHPLIQHE-ZBFHGGJFSA-N	0	3	311.447	2.383	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)Nc1ccc(N2CCCC2)cc1	ZINC000091135282	193001769	/nfs/dbraw/zinc/00/17/69/193001769.db2.gz	BANPPIJGYGGJHL-CQSZACIVSA-N	0	3	305.447	2.320	10	0		DEAEHN
C[C@@H](CN1CCCC1)NC(=O)c1ccc(Br)nc1	ZINC000091448320	193057906	/nfs/dbraw/zinc/05/79/06/193057906.db2.gz	UGMZCWVVZBPAKA-JTQLQIEISA-N	0	3	312.211	2.058	10	0		DEAEHN
Cc1ccc(C(F)(F)F)cc1[N-]S(=O)(=O)[C@@H]1CC[NH2+]C1	ZINC000091481320	193062216	/nfs/dbraw/zinc/06/22/16/193062216.db2.gz	ZGAIZAMZVSLVNQ-SNVBAGLBSA-N	0	3	308.325	2.117	10	0		DEAEHN
C[C@@H](NC[C@@H]1COCCN1C)c1cc(Br)cs1	ZINC000624176892	365320489	/nfs/dbraw/zinc/32/04/89/365320489.db2.gz	UQPKPXMFEVIANR-MWLCHTKSSA-N	0	3	319.268	2.492	10	0		DEAEHN
O[C@@H]1COCC[C@@H]1N[C@@H]1CCc2c1cccc2Br	ZINC000624238730	365346506	/nfs/dbraw/zinc/34/65/06/365346506.db2.gz	XNSPORARCWPQDB-HZSPNIEDSA-N	0	3	312.207	2.176	10	0		DEAEHN
COc1cc(F)cc(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000091928395	193127817	/nfs/dbraw/zinc/12/78/17/193127817.db2.gz	FVKFDBPSLPHCHZ-WFASDCNBSA-N	0	3	323.412	2.458	10	0		DEAEHN
CC(C)CNCc1ncoc1-c1ccc(S(C)(=O)=O)cc1	ZINC000091959375	193132283	/nfs/dbraw/zinc/13/22/83/193132283.db2.gz	FZHDENJQUYRUMW-UHFFFAOYSA-N	0	3	308.403	2.491	10	0		DEAEHN
Cc1ccc(OCCCS(C)(=O)=O)c(CNC(C)(C)C)n1	ZINC000091996060	193138021	/nfs/dbraw/zinc/13/80/21/193138021.db2.gz	RBKCVGXRHXITDZ-UHFFFAOYSA-N	0	3	314.451	2.092	10	0		DEAEHN
CCOC(=O)CC[C@@H]1CCCN(Cc2c(C)nn(C)c2OC)C1	ZINC000092093825	193155623	/nfs/dbraw/zinc/15/56/23/193155623.db2.gz	ZNBYCFMLISEQNF-AWEZNQCLSA-N	0	3	323.437	2.292	10	0		DEAEHN
CC(=O)N1CC[C@H](CN(C)Cc2cc(-c3ccccc3)n[nH]2)C1	ZINC000092101885	193159308	/nfs/dbraw/zinc/15/93/08/193159308.db2.gz	QGCGARCUZMIRKS-OAHLLOKOSA-N	0	3	312.417	2.377	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2ccc(CNC(C)(C)C)o2)C[C@@H]1C	ZINC000092113110	193160403	/nfs/dbraw/zinc/16/04/03/193160403.db2.gz	OGHKTYCSLBXDJT-RYUDHWBXSA-N	0	3	314.451	2.444	10	0		DEAEHN
CCN(Cc1ccco1)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115872	193163906	/nfs/dbraw/zinc/16/39/06/193163906.db2.gz	LCFSREJSQRDCHS-UHFFFAOYSA-N	0	3	312.366	2.088	10	0		DEAEHN
CC[NH2+]Cc1ccc(S(=O)(=O)[N-]CC(C)(C)C)c(F)c1	ZINC000092115849	193164197	/nfs/dbraw/zinc/16/41/97/193164197.db2.gz	KVGJKDMGXYTRKU-UHFFFAOYSA-N	0	3	302.415	2.260	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)c(F)c1	ZINC000092116293	193164421	/nfs/dbraw/zinc/16/44/21/193164421.db2.gz	XBARQPMVDFEAMN-RYUDHWBXSA-N	0	3	314.426	2.212	10	0		DEAEHN
C/C(=C/c1cccc(C(F)(F)F)c1)CN[C@@H]1COC[C@@H]1O	ZINC000631200523	368074026	/nfs/dbraw/zinc/07/40/26/368074026.db2.gz	LFMFUDUSEWLOLJ-GIGVFAARSA-N	0	3	301.308	2.458	10	0		DEAEHN
O=C(N[C@@H]1CCOc2ccccc21)N1CC[C@@H](N2CCCC2)C1	ZINC000066174551	284083814	/nfs/dbraw/zinc/08/38/14/284083814.db2.gz	CCSSIHOKHAXTDC-GDBMZVCRSA-N	0	3	315.417	2.390	10	0		DEAEHN
COCCNCc1sc(N(C)[C@H](C)COC)nc1C(C)C	ZINC000092999850	193192748	/nfs/dbraw/zinc/19/27/48/193192748.db2.gz	MCQTWSQUEQYFOG-GFCCVEGCSA-N	0	3	315.483	2.474	10	0		DEAEHN
CCCn1cc(S(=O)(=O)N(CC)C[C@H](C)CC)cc1CN	ZINC000093265943	193222945	/nfs/dbraw/zinc/22/29/45/193222945.db2.gz	XVWDLBNGLJVPNM-CYBMUJFWSA-N	0	3	315.483	2.414	10	0		DEAEHN
CN[C@@H](Cc1ccc(Br)cc1F)C(OC)OC	ZINC000093304829	193227684	/nfs/dbraw/zinc/22/76/84/193227684.db2.gz	ORPUUIYYYYKCBF-NSHDSACASA-N	0	3	306.175	2.338	10	0		DEAEHN
CCOCCN(C)C[C@@H](O)COCc1ccc(Cl)cc1	ZINC000093313879	193229531	/nfs/dbraw/zinc/22/95/31/193229531.db2.gz	NIRWTFJFEBUTGI-OAHLLOKOSA-N	0	3	301.814	2.186	10	0		DEAEHN
COCCNCc1cn(C)nc1-c1cnc2ccsc2c1	ZINC000093297518	193226358	/nfs/dbraw/zinc/22/63/58/193226358.db2.gz	YTGKHEQTETYIHG-UHFFFAOYSA-N	0	3	302.403	2.433	10	0		DEAEHN
CCOC(OCC)[C@@H](N)Cc1c(Cl)c(CC)nn1CC	ZINC000093306621	193227232	/nfs/dbraw/zinc/22/72/32/193227232.db2.gz	OBISZWJDKNWATB-JTQLQIEISA-N	0	3	303.834	2.388	10	0		DEAEHN
CN[C@H](Cc1cc(OC)ccc1Br)C(OC)OC	ZINC000093304916	193227320	/nfs/dbraw/zinc/22/73/20/193227320.db2.gz	LPSREHPFAUKKII-GFCCVEGCSA-N	0	3	318.211	2.207	10	0		DEAEHN
NC(=O)[C@@]1(N)CCC[C@@H]1CCSc1nc2ccccc2[nH]1	ZINC000093629105	193276278	/nfs/dbraw/zinc/27/62/78/193276278.db2.gz	OIQQIDYNYNVXHO-MEBBXXQBSA-N	0	3	304.419	2.028	10	0		DEAEHN
CN(C)C[C@H](NCc1cc(C(N)=O)cs1)c1ccccc1	ZINC000093685368	193288782	/nfs/dbraw/zinc/28/87/82/193288782.db2.gz	KUJRXPKGDMODMJ-HNNXBMFYSA-N	0	3	303.431	2.240	10	0		DEAEHN
C[C@@]1(c2nc3cc(F)c(Br)cc3[nH]2)COC[C@@H]1N	ZINC000093728890	193297804	/nfs/dbraw/zinc/29/78/04/193297804.db2.gz	GXPBDZPXMYQXRM-CMPLNLGQSA-N	0	3	314.158	2.080	10	0		DEAEHN
CCN[C@]1(C(=O)OC)CCC[C@@H](N(C)CCC(F)(F)F)C1	ZINC000093756624	193301149	/nfs/dbraw/zinc/30/11/49/193301149.db2.gz	CTWYVPBSOZPPBL-DGCLKSJQSA-N	0	3	310.360	2.335	10	0		DEAEHN
NC(=O)[C@@]1(NC2CC2)CC[C@H](Sc2ccc(Cl)cn2)C1	ZINC000093854038	193319393	/nfs/dbraw/zinc/31/93/93/193319393.db2.gz	KIAYUTZGLCQHDU-SMDDNHRTSA-N	0	3	311.838	2.356	10	0		DEAEHN
CCN1CCO[C@@H]([C@@H](Cc2nc3ccccc3s2)NC)C1	ZINC000094251586	193355388	/nfs/dbraw/zinc/35/53/88/193355388.db2.gz	UOTUPFVNIXXWCO-ZIAGYGMSSA-N	0	3	305.447	2.148	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)s1)N(C)CCS(C)(=O)=O	ZINC000094297315	193356596	/nfs/dbraw/zinc/35/65/96/193356596.db2.gz	MDQQKFJOMJUFGX-JOYOIKCWSA-N	0	3	324.899	2.156	10	0		DEAEHN
CC[C@@](C)(N)C(=O)N1CCN(Cc2ccc(Cl)s2)CC1	ZINC000094234379	193353226	/nfs/dbraw/zinc/35/32/26/193353226.db2.gz	MBEIIGMILSZGRP-CQSZACIVSA-N	0	3	315.870	2.173	10	0		DEAEHN
CCC(N)(CC)C(=O)Nc1cc(C(=O)N(C)C)ccc1Cl	ZINC000094243768	193354257	/nfs/dbraw/zinc/35/42/57/193354257.db2.gz	YCTRKWTVSMVXRH-UHFFFAOYSA-N	0	3	311.813	2.498	10	0		DEAEHN
CCN[C@@H](c1cc(F)c(C)cc1F)[C@H]1CCS(=O)(=O)C1	ZINC000094707857	193393173	/nfs/dbraw/zinc/39/31/73/193393173.db2.gz	ALOKMSGXEYTSFO-IINYFYTJSA-N	0	3	303.374	2.359	10	0		DEAEHN
CCN[C@H](C)c1cc(F)ccc1O[C@H]1CCS(=O)(=O)C1	ZINC000094618896	193385299	/nfs/dbraw/zinc/38/52/99/193385299.db2.gz	IHOJRYRMXQDDLJ-PWSUYJOCSA-N	0	3	301.383	2.062	10	0		DEAEHN
Cc1cc(F)c([C@@H](C)NC[C@H]2CCS(=O)(=O)C2)cc1F	ZINC000094736791	193393889	/nfs/dbraw/zinc/39/38/89/193393889.db2.gz	CQNMVLLQCXLLND-GHMZBOCLSA-N	0	3	303.374	2.359	10	0		DEAEHN
CCn1c(=O)[nH]nc1Sc1cc(C)c(F)cc1[C@@H](C)NC	ZINC000094768537	193396583	/nfs/dbraw/zinc/39/65/83/193396583.db2.gz	AVIJGWZFCMHAEE-SECBINFHSA-N	0	3	310.398	2.470	10	0		DEAEHN
COC[C@H](C)[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000019904364	182162334	/nfs/dbraw/zinc/16/23/34/182162334.db2.gz	GREDTCPOAAMQQR-QMMMGPOBSA-N	0	3	304.184	2.288	10	0		DEAEHN
O=C1C[C@H](NCCc2ccc(F)cc2)C(=O)N1c1ccccc1	ZINC000019889546	182161084	/nfs/dbraw/zinc/16/10/84/182161084.db2.gz	IAWUYAPYBPOPGX-INIZCTEOSA-N	0	3	312.344	2.290	10	0		DEAEHN
Cc1cccc(CNS(=O)(=O)c2cc(CN)ccc2C)c1	ZINC000020189401	182195645	/nfs/dbraw/zinc/19/56/45/182195645.db2.gz	RKYSERCXZDXOTI-UHFFFAOYSA-N	0	3	304.415	2.241	10	0		DEAEHN
CC(C)NC(=O)[C@@H](C)Oc1ccc(Br)cc1CN	ZINC000020483348	182223172	/nfs/dbraw/zinc/22/31/72/182223172.db2.gz	IEPGCZXGVNSDCR-SECBINFHSA-N	0	3	315.211	2.200	10	0		DEAEHN
Cc1ccsc1[C@@H](CN)N1CCN(c2nccs2)CC1	ZINC000020565496	182233520	/nfs/dbraw/zinc/23/35/20/182233520.db2.gz	QOWWTZTYYGMDJJ-GFCCVEGCSA-N	0	3	308.476	2.335	10	0		DEAEHN
Cc1cccc([C@@H](CN)N2CCN(c3nccs3)CC2)c1	ZINC000022153976	182311442	/nfs/dbraw/zinc/31/14/42/182311442.db2.gz	RCPZLDGRNKFELP-OAHLLOKOSA-N	0	3	302.447	2.274	10	0		DEAEHN
CC(C)OCCN1CCC(NC(=O)NCCCC2CC2)CC1	ZINC000530868202	284477945	/nfs/dbraw/zinc/47/79/45/284477945.db2.gz	ZJAUAKZKWMOAGN-UHFFFAOYSA-N	0	3	311.470	2.365	10	0		DEAEHN
Cc1ccc(OCCCN2CCO[C@@H](CN(C)C)C2)cc1C	ZINC000155287944	291603734	/nfs/dbraw/zinc/60/37/34/291603734.db2.gz	SHYARUWXTTWGIU-SFHVURJKSA-N	0	3	306.450	2.335	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCN(Cc2cccc(F)c2)CC1)N(C)C	ZINC000157999678	291636372	/nfs/dbraw/zinc/63/63/72/291636372.db2.gz	VQHKZORLGKVAGA-KRWDZBQOSA-N	0	3	321.440	2.200	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N(C)C[C@@H](C)C(=O)OC(C)(C)C	ZINC000458369641	248277941	/nfs/dbraw/zinc/27/79/41/248277941.db2.gz	WCYHREOBHFJHQF-ZIAGYGMSSA-N	0	3	312.454	2.297	10	0		DEAEHN
CCOc1cccc(CCNC(=O)NC(C)(C)CN(C)C)c1	ZINC000458579647	248383363	/nfs/dbraw/zinc/38/33/63/248383363.db2.gz	QAZUVGSZFGLONF-UHFFFAOYSA-N	0	3	307.438	2.267	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2ccc(Cl)c3cccnc23)C1	ZINC000040634093	183111962	/nfs/dbraw/zinc/11/19/62/183111962.db2.gz	FOOOJBGADONOGS-TVQRCGJNSA-N	0	3	305.765	2.204	10	0		DEAEHN
CN1CCC[C@@H](NCc2ccc(I)o2)C1	ZINC000040672956	183116648	/nfs/dbraw/zinc/11/66/48/183116648.db2.gz	KKMIKQDDLDNUKU-SECBINFHSA-N	0	3	320.174	2.068	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2ccc(OC(F)F)c(Cl)c2)C1	ZINC000040850849	183141634	/nfs/dbraw/zinc/14/16/34/183141634.db2.gz	HYNYFFDVJNESSD-SCZZXKLOSA-N	0	3	320.723	2.257	10	0		DEAEHN
Cc1ccc(F)c(NC(=O)C(=O)NCCN2CCCC[C@H]2C)c1	ZINC000041664521	183213849	/nfs/dbraw/zinc/21/38/49/183213849.db2.gz	YOCUXKHSLNYXKC-CYBMUJFWSA-N	0	3	321.396	2.063	10	0		DEAEHN
CCNCc1cccc(Br)c1O[C@H]1CCOC1=O	ZINC000042411760	183265945	/nfs/dbraw/zinc/26/59/45/183265945.db2.gz	DZGBIDDDMUBQNU-NSHDSACASA-N	0	3	314.179	2.253	10	0		DEAEHN
CC(C)CN(CC(=O)Nc1cccc(C(N)=S)c1)C1CC1	ZINC000042557159	183284760	/nfs/dbraw/zinc/28/47/60/183284760.db2.gz	QYYFCZXGXNCFER-UHFFFAOYSA-N	0	3	305.447	2.380	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccccc1Cl)N(C)CC(=O)N1CCCC1	ZINC000043052106	183333109	/nfs/dbraw/zinc/33/31/09/183333109.db2.gz	DPXIIRZEMCRZRG-MLGOLLRUSA-N	0	3	309.841	2.283	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)cc1)N(C)CC(=O)NC1CC1	ZINC000042945178	183319590	/nfs/dbraw/zinc/31/95/90/183319590.db2.gz	WPAXAGKPHJSHCY-ZBFHGGJFSA-N	0	3	309.841	2.329	10	0		DEAEHN
NC[C@@H](c1cccc(Br)c1)N1CCCC[C@@H]1CO	ZINC000043021096	183329818	/nfs/dbraw/zinc/32/98/18/183329818.db2.gz	BQMHJVWTHMIITQ-KGLIPLIRSA-N	0	3	313.239	2.296	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccccc1Cl)N1CCS(=O)CC1	ZINC000043052233	183332692	/nfs/dbraw/zinc/33/26/92/183332692.db2.gz	AJZUYSQENTXJLW-UONOGXRCSA-N	0	3	300.855	2.183	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccccc1Cl)N1CCS(=O)CC1	ZINC000043052238	183333032	/nfs/dbraw/zinc/33/30/32/183333032.db2.gz	AJZUYSQENTXJLW-KGLIPLIRSA-N	0	3	300.855	2.183	10	0		DEAEHN
CCN(CC)C(=O)CN(C)[C@H](CN)c1ccc(Cl)s1	ZINC000043253549	183347749	/nfs/dbraw/zinc/34/77/49/183347749.db2.gz	UUOUDFOODYUKJM-SNVBAGLBSA-N	0	3	303.859	2.202	10	0		DEAEHN
CN[C@@H](c1ccccc1OC(F)(F)F)[C@@H]1CCS(=O)(=O)C1	ZINC000043300628	183352667	/nfs/dbraw/zinc/35/26/67/183352667.db2.gz	BNFHYUBZMDNYNK-BXKDBHETSA-N	0	3	323.336	2.280	10	0		DEAEHN
CN[C@H](c1cccc(C(F)(F)F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000043300566	183352696	/nfs/dbraw/zinc/35/26/96/183352696.db2.gz	DQYYQVDHDFCBBO-CMPLNLGQSA-N	0	3	307.337	2.401	10	0		DEAEHN
COC[C@@H](Cc1ccccc1)N[C@H]1CCO[C@@H]1c1ccnn1C	ZINC000284647854	218114428	/nfs/dbraw/zinc/11/44/28/218114428.db2.gz	OODJDGTXTBBICR-RYRKJORJSA-N	0	3	315.417	2.097	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)N[C@H](C)c2ccccc2)c1	ZINC000105881142	194155713	/nfs/dbraw/zinc/15/57/13/194155713.db2.gz	JEZRIUSDAUJFGW-HUUCEWRRSA-N	0	3	300.406	2.047	10	0		DEAEHN
CC[C@H]1CN(Cc2cc(-c3ccco3)on2)CCN1C[C@@H](C)O	ZINC000105912976	194168462	/nfs/dbraw/zinc/16/84/62/194168462.db2.gz	BWHHUNPDIYSXRN-HIFRSBDPSA-N	0	3	319.405	2.212	10	0		DEAEHN
CCn1cnnc1C1CCN(C[C@@](C)(O)c2ccccc2)CC1	ZINC000106387136	194206511	/nfs/dbraw/zinc/20/65/11/194206511.db2.gz	RQYJOBSZCBWDRM-GOSISDBHSA-N	0	3	314.433	2.385	10	0		DEAEHN
COc1cccc([C@H]2C[C@H]2C(=O)N(C)C2CCN(C)CC2)c1	ZINC000106725411	194246404	/nfs/dbraw/zinc/24/64/04/194246404.db2.gz	KQMBJMKRIXUMID-IAGOWNOFSA-N	0	3	302.418	2.351	10	0		DEAEHN
CCC[C@H](C(N)=S)N1CCN(Cc2ccccc2F)CC1	ZINC000109470287	194267208	/nfs/dbraw/zinc/26/72/08/194267208.db2.gz	ZFOXXQPHBJGPML-OAHLLOKOSA-N	0	3	309.454	2.398	10	0		DEAEHN
C[C@H](C(N)=S)N1CCN(c2ccnc3ccccc32)CC1	ZINC000109471381	194267507	/nfs/dbraw/zinc/26/75/07/194267507.db2.gz	KEDNIHGRBDHUJR-GFCCVEGCSA-N	0	3	300.431	2.031	10	0		DEAEHN
O=c1ccccn1CCNCc1ccc(Br)s1	ZINC000110056472	194308304	/nfs/dbraw/zinc/30/83/04/194308304.db2.gz	FBMRYWVYDUPGPB-UHFFFAOYSA-N	0	3	313.220	2.462	10	0		DEAEHN
O[C@@H](CCN1CCC(O)CC1)c1cccc(Br)c1	ZINC000053972404	183918336	/nfs/dbraw/zinc/91/83/36/183918336.db2.gz	BBHPPTOKSURTPI-AWEZNQCLSA-N	0	3	314.223	2.329	10	0		DEAEHN
CCCN[C@@](C)(C[C@H](C)N(C)CCOCC)C(=O)OCC	ZINC000157474326	197190337	/nfs/dbraw/zinc/19/03/37/197190337.db2.gz	OWVMEWMTOGJCAC-HOCLYGCPSA-N	0	3	302.459	2.055	10	0		DEAEHN
CCO[C@@H]1C[C@@](N)(C(=O)NCCCCC(F)(F)F)C1(C)C	ZINC000157513293	197193273	/nfs/dbraw/zinc/19/32/73/197193273.db2.gz	ZDFUTQLWRFUVPE-ZWNOBZJWSA-N	0	3	310.360	2.368	10	0		DEAEHN
CCNC(C)(C)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	ZINC000061292737	184167972	/nfs/dbraw/zinc/16/79/72/184167972.db2.gz	OOVIWQJLUCEDNY-UHFFFAOYSA-N	0	3	320.361	2.010	10	0		DEAEHN
CCCN[C@](C)(CSc1nc2cc(C)ccc2[nH]1)C(N)=O	ZINC000061440842	184170914	/nfs/dbraw/zinc/17/09/14/184170914.db2.gz	UKRJZEQXTDCSEZ-OAHLLOKOSA-N	0	3	306.435	2.207	10	0		DEAEHN
CCCN[C@](C)(CSc1nc2ccc(C)cc2[nH]1)C(N)=O	ZINC000061440842	184170917	/nfs/dbraw/zinc/17/09/17/184170917.db2.gz	UKRJZEQXTDCSEZ-OAHLLOKOSA-N	0	3	306.435	2.207	10	0		DEAEHN
CC(C)c1ncc(Cl)c(C(=O)N2CCC[C@H]2CN(C)C)n1	ZINC000061644509	184180464	/nfs/dbraw/zinc/18/04/64/184180464.db2.gz	LLRXAPBRXITJNX-NSHDSACASA-N	0	3	310.829	2.420	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1cncc(Br)c1	ZINC000061652044	184181160	/nfs/dbraw/zinc/18/11/60/184181160.db2.gz	BDGZLUOXZMEFHE-GFCCVEGCSA-N	0	3	312.211	2.010	10	0		DEAEHN
CNCc1cc(Br)cnc1N1CCCO[C@@H](C)C1	ZINC000061935209	184196920	/nfs/dbraw/zinc/19/69/20/184196920.db2.gz	CFHTZZFMGWAQHQ-JTQLQIEISA-N	0	3	314.227	2.179	10	0		DEAEHN
CC(C)(C)N1C(=O)C[C@@H](N)[C@@H]1c1ccc(Br)o1	ZINC000062210194	184220981	/nfs/dbraw/zinc/22/09/81/184220981.db2.gz	NDBAJMCSMUVBKY-RDDDGLTNSA-N	0	3	301.184	2.441	10	0		DEAEHN
NC[C@@H](c1ccccc1Br)N1CCn2ccnc2C1	ZINC000062246034	184225338	/nfs/dbraw/zinc/22/53/38/184225338.db2.gz	KIPLGUFWJKYZSI-ZDUSSCGKSA-N	0	3	321.222	2.161	10	0		DEAEHN
Cc1ccc(F)c(S(=O)(=O)[N-][C@H]2CCCCC[C@H]2[NH3+])c1	ZINC000063213463	184278393	/nfs/dbraw/zinc/27/83/93/184278393.db2.gz	VAIOYIGRYXMMTH-OLZOCXBDSA-N	0	3	300.399	2.072	10	0		DEAEHN
CN(CC1CCN(C)CC1)C(=O)c1cc(Cl)ccc1NN	ZINC000063125841	184271886	/nfs/dbraw/zinc/27/18/86/184271886.db2.gz	AAQXNDNCDQRJTD-UHFFFAOYSA-N	0	3	310.829	2.039	10	0		DEAEHN
O=c1cc2c(nn1Cc1ccc(Cl)cc1Cl)CCNC2	ZINC000063169767	184275592	/nfs/dbraw/zinc/27/55/92/184275592.db2.gz	QPSBWSZHFQHEQC-UHFFFAOYSA-N	0	3	310.184	2.244	10	0		DEAEHN
O=C(NCCc1c(F)cccc1F)N1CCCN(C2CC2)CC1	ZINC000064224596	184293066	/nfs/dbraw/zinc/29/30/66/184293066.db2.gz	LKUZEZKKMCYZDP-UHFFFAOYSA-N	0	3	323.387	2.387	10	0		DEAEHN
COC[C@H](C)CN1CCCN(C(=O)CCc2ccccc2)CC1	ZINC000189806992	335045198	/nfs/dbraw/zinc/04/51/98/335045198.db2.gz	PRQSTLALOAVTQA-QGZVFWFLSA-N	0	3	318.461	2.436	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)NC(C)(C)C)cc(C)c1F	ZINC000159078797	197325474	/nfs/dbraw/zinc/32/54/74/197325474.db2.gz	UKZDZZFFPSHGGA-UHFFFAOYSA-N	0	3	302.415	2.320	10	0		DEAEHN
N[C@@H]1CC(=O)N(c2ccc(OCCOc3ccccc3)cc2)C1	ZINC000066055686	184386088	/nfs/dbraw/zinc/38/60/88/184386088.db2.gz	BJGJKVGRRPXIIH-CQSZACIVSA-N	0	3	312.369	2.208	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1C[C@H](C)[C@@H]2CCCC[C@@H]21	ZINC000248409794	285023781	/nfs/dbraw/zinc/02/37/81/285023781.db2.gz	CVDKKDNGWHQUCH-YVSFHVDLSA-N	0	3	323.481	2.317	10	0		DEAEHN
COC(=O)c1ccc(NC(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc1	ZINC000120142239	195105320	/nfs/dbraw/zinc/10/53/20/195105320.db2.gz	ULMHOIYPQUKFNN-WFASDCNBSA-N	0	3	319.405	2.323	10	0		DEAEHN
Cc1cc(N[C@@H]2CCN(C)[C@@H]2c2ccccc2)n2ncnc2n1	ZINC000270269172	208335969	/nfs/dbraw/zinc/33/59/69/208335969.db2.gz	JZOWANFTBBMXOU-GDBMZVCRSA-N	0	3	308.389	2.290	10	0		DEAEHN
CCC[C@@H](N)C(=O)N1CCC([C@H](O)c2ccc(F)cc2)CC1	ZINC000159288618	197342873	/nfs/dbraw/zinc/34/28/73/197342873.db2.gz	BGDGZGXIFMPOGF-HZPDHXFCSA-N	0	3	308.397	2.225	10	0		DEAEHN
CCNCc1cccc(Cl)c1O[C@H]1CCS(=O)(=O)C1	ZINC000159152788	197331016	/nfs/dbraw/zinc/33/10/16/197331016.db2.gz	YUIDJYQHFSGOBO-NSHDSACASA-N	0	3	303.811	2.015	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCC1(Cc2ccccc2)CC1	ZINC000159123661	197329545	/nfs/dbraw/zinc/32/95/45/197329545.db2.gz	MEYDJMBIYUQKOO-INIZCTEOSA-N	0	3	301.434	2.403	10	0		DEAEHN
CC(C)(C)c1ccc(S(=O)(=O)C[C@@H](N)[C@@H]2CCOC2)cc1	ZINC000158771285	197300231	/nfs/dbraw/zinc/30/02/31/197300231.db2.gz	MCNIHVAMZNZRCR-IUODEOHRSA-N	0	3	311.447	2.122	10	0		DEAEHN
CCNCc1ccccc1S(=O)(=O)N1C[C@@H]2CCC[C@H]2C1	ZINC000158767236	197300348	/nfs/dbraw/zinc/30/03/48/197300348.db2.gz	ZKUQYBIMTCPBLV-GJZGRUSLSA-N	0	3	308.447	2.217	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)cc(CN)c1F	ZINC000158761579	197299218	/nfs/dbraw/zinc/29/92/18/197299218.db2.gz	ZNGGSEMMSBQQJE-VXGBXAGGSA-N	0	3	312.410	2.013	10	0		DEAEHN
CCc1ccc(CN)cc1S(=O)(=O)N1C[C@@H]2CCC[C@H]2C1	ZINC000158753219	197298647	/nfs/dbraw/zinc/29/86/47/197298647.db2.gz	CIGOMCGMIUKRCV-GJZGRUSLSA-N	0	3	308.447	2.128	10	0		DEAEHN
CC(C)CO[C@@H]1CCN(C(=O)N[C@H](CC(C)C)CN(C)C)C1	ZINC000158618536	197288701	/nfs/dbraw/zinc/28/87/01/197288701.db2.gz	YQGKPABRTDSZGN-HZPDHXFCSA-N	0	3	313.486	2.419	10	0		DEAEHN
C[C@H](CCO)NC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000157986208	197232742	/nfs/dbraw/zinc/23/27/42/197232742.db2.gz	UFSXISJHSOQMLR-WBVHZDCISA-N	0	3	319.449	2.111	10	0		DEAEHN
C[C@](F)(Cc1cncc(Br)c1)C[C@@H]1COCCN1	ZINC000157668692	197206579	/nfs/dbraw/zinc/20/65/79/197206579.db2.gz	BCKRHLCLXSHDOM-OLZOCXBDSA-N	0	3	317.202	2.493	10	0		DEAEHN
O=C1NCCCC[C@@H]1N1CCC([C@@H](O)c2ccc(F)cc2)CC1	ZINC000120325873	195143377	/nfs/dbraw/zinc/14/33/77/195143377.db2.gz	RDUQQWPQFYOMSP-IRXDYDNUSA-N	0	3	320.408	2.240	10	0		DEAEHN
NN=c1[nH]cc(Br)cc1C(=O)NCCCC1CC1	ZINC000157157115	197166674	/nfs/dbraw/zinc/16/66/74/197166674.db2.gz	BKRQHISIOCSFGZ-UHFFFAOYSA-N	0	3	313.199	2.050	10	0		DEAEHN
C[C@@](O)(Cc1sccc1Br)C[C@H]1COCCN1	ZINC000156858832	197145742	/nfs/dbraw/zinc/14/57/42/197145742.db2.gz	CVLMZVIERRRRQC-CABZTGNLSA-N	0	3	320.252	2.183	10	0		DEAEHN
C[C@](O)(Cc1ccccc1Br)C[C@@H]1COCCN1	ZINC000156802932	197142548	/nfs/dbraw/zinc/14/25/48/197142548.db2.gz	MOLLLXGQRMEHAS-OCCSQVGLSA-N	0	3	314.223	2.121	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)NCCN1CCC[C@H](C)C1	ZINC000189706962	533145342	/nfs/dbraw/zinc/14/53/42/533145342.db2.gz	ZJQVJRITQTYVLF-KBPBESRZSA-N	0	3	320.437	2.182	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCc2nc(C(F)(F)F)cs2)C1	ZINC000155474979	197058476	/nfs/dbraw/zinc/05/84/76/197058476.db2.gz	IQNBVKSMMYTMLZ-QMMMGPOBSA-N	0	3	322.356	2.007	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1nc2cccc(C)c2n1C)N(C)C	ZINC000155417485	197053462	/nfs/dbraw/zinc/05/34/62/197053462.db2.gz	BXDGMECMUHXWDI-AWEZNQCLSA-N	0	3	302.422	2.228	10	0		DEAEHN
Cc1ccc([C@H](CNC(=O)c2cccc3ncnn32)N(C)C)cc1	ZINC000542938929	285264707	/nfs/dbraw/zinc/26/47/07/285264707.db2.gz	DNIIBDPELNKKMK-INIZCTEOSA-N	0	3	323.400	2.070	10	0		DEAEHN
Cc1cc(F)cc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000120662523	195210748	/nfs/dbraw/zinc/21/07/48/195210748.db2.gz	PWGHNLVGHVQMKV-IUODEOHRSA-N	0	3	321.396	2.014	10	0		DEAEHN
Cc1cccc(CN2CC[C@@H]3C[C@@H](C(=O)NC4CC4)O[C@H]3C2)c1	ZINC000247894247	257115665	/nfs/dbraw/zinc/11/56/65/257115665.db2.gz	GOMWXRTUDCGHKE-NJAFHUGGSA-N	0	3	314.429	2.253	10	0		DEAEHN
COc1c(C)cc(Br)c(C)c1[C@H](N)CCC(N)=O	ZINC000124742824	195674359	/nfs/dbraw/zinc/67/43/59/195674359.db2.gz	WUMKDFDJRWQRRO-SNVBAGLBSA-N	0	3	315.211	2.340	10	0		DEAEHN
N[C@@H]1CSCc2c(Br)cc3c(c21)OCCO3	ZINC000125453287	195751818	/nfs/dbraw/zinc/75/18/18/195751818.db2.gz	LOWCEPWDLKNAET-MRVPVSSYSA-N	0	3	302.193	2.467	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@H]2CCC[C@@H]2C[NH3+])c(Cl)cc1F	ZINC000237792292	291980308	/nfs/dbraw/zinc/98/03/08/291980308.db2.gz	XPRKIYBJADTARY-SKDRFNHKSA-N	0	3	320.817	2.193	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@@H]1C[C@]12CCCc1ccccc12	ZINC000562450596	291985931	/nfs/dbraw/zinc/98/59/31/291985931.db2.gz	RQTUZAQEYVUIRW-ICSRJNTNSA-N	0	3	321.424	2.326	10	0		DEAEHN
CC[C@@H](CO)N1CCN(Cc2cc(F)cc3cccnc32)CC1	ZINC000174134951	132507433	/nfs/dbraw/zinc/50/74/33/132507433.db2.gz	ZCERUQGHCORLKH-KRWDZBQOSA-N	0	3	317.408	2.262	10	0		DEAEHN
C[C@H]1CCc2c(-c3nc([C@H]4CNCCN4C)no3)csc2C1	ZINC000263312538	132581379	/nfs/dbraw/zinc/58/13/79/132581379.db2.gz	YXPISMVDXVUCEP-GXFFZTMASA-N	0	3	318.446	2.499	10	0		DEAEHN
CC1CCN(CCNC(=O)NCc2ccc3cc[nH]c3n2)CC1	ZINC000357608135	133088227	/nfs/dbraw/zinc/08/82/27/133088227.db2.gz	LISSDTKDNKQNSU-UHFFFAOYSA-N	0	3	315.421	2.094	10	0		DEAEHN
C[C@H](NCCN1CCN(C(=O)C2CCC2)CC1)c1ccsc1	ZINC000358144063	133123835	/nfs/dbraw/zinc/12/38/35/133123835.db2.gz	VKEYMGCPAUISOT-AWEZNQCLSA-N	0	3	321.490	2.343	10	0		DEAEHN
Cc1ccc([C@@H](C)NCCN2CCN(C(=O)C3CCC3)CC2)o1	ZINC000358142353	133124301	/nfs/dbraw/zinc/12/43/01/133124301.db2.gz	QTDWPQKQAGYIFX-OAHLLOKOSA-N	0	3	319.449	2.183	10	0		DEAEHN
Cc1csc(NC2CCN(C(=O)CN(C)C(C)C)CC2)n1	ZINC000377358237	133327199	/nfs/dbraw/zinc/32/71/99/133327199.db2.gz	FWMJRWLFAQVZFH-UHFFFAOYSA-N	0	3	310.467	2.195	10	0		DEAEHN
C[C@H](N[C@H]1CCC(=O)N[C@@H]1C)c1cncc(Br)c1	ZINC000563446686	292057918	/nfs/dbraw/zinc/05/79/18/292057918.db2.gz	XGCPCGTZNATJPS-SBMIAAHKSA-N	0	3	312.211	2.162	10	0		DEAEHN
CN(C)CCn1ccc(NC(=O)N2CCC[C@@H]2c2ccco2)n1	ZINC000173945464	144853941	/nfs/dbraw/zinc/85/39/41/144853941.db2.gz	FANDYZCETSCOGJ-CYBMUJFWSA-N	0	3	317.393	2.407	10	0		DEAEHN
O=C(Nc1nc(-c2ccco2)cs1)c1n[nH]c2c1CNCC2	ZINC000188343877	145010618	/nfs/dbraw/zinc/01/06/18/145010618.db2.gz	IRZMDMWVAQZPKQ-UHFFFAOYSA-N	0	3	315.358	2.024	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1ccn(-c2ccccc2)n1	ZINC000188745392	145016766	/nfs/dbraw/zinc/01/67/66/145016766.db2.gz	HPLVZFOWGCCRCY-UHFFFAOYSA-N	0	3	318.380	2.406	10	0		DEAEHN
COC[C@H](O)CN1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000189806242	145034673	/nfs/dbraw/zinc/03/46/73/145034673.db2.gz	ZNPXHOMBMIQTSF-CQSZACIVSA-N	0	3	304.390	2.323	10	0		DEAEHN
Cc1cc(NC(=O)C2CCN(C[C@H]3CCC=CO3)CC2)no1	ZINC000191068845	145052293	/nfs/dbraw/zinc/05/22/93/145052293.db2.gz	QNIHATRZJDHLJW-CQSZACIVSA-N	0	3	305.378	2.326	10	0		DEAEHN
CCC[C@@H]1CN(C[C@H](O)CC2CCCC2)CCN1CCOC	ZINC000191028677	145052302	/nfs/dbraw/zinc/05/23/02/145052302.db2.gz	FCLFRYXIIUMALN-QZTJIDSGSA-N	0	3	312.498	2.360	10	0		DEAEHN
Cc1nsc(N2CCCN(C[C@H](O)C3CCCCC3)CC2)n1	ZINC000191349426	145056837	/nfs/dbraw/zinc/05/68/37/145056837.db2.gz	KXHLARIJYUDGOS-HNNXBMFYSA-N	0	3	324.494	2.300	10	0		DEAEHN
O=C(Nc1ccccc1)C1CCN([C@@H]2CCCCNC2=O)CC1	ZINC000192651273	145076661	/nfs/dbraw/zinc/07/66/61/145076661.db2.gz	XPXDZFWFWZZGQT-MRXNPFEDSA-N	0	3	315.417	2.006	10	0		DEAEHN
CO[C@@H]1CCCN(C[C@@H](O)COCc2ccc(Cl)cc2)C1	ZINC000246130627	145093098	/nfs/dbraw/zinc/09/30/98/145093098.db2.gz	OYTCTJBNMZSICU-HZPDHXFCSA-N	0	3	313.825	2.328	10	0		DEAEHN
c1cc(OCCCN2CCN3CCCC[C@H]3C2)cc2c1OCO2	ZINC000246223211	145095150	/nfs/dbraw/zinc/09/51/50/145095150.db2.gz	QNHXGULHRNODJW-HNNXBMFYSA-N	0	3	318.417	2.354	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(C)cc1	ZINC000246281392	145097310	/nfs/dbraw/zinc/09/73/10/145097310.db2.gz	VPTUCRHYBXSBKM-GJZGRUSLSA-N	0	3	308.447	2.242	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H](c2ccccc2)CN(Cc2cnn(C)c2)C1	ZINC000246315072	145098387	/nfs/dbraw/zinc/09/83/87/145098387.db2.gz	RBBFZGSUGVVROE-IAGOWNOFSA-N	0	3	313.401	2.199	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)C(=O)Nc2ccccc2Cl)C1	ZINC000246407280	145101844	/nfs/dbraw/zinc/10/18/44/145101844.db2.gz	LTKDGQBBOFVCKP-SMDDNHRTSA-N	0	3	323.824	2.123	10	0		DEAEHN
CCOc1ccccc1CN1C[C@@H](C)[C@@H](N2CCOCC2)C1	ZINC000246455471	145103702	/nfs/dbraw/zinc/10/37/02/145103702.db2.gz	MZDSQLKZVZMPBN-WBVHZDCISA-N	0	3	304.434	2.238	10	0		DEAEHN
CCc1cccc(OCCN2C[C@H](N3CCOCC3)[C@@H](C)C2)c1	ZINC000246496382	145105145	/nfs/dbraw/zinc/10/51/45/145105145.db2.gz	PRAOYZKDVNPJOH-LPHOPBHVSA-N	0	3	318.461	2.280	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)COCc2ccccc2)C1	ZINC000246797962	145114487	/nfs/dbraw/zinc/11/44/87/145114487.db2.gz	ROAHTAHYHYOZNQ-IRXDYDNUSA-N	0	3	302.418	2.146	10	0		DEAEHN
O=C([C@@H]1SCCc2ccccc21)N1CCN2CCC[C@H]2C1	ZINC000247240808	145130647	/nfs/dbraw/zinc/13/06/47/145130647.db2.gz	XWWCJCQHJKKSLF-GOEBONIOSA-N	0	3	302.443	2.324	10	0		DEAEHN
CCc1ccc([C@H](CNC(=O)N[C@H](C)[C@H](C)CO)N(C)C)cc1	ZINC000247294975	145132402	/nfs/dbraw/zinc/13/24/02/145132402.db2.gz	USJOHNIXSLDGIL-CPUCHLNUSA-N	0	3	321.465	2.168	10	0		DEAEHN
C[C@H](C(=O)N1C[C@@H]2CCCN2C[C@H]1C)n1cnc2ccccc21	ZINC000247508830	145139606	/nfs/dbraw/zinc/13/96/06/145139606.db2.gz	VRFPLHAQYKQRHR-KFWWJZLASA-N	0	3	312.417	2.292	10	0		DEAEHN
CC[C@H](NC(=O)N1CCN2CCC[C@H]2C1)c1nc(C)cs1	ZINC000247649669	145142699	/nfs/dbraw/zinc/14/26/99/145142699.db2.gz	WFJJNDOUPUTPRQ-STQMWFEESA-N	0	3	308.451	2.392	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2ccc(OC(F)F)cc2)C[C@@H]1C	ZINC000247806861	145144172	/nfs/dbraw/zinc/14/41/72/145144172.db2.gz	SXIFDRNOQHVCRE-STQMWFEESA-N	0	3	314.376	2.175	10	0		DEAEHN
C[C@H](C(=O)NC1CCCCC1)N1CC[C@@]2(O)CCCC[C@H]2C1	ZINC000247968051	145145892	/nfs/dbraw/zinc/14/58/92/145145892.db2.gz	IJGPTBQBQJJMQV-VKJFTORMSA-N	0	3	308.466	2.451	10	0		DEAEHN
Cc1cccc(C)c1OC[C@H](O)CN1CCN2CCCC[C@H]2C1	ZINC000248370318	145151956	/nfs/dbraw/zinc/15/19/56/145151956.db2.gz	XILKERCIDTVUQE-ZWKOTPCHSA-N	0	3	318.461	2.213	10	0		DEAEHN
Cc1csc([C@@H]2CCCN(CCN3CCO[C@@H](C)C3)C2)n1	ZINC000249268421	145181481	/nfs/dbraw/zinc/18/14/81/145181481.db2.gz	IQZDQZVADNONPR-LSDHHAIUSA-N	0	3	309.479	2.352	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CCCO[C@H]1C	ZINC000249432343	145184526	/nfs/dbraw/zinc/18/45/26/145184526.db2.gz	IUWWAFIGIPZNKV-ATLSCFEFSA-N	0	3	316.445	2.438	10	0		DEAEHN
C[C@H](Oc1ccc(F)c(F)c1)C(=O)N1CCN2CCC[C@H]2C1	ZINC000249824337	145191255	/nfs/dbraw/zinc/19/12/55/145191255.db2.gz	JEVGLKVLJLCFQO-RYUDHWBXSA-N	0	3	310.344	2.039	10	0		DEAEHN
O=C(CN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)Nc1nccs1	ZINC000252692394	145200137	/nfs/dbraw/zinc/20/01/37/145200137.db2.gz	BGXJZWWQMWENNP-GXTWGEPZSA-N	0	3	320.462	2.030	10	0		DEAEHN
N[C@@H](C(=O)Nc1cccc(-c2cnco2)c1)C1CCOCC1	ZINC000261705267	145218564	/nfs/dbraw/zinc/21/85/64/145218564.db2.gz	IJRWDOXWQHYEEX-OAHLLOKOSA-N	0	3	301.346	2.034	10	0		DEAEHN
COc1c(C)cnc(CN2CCNC[C@H]2c2cccnc2)c1C	ZINC000261877666	145236757	/nfs/dbraw/zinc/23/67/57/145236757.db2.gz	YCJHTTFUGZGHNB-KRWDZBQOSA-N	0	3	312.417	2.249	10	0		DEAEHN
COc1ccc(CN[C@@H]2CCC[C@@H]2[C@@H]2COCCN2)c(F)c1	ZINC000261933508	145244299	/nfs/dbraw/zinc/24/42/99/145244299.db2.gz	LZVLFZCQKRHUGS-UAGQMJEPSA-N	0	3	308.397	2.081	10	0		DEAEHN
c1cc2c(c(CN3CCC(O[C@@H]4CCOC4)CC3)c1)NCC2	ZINC000261944827	145244665	/nfs/dbraw/zinc/24/46/65/145244665.db2.gz	NDUOVJLZRADSNQ-QGZVFWFLSA-N	0	3	302.418	2.425	10	0		DEAEHN
Cc1cccc(CNC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000261983535	145249917	/nfs/dbraw/zinc/24/99/17/145249917.db2.gz	ASIWEZPAVYQBTK-RLFYNMQTSA-N	0	3	302.418	2.144	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)CN1CCNC[C@@H]1c1cccnc1	ZINC000262227340	145269957	/nfs/dbraw/zinc/26/99/57/145269957.db2.gz	NKRRLZGAFFTEDO-QGZVFWFLSA-N	0	3	324.428	2.283	10	0		DEAEHN
COc1ccccc1[C@H]1CNCCN1Cc1nc(C(C)C)no1	ZINC000262276168	145272600	/nfs/dbraw/zinc/27/26/00/145272600.db2.gz	TVCVJUUMUFPRFZ-CQSZACIVSA-N	0	3	316.405	2.348	10	0		DEAEHN
CC(C)C(=O)Nc1ccc(N[C@@H](C)C[C@H]2COCCN2)cc1	ZINC000262298428	145274535	/nfs/dbraw/zinc/27/45/35/145274535.db2.gz	OFGKJVBPSJSZJU-BBRMVZONSA-N	0	3	305.422	2.460	10	0		DEAEHN
C[C@H](NC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C)c1ccccc1	ZINC000262587095	145295667	/nfs/dbraw/zinc/29/56/67/145295667.db2.gz	ZWJPMQRMFMRBNS-CTNYNGJSSA-N	0	3	302.418	2.396	10	0		DEAEHN
C[C@H]1C[NH2+]CC[C@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000262790513	145305120	/nfs/dbraw/zinc/30/51/20/145305120.db2.gz	ROEAUSOFEHEFKH-GZMMTYOYSA-N	0	3	323.245	2.270	10	0		DEAEHN
COC(C)(C)C(=O)NC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000309638645	145349367	/nfs/dbraw/zinc/34/93/67/145349367.db2.gz	AYYCCPXRSCPLHN-GOSISDBHSA-N	0	3	304.434	2.440	10	0		DEAEHN
COc1cccc(C2=CCN(C(=O)N[C@@H](C)CN(C)C)CC2)c1	ZINC000358498088	147146008	/nfs/dbraw/zinc/14/60/08/147146008.db2.gz	KEGPUWPOGGXMBH-AWEZNQCLSA-N	0	3	317.433	2.444	10	0		DEAEHN
O=C(Nc1cccc2c1OCCC2)N1CC[C@@H](N2CC=CC2)C1	ZINC000370537938	148028320	/nfs/dbraw/zinc/02/83/20/148028320.db2.gz	HYQMXERRJCLYQZ-OAHLLOKOSA-N	0	3	313.401	2.490	10	0		DEAEHN
Cc1ccc(CCC(=O)N2CCCN([C@H](C)CO)CC2)c(C)c1	ZINC000375500440	148380067	/nfs/dbraw/zinc/38/00/67/148380067.db2.gz	YLIZCTYNQHRLTR-QGZVFWFLSA-N	0	3	318.461	2.151	10	0		DEAEHN
CC(C)c1ccccc1OC[C@@H](O)CN(C)CCn1cccn1	ZINC000111695287	401721634	/nfs/dbraw/zinc/72/16/34/401721634.db2.gz	OVSBSVAJSDJCTN-INIZCTEOSA-N	0	3	317.433	2.378	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC[C@H](n3cc(C)cn3)C2)C1	ZINC000111836809	401725304	/nfs/dbraw/zinc/72/53/04/401725304.db2.gz	LBIMDHKDFNDUFF-HOTGVXAUSA-N	0	3	319.453	2.022	10	0		DEAEHN
CCN(CCNC(=O)N1CCC[C@@H](n2cc(C)cn2)C1)C1CC1	ZINC000111849961	401726012	/nfs/dbraw/zinc/72/60/12/401726012.db2.gz	VSFXUGVOYKHNBY-MRXNPFEDSA-N	0	3	319.453	2.022	10	0		DEAEHN
CC[C@]1(C)CCCN(C(=O)NC[C@H]2CCCN2CCOC)C1	ZINC000074167180	401731990	/nfs/dbraw/zinc/73/19/90/401731990.db2.gz	OIHRCVJKQNCVHI-NVXWUHKLSA-N	0	3	311.470	2.319	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2ccc(N3CCCC3)nc2)CCN1C	ZINC000127558445	401740035	/nfs/dbraw/zinc/74/00/35/401740035.db2.gz	XVABXRAITXGDSW-GOEBONIOSA-N	0	3	316.449	2.237	10	0		DEAEHN
CCc1cnc(CCNC(=O)N2CCCN(C3CC3)CC2)s1	ZINC000074842449	401744937	/nfs/dbraw/zinc/74/49/37/401744937.db2.gz	WCUPSOCITGUFFJ-UHFFFAOYSA-N	0	3	322.478	2.128	10	0		DEAEHN
COc1cc(F)c(C(=O)N2CC[C@H](N3CCCC3)C2)cc1OC	ZINC000126365287	401691164	/nfs/dbraw/zinc/69/11/64/401691164.db2.gz	CFELVNJIQAGMMN-LBPRGKRZSA-N	0	3	322.380	2.153	10	0		DEAEHN
CN(C)Cc1ccc([C@]2(O)c3ccccc3C3=NCCN32)cc1	ZINC000013491056	401800207	/nfs/dbraw/zinc/80/02/07/401800207.db2.gz	DGZRWRJCFZDZKJ-IBGZPJMESA-N	0	3	307.397	2.017	10	0		DEAEHN
CN(C)[C@@H](CNC(=O)N(C)C[C@@H]1CCCO1)c1ccccc1	ZINC000076996468	401802029	/nfs/dbraw/zinc/80/20/29/401802029.db2.gz	AFZXXGJQKORIDC-HOTGVXAUSA-N	0	3	305.422	2.110	10	0		DEAEHN
CCc1cnc(CCNC(=O)NCCN2CCC(C)CC2)s1	ZINC000075810425	401768994	/nfs/dbraw/zinc/76/89/94/401768994.db2.gz	QZVSFDBDBGVMMG-UHFFFAOYSA-N	0	3	324.494	2.279	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc2c(c(Cl)c1)OCO2	ZINC000113226673	401770847	/nfs/dbraw/zinc/77/08/47/401770847.db2.gz	HWVXFQFXFUZTFP-CMPLNLGQSA-N	0	3	322.792	2.377	10	0		DEAEHN
Cc1ccccc1-n1cc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cn1	ZINC000113227189	401772009	/nfs/dbraw/zinc/77/20/09/401772009.db2.gz	XEZOJLXPZONCST-RDJZCZTQSA-N	0	3	324.428	2.489	10	0		DEAEHN
CC(C)Cn1ncc(C(=O)N2CC[C@H](N(C)C)C2)c1C(F)F	ZINC000128733135	401789639	/nfs/dbraw/zinc/78/96/39/401789639.db2.gz	IOTPAJITHQQRTH-NSHDSACASA-N	0	3	314.380	2.253	10	0		DEAEHN
COc1ccc([C@@H]2C[C@@H](C)N(CC(=O)N(C)C3CC3)C2)cc1	ZINC000076389127	401793621	/nfs/dbraw/zinc/79/36/21/401793621.db2.gz	IYOGAYVDXBVBHC-UKRRQHHQSA-N	0	3	302.418	2.494	10	0		DEAEHN
Cc1ccccc1[C@H](C)CC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000116785132	401858641	/nfs/dbraw/zinc/85/86/41/401858641.db2.gz	KTKCLUZYBVIHNY-CVEARBPZSA-N	0	3	304.434	2.278	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)CSCc2cscn2)[C@@H](C)C1	ZINC000131981032	401860697	/nfs/dbraw/zinc/86/06/97/401860697.db2.gz	UGEUSLDPPNLIBM-AAEUAGOBSA-N	0	3	313.492	2.221	10	0		DEAEHN
C[C@H](CN1CCN(c2ccc3nncn3n2)CC1)c1ccccc1	ZINC000116878790	401863143	/nfs/dbraw/zinc/86/31/43/401863143.db2.gz	FIBSUAOQJIKNDY-OAHLLOKOSA-N	0	3	322.416	2.050	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)NCCCC2CCCCC2)CCO1	ZINC000117033032	401867113	/nfs/dbraw/zinc/86/71/13/401867113.db2.gz	LMYPRBGOTLGELQ-MRXNPFEDSA-N	0	3	311.470	2.319	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC[C@@H](c2cc[nH]n2)C1	ZINC000114933361	401815114	/nfs/dbraw/zinc/81/51/14/401815114.db2.gz	RISKXKWKOZBMPQ-CABCVRRESA-N	0	3	321.469	2.275	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1sc(COC)nc1C	ZINC000119215454	401933713	/nfs/dbraw/zinc/93/37/13/401933713.db2.gz	VFZIZGGMAUGNKG-LBPRGKRZSA-N	0	3	311.451	2.154	10	0		DEAEHN
C[C@H]1CN2CCCC[C@@H]2CN1c1ncc(Br)cn1	ZINC000083704205	401901084	/nfs/dbraw/zinc/90/10/84/401901084.db2.gz	YPNJLVNWJJUXOG-CMPLNLGQSA-N	0	3	311.227	2.302	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)Nc2cc(F)ccc2Cl)CCO1	ZINC000118818003	401909547	/nfs/dbraw/zinc/90/95/47/401909547.db2.gz	LVIAPMPQRYHBAS-LLVKDONJSA-N	0	3	315.776	2.273	10	0		DEAEHN
C[C@H](CCc1ccc(OC(F)F)cc1)NCC(=O)N(C)C	ZINC000037225380	401911334	/nfs/dbraw/zinc/91/13/34/401911334.db2.gz	KWILUMLIBRMRPQ-LLVKDONJSA-N	0	3	300.349	2.287	10	0		DEAEHN
CSCCCC(=O)NCc1ccccc1OCCN(C)C	ZINC000134715369	401911612	/nfs/dbraw/zinc/91/16/12/401911612.db2.gz	GOEMCOWWNPYGDJ-UHFFFAOYSA-N	0	3	310.463	2.386	10	0		DEAEHN
Cc1noc(CCN[C@@H](C)c2ccc3c(c2)OCCCO3)n1	ZINC000089517876	401950866	/nfs/dbraw/zinc/95/08/66/401950866.db2.gz	QYQSHRIAIJEOLN-NSHDSACASA-N	0	3	303.362	2.433	10	0		DEAEHN
O=C1CC[C@@H]2CN(C[C@@H](O)c3ccccc3)CC[C@H]2N1C1CC1	ZINC000119889343	401969877	/nfs/dbraw/zinc/96/98/77/401969877.db2.gz	ZPXURCSZXNUNGZ-KBAYOESNSA-N	0	3	314.429	2.195	10	0		DEAEHN
CC(C)Cc1ccc([C@@H](C)NCC(=O)N2CCNC2=O)cc1	ZINC000120303203	401985443	/nfs/dbraw/zinc/98/54/43/401985443.db2.gz	HDUZGTOAJRAPNP-CYBMUJFWSA-N	0	3	303.406	2.088	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)C(=O)Nc2cccc(Cl)c2)C1	ZINC000150775603	401995182	/nfs/dbraw/zinc/99/51/82/401995182.db2.gz	UTBTXCRQQJFTHA-RISCZKNCSA-N	0	3	323.824	2.123	10	0		DEAEHN
Cc1nn(C)c(CNC[C@H]2CCCC[C@H]2O)c1Br	ZINC000089233364	401939858	/nfs/dbraw/zinc/93/98/58/401939858.db2.gz	JSHSEUIYKBINMF-ZYHUDNBSSA-N	0	3	316.243	2.132	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCc2ccc(Cl)nc2)CCN1C	ZINC000119305514	401940308	/nfs/dbraw/zinc/94/03/08/401940308.db2.gz	XJNRHRJCCBAYGO-OCCSQVGLSA-N	0	3	324.856	2.402	10	0		DEAEHN
C[C@H]1CC[C@@H](C(=O)N(CCN(C)C)Cc2ccccc2F)O1	ZINC000150817491	401996955	/nfs/dbraw/zinc/99/69/55/401996955.db2.gz	NJVIZMPCTOAOSH-BBRMVZONSA-N	0	3	308.397	2.283	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCO[C@H](c2ccsc2)C1	ZINC000151121409	402017342	/nfs/dbraw/zinc/01/73/42/402017342.db2.gz	KRJLVCCIPJCOGW-CABCVRRESA-N	0	3	323.462	2.315	10	0		DEAEHN
O=C(CN[C@H](c1ccc(Cl)cc1)C1CC1)NC(=O)NC1CC1	ZINC000050273799	402026246	/nfs/dbraw/zinc/02/62/46/402026246.db2.gz	MMWXONRTHWRTHR-HNNXBMFYSA-N	0	3	321.808	2.369	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CCCCC1(C)C	ZINC000150887245	402003066	/nfs/dbraw/zinc/00/30/66/402003066.db2.gz	VSURTZWEGWKBMH-HUUCEWRRSA-N	0	3	311.470	2.365	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cn(C)nc2C(C)(C)C)CCN1C	ZINC000092814747	402009850	/nfs/dbraw/zinc/00/98/50/402009850.db2.gz	MEUGAMFJJKKYQF-CHWSQXEVSA-N	0	3	306.454	2.272	10	0		DEAEHN
COc1cc(CCC2CCN(C(=O)[C@H](C)N)CC2)cc(OC)c1	ZINC000152012551	402071113	/nfs/dbraw/zinc/07/11/13/402071113.db2.gz	CLNTXGUCIRWQOZ-ZDUSSCGKSA-N	0	3	320.433	2.222	10	0		DEAEHN
CC(C)[C@@H](Cc1ccccc1)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000123041673	402107193	/nfs/dbraw/zinc/10/71/93/402107193.db2.gz	UTULDOPEFGURNY-ZWKOTPCHSA-N	0	3	318.461	2.290	10	0		DEAEHN
CCc1ccc([C@@H](CNC(=O)NC[C@@H](O)C(C)C)N(C)C)cc1	ZINC000152947889	402118086	/nfs/dbraw/zinc/11/80/86/402118086.db2.gz	OMHCKGZPKJSZSG-IAGOWNOFSA-N	0	3	321.465	2.168	10	0		DEAEHN
COc1cccc(OC)c1CC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000122215581	402067262	/nfs/dbraw/zinc/06/72/62/402067262.db2.gz	KHTUBJCAWHWWNJ-KBPBESRZSA-N	0	3	320.433	2.187	10	0		DEAEHN
O=C(CN1CC[C@@H]2OCCC[C@@H]2C1)N1CCc2ccccc2C1	ZINC000153167077	402130882	/nfs/dbraw/zinc/13/08/82/402130882.db2.gz	ORVJMUAIBZZLPH-MSOLQXFVSA-N	0	3	314.429	2.072	10	0		DEAEHN
CCc1noc2ncc(C(=O)N(C)[C@@H]3CCN(C)[C@H](C)C3)cc12	ZINC000123523828	402132250	/nfs/dbraw/zinc/13/22/50/402132250.db2.gz	LLWNWRPQFYWKIG-DGCLKSJQSA-N	0	3	316.405	2.340	10	0		DEAEHN
O=S(=O)(NCc1ccc2c(c1)CNC2)c1ccc(Cl)cc1	ZINC000097829621	402133255	/nfs/dbraw/zinc/13/32/55/402133255.db2.gz	OSIGWACMJSBHCL-UHFFFAOYSA-N	0	3	322.817	2.422	10	0		DEAEHN
c1cc(-c2noc(CN3CCC[C@@H]3CN3CCCC3)n2)co1	ZINC000066537022	402135961	/nfs/dbraw/zinc/13/59/61/402135961.db2.gz	VNXCIBPNWVYPLT-CQSZACIVSA-N	0	3	302.378	2.390	10	0		DEAEHN
CC[C@H](C(=O)N1CCO[C@@H](CN(C)C)C1)c1ccc(F)cc1	ZINC000123594618	402137213	/nfs/dbraw/zinc/13/72/13/402137213.db2.gz	LHVRFEALVYHFOY-HOTGVXAUSA-N	0	3	308.397	2.108	10	0		DEAEHN
CCCC(=O)NCC(=O)N(CC)Cc1ccc(CN(C)C)cc1	ZINC000066725791	402140621	/nfs/dbraw/zinc/14/06/21/402140621.db2.gz	CVCRMKQXOKLWGH-UHFFFAOYSA-N	0	3	319.449	2.013	10	0		DEAEHN
CC(C)CCOc1ccc([C@@H](C)N[C@@H](C)C(=O)NC(N)=O)cc1	ZINC000101583032	402150250	/nfs/dbraw/zinc/15/02/50/402150250.db2.gz	QDJPQSCTPWAKDG-OLZOCXBDSA-N	0	3	321.421	2.346	10	0		DEAEHN
CC(C(=O)N[C@H](C)c1ccccc1)S(=O)(=O)c1nccs1	ZINC000068144712	402184998	/nfs/dbraw/zinc/18/49/98/402184998.db2.gz	XOCJXCCCPKPMIO-GHMZBOCLSA-N	0	3	324.427	2.183	10	0		DEAEHN
Cc1ccc(CCN2CCCN(Cc3cnn(C)c3)CC2)cc1	ZINC000124626220	402188784	/nfs/dbraw/zinc/18/87/84/402188784.db2.gz	MNCIATLXCTZNIM-UHFFFAOYSA-N	0	3	312.461	2.479	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H]1CCN(c2ncccc2Cl)C1)N(C)C	ZINC000154081258	402191478	/nfs/dbraw/zinc/19/14/78/402191478.db2.gz	VQQOQOIUSCWUPJ-GXTWGEPZSA-N	0	3	324.856	2.160	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)CCc2ccc(C(=O)OC)cc2)C1	ZINC000068429906	402197501	/nfs/dbraw/zinc/19/75/01/402197501.db2.gz	BUZQYVGAKNKQFO-INIZCTEOSA-N	0	3	318.417	2.006	10	0		DEAEHN
CN(CCCNC(=O)N(C)C[C@H]1CCCO1)Cc1ccccc1	ZINC000102902163	402174456	/nfs/dbraw/zinc/17/44/56/402174456.db2.gz	LTRAUGVBURUMQH-QGZVFWFLSA-N	0	3	319.449	2.329	10	0		DEAEHN
c1ccc(Cc2nc(CN3CC[C@@H](N4CCCC4)C3)no2)cc1	ZINC000069222337	402216338	/nfs/dbraw/zinc/21/63/38/402216338.db2.gz	QYRSJPZIBDFMPR-MRXNPFEDSA-N	0	3	312.417	2.331	10	0		DEAEHN
O=C([C@H]1CCCc2n[nH]cc21)N1CCN(C2CCCCC2)CC1	ZINC000154743659	402229186	/nfs/dbraw/zinc/22/91/86/402229186.db2.gz	BQJWYRSVYYEJBY-HNNXBMFYSA-N	0	3	316.449	2.307	10	0		DEAEHN
O=C(Nc1ccccc1)C(=O)N1CCCC[C@H](N2CCCC2)C1	ZINC000107666960	402236894	/nfs/dbraw/zinc/23/68/94/402236894.db2.gz	JNWILFMAWLSWPD-INIZCTEOSA-N	0	3	315.417	2.102	10	0		DEAEHN
COC(=O)[C@@H]1CCN(CCC(=O)Nc2cccc(Cl)c2)C1	ZINC000107823913	402241176	/nfs/dbraw/zinc/24/11/76/402241176.db2.gz	NIUGZGHCPVDXDN-LLVKDONJSA-N	0	3	310.781	2.164	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)[C@H]1C[C@@H](C(C)=O)C1(C)C	ZINC000155023512	402241634	/nfs/dbraw/zinc/24/16/34/402241634.db2.gz	WNXYTNDKKBEJSD-XUWVNRHRSA-N	0	3	306.450	2.323	10	0		DEAEHN
Cc1cc(C)n([C@@H](C)C(=O)NCc2cccc(CN(C)C)c2)n1	ZINC000125748347	402247936	/nfs/dbraw/zinc/24/79/36/402247936.db2.gz	RLBAYEMKUUGVQL-HNNXBMFYSA-N	0	3	314.433	2.439	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2sc(C)nc2C)C1	ZINC000108562035	402257538	/nfs/dbraw/zinc/25/75/38/402257538.db2.gz	CWFCLPLUQOJOCX-ZDUSSCGKSA-N	0	3	310.467	2.086	10	0		DEAEHN
CCOc1ccc(CNC(=O)NC[C@H]2CCCN(C)C2)cc1F	ZINC000108575837	402258076	/nfs/dbraw/zinc/25/80/76/402258076.db2.gz	YVPWKACQVPRWCJ-CQSZACIVSA-N	0	3	323.412	2.365	10	0		DEAEHN
Cc1ccc(OCCN(C)C(=O)NC[C@@H]2CCCN(C)C2)cc1	ZINC000108588195	402258088	/nfs/dbraw/zinc/25/80/88/402258088.db2.gz	MQWJWXCFDVUPJR-INIZCTEOSA-N	0	3	319.449	2.357	10	0		DEAEHN
Cc1ccccc1OCCN1CCCN(c2cccnn2)CC1	ZINC000105909336	402210460	/nfs/dbraw/zinc/21/04/60/402210460.db2.gz	PXLUEDSZXPKUJY-UHFFFAOYSA-N	0	3	312.417	2.376	10	0		DEAEHN
CCn1nccc1CCN1C[C@H](O)C[C@H]1c1cccc(OC)c1	ZINC000225787188	402323581	/nfs/dbraw/zinc/32/35/81/402323581.db2.gz	YRPGMLGYUMTPSX-AEFFLSMTSA-N	0	3	315.417	2.262	10	0		DEAEHN
CNC(=O)c1ccc(CN2CCC(Cn3cccn3)CC2)cc1	ZINC000109005715	402266584	/nfs/dbraw/zinc/26/65/84/402266584.db2.gz	IYIZRAKYEYPUBJ-UHFFFAOYSA-N	0	3	312.417	2.155	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1cccc(COC)c1	ZINC000110088539	402281385	/nfs/dbraw/zinc/28/13/85/402281385.db2.gz	GXAKZNQJFLVYLU-MRXNPFEDSA-N	0	3	321.421	2.065	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccc(OCCCOC)cc2)C1	ZINC000176268220	402295612	/nfs/dbraw/zinc/29/56/12/402295612.db2.gz	DQMAUOYXWUBVST-INIZCTEOSA-N	0	3	320.433	2.316	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cnc(C(F)(F)F)nc2)CCN1C	ZINC000157554806	402295905	/nfs/dbraw/zinc/29/59/05/402295905.db2.gz	NDTTZYQAIGFJDM-GXSJLCMTSA-N	0	3	316.327	2.050	10	0		DEAEHN
Cn1cc(-c2cc(CN(CCO)C3CCCCC3)on2)cn1	ZINC000185040537	402319360	/nfs/dbraw/zinc/31/93/60/402319360.db2.gz	AQXAFHJOKWPUSZ-UHFFFAOYSA-N	0	3	304.394	2.202	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1cccnc1Br	ZINC000229614300	402344206	/nfs/dbraw/zinc/34/42/06/402344206.db2.gz	IGAFXTMOMSCLMO-JTQLQIEISA-N	0	3	312.211	2.010	10	0		DEAEHN
C[C@H](CN1CCCCCC1)NC(=O)c1cccc(NC(N)=O)c1	ZINC000185434697	402351965	/nfs/dbraw/zinc/35/19/65/402351965.db2.gz	RBMOARFKYFIPOR-CYBMUJFWSA-N	0	3	318.421	2.172	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cccc(C(=O)OC)c1	ZINC000176976757	402355765	/nfs/dbraw/zinc/35/57/65/402355765.db2.gz	UEYUYXLGKGWXCI-HNNXBMFYSA-N	0	3	304.390	2.030	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(F)cc2nccnc21	ZINC000177013175	402359399	/nfs/dbraw/zinc/35/93/99/402359399.db2.gz	RJZUMKVLHRYTHK-ZDUSSCGKSA-N	0	3	316.380	2.325	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C[C@H]1OC(=O)c2ccccc21	ZINC000177020638	402360283	/nfs/dbraw/zinc/36/02/83/402360283.db2.gz	LMESTOCRHCKWJF-CZUORRHYSA-N	0	3	316.401	2.231	10	0		DEAEHN
COC(=O)[C@](C)(O)CN[C@@H](C)c1cccc(Br)c1	ZINC000228639294	402338997	/nfs/dbraw/zinc/33/89/97/402338997.db2.gz	DWUVXAKCJLTNJU-TVQRCGJNSA-N	0	3	316.195	2.024	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCc1ccc(C)nc1	ZINC000177506128	402409930	/nfs/dbraw/zinc/40/99/30/402409930.db2.gz	LEOLTHMMIYTWAZ-MRXNPFEDSA-N	0	3	304.438	2.058	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2cccnc2N(C)C)C12CCOCC2	ZINC000186243544	402414443	/nfs/dbraw/zinc/41/44/43/402414443.db2.gz	WIWGPYSHBLECBH-HZPDHXFCSA-N	0	3	319.449	2.211	10	0		DEAEHN
CCO[C@H]1C[C@@H](NCc2cccc3c2OCO3)C12CCOCC2	ZINC000186265526	402416540	/nfs/dbraw/zinc/41/65/40/402416540.db2.gz	AZCDTJFPOBMSOD-CVEARBPZSA-N	0	3	319.401	2.479	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2ccc(C(=O)OC)o2)C12CCOCC2	ZINC000186338588	402422976	/nfs/dbraw/zinc/42/29/76/402422976.db2.gz	JBIFKBXUNCTYBP-LSDHHAIUSA-N	0	3	323.389	2.130	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)NCc1ccccc1F	ZINC000177700861	402428088	/nfs/dbraw/zinc/42/80/88/402428088.db2.gz	OCTOAVGJXSAKDF-GOEBONIOSA-N	0	3	321.440	2.247	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)N(C)Cc1ccccc1	ZINC000177704683	402428513	/nfs/dbraw/zinc/42/85/13/402428513.db2.gz	UKQVFLJQFOPPRV-WMZOPIPTSA-N	0	3	317.477	2.450	10	0		DEAEHN
CSC1(C(=O)Nc2ccnc(OC3CCN(C)CC3)c2)CC1	ZINC000242197018	402444663	/nfs/dbraw/zinc/44/46/63/402444663.db2.gz	XHBPVNIAFMFXIG-UHFFFAOYSA-N	0	3	321.446	2.389	10	0		DEAEHN
COc1ccc(OCCCN2CCCC[C@@]2(C)C(N)=O)cc1	ZINC000185966387	402393444	/nfs/dbraw/zinc/39/34/44/402393444.db2.gz	SWQCNYKYMVYGIB-KRWDZBQOSA-N	0	3	306.406	2.194	10	0		DEAEHN
COC[C@@H](NCc1cccc(OC)c1OC)C1CCOCC1	ZINC000187799107	402511658	/nfs/dbraw/zinc/51/16/58/402511658.db2.gz	UDAXLXLNCIAFQP-OAHLLOKOSA-N	0	3	309.406	2.235	10	0		DEAEHN
C[C@H](NCc1cccnc1-n1cncn1)c1ccc2c(c1)OCO2	ZINC000178048910	402455490	/nfs/dbraw/zinc/45/54/90/402455490.db2.gz	DQUGODDFLRARGW-LBPRGKRZSA-N	0	3	323.356	2.242	10	0		DEAEHN
CCO[C@@H]1C[C@@](N)(C(=O)N(C)Cc2ccc(F)cc2)C1(C)C	ZINC000186706542	402457512	/nfs/dbraw/zinc/45/75/12/402457512.db2.gz	YAGZTUKXVIVYJX-RHSMWYFYSA-N	0	3	308.397	2.317	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NC[C@@H](OC)c1ccccc1	ZINC000245430255	402459760	/nfs/dbraw/zinc/45/97/60/402459760.db2.gz	ZPKYARBVLAAQPS-IAGOWNOFSA-N	0	3	319.449	2.500	10	0		DEAEHN
C[C@@H](CC(=O)N1CCN2CCC[C@H]2C1)C(=O)c1cccc(F)c1	ZINC000245461219	402462606	/nfs/dbraw/zinc/46/26/06/402462606.db2.gz	MRQQRRAUCAXLJD-BBRMVZONSA-N	0	3	318.392	2.341	10	0		DEAEHN
CC(C)n1cnnc1[C@@H]1CCCN(C[C@@H](O)COC(C)(C)C)C1	ZINC000245541114	402469027	/nfs/dbraw/zinc/46/90/27/402469027.db2.gz	QECRSEDGJMACFK-HUUCEWRRSA-N	0	3	324.469	2.214	10	0		DEAEHN
O=C([C@@H]1CCCn2ccnc21)N1CCN(C2CCCCC2)CC1	ZINC000178195408	402470112	/nfs/dbraw/zinc/47/01/12/402470112.db2.gz	BQLZJWKGZAPXTG-MRXNPFEDSA-N	0	3	316.449	2.237	10	0		DEAEHN
Cc1cc(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc(=O)[nH]1	ZINC000245560029	402470853	/nfs/dbraw/zinc/47/08/53/402470853.db2.gz	IYWQTAGYMLRPBH-RDJZCZTQSA-N	0	3	311.385	2.271	10	0		DEAEHN
Cc1cc(CN2CCN3CCCC[C@H]3C2)ccc1-n1cncn1	ZINC000245553787	402471006	/nfs/dbraw/zinc/47/10/06/402471006.db2.gz	FYYULPLFZPYTBQ-KRWDZBQOSA-N	0	3	311.433	2.246	10	0		DEAEHN
CC(C)COC(=O)N1CCCN(C[C@](C)(O)C(C)C)CC1	ZINC000186915975	402471169	/nfs/dbraw/zinc/47/11/69/402471169.db2.gz	GJQYAPKIIYUHIA-INIZCTEOSA-N	0	3	300.443	2.194	10	0		DEAEHN
C[C@H](CNC(=O)N1CCCN(C2CC2)CC1)c1nccs1	ZINC000187011526	402477891	/nfs/dbraw/zinc/47/78/91/402477891.db2.gz	JTUGHOXMDNVTGX-GFCCVEGCSA-N	0	3	308.451	2.126	10	0		DEAEHN
CCCN(CCC)C(=O)CN1CCC[C@@H]1Cn1ccnc1C	ZINC000178293441	402481278	/nfs/dbraw/zinc/48/12/78/402481278.db2.gz	QPPOUEVLFHNFPO-MRXNPFEDSA-N	0	3	306.454	2.305	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CC(=O)NCc1cccs1	ZINC000178308989	402483496	/nfs/dbraw/zinc/48/34/96/402483496.db2.gz	PJHAPSWRKQNSAL-CQSZACIVSA-N	0	3	318.446	2.034	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N(C)CC1CCN(C)CC1	ZINC000187139880	402484409	/nfs/dbraw/zinc/48/44/09/402484409.db2.gz	XKLNLHLIQMRJIW-ZDUSSCGKSA-N	0	3	320.437	2.134	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@@H](C)C(=O)N1CCCCC1	ZINC000178320682	402484561	/nfs/dbraw/zinc/48/45/61/402484561.db2.gz	JZPPVHBJRQMEBI-HOCLYGCPSA-N	0	3	304.438	2.057	10	0		DEAEHN
CCOCCN1CCN(Cc2ccc3c[nH]nc3c2)C[C@H]1C	ZINC000245789392	402488568	/nfs/dbraw/zinc/48/85/68/402488568.db2.gz	VWHYTZBWEFYAMM-CQSZACIVSA-N	0	3	302.422	2.106	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cnc([C@@H]2CCCO2)s1	ZINC000245846874	402491317	/nfs/dbraw/zinc/49/13/17/402491317.db2.gz	IOJUZRLZEBCQJS-AGIUHOORSA-N	0	3	321.446	2.303	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCCCc1ccccn1	ZINC000178408844	402495401	/nfs/dbraw/zinc/49/54/01/402495401.db2.gz	GSJBKEBSFLNUFJ-SJORKVTESA-N	0	3	316.449	2.282	10	0		DEAEHN
c1ccc2nc(CN3CCN(C[C@H]4CCOC4)CC3)ccc2c1	ZINC000178472887	402502102	/nfs/dbraw/zinc/50/21/02/402502102.db2.gz	MTFNRIDXADPBFU-MRXNPFEDSA-N	0	3	311.429	2.389	10	0		DEAEHN
COc1cc(CN2CCN(C[C@H](C)O)[C@@H](C)C2)ccc1SC	ZINC000246009208	402503020	/nfs/dbraw/zinc/50/30/20/402503020.db2.gz	HMFPXKGVXLWYNX-KBPBESRZSA-N	0	3	324.490	2.304	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@H](C)C(=O)N1CCCCC1	ZINC000246986773	402552450	/nfs/dbraw/zinc/55/24/50/402552450.db2.gz	JZPPVHBJRQMEBI-ZBFHGGJFSA-N	0	3	304.438	2.057	10	0		DEAEHN
Cc1cc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)nn1-c1ccccc1	ZINC000247026357	402554286	/nfs/dbraw/zinc/55/42/86/402554286.db2.gz	GFKBTVVWXFKVNK-WBVHZDCISA-N	0	3	324.428	2.489	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2ccc3c(c2)CCCN3C)C1	ZINC000171082155	402555872	/nfs/dbraw/zinc/55/58/72/402555872.db2.gz	FTBJZHMWIYNRAD-OAHLLOKOSA-N	0	3	302.422	2.237	10	0		DEAEHN
Cc1nc(-c2cccc(NC(=O)N3CC[C@H](N(C)C)C3)c2)no1	ZINC000171082069	402555914	/nfs/dbraw/zinc/55/59/14/402555914.db2.gz	HFYNPVXMBHNRDV-AWEZNQCLSA-N	0	3	315.377	2.213	10	0		DEAEHN
COCCN(C)CCNC(=O)COc1ccc(C(C)(C)C)cc1	ZINC000171129665	402560276	/nfs/dbraw/zinc/56/02/76/402560276.db2.gz	FOSZABHKTNLUTQ-UHFFFAOYSA-N	0	3	322.449	2.057	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c(C)c1	ZINC000247335714	402564194	/nfs/dbraw/zinc/56/41/94/402564194.db2.gz	HGOBDIVBQLSJAF-HZPDHXFCSA-N	0	3	322.474	2.408	10	0		DEAEHN
OC[C@H](NCCOCC(F)F)c1cccc(Br)c1	ZINC000189882196	402564409	/nfs/dbraw/zinc/56/44/09/402564409.db2.gz	UDONVBIDIVHYKK-NSHDSACASA-N	0	3	324.165	2.354	10	0		DEAEHN
CCCS(=O)(=O)CCN[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000189909553	402566231	/nfs/dbraw/zinc/56/62/31/402566231.db2.gz	JGIWVLVCDQSXJA-AWEZNQCLSA-N	0	3	321.446	2.348	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)[C@H]1CCC[C@H](C)C1	ZINC000247480867	402569018	/nfs/dbraw/zinc/56/90/18/402569018.db2.gz	JKSRDJIFHCOFRR-HRCADAONSA-N	0	3	311.470	2.317	10	0		DEAEHN
CCOc1ccc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1OC	ZINC000247521617	402570712	/nfs/dbraw/zinc/57/07/12/402570712.db2.gz	WTOQTMDRQQRDIB-UKRRQHHQSA-N	0	3	318.417	2.403	10	0		DEAEHN
C[C@@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N1CCCN(C2CC2)CC1	ZINC000246195267	402517568	/nfs/dbraw/zinc/51/75/68/402517568.db2.gz	LKFABFQJNBZNID-XHSDSOJGSA-N	0	3	307.482	2.335	10	0		DEAEHN
Cc1ccc([C@H](C)NC(=O)CN2CCN3CCC[C@@H]3C2)cc1C	ZINC000178631307	402519467	/nfs/dbraw/zinc/51/94/67/402519467.db2.gz	RQECHNGINRRBQG-FUHWJXTLSA-N	0	3	315.461	2.261	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@H]2CCOc3ccccc32)C1	ZINC000246255471	402521031	/nfs/dbraw/zinc/52/10/31/402521031.db2.gz	MOBDYGSZNUYEGJ-HUUCEWRRSA-N	0	3	317.433	2.336	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H](C)CCc2cccn2C)C1	ZINC000246389082	402528532	/nfs/dbraw/zinc/52/85/32/402528532.db2.gz	QYRGXKCITCBTKR-HUUCEWRRSA-N	0	3	306.454	2.130	10	0		DEAEHN
CCCOCc1ccccc1CNC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170831394	402530376	/nfs/dbraw/zinc/53/03/76/402530376.db2.gz	DXMLOAZUXIQHME-QGZVFWFLSA-N	0	3	319.449	2.459	10	0		DEAEHN
Cc1nnc(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)n1C1CC1	ZINC000246426258	402530571	/nfs/dbraw/zinc/53/05/71/402530571.db2.gz	CJGVWAAIYGSJNS-YOEHRIQHSA-N	0	3	315.465	2.370	10	0		DEAEHN
Cc1cccc(C)c1OC[C@H](C)NC(=O)N1CC[C@H](N(C)C)C1	ZINC000170833981	402530878	/nfs/dbraw/zinc/53/08/78/402530878.db2.gz	FEQOYQBLXVONTP-HOTGVXAUSA-N	0	3	319.449	2.416	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cccc(OC[C@H]3CCCO3)c2)C1	ZINC000170856258	402533406	/nfs/dbraw/zinc/53/34/06/402533406.db2.gz	VFQJGQYLPHSPJA-NVXWUHKLSA-N	0	3	318.417	2.021	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)CSc2nc3ccccc3o2)C1	ZINC000170861180	402534302	/nfs/dbraw/zinc/53/43/02/402534302.db2.gz	XAMZDPAXEWKCNB-NSHDSACASA-N	0	3	305.403	2.082	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cc(Br)cs2)C1	ZINC000170864439	402535310	/nfs/dbraw/zinc/53/53/10/402535310.db2.gz	AZZWFMBVTSEXHE-VIFPVBQESA-N	0	3	303.225	2.287	10	0		DEAEHN
CN(C[C@@H]1CCCO1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000179263213	402583176	/nfs/dbraw/zinc/58/31/76/402583176.db2.gz	GRCOVSNOMGJPPH-ULQDDVLXSA-N	0	3	317.433	2.252	10	0		DEAEHN
C[C@@H]1CN([C@@H](CNCc2cncn2C)c2cccs2)CCO1	ZINC000171627216	402603148	/nfs/dbraw/zinc/60/31/48/402603148.db2.gz	NCNBYLRPKSEKDC-HIFRSBDPSA-N	0	3	320.462	2.033	10	0		DEAEHN
Cc1c(NC(=O)N2CCN3CCC[C@H]3C2)cccc1N(C)C	ZINC000180119681	402607658	/nfs/dbraw/zinc/60/76/58/402607658.db2.gz	WPAUISQUFNNRTL-AWEZNQCLSA-N	0	3	302.422	2.373	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1n[nH]c2c1CCCCC2	ZINC000248909904	402614046	/nfs/dbraw/zinc/61/40/46/402614046.db2.gz	MRHCOFMXFHWCSV-KGLIPLIRSA-N	0	3	316.449	2.377	10	0		DEAEHN
COc1ccccc1NC(=O)C[C@H](C)NCC1(C)OCCCO1	ZINC000190652901	402616542	/nfs/dbraw/zinc/61/65/42/402616542.db2.gz	XEGBMNSJQACNHO-ZDUSSCGKSA-N	0	3	322.405	2.155	10	0		DEAEHN
CC(C)[C@H](C)CNC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000180461526	402617602	/nfs/dbraw/zinc/61/76/02/402617602.db2.gz	VSMHVUJYNJZFGL-SJORKVTESA-N	0	3	324.513	2.090	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)N[C@@H]2CCOc3ccccc32)C1	ZINC000171746454	402617858	/nfs/dbraw/zinc/61/78/58/402617858.db2.gz	IBZHAVNRLXILJU-DZGCQCFKSA-N	0	3	303.406	2.151	10	0		DEAEHN
CCc1nc2n(n1)C[C@H](N[C@@H]1CCc3ccc(OC)cc31)CC2	ZINC000180608573	402621216	/nfs/dbraw/zinc/62/12/16/402621216.db2.gz	RKWABSFRQIWGNJ-CZUORRHYSA-N	0	3	312.417	2.441	10	0		DEAEHN
CC(C)Oc1cccc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)n1	ZINC000179168849	402577683	/nfs/dbraw/zinc/57/76/83/402577683.db2.gz	VVFQTULOPBQTMC-HIFRSBDPSA-N	0	3	305.422	2.327	10	0		DEAEHN
Cc1cccc(C)c1OCCCN1CCN(CCO)[C@@H](C)C1	ZINC000249586881	402635513	/nfs/dbraw/zinc/63/55/13/402635513.db2.gz	UCZZNPCVPASRBG-KRWDZBQOSA-N	0	3	306.450	2.071	10	0		DEAEHN
C[C@@H](NC(=O)CN(C)[C@]1(CO)CC[C@@H](C)C1)c1cccs1	ZINC000249598262	402636313	/nfs/dbraw/zinc/63/63/13/402636313.db2.gz	XKCMVZJFLXMTRZ-XJKCOSOUSA-N	0	3	310.463	2.408	10	0		DEAEHN
Cc1nc(C[C@@H]2CCCN(C[C@@H](O)c3ccccc3)C2)no1	ZINC000249873940	402642935	/nfs/dbraw/zinc/64/29/35/402642935.db2.gz	LBBZJJGHHZJKPL-GOEBONIOSA-N	0	3	301.390	2.366	10	0		DEAEHN
Cc1cnn(CCNC(=O)Nc2cccc(CN(C)C)c2)c1	ZINC000172217003	402645710	/nfs/dbraw/zinc/64/57/10/402645710.db2.gz	ZNIYNCUXACURLC-UHFFFAOYSA-N	0	3	301.394	2.075	10	0		DEAEHN
CN(Cc1cnn(C)c1)C(=O)CN1CCC[C@]2(CC=CCC2)C1	ZINC000172282425	402647830	/nfs/dbraw/zinc/64/78/30/402647830.db2.gz	JXGIXBBLFGPOPP-GOSISDBHSA-N	0	3	316.449	2.201	10	0		DEAEHN
CC(C)N(C)c1ccc(CN2C[C@H](C(N)=O)CC[C@@H]2C)cn1	ZINC000191239376	402653659	/nfs/dbraw/zinc/65/36/59/402653659.db2.gz	LZLWRYURHVCVGS-DZGCQCFKSA-N	0	3	304.438	2.012	10	0		DEAEHN
COC(=O)CNC(=O)CCN[C@@H](C)c1ccc(C(C)(C)C)cc1	ZINC000182609076	402703852	/nfs/dbraw/zinc/70/38/52/402703852.db2.gz	KIXQFDZEQRUORT-ZDUSSCGKSA-N	0	3	320.433	2.314	10	0		DEAEHN
Cc1csc([C@@H]2CCCN(CCCN3CCOCC3)C2)n1	ZINC000173649907	402707032	/nfs/dbraw/zinc/70/70/32/402707032.db2.gz	DELQZRBZQSYOJH-OAHLLOKOSA-N	0	3	309.479	2.353	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1OCCNC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000173903797	402718304	/nfs/dbraw/zinc/71/83/04/402718304.db2.gz	JONUNPZVCDKNJE-IKGGRYGDSA-N	0	3	321.465	2.237	10	0		DEAEHN
C[C@H]1CCCC[C@@H]1N(C)C(=O)CN1CCCN(C2CC2)CC1	ZINC000172543399	402661805	/nfs/dbraw/zinc/66/18/05/402661805.db2.gz	UHRRTYZCCFNMHM-RDJZCZTQSA-N	0	3	307.482	2.194	10	0		DEAEHN
C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc2ccccc2[nH]c1=O	ZINC000253544386	402668238	/nfs/dbraw/zinc/66/82/38/402668238.db2.gz	NJFTZWMCYUVHNP-BLLLJJGKSA-N	0	3	313.401	2.353	10	0		DEAEHN
C[C@@H]1C[C@@H](NCC2(C)OCCCO2)CN1Cc1ccccc1	ZINC000192248594	402719260	/nfs/dbraw/zinc/71/92/60/402719260.db2.gz	WHJMHXQRLZMGNJ-NVXWUHKLSA-N	0	3	304.434	2.392	10	0		DEAEHN
COCCN1CCN(CCCc2ccccc2OC)C[C@@H]1C	ZINC000182441284	402690076	/nfs/dbraw/zinc/69/00/76/402690076.db2.gz	UIZLGBGYYSDUBL-INIZCTEOSA-N	0	3	306.450	2.280	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)Cc2ccccc2C)[C@H](C)C1	ZINC000173262455	402690367	/nfs/dbraw/zinc/69/03/67/402690367.db2.gz	JLANVHAWVSCBMP-NVXWUHKLSA-N	0	3	324.490	2.487	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)s1	ZINC000173391222	402695704	/nfs/dbraw/zinc/69/57/04/402695704.db2.gz	AGQBTZVDMPOESY-OLZOCXBDSA-N	0	3	324.494	2.372	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1n[nH]c2c1CCCCC2	ZINC000191928375	402698836	/nfs/dbraw/zinc/69/88/36/402698836.db2.gz	MRHCOFMXFHWCSV-UONOGXRCSA-N	0	3	316.449	2.377	10	0		DEAEHN
COCc1csc(NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)n1	ZINC000174376729	402738441	/nfs/dbraw/zinc/73/84/41/402738441.db2.gz	WWFUYWSDXYCRKJ-PWSUYJOCSA-N	0	3	312.439	2.236	10	0		DEAEHN
COCc1csc(NC(=O)NC2CCN(C3CC3)CC2)n1	ZINC000174402723	402739693	/nfs/dbraw/zinc/73/96/93/402739693.db2.gz	MCBXWQHJMRLRRE-UHFFFAOYSA-N	0	3	310.423	2.038	10	0		DEAEHN
C[C@@H](NCC(=O)N(Cc1ccccc1)C1CC1)[C@@H]1CCCO1	ZINC000183174747	402744534	/nfs/dbraw/zinc/74/45/34/402744534.db2.gz	IUTBZZXTCBNGIT-PBHICJAKSA-N	0	3	302.418	2.335	10	0		DEAEHN
C[C@H](NCC(=O)NCC1CCC1)c1ccccc1-n1cccn1	ZINC000183173718	402744703	/nfs/dbraw/zinc/74/47/03/402744703.db2.gz	LLTWHHAKNLZDMZ-AWEZNQCLSA-N	0	3	312.417	2.439	10	0		DEAEHN
O=C(NCc1ccn(C2CCCC2)n1)C1CCN(C2CC2)CC1	ZINC000192755187	402748232	/nfs/dbraw/zinc/74/82/32/402748232.db2.gz	DYOFHCGYPWLFAQ-UHFFFAOYSA-N	0	3	316.449	2.489	10	0		DEAEHN
Cc1cc(-c2nc([C@H]3CNCCN3C)no2)c(C)n1C1CC1	ZINC000263236965	402748842	/nfs/dbraw/zinc/74/88/42/402748842.db2.gz	OEIOFAFHWMRNOX-CQSZACIVSA-N	0	3	301.394	2.066	10	0		DEAEHN
Cc1cc(C)cc(C2(c3nc([C@@H]4CNCCN4C)no3)CC2)c1	ZINC000263317363	402757983	/nfs/dbraw/zinc/75/79/83/402757983.db2.gz	ZSBAZCBOUBLMQQ-HNNXBMFYSA-N	0	3	312.417	2.342	10	0		DEAEHN
CCc1ccc([C@H](CN2CCOCC2)N[C@@H]2CCCOC2)cc1	ZINC000183563489	402776299	/nfs/dbraw/zinc/77/62/99/402776299.db2.gz	XNIFQARHTAVSFC-MOPGFXCFSA-N	0	3	318.461	2.391	10	0		DEAEHN
CC(C)N(C)C(=O)[C@H](C)N1CC[C@H](CNc2ccccn2)C1	ZINC000175252472	402791424	/nfs/dbraw/zinc/79/14/24/402791424.db2.gz	XLVVJOXSZNCLJO-LSDHHAIUSA-N	0	3	304.438	2.071	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN([C@@H]3CCN(C(C)C)C3=O)C2)n1	ZINC000175252501	402791541	/nfs/dbraw/zinc/79/15/41/402791541.db2.gz	DJTYJQNZLRTCEI-JKSUJKDBSA-N	0	3	316.449	2.133	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc(-n3cccn3)cc2)C1	ZINC000194331650	402792769	/nfs/dbraw/zinc/79/27/69/402792769.db2.gz	RSKLQAFKRMFUMU-HNNXBMFYSA-N	0	3	313.405	2.478	10	0		DEAEHN
O=C(c1cc(F)cc2[nH]c(=S)[nH]c21)N1CCN2CCC[C@@H]2C1	ZINC000195336095	402842125	/nfs/dbraw/zinc/84/21/25/402842125.db2.gz	ZWCSOHGTRYUKRI-SNVBAGLBSA-N	0	3	320.393	2.285	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)NCc1ccc(C)c(F)c1	ZINC000175333447	402798002	/nfs/dbraw/zinc/79/80/02/402798002.db2.gz	FHPJDXZREQAMLX-MRXNPFEDSA-N	0	3	321.440	2.166	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)NCCc1ccccc1C	ZINC000175350431	402799042	/nfs/dbraw/zinc/79/90/42/402799042.db2.gz	XKZQFUWTYCBUCC-SFHVURJKSA-N	0	3	317.477	2.070	10	0		DEAEHN
CC(C)OCCN[C@H](CO)c1cccc(Br)c1	ZINC000183878319	402803022	/nfs/dbraw/zinc/80/30/22/402803022.db2.gz	MBIOAGRREYDXRQ-CYBMUJFWSA-N	0	3	302.212	2.497	10	0		DEAEHN
CC1(C)CCC(NC(=O)NC[C@@H](O)CN2CCCCC2)CC1	ZINC000175446801	402807194	/nfs/dbraw/zinc/80/71/94/402807194.db2.gz	OPHAKQVOLHXXIB-OAHLLOKOSA-N	0	3	311.470	2.101	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cc(C2CC2)n(C(C)(C)C)n1	ZINC000194696172	402811303	/nfs/dbraw/zinc/81/13/03/402811303.db2.gz	BBVGYJWTMNADHS-ZDUSSCGKSA-N	0	3	304.438	2.340	10	0		DEAEHN
COc1cccc([C@H](C)N2CCC(N3CCNC3=O)CC2)c1	ZINC000175587266	402819604	/nfs/dbraw/zinc/81/96/04/402819604.db2.gz	BKLVZWUMGSNJAS-ZDUSSCGKSA-N	0	3	303.406	2.246	10	0		DEAEHN
COc1ccc(C)nc1NC(=O)N1CCC[C@@H]1CN1CCCC1	ZINC000184252943	402830693	/nfs/dbraw/zinc/83/06/93/402830693.db2.gz	YTXIICNGZVUYBE-CQSZACIVSA-N	0	3	318.421	2.491	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NC[C@H](CO)c1ccccc1	ZINC000175865470	402839218	/nfs/dbraw/zinc/83/92/18/402839218.db2.gz	DMSRKDHDCPPPRO-IAGOWNOFSA-N	0	3	321.465	2.038	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)CC[N@@H+]1C	ZINC000175191540	402786584	/nfs/dbraw/zinc/78/65/84/402786584.db2.gz	YSWATNWQTYDCEG-DGCLKSJQSA-N	0	3	309.385	2.155	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)CC[N@H+]1C	ZINC000175191540	402786586	/nfs/dbraw/zinc/78/65/86/402786586.db2.gz	YSWATNWQTYDCEG-DGCLKSJQSA-N	0	3	309.385	2.155	10	0		DEAEHN
CC[C@H](CNC(=O)N1CC[C@H](N(C)C)C1)Oc1ccccc1F	ZINC000175956996	402844984	/nfs/dbraw/zinc/84/49/84/402844984.db2.gz	AUTWEHLJCQEPFX-UONOGXRCSA-N	0	3	323.412	2.329	10	0		DEAEHN
CCCC[C@H](CCC)NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000175988707	402846305	/nfs/dbraw/zinc/84/63/05/402846305.db2.gz	YVGBOFGHORFNBC-JKSUJKDBSA-N	0	3	313.486	2.491	10	0		DEAEHN
Cc1ccc(CNC(=O)CN2CCC(c3ccn[nH]3)CC2)cc1	ZINC000195506651	402848156	/nfs/dbraw/zinc/84/81/56/402848156.db2.gz	QQUOVSCFBNRLCO-UHFFFAOYSA-N	0	3	312.417	2.214	10	0		DEAEHN
O=C(CN1CCC(c2ccn[nH]2)CC1)NCc1ccc(F)cc1	ZINC000195506769	402848275	/nfs/dbraw/zinc/84/82/75/402848275.db2.gz	YWRQBYZVCSEKTR-UHFFFAOYSA-N	0	3	316.380	2.045	10	0		DEAEHN
CC(=O)N(C[C@H]1CCCN1C[C@H](O)c1ccc(F)cc1)C1CC1	ZINC000276339542	403165678	/nfs/dbraw/zinc/16/56/78/403165678.db2.gz	HBVVFFODJDKDDQ-MSOLQXFVSA-N	0	3	320.408	2.334	10	0		DEAEHN
CC(=O)CCc1ccc(OC[C@H](O)CN2C[C@@H](C)[C@@H]2C)cc1	ZINC000293532190	403497048	/nfs/dbraw/zinc/49/70/48/403497048.db2.gz	XEIWVAPEKSOPSX-UKPHBRMFSA-N	0	3	305.418	2.288	10	0		DEAEHN
CCn1ccnc1[C@H](NCC1CCOCC1)C1CCOCC1	ZINC000343404329	403573743	/nfs/dbraw/zinc/57/37/43/403573743.db2.gz	RGTBTUZRIZRYFM-MRXNPFEDSA-N	0	3	307.438	2.387	10	0		DEAEHN
CCO[C@@H]1CCCC[C@H]1NCC(=O)N1CCO[C@@H]2CCCC[C@H]21	ZINC000333065855	403658581	/nfs/dbraw/zinc/65/85/81/403658581.db2.gz	JCIWRDIOKJJSNQ-QBPKDAKJSA-N	0	3	324.465	2.094	10	0		DEAEHN
COc1nc(C)nc(NCCCCN2C[C@H](C)O[C@@H](C)C2)c1C	ZINC000301862618	403691674	/nfs/dbraw/zinc/69/16/74/403691674.db2.gz	CPYIRRXCVRTPIG-STQMWFEESA-N	0	3	322.453	2.403	10	0		DEAEHN
Cc1ccc2ncnc(N[C@H](CO)CN3CCCCC3)c2c1	ZINC000289185974	403865745	/nfs/dbraw/zinc/86/57/45/403865745.db2.gz	SLNUFZUBEGBENU-AWEZNQCLSA-N	0	3	300.406	2.197	10	0		DEAEHN
Cc1cc(-n2ccnc2)ccc1CN1CCSC[C@H]1CCO	ZINC000361829851	403891718	/nfs/dbraw/zinc/89/17/18/403891718.db2.gz	IVTMKEDLEGTDIG-QGZVFWFLSA-N	0	3	317.458	2.481	10	0		DEAEHN
COc1ccccc1[C@H]1[C@@H](N)CCCN1C(=O)[C@@H]1CCCOC1	ZINC000333964427	403907893	/nfs/dbraw/zinc/90/78/93/403907893.db2.gz	PAFXPDKTADDTPJ-KMFMINBZSA-N	0	3	318.417	2.113	10	0		DEAEHN
COCCOC[C@@H](O)CN(C)[C@H](C)c1ccc(Cl)cc1	ZINC000296462105	404261345	/nfs/dbraw/zinc/26/13/45/404261345.db2.gz	JJLRXMUMAJFMTL-DOMZBBRYSA-N	0	3	301.814	2.357	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@@H]1CCCc2cn[nH]c21	ZINC000291782802	404517787	/nfs/dbraw/zinc/51/77/87/404517787.db2.gz	VCSCLMTYYBPMQP-MRXNPFEDSA-N	0	3	308.389	2.217	10	0		DEAEHN
Brc1ccc(CN[C@@H]2CCO[C@]3(CCOC3)C2)o1	ZINC000365154440	404563776	/nfs/dbraw/zinc/56/37/76/404563776.db2.gz	GLXUEYHRFAYHPD-ZWNOBZJWSA-N	0	3	316.195	2.470	10	0		DEAEHN
c1c(CN[C@@H]2CCCN(Cc3ccccc3)C2)nc2ncccn12	ZINC000297822796	404633744	/nfs/dbraw/zinc/63/37/44/404633744.db2.gz	ZBTIJOLQVQUCKF-QGZVFWFLSA-N	0	3	321.428	2.484	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)N(C)CCCO)CCN1Cc1ccccc1	ZINC000367009402	404896612	/nfs/dbraw/zinc/89/66/12/404896612.db2.gz	GMKOPSNTZTWFGZ-DOTOQJQBSA-N	0	3	319.449	2.063	10	0		DEAEHN
Cc1cc(C)n(-c2ccc(CN3CCC[C@H]4C(=O)NC[C@H]43)cc2)n1	ZINC000366870124	404861308	/nfs/dbraw/zinc/86/13/08/404861308.db2.gz	RDCMQQFYEZIYHD-QZTJIDSGSA-N	0	3	324.428	2.200	10	0		DEAEHN
NC(=O)CC[C@@H]1CCCN(Cc2ccc(-c3cc[nH]n3)o2)C1	ZINC000435136166	404959597	/nfs/dbraw/zinc/95/95/97/404959597.db2.gz	YZMRCABZXAYFQI-LBPRGKRZSA-N	0	3	302.378	2.147	10	0		DEAEHN
c1cc(-c2ccc(CN3CCC(O[C@@H]4CCOC4)CC3)o2)n[nH]1	ZINC000435135563	404959706	/nfs/dbraw/zinc/95/97/06/404959706.db2.gz	ROWHPEMQRJOKHS-OAHLLOKOSA-N	0	3	317.389	2.440	10	0		DEAEHN
C/C(=C\c1ccccc1)CN[C@@H]1CCN(C2CCOCC2)C1=O	ZINC000367058865	404913803	/nfs/dbraw/zinc/91/38/03/404913803.db2.gz	YOHNBQSGYCJZHL-FDPSAONLSA-N	0	3	314.429	2.459	10	0		DEAEHN
CCN1CC[C@H](NC(=O)c2ccc(F)c(Br)c2)C1	ZINC000389952818	405043408	/nfs/dbraw/zinc/04/34/08/405043408.db2.gz	DRWFSLYGKMFLNM-JTQLQIEISA-N	0	3	315.186	2.412	10	0		DEAEHN
CCN1CC[C@H](NC(=O)c2cc(F)ccc2Br)C1	ZINC000389975136	405043673	/nfs/dbraw/zinc/04/36/73/405043673.db2.gz	IQELDQOCGUMZIC-JTQLQIEISA-N	0	3	315.186	2.412	10	0		DEAEHN
C[C@H]1CCOCCN1C[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000367460166	405056616	/nfs/dbraw/zinc/05/66/16/405056616.db2.gz	YYGYOZSLWUJJDX-PKOBYXMFSA-N	0	3	318.461	2.388	10	0		DEAEHN
Fc1ccc(OCCN2CCC(O[C@H]3CCOC3)CC2)cc1	ZINC000361438443	405075825	/nfs/dbraw/zinc/07/58/25/405075825.db2.gz	ZGDPTUUXBCRQGN-KRWDZBQOSA-N	0	3	309.381	2.474	10	0		DEAEHN
Cc1ccn2ncc(C(=O)Nc3ccccc3CCN(C)C)c2n1	ZINC000354182572	405084793	/nfs/dbraw/zinc/08/47/93/405084793.db2.gz	RLOURJZPRDHFOD-UHFFFAOYSA-N	0	3	323.400	2.394	10	0		DEAEHN
C/C=C\C[C@H](NC(=O)[C@@H](C)N1CCCCCC1)C(=O)OCC	ZINC000361548610	405127047	/nfs/dbraw/zinc/12/70/47/405127047.db2.gz	GWLWBSWVRWQDEU-VASHYATMSA-N	0	3	310.438	2.265	10	0		DEAEHN
C[C@H]1CN2CCCC[C@H]2CN1Cc1nc(-c2ccoc2)no1	ZINC000408183447	405132533	/nfs/dbraw/zinc/13/25/33/405132533.db2.gz	RTOAQGGBSXEMEB-JSGCOSHPSA-N	0	3	302.378	2.388	10	0		DEAEHN
C[C@@H](NC[C@@H]1[C@H]2COC[C@H]21)c1ncc(Br)s1	ZINC000367683097	405124403	/nfs/dbraw/zinc/12/44/03/405124403.db2.gz	CGTSFSPCJHKZND-BGZDPUMWSA-N	0	3	303.225	2.449	10	0		DEAEHN
Cn1nnc2cc(CN3CC[C@@H](C(C)(C)C)[C@@H](O)C3)ccc21	ZINC000408198539	405136924	/nfs/dbraw/zinc/13/69/24/405136924.db2.gz	NHMZWAPSHPLXHM-CJNGLKHVSA-N	0	3	302.422	2.197	10	0		DEAEHN
c1cnn([C@@H]2CCN(CCOCCOc3ccccc3)C2)c1	ZINC000361590814	405149377	/nfs/dbraw/zinc/14/93/77/405149377.db2.gz	KLZYCWKOWQKMSK-MRXNPFEDSA-N	0	3	301.390	2.226	10	0		DEAEHN
Cc1ccc(-c2cc(C(=O)N3CCN(C)C[C@@H]3C)n[nH]2)c(C)c1	ZINC000408368553	405187835	/nfs/dbraw/zinc/18/78/35/405187835.db2.gz	JXDYEUACCRWNOM-AWEZNQCLSA-N	0	3	312.417	2.470	10	0		DEAEHN
Cc1cc(C[C@H](C)NC(=O)NCCN2CCCC(C)(C)C2)[nH]n1	ZINC000445222169	405349347	/nfs/dbraw/zinc/34/93/47/405349347.db2.gz	KATOIMZWVQRILJ-ZDUSSCGKSA-N	0	3	321.469	2.070	10	0		DEAEHN
COc1nsc(CNCC[C@H](C)OC)c1Br	ZINC000638486029	405501647	/nfs/dbraw/zinc/50/16/47/405501647.db2.gz	OGSALSZVYNZHIF-ZETCQYMHSA-N	0	3	309.229	2.429	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2cccc3ccoc32)CC12COC2	ZINC000449363850	405525198	/nfs/dbraw/zinc/52/51/98/405525198.db2.gz	MMLLTDYLAGKVBO-OAHLLOKOSA-N	0	3	315.369	2.444	10	0		DEAEHN
COC(=O)C(C)(C)N1CCN(CCCc2ccccc2C)CC1	ZINC000494452211	405701006	/nfs/dbraw/zinc/70/10/06/405701006.db2.gz	NQNRQNRBNGMOEV-UHFFFAOYSA-N	0	3	318.461	2.497	10	0		DEAEHN
c1ccc([C@@H](NCCN2C[C@H]3CC[C@@H](C2)O3)C2CCC2)nc1	ZINC000528658553	405701136	/nfs/dbraw/zinc/70/11/36/405701136.db2.gz	NFZDLPCCEHWHNY-JZXOWHBKSA-N	0	3	301.434	2.376	10	0		DEAEHN
O=S(=O)([N-]CC[NH2+][C@H]1CC[C@@H]1C1CCC1)c1cccs1	ZINC000558696779	405692364	/nfs/dbraw/zinc/69/23/64/405692364.db2.gz	CKJVKPYEFOYHHC-OLZOCXBDSA-N	0	3	314.476	2.195	10	0		DEAEHN
CC(=O)c1cc(C(=O)N[C@H]2C[C@H](N(C)C)C2(C)C)c(C)nc1C	ZINC000636103078	405742707	/nfs/dbraw/zinc/74/27/07/405742707.db2.gz	ZDRKJSJCIKFCHG-HOTGVXAUSA-N	0	3	317.433	2.360	10	0		DEAEHN
COc1nsc(CNCC[C@H]2CCOC2)c1Br	ZINC000639038388	405836233	/nfs/dbraw/zinc/83/62/33/405836233.db2.gz	RXBAGIRDXBXZQB-QMMMGPOBSA-N	0	3	321.240	2.430	10	0		DEAEHN
CN(C)C[C@@](C)(O)CNC(=O)C1=C(c2ccccc2)CCCC1	ZINC000450338875	405843389	/nfs/dbraw/zinc/84/33/89/405843389.db2.gz	ZGXNBSRKZGZLGD-IBGZPJMESA-N	0	3	316.445	2.443	10	0		DEAEHN
COc1nsc(CN[C@@H]2CCOC[C@@H]2C)c1Br	ZINC000639121200	405898341	/nfs/dbraw/zinc/89/83/41/405898341.db2.gz	NFSPATDFIZBBLV-JGVFFNPUSA-N	0	3	321.240	2.429	10	0		DEAEHN
COC(=O)[C@H](O)C1CCN(Cc2ccc(C3CC3)cc2)CC1	ZINC000459355414	405869826	/nfs/dbraw/zinc/86/98/26/405869826.db2.gz	MSWUBHFNIHQYQA-QGZVFWFLSA-N	0	3	303.402	2.310	10	0		DEAEHN
c1ccc(-n2nnc(CN3CCN4CCC3CC4)c2C2CC2)cc1	ZINC000639171401	405943769	/nfs/dbraw/zinc/94/37/69/405943769.db2.gz	BVYLBKRILJFVOD-UHFFFAOYSA-N	0	3	323.444	2.425	10	0		DEAEHN
COc1cccc2c1CCN(CCOC[C@H]1CCCO1)CC2	ZINC000562333955	405987735	/nfs/dbraw/zinc/98/77/35/405987735.db2.gz	FJYCXLHHSYJZFH-MRXNPFEDSA-N	0	3	305.418	2.291	10	0		DEAEHN
CC(C)OC[C@H](O)CN1CCC[C@@H](CC(=O)OC(C)(C)C)C1	ZINC000532124859	406048034	/nfs/dbraw/zinc/04/80/34/406048034.db2.gz	JERDMMJYYAVQTB-LSDHHAIUSA-N	0	3	315.454	2.216	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)Nc2cccc3c2OCCC3)C1	ZINC000532133479	406049666	/nfs/dbraw/zinc/04/96/66/406049666.db2.gz	WNBNAGXKMSZLDH-CYBMUJFWSA-N	0	3	303.406	2.475	10	0		DEAEHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)NCCOCC1CCC1	ZINC000516950338	406115202	/nfs/dbraw/zinc/11/52/02/406115202.db2.gz	GHVCUHUVHBEBEG-HNNXBMFYSA-N	0	3	311.470	2.223	10	0		DEAEHN
CCN(C)C(=O)CCN1CCC[C@H](CC(=O)OC(C)(C)C)C1	ZINC000533207973	406129642	/nfs/dbraw/zinc/12/96/42/406129642.db2.gz	ZVRAWRVSCKWAKJ-CQSZACIVSA-N	0	3	312.454	2.299	10	0		DEAEHN
CN(Cc1ccccc1)[C@@H](CNC(=O)c1ncccc1N)C1CC1	ZINC000632555577	406180183	/nfs/dbraw/zinc/18/01/83/406180183.db2.gz	LJGMAPZNHZAUBW-KRWDZBQOSA-N	0	3	324.428	2.304	10	0		DEAEHN
CC(=O)c1cc(C(=O)N2CCC[C@@H]2CN(C)C)c(C)nc1C	ZINC000487162495	406209920	/nfs/dbraw/zinc/20/99/20/406209920.db2.gz	QYZYVWCBJOFCMG-CQSZACIVSA-N	0	3	303.406	2.067	10	0		DEAEHN
c1nc([C@@H]2CCCN(CCc3cnccn3)C2)n2c1CCCC2	ZINC000639626333	406175515	/nfs/dbraw/zinc/17/55/15/406175515.db2.gz	PACIGBCAFRIHMC-OAHLLOKOSA-N	0	3	311.433	2.432	10	0		DEAEHN
C[C@@H]1OCC[C@H]1N[C@H](CO)c1ccc(Br)cc1	ZINC000536831857	406278649	/nfs/dbraw/zinc/27/86/49/406278649.db2.gz	ISTOYRDBEQRAIS-ZWKOPEQDSA-N	0	3	300.196	2.250	10	0		DEAEHN
Cc1cccc(N(C)C(=O)[C@H](N)CN(C)Cc2ccccc2)c1	ZINC000637907364	406472226	/nfs/dbraw/zinc/47/22/26/406472226.db2.gz	NFPLMPOGOXXAGJ-GOSISDBHSA-N	0	3	311.429	2.417	10	0		DEAEHN
CC(C)CN(C(=O)[C@@H](N)CN(C)Cc1ccccc1)C1CC1	ZINC000637929315	406482164	/nfs/dbraw/zinc/48/21/64/406482164.db2.gz	LESNYHMJSHZSFY-KRWDZBQOSA-N	0	3	303.450	2.093	10	0		DEAEHN
CCCCN(C(=O)[C@@H](N)CN(C)Cc1ccccc1)C1CC1	ZINC000637938003	406486388	/nfs/dbraw/zinc/48/63/88/406486388.db2.gz	ZQMVJQQMTICXMX-KRWDZBQOSA-N	0	3	303.450	2.237	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCc1ccccc1NC(C)=O	ZINC000524648565	406452362	/nfs/dbraw/zinc/45/23/62/406452362.db2.gz	DBBFYZBGFDOBEJ-INIZCTEOSA-N	0	3	303.406	2.136	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637874243	406456596	/nfs/dbraw/zinc/45/65/96/406456596.db2.gz	GFALMFXGXDBFEH-DJIMGWMZSA-N	0	3	303.450	2.141	10	0		DEAEHN
CC(=O)N1CCCN(C[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000637881140	406460054	/nfs/dbraw/zinc/46/00/54/406460054.db2.gz	HMNDJHKNKDPYFG-KRWDZBQOSA-N	0	3	301.434	2.067	10	0		DEAEHN
CC[C@@H]1C[C@H](C)CN1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638006998	406520051	/nfs/dbraw/zinc/52/00/51/406520051.db2.gz	JYQDPKVVNOAYFV-UAGQMJEPSA-N	0	3	303.450	2.093	10	0		DEAEHN
OCCN1CCC[C@H](NCc2c(F)ccc(F)c2Cl)C1	ZINC000527655702	406705724	/nfs/dbraw/zinc/70/57/24/406705724.db2.gz	NPCGNCQJDYHYKX-JTQLQIEISA-N	0	3	304.768	2.165	10	0		DEAEHN
O=C(N[C@@H]1CCN(C2CC2)C1)N1CCC(C2CCOCC2)CC1	ZINC000554591001	406815121	/nfs/dbraw/zinc/81/51/21/406815121.db2.gz	FNRXWYHTAJRXHT-MRXNPFEDSA-N	0	3	321.465	2.071	10	0		DEAEHN
OCc1sc(N2CC[C@H](N3CCCCC3)C2)nc1Cl	ZINC000129121559	196020786	/nfs/dbraw/zinc/02/07/86/196020786.db2.gz	WGOIEAPILBJHBU-JTQLQIEISA-N	0	3	301.843	2.353	10	0		DEAEHN
Cc1cc(Br)cc2nc(C[C@H]3CNCCO3)[nH]c21	ZINC000129608383	196061407	/nfs/dbraw/zinc/06/14/07/196061407.db2.gz	PVTOMKHWMGORCG-JTQLQIEISA-N	0	3	310.195	2.165	10	0		DEAEHN
Cc1cc(Br)cc2[nH]c(C[C@H]3CNCCO3)nc21	ZINC000129608383	196061409	/nfs/dbraw/zinc/06/14/09/196061409.db2.gz	PVTOMKHWMGORCG-JTQLQIEISA-N	0	3	310.195	2.165	10	0		DEAEHN
C[C@H](NC(=O)C(C)(C)N1CCNCC1)c1cccc(Cl)c1	ZINC000129672072	196066511	/nfs/dbraw/zinc/06/65/11/196066511.db2.gz	CQILZKOALCRKST-LBPRGKRZSA-N	0	3	309.841	2.201	10	0		DEAEHN
COc1ccccc1[C@@H](O)CN[C@@H]1CCCc2c1cnn2C	ZINC000130602192	196093957	/nfs/dbraw/zinc/09/39/57/196093957.db2.gz	YZYREVJJBJGWAO-ZBFHGGJFSA-N	0	3	301.390	2.129	10	0		DEAEHN
COc1ccc([C@H](N)[C@H]2CCC[C@H](S(C)(=O)=O)C2)c(F)c1	ZINC000130978570	196129027	/nfs/dbraw/zinc/12/90/27/196129027.db2.gz	VXPUPYDUDNXVBS-ITDIGPHOSA-N	0	3	315.410	2.438	10	0		DEAEHN
CCN[C@H](CCCS(C)(=O)=O)c1ccc(OC)cc1OC	ZINC000131233800	196152172	/nfs/dbraw/zinc/15/21/72/196152172.db2.gz	VALKDHWNXMPWTH-CQSZACIVSA-N	0	3	315.435	2.179	10	0		DEAEHN
CC[C@H](C)[C@](C)(O)c1c(Br)cnn1CCN(C)C	ZINC000131446357	196170200	/nfs/dbraw/zinc/17/02/00/196170200.db2.gz	RELCFGLPXIVMTB-GWCFXTLKSA-N	0	3	318.259	2.461	10	0		DEAEHN
CNc1nc(N[C@@H](C)c2sc(C)nc2C)nc(N(C)C)n1	ZINC000131485735	196173388	/nfs/dbraw/zinc/17/33/88/196173388.db2.gz	RKTZHILWXQXPGS-QMMMGPOBSA-N	0	3	307.427	2.226	10	0		DEAEHN
CC(C)NCc1cc(S(=O)(=O)N2CC[C@@H](C)[C@@H](C)C2)c[nH]1	ZINC000131733654	196195301	/nfs/dbraw/zinc/19/53/01/196195301.db2.gz	IUSSPXXHIXZSOP-OLZOCXBDSA-N	0	3	313.467	2.179	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)N1CCC[C@@H]1Cc1cccc(F)c1	ZINC000132580758	196267129	/nfs/dbraw/zinc/26/71/29/196267129.db2.gz	WJQHRHRWXPNKGG-HZPDHXFCSA-N	0	3	322.449	2.454	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)N1CCC[C@H]1Cc1cccc(F)c1	ZINC000132580582	196267754	/nfs/dbraw/zinc/26/77/54/196267754.db2.gz	WJQHRHRWXPNKGG-CVEARBPZSA-N	0	3	322.449	2.454	10	0		DEAEHN
C[C@@H]1CNC[C@H](COCc2ccc(F)cc2Br)O1	ZINC000132805309	196285475	/nfs/dbraw/zinc/28/54/75/196285475.db2.gz	BVTQDPFCPNCNHB-BXKDBHETSA-N	0	3	318.186	2.482	10	0		DEAEHN
CCCNc1ncc(Br)c(NCCN(C)CC)n1	ZINC000132838116	196289539	/nfs/dbraw/zinc/28/95/39/196289539.db2.gz	PDSDPJRAPYXCDB-UHFFFAOYSA-N	0	3	316.247	2.425	10	0		DEAEHN
CSCC[C@@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000133219158	196321894	/nfs/dbraw/zinc/32/18/94/196321894.db2.gz	QWAWBJXBADVNJD-LLVKDONJSA-N	0	3	320.480	2.198	10	0		DEAEHN
CSCC[C@@H](C)NS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000133219158	196321897	/nfs/dbraw/zinc/32/18/97/196321897.db2.gz	QWAWBJXBADVNJD-LLVKDONJSA-N	0	3	320.480	2.198	10	0		DEAEHN
CC[C@H](CSC)NS(=O)(=O)c1cccc([C@@H](C)N)c1	ZINC000133233337	196323457	/nfs/dbraw/zinc/32/34/57/196323457.db2.gz	XDPPHTBLPOZZPH-ZYHUDNBSSA-N	0	3	302.465	2.126	10	0		DEAEHN
COC(=O)c1sc(N2CC[C@@H](N3CCCCC3)C2)nc1C	ZINC000133237954	196324040	/nfs/dbraw/zinc/32/40/40/196324040.db2.gz	FPYWOCMJLDANQM-GFCCVEGCSA-N	0	3	309.435	2.303	10	0		DEAEHN
CCN(CC)C(C)(C)C(=O)c1c(Cl)cnn1CCN(C)C	ZINC000134084158	196359846	/nfs/dbraw/zinc/35/98/46/196359846.db2.gz	HOYNWOVZFVDVFO-UHFFFAOYSA-N	0	3	314.861	2.401	10	0		DEAEHN
CC(C)c1ccc([C@@H](O)CNC[C@@H]2CCCS2(=O)=O)cc1	ZINC000134097746	196361284	/nfs/dbraw/zinc/36/12/84/196361284.db2.gz	YNEOFCOIUHJWAU-HOTGVXAUSA-N	0	3	311.447	2.010	10	0		DEAEHN
CC[C@@H](CCO)NCC(=O)Nc1ccc(Br)cc1	ZINC000134389036	196385526	/nfs/dbraw/zinc/38/55/26/196385526.db2.gz	BIUMHTBTDONMQG-NSHDSACASA-N	0	3	315.211	2.138	10	0		DEAEHN
c1ccc(OC2CCC2)c(CN[C@@H](C2CC2)[C@H]2CNCCO2)c1	ZINC000422915782	230276841	/nfs/dbraw/zinc/27/68/41/230276841.db2.gz	YZNPRTDMNJKRAX-MOPGFXCFSA-N	0	3	316.445	2.475	10	0		DEAEHN
CCC(C)(C)NC(=O)[C@H](C)N1CCC(Cc2nccn2C)CC1	ZINC000105876293	424849391	/nfs/dbraw/zinc/84/93/91/424849391.db2.gz	INKUUWJZDKZIQQ-AWEZNQCLSA-N	0	3	320.481	2.368	10	0		DEAEHN
CCOc1ccccc1CCC(=O)N1CCN2CCC[C@H]2C1	ZINC000195318495	424882238	/nfs/dbraw/zinc/88/22/38/424882238.db2.gz	GRPXYHNWTSEXGM-INIZCTEOSA-N	0	3	302.418	2.325	10	0		DEAEHN
CC[C@@](C)(N)c1cn(Cc2ccc(Br)cn2)nn1	ZINC000384166077	424910720	/nfs/dbraw/zinc/91/07/20/424910720.db2.gz	LIVPFYHKNRRVNK-GFCCVEGCSA-N	0	3	310.199	2.068	10	0		DEAEHN
O[C@@]1(CCNCc2ccc(F)cc2Br)CCOC1	ZINC000404195475	424926084	/nfs/dbraw/zinc/92/60/84/424926084.db2.gz	HPDQBBFFEIZAAN-ZDUSSCGKSA-N	0	3	318.186	2.219	10	0		DEAEHN
CCn1ccnc1[C@@H]1OCC[C@H]1CN[C@@H](C)c1nccnc1C	ZINC000658201549	425453991	/nfs/dbraw/zinc/45/39/91/425453991.db2.gz	OEJRVVKXPDUNMH-OFQRWUPVSA-N	0	3	315.421	2.430	10	0		DEAEHN
CN(C(=O)[C@H]1CSc2ccccc21)[C@H](CN)C(F)(F)F	ZINC000662980398	425771723	/nfs/dbraw/zinc/77/17/23/425771723.db2.gz	GXNNBLHPRQDXJU-GXSJLCMTSA-N	0	3	304.337	2.224	10	0		DEAEHN
CCN1CC[C@H](NC(=O)N[C@@H]2CCO[C@@H](c3cccs3)C2)C1	ZINC000334128270	269022949	/nfs/dbraw/zinc/02/29/49/269022949.db2.gz	REJMFKVSSQEWPI-HZSPNIEDSA-N	0	3	323.462	2.362	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CC[C@@H](Cc2ccncc2)C1	ZINC000363718806	269074213	/nfs/dbraw/zinc/07/42/13/269074213.db2.gz	NSOAAYXZBHRIRZ-IRXDYDNUSA-N	0	3	316.449	2.140	10	0		DEAEHN
CCCCC(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000397655646	269106646	/nfs/dbraw/zinc/10/66/46/269106646.db2.gz	YFEMKQYNRUJTCM-UHFFFAOYSA-N	0	3	304.434	2.320	10	0		DEAEHN
Cc1cc(N2CCO[C@@H](CN(C)C)C2)c2cccc(F)c2n1	ZINC000124920586	274708907	/nfs/dbraw/zinc/70/89/07/274708907.db2.gz	BMNRPBQTGAFJQC-ZDUSSCGKSA-N	0	3	303.381	2.449	10	0		DEAEHN
O=C(N[C@H]1CCOc2ccccc21)N1CC[C@@H](N2CCCC2)C1	ZINC000066174552	274993308	/nfs/dbraw/zinc/99/33/08/274993308.db2.gz	CCSSIHOKHAXTDC-ZBFHGGJFSA-N	0	3	315.417	2.390	10	0		DEAEHN
CCN(CC)CC(=O)N1C[C@@H](C)O[C@H](c2ccc(F)cc2)C1	ZINC000173523263	276094286	/nfs/dbraw/zinc/09/42/86/276094286.db2.gz	OIOMBGIPIXGXJD-CJNGLKHVSA-N	0	3	308.397	2.456	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC[C@H](n2ccnc2CC)C1)N(C)C	ZINC000179110066	276268597	/nfs/dbraw/zinc/26/85/97/276268597.db2.gz	JLGBSVQBZVVQAP-GJZGRUSLSA-N	0	3	306.454	2.339	10	0		DEAEHN
CN1CCCN(C(=O)C2=Cc3cc(Cl)ccc3OC2)CC1	ZINC000096978985	277047562	/nfs/dbraw/zinc/04/75/62/277047562.db2.gz	MIQGIZLGLMFMRW-UHFFFAOYSA-N	0	3	306.793	2.280	10	0		DEAEHN
CN1CC[C@@H]2CN(C(=O)Nc3cccc4c3OCCC4)C[C@@H]21	ZINC000454960463	277149012	/nfs/dbraw/zinc/14/90/12/277149012.db2.gz	PYTCUIABJITBEU-HIFRSBDPSA-N	0	3	301.390	2.179	10	0		DEAEHN
CN1CC[C@H](NC(=O)NC[C@]2(C)CCCO2)[C@@H]1c1ccccc1	ZINC000245641785	277166911	/nfs/dbraw/zinc/16/69/11/277166911.db2.gz	KQCIQNMRZFBJSF-BQFCYCMXSA-N	0	3	317.433	2.300	10	0		DEAEHN
C/C(=C/c1ccc(C)cc1)C(=O)NC[C@H](O)CN1CCCCC1	ZINC000182557116	277727967	/nfs/dbraw/zinc/72/79/67/277727967.db2.gz	LRXURMKLMMJFMM-XOQYZJNISA-N	0	3	316.445	2.361	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)[C@H]2Oc3ccccc3[C@H]2C)CN1C1CC1	ZINC000177169849	278023127	/nfs/dbraw/zinc/02/31/27/278023127.db2.gz	GDSVKPBFHRSSQV-FJZAXULXSA-N	0	3	300.402	2.293	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)NC1CCN(C2CC2)CC1	ZINC000117748513	278108833	/nfs/dbraw/zinc/10/88/33/278108833.db2.gz	DRKHUOHUTAFTIJ-PXAZEXFGSA-N	0	3	300.402	2.294	10	0		DEAEHN
C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1ncoc1[C@@H]1CCCO1	ZINC000329352287	278969004	/nfs/dbraw/zinc/96/90/04/278969004.db2.gz	DUULBILXOLMYBG-RDBSUJKOSA-N	0	3	319.405	2.225	10	0		DEAEHN
C[C@H](C(=O)N(C)C1CCCCC1)N1CCCN(C2CC2)CC1	ZINC000178869998	279183534	/nfs/dbraw/zinc/18/35/34/279183534.db2.gz	USPRNLNRLZMOAD-OAHLLOKOSA-N	0	3	307.482	2.336	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N[C@H](CCO)c2ccco2)C12CCOCC2	ZINC000249053290	279821579	/nfs/dbraw/zinc/82/15/79/279821579.db2.gz	XBPXTALGBPITMZ-FVQBIDKESA-N	0	3	309.406	2.267	10	0		DEAEHN
C[C@H]1NC(=S)N(C[C@@H]2CCCCN2Cc2ccccc2)C1=O	ZINC000067507290	280043223	/nfs/dbraw/zinc/04/32/23/280043223.db2.gz	MFFDYRUZQZYPEZ-HIFRSBDPSA-N	0	3	317.458	2.146	10	0		DEAEHN
CC[C@@H](C(=O)NCC[C@H]1COc2ccccc2O1)N(CC)CC	ZINC000361914978	280076959	/nfs/dbraw/zinc/07/69/59/280076959.db2.gz	GNDOUQPODHUWPS-GJZGRUSLSA-N	0	3	320.433	2.453	10	0		DEAEHN
O=C1NCCC[C@@H]1N[C@H]1CCc2cc(Br)ccc21	ZINC000050395466	280287200	/nfs/dbraw/zinc/28/72/00/280287200.db2.gz	VYVNKMUKUSFSOF-STQMWFEESA-N	0	3	309.207	2.305	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)N1CCO[C@H](c2ccccc2)C1	ZINC000262566853	280991445	/nfs/dbraw/zinc/99/14/45/280991445.db2.gz	WVPBLMNSMWUIEE-JKSUJKDBSA-N	0	3	302.418	2.365	10	0		DEAEHN
Cc1nccn1CCCCNC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000073722854	281545939	/nfs/dbraw/zinc/54/59/39/281545939.db2.gz	MKBSTIUJUBZMKC-MRXNPFEDSA-N	0	3	323.485	2.247	10	0		DEAEHN
Cc1csc(NC(=O)CN[C@H]2CCCC[C@H]2n2cccn2)n1	ZINC000129106852	281730430	/nfs/dbraw/zinc/73/04/30/281730430.db2.gz	WPIXXQCZULNZCP-QWHCGFSZSA-N	0	3	319.434	2.360	10	0		DEAEHN
CCC(C)(C)[C@@H]1CCCN1CC(=O)NC(=O)NCC(F)(F)F	ZINC000156852626	282034899	/nfs/dbraw/zinc/03/48/99/282034899.db2.gz	QGWISKAWZCLEJP-JTQLQIEISA-N	0	3	323.359	2.275	10	0		DEAEHN
CN(C)C(=O)[C@H](c1ccccc1)N1CC[C@H]2OCCC[C@H]2C1	ZINC000246739492	289016433	/nfs/dbraw/zinc/01/64/33/289016433.db2.gz	PCAHDJYQDUUYBI-BBWFWOEESA-N	0	3	302.418	2.317	10	0		DEAEHN
COc1cccc(OC)c1CC(=O)NCCN1CCCC[C@@H]1C	ZINC000156001560	295309329	/nfs/dbraw/zinc/30/93/29/295309329.db2.gz	JCNJRIOCMQYPTA-AWEZNQCLSA-N	0	3	320.433	2.237	10	0		DEAEHN
COC(=O)c1ccc(NCCN2CCC(C)CC2)nc1OC	ZINC000302356632	534223820	/nfs/dbraw/zinc/22/38/20/534223820.db2.gz	ZEQJHSJGHDBFQP-UHFFFAOYSA-N	0	3	307.394	2.021	10	0		DEAEHN
CC(C)CC(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000112256076	519603523	/nfs/dbraw/zinc/60/35/23/519603523.db2.gz	KPULEGVQCVCXKN-UHFFFAOYSA-N	0	3	317.433	2.497	10	0		DEAEHN
CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)NCc2ccc([O-])c(F)c2)C1	ZINC000132582133	519692107	/nfs/dbraw/zinc/69/21/07/519692107.db2.gz	GTMIFVMGOFQKEA-RISCZKNCSA-N	0	3	309.385	2.059	10	0		DEAEHN
CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NCc2ccc([O-])c(F)c2)C1	ZINC000132582133	519692109	/nfs/dbraw/zinc/69/21/09/519692109.db2.gz	GTMIFVMGOFQKEA-RISCZKNCSA-N	0	3	309.385	2.059	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H]1CCN(C(=O)C2CCCCC2)C1)N(C)C	ZINC000154896917	520594017	/nfs/dbraw/zinc/59/40/17/520594017.db2.gz	LDPDUXWIUCGEGW-CVEARBPZSA-N	0	3	323.481	2.014	10	0		DEAEHN
CCC(=O)Nc1cccc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000247312368	521225077	/nfs/dbraw/zinc/22/50/77/521225077.db2.gz	LZZPOWSHMVFEIW-CJNGLKHVSA-N	0	3	317.433	2.494	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)NC[C@H](c1ccccc1)C(C)(C)CO	ZINC000246035780	521833299	/nfs/dbraw/zinc/83/32/99/521833299.db2.gz	WMGPKZFPGCGSSP-NUEKZKHPSA-N	0	3	306.450	2.278	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)Nc1ccc(Sc2nncn2C)cc1	ZINC000237016591	522302203	/nfs/dbraw/zinc/30/22/03/522302203.db2.gz	VXXJYYALBWJUAZ-ZWNOBZJWSA-N	0	3	319.434	2.278	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(C)[C@H](C)c1ccco1	ZINC000111865124	523831353	/nfs/dbraw/zinc/83/13/53/523831353.db2.gz	PILSVHDJANFBJZ-KGLIPLIRSA-N	0	3	309.410	2.093	10	0		DEAEHN
C[C@@H](C(=O)NC1CCCC1)N1CCN(CC2CCCC2)CC1	ZINC000103491758	524164470	/nfs/dbraw/zinc/16/44/70/524164470.db2.gz	RZTGGKGENHYDKF-HNNXBMFYSA-N	0	3	307.482	2.242	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(-n2ccnc2C)cc1	ZINC000450677478	534789689	/nfs/dbraw/zinc/78/96/89/534789689.db2.gz	GNXKDXNTANDOHB-PXAZEXFGSA-N	0	3	301.390	2.171	10	0		DEAEHN
C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1ncncc1Cl	ZINC000247238205	524636006	/nfs/dbraw/zinc/63/60/06/524636006.db2.gz	ZTYYCLGWUXUVBU-TUAOUCFPSA-N	0	3	310.829	2.226	10	0		DEAEHN
C[C@@H](CN[C@@H](C)c1cc(F)c(F)c(F)c1)N1CCOCC1	ZINC000123359555	524748036	/nfs/dbraw/zinc/74/80/36/524748036.db2.gz	IAKAHRJMYDSNNC-QWRGUYRKSA-N	0	3	302.340	2.475	10	0		DEAEHN
C[C@H](NC[C@H](O)Cn1cccn1)c1ccccc1Br	ZINC000149004228	525408382	/nfs/dbraw/zinc/40/83/82/525408382.db2.gz	BKZQFFJRISULIJ-RYUDHWBXSA-N	0	3	324.222	2.357	10	0		DEAEHN
Cc1ccc(C(N)=O)cc1NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000246812876	526252842	/nfs/dbraw/zinc/25/28/42/526252842.db2.gz	MDXQTYYPBYRCCG-GXTWGEPZSA-N	0	3	318.421	2.040	10	0		DEAEHN
O=C(NCCNCC1=Cc2ccccc2OC1)c1ccccc1	ZINC000102425368	526335942	/nfs/dbraw/zinc/33/59/42/526335942.db2.gz	VGEUFSWBCJQBDG-UHFFFAOYSA-N	0	3	308.381	2.482	10	0		DEAEHN
CCCCOC[C@@H](O)CN[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000195215098	528620050	/nfs/dbraw/zinc/62/00/50/528620050.db2.gz	CDMJTCKSAIBZIU-PBHICJAKSA-N	0	3	318.421	2.096	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@H]1CCO[C@H](C2CC2)C1	ZINC000248943745	529067033	/nfs/dbraw/zinc/06/70/33/529067033.db2.gz	ZAZVWRUZQGSRGM-XHSDSOJGSA-N	0	3	309.454	2.070	10	0		DEAEHN
CC(=O)c1ccccc1OCCN(C)[C@@H]1CCN(C2CC2)C1	ZINC000348181143	534926403	/nfs/dbraw/zinc/92/64/03/534926403.db2.gz	OTNXEMLSROLRJU-MRXNPFEDSA-N	0	3	302.418	2.437	10	0		DEAEHN
CC(C)N(CC(=O)OC(C)(C)C)C(=O)CC1CCN(C)CC1	ZINC000362997837	535040830	/nfs/dbraw/zinc/04/08/30/535040830.db2.gz	SOCJOMFFFFYJNM-UHFFFAOYSA-N	0	3	312.454	2.297	10	0		DEAEHN
CC1(CNCc2c[nH]nc2-c2ccc(F)cc2)OCCCO1	ZINC000192249186	535150941	/nfs/dbraw/zinc/15/09/41/535150941.db2.gz	KENRXQHOALLIPY-UHFFFAOYSA-N	0	3	305.353	2.459	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@H]2CCc3ccccc32)C1	ZINC000247512116	535531864	/nfs/dbraw/zinc/53/18/64/535531864.db2.gz	PXLAMAVLMFGKST-HZPDHXFCSA-N	0	3	301.434	2.500	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(C3CC3)cc2)CCO1	ZINC000191604186	535946972	/nfs/dbraw/zinc/94/69/72/535946972.db2.gz	MCSYDAPNSJRVSD-QGZVFWFLSA-N	0	3	317.433	2.036	10	0		DEAEHN
CN(CCOc1ccccc1F)C(=O)[C@@H]1NCCCC1(C)C	ZINC000261980413	536402590	/nfs/dbraw/zinc/40/25/90/536402590.db2.gz	AHOSPUWRNGFKII-HNNXBMFYSA-N	0	3	308.397	2.441	10	0		DEAEHN
COC(=O)[C@H](NC[C@@H](C1CC1)N(C)Cc1ccccc1)C1CC1	ZINC000358664462	536737859	/nfs/dbraw/zinc/73/78/59/536737859.db2.gz	UBOPBHUCZPSACU-ZWKOTPCHSA-N	0	3	316.445	2.438	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)C[C@@H]1CCCOC1	ZINC000193759423	625662358	/nfs/dbraw/zinc/66/23/58/625662358.db2.gz	JWMKUHFXISHZOA-RDJZCZTQSA-N	0	3	304.434	2.440	10	0		DEAEHN
CN(C[C@H]1CCCN(C)C1)S(=O)(=O)/C=C\c1ccccc1	ZINC000255318408	624161517	/nfs/dbraw/zinc/16/15/17/624161517.db2.gz	FQSPPJWNSAZXAJ-DMIOIOJGSA-N	0	3	308.447	2.261	10	0		DEAEHN
O=S(=O)(/C=C\c1ccccc1)N1CC[C@@H](N2CCCC2)C1	ZINC000255494289	624845643	/nfs/dbraw/zinc/84/56/43/624845643.db2.gz	IQYBZMWXNVYLLI-RCBBPTIPSA-N	0	3	306.431	2.157	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N[C@H]1CCCc2nc(C)ncc21	ZINC000734823794	633429948	/nfs/dbraw/zinc/42/99/48/633429948.db2.gz	DXKMBCFIZVINAR-HOTGVXAUSA-N	0	3	302.422	2.153	10	0		DEAEHN
O=C(Cc1ccc(Br)cc1)N[C@@H]1CN2CCC1CC2	ZINC000222591393	636364322	/nfs/dbraw/zinc/36/43/22/636364322.db2.gz	ASSTUMJYNNPLSC-CQSZACIVSA-N	0	3	323.234	2.202	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc3oc(=O)ccc3c2)C1	ZINC000067719916	640629038	/nfs/dbraw/zinc/62/90/38/640629038.db2.gz	KWKMNEDNNFPTAP-AWEZNQCLSA-N	0	3	315.373	2.399	10	0		DEAEHN
Cc1cc(C)cc([C@@H](O)CN2CCC(N3CCCC3=O)CC2)c1	ZINC000173668236	646776768	/nfs/dbraw/zinc/77/67/68/646776768.db2.gz	CVQKMDOBXSRGAB-SFHVURJKSA-N	0	3	316.445	2.424	10	0		DEAEHN
[NH3+][C@@H]1CC[C@H](C[N-]S(=O)(=O)c2cc(Cl)ccc2Cl)C1	ZINC000394107134	685455345	/nfs/dbraw/zinc/45/53/45/685455345.db2.gz	IHSFIUCPTBDKPB-WCBMZHEXSA-N	0	3	323.245	2.399	10	0		DEAEHN
O=C([N-]CCC[N@H+](C[C@@H]1CCCO1)C1CCCC1)C(F)(F)F	ZINC000091582630	684037263	/nfs/dbraw/zinc/03/72/63/684037263.db2.gz	XOAWIYDBNSSMDC-ZDUSSCGKSA-N	0	3	322.371	2.479	10	0		DEAEHN
O=C([N-]CCC[N@@H+](C[C@@H]1CCCO1)C1CCCC1)C(F)(F)F	ZINC000091582630	684037265	/nfs/dbraw/zinc/03/72/65/684037265.db2.gz	XOAWIYDBNSSMDC-ZDUSSCGKSA-N	0	3	322.371	2.479	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](C)C[C@H](O)c2ccccc2)C1	ZINC000119729474	684086322	/nfs/dbraw/zinc/08/63/22/684086322.db2.gz	YXWQRFDHEHWJDV-XIRDDKMYSA-N	0	3	319.449	2.282	10	0		DEAEHN
Cn1c(=O)sc2cc(CNC[C@@H](O)c3ccsc3)ccc21	ZINC000192586803	684453801	/nfs/dbraw/zinc/45/38/01/684453801.db2.gz	CDXYVAVHEHZXNX-CYBMUJFWSA-N	0	3	320.439	2.485	10	0		DEAEHN
CC(=O)N1C[C@H](NCc2cccnc2)CC[C@H]1C(F)(F)F	ZINC000886038213	691989841	/nfs/dbraw/zinc/98/98/41/691989841.db2.gz	SITLTIFDKCFRQS-OLZOCXBDSA-N	0	3	301.312	2.113	10	0		DEAEHN
Cc1cc(Cl)cc(CN[C@H]2COC[C@H]2Oc2cnn(C)c2)c1	ZINC000886079516	691998781	/nfs/dbraw/zinc/99/87/81/691998781.db2.gz	DLZROMOXRQIVEG-JKSUJKDBSA-N	0	3	321.808	2.318	10	0		DEAEHN
CC(C)(C)OC(=O)N1C[C@H](NCc2cncnc2)C(C)(C)C1	ZINC000721845502	780288155	/nfs/dbraw/zinc/28/81/55/780288155.db2.gz	GHIDPHQLNIVQBI-ZDUSSCGKSA-N	0	3	306.410	2.212	10	0		DEAEHN
Cn1cc(CN[C@H]2CN(C(=O)OC(C)(C)C)CC2(C)C)cn1	ZINC000721853388	780370864	/nfs/dbraw/zinc/37/08/64/780370864.db2.gz	ZRFABRYYKSEFBV-ZDUSSCGKSA-N	0	3	308.426	2.155	10	0		DEAEHN
Cc1csc(CCCNC(=O)N2CC[C@H](N3CC=CC3)C2)n1	ZINC000174602853	783362186	/nfs/dbraw/zinc/36/21/86/783362186.db2.gz	SLIUZOSCPBOGPG-AWEZNQCLSA-N	0	3	320.462	2.040	10	0		DEAEHN
CO[C@](C)(CNCc1cncnc1)COCc1ccccc1	ZINC000702798028	1086460096	/nfs/dbraw/zinc/46/00/96/1086460096.db2.gz	RISAKDPGWGFDEV-QGZVFWFLSA-N	0	3	301.390	2.188	10	0		DEAEHN
C[C@H](N[C@H]1CON(C(=O)OC(C)(C)C)C1)[C@@H]1CCCCO1	ZINC000703289520	1086492856	/nfs/dbraw/zinc/49/28/56/1086492856.db2.gz	IPFHIHQPNSICER-XQQFMLRXSA-N	0	3	300.399	2.085	10	0		DEAEHN
C[C@@H](O)[C@@H](C)NCc1ccc(Br)cc1[N+](=O)[O-]	ZINC000387016611	1144509057	/nfs/dbraw/zinc/50/90/57/1144509057.db2.gz	ODIWEWFNMIPZGJ-HTQZYQBOSA-N	0	3	303.156	2.216	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000278296478	214073866	/nfs/dbraw/zinc/07/38/66/214073866.db2.gz	HOQNURYFBHTISP-GUYCJALGSA-N	0	3	317.433	2.224	10	0		DEAEHN
CCN[C@@H](CSCCS(C)(=O)=O)c1cccc(OC)c1	ZINC000081769105	192322741	/nfs/dbraw/zinc/32/27/41/192322741.db2.gz	TWDRKWBTCUAZHL-AWEZNQCLSA-N	0	3	317.476	2.124	10	0		DEAEHN
CC(C)[C@H](SCCS(C)(=O)=O)[C@H](N)c1ccccc1	ZINC000081768782	192323077	/nfs/dbraw/zinc/32/30/77/192323077.db2.gz	DHCAEKVXLDKFKO-KGLIPLIRSA-N	0	3	301.477	2.489	10	0		DEAEHN
CCOC(=O)CSC[C@H](NC)c1ccc2c(c1)OCCO2	ZINC000081796373	192324636	/nfs/dbraw/zinc/32/46/36/192324636.db2.gz	LBRYGWYCXAPXEL-LBPRGKRZSA-N	0	3	311.403	2.015	10	0		DEAEHN
OCc1ccc(CN[C@@H]2CCN(c3ncccc3Cl)C2)o1	ZINC000151228583	282113115	/nfs/dbraw/zinc/11/31/15/282113115.db2.gz	FKIHZSHQJOVPPP-LLVKDONJSA-N	0	3	307.781	2.189	10	0		DEAEHN
CC[C@H](N)[C@@H](C)S(=O)(=O)c1ccc(Br)cc1	ZINC000081933352	192340807	/nfs/dbraw/zinc/34/08/07/192340807.db2.gz	MOVUGOIGTAQIDA-KCJUWKMLSA-N	0	3	306.225	2.349	10	0		DEAEHN
CCCN[C@H](CC)CS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000081935514	192343073	/nfs/dbraw/zinc/34/30/73/192343073.db2.gz	IJRIJSSNWMQZSW-GFCCVEGCSA-N	0	3	313.419	2.010	10	0		DEAEHN
CCN[C@@H](c1ccccc1)[C@H](C(C)C)S(=O)(=O)CCOC	ZINC000081943741	192344551	/nfs/dbraw/zinc/34/45/51/192344551.db2.gz	CYZHIPDCACRWEJ-HOTGVXAUSA-N	0	3	313.463	2.423	10	0		DEAEHN
CC(C)(C)[C@@H]1CCCN(S(=O)(=O)[C@@H]2CCCNC2)CC1	ZINC000079358439	185166829	/nfs/dbraw/zinc/16/68/29/185166829.db2.gz	OAEZEDQPGATMEF-ZIAGYGMSSA-N	0	3	302.484	2.216	10	0		DEAEHN
COc1cc(Br)c(C(=O)[C@H]2CCCN2)cc1OC	ZINC000082724505	185197043	/nfs/dbraw/zinc/19/70/43/185197043.db2.gz	CEZQMIDIXFIEMN-SNVBAGLBSA-N	0	3	314.179	2.401	10	0		DEAEHN
COc1ccc(OC)c([C@@H](C)NC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000170826748	282180520	/nfs/dbraw/zinc/18/05/20/282180520.db2.gz	VCMGRPNZBSMJFR-OLZOCXBDSA-N	0	3	321.421	2.110	10	0		DEAEHN
CCC[C@H](C[NH3+])[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000087403982	185223803	/nfs/dbraw/zinc/22/38/03/185223803.db2.gz	XYPSSRAOMJFEIB-SNVBAGLBSA-N	0	3	311.234	2.399	10	0		DEAEHN
Cc1cc([C@H]2CCCN(C(=O)[C@H](C3CC3)N3CCCC3)C2)[nH]n1	ZINC000328704823	231315150	/nfs/dbraw/zinc/31/51/50/231315150.db2.gz	YKQOQANOLRQFQT-RDJZCZTQSA-N	0	3	316.449	2.299	10	0		DEAEHN
CC(C)c1nnsc1C(=O)N1C[C@@H](N)Cc2ccccc21	ZINC000087443038	185225193	/nfs/dbraw/zinc/22/51/93/185225193.db2.gz	VRLWGHTYJWBGSJ-NSHDSACASA-N	0	3	302.403	2.192	10	0		DEAEHN
CC[C@@H]1CN(C(=O)c2snnc2C(C)(C)C)[C@@H](CC)CN1	ZINC000087456115	185225592	/nfs/dbraw/zinc/22/55/92/185225592.db2.gz	AHDDKWVWFOFXLL-MNOVXSKESA-N	0	3	310.467	2.438	10	0		DEAEHN
COc1cc(Cl)c([C@H](N)CC(C)(C)C(N)=O)cc1OC	ZINC000087722291	185231017	/nfs/dbraw/zinc/23/10/17/185231017.db2.gz	IFLCUCHNIDNWGF-SNVBAGLBSA-N	0	3	300.786	2.259	10	0		DEAEHN
CN(CCc1ccccc1)S(=O)(=O)c1ccccc1CN	ZINC000088196226	185241437	/nfs/dbraw/zinc/24/14/37/185241437.db2.gz	RVCSICLQFRXRDX-UHFFFAOYSA-N	0	3	304.415	2.009	10	0		DEAEHN
NC(=S)CC1(CN2CCN(c3ccc(F)cc3)CC2)CC1	ZINC000088256880	185243942	/nfs/dbraw/zinc/24/39/42/185243942.db2.gz	YZJCTMNMGMKIQS-UHFFFAOYSA-N	0	3	307.438	2.404	10	0		DEAEHN
CC[C@@H](CN)S(=O)(=O)Nc1ccc(C)c(C(F)(F)F)c1	ZINC000088473399	185252275	/nfs/dbraw/zinc/25/22/75/185252275.db2.gz	MFYTXYASTRSPBY-JTQLQIEISA-N	0	3	310.341	2.493	10	0		DEAEHN
NCc1ccccc1S(=O)(=O)N1CCC[C@@H](C(F)(F)F)C1	ZINC000088419190	185249507	/nfs/dbraw/zinc/24/95/07/185249507.db2.gz	VKYNFZLQNDYAAA-LLVKDONJSA-N	0	3	322.352	2.108	10	0		DEAEHN
CCN[C@H](Cc1nc2ccccc2o1)C(C)(C)S(C)(=O)=O	ZINC000088518437	185254726	/nfs/dbraw/zinc/25/47/26/185254726.db2.gz	CEBHDWWHACUQPJ-CYBMUJFWSA-N	0	3	310.419	2.172	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1ccccc1COC	ZINC000177349939	282204821	/nfs/dbraw/zinc/20/48/21/282204821.db2.gz	MSCUBMQWSBQPRV-KRWDZBQOSA-N	0	3	319.449	2.459	10	0		DEAEHN
C[N-]S(=O)(=O)c1ccc(C[NH2+]C2C[C@H](C)C[C@@H](C)C2)o1	ZINC000088540909	185255747	/nfs/dbraw/zinc/25/57/47/185255747.db2.gz	JZNVSBUZXPCGEP-GHMZBOCLSA-N	0	3	300.424	2.102	10	0		DEAEHN
CCCN[C@H](c1ccc(COC)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000088567525	185258195	/nfs/dbraw/zinc/25/81/95/185258195.db2.gz	RGSYOTKTDPYZEN-HZPDHXFCSA-N	0	3	311.447	2.308	10	0		DEAEHN
COCCNCCc1nnc(-c2c(F)cc(F)cc2F)s1	ZINC000088824209	185266671	/nfs/dbraw/zinc/26/66/71/185266671.db2.gz	GRYMFMAOMFFDFU-UHFFFAOYSA-N	0	3	317.336	2.401	10	0		DEAEHN
Cc1ccccc1S(=O)(=O)N1CCC[C@H](N2CCCC2)C1	ZINC000088718431	185263021	/nfs/dbraw/zinc/26/30/21/185263021.db2.gz	ZPXGQCOVNFLANP-HNNXBMFYSA-N	0	3	308.447	2.244	10	0		DEAEHN
CCN[C@H](c1ccccc1)[C@@H](C)S(=O)(=O)C1CCOCC1	ZINC000081989519	192351134	/nfs/dbraw/zinc/35/11/34/192351134.db2.gz	MMRFEZFNCDIPFR-CJNGLKHVSA-N	0	3	311.447	2.320	10	0		DEAEHN
CCN[C@H](C[S@](=O)CCCOC)c1cc(C)ccc1OC	ZINC000081998323	192351842	/nfs/dbraw/zinc/35/18/42/192351842.db2.gz	XVQWVPBZOYTMTL-VFNWGFHPSA-N	0	3	313.463	2.439	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000090293293	185290016	/nfs/dbraw/zinc/29/00/16/185290016.db2.gz	NJGXLQSUOSJBRO-UHFFFAOYSA-N	0	3	310.463	2.357	10	0		DEAEHN
N[C@@H]1COC[C@H]1c1nc(-c2ccc(Br)s2)no1	ZINC000090364813	185292802	/nfs/dbraw/zinc/29/28/02/185292802.db2.gz	GASXRQZMWHFCFF-PHDIDXHHSA-N	0	3	316.180	2.002	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1ccc(Cl)c2ncccc12	ZINC000090433781	185296108	/nfs/dbraw/zinc/29/61/08/185296108.db2.gz	ZIPKIHQGTARFCT-GWCFXTLKSA-N	0	3	305.765	2.061	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1ccc(Cl)c2ncccc12	ZINC000090433780	185296142	/nfs/dbraw/zinc/29/61/42/185296142.db2.gz	ZIPKIHQGTARFCT-GXFFZTMASA-N	0	3	305.765	2.061	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1c2ncsc2ccc1Cl	ZINC000090432863	185296314	/nfs/dbraw/zinc/29/63/14/185296314.db2.gz	FSAASTYZGUFZJV-CBAPKCEASA-N	0	3	311.794	2.123	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1ccc(C)c(C(F)(F)F)c1	ZINC000090436990	185296394	/nfs/dbraw/zinc/29/63/94/185296394.db2.gz	LWNHPBYDXFAOQU-JQWIXIFHSA-N	0	3	302.296	2.187	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1ccccc1SC(F)(F)F	ZINC000090432893	185296446	/nfs/dbraw/zinc/29/64/46/185296446.db2.gz	XOEDFDGKEVFALQ-SCZZXKLOSA-N	0	3	320.336	2.471	10	0		DEAEHN
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)[C@@]1(C)COC[C@H]1N	ZINC000090590497	185305445	/nfs/dbraw/zinc/30/54/45/185305445.db2.gz	RGRYJIDMDZOHIN-OCCSQVGLSA-N	0	3	317.216	2.316	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@]2(C)COC[C@@H]2N)cc1C(F)(F)F	ZINC000090601198	185306009	/nfs/dbraw/zinc/30/60/09/185306009.db2.gz	IKOCEQNUWKHGEL-AAEUAGOBSA-N	0	3	302.296	2.316	10	0		DEAEHN
C[C@H](NC(=O)c1ccnc(OCCN(C)C)c1)C1CCCC1	ZINC000183206546	282240472	/nfs/dbraw/zinc/24/04/72/282240472.db2.gz	IPJDTQXVOAZBGR-ZDUSSCGKSA-N	0	3	305.422	2.331	10	0		DEAEHN
COC(=O)CNC(=O)[C@@H](C)N[C@H](C)c1ccc2ccccc2c1	ZINC000181495025	199306373	/nfs/dbraw/zinc/30/63/73/199306373.db2.gz	PFGULCOGDLCTDE-CHWSQXEVSA-N	0	3	314.385	2.168	10	0		DEAEHN
COCc1ccc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)o1	ZINC000097007507	185396690	/nfs/dbraw/zinc/39/66/90/185396690.db2.gz	NLNNHGMBPAYACR-HNNXBMFYSA-N	0	3	316.401	2.329	10	0		DEAEHN
C[C@@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccncc1	ZINC000036954911	539334517	/nfs/dbraw/zinc/33/45/17/539334517.db2.gz	DYKRVXSUSZVVNO-VXGBXAGGSA-N	0	3	305.403	2.141	10	0		DEAEHN
CC(C)(C)OC(=O)C1CCC(NCc2cc(C(N)=O)co2)CC1	ZINC000189417648	282309327	/nfs/dbraw/zinc/30/93/27/282309327.db2.gz	BBFMDKYNFIRRKZ-UHFFFAOYSA-N	0	3	322.405	2.369	10	0		DEAEHN
CCCn1cc(CNCCc2nc(C(=O)OCC)cs2)cn1	ZINC000190347973	282318575	/nfs/dbraw/zinc/31/85/75/282318575.db2.gz	SBNZQRBHHPKTTQ-UHFFFAOYSA-N	0	3	322.434	2.259	10	0		DEAEHN
COc1c(CNCCc2cc(C)c(O)c(C)c2)c(C)nn1C	ZINC000190390518	282319925	/nfs/dbraw/zinc/31/99/25/282319925.db2.gz	RGRNCMJYUMEARJ-UHFFFAOYSA-N	0	3	303.406	2.392	10	0		DEAEHN
Cc1nn(C)c(CNCC[C@@H]2CCCO2)c1Br	ZINC000089232037	539410982	/nfs/dbraw/zinc/41/09/82/539410982.db2.gz	HWDMJAGOYFLONW-JTQLQIEISA-N	0	3	302.216	2.150	10	0		DEAEHN
COC[C@H](NC[C@@]1(CCO)CCOC1)c1ccc(Cl)cc1	ZINC000194083400	282362505	/nfs/dbraw/zinc/36/25/05/282362505.db2.gz	SAMSBBVHBSQBAC-JKSUJKDBSA-N	0	3	313.825	2.406	10	0		DEAEHN
Cc1cc(NC(=O)COC2(C)CNC2)ccc1Br	ZINC000098060276	539436030	/nfs/dbraw/zinc/43/60/30/539436030.db2.gz	GEYNCQDIDUBMOX-UHFFFAOYSA-N	0	3	313.195	2.075	10	0		DEAEHN
Cc1cc(Br)ccc1NC(=O)COC1(C)CNC1	ZINC000098060414	539436050	/nfs/dbraw/zinc/43/60/50/539436050.db2.gz	IBQNYXSPJGOAMA-UHFFFAOYSA-N	0	3	313.195	2.075	10	0		DEAEHN
CC[C@@H]1CCCCCN1S(=O)(=O)c1ccc(CNC)cn1	ZINC000126516520	185870453	/nfs/dbraw/zinc/87/04/53/185870453.db2.gz	GUWWEZPMYVSEKH-CQSZACIVSA-N	0	3	311.451	2.144	10	0		DEAEHN
CCC[C@H](C(N)=S)N1CCN(CCc2ccsc2)CC1	ZINC000070246553	190875391	/nfs/dbraw/zinc/87/53/91/190875391.db2.gz	ORKNPLGPUOBAPX-CQSZACIVSA-N	0	3	311.520	2.363	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CC[C@@H](c2cccc(CO)c2)C1	ZINC000616611147	362897927	/nfs/dbraw/zinc/89/79/27/362897927.db2.gz	ATRKCWVBIYTPQO-MRXNPFEDSA-N	0	3	320.433	2.493	10	0		DEAEHN
Cc1n[nH]cc1[C@H](C)N[C@H](C)Cn1ncc2ccccc2c1=O	ZINC000181035381	539648283	/nfs/dbraw/zinc/64/82/83/539648283.db2.gz	RUJDYWBDYIHEDP-NEPJUHHUSA-N	0	3	311.389	2.167	10	0		DEAEHN
CSCC[C@@H](C)NCC(=O)Nc1ccc2c(c1)OCCO2	ZINC000130152200	185941494	/nfs/dbraw/zinc/94/14/94/185941494.db2.gz	VCEYPFSMDGKEMI-LLVKDONJSA-N	0	3	310.419	2.128	10	0		DEAEHN
Cc1cc(Br)c([C@H](N)[C@@H]2CCS(=O)(=O)C2)s1	ZINC000083677984	192378637	/nfs/dbraw/zinc/37/86/37/192378637.db2.gz	NZEVHZNIEHTOPZ-VXNVDRBHSA-N	0	3	324.265	2.254	10	0		DEAEHN
NC[C@H](NC[C@@H]1CCCO1)c1cc(Br)cs1	ZINC000083774352	192382327	/nfs/dbraw/zinc/38/23/27/192382327.db2.gz	NBSGKZQJYLGWFH-UWVGGRQHSA-N	0	3	305.241	2.279	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccc(N3CCCC3=O)cc2)C1	ZINC000194623977	539718958	/nfs/dbraw/zinc/71/89/58/539718958.db2.gz	AOUCLKNLOSOYGO-HNNXBMFYSA-N	0	3	315.417	2.028	10	0		DEAEHN
CN1C[C@H](NCc2ccc(Br)cc2F)CCC1=O	ZINC000084063322	192399626	/nfs/dbraw/zinc/39/96/26/192399626.db2.gz	KJSSBBCEWHCJJL-LLVKDONJSA-N	0	3	315.186	2.299	10	0		DEAEHN
CC(C)[C@@H](N)c1nc(CC(=O)Nc2ncccc2O)cs1	ZINC000071694406	191009023	/nfs/dbraw/zinc/00/90/23/191009023.db2.gz	ZXIJWJGRSLFPQT-GFCCVEGCSA-N	0	3	306.391	2.081	10	0		DEAEHN
CCCN(CC)S(=O)(=O)c1cc(CNCC)cc(F)c1F	ZINC000138448259	186016837	/nfs/dbraw/zinc/01/68/37/186016837.db2.gz	QBRQTXPQSWVZOL-UHFFFAOYSA-N	0	3	320.405	2.495	10	0		DEAEHN
CO[C@H](CNC(=O)N1CCCN(C2CC2)CC1)c1ccccc1	ZINC000140441976	186026966	/nfs/dbraw/zinc/02/69/66/186026966.db2.gz	MAXAYZKCCGDHTA-QGZVFWFLSA-N	0	3	317.433	2.254	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)NCCCCC(C)C)cn1C	ZINC000147918142	186042380	/nfs/dbraw/zinc/04/23/80/186042380.db2.gz	PTJZZNVCBJDSIM-UHFFFAOYSA-N	0	3	315.483	2.239	10	0		DEAEHN
CCc1cc(Br)ccc1NC(=O)[C@@H](N)CCOC	ZINC000148156619	186043355	/nfs/dbraw/zinc/04/33/55/186043355.db2.gz	KENRBLPZFDIVJL-NSHDSACASA-N	0	3	315.211	2.314	10	0		DEAEHN
Cc1ccc([C@H]2NCC(=O)N2[C@H](CC(C)C)CN(C)C)s1	ZINC000143962752	186033922	/nfs/dbraw/zinc/03/39/22/186033922.db2.gz	CCMQFIGKVRXNBI-CJNGLKHVSA-N	0	3	309.479	2.463	10	0		DEAEHN
CC[C@@H]1N[C@H](c2cccs2)N(CCN2CCCCC2)C1=O	ZINC000144061749	186035211	/nfs/dbraw/zinc/03/52/11/186035211.db2.gz	OGCCOTZBVCQHBH-ZFWWWQNUSA-N	0	3	307.463	2.443	10	0		DEAEHN
C[C@H](CN1C(=O)C2(CCCC2)N[C@@H]1c1cccs1)N(C)C	ZINC000144942384	186035938	/nfs/dbraw/zinc/03/59/38/186035938.db2.gz	NFQQEWGKFRKAOH-OCCSQVGLSA-N	0	3	307.463	2.441	10	0		DEAEHN
C[C@@H](CN1C(=O)C2(CCCC2)N[C@H]1c1ccsc1)N(C)C	ZINC000144941191	186035973	/nfs/dbraw/zinc/03/59/73/186035973.db2.gz	FRLYSJCAYDKHBR-GXTWGEPZSA-N	0	3	307.463	2.441	10	0		DEAEHN
Cc1ccc([C@@H]2NCC(=O)N2C[C@@H](C)N2CCCCC2)s1	ZINC000145700056	186038005	/nfs/dbraw/zinc/03/80/05/186038005.db2.gz	OYPVRGSOEGRIGV-MLGOLLRUSA-N	0	3	307.463	2.361	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)N1CCC[C@@H]2CCCC[C@H]21	ZINC000145767548	186038163	/nfs/dbraw/zinc/03/81/63/186038163.db2.gz	BWFHYGSOBUCUDR-FUHWJXTLSA-N	0	3	319.493	2.338	10	0		DEAEHN
COc1cccc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1OC	ZINC000155754082	186109364	/nfs/dbraw/zinc/10/93/64/186109364.db2.gz	NBPWZRCCHDIANW-JSGCOSHPSA-N	0	3	306.406	2.162	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2cc(C)ccc2Br)C1	ZINC000163970354	186144228	/nfs/dbraw/zinc/14/42/28/186144228.db2.gz	KRJXDMHAABPPSA-CABZTGNLSA-N	0	3	313.195	2.073	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)NC2CC(C)C2)ccc1F	ZINC000163999605	186145648	/nfs/dbraw/zinc/14/56/48/186145648.db2.gz	WNGODUJVZZWKLO-UHFFFAOYSA-N	0	3	300.399	2.012	10	0		DEAEHN
CC(C(=O)Nc1cc(Cl)ccc1-n1cccn1)=C1CNC1	ZINC000164121259	186149142	/nfs/dbraw/zinc/14/91/42/186149142.db2.gz	DJDVJUIFOCYDPC-UHFFFAOYSA-N	0	3	302.765	2.384	10	0		DEAEHN
CCN(CC)c1nc(NC)nc(N2C[C@@H](C)S[C@@H](C)C2)n1	ZINC000155891483	186120852	/nfs/dbraw/zinc/12/08/52/186120852.db2.gz	HAKGULYPYGYFGL-PHIMTYICSA-N	0	3	310.471	2.090	10	0		DEAEHN
CC(C(=O)Nc1cccc(Cl)c1-n1ccnc1)=C1CNC1	ZINC000163932414	186142821	/nfs/dbraw/zinc/14/28/21/186142821.db2.gz	NQUJHOCECSFELB-UHFFFAOYSA-N	0	3	302.765	2.384	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](Cc2noc(C)n2)C1	ZINC000171510321	186170979	/nfs/dbraw/zinc/17/09/79/186170979.db2.gz	PLARXMAUTUFGQU-HUUCEWRRSA-N	0	3	320.437	2.034	10	0		DEAEHN
CC(C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1)=C1CNC1	ZINC000164278723	186154486	/nfs/dbraw/zinc/15/44/86/186154486.db2.gz	KBGRUABKKZKRRK-OAHLLOKOSA-N	0	3	306.793	2.160	10	0		DEAEHN
Cn1ncc(Br)c1C(=O)[C@@H]1CNCc2ccccc21	ZINC000164288755	186155204	/nfs/dbraw/zinc/15/52/04/186155204.db2.gz	IZMBONLLTMFMLG-LLVKDONJSA-N	0	3	320.190	2.252	10	0		DEAEHN
CC(C)(C)c1nnc(NC(=O)N2CCN3CCC[C@H]3C2)s1	ZINC000171891159	198002132	/nfs/dbraw/zinc/00/21/32/198002132.db2.gz	QQFZZEVHZLIVGJ-JTQLQIEISA-N	0	3	309.439	2.148	10	0		DEAEHN
Cc1cc(C)cc(OCCNC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000171904108	198005095	/nfs/dbraw/zinc/00/50/95/198005095.db2.gz	QQADZJNHEAULOY-INIZCTEOSA-N	0	3	317.433	2.172	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)S(=O)(=O)Cc2ccccc2F)CCN1C	ZINC000173269538	198204730	/nfs/dbraw/zinc/20/47/30/198204730.db2.gz	KQVGHWDQZCBYKL-JSGCOSHPSA-N	0	3	314.426	2.070	10	0		DEAEHN
CCOC(=O)[C@H](CC)N1CC[C@H](CNc2cccc(C)n2)C1	ZINC000173779865	198250415	/nfs/dbraw/zinc/25/04/15/198250415.db2.gz	COXWBQQWQVGDEL-CABCVRRESA-N	0	3	305.422	2.466	10	0		DEAEHN
COC[C@@H](C)C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000173706803	198242867	/nfs/dbraw/zinc/24/28/67/198242867.db2.gz	KLZRBAPXVUGWEI-WBVHZDCISA-N	0	3	304.434	2.392	10	0		DEAEHN
CC[C@H](O)CN1CCN(CCCOc2ccc(C)c(C)c2)CC1	ZINC000174094665	198291256	/nfs/dbraw/zinc/29/12/56/198291256.db2.gz	ZYRTXTUOHPAQTM-SFHVURJKSA-N	0	3	320.477	2.461	10	0		DEAEHN
Cc1ccccc1OCCNC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000174204457	198305239	/nfs/dbraw/zinc/30/52/39/198305239.db2.gz	MHCIZNFRGCMXOI-INIZCTEOSA-N	0	3	315.417	2.030	10	0		DEAEHN
CCOC[C@H]1CCCN(C(=O)N[C@@H](CC(C)C)CN(C)C)C1	ZINC000073203345	191291709	/nfs/dbraw/zinc/29/17/09/191291709.db2.gz	ALICMFHHAIKYAD-HOTGVXAUSA-N	0	3	313.486	2.421	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCCC[C@H]1CCO	ZINC000070950226	354892452	/nfs/dbraw/zinc/89/24/52/354892452.db2.gz	LWEOOCFULVHZEM-KRWDZBQOSA-N	0	3	304.434	2.272	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](C)[C@H]2CCCO2)o1	ZINC000079620058	355322271	/nfs/dbraw/zinc/32/22/71/355322271.db2.gz	OUMGWUZITRMJJB-GOEBONIOSA-N	0	3	323.437	2.229	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)Nc1ccc([S@](C)=O)cc1	ZINC000080127881	355348194	/nfs/dbraw/zinc/34/81/94/355348194.db2.gz	XAUMTIOJEMULBY-MCMMXHMISA-N	0	3	323.462	2.420	10	0		DEAEHN
NC[C@@H](NC(=O)c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000401734603	540142144	/nfs/dbraw/zinc/14/21/44/540142144.db2.gz	XDBBRGCICHCLKW-MRVPVSSYSA-N	0	3	300.202	2.325	10	0		DEAEHN
CCc1nc(CNC(=O)NC2CCN(C3CC3)CC2)cs1	ZINC000107728104	355728925	/nfs/dbraw/zinc/72/89/25/355728925.db2.gz	OGMKJSRPXBYWAO-UHFFFAOYSA-N	0	3	308.451	2.132	10	0		DEAEHN
COCCN1CCN(CCCCC(=O)OC(C)(C)C)C[C@H]1C	ZINC000181817823	356096729	/nfs/dbraw/zinc/09/67/29/356096729.db2.gz	NCPMREGZLVEABQ-OAHLLOKOSA-N	0	3	314.470	2.151	10	0		DEAEHN
C[C@@H](N[C@H]1CCCS(=O)(=O)C1)c1cccc(-n2ccnc2)c1	ZINC000183050738	356157496	/nfs/dbraw/zinc/15/74/96/356157496.db2.gz	POLNXLOWXCIYEM-HIFRSBDPSA-N	0	3	319.430	2.100	10	0		DEAEHN
Cc1cc(C)cc([C@H]2CCN(CCN3C(=O)CCC3=O)C2)c1	ZINC000183467493	356172603	/nfs/dbraw/zinc/17/26/03/356172603.db2.gz	QJOJWSIFHQTOOB-HNNXBMFYSA-N	0	3	300.402	2.242	10	0		DEAEHN
CCOCCN1CCN(CCCC(=O)OC(C)(C)C)C[C@H]1C	ZINC000248461963	356322399	/nfs/dbraw/zinc/32/23/99/356322399.db2.gz	PMMAXOCWRYZCEN-OAHLLOKOSA-N	0	3	314.470	2.151	10	0		DEAEHN
CC[C@](C)(CO)NCC(=O)Nc1cccc(Br)c1	ZINC000080897513	192199843	/nfs/dbraw/zinc/19/98/43/192199843.db2.gz	SYDPSWJTCXJEMO-CYBMUJFWSA-N	0	3	315.211	2.138	10	0		DEAEHN
C[C@H]1CCC[C@@](N)(C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1	ZINC000080917123	192201672	/nfs/dbraw/zinc/20/16/72/192201672.db2.gz	DPMSSIPEDPRGQN-VFZGTOFNSA-N	0	3	309.797	2.285	10	0		DEAEHN
COC[C@@H]1CCN([C@@H](CN)c2ccccc2OC(F)F)C1	ZINC000081049453	192218618	/nfs/dbraw/zinc/21/86/18/192218618.db2.gz	RVFSKRPKQKHZGU-YPMHNXCESA-N	0	3	300.349	2.256	10	0		DEAEHN
CNCc1cc(Br)cnc1N1CC[C@@H](COC)C1	ZINC000081117391	192228764	/nfs/dbraw/zinc/22/87/64/192228764.db2.gz	WLLDXNNGPDFRAK-SNVBAGLBSA-N	0	3	314.227	2.036	10	0		DEAEHN
CC(C)OC(=O)C[C@@H]1CCCN(C[C@@H](O)COC(C)(C)C)C1	ZINC000248626257	535302844	/nfs/dbraw/zinc/30/28/44/535302844.db2.gz	OCIWVUGEKBDIQV-LSDHHAIUSA-N	0	3	315.454	2.216	10	0		DEAEHN
C[C@@H]1CC[C@@](N)(c2ncncc2I)C1	ZINC000306153623	356402602	/nfs/dbraw/zinc/40/26/02/356402602.db2.gz	BAMRFPVGNRERRF-XCBNKYQSSA-N	0	3	303.147	2.055	10	0		DEAEHN
CCc1ccc(C(=O)N2CCO[C@H](CN(C)CC3CC3)C2)o1	ZINC000328651462	356466447	/nfs/dbraw/zinc/46/64/47/356466447.db2.gz	VXQKIISTBQXZLI-OAHLLOKOSA-N	0	3	306.406	2.025	10	0		DEAEHN
C[C@H]1CC[C@H](C)N1CC(=O)N[C@H]1CCCO[C@@H]1c1ccncc1	ZINC000332678918	356467259	/nfs/dbraw/zinc/46/72/59/356467259.db2.gz	FPJHLGRZEVHXLX-ILXVDBEPSA-N	0	3	317.433	2.291	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N[C@H]1CN(C)Cc2ccccc21	ZINC000536036061	540241084	/nfs/dbraw/zinc/24/10/84/540241084.db2.gz	PZANPNWSEXRRQF-IRXDYDNUSA-N	0	3	301.434	2.164	10	0		DEAEHN
CCC[C@H](N)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	ZINC000236961832	202094643	/nfs/dbraw/zinc/09/46/43/202094643.db2.gz	ZXHCJVJGAKFSGX-LBPRGKRZSA-N	0	3	307.785	2.046	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)N(C)CC(=O)Nc1ccccc1SC	ZINC000236990791	202110952	/nfs/dbraw/zinc/11/09/52/202110952.db2.gz	URAGUVNMUKQMCX-NHYWBVRUSA-N	0	3	323.462	2.179	10	0		DEAEHN
C[C@@H](N[C@@H]1CC[C@H]1O)c1ccc(I)cc1	ZINC000382201767	356674647	/nfs/dbraw/zinc/67/46/47/356674647.db2.gz	FGFPNZAFRMAXDZ-GGZOMVNGSA-N	0	3	317.170	2.465	10	0		DEAEHN
Brc1cccc(CN2CC[C@@H]3OCCN[C@@H]3C2)c1	ZINC000404040297	356730709	/nfs/dbraw/zinc/73/07/09/356730709.db2.gz	AUGHSUDASURWLE-KGLIPLIRSA-N	0	3	311.223	2.012	10	0		DEAEHN
CCOCC[C@@H](O)CN1CCC[C@H](CC(=O)OC(C)(C)C)C1	ZINC000578875895	356885520	/nfs/dbraw/zinc/88/55/20/356885520.db2.gz	BYHPZAKIBIHVHM-HUUCEWRRSA-N	0	3	315.454	2.218	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2CCC[C@H]2CC)cs1	ZINC000088972954	192675623	/nfs/dbraw/zinc/67/56/23/192675623.db2.gz	PQNHFUBLRGQVPT-LLVKDONJSA-N	0	3	302.465	2.421	10	0		DEAEHN
Cc1sc(CNC2CC2)cc1S(=O)(=O)N1CC[C@H](C)C1	ZINC000088986401	192682407	/nfs/dbraw/zinc/68/24/07/192682407.db2.gz	SUQUNJCCNYLQMD-JTQLQIEISA-N	0	3	314.476	2.339	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCc1c(C)cc(C)nc1OC	ZINC000589583909	357480470	/nfs/dbraw/zinc/48/04/70/357480470.db2.gz	WKUREANUYORABB-HNNXBMFYSA-N	0	3	305.422	2.198	10	0		DEAEHN
CN1CC[C@@H](NC(=O)Cc2ccccc2O)[C@@H]1c1ccccc1	ZINC000179223461	199001615	/nfs/dbraw/zinc/00/16/15/199001615.db2.gz	IRLIQGDVYKHYPY-APWZRJJASA-N	0	3	310.397	2.496	10	0		DEAEHN
CCOCCN(CC)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179468744	199041402	/nfs/dbraw/zinc/04/14/02/199041402.db2.gz	UXMFISPHGFOXOS-IAGOWNOFSA-N	0	3	319.449	2.500	10	0		DEAEHN
Cc1noc(C)c1CC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000180111337	199118234	/nfs/dbraw/zinc/11/82/34/199118234.db2.gz	URMFXSZWTSTRJL-SJLPKXTDSA-N	0	3	313.401	2.396	10	0		DEAEHN
C[C@@H](N[C@@H]1CCc2ncnn2C1)c1cnn(Cc2ccccc2)c1	ZINC000180580949	199179852	/nfs/dbraw/zinc/17/98/52/199179852.db2.gz	OPILHUJNVBVQDW-RHSMWYFYSA-N	0	3	322.416	2.189	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N[C@H](CC)c2nccn2C)C12CCOCC2	ZINC000248644357	535418564	/nfs/dbraw/zinc/41/85/64/535418564.db2.gz	PTQSWXLIUHLESN-RBSFLKMASA-N	0	3	307.438	2.435	10	0		DEAEHN
Cc1cc(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc(=O)[nH]1	ZINC000180888730	199223995	/nfs/dbraw/zinc/22/39/95/199223995.db2.gz	IYWQTAGYMLRPBH-NVXWUHKLSA-N	0	3	311.385	2.271	10	0		DEAEHN
Cc1cc(C)c(S(=O)(=O)NCc2ccsc2)cc1CN	ZINC000089035571	192710758	/nfs/dbraw/zinc/71/07/58/192710758.db2.gz	XZKJBTLSBAGAQM-UHFFFAOYSA-N	0	3	310.444	2.302	10	0		DEAEHN
C[C@H](CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)c1nccs1	ZINC000187011216	200047192	/nfs/dbraw/zinc/04/71/92/200047192.db2.gz	OHWJPBAWRLPPEP-UPJWGTAASA-N	0	3	310.467	2.371	10	0		DEAEHN
C[C@H]1OCCC[C@@H]1C(=O)NCCCN1CCc2ccccc2C1	ZINC000188403900	200240704	/nfs/dbraw/zinc/24/07/04/200240704.db2.gz	YAPHEQCVDAIMLK-QAPCUYQASA-N	0	3	316.445	2.366	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2cccc(Br)n2)C1	ZINC000188584890	200270418	/nfs/dbraw/zinc/27/04/18/200270418.db2.gz	BRWIZHQZXDMXFX-VIFPVBQESA-N	0	3	313.199	2.012	10	0		DEAEHN
CO[C@@H]1CN(CCc2cccc(Cl)c2)C[C@H]1c1c[nH]nn1	ZINC000668577008	540691981	/nfs/dbraw/zinc/69/19/81/540691981.db2.gz	NLMLAWXAEFRYAI-DZGCQCFKSA-N	0	3	306.797	2.115	10	0		DEAEHN
C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000471971394	291269548	/nfs/dbraw/zinc/26/95/48/291269548.db2.gz	AHDFOSLNRZJTPH-KXNHARMFSA-N	0	3	307.360	2.451	10	0		DEAEHN
Cc1ncc(CNCC2(O)CCN(Cc3ccccc3)CC2)o1	ZINC000628312305	366806160	/nfs/dbraw/zinc/80/61/60/366806160.db2.gz	WXFXFSZLSGLHBR-UHFFFAOYSA-N	0	3	315.417	2.100	10	0		DEAEHN
CCN1CC[C@H](N(C)C(=O)c2nc3cccnc3s2)[C@H](C)C1	ZINC000193958943	201153672	/nfs/dbraw/zinc/15/36/72/201153672.db2.gz	OJKZUSUIXHAICE-YPMHNXCESA-N	0	3	318.446	2.494	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCC[C@@H](C(C)(C)C(=O)OC)C1	ZINC000611311380	361577859	/nfs/dbraw/zinc/57/78/59/361577859.db2.gz	MBYAKEMCVACQFM-CABCVRRESA-N	0	3	324.465	2.299	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCC(O)(c2ccccc2)CC1	ZINC000195219100	201362183	/nfs/dbraw/zinc/36/21/83/201362183.db2.gz	CHAGMDSPEMNHCZ-KRWDZBQOSA-N	0	3	307.434	2.148	10	0		DEAEHN
Cc1cc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)no1	ZINC000195297593	201375260	/nfs/dbraw/zinc/37/52/60/201375260.db2.gz	NUCCGWWVBMUIBE-MRXNPFEDSA-N	0	3	300.406	2.332	10	0		DEAEHN
Cn1cncc1[C@H]1C[C@@H](NCc2cccc3c2OCO3)CCO1	ZINC000275399926	212310263	/nfs/dbraw/zinc/31/02/63/212310263.db2.gz	CLEHTMPPIBJAKN-XJKSGUPXSA-N	0	3	315.373	2.159	10	0		DEAEHN
C(=C/c1ccccc1)\CN[C@@H]1CCN(c2ccc3nncn3n2)C1	ZINC000623652617	365117666	/nfs/dbraw/zinc/11/76/66/365117666.db2.gz	LFACVIXKZCJXHG-IEXSPKMKSA-N	0	3	320.400	2.006	10	0		DEAEHN
CN1CCOC[C@H]1CNCc1ccc(Br)cc1F	ZINC000623710421	365140588	/nfs/dbraw/zinc/14/05/88/365140588.db2.gz	CDNIPLKGDUJPBY-GFCCVEGCSA-N	0	3	317.202	2.008	10	0		DEAEHN
CN1CCOC[C@@H]1CNCc1ccc(Br)c(F)c1	ZINC000623711652	365141853	/nfs/dbraw/zinc/14/18/53/365141853.db2.gz	KUNAVQPICQIEGI-NSHDSACASA-N	0	3	317.202	2.008	10	0		DEAEHN
O=C(C[C@@H]1CNCCO1)Nc1cc(Cl)cc2cccnc21	ZINC000091299704	193034025	/nfs/dbraw/zinc/03/40/25/193034025.db2.gz	AJHIXBHDXCSKOL-GFCCVEGCSA-N	0	3	305.765	2.205	10	0		DEAEHN
CS(=O)(=O)CCC[C@H](N)c1cc(F)cc(Br)c1	ZINC000091331499	193041288	/nfs/dbraw/zinc/04/12/88/193041288.db2.gz	MEXMMSCENLAOIK-NSHDSACASA-N	0	3	324.215	2.413	10	0		DEAEHN
CCNc1cc(C(=O)N2CCC[C@@H](N(C)C)C2)cc(Cl)n1	ZINC000091427519	193053900	/nfs/dbraw/zinc/05/39/00/193053900.db2.gz	KXHFWWDQIFLAHH-GFCCVEGCSA-N	0	3	310.829	2.333	10	0		DEAEHN
C[C@@H](NC[C@H]1CN(C)CCO1)c1ccccc1OC(F)F	ZINC000091667763	193087775	/nfs/dbraw/zinc/08/77/75/193087775.db2.gz	YQTQZUHQCYFOMT-NEPJUHHUSA-N	0	3	300.349	2.269	10	0		DEAEHN
CN[C@@H](c1cccc(OC(F)(F)F)c1)[C@@H]1CN(C)CCO1	ZINC000091717591	193096880	/nfs/dbraw/zinc/09/68/80/193096880.db2.gz	GPYQVAQNJUNBKB-STQMWFEESA-N	0	3	304.312	2.176	10	0		DEAEHN
CC[C@@H]1[NH2+]CC[C@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000624391633	365405825	/nfs/dbraw/zinc/40/58/25/365405825.db2.gz	AMYCMGXEKXXHIW-WDEREUQCSA-N	0	3	323.245	2.412	10	0		DEAEHN
C[NH2+]C1CCC([N-]S(=O)(=O)c2ccc(F)cc2Cl)CC1	ZINC000091872499	193121228	/nfs/dbraw/zinc/12/12/28/193121228.db2.gz	RCWQOOORHBGCKR-UHFFFAOYSA-N	0	3	320.817	2.288	10	0		DEAEHN
C[C@@H]1CC[C@H]([N-]S(=O)(=O)c2c(Cl)cccc2Cl)C[NH2+]1	ZINC000624407013	365413487	/nfs/dbraw/zinc/41/34/87/365413487.db2.gz	RGSYOJGKTRSFGD-BDAKNGLRSA-N	0	3	323.245	2.412	10	0		DEAEHN
C[C@@H]1CN(S(=O)(=O)c2cc(CN)ccc2Cl)C[C@H]1C	ZINC000092113468	193161522	/nfs/dbraw/zinc/16/15/22/193161522.db2.gz	JSHYZAAZYKZRBK-NXEZZACHSA-N	0	3	302.827	2.075	10	0		DEAEHN
CCc1ccc(CNC)cc1S(=O)(=O)N1C[C@H](C)[C@@H](C)C1	ZINC000092113825	193161715	/nfs/dbraw/zinc/16/17/15/193161715.db2.gz	YGULWOFSJUSKHZ-STQMWFEESA-N	0	3	310.463	2.245	10	0		DEAEHN
CCC[C@H](C)N(C)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115707	193162885	/nfs/dbraw/zinc/16/28/85/193162885.db2.gz	KQSDVMQZTIZDOH-NSHDSACASA-N	0	3	302.415	2.354	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N(C)C2CCCCC2)c(F)c1	ZINC000092115520	193163017	/nfs/dbraw/zinc/16/30/17/193163017.db2.gz	IMHDEKAPHHDPAA-UHFFFAOYSA-N	0	3	314.426	2.498	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCC[C@@H]2C)c(F)c1	ZINC000092115734	193163240	/nfs/dbraw/zinc/16/32/40/193163240.db2.gz	NOYRZPOOCZAXCD-NSHDSACASA-N	0	3	300.399	2.108	10	0		DEAEHN
CC[C@H](C)N(CC)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115643	193163340	/nfs/dbraw/zinc/16/33/40/193163340.db2.gz	SGEGBNVPIPJVHI-NSHDSACASA-N	0	3	302.415	2.354	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2[C@H](C)CCC[C@@H]2C)c(F)c1	ZINC000092115547	193163413	/nfs/dbraw/zinc/16/34/13/193163413.db2.gz	PTMDCWRLURKHCX-TXEJJXNPSA-N	0	3	314.426	2.497	10	0		DEAEHN
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115597	193163421	/nfs/dbraw/zinc/16/34/21/193163421.db2.gz	RGHVKHMBPRLSRK-LBPRGKRZSA-N	0	3	300.399	2.238	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N(C)CC(C)(C)C)c(F)c1	ZINC000092116016	193164178	/nfs/dbraw/zinc/16/41/78/193164178.db2.gz	WBLJAKJKVGKZNK-UHFFFAOYSA-N	0	3	302.415	2.212	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)NC[C@H](c1ccco1)N1CCCCC1	ZINC000262297143	203254093	/nfs/dbraw/zinc/25/40/93/203254093.db2.gz	JIBCGCKFPRPJEM-RHSMWYFYSA-N	0	3	307.438	2.440	10	0		DEAEHN
O=C(Nc1cccc(COC2CCCCC2)c1)[C@@H]1C[C@@H](O)CN1	ZINC000262490294	203306759	/nfs/dbraw/zinc/30/67/59/203306759.db2.gz	ZJCAHBHUOHBJTJ-WBVHZDCISA-N	0	3	318.417	2.197	10	0		DEAEHN
Cc1c(CSC(C)C)cccc1NC(=O)[C@@H]1C[C@@H](O)CN1	ZINC000262489052	203307289	/nfs/dbraw/zinc/30/72/89/203307289.db2.gz	ZBYSCLDQSSZKFP-HIFRSBDPSA-N	0	3	308.447	2.298	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)NCc1cc(OC)nc2ccccc12	ZINC000262705834	203388112	/nfs/dbraw/zinc/38/81/12/203388112.db2.gz	MHBYBSMSQUNPIF-QGZVFWFLSA-N	0	3	301.390	2.377	10	0		DEAEHN
CN[C@@]1(C(=O)OC)CCC[C@H]1CCN(C)CCC(F)(F)F	ZINC000093596101	193271959	/nfs/dbraw/zinc/27/19/59/193271959.db2.gz	AXJVCBISPJOTNW-AAEUAGOBSA-N	0	3	310.360	2.192	10	0		DEAEHN
Cc1nn([C@H]2CCC[C@](NC3CC3)(C(N)=O)C2)c(C)c1Cl	ZINC000093759583	193301655	/nfs/dbraw/zinc/30/16/55/193301655.db2.gz	BLUVUUNMEDRXIG-SWLSCSKDSA-N	0	3	310.829	2.245	10	0		DEAEHN
CCN[C@@]1(C(=O)OCC)CC[C@H](N(C)CCC(F)(F)F)C1	ZINC000093831813	193315063	/nfs/dbraw/zinc/31/50/63/193315063.db2.gz	XTDLLINJQPRBBA-AAEUAGOBSA-N	0	3	310.360	2.335	10	0		DEAEHN
NC(=O)[C@@]1(N)CC[C@H](Sc2ccc(Br)cc2)C1	ZINC000093848878	193317165	/nfs/dbraw/zinc/31/71/65/193317165.db2.gz	YIKXJFQGDZORSE-CMPLNLGQSA-N	0	3	315.236	2.277	10	0		DEAEHN
CN[C@]1(C(N)=O)CC[C@H](Sc2nc3ccccc3s2)C1	ZINC000093849277	193317998	/nfs/dbraw/zinc/31/79/98/193317998.db2.gz	WYQPCHNPQQETFG-LKFCYVNXSA-N	0	3	307.444	2.384	10	0		DEAEHN
CN1CCC[C@@H]1CNC(=O)c1cccc(C(=O)OC(C)(C)C)c1	ZINC000094135135	193346157	/nfs/dbraw/zinc/34/61/57/193346157.db2.gz	DHRHDWHLQDHVNE-OAHLLOKOSA-N	0	3	318.417	2.466	10	0		DEAEHN
CN(C)C1([C@H](O)[C@H]2CCC[C@H](S(C)(=O)=O)C2)CCCCC1	ZINC000094641360	193389160	/nfs/dbraw/zinc/38/91/60/193389160.db2.gz	DLUILSXPPPSRRH-SOUVJXGZSA-N	0	3	317.495	2.215	10	0		DEAEHN
CCNCc1c(C)nn([C@H]2CCC[C@@H](S(C)(=O)=O)C2)c1C	ZINC000094643984	193389978	/nfs/dbraw/zinc/38/99/78/193389978.db2.gz	BRGCSZQZOQXFBE-UONOGXRCSA-N	0	3	313.467	2.138	10	0		DEAEHN
CCOC(=O)[C@@]1(NCCN(CC)CC)CSCC(C)(C)C1	ZINC000094490020	193373584	/nfs/dbraw/zinc/37/35/84/193373584.db2.gz	QUEGDVXFXPWMIH-INIZCTEOSA-N	0	3	316.511	2.383	10	0		DEAEHN
CCCN[C@H](c1cc(Cl)cnc1N)[C@H]1CSCCO1	ZINC000094504392	193374691	/nfs/dbraw/zinc/37/46/91/193374691.db2.gz	XTMWSOBOLCJZQG-VXGBXAGGSA-N	0	3	301.843	2.490	10	0		DEAEHN
CCNCCS(=O)(=O)NC12CC3C[C@@](C)(C1)C[C@](C)(C3)C2	ZINC000094545319	193378546	/nfs/dbraw/zinc/37/85/46/193378546.db2.gz	GJZWCULDVHWJGV-IRHLINNNSA-N	0	3	314.495	2.264	10	0		DEAEHN
Cc1ccsc1CNS(=O)(=O)c1ccc(C)c(CN)c1	ZINC000094886828	193404990	/nfs/dbraw/zinc/40/49/90/193404990.db2.gz	KEJRJFKKFCNPMF-UHFFFAOYSA-N	0	3	310.444	2.302	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)CCN2CCC([C@@H](C)O)CC2)cc1	ZINC000264714196	204095927	/nfs/dbraw/zinc/09/59/27/204095927.db2.gz	LNQBFRGRDIHTSY-CQSZACIVSA-N	0	3	318.417	2.311	10	0		DEAEHN
CN(C)C[C@@H]1C[C@@H](O)CN1Cc1ccc(Cl)c(Cl)c1	ZINC000097263836	193702051	/nfs/dbraw/zinc/70/20/51/193702051.db2.gz	JFCOKHTVHFUSCS-NWDGAFQWSA-N	0	3	303.233	2.490	10	0		DEAEHN
CN[C@H](c1csc(C)n1)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000097312689	193706766	/nfs/dbraw/zinc/70/67/66/193706766.db2.gz	MXFMDWYRZWUNNS-MDZLAQPJSA-N	0	3	302.465	2.315	10	0		DEAEHN
Cn1ncc(Br)c1[C@@H](N)[C@@H]1COc2ccccc21	ZINC000161953750	197532329	/nfs/dbraw/zinc/53/23/29/197532329.db2.gz	BOXNRDWXESNPOF-SKDRFNHKSA-N	0	3	308.179	2.359	10	0		DEAEHN
N[C@@H]1CCC(=O)N[C@@H]1c1ccc(Br)cc1Cl	ZINC000161117786	197466864	/nfs/dbraw/zinc/46/68/64/197466864.db2.gz	MJLSSDFYGCMECD-MWLCHTKSSA-N	0	3	303.587	2.381	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2ccc(OC(F)F)cc2)C[C@H](C)O1	ZINC000020081636	182184997	/nfs/dbraw/zinc/18/49/97/182184997.db2.gz	ZUOUGDPMBANCCL-WDMOLILDSA-N	0	3	300.349	2.397	10	0		DEAEHN
CC[C@H](CO)[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000020194436	182196017	/nfs/dbraw/zinc/19/60/17/182196017.db2.gz	NAOCUGPGCOVODP-SECBINFHSA-N	0	3	304.184	2.024	10	0		DEAEHN
C[C@@H](CNC(=O)NCC1CCCCCC1)CN1CCN(C)CC1	ZINC000454626973	246002017	/nfs/dbraw/zinc/00/20/17/246002017.db2.gz	UJLYHBOPFGACHW-INIZCTEOSA-N	0	3	324.513	2.140	10	0		DEAEHN
C[C@@H]1CCc2nn(CC(=O)NCCN3CCCCCC3)cc2C1	ZINC000020865885	182250865	/nfs/dbraw/zinc/25/08/65/182250865.db2.gz	ZAMHMFZUVSTOTL-OAHLLOKOSA-N	0	3	318.465	2.000	10	0		DEAEHN
CNCc1cc(Br)ccc1O[C@H]1CCC[C@H]1O	ZINC000037702799	182919000	/nfs/dbraw/zinc/91/90/00/182919000.db2.gz	DANUIGFFRBPMBB-YPMHNXCESA-N	0	3	300.196	2.461	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2ccc(OC(F)F)c(Cl)c2)C1	ZINC000040850845	183142223	/nfs/dbraw/zinc/14/22/23/183142223.db2.gz	HYNYFFDVJNESSD-PSASIEDQSA-N	0	3	320.723	2.257	10	0		DEAEHN
Cc1nc2c(C)cccn2c1CC(=O)N(C)C1CCN(C)CC1	ZINC000041292513	183183429	/nfs/dbraw/zinc/18/34/29/183183429.db2.gz	PEWYKZNBYYHNQE-UHFFFAOYSA-N	0	3	314.433	2.046	10	0		DEAEHN
CCN(CCO)CC[C@@H](O)c1ccc(Br)cc1	ZINC000041145259	183176073	/nfs/dbraw/zinc/17/60/73/183176073.db2.gz	WWQCBSGWLBXCBV-CYBMUJFWSA-N	0	3	302.212	2.187	10	0		DEAEHN
CN1CCN(CC[C@@H](O)c2ccc(Br)cc2)CC1	ZINC000041145247	183176278	/nfs/dbraw/zinc/17/62/78/183176278.db2.gz	TUGWQWPWICJIBY-CQSZACIVSA-N	0	3	313.239	2.120	10	0		DEAEHN
CCc1ccccc1NC(=O)C(=O)NCCN1CCCC[C@H]1C	ZINC000041665296	183213083	/nfs/dbraw/zinc/21/30/83/183213083.db2.gz	VDVPDLLEEGDXJE-CQSZACIVSA-N	0	3	317.433	2.178	10	0		DEAEHN
CNCc1c(N(CCOC)[C@H](C)C2CC2)nc2sccn12	ZINC000042681020	183296281	/nfs/dbraw/zinc/29/62/81/183296281.db2.gz	CHTOREOBQLGEBJ-LLVKDONJSA-N	0	3	308.451	2.367	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)s1)N(C)CC(=O)N(C)C	ZINC000043252472	183346721	/nfs/dbraw/zinc/34/67/21/183346721.db2.gz	PPLMIWKALMMJBZ-ZANVPECISA-N	0	3	303.859	2.200	10	0		DEAEHN
CC[C@H](N)[C@@H](c1sccc1C)N1CCCC[C@@H]1C(=O)NC	ZINC000043248708	183346795	/nfs/dbraw/zinc/34/67/95/183346795.db2.gz	XKHAEGZQYTWBNT-MJBXVCDLSA-N	0	3	309.479	2.435	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)s1)N(CC(N)=O)C(C)C	ZINC000043253846	183348219	/nfs/dbraw/zinc/34/82/19/183348219.db2.gz	DCPYARSVOUEUML-RNCFNFMXSA-N	0	3	303.859	2.376	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccc(Cl)s1)N1CCC(CC(N)=O)CC1	ZINC000043253804	183348297	/nfs/dbraw/zinc/34/82/97/183348297.db2.gz	JGILHOOHGFCPBL-XPTSAGLGSA-N	0	3	315.870	2.377	10	0		DEAEHN
NC[C@H](c1cc(Br)cs1)N1CCC(CO)CC1	ZINC000043285133	183350203	/nfs/dbraw/zinc/35/02/03/183350203.db2.gz	BDGQIKRACZLTEO-LLVKDONJSA-N	0	3	319.268	2.215	10	0		DEAEHN
CCN[C@@H](c1ccccc1OC(F)F)[C@@H]1CCS(=O)(=O)C1	ZINC000043300989	183352346	/nfs/dbraw/zinc/35/23/46/183352346.db2.gz	FXBAYXMNLLMVBH-ZWNOBZJWSA-N	0	3	319.373	2.373	10	0		DEAEHN
CC(C)N(CCO)[C@@H](CN)c1ccccc1Br	ZINC000043093282	183336494	/nfs/dbraw/zinc/33/64/94/183336494.db2.gz	PAQOGXAWLQCZNU-ZDUSSCGKSA-N	0	3	301.228	2.152	10	0		DEAEHN
CCOC(=O)CCCN1CCC(C(=O)N[C@H](C)C(C)C)CC1	ZINC000102400189	193884816	/nfs/dbraw/zinc/88/48/16/193884816.db2.gz	ORUKYPSOERSBPQ-CQSZACIVSA-N	0	3	312.454	2.202	10	0		DEAEHN
CC(C)(CNC(=O)N1CCN2CCCC[C@H]2C1)N1CCCCC1	ZINC000105081527	194070005	/nfs/dbraw/zinc/07/00/05/194070005.db2.gz	XRMNWEAPYVEAOK-INIZCTEOSA-N	0	3	322.497	2.131	10	0		DEAEHN
Cc1ccccc1CNC(=O)[C@H]1CCO[C@@H]1C1CCN(C)CC1	ZINC000284821209	218191840	/nfs/dbraw/zinc/19/18/40/218191840.db2.gz	UYEMWEHQICKMNV-ZWKOTPCHSA-N	0	3	316.445	2.358	10	0		DEAEHN
CN(CCOc1ccccc1)[C@@H]1CCCN(c2cccnn2)C1	ZINC000105802630	194132497	/nfs/dbraw/zinc/13/24/97/194132497.db2.gz	PCMGTFBEOUYOCI-MRXNPFEDSA-N	0	3	312.417	2.456	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)N[C@H](C)c2ccccc2)c1	ZINC000105881139	194155052	/nfs/dbraw/zinc/15/50/52/194155052.db2.gz	JEZRIUSDAUJFGW-CABCVRRESA-N	0	3	300.406	2.047	10	0		DEAEHN
CC[C@H]1CN(CCOc2c(C)cccc2C)CCN1C[C@@H](C)O	ZINC000105912969	194169135	/nfs/dbraw/zinc/16/91/35/194169135.db2.gz	LCICMSVQOPPRNS-MSOLQXFVSA-N	0	3	320.477	2.459	10	0		DEAEHN
CCOc1ccc(CNC(=O)NC[C@H]2CCCN2C)cc1F	ZINC000106335535	194198586	/nfs/dbraw/zinc/19/85/86/194198586.db2.gz	LEUAVJXVBRTFSE-CYBMUJFWSA-N	0	3	309.385	2.118	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@H]1SCCc2sccc21	ZINC000533815016	284808684	/nfs/dbraw/zinc/80/86/84/284808684.db2.gz	KJAJAALUGZNZOA-AWEZNQCLSA-N	0	3	319.455	2.124	10	0		DEAEHN
CC[C@@H](C(N)=S)N1CCN(Cc2cc(C)cc(C)c2)CC1	ZINC000109469493	194266559	/nfs/dbraw/zinc/26/65/59/194266559.db2.gz	VVLWDXCLKUHJDC-INIZCTEOSA-N	0	3	305.491	2.486	10	0		DEAEHN
COC[C@@H](N)Cc1nc(-c2ccc(Br)cc2)no1	ZINC000109503320	194270256	/nfs/dbraw/zinc/27/02/56/194270256.db2.gz	JEGHOIQHDPJINC-JTQLQIEISA-N	0	3	312.167	2.015	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1ccc(C)cc1F	ZINC000110085717	194308763	/nfs/dbraw/zinc/30/87/63/194308763.db2.gz	WZRXKTHUYLLWTM-ZDUSSCGKSA-N	0	3	309.385	2.366	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)s1)N1CCNC(=O)C1(C)C	ZINC000110653439	194346930	/nfs/dbraw/zinc/34/69/30/194346930.db2.gz	VOGLDRVZSSVPFY-JOYOIKCWSA-N	0	3	315.870	2.390	10	0		DEAEHN
C[C@H]1CN([C@@H](CN)c2ccccc2C(F)(F)F)CCN1C	ZINC000110708494	194352817	/nfs/dbraw/zinc/35/28/17/194352817.db2.gz	MWVIDJVQTGBFOT-FZMZJTMJSA-N	0	3	301.356	2.341	10	0		DEAEHN
CN[C@H](CCN1CCOCC1)c1ccccc1Br	ZINC000054015560	183920183	/nfs/dbraw/zinc/92/01/83/183920183.db2.gz	XOOXTIULZVPTNF-CQSZACIVSA-N	0	3	313.239	2.432	10	0		DEAEHN
CN(CC1CCOCC1)[C@@H](CN)c1cc(F)c(F)c(F)c1	ZINC000111159909	194398167	/nfs/dbraw/zinc/39/81/67/194398167.db2.gz	SNPAFLHBTWRZPN-AWEZNQCLSA-N	0	3	302.340	2.462	10	0		DEAEHN
CCNCc1cccc(Br)c1O[C@@H](CC)C(N)=O	ZINC000061675986	184181684	/nfs/dbraw/zinc/18/16/84/184181684.db2.gz	JKUDBJSJBODUTP-NSHDSACASA-N	0	3	315.211	2.201	10	0		DEAEHN
CC[C@H](Oc1ccc(Br)cc1[C@@H](C)NC)C(N)=O	ZINC000061676072	184181922	/nfs/dbraw/zinc/18/19/22/184181922.db2.gz	BJXHBNBKGDMTNX-KCJUWKMLSA-N	0	3	315.211	2.372	10	0		DEAEHN
CN(C)C[C@@H](O)CNc1cc(Br)ccc1Cl	ZINC000061691229	184183127	/nfs/dbraw/zinc/18/31/27/184183127.db2.gz	BAUALOSCFDYIEE-VIFPVBQESA-N	0	3	307.619	2.437	10	0		DEAEHN
COc1ccc(Br)cc1[C@H](N)C[C@@H](C)CC(N)=O	ZINC000061830214	184188892	/nfs/dbraw/zinc/18/88/92/184188892.db2.gz	ZDUJJEUIJNGLAD-LDYMZIIASA-N	0	3	315.211	2.359	10	0		DEAEHN
NC[C@H](c1ccc(F)c(Br)c1)N1CCCOCC1	ZINC000061916546	184195001	/nfs/dbraw/zinc/19/50/01/184195001.db2.gz	XZGWKGBGXAJZOS-CYBMUJFWSA-N	0	3	317.202	2.310	10	0		DEAEHN
CC(C)[NH2+][C@@](C)(CCCCN1CCCO[C@@H](C)C1)C(=O)[O-]	ZINC000061933431	184196841	/nfs/dbraw/zinc/19/68/41/184196841.db2.gz	OEDHKNLYJBGTTQ-HOCLYGCPSA-N	0	3	300.443	2.109	10	0		DEAEHN
COCCCN(C)[C@H](CN)c1ccccc1Br	ZINC000062029318	184202236	/nfs/dbraw/zinc/20/22/36/184202236.db2.gz	DSKLTLJJQIQRPM-CYBMUJFWSA-N	0	3	301.228	2.417	10	0		DEAEHN
C[C@H](Cc1ccccc1)NS(=O)(=O)c1ccccc1CN	ZINC000062187551	184216804	/nfs/dbraw/zinc/21/68/04/184216804.db2.gz	RECPYSSPBMHQFX-CYBMUJFWSA-N	0	3	304.415	2.055	10	0		DEAEHN
COc1cccc(CNC(C)(C)C)c1OCCS(C)(=O)=O	ZINC000062732193	184251031	/nfs/dbraw/zinc/25/10/31/184251031.db2.gz	XRWNJWZFTQKPEA-UHFFFAOYSA-N	0	3	315.435	2.007	10	0		DEAEHN
CCN[C@@H](CCSc1cccc(Br)c1)C(N)=O	ZINC000062604194	184244798	/nfs/dbraw/zinc/24/47/98/184244798.db2.gz	MEPTUTAGMYLBGB-NSHDSACASA-N	0	3	317.252	2.395	10	0		DEAEHN
c1ccc(C[C@H]2CSC(N[C@H]3CN4CCC3CC4)=N2)cc1	ZINC000063220251	184279340	/nfs/dbraw/zinc/27/93/40/184279340.db2.gz	KCLIKTGYUCMWBH-HOTGVXAUSA-N	0	3	301.459	2.384	10	0		DEAEHN
CN(C)[C@H]1CCN(CC(=O)c2sccc2Br)C1	ZINC000062966753	184262919	/nfs/dbraw/zinc/26/29/19/184262919.db2.gz	HYNLCCDGVTZLEF-VIFPVBQESA-N	0	3	317.252	2.329	10	0		DEAEHN
Nc1ncc(C(=O)N2CC[C@@H](N3CCCCC3)C2)cc1Cl	ZINC000062984979	184265121	/nfs/dbraw/zinc/26/51/21/184265121.db2.gz	PZDGKBXBHIAFDI-GFCCVEGCSA-N	0	3	308.813	2.018	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1cc(C)c(Cl)cc1OC	ZINC000159092902	197327027	/nfs/dbraw/zinc/32/70/27/197327027.db2.gz	YAPGYVXHMKOYGO-NSHDSACASA-N	0	3	300.786	2.349	10	0		DEAEHN
CNCC(=O)Nc1cccc(C(=O)N[C@H](C)c2ccccc2)c1	ZINC000066225866	184397722	/nfs/dbraw/zinc/39/77/22/184397722.db2.gz	FLWMVJAVDQZOCM-CYBMUJFWSA-N	0	3	311.385	2.336	10	0		DEAEHN
COc1cccc(SC[C@](NC(C)C)(C(N)=O)C2CC2)c1	ZINC000069186410	184503224	/nfs/dbraw/zinc/50/32/24/184503224.db2.gz	LVSSWBHGGQDVEW-MRXNPFEDSA-N	0	3	308.447	2.419	10	0		DEAEHN
O=S1(=O)CC[C@H](N[C@H]2CCO[C@H](C3CC3)C2)c2ccccc21	ZINC000186415127	285071111	/nfs/dbraw/zinc/07/11/11/285071111.db2.gz	GAOOTMWSRJDSKK-BPUTZDHNSA-N	0	3	321.442	2.452	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)c1cc(-c2ccncc2)on1	ZINC000120141640	195104635	/nfs/dbraw/zinc/10/46/35/195104635.db2.gz	AKDKQZKNROBDKB-ZDUSSCGKSA-N	0	3	314.389	2.341	10	0		DEAEHN
CN1CCN([C@@H](CN)c2cc(F)cc(C(F)(F)F)c2)CC1	ZINC000159275571	197341350	/nfs/dbraw/zinc/34/13/50/197341350.db2.gz	XCODERNEAPBHJN-ZDUSSCGKSA-N	0	3	305.319	2.092	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2CCCC2)cc(C)c1F	ZINC000159047669	197321485	/nfs/dbraw/zinc/32/14/85/197321485.db2.gz	KMRKKUZFKNXMFH-UHFFFAOYSA-N	0	3	300.399	2.028	10	0		DEAEHN
O=C1NCCCC[C@@H]1N1CCC(Nc2ccccc2F)CC1	ZINC000120233555	195124519	/nfs/dbraw/zinc/12/45/19/195124519.db2.gz	PUEGCYUODPKSKD-INIZCTEOSA-N	0	3	305.397	2.371	10	0		DEAEHN
O=C(NCCNc1ccncc1)Nc1ccc2c(c1)C(=O)CCC2	ZINC000540919891	285138135	/nfs/dbraw/zinc/13/81/35/285138135.db2.gz	HWQTWPWPYORFSE-UHFFFAOYSA-N	0	3	324.384	2.256	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)[C@@H](C)N)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000158200093	197252536	/nfs/dbraw/zinc/25/25/36/197252536.db2.gz	SZUYHMYZKJBIJM-FZQKWOKYSA-N	0	3	313.804	2.078	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2ccccc2O[C@@H]2CCOC2)C1	ZINC000120300085	195138479	/nfs/dbraw/zinc/13/84/79/195138479.db2.gz	NUPYAMOTQOQFTL-ZIAGYGMSSA-N	0	3	319.405	2.022	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1[C@@H](O)C1(C)CC1	ZINC000157817611	197217987	/nfs/dbraw/zinc/21/79/87/197217987.db2.gz	XVTNYVXCHPYXMW-LLVKDONJSA-N	0	3	302.216	2.041	10	0		DEAEHN
CCOCCN(C)[C@@H](CN)c1ccc(Br)cc1	ZINC000157720644	197209812	/nfs/dbraw/zinc/20/98/12/197209812.db2.gz	VHPWGBSVSUSVIU-ZDUSSCGKSA-N	0	3	301.228	2.417	10	0		DEAEHN
CCCN[C@](C)(C[C@H](C)N(C)CCOCC)C(=O)OCC	ZINC000157474486	197189597	/nfs/dbraw/zinc/18/95/97/197189597.db2.gz	OWVMEWMTOGJCAC-GOEBONIOSA-N	0	3	302.459	2.055	10	0		DEAEHN
COC[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccccc1)C1CC1	ZINC000157208567	197170012	/nfs/dbraw/zinc/17/00/12/197170012.db2.gz	JZNMFHJOMWLISF-JKSUJKDBSA-N	0	3	305.422	2.014	10	0		DEAEHN
Cc1ccc([C@H](C)NC(=O)N2CCO[C@@H](CN(C)C)C2)cc1F	ZINC000156805930	197142110	/nfs/dbraw/zinc/14/21/10/197142110.db2.gz	QHOTWRVZYUSHBI-ZFWWWQNUSA-N	0	3	323.412	2.167	10	0		DEAEHN
C[C@](O)(Cc1cccc(C(F)(F)F)c1)C[C@@H]1COCCN1	ZINC000156777999	197140653	/nfs/dbraw/zinc/14/06/53/197140653.db2.gz	XODUCFHAOXANQH-KGLIPLIRSA-N	0	3	303.324	2.377	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)C(=O)Nc2ccccc2Cl)CCN1C	ZINC000120621896	195203373	/nfs/dbraw/zinc/20/33/73/195203373.db2.gz	KTHPQZRUKXNRRM-NWDGAFQWSA-N	0	3	323.824	2.220	10	0		DEAEHN
Cc1ccc(F)cc1NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000120626404	195203629	/nfs/dbraw/zinc/20/36/29/195203629.db2.gz	QTYGVKLJQHGGJI-OCCSQVGLSA-N	0	3	321.396	2.014	10	0		DEAEHN
Cc1noc(C[C@@]23COC[C@@H]2CN(Cc2ccsc2)C3)n1	ZINC000247972322	257113130	/nfs/dbraw/zinc/11/31/30/257113130.db2.gz	STWDBRFILGKICT-DZGCQCFKSA-N	0	3	305.403	2.131	10	0		DEAEHN
O=C1[C@@H]2CN(Cc3ccoc3)C[C@H]2CCN1Cc1cccnc1	ZINC000247712575	257117917	/nfs/dbraw/zinc/11/79/17/257117917.db2.gz	KXVRCCDITZPYBK-IAGOWNOFSA-N	0	3	311.385	2.155	10	0		DEAEHN
O=C(NCC1CC1)[C@@H]1CN(Cc2ccsc2)C[C@@H]2OCC[C@@H]21	ZINC000247494530	257119196	/nfs/dbraw/zinc/11/91/96/257119196.db2.gz	NREZRYSYLQELAQ-OAGGEKHMSA-N	0	3	320.458	2.111	10	0		DEAEHN
C[C@@H]1CCOCCN1CCC(=O)N1CCc2ccccc2C1	ZINC000364614128	404471252	/nfs/dbraw/zinc/47/12/52/404471252.db2.gz	PUQWRQHCOPLALI-OAHLLOKOSA-N	0	3	302.418	2.072	10	0		DEAEHN
CC(C)OC[C@H](O)COc1ccc(Br)c(CN)c1	ZINC000128032061	195930616	/nfs/dbraw/zinc/93/06/16/195930616.db2.gz	XEXGPCIGVKVBJR-NSHDSACASA-N	0	3	318.211	2.073	10	0		DEAEHN
COc1ccc2ccccc2c1CN1CCN(CCO)[C@@H](C)C1	ZINC000190249841	533338566	/nfs/dbraw/zinc/33/85/66/533338566.db2.gz	TZKHSZSAIWJWCQ-HNNXBMFYSA-N	0	3	314.429	2.347	10	0		DEAEHN
CCN1CC[C@H](N(C)C(=O)c2cn(CCC(C)C)nn2)[C@H](C)C1	ZINC000122240177	132162314	/nfs/dbraw/zinc/16/23/14/132162314.db2.gz	TUYXTGATMSWZLO-ZBFHGGJFSA-N	0	3	321.469	2.127	10	0		DEAEHN
Cc1ccc([C@@H]2CN(C(=O)C3CCN(C4CC4)CC3)CCO2)o1	ZINC000194806682	132541583	/nfs/dbraw/zinc/54/15/83/132541583.db2.gz	RSCIINAZFSEHHI-KRWDZBQOSA-N	0	3	318.417	2.362	10	0		DEAEHN
Cc1cc(-c2nc([C@H]3CNCCN3C)no2)c2ccccc2n1	ZINC000263245761	132579305	/nfs/dbraw/zinc/57/93/05/132579305.db2.gz	PGKUUJDHUQEQAD-OAHLLOKOSA-N	0	3	309.373	2.169	10	0		DEAEHN
CN1CCNC[C@H]1c1noc([C@@]2(C)CCc3ccccc3C2)n1	ZINC000263316727	132582065	/nfs/dbraw/zinc/58/20/65/132582065.db2.gz	ZNQQNEMVVPYUSU-YJBOKZPZSA-N	0	3	312.417	2.092	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NC[C@@H](C)Oc1cccc(OC)c1	ZINC000359606295	133134138	/nfs/dbraw/zinc/13/41/38/133134138.db2.gz	WFZHUJFFUJERRM-RHSMWYFYSA-N	0	3	320.433	2.453	10	0		DEAEHN
Cc1ccc(NC(=O)c2cccc3ncnn32)c(CN(C)C)c1	ZINC000359812421	133146636	/nfs/dbraw/zinc/14/66/36/133146636.db2.gz	RCMTVUARIBXKEU-UHFFFAOYSA-N	0	3	309.373	2.352	10	0		DEAEHN
CC1(C)C[C@@H](NCc2cccc(N3CCOCC3)n2)C(C)(C)O1	ZINC000360009670	133157028	/nfs/dbraw/zinc/15/70/28/133157028.db2.gz	AHBQVZYCMLQBAM-OAHLLOKOSA-N	0	3	319.449	2.354	10	0		DEAEHN
C[C@@H]1C[C@@H]1CNC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000360430296	133181844	/nfs/dbraw/zinc/18/18/44/133181844.db2.gz	PGUDDGAWAZSUHW-YALNPMBYSA-N	0	3	301.434	2.462	10	0		DEAEHN
c1ccc(OC[C@H]2CN(CCN3CCCCC3)CCO2)cc1	ZINC000361987711	133203153	/nfs/dbraw/zinc/20/31/53/133203153.db2.gz	UJBDWSWZRYOFAE-GOSISDBHSA-N	0	3	304.434	2.252	10	0		DEAEHN
COC(=O)CN(C)C(=O)CCN1CC[C@H](C)C[C@@H]1c1ccco1	ZINC000362462645	133231790	/nfs/dbraw/zinc/23/17/90/133231790.db2.gz	GWPWPICEGALJDU-UONOGXRCSA-N	0	3	322.405	2.074	10	0		DEAEHN
Fc1ccccc1OCCN1CCCC[C@H]1CN1CCOCC1	ZINC000109819210	144629285	/nfs/dbraw/zinc/62/92/85/144629285.db2.gz	UXPUUXXCJCAJBK-INIZCTEOSA-N	0	3	322.424	2.391	10	0		DEAEHN
Cc1cc(Cl)ccc1OCCCNC(=O)[C@H]1C[C@H](F)CN1	ZINC000188431183	145012135	/nfs/dbraw/zinc/01/21/35/145012135.db2.gz	JQFORWNAOULTDW-QWHCGFSZSA-N	0	3	314.788	2.234	10	0		DEAEHN
C[C@H]1CC[C@H](CN2CCCN(Cc3noc(C4CC4)n3)CC2)O1	ZINC000190525274	145043711	/nfs/dbraw/zinc/04/37/11/145043711.db2.gz	TXHVSGALOYFZHP-DZGCQCFKSA-N	0	3	320.437	2.022	10	0		DEAEHN
O[C@@H](CC1CCCC1)CN1CCC(Nc2cccnn2)CC1	ZINC000191333942	145056283	/nfs/dbraw/zinc/05/62/83/145056283.db2.gz	YLVSMMJHBRPYHW-INIZCTEOSA-N	0	3	304.438	2.294	10	0		DEAEHN
COc1ccc(C[C@@H](C)CN2CCCN(C)C(=O)C2)cc1F	ZINC000191664376	145062101	/nfs/dbraw/zinc/06/21/01/145062101.db2.gz	RDSQPSAHKHGHTA-CYBMUJFWSA-N	0	3	308.397	2.177	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2n[nH]c3c2CCCCC3)CCN1C	ZINC000191856262	145066146	/nfs/dbraw/zinc/06/61/46/145066146.db2.gz	ZMXORJQSPBNZTG-CHWSQXEVSA-N	0	3	304.438	2.233	10	0		DEAEHN
C[C@@H](NC(=O)N1CCC(CN2CCN(C)CC2)CC1)C(C)(C)C	ZINC000192182278	145071321	/nfs/dbraw/zinc/07/13/21/145071321.db2.gz	GXXXBGBHAFWZJH-OAHLLOKOSA-N	0	3	324.513	2.090	10	0		DEAEHN
CCOC(=O)[C@@H](C)[C@@H](C)NCc1ccc2c(c1)sc(=O)n2C	ZINC000192720527	145077788	/nfs/dbraw/zinc/07/77/88/145077788.db2.gz	AMKFGMAYSHIAAF-WDEREUQCSA-N	0	3	322.430	2.277	10	0		DEAEHN
Cc1csc2c1ncnc2N[C@H](C)CCN1CCN(C)CC1	ZINC000192779323	145079180	/nfs/dbraw/zinc/07/91/80/145079180.db2.gz	PFTUTMLXVPZEMG-CYBMUJFWSA-N	0	3	319.478	2.438	10	0		DEAEHN
C[C@H](N[C@@H](C)[C@H]1CCCO1)C(=O)NCCc1ccc(F)cc1	ZINC000193128692	145082958	/nfs/dbraw/zinc/08/29/58/145082958.db2.gz	WMHQSRWFQYLASL-HEHGZKQESA-N	0	3	308.397	2.030	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](N[C@@H](C(=O)NC2CC2)c2ccccc2)C1	ZINC000246300466	145097701	/nfs/dbraw/zinc/09/77/01/145097701.db2.gz	VFGACBOMCKLDIW-FHLIZLRMSA-N	0	3	315.461	2.325	10	0		DEAEHN
Cc1ccc(NC(=O)[C@H](C)N2CCN3CCC[C@H]3C2)cc1C	ZINC000246367673	145100116	/nfs/dbraw/zinc/10/01/16/145100116.db2.gz	NTROCMZVJVNXNO-RDJZCZTQSA-N	0	3	301.434	2.410	10	0		DEAEHN
C[C@@H](C(=O)NCc1ccc(Cl)cc1)N1CCN2CCC[C@H]2C1	ZINC000246391706	145101310	/nfs/dbraw/zinc/10/13/10/145101310.db2.gz	PIVXPNPRNFTMSG-BBRMVZONSA-N	0	3	321.852	2.125	10	0		DEAEHN
Cn1cc([C@H]2CCN([C@@H](C(=O)NC3CC3)c3ccccc3)C2)cn1	ZINC000246822400	145115611	/nfs/dbraw/zinc/11/56/11/145115611.db2.gz	CAJKHLSXGNXGPO-MAUKXSAKSA-N	0	3	324.428	2.229	10	0		DEAEHN
C[C@H](C(=O)N1CCc2ccccc21)N1CC[C@H]2OCCC[C@H]2C1	ZINC000246941937	145120478	/nfs/dbraw/zinc/12/04/78/145120478.db2.gz	WWCNXIOCGXQZOV-UWWQBHOKSA-N	0	3	314.429	2.465	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)[C@H](C)Sc2ccccn2)C1	ZINC000247044844	145124611	/nfs/dbraw/zinc/12/46/11/145124611.db2.gz	IDAMVOPVYAMWHF-MELADBBJSA-N	0	3	307.463	2.407	10	0		DEAEHN
O=C(NC[C@@H]1CCOc2ccccc21)N1CCN2CCC[C@H]2C1	ZINC000247235221	145129889	/nfs/dbraw/zinc/12/98/89/145129889.db2.gz	DHBRXNQQOMPBPE-GJZGRUSLSA-N	0	3	315.417	2.042	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)CSC[C@H]2CCCCO2)C1	ZINC000247342180	145134234	/nfs/dbraw/zinc/13/42/34/145134234.db2.gz	NPOYFLMVGMHTNO-KFWWJZLASA-N	0	3	314.495	2.134	10	0		DEAEHN
Cc1ccc(C[C@H](C)NC(=O)N2CCN3CCC[C@H]3C2)s1	ZINC000247401697	145136205	/nfs/dbraw/zinc/13/62/05/145136205.db2.gz	RLHXTRJEVSPBGO-JSGCOSHPSA-N	0	3	307.463	2.477	10	0		DEAEHN
C[C@H](C(=O)N1CCC(c2cc[nH]n2)CC1)N1[C@H](C)CC[C@H]1C	ZINC000247422638	145136661	/nfs/dbraw/zinc/13/66/61/145136661.db2.gz	VAAZYIQFQIVCCD-MGPQQGTHSA-N	0	3	304.438	2.377	10	0		DEAEHN
C[C@H](NCC(=O)N[C@H](c1ccccc1)C1CC1)[C@H]1CCCO1	ZINC000248597295	145160967	/nfs/dbraw/zinc/16/09/67/145160967.db2.gz	MTHKOMXLSMRGMF-FDQGKXFDSA-N	0	3	302.418	2.411	10	0		DEAEHN
Cc1cc(=O)[n-]c([C@H](C)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C(C)C)n1	ZINC000248774917	145166670	/nfs/dbraw/zinc/16/66/70/145166670.db2.gz	UDUYOSRBZHTIEB-ZNMIVQPWSA-N	0	3	304.438	2.499	10	0		DEAEHN
Cc1cc(=O)[n-]c([C@H](C)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)n1	ZINC000248774917	145166671	/nfs/dbraw/zinc/16/66/71/145166671.db2.gz	UDUYOSRBZHTIEB-ZNMIVQPWSA-N	0	3	304.438	2.499	10	0		DEAEHN
O=C1O[C@@H](CN2CC[C@@H](Oc3cccnc3)C2)CC12CCC2	ZINC000248828684	145169522	/nfs/dbraw/zinc/16/95/22/145169522.db2.gz	HPXGJGKAUMHQLG-HUUCEWRRSA-N	0	3	302.374	2.021	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@](C)(Cc1ccccc1)[C@H](C)O)N(C)C	ZINC000248853766	145170248	/nfs/dbraw/zinc/17/02/48/145170248.db2.gz	CVPCLDBAIPKEDZ-WDYCEAGBSA-N	0	3	320.477	2.463	10	0		DEAEHN
C[C@@H](NC(=O)[C@H]1CCOC[C@H]1C)[C@@H](c1ccccc1)N(C)C	ZINC000248840049	145170406	/nfs/dbraw/zinc/17/04/06/145170406.db2.gz	FNVPUIMISCJKLL-JHNDHUHGSA-N	0	3	304.434	2.467	10	0		DEAEHN
COc1ccc(C[C@@H](C)CN2CCO[C@@H](CN(C)C)C2)cc1F	ZINC000248873485	145171560	/nfs/dbraw/zinc/17/15/60/145171560.db2.gz	LAWNXUJGOYIKTD-ZBFHGGJFSA-N	0	3	324.440	2.275	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2cncn2C)[C@H]1Oc1ccccc1	ZINC000249463077	145184833	/nfs/dbraw/zinc/18/48/33/145184833.db2.gz	ROHQRAHOVBYPBU-GVDBMIGSSA-N	0	3	301.390	2.135	10	0		DEAEHN
CCN(CC)C(=O)[C@H](C)N1CC[C@@H](CNc2ccccn2)C1	ZINC000249898726	145192145	/nfs/dbraw/zinc/19/21/45/145192145.db2.gz	SIVTTZCUNSJKGQ-GJZGRUSLSA-N	0	3	304.438	2.072	10	0		DEAEHN
COc1c(Cl)cc(NC(=O)C2(N)CCOCC2)cc1Cl	ZINC000261668272	145215028	/nfs/dbraw/zinc/21/50/28/145215028.db2.gz	BPSOJYZVLHEMPU-UHFFFAOYSA-N	0	3	319.188	2.448	10	0		DEAEHN
c1cncc([C@@H]2CNCCN2Cc2ccc(N3CCCC3)nc2)c1	ZINC000261810229	145229329	/nfs/dbraw/zinc/22/93/29/145229329.db2.gz	MMIIUMTZIBIHCU-SFHVURJKSA-N	0	3	323.444	2.223	10	0		DEAEHN
Cc1cccc(CNC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)c1	ZINC000261983533	145250365	/nfs/dbraw/zinc/25/03/65/145250365.db2.gz	ASIWEZPAVYQBTK-HDMKZQKVSA-N	0	3	302.418	2.144	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)Nc1cccc(F)c1F	ZINC000262505692	145289148	/nfs/dbraw/zinc/28/91/48/145289148.db2.gz	MKMUOXCVWOPJPC-FMGDLQRFSA-N	0	3	310.344	2.436	10	0		DEAEHN
COc1cccc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000262504450	145289195	/nfs/dbraw/zinc/28/91/95/145289195.db2.gz	MIGXXBWNARESKH-JKIFEVAISA-N	0	3	304.390	2.166	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N1Cc2ccccc2C1	ZINC000262544605	145291974	/nfs/dbraw/zinc/29/19/74/145291974.db2.gz	RPCQTKDBGKMILX-DAYGRLMNSA-N	0	3	300.402	2.061	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(C(C)(C)Cc2ccccc2)n1	ZINC000263155691	145330203	/nfs/dbraw/zinc/33/02/03/145330203.db2.gz	DJIHMTPLZODILT-CQSZACIVSA-N	0	3	300.406	2.166	10	0		DEAEHN
CCOc1cc(-c2nc([C@H]3CNCCN3C)no2)ccc1C	ZINC000263229778	145338449	/nfs/dbraw/zinc/33/84/49/145338449.db2.gz	NFETXVIYYQWKDP-CYBMUJFWSA-N	0	3	302.378	2.020	10	0		DEAEHN
C[C@H](C(=O)N[C@H]1CCCC[C@H]1C)N1CCC[C@H](c2nc[nH]n2)C1	ZINC000332966674	145393065	/nfs/dbraw/zinc/39/30/65/145393065.db2.gz	OXIPZDXPIYUUQT-KBXIAJHMSA-N	0	3	319.453	2.068	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@@H](C)N2CCCC[C@H]2C)C1	ZINC000358604981	147165560	/nfs/dbraw/zinc/16/55/60/147165560.db2.gz	MTGKRFHUYRZGQE-HUUCEWRRSA-N	0	3	311.470	2.317	10	0		DEAEHN
C[C@H]1CN(C(=O)c2cccc(CN3CCCC3)c2)C[C@H](C)N1C	ZINC000358672468	147178190	/nfs/dbraw/zinc/17/81/90/147178190.db2.gz	ZRROCERYJACXMT-HOTGVXAUSA-N	0	3	315.461	2.447	10	0		DEAEHN
CC(C)Cn1cc(CNC[C@@H]2CCC3(CCOCC3)[C@H]2O)cn1	ZINC000374687617	148278720	/nfs/dbraw/zinc/27/87/20/148278720.db2.gz	OTTGQLHHFRQSMA-IRXDYDNUSA-N	0	3	321.465	2.196	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)NCc3ccco3)cc2)CC1	ZINC000074164079	401732026	/nfs/dbraw/zinc/73/20/26/401732026.db2.gz	CWLDUBHUUPRRDB-UHFFFAOYSA-N	0	3	313.401	2.352	10	0		DEAEHN
CC[C@H](O)CC[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000127396130	401732758	/nfs/dbraw/zinc/73/27/58/401732758.db2.gz	BVRVBTIKKUWLIT-JTQLQIEISA-N	0	3	318.211	2.414	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2ccc3c(c2)CCC(=O)N3)CCN1C	ZINC000127461860	401735644	/nfs/dbraw/zinc/73/56/44/401735644.db2.gz	JUXAOEFXOFQNDV-IUODEOHRSA-N	0	3	315.417	2.126	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1cccc(F)c1C	ZINC000072606101	401711098	/nfs/dbraw/zinc/71/10/98/401711098.db2.gz	MVZLRDREGYZPCR-ZDUSSCGKSA-N	0	3	309.385	2.366	10	0		DEAEHN
Fc1ccc(CNCCCn2ccnn2)c(Br)c1	ZINC000126879767	401712118	/nfs/dbraw/zinc/71/21/18/401712118.db2.gz	WPTBNTFIIHOHOL-UHFFFAOYSA-N	0	3	313.174	2.360	10	0		DEAEHN
CN(C)[C@H](CNC(=O)N(C)C[C@@H]1CCCO1)c1ccccc1	ZINC000076996471	401802332	/nfs/dbraw/zinc/80/23/32/401802332.db2.gz	AFZXXGJQKORIDC-JKSUJKDBSA-N	0	3	305.422	2.110	10	0		DEAEHN
CCOC(=O)CCCN1CCC[C@H](c2nncn2C2CC2)C1	ZINC000129461854	401803757	/nfs/dbraw/zinc/80/37/57/401803757.db2.gz	XGAUOVURRWUQTB-ZDUSSCGKSA-N	0	3	306.410	2.136	10	0		DEAEHN
O=C(CCN1CC=C(c2ccccc2F)CC1)N1CCOCC1	ZINC000127773307	401749973	/nfs/dbraw/zinc/74/99/73/401749973.db2.gz	GAJXVPCKRHYRLE-UHFFFAOYSA-N	0	3	318.392	2.164	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)CN[C@@H]2CCCC[C@@H]2n2cccn2)C1	ZINC000127867672	401753223	/nfs/dbraw/zinc/75/32/23/401753223.db2.gz	XQFQYOZWZRTGJZ-OAGGEKHMSA-N	0	3	304.438	2.215	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2ccc(C)cc2OC)C1	ZINC000128076243	401761688	/nfs/dbraw/zinc/76/16/88/401761688.db2.gz	ZPDYTXKLKZENPI-OAHLLOKOSA-N	0	3	305.422	2.287	10	0		DEAEHN
Cc1cc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)nn1-c1ccccc1	ZINC000113225945	401770281	/nfs/dbraw/zinc/77/02/81/401770281.db2.gz	GFKBTVVWXFKVNK-RDJZCZTQSA-N	0	3	324.428	2.489	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(-n2cccn2)cc1	ZINC000113223344	401770441	/nfs/dbraw/zinc/77/04/41/401770441.db2.gz	UXUUWTXLKPGNII-RHSMWYFYSA-N	0	3	310.401	2.181	10	0		DEAEHN
COc1ccc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c(OC)c1	ZINC000113232268	401771172	/nfs/dbraw/zinc/77/11/72/401771172.db2.gz	QPWWEFGHPZOSPZ-CHWSQXEVSA-N	0	3	304.390	2.013	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)ccc1C	ZINC000113232922	401771344	/nfs/dbraw/zinc/77/13/44/401771344.db2.gz	ZXAZEECMVZKPLR-BBRMVZONSA-N	0	3	315.417	2.262	10	0		DEAEHN
COCCOc1cccc(CN2CC[C@H](c3cnn(C)c3)C2)c1	ZINC000128387880	401774724	/nfs/dbraw/zinc/77/47/24/401774724.db2.gz	MLMKZCSUFALUOW-INIZCTEOSA-N	0	3	315.417	2.435	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N[C@@H](CO)CC(C)(C)C	ZINC000128435748	401776751	/nfs/dbraw/zinc/77/67/51/401776751.db2.gz	IQMIJVCEZBNOGK-UONOGXRCSA-N	0	3	301.475	2.059	10	0		DEAEHN
c1ncn(C[C@H]2CCCN(CC3=Cc4ccccc4OC3)C2)n1	ZINC000128599103	401784683	/nfs/dbraw/zinc/78/46/83/401784683.db2.gz	FRAMHNNXTZKCIM-HNNXBMFYSA-N	0	3	310.401	2.466	10	0		DEAEHN
O=C(CN[C@@H]1CCCC[C@@H]1n1cccn1)N1CCCCCC1	ZINC000128695908	401788222	/nfs/dbraw/zinc/78/82/22/401788222.db2.gz	UMDHSBRQQSPXIR-CVEARBPZSA-N	0	3	304.438	2.359	10	0		DEAEHN
COc1ccc2c(c1)CCN2C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000130313303	401827216	/nfs/dbraw/zinc/82/72/16/401827216.db2.gz	NKJXGOLFOZWSFF-GXTWGEPZSA-N	0	3	315.417	2.393	10	0		DEAEHN
Cc1cccnc1[C@H](NC(=O)N1CC[C@@H](N(C)C)C1)C(C)C	ZINC000115840200	401838280	/nfs/dbraw/zinc/83/82/80/401838280.db2.gz	FGKIXAUOYXTWMB-HUUCEWRRSA-N	0	3	304.438	2.433	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000026160581	401838945	/nfs/dbraw/zinc/83/89/45/401838945.db2.gz	HZBZEYXAHTVQKW-INIZCTEOSA-N	0	3	316.449	2.003	10	0		DEAEHN
CNC(=O)NC(=O)[C@H](C)N[C@H](C)c1ccc(CC(C)C)cc1	ZINC000028877680	401853400	/nfs/dbraw/zinc/85/34/00/401853400.db2.gz	COODCLLYQAJYIL-OLZOCXBDSA-N	0	3	305.422	2.380	10	0		DEAEHN
CNC(=O)NC(=O)[C@@H](C)N[C@H](C)c1ccc(CC(C)C)cc1	ZINC000028877674	401853507	/nfs/dbraw/zinc/85/35/07/401853507.db2.gz	COODCLLYQAJYIL-CHWSQXEVSA-N	0	3	305.422	2.380	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC(C)(C)c2nc(C)cs2)C1	ZINC000116535578	401854457	/nfs/dbraw/zinc/85/44/57/401854457.db2.gz	XXZPZHPXJZVQRX-GFCCVEGCSA-N	0	3	310.467	2.470	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NC[C@H]1CCCS1	ZINC000131715854	401855645	/nfs/dbraw/zinc/85/56/45/401855645.db2.gz	LQLTYZWZDMEVKP-CYBMUJFWSA-N	0	3	308.447	2.252	10	0		DEAEHN
Cc1ccc(C(C)(C)C(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000116787025	401859348	/nfs/dbraw/zinc/85/93/48/401859348.db2.gz	MIMGHJCZXUNNKL-MRXNPFEDSA-N	0	3	304.434	2.062	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2)CCO1	ZINC000116798182	401859645	/nfs/dbraw/zinc/85/96/45/401859645.db2.gz	GUYQZOJRLFTLGR-CYBMUJFWSA-N	0	3	317.216	2.396	10	0		DEAEHN
CCCCc1ccc(CC(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000116796270	401859664	/nfs/dbraw/zinc/85/96/64/401859664.db2.gz	AZPUUSAMOCIKJF-GOSISDBHSA-N	0	3	318.461	2.361	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)CSCc2cscn2)C1	ZINC000131980785	401861010	/nfs/dbraw/zinc/86/10/10/401861010.db2.gz	UGEUSLDPPNLIBM-YPMHNXCESA-N	0	3	313.492	2.221	10	0		DEAEHN
CC[C@@H](COC)N[C@@H](CO)c1cccc(Br)c1	ZINC000119197011	401932426	/nfs/dbraw/zinc/93/24/26/401932426.db2.gz	CCWJZUQGHMTHSO-STQMWFEESA-N	0	3	302.212	2.497	10	0		DEAEHN
CC[C@@H](COC)N[C@H](CO)c1cccc(Br)c1	ZINC000119197171	401932539	/nfs/dbraw/zinc/93/25/39/401932539.db2.gz	CCWJZUQGHMTHSO-QWHCGFSZSA-N	0	3	302.212	2.497	10	0		DEAEHN
CN(C)[C@H]1CCCN(C(=O)C[C@H]2CCOc3ccccc32)C1	ZINC000117783720	401884370	/nfs/dbraw/zinc/88/43/70/401884370.db2.gz	INTXIWWGELFYIH-CABCVRRESA-N	0	3	302.418	2.495	10	0		DEAEHN
C[C@H](CNC(=O)[C@H]1CCCc2n[nH]cc21)N1CCC(C)CC1	ZINC000133736712	401894147	/nfs/dbraw/zinc/89/41/47/401894147.db2.gz	XMRZJSYSZMVKRB-KGLIPLIRSA-N	0	3	304.438	2.066	10	0		DEAEHN
CCCC(=O)OC[C@H](O)CN(CCOC)Cc1ccccc1C	ZINC000036099890	401902757	/nfs/dbraw/zinc/90/27/57/401902757.db2.gz	BQGOCEOYOCOTQJ-QGZVFWFLSA-N	0	3	323.433	2.148	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ccc(F)nc1	ZINC000118777739	401907373	/nfs/dbraw/zinc/90/73/73/401907373.db2.gz	RBXITLPLMMBRFW-OAHLLOKOSA-N	0	3	301.365	2.123	10	0		DEAEHN
CC1CCN(CC(=O)NCc2ccc(F)c(CN(C)C)c2)CC1	ZINC000136282211	401964677	/nfs/dbraw/zinc/96/46/77/401964677.db2.gz	QFNLJGYFLWKMAS-UHFFFAOYSA-N	0	3	321.440	2.235	10	0		DEAEHN
CC[C@@H](CO)N1CCN(Cc2ccc3c(c2)CC(C)(C)O3)CC1	ZINC000136401148	401967571	/nfs/dbraw/zinc/96/75/71/401967571.db2.gz	XOMPROHYYYZFLS-KRWDZBQOSA-N	0	3	318.461	2.289	10	0		DEAEHN
O=C1CC[C@@H]2CN(C[C@H](O)c3ccccc3)CC[C@H]2N1C1CC1	ZINC000119889490	401969994	/nfs/dbraw/zinc/96/99/94/401969994.db2.gz	ZPXURCSZXNUNGZ-NXHRZFHOSA-N	0	3	314.429	2.195	10	0		DEAEHN
COC(=O)CC(C)(C)CC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000136662412	401971402	/nfs/dbraw/zinc/97/14/02/401971402.db2.gz	LUCWIAUJTXVKHB-CYBMUJFWSA-N	0	3	300.443	2.058	10	0		DEAEHN
CCN(Cc1ccccc1)[C@@H](C)C(=O)N1CCN(CC)CC1	ZINC000120046782	401976062	/nfs/dbraw/zinc/97/60/62/401976062.db2.gz	RVLKAUQGQLBITO-INIZCTEOSA-N	0	3	303.450	2.061	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCO[C@H](c2cccs2)C1)N(C)C1CC1	ZINC000120165700	401980278	/nfs/dbraw/zinc/98/02/78/401980278.db2.gz	QKKLIMBQFRXJOM-JSGCOSHPSA-N	0	3	323.462	2.314	10	0		DEAEHN
COc1cc([C@H](C)NCC2(CS(C)(=O)=O)CC2)ccc1F	ZINC000090182958	401980848	/nfs/dbraw/zinc/98/08/48/401980848.db2.gz	DZCMGVCRWNYCNG-NSHDSACASA-N	0	3	315.410	2.310	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCN(C3CCCCC3)CC2)C1	ZINC000137209173	401980970	/nfs/dbraw/zinc/98/09/70/401980970.db2.gz	ZVYZJGCEZDIIIH-MRXNPFEDSA-N	0	3	322.497	2.131	10	0		DEAEHN
CCc1ccc([C@@H](C)NCC(=O)NC(=O)NCC(C)C)cc1	ZINC000120419826	401989850	/nfs/dbraw/zinc/98/98/50/401989850.db2.gz	XYYKJPZDFGHHRV-CYBMUJFWSA-N	0	3	305.422	2.381	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NCCCOCC1CC1)c1ccccc1	ZINC000048198260	401995534	/nfs/dbraw/zinc/99/55/34/401995534.db2.gz	IIBGICMYRIQEOJ-QGZVFWFLSA-N	0	3	319.449	2.405	10	0		DEAEHN
COc1cc(OCc2ccccc2)c([C@H](N)CN)cc1OC	ZINC000044470015	401943615	/nfs/dbraw/zinc/94/36/15/401943615.db2.gz	QEWZKBMGXBZJFJ-CQSZACIVSA-N	0	3	302.374	2.241	10	0		DEAEHN
CCc1ccc(S(=O)(=O)NC[C@@H](N)c2ccccc2)s1	ZINC000049044865	402011074	/nfs/dbraw/zinc/01/10/74/402011074.db2.gz	AMFXPZATIWZJCZ-CYBMUJFWSA-N	0	3	310.444	2.289	10	0		DEAEHN
C[C@H]1CC[C@@H](C(=O)N(CCN(C)C)Cc2cccc(F)c2)O1	ZINC000151044616	402012686	/nfs/dbraw/zinc/01/26/86/402012686.db2.gz	PHJBILORVRZZPF-BBRMVZONSA-N	0	3	308.397	2.283	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCO[C@H](c2ccsc2)C1	ZINC000151121494	402017766	/nfs/dbraw/zinc/01/77/66/402017766.db2.gz	KRJLVCCIPJCOGW-GJZGRUSLSA-N	0	3	323.462	2.315	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)N1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000151478828	402038678	/nfs/dbraw/zinc/03/86/78/402038678.db2.gz	JRXCZZBWMUGOBP-JFIYKMOQSA-N	0	3	323.481	2.197	10	0		DEAEHN
Cc1cnc(CCN(C)C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)s1	ZINC000121727227	402050295	/nfs/dbraw/zinc/05/02/95/402050295.db2.gz	NHYYVDRUVFVHFZ-GXTWGEPZSA-N	0	3	324.494	2.364	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCc1csc(-c2ccco2)n1	ZINC000150858602	402000671	/nfs/dbraw/zinc/00/06/71/402000671.db2.gz	LLNYBVTXTLKALH-LBPRGKRZSA-N	0	3	320.418	2.297	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H]1CCC[C@H]2OCC[C@@H]21	ZINC000152218876	402082598	/nfs/dbraw/zinc/08/25/98/402082598.db2.gz	QRAHPYPTIHYENE-KLHDSHLOSA-N	0	3	309.454	2.070	10	0		DEAEHN
CC(C)(C)OC[C@@H](O)CN1CCC[C@H](c2nnc(C3CC3)[nH]2)C1	ZINC000152285115	402086750	/nfs/dbraw/zinc/08/67/50/402086750.db2.gz	CURAMFPEZCWRNM-KBPBESRZSA-N	0	3	322.453	2.038	10	0		DEAEHN
O[C@@H](CNc1cnc2cc(F)c(F)cc2n1)CN1CCCCC1	ZINC000122626602	402087767	/nfs/dbraw/zinc/08/77/67/402087767.db2.gz	PENOFKTWSNMQGA-NSHDSACASA-N	0	3	322.359	2.167	10	0		DEAEHN
C[C@H](c1nc(-c2cccnc2)no1)N(C)C[C@@H]1CCCN(C)C1	ZINC000152420720	402095546	/nfs/dbraw/zinc/09/55/46/402095546.db2.gz	QPRGECHOGJIENJ-ZIAGYGMSSA-N	0	3	315.421	2.466	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)Cc1cccc(OC(F)(F)F)c1	ZINC000122834313	402096796	/nfs/dbraw/zinc/09/67/96/402096796.db2.gz	AMMCKHLZIINUIJ-LBPRGKRZSA-N	0	3	316.323	2.338	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)NCc2ccc(Cl)cn2)C1	ZINC000097049621	402102852	/nfs/dbraw/zinc/10/28/52/402102852.db2.gz	ORURRGCYUBTQKT-IUODEOHRSA-N	0	3	322.840	2.361	10	0		DEAEHN
O=C(NCCSC(F)(F)F)N1CCCN(C2CC2)CC1	ZINC000061865948	402108919	/nfs/dbraw/zinc/10/89/19/402108919.db2.gz	FQOOHCWCFXJFIF-UHFFFAOYSA-N	0	3	311.373	2.119	10	0		DEAEHN
Cc1ccc([C@H](Cn2c(=O)[nH]c3ccccc3c2=O)N(C)C)cc1	ZINC000063840327	402115451	/nfs/dbraw/zinc/11/54/51/402115451.db2.gz	DQNUBNVTLGGIOU-KRWDZBQOSA-N	0	3	323.396	2.301	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2cc(F)c(Cl)cc2F)CCO1	ZINC000122194997	402065887	/nfs/dbraw/zinc/06/58/87/402065887.db2.gz	PBIDBKNOLUUZLY-SECBINFHSA-N	0	3	318.751	2.021	10	0		DEAEHN
C[C@@H]1CN(C2CCN(Cc3cn4ccsc4n3)CC2)CCO1	ZINC000066562385	402136937	/nfs/dbraw/zinc/13/69/37/402136937.db2.gz	NTATYDGNTANSQA-CYBMUJFWSA-N	0	3	320.462	2.081	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)Cc1cccc(O)c1	ZINC000101649921	402152919	/nfs/dbraw/zinc/15/29/19/402152919.db2.gz	VNPGOERZNJYTMJ-QGZVFWFLSA-N	0	3	312.413	2.224	10	0		DEAEHN
COC(=O)c1ccc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1	ZINC000123922467	402154079	/nfs/dbraw/zinc/15/40/79/402154079.db2.gz	IWAXWXATJQYUBL-DOMZBBRYSA-N	0	3	304.390	2.028	10	0		DEAEHN
CC(C)NC(=O)NC[C@H]1CCN(Cc2cc(C(C)(C)C)[nH]n2)C1	ZINC000067769453	402172381	/nfs/dbraw/zinc/17/23/81/402172381.db2.gz	MYLCKLNCBQJPMQ-CYBMUJFWSA-N	0	3	321.469	2.237	10	0		DEAEHN
CC1(C)CCCN1CC(=O)N1CCN(c2ccccc2F)CC1	ZINC000102930598	402174619	/nfs/dbraw/zinc/17/46/19/402174619.db2.gz	FFFFWCDMGZYTAA-UHFFFAOYSA-N	0	3	319.424	2.349	10	0		DEAEHN
COc1cc(CNC[C@H]2CN(C3CC3)CCO2)ccc1SC	ZINC000106380413	402213394	/nfs/dbraw/zinc/21/33/94/402213394.db2.gz	BYVJGPYYDDQWBL-HNNXBMFYSA-N	0	3	322.474	2.370	10	0		DEAEHN
COc1ccc([C@H](C)NC[C@@H]2CCCN2C)cc1NC(C)=O	ZINC000154609045	402221061	/nfs/dbraw/zinc/22/10/61/402221061.db2.gz	AFBONLIWTZTVDP-WFASDCNBSA-N	0	3	305.422	2.398	10	0		DEAEHN
C[C@@H]1CC[C@H](C(=O)N(Cc2ccco2)C2CCN(C)CC2)O1	ZINC000154621998	402221846	/nfs/dbraw/zinc/22/18/46/402221846.db2.gz	LPNGGWKXPUUQEC-CZUORRHYSA-N	0	3	306.406	2.270	10	0		DEAEHN
C[C@H]1CC[C@H](C(=O)N(Cc2ccco2)C2CCN(C)CC2)O1	ZINC000154622124	402221969	/nfs/dbraw/zinc/22/19/69/402221969.db2.gz	LPNGGWKXPUUQEC-XJKSGUPXSA-N	0	3	306.406	2.270	10	0		DEAEHN
O=C(c1ccc(-c2ncon2)cc1)N1CC[C@H](N2CCCC2)C1	ZINC000107244708	402228647	/nfs/dbraw/zinc/22/86/47/402228647.db2.gz	NBADKTLCYOJKEC-HNNXBMFYSA-N	0	3	312.373	2.047	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H](C)c1cn(-c2ccccc2)nn1)N(C)C	ZINC000155134263	402246261	/nfs/dbraw/zinc/24/62/61/402246261.db2.gz	ZHQQRNLRZKZYFG-CJNGLKHVSA-N	0	3	315.421	2.175	10	0		DEAEHN
C[C@H](NC(=O)NC[C@@H]1CCCN(C)C1)c1ccc2c(c1)OCO2	ZINC000108546608	402256588	/nfs/dbraw/zinc/25/65/88/402256588.db2.gz	GKNIFHNDRVIMNI-STQMWFEESA-N	0	3	319.405	2.117	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)CSCc1cscn1	ZINC000125927132	402257448	/nfs/dbraw/zinc/25/74/48/402257448.db2.gz	COMHVFIGETWDRK-LBPRGKRZSA-N	0	3	313.492	2.367	10	0		DEAEHN
c1ccc(-c2noc(CCCN3CCN(C4CC4)CC3)n2)cc1	ZINC000125977820	402259167	/nfs/dbraw/zinc/25/91/67/402259167.db2.gz	NLOGOXIBONKBRB-UHFFFAOYSA-N	0	3	312.417	2.449	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)NC[C@H]1CCCN1C	ZINC000154358582	402208081	/nfs/dbraw/zinc/20/80/81/402208081.db2.gz	UYOMGGKRSOANIX-TZMCWYRMSA-N	0	3	321.469	2.401	10	0		DEAEHN
C[C@H]1CCCCN1C(=O)CN1CCC(Cc2nccn2C)CC1	ZINC000105918375	402211300	/nfs/dbraw/zinc/21/13/00/402211300.db2.gz	AYHDFMRFRDWXKZ-HNNXBMFYSA-N	0	3	318.465	2.076	10	0		DEAEHN
CCCCOC(=O)CCN1CCC[C@H](Cn2nc(C)nc2C)C1	ZINC000105919883	402211699	/nfs/dbraw/zinc/21/16/99/402211699.db2.gz	WLFJXCODWULHCE-INIZCTEOSA-N	0	3	322.453	2.340	10	0		DEAEHN
NC(=O)NC(=O)CN1CCCC[C@H]1CCCc1ccccc1	ZINC000125074729	402212107	/nfs/dbraw/zinc/21/21/07/402212107.db2.gz	VDQMKQDOQJHMHP-HNNXBMFYSA-N	0	3	303.406	2.059	10	0		DEAEHN
Cc1cc2occ(C(=O)N3CCO[C@@H](CN(C)C)C3)c2cc1C	ZINC000184556742	402276088	/nfs/dbraw/zinc/27/60/88/402276088.db2.gz	FEVKVGYIGBFGBO-AWEZNQCLSA-N	0	3	316.401	2.452	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1c(F)cccc1F	ZINC000110084821	402281228	/nfs/dbraw/zinc/28/12/28/402281228.db2.gz	SCAYVCFKVDIWCF-NSHDSACASA-N	0	3	313.348	2.197	10	0		DEAEHN
CNC(=O)c1cccc(CN(C)CCc2ncc(C)s2)c1	ZINC000157604680	402296563	/nfs/dbraw/zinc/29/65/63/402296563.db2.gz	VFUGTNBNZKLMIX-UHFFFAOYSA-N	0	3	303.431	2.486	10	0		DEAEHN
C[C@@H](CNC(=O)NCCc1cc(F)ccc1F)N(C)C1CC1	ZINC000176329905	402299995	/nfs/dbraw/zinc/29/99/95/402299995.db2.gz	MOPLTOWKOWBYQU-NSHDSACASA-N	0	3	311.376	2.289	10	0		DEAEHN
c1ccn2c(c1)nnc2C1CCN(CCOCC2CC2)CC1	ZINC000158589705	402308498	/nfs/dbraw/zinc/30/84/98/402308498.db2.gz	VVGVLAUPYIBDPN-UHFFFAOYSA-N	0	3	300.406	2.335	10	0		DEAEHN
O=C(NCCc1cc(F)ccc1F)N1CC[C@@H](N2CC=CC2)C1	ZINC000176458421	402311232	/nfs/dbraw/zinc/31/12/32/402311232.db2.gz	GLVPETAKSWCFEK-OAHLLOKOSA-N	0	3	321.371	2.163	10	0		DEAEHN
CC[C@@H](O)[C@@H]1CCCCN1Cc1cc(-c2cnn(C)c2)no1	ZINC000185008022	402316657	/nfs/dbraw/zinc/31/66/57/402316657.db2.gz	LUOJZFPDHTXDSF-JKSUJKDBSA-N	0	3	304.394	2.201	10	0		DEAEHN
CN(Cc1cc(-c2cnn(C)c2)no1)C[C@@H]1CCCC[C@@H]1O	ZINC000185058398	402321156	/nfs/dbraw/zinc/32/11/56/402321156.db2.gz	HRQHLZBNLKCQCX-LRDDRELGSA-N	0	3	304.394	2.058	10	0		DEAEHN
CC(C)C[C@@H](CO)N(C)Cc1cc(=O)n2cc(Cl)ccc2n1	ZINC000185320991	402343048	/nfs/dbraw/zinc/34/30/48/402343048.db2.gz	RHQYOOGNPOJBRL-AWEZNQCLSA-N	0	3	323.824	2.187	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1ccc(C)cc1F	ZINC000176903375	402348652	/nfs/dbraw/zinc/34/86/52/402348652.db2.gz	DQCBXQOAMAXEHR-CYBMUJFWSA-N	0	3	321.396	2.015	10	0		DEAEHN
C[C@H](NCC(=O)NC(N)=O)c1ccc(Cl)c2ccccc21	ZINC000185383718	402348937	/nfs/dbraw/zinc/34/89/37/402348937.db2.gz	ASSCLRJBPKCMIS-VIFPVBQESA-N	0	3	305.765	2.339	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cccc(C[S@](C)=O)c1	ZINC000176966434	402355206	/nfs/dbraw/zinc/35/52/06/402355206.db2.gz	FVQAANUDBFQCQY-AOMKIAJQSA-N	0	3	322.474	2.121	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1ncccc1Br	ZINC000231763135	402355599	/nfs/dbraw/zinc/35/55/99/402355599.db2.gz	JOVLJYVFEOLWPS-JTQLQIEISA-N	0	3	312.211	2.010	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cccc(OCCOC)c1	ZINC000176974492	402355880	/nfs/dbraw/zinc/35/58/80/402355880.db2.gz	QMAVAPPBKBJWTJ-MRXNPFEDSA-N	0	3	320.433	2.268	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)COc1ccccc1OC	ZINC000177026181	402360825	/nfs/dbraw/zinc/36/08/25/402360825.db2.gz	LLVAIVCOBKNOKX-CQSZACIVSA-N	0	3	306.406	2.017	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)s1	ZINC000176688500	402328700	/nfs/dbraw/zinc/32/87/00/402328700.db2.gz	RJCJQXJTPRFDHE-UHTWSYAYSA-N	0	3	323.462	2.468	10	0		DEAEHN
CCC[C@@H](N)C(=O)NC[C@H](O)c1c(Cl)cccc1Cl	ZINC000161796159	402399831	/nfs/dbraw/zinc/39/98/31/402399831.db2.gz	JUJHLHSCVFZSKD-MNOVXSKESA-N	0	3	305.205	2.270	10	0		DEAEHN
COc1cccc(N2CCC[C@@H](NC(=O)[C@@H](N)CC(C)C)C2)c1	ZINC000237253091	402401321	/nfs/dbraw/zinc/40/13/21/402401321.db2.gz	IUVFYVBTCIOBTM-PBHICJAKSA-N	0	3	319.449	2.154	10	0		DEAEHN
Cc1nn(C)c(C)c1CCNC(=O)[C@H](C)[C@@H](N)c1ccccc1	ZINC000237610347	402415278	/nfs/dbraw/zinc/41/52/78/402415278.db2.gz	LZRSJFLATHBHPQ-SJKOYZFVSA-N	0	3	314.433	2.032	10	0		DEAEHN
Cc1ccn(-c2ccccc2NC(=O)C[C@H]2CSCCN2)n1	ZINC000237860639	402423880	/nfs/dbraw/zinc/42/38/80/402423880.db2.gz	RYXVROOTPVPJHI-ZDUSSCGKSA-N	0	3	316.430	2.214	10	0		DEAEHN
CN(C)CCN(C)C(=O)c1cnn(-c2cccc(Cl)c2)c1	ZINC000177679998	402426258	/nfs/dbraw/zinc/42/62/58/402426258.db2.gz	MLCSPLWPUVOYIO-UHFFFAOYSA-N	0	3	306.797	2.159	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)NCCc1cccs1	ZINC000177713976	402429303	/nfs/dbraw/zinc/42/93/03/402429303.db2.gz	RDGHAHJIZHTKDA-GJZGRUSLSA-N	0	3	323.506	2.211	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)Nc1cccnc1Cl	ZINC000177713766	402429612	/nfs/dbraw/zinc/42/96/12/402429612.db2.gz	LSHLXUBSZXGYGM-QWHCGFSZSA-N	0	3	324.856	2.478	10	0		DEAEHN
CCC1(CC)CCN([C@H](C)C(=O)N(C)CC(=O)NC2CC2)CC1	ZINC000186546370	402440603	/nfs/dbraw/zinc/44/06/03/402440603.db2.gz	ZCWZBBIJCFMDAY-CQSZACIVSA-N	0	3	323.481	2.014	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2nc(C)c(C)s2)C1	ZINC000177853883	402441030	/nfs/dbraw/zinc/44/10/30/402441030.db2.gz	IPYXUCMUOPYRFD-ZDUSSCGKSA-N	0	3	310.467	2.086	10	0		DEAEHN
CC(C)CNC(=O)CN[C@H](C)c1ccccc1-n1cccn1	ZINC000177324952	402391724	/nfs/dbraw/zinc/39/17/24/402391724.db2.gz	HCYGUBJDCPGULC-CQSZACIVSA-N	0	3	300.406	2.295	10	0		DEAEHN
C[C@H](OCc1ccccc1)C(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000185949397	402391899	/nfs/dbraw/zinc/39/18/99/402391899.db2.gz	XRMVYFMNERKIHI-YQQAZPJKSA-N	0	3	302.418	2.287	10	0		DEAEHN
CCC[C@H](C(=O)NCc1cnn(Cc2ccccc2)c1)N(C)C	ZINC000161597131	402393357	/nfs/dbraw/zinc/39/33/57/402393357.db2.gz	NTPRKLCOEZHNNM-QGZVFWFLSA-N	0	3	314.433	2.278	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1ccc(COC)cc1	ZINC000177361679	402394304	/nfs/dbraw/zinc/39/43/04/402394304.db2.gz	QVTHEQFNTCQBCQ-QGZVFWFLSA-N	0	3	319.449	2.459	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@H]1CCCN1c1nccs1	ZINC000245435411	402460539	/nfs/dbraw/zinc/46/05/39/402460539.db2.gz	STAWWXHTBBOPBP-ZIAGYGMSSA-N	0	3	322.478	2.055	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)N[C@H](C)c1cccs1	ZINC000245467541	402464064	/nfs/dbraw/zinc/46/40/64/402464064.db2.gz	KALIUFOVRIZWSM-ZIAGYGMSSA-N	0	3	309.479	2.341	10	0		DEAEHN
COC[C@](C)(CCO)NCc1csc(Br)c1	ZINC000165451188	402476169	/nfs/dbraw/zinc/47/61/69/402476169.db2.gz	KTPAKBBUZPDQLM-NSHDSACASA-N	0	3	308.241	2.388	10	0		DEAEHN
Cc1ccc(CN2CCC[C@H](CN3CCOCC3)C2)c(C)n1	ZINC000187024709	402478290	/nfs/dbraw/zinc/47/82/90/402478290.db2.gz	RYDCEBPYBOSLSJ-QGZVFWFLSA-N	0	3	303.450	2.243	10	0		DEAEHN
COC(=O)c1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)o1	ZINC000245684011	402479248	/nfs/dbraw/zinc/47/92/48/402479248.db2.gz	MBPPQDLGARNAIV-OLZOCXBDSA-N	0	3	320.389	2.154	10	0		DEAEHN
C[C@@H]1CN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)C[C@@H](C)O1	ZINC000245699773	402480706	/nfs/dbraw/zinc/48/07/06/402480706.db2.gz	ZANPUTGZHODSPZ-SRABZTEZSA-N	0	3	317.433	2.251	10	0		DEAEHN
CCO[C@@H]1C[C@@H](O)C12CCN(Cc1ccc(C)nc1C)CC2	ZINC000187075735	402480872	/nfs/dbraw/zinc/48/08/72/402480872.db2.gz	MQIOWEIVPSSTNZ-IAGOWNOFSA-N	0	3	304.434	2.450	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2ccc(F)c(Cl)c2)C[C@@H]1C	ZINC000245709981	402481395	/nfs/dbraw/zinc/48/13/95/402481395.db2.gz	FVAMBEZDMZNQCX-RYUDHWBXSA-N	0	3	300.805	2.366	10	0		DEAEHN
COC(=O)c1coc(CN2CCC[C@@H]2Cn2ccnc2C)c1	ZINC000178303772	402482382	/nfs/dbraw/zinc/48/23/82/402482382.db2.gz	HVXVWGFULDWXAU-CQSZACIVSA-N	0	3	303.362	2.236	10	0		DEAEHN
CCOCCN1CCN(Cc2ccc(NC(C)=O)cc2)C[C@H]1C	ZINC000245766278	402486281	/nfs/dbraw/zinc/48/62/81/402486281.db2.gz	QWWOXVKSVRPGJC-OAHLLOKOSA-N	0	3	319.449	2.188	10	0		DEAEHN
CC(C)Cc1ncc(CN2C[C@H](C)[C@H](N3CCOCC3)C2)s1	ZINC000245781558	402487690	/nfs/dbraw/zinc/48/76/90/402487690.db2.gz	UKNKZCMHFZIEIW-GOEBONIOSA-N	0	3	323.506	2.494	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)CC(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)C1	ZINC000187935802	402513490	/nfs/dbraw/zinc/51/34/90/402513490.db2.gz	ZUEWPODXDNTQRO-JFBPSJKJSA-N	0	3	310.482	2.410	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCCc2ccccn2)CCN1C	ZINC000178417637	402496566	/nfs/dbraw/zinc/49/65/66/402496566.db2.gz	VGIBJRXYOPJDQU-ZBFHGGJFSA-N	0	3	304.438	2.138	10	0		DEAEHN
CO[C@@H]1CN(C(=O)N[C@H](C)CN2CCC[C@H](C)C2)CC[C@@H]1C	ZINC000187620069	402506042	/nfs/dbraw/zinc/50/60/42/402506042.db2.gz	RTCZDMUUXDDZMP-CAOSSQGBSA-N	0	3	311.470	2.173	10	0		DEAEHN
C[C@@H]1CN(CCOc2cccc3ccccc32)CCN1CCO	ZINC000187711986	402509171	/nfs/dbraw/zinc/50/91/71/402509171.db2.gz	JBAHETXCJZNBJT-MRXNPFEDSA-N	0	3	314.429	2.217	10	0		DEAEHN
Cc1ccc(N2CCC[C@H](N[C@H]3CCCS(=O)(=O)C3)C2)cc1	ZINC000246095430	402509282	/nfs/dbraw/zinc/50/92/82/402509282.db2.gz	XHVPDQVPFARJDG-HOTGVXAUSA-N	0	3	322.474	2.131	10	0		DEAEHN
CC(C)CO[C@@H]1CCN(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)C1	ZINC000246962028	402550568	/nfs/dbraw/zinc/55/05/68/402550568.db2.gz	CHXBIRVKUROCRI-XHSDSOJGSA-N	0	3	311.470	2.172	10	0		DEAEHN
CCc1c(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)[nH]c(C)c1C(C)=O	ZINC000246970233	402551878	/nfs/dbraw/zinc/55/18/78/402551878.db2.gz	DPNHGGZOCQYVKG-RISCZKNCSA-N	0	3	317.433	2.397	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)ccc1F	ZINC000247046344	402554966	/nfs/dbraw/zinc/55/49/66/402554966.db2.gz	GUZUTMGWBAYIFB-RISCZKNCSA-N	0	3	319.380	2.093	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCC[C@@H]2CCC[C@@H]21	ZINC000247069279	402555656	/nfs/dbraw/zinc/55/56/56/402555656.db2.gz	YFNOKXGOEWPRAH-XHSDSOJGSA-N	0	3	309.454	2.071	10	0		DEAEHN
CC[S@](=O)c1ccccc1C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000247093372	402556985	/nfs/dbraw/zinc/55/69/85/402556985.db2.gz	IFBOKQXTFLURDG-SOHPYSCWSA-N	0	3	320.458	2.123	10	0		DEAEHN
CCOc1ncc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1Cl	ZINC000247411568	402566115	/nfs/dbraw/zinc/56/61/15/402566115.db2.gz	QDRPFFRPPULLGQ-DGCLKSJQSA-N	0	3	323.824	2.442	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCc2cscn2)[C@@H]1c1ccccc1	ZINC000179142956	402575839	/nfs/dbraw/zinc/57/58/39/402575839.db2.gz	MFUGWOWUHVGXES-CABCVRRESA-N	0	3	316.430	2.388	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Cc2c[nH]c3cc(F)ccc23)C1	ZINC000171268624	402572999	/nfs/dbraw/zinc/57/29/99/402572999.db2.gz	NLVYRMZWHCHJCZ-CQSZACIVSA-N	0	3	303.381	2.450	10	0		DEAEHN
COc1cc(C)cc(C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1O	ZINC000246282995	402522988	/nfs/dbraw/zinc/52/29/88/402522988.db2.gz	BQJJQLXYCAMHBC-TZMCWYRMSA-N	0	3	306.406	2.168	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)s1	ZINC000246311418	402524792	/nfs/dbraw/zinc/52/47/92/402524792.db2.gz	MGOYTNFZTQGSOL-TZMCWYRMSA-N	0	3	324.494	2.230	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCC[C@H]3OCC[C@H]32)CCN1C	ZINC000246370266	402527497	/nfs/dbraw/zinc/52/74/97/402527497.db2.gz	LLUOPPMHDVXFGV-IBEHDNSVSA-N	0	3	309.454	2.068	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H](C)c2nc(C(C)(C)C)no2)C1	ZINC000246402564	402528938	/nfs/dbraw/zinc/52/89/38/402528938.db2.gz	RQPDGBVJNMGUJL-VXGBXAGGSA-N	0	3	323.441	2.212	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCc2ccccc2OC(F)F)C1	ZINC000170827852	402529755	/nfs/dbraw/zinc/52/97/55/402529755.db2.gz	MOOUWRCBMSZWIM-GFCCVEGCSA-N	0	3	313.348	2.134	10	0		DEAEHN
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CC[C@H](N(C)C)C1	ZINC000170827717	402529998	/nfs/dbraw/zinc/52/99/98/402529998.db2.gz	GKZLHZBKGBUCRO-ZFWWWQNUSA-N	0	3	305.422	2.059	10	0		DEAEHN
C[C@H](CNC(=O)N1CC[C@@H](N(C)C)C1)COCc1ccccc1	ZINC000170833610	402530688	/nfs/dbraw/zinc/53/06/88/402530688.db2.gz	ZGQQYXQXNOWXIC-NVXWUHKLSA-N	0	3	319.449	2.185	10	0		DEAEHN
O=C(Cc1c[nH]c2cc(F)ccc12)N1CCN2CCC[C@H]2C1	ZINC000171278964	402573879	/nfs/dbraw/zinc/57/38/79/402573879.db2.gz	KWDHYUGXIBFOGB-AWEZNQCLSA-N	0	3	301.365	2.156	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)CCCOc2ccc(F)cc2F)C1	ZINC000170864406	402534919	/nfs/dbraw/zinc/53/49/19/402534919.db2.gz	ITYWPCWXHUXFLQ-CYBMUJFWSA-N	0	3	312.360	2.286	10	0		DEAEHN
CCC[C@H](C(=O)N(C)C[C@@H]1COc2ccccc2O1)N(C)C	ZINC000179186686	402579227	/nfs/dbraw/zinc/57/92/27/402579227.db2.gz	DWOQHWYUQSWKSL-ZIAGYGMSSA-N	0	3	306.406	2.015	10	0		DEAEHN
CCCN(CCC)C(=O)CCC(=O)N1CCCN(C2CC2)CC1	ZINC000171474236	402588733	/nfs/dbraw/zinc/58/87/33/402588733.db2.gz	YBWAFXORGUTHRJ-UHFFFAOYSA-N	0	3	323.481	2.112	10	0		DEAEHN
CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)NCCn1cccn1	ZINC000171645186	402605069	/nfs/dbraw/zinc/60/50/69/402605069.db2.gz	JOZIRZNCOHSUQG-MRXNPFEDSA-N	0	3	314.433	2.298	10	0		DEAEHN
C[C@@H]1C[C@@H](O)C[C@H](C)N1C[C@H](O)COc1ccc(Cl)cc1	ZINC000248748844	402607240	/nfs/dbraw/zinc/60/72/40/402607240.db2.gz	FWLAHVHGNZINCG-NEBZKDRISA-N	0	3	313.825	2.313	10	0		DEAEHN
CN(C[C@@H]1CCCC[C@@H]1O)[C@H]1CCc2ccccc2NC1=O	ZINC000248845991	402611102	/nfs/dbraw/zinc/61/11/02/402611102.db2.gz	NDVKGIGIBPTYCH-XIRDDKMYSA-N	0	3	302.418	2.423	10	0		DEAEHN
C[C@H](CC(=O)Nc1ccc(F)cc1)NCC1(C)OCCCO1	ZINC000190660707	402616614	/nfs/dbraw/zinc/61/66/14/402616614.db2.gz	MQYUSFGNZZJMDM-GFCCVEGCSA-N	0	3	310.369	2.286	10	0		DEAEHN
CCCCCNC(=O)N(C)C1CCN(CCn2cccn2)CC1	ZINC000171756767	402619067	/nfs/dbraw/zinc/61/90/67/402619067.db2.gz	FVIMWKWSTDVVOL-UHFFFAOYSA-N	0	3	321.469	2.179	10	0		DEAEHN
CCOc1ncc(C(=O)N2CCN3CCC[C@H]3C2)cc1Cl	ZINC000171804616	402623563	/nfs/dbraw/zinc/62/35/63/402623563.db2.gz	HCQIBLAITOJIPR-LBPRGKRZSA-N	0	3	309.797	2.054	10	0		DEAEHN
CCCOc1ccc(CNC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000171900455	402632590	/nfs/dbraw/zinc/63/25/90/402632590.db2.gz	APMRJFMXSIIHTB-MRXNPFEDSA-N	0	3	317.433	2.465	10	0		DEAEHN
CCc1ccccc1S(=O)(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000249432179	402629508	/nfs/dbraw/zinc/62/95/08/402629508.db2.gz	HLDKMAKZXNSPPC-HZPDHXFCSA-N	0	3	322.474	2.354	10	0		DEAEHN
COCCOc1ccc(C(=O)NCCN2CCCC[C@H]2C)cc1	ZINC000171959917	402635380	/nfs/dbraw/zinc/63/53/80/402635380.db2.gz	GLZOXCUXQXPTDH-OAHLLOKOSA-N	0	3	320.433	2.316	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H](c2cccs2)N(C)C)C1	ZINC000249611340	402636891	/nfs/dbraw/zinc/63/68/91/402636891.db2.gz	LAWVYGARWPNGLL-UONOGXRCSA-N	0	3	324.494	2.134	10	0		DEAEHN
O=C(N[C@H]1CCOc2ccc(F)cc21)N1CCN2CCC[C@@H]2C1	ZINC000171908135	402632948	/nfs/dbraw/zinc/63/29/48/402632948.db2.gz	YZEQHOMVXJTFHL-HIFRSBDPSA-N	0	3	319.380	2.139	10	0		DEAEHN
CCC(=O)OC[C@H]1CN(Cc2ccccc2)C[C@H]1OC(=O)CC	ZINC000249688190	402638433	/nfs/dbraw/zinc/63/84/33/402638433.db2.gz	IAILZLXBCDRKGE-HZPDHXFCSA-N	0	3	319.401	2.393	10	0		DEAEHN
C[C@H]1OCCC[C@H]1C(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000191139587	402644688	/nfs/dbraw/zinc/64/46/88/402644688.db2.gz	CPUVRFPMZRENCQ-RHSMWYFYSA-N	0	3	320.433	2.058	10	0		DEAEHN
COCCCN1CCC(NC(=O)N[C@@H](C)C2CCCC2)CC1	ZINC000172226176	402646206	/nfs/dbraw/zinc/64/62/06/402646206.db2.gz	OYLCFKOBVRFDEH-AWEZNQCLSA-N	0	3	311.470	2.365	10	0		DEAEHN
O[C@@H]1c2ccccc2C[C@H]1N1CCC(Nc2cccnn2)CC1	ZINC000182753354	402714091	/nfs/dbraw/zinc/71/40/91/402714091.db2.gz	TVGVXLCCLRANMQ-SJLPKXTDSA-N	0	3	310.401	2.011	10	0		DEAEHN
COC(=O)CCCN[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1	ZINC000192150653	402714657	/nfs/dbraw/zinc/71/46/57/402714657.db2.gz	KCYAHDYQFODTIZ-CJNGLKHVSA-N	0	3	324.808	2.155	10	0		DEAEHN
C[C@H](C(=O)N(C)Cc1ccccc1)N1CCCN(C2CC2)CC1	ZINC000172541828	402661840	/nfs/dbraw/zinc/66/18/40/402661840.db2.gz	NZALXBKBTTXBFK-MRXNPFEDSA-N	0	3	315.461	2.204	10	0		DEAEHN
Cc1ccc(CNC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)s1	ZINC000253207729	402661893	/nfs/dbraw/zinc/66/18/93/402661893.db2.gz	HOOREDARYJELFV-WOSRLPQWSA-N	0	3	308.447	2.205	10	0		DEAEHN
Cc1c([C@H](C)N[C@@H]2CCc3ncnn3C2)cnn1C(C)(C)C	ZINC000191357402	402663479	/nfs/dbraw/zinc/66/34/79/402663479.db2.gz	UPFGKPBMESKABJ-WCQYABFASA-N	0	3	302.426	2.204	10	0		DEAEHN
CC[C@@H](NC(=O)N1CCCN(C2CC2)CC1)c1nccs1	ZINC000172615671	402666491	/nfs/dbraw/zinc/66/64/91/402666491.db2.gz	STAYAHRCTXJPML-CYBMUJFWSA-N	0	3	308.451	2.474	10	0		DEAEHN
Cc1noc(C)c1C[C@H](C)NC(=O)N1CCCN(C2CC2)CC1	ZINC000172613460	402666542	/nfs/dbraw/zinc/66/65/42/402666542.db2.gz	QSCKQTYWXCTUDI-LBPRGKRZSA-N	0	3	320.437	2.102	10	0		DEAEHN
COc1ccc(/C=C\C(=O)N2CCN3CCC[C@H]3C2)cc1OC	ZINC000254984997	402674157	/nfs/dbraw/zinc/67/41/57/402674157.db2.gz	INNYAUSKAARTAZ-LYASGUKUSA-N	0	3	316.401	2.024	10	0		DEAEHN
CN1CCC(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCO3)CC1	ZINC000172765955	402674814	/nfs/dbraw/zinc/67/48/14/402674814.db2.gz	YCVCTQVVTBCVMV-HNNXBMFYSA-N	0	3	316.401	2.421	10	0		DEAEHN
COC(=O)c1ccccc1OCCN1CC[C@@H]2OCCC[C@@H]2C1	ZINC000182245008	402675925	/nfs/dbraw/zinc/67/59/25/402675925.db2.gz	NVNQOTGANHMPLU-ZBFHGGJFSA-N	0	3	319.401	2.353	10	0		DEAEHN
CN(C)[C@H](CNC(=O)c1ccc2nnn(C)c2c1)c1ccccc1	ZINC000182253312	402676701	/nfs/dbraw/zinc/67/67/01/402676701.db2.gz	CYMJVZDORNAFCG-QGZVFWFLSA-N	0	3	323.400	2.001	10	0		DEAEHN
CO[C@@H](C)CN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000182286289	402678507	/nfs/dbraw/zinc/67/85/07/402678507.db2.gz	HCIFSSVLGPAIHD-AWEZNQCLSA-N	0	3	302.418	2.323	10	0		DEAEHN
N[C@@H](C(=O)NCCC12CC3CC(CC(C3)C1)C2)C1CCOCC1	ZINC000261915697	402719622	/nfs/dbraw/zinc/71/96/22/402719622.db2.gz	YBJPYHWEJPFNQK-MUGCCGGLSA-N	0	3	320.477	2.463	10	0		DEAEHN
CC(C)OCCCC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000182304673	402679824	/nfs/dbraw/zinc/67/98/24/402679824.db2.gz	FMOODDMIGMPVIW-QGZVFWFLSA-N	0	3	306.450	2.481	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@@H](C)C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000173256671	402689574	/nfs/dbraw/zinc/68/95/74/402689574.db2.gz	IVHPBQWSNVWDKE-CZUORRHYSA-N	0	3	322.497	2.308	10	0		DEAEHN
C[C@H]1C[C@H](N(C)S(=O)(=O)CC2CCCCC2)CCN1C	ZINC000173276796	402690674	/nfs/dbraw/zinc/69/06/74/402690674.db2.gz	KTICVGNZJXQAOL-DZGCQCFKSA-N	0	3	302.484	2.311	10	0		DEAEHN
COc1cccc(CCN[C@H]2CCCC[C@@H]2S(C)(=O)=O)c1	ZINC000182464074	402692167	/nfs/dbraw/zinc/69/21/67/402692167.db2.gz	YOEXFWBCAJTGLG-HOTGVXAUSA-N	0	3	311.447	2.183	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCCOc2ccccc2)CCN1C	ZINC000173366439	402694264	/nfs/dbraw/zinc/69/42/64/402694264.db2.gz	PAEAGZFPTCVBOD-HUUCEWRRSA-N	0	3	305.422	2.190	10	0		DEAEHN
O=C(NC1C2CC3CC(C2)CC1C3)N1CC[C@H](N2CC=CC2)C1	ZINC000173448186	402698006	/nfs/dbraw/zinc/69/80/06/402698006.db2.gz	MFIKZSMDNGKJEF-NFSPANSCSA-N	0	3	315.461	2.467	10	0		DEAEHN
C[C@@H]1CN(C2CCN(Cc3cccc(Cl)n3)CC2)CCO1	ZINC000173559383	402703017	/nfs/dbraw/zinc/70/30/17/402703017.db2.gz	GSSXLSVXPVZKDD-CYBMUJFWSA-N	0	3	309.841	2.420	10	0		DEAEHN
COCc1csc(NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)n1	ZINC000174376719	402738348	/nfs/dbraw/zinc/73/83/48/402738348.db2.gz	WWFUYWSDXYCRKJ-CMPLNLGQSA-N	0	3	312.439	2.236	10	0		DEAEHN
C[C@H](NCC(=O)NCc1ccc(Cl)s1)[C@H]1CCCO1	ZINC000183138314	402742499	/nfs/dbraw/zinc/74/24/99/402742499.db2.gz	RCXUDTLHKWNLCE-GXSJLCMTSA-N	0	3	302.827	2.175	10	0		DEAEHN
CCCN1CCC(CNS(=O)(=O)c2cc(C)oc2C)CC1	ZINC000183146851	402742885	/nfs/dbraw/zinc/74/28/85/402742885.db2.gz	JZZHZRBVTKHSLJ-UHFFFAOYSA-N	0	3	314.451	2.297	10	0		DEAEHN
CCOCCNC(=O)CN[C@H]1c2ccccc2CCC1(C)C	ZINC000183224862	402748514	/nfs/dbraw/zinc/74/85/14/402748514.db2.gz	MIAMHPHEQSWHGH-KRWDZBQOSA-N	0	3	304.434	2.442	10	0		DEAEHN
COc1ccc2nc(N3CCN(C[C@@H](C)O)[C@H](C)C3)ccc2c1	ZINC000174732385	402753989	/nfs/dbraw/zinc/75/39/89/402753989.db2.gz	GTQAVKKSTAHOFJ-ZIAGYGMSSA-N	0	3	315.417	2.135	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2ccc(OC3CCC3)cc2)n1	ZINC000263295477	402755355	/nfs/dbraw/zinc/75/53/55/402755355.db2.gz	WGHMCAPSDQXZFQ-OAHLLOKOSA-N	0	3	314.389	2.244	10	0		DEAEHN
CCc1nc([C@H](C)NC(=O)N2CC[C@@H](N3CC=CC3)C2)cs1	ZINC000174847770	402760555	/nfs/dbraw/zinc/76/05/55/402760555.db2.gz	QOCGHIOLTHHKMW-QWHCGFSZSA-N	0	3	320.462	2.422	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(OC)ccc1OC	ZINC000175032734	402773033	/nfs/dbraw/zinc/77/30/33/402773033.db2.gz	HZVYPYZVDJMFKQ-UONOGXRCSA-N	0	3	318.417	2.403	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2CC(C)(C)OC2(C)C)CCN1C	ZINC000183588313	402778936	/nfs/dbraw/zinc/77/89/36/402778936.db2.gz	AMLUKMCYSFVIIJ-HZSPNIEDSA-N	0	3	311.470	2.457	10	0		DEAEHN
Cc1ccc(OC2CCN(C[C@@H](O)COC(C)C)CC2)nc1	ZINC000182852141	402722283	/nfs/dbraw/zinc/72/22/83/402722283.db2.gz	QEKBPWBKALDAGS-OAHLLOKOSA-N	0	3	308.422	2.019	10	0		DEAEHN
COC(=O)c1coc(C(=O)N2CCCN(C3CCCC3)CC2)c1	ZINC000183691256	402789167	/nfs/dbraw/zinc/78/91/67/402789167.db2.gz	FVAFYMBXTKXNJQ-UHFFFAOYSA-N	0	3	320.389	2.157	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc(NC(C)=O)cc2)C1	ZINC000194326817	402792424	/nfs/dbraw/zinc/79/24/24/402792424.db2.gz	RWPQDGFPYGSBLS-HNNXBMFYSA-N	0	3	304.394	2.251	10	0		DEAEHN
CCC(CC)[C@@H]1C[C@@H](NC(=O)N2CC[C@H](N(C)C)C2)CCO1	ZINC000183729052	402792587	/nfs/dbraw/zinc/79/25/87/402792587.db2.gz	DQZBXTCPJBKQEW-JYJNAYRXSA-N	0	3	311.470	2.316	10	0		DEAEHN
CCCO[C@H]1CCCN(C(=O)NC[C@@H]2CCCN2CC)CC1	ZINC000175368421	402800908	/nfs/dbraw/zinc/80/09/08/402800908.db2.gz	BPCWJPTUDPLJTD-HOTGVXAUSA-N	0	3	311.470	2.461	10	0		DEAEHN
O=C(c1cc(-c2ccc(F)cc2)n[nH]1)N1CCN2CCC[C@@H]2C1	ZINC000195330533	402842554	/nfs/dbraw/zinc/84/25/54/402842554.db2.gz	FGOMKCFGCJCGGE-CQSZACIVSA-N	0	3	314.364	2.136	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)S(=O)(=O)c1ccc2c(c1)CCC2	ZINC000175391372	402802407	/nfs/dbraw/zinc/80/24/07/402802407.db2.gz	YQBZDGGHQOCEAT-INIZCTEOSA-N	0	3	322.474	2.280	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)NCCC1=CCCCC1	ZINC000195341176	402842917	/nfs/dbraw/zinc/84/29/17/402842917.db2.gz	TUTZDIHMZRXCFA-UHFFFAOYSA-N	0	3	305.466	2.163	10	0		DEAEHN
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCCN(C2CC2)CC1	ZINC000194673014	402809248	/nfs/dbraw/zinc/80/92/48/402809248.db2.gz	BSQLYAIALRJXQO-AWEZNQCLSA-N	0	3	317.433	2.203	10	0		DEAEHN
CN1CCC[C@@H]1CNC(=O)c1cnn(-c2cccc(Cl)c2)c1	ZINC000194691859	402810376	/nfs/dbraw/zinc/81/03/76/402810376.db2.gz	MWSXEGYQVAPGRB-OAHLLOKOSA-N	0	3	318.808	2.350	10	0		DEAEHN
Cc1cc(C)n(-c2ccc(C(=O)NC[C@@H]3CCCN3C)cc2)n1	ZINC000194738296	402813416	/nfs/dbraw/zinc/81/34/16/402813416.db2.gz	XKKAFLUNPBKEIJ-KRWDZBQOSA-N	0	3	312.417	2.313	10	0		DEAEHN
CN(Cc1ccc2c(c1)sc(=O)n2C)[C@H](CO)C(C)(C)C	ZINC000195039874	402828111	/nfs/dbraw/zinc/82/81/11/402828111.db2.gz	LQSSBHYKEWPLIO-CQSZACIVSA-N	0	3	308.447	2.439	10	0		DEAEHN
C[C@@H]1C[C@H](C(=O)NCC2CCN(CCO)CC2)CC(C)(C)C1	ZINC000184233604	402828822	/nfs/dbraw/zinc/82/88/22/402828822.db2.gz	VIWINJXNVRZKLS-ZBFHGGJFSA-N	0	3	310.482	2.269	10	0		DEAEHN
CC[C@H]1CN(c2ccccc2)CCN1C(=O)CN(C)C(C)C	ZINC000184272744	402831923	/nfs/dbraw/zinc/83/19/23/402831923.db2.gz	AQMOVFBTKFLERS-INIZCTEOSA-N	0	3	303.450	2.454	10	0		DEAEHN
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1C[C@@H]1C1CCCCC1	ZINC000184379874	402839286	/nfs/dbraw/zinc/83/92/86/402839286.db2.gz	GKKRTRQPGWBCHM-NXHRZFHOSA-N	0	3	321.509	2.345	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)c1cc(C(=O)OC)co1	ZINC000183642693	402784915	/nfs/dbraw/zinc/78/49/15/402784915.db2.gz	GZGSHEAKFVXALH-ZDUSSCGKSA-N	0	3	308.378	2.061	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2ccccc2COC)C1	ZINC000194144710	402785665	/nfs/dbraw/zinc/78/56/65/402785665.db2.gz	PCOBJJARMCUTOA-MRXNPFEDSA-N	0	3	305.422	2.117	10	0		DEAEHN
COc1cccc(NC(=O)CN2CCC(c3ccn[nH]3)CC2)c1	ZINC000195506951	402848135	/nfs/dbraw/zinc/84/81/35/402848135.db2.gz	ZPINNGQXYCGGHP-UHFFFAOYSA-N	0	3	314.389	2.236	10	0		DEAEHN
O=C(CN1CCC(c2ccn[nH]2)CC1)Nc1ccccc1F	ZINC000195506833	402848343	/nfs/dbraw/zinc/84/83/43/402848343.db2.gz	IAAVYPHHAVEYEG-UHFFFAOYSA-N	0	3	302.353	2.367	10	0		DEAEHN
COc1cccc(Cl)c1CC(=O)N1CCN2CCC[C@H]2C1	ZINC000184528697	402849109	/nfs/dbraw/zinc/84/91/09/402849109.db2.gz	QLBFJDPUVKVYDG-LBPRGKRZSA-N	0	3	308.809	2.198	10	0		DEAEHN
CCC(C)(C)NC(=O)CN1CC[C@H](CNc2cccc(C)n2)C1	ZINC000195516170	402849303	/nfs/dbraw/zinc/84/93/03/402849303.db2.gz	ONPYGJPHAVJWRB-OAHLLOKOSA-N	0	3	318.465	2.429	10	0		DEAEHN
Cc1c(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)[nH]c2c1C(=O)CCC2	ZINC000265023402	402893638	/nfs/dbraw/zinc/89/36/38/402893638.db2.gz	YPSHLOVXMAENAE-YPMHNXCESA-N	0	3	315.417	2.151	10	0		DEAEHN
CCN1CCC(NC(=O)N2CCCC[C@@H]2c2cn[nH]c2)CC1	ZINC000272470549	402940990	/nfs/dbraw/zinc/94/09/90/402940990.db2.gz	QALVXGPPAJIBOX-OAHLLOKOSA-N	0	3	305.426	2.131	10	0		DEAEHN
CC1(C)C[C@H]1C(=O)NCc1ccccc1CN1CCC[C@H]1CO	ZINC000272854078	402960655	/nfs/dbraw/zinc/96/06/55/402960655.db2.gz	QNCOZDSNWFCUCD-IRXDYDNUSA-N	0	3	316.445	2.306	10	0		DEAEHN
c1ccc2c(c1)ncnc2N1CCN(CC2CCOCC2)CC1	ZINC000265526370	402926790	/nfs/dbraw/zinc/92/67/90/402926790.db2.gz	SQSBUEBMCGRASG-UHFFFAOYSA-N	0	3	312.417	2.178	10	0		DEAEHN
Cc1nc(C2CC2)oc1C(=O)NC[C@]1(N(C)C)CCSC1	ZINC000273583794	403017184	/nfs/dbraw/zinc/01/71/84/403017184.db2.gz	FCTSRZSYQQGUAW-OAHLLOKOSA-N	0	3	309.435	2.028	10	0		DEAEHN
CN(c1cc(Cl)nc(N)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000268494360	403088248	/nfs/dbraw/zinc/08/82/48/403088248.db2.gz	PTPHGYRPVHZVGJ-CYBMUJFWSA-N	0	3	317.824	2.423	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@@H]1NCc1cc(F)cc(Br)c1	ZINC000282389884	403149197	/nfs/dbraw/zinc/14/91/97/403149197.db2.gz	OXAUHYSSTLHMFQ-UFBFGSQYSA-N	0	3	315.186	2.345	10	0		DEAEHN
CCN1CCC[C@H](Nc2nc(C(F)(F)F)nc3nc[nH]c32)C1	ZINC000301102756	403590438	/nfs/dbraw/zinc/59/04/38/403590438.db2.gz	SAKYNGVXPQTTHR-QMMMGPOBSA-N	0	3	314.315	2.268	10	0		DEAEHN
CNC(=O)c1cccnc1NC[C@H](c1ccc(F)cc1)N(C)C	ZINC000301339458	403617509	/nfs/dbraw/zinc/61/75/09/403617509.db2.gz	FBVJTGYDPNEALJ-OAHLLOKOSA-N	0	3	316.380	2.295	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1N(C)C(=O)CN1CCC[C@H](c2nc[nH]n2)C1	ZINC000333096403	403665070	/nfs/dbraw/zinc/66/50/70/403665070.db2.gz	UJNBSUXMJVRNSQ-ILXRZTDVSA-N	0	3	319.453	2.021	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)[C@H](C)N[C@H]1CCOC1(C)C	ZINC000295366575	403884388	/nfs/dbraw/zinc/88/43/88/403884388.db2.gz	ZOLGPKRSWHLLAA-NHYWBVRUSA-N	0	3	304.390	2.373	10	0		DEAEHN
Cc1cc(C[C@@H](C)NC(=O)c2ccccc2CN(C)C)[nH]n1	ZINC000362941560	404016587	/nfs/dbraw/zinc/01/65/87/404016587.db2.gz	DGSCCFOIIJUOCB-GFCCVEGCSA-N	0	3	300.406	2.141	10	0		DEAEHN
CCC1CCC(NC(=O)CC2CCN(C)CC2)(C(=O)OC)CC1	ZINC000362949350	404020532	/nfs/dbraw/zinc/02/05/32/404020532.db2.gz	NWIHFMDLRLKGER-UHFFFAOYSA-N	0	3	324.465	2.347	10	0		DEAEHN
COc1nccc(CN[C@@H](C)CN(C)Cc2ccccc2)n1	ZINC000295530991	403974903	/nfs/dbraw/zinc/97/49/03/403974903.db2.gz	WREACJDPNKIDSH-AWEZNQCLSA-N	0	3	300.406	2.095	10	0		DEAEHN
O=C1CCCN1C1CCN(CCOc2ccc(F)cc2)CC1	ZINC000363571218	404190351	/nfs/dbraw/zinc/19/03/51/404190351.db2.gz	KCVFUNSDCIMWHW-UHFFFAOYSA-N	0	3	306.381	2.291	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@@H]1NCc1cccc(Br)c1F	ZINC000296862872	404346730	/nfs/dbraw/zinc/34/67/30/404346730.db2.gz	PCCVWDNHHQRZOU-KWQFWETISA-N	0	3	315.186	2.345	10	0		DEAEHN
CCSc1nccnc1C(=O)NC1CC(N2CCCCC2)C1	ZINC000365465533	404668255	/nfs/dbraw/zinc/66/82/55/404668255.db2.gz	JFRPHTMRYKWYMK-UHFFFAOYSA-N	0	3	320.462	2.335	10	0		DEAEHN
O=C(c1cccc(CN2CCCC2)c1)N1CC[C@](O)(C2CC2)C1	ZINC000365880337	404738463	/nfs/dbraw/zinc/73/84/63/404738463.db2.gz	WNIFPGXRUJQDRU-LJQANCHMSA-N	0	3	314.429	2.269	10	0		DEAEHN
CCOC(=O)[C@H]1CN(CCCCC(F)(F)F)CC12COC2	ZINC000451138132	404877158	/nfs/dbraw/zinc/87/71/58/404877158.db2.gz	PZVFOUYZQUXVIJ-LLVKDONJSA-N	0	3	309.328	2.231	10	0		DEAEHN
CCOC(=O)[C@H]1CN([C@H](C)c2cccc(F)c2)CC12COC2	ZINC000451140293	404877878	/nfs/dbraw/zinc/87/78/78/404877878.db2.gz	TYTWANYZECUOLW-IUODEOHRSA-N	0	3	307.365	2.398	10	0		DEAEHN
Cn1cc(CN2CCC[C@@H]2Cn2cncn2)c(-c2ccccc2)n1	ZINC000378441817	404965741	/nfs/dbraw/zinc/96/57/41/404965741.db2.gz	IGKVIJMSAHADPG-QGZVFWFLSA-N	0	3	322.416	2.343	10	0		DEAEHN
CC(=O)N1CCC(Nc2cccc3c2OCC[C@H]3N(C)C)CC1	ZINC000435025623	404951444	/nfs/dbraw/zinc/95/14/44/404951444.db2.gz	JGYQGMNZTLRWPX-QGZVFWFLSA-N	0	3	317.433	2.495	10	0		DEAEHN
O[C@H](CC1CCCC1)CN1CCOC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000408041271	405097256	/nfs/dbraw/zinc/09/72/56/405097256.db2.gz	BXNLTTVMFJIDFF-BRSBDYLESA-N	0	3	311.466	2.180	10	0		DEAEHN
CC(C)(O)[C@@H]1CCCN1CC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000408032449	405093484	/nfs/dbraw/zinc/09/34/84/405093484.db2.gz	XDSFVSPIXYUAIU-DZPQGLOJSA-N	0	3	320.477	2.307	10	0		DEAEHN
Brc1cnccc1N1CCC[C@H](c2nc[nH]n2)C1	ZINC000408106477	405113948	/nfs/dbraw/zinc/11/39/48/405113948.db2.gz	KXTGAAPAYYALJY-VIFPVBQESA-N	0	3	308.183	2.346	10	0		DEAEHN
CC(C)(C)c1nnsc1C(=O)N[C@H]1CCN2CCCC[C@@H]12	ZINC000408320363	405173097	/nfs/dbraw/zinc/17/30/97/405173097.db2.gz	KZCFXWHMMSLQOO-QWRGUYRKSA-N	0	3	308.451	2.192	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NC[C@@H](Cc1ccccc1)OC	ZINC000452834669	405249345	/nfs/dbraw/zinc/24/93/45/405249345.db2.gz	YXERAWKRKZBKJD-SJORKVTESA-N	0	3	304.434	2.235	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)Nc2ccc(N3CCC3=O)cc2)CCN1C	ZINC000439970429	405298603	/nfs/dbraw/zinc/29/86/03/405298603.db2.gz	ZZSOSOQDCONBQR-OCCSQVGLSA-N	0	3	316.405	2.028	10	0		DEAEHN
O=C(NCCNc1ccncc1)c1cc(-c2ccccc2)ns1	ZINC000440117603	405302323	/nfs/dbraw/zinc/30/23/23/405302323.db2.gz	BNQQVTOHSHUSOD-UHFFFAOYSA-N	0	3	324.409	2.469	10	0		DEAEHN
O[C@@H](COC[C@H]1CCCO1)CN1CCC=C(c2ccccc2)C1	ZINC000556506003	405485693	/nfs/dbraw/zinc/48/56/93/405485693.db2.gz	SORQBDZVIGSERC-RTBURBONSA-N	0	3	317.429	2.332	10	0		DEAEHN
c1cnc(-c2ccnc(NC[C@H]3CCN3C3CCCC3)n2)cn1	ZINC000528210542	405531629	/nfs/dbraw/zinc/53/16/29/405531629.db2.gz	LYZRIIXJZHSLAU-CQSZACIVSA-N	0	3	310.405	2.362	10	0		DEAEHN
Cc1cc(NC(=O)[C@H](N)CN(C)Cc2ccccc2)cs1	ZINC000638994062	405806309	/nfs/dbraw/zinc/80/63/09/405806309.db2.gz	HGQOCASCBAIJSF-OAHLLOKOSA-N	0	3	303.431	2.454	10	0		DEAEHN
c1ccc(-n2nnnc2CCN2CCC[C@H]2c2ccccn2)cc1	ZINC000530724688	405852638	/nfs/dbraw/zinc/85/26/38/405852638.db2.gz	ZKHZPOXWYHCEHH-KRWDZBQOSA-N	0	3	320.400	2.437	10	0		DEAEHN
c1nc(CN[C@@H](C2CCC2)[C@H]2CCCO2)cc2c1OCCO2	ZINC000639388782	406076584	/nfs/dbraw/zinc/07/65/84/406076584.db2.gz	BGYUWWYWKXNUPE-PBHICJAKSA-N	0	3	304.390	2.290	10	0		DEAEHN
C/C(=C\c1ccccc1)CN(C)C[C@H](O)CC1(O)CCOCC1	ZINC000639633659	406180015	/nfs/dbraw/zinc/18/00/15/406180015.db2.gz	OORLCSYAEXHSPK-FXFXYLOPSA-N	0	3	319.445	2.314	10	0		DEAEHN
c1cc(N2CCCN(Cc3nc(C4CCC4)no3)CC2)ccn1	ZINC000639685651	406205477	/nfs/dbraw/zinc/20/54/77/406205477.db2.gz	WNGVNMIVXMQZGB-UHFFFAOYSA-N	0	3	313.405	2.444	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@H]1C[C@H]1C1CCCCC1	ZINC000536020222	406248287	/nfs/dbraw/zinc/24/82/87/406248287.db2.gz	UALIKBLWGPMDAC-HOTGVXAUSA-N	0	3	302.422	2.183	10	0		DEAEHN
CC(C)c1ccc(CCNC(=O)CN2CC[C@@H](CO)[C@H]2C)cc1	ZINC000488716542	406340593	/nfs/dbraw/zinc/34/05/93/406340593.db2.gz	JQOUTKQGCUFJJF-QAPCUYQASA-N	0	3	318.461	2.171	10	0		DEAEHN
CC1=CCN(CCNCc2ccc(-n3cncn3)c(F)c2)CC1	ZINC000546562904	406362010	/nfs/dbraw/zinc/36/20/10/406362010.db2.gz	PDOGUJXFPBYABM-UHFFFAOYSA-N	0	3	315.396	2.148	10	0		DEAEHN
C[C@@H](NCCCn1ccnn1)c1ccc(Br)cn1	ZINC000570598614	406415589	/nfs/dbraw/zinc/41/55/89/406415589.db2.gz	MHFBRBONEKZLTF-SNVBAGLBSA-N	0	3	310.199	2.177	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)[C@@H]2CNCc3ccccc32)c1	ZINC000570680022	406425525	/nfs/dbraw/zinc/42/55/25/406425525.db2.gz	GWKHQYRAXTZEBH-GOSISDBHSA-N	0	3	323.396	2.495	10	0		DEAEHN
CC[C@@H]1CCCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)C1	ZINC000637935772	406484562	/nfs/dbraw/zinc/48/45/62/406484562.db2.gz	UVNRTTDTKVLZRU-WBVHZDCISA-N	0	3	303.450	2.094	10	0		DEAEHN
CCC1CCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)CC1	ZINC000637941273	406488053	/nfs/dbraw/zinc/48/80/53/406488053.db2.gz	MKRUKGLFHSABBT-KRWDZBQOSA-N	0	3	303.450	2.094	10	0		DEAEHN
Cc1ccccc1CNC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637887862	406463834	/nfs/dbraw/zinc/46/38/34/406463834.db2.gz	ZRAUMCHFIDWHHX-GOSISDBHSA-N	0	3	311.429	2.071	10	0		DEAEHN
CS[C@H]1CN(C(=O)CCOCC(C)C)C[C@H]1N1CCCC1	ZINC000361632693	286719535	/nfs/dbraw/zinc/71/95/35/286719535.db2.gz	UJVIGRPSEGOOAG-CABCVRRESA-N	0	3	314.495	2.087	10	0		DEAEHN
Cc1cc(CCN[C@H](C)c2ccc3c(c2)OCC(=O)N3)on1	ZINC000552098547	406683121	/nfs/dbraw/zinc/68/31/21/406683121.db2.gz	HAAWKGTYPWIJFD-LLVKDONJSA-N	0	3	301.346	2.207	10	0		DEAEHN
COc1nsc(CNC[C@@H]2CCCOC2)c1Br	ZINC000638398848	406747412	/nfs/dbraw/zinc/74/74/12/406747412.db2.gz	FRGNTPGKICXVPQ-QMMMGPOBSA-N	0	3	321.240	2.430	10	0		DEAEHN
COc1ccccc1[C@H](O)CN[C@H]1CCCc2c1cnn2C	ZINC000130602832	196094395	/nfs/dbraw/zinc/09/43/95/196094395.db2.gz	YZYREVJJBJGWAO-GOEBONIOSA-N	0	3	301.390	2.129	10	0		DEAEHN
CSCC[C@@H](N)C(=O)Nc1cc(C)c(Br)cn1	ZINC000131280117	196156518	/nfs/dbraw/zinc/15/65/18/196156518.db2.gz	JBRDIJRZKULVPF-SECBINFHSA-N	0	3	318.240	2.171	10	0		DEAEHN
Cc1nn(C)c(C[C@@H](N)c2ncccc2F)c1Br	ZINC000131316091	196160204	/nfs/dbraw/zinc/16/02/04/196160204.db2.gz	RCYIBPQWLQLPGV-SECBINFHSA-N	0	3	313.174	2.268	10	0		DEAEHN
N[C@H](CSc1ncns1)c1ccc2c(c1)OCCCO2	ZINC000131325462	196160490	/nfs/dbraw/zinc/16/04/90/196160490.db2.gz	XEDCJZPTVAUZDH-SNVBAGLBSA-N	0	3	309.416	2.492	10	0		DEAEHN
COCCN(CCOC)[C@@H](CN)c1ccc(C(F)F)cc1	ZINC000131422930	196166743	/nfs/dbraw/zinc/16/67/43/196166743.db2.gz	GCIRYFWUIICLGM-AWEZNQCLSA-N	0	3	302.365	2.219	10	0		DEAEHN
CCN[C@@H](Cc1cccc(F)c1F)[C@H]1CCCCS1(=O)=O	ZINC000131484392	196173259	/nfs/dbraw/zinc/17/32/59/196173259.db2.gz	MNTJOEKLTMRWJB-UONOGXRCSA-N	0	3	317.401	2.453	10	0		DEAEHN
CCCC[C@@H](O)c1c(Br)cnn1CCN(C)C	ZINC000132190979	196234133	/nfs/dbraw/zinc/23/41/33/196234133.db2.gz	ONEORZPANQHHBK-LLVKDONJSA-N	0	3	304.232	2.431	10	0		DEAEHN
C[C@@H]1CC[C@](O)(c2c(Br)cnn2CCN(C)C)C1	ZINC000132360090	196248725	/nfs/dbraw/zinc/24/87/25/196248725.db2.gz	ZKBOTSOLAFIEMT-ZWNOBZJWSA-N	0	3	316.243	2.215	10	0		DEAEHN
C[C@H]1CNC[C@H](COCc2cccc(Br)c2)O1	ZINC000132728797	196278842	/nfs/dbraw/zinc/27/88/42/196278842.db2.gz	IWOXMRKXQNWLGK-GXFFZTMASA-N	0	3	300.196	2.343	10	0		DEAEHN
C[C@@H](NCCn1c(=O)cccc1C(F)(F)F)[C@@H]1CCCO1	ZINC000132826911	196288380	/nfs/dbraw/zinc/28/83/80/196288380.db2.gz	WDGGJKOBRVVWGR-MNOVXSKESA-N	0	3	304.312	2.024	10	0		DEAEHN
COc1ccncc1NC(=O)c1ccccc1OCCN(C)C	ZINC000132847178	196290120	/nfs/dbraw/zinc/29/01/20/196290120.db2.gz	FPEIWMKQNNKFAD-UHFFFAOYSA-N	0	3	315.373	2.283	10	0		DEAEHN
COc1ccccc1C1CC(NC[C@@H]2CCCS2(=O)=O)C1	ZINC000133872263	196342072	/nfs/dbraw/zinc/34/20/72/196342072.db2.gz	CGGZMQLONRBCKK-RUXDESIVSA-N	0	3	309.431	2.108	10	0		DEAEHN
COCC(C)(C)NCC(=O)Nc1cccc(Br)c1	ZINC000134309492	196378812	/nfs/dbraw/zinc/37/88/12/196378812.db2.gz	WHWCOEISFFYMBS-UHFFFAOYSA-N	0	3	315.211	2.402	10	0		DEAEHN
CN(C)CCc1noc(-c2cccc(Br)c2N)n1	ZINC000134762184	196418275	/nfs/dbraw/zinc/41/82/75/196418275.db2.gz	ZULHPYXWMMFIBC-UHFFFAOYSA-N	0	3	311.183	2.185	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)c2sc3cnccc3c2N)C1	ZINC000135950209	196510917	/nfs/dbraw/zinc/51/09/17/196510917.db2.gz	NBNLWIVNEZPGEB-SNVBAGLBSA-N	0	3	304.419	2.045	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2[C@@H](C)CC[C@@H]2CC)nc1	ZINC000136753348	196551511	/nfs/dbraw/zinc/55/15/11/196551511.db2.gz	WBQPXBGYWXRUCP-JSGCOSHPSA-N	0	3	311.451	2.143	10	0		DEAEHN
Cc1ccccc1CCNC(=O)CN(C)[C@]1(CO)CC[C@H](C)C1	ZINC000188030985	225006584	/nfs/dbraw/zinc/00/65/84/225006584.db2.gz	AQSAPHNTAXXWJR-HNAYVOBHSA-N	0	3	318.461	2.137	10	0		DEAEHN
Cc1nnc(CN2CCN(c3ccnc4c(C)cccc34)CC2)[nH]1	ZINC000302139931	230117074	/nfs/dbraw/zinc/11/70/74/230117074.db2.gz	JBYOPIQROZMXMB-UHFFFAOYSA-N	0	3	322.416	2.292	10	0		DEAEHN
CC(C)(N)c1cn(Cc2ccc(F)cc2Br)nn1	ZINC000070118082	424842183	/nfs/dbraw/zinc/84/21/83/424842183.db2.gz	TYEJZOBUBQPVIP-UHFFFAOYSA-N	0	3	313.174	2.422	10	0		DEAEHN
Fc1ccc(OCCN2CCC[C@@H](Cn3cncn3)C2)cc1	ZINC000105882791	424849658	/nfs/dbraw/zinc/84/96/58/424849658.db2.gz	IPIHLHPCUJHKJH-CQSZACIVSA-N	0	3	304.369	2.208	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cccc(NC(=O)C3CC3)c2)C1	ZINC000194628131	424877691	/nfs/dbraw/zinc/87/76/91/424877691.db2.gz	HJUCUPYKHPQMEU-INIZCTEOSA-N	0	3	315.417	2.249	10	0		DEAEHN
O=C(CCc1cnn(-c2ccccc2)c1)N1CCN2CCC[C@@H]2C1	ZINC000195321735	424882309	/nfs/dbraw/zinc/88/23/09/424882309.db2.gz	SGORZWWVKVLGFJ-GOSISDBHSA-N	0	3	324.428	2.112	10	0		DEAEHN
Cc1nc(-c2c[nH]c(C(=O)N3CCN4CCC[C@@H]4C3)c2)cs1	ZINC000195321629	424882401	/nfs/dbraw/zinc/88/24/01/424882401.db2.gz	MHPHHVQHTNJFFM-CYBMUJFWSA-N	0	3	316.430	2.367	10	0		DEAEHN
CCc1ccc([C@@H](C)NCCN2C(=O)NC(C)(C)C2=O)cc1	ZINC000129943243	424857575	/nfs/dbraw/zinc/85/75/75/424857575.db2.gz	XZVOINNLUYKLHF-GFCCVEGCSA-N	0	3	303.406	2.230	10	0		DEAEHN
Cc1nn(CC(C)C)c(C)c1CC(=O)N(C)[C@H]1CCCN(C)C1	ZINC000153799600	424860603	/nfs/dbraw/zinc/86/06/03/424860603.db2.gz	GFGIYTWJWIXMRO-INIZCTEOSA-N	0	3	320.481	2.251	10	0		DEAEHN
CC(C)n1ncnc1CN[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000389839272	424916027	/nfs/dbraw/zinc/91/60/27/424916027.db2.gz	MMHDDRCEOKFLAR-DOTOQJQBSA-N	0	3	313.449	2.469	10	0		DEAEHN
CCCC(=O)N1CCO[C@H]2CCN(Cc3ccccc3)C[C@@H]21	ZINC000404139320	424925023	/nfs/dbraw/zinc/92/50/23/424925023.db2.gz	GMJGGIWWEMKKGY-IRXDYDNUSA-N	0	3	302.418	2.288	10	0		DEAEHN
CC[C@H]1COC(C)(C)CN1C[C@H](O)COCc1ccccc1	ZINC000403898836	424925298	/nfs/dbraw/zinc/92/52/98/424925298.db2.gz	YZDUCJXPXAINAW-IRXDYDNUSA-N	0	3	307.434	2.454	10	0		DEAEHN
O[C@]1(CCNCc2cc(Br)ccc2F)CCOC1	ZINC000404223139	424925811	/nfs/dbraw/zinc/92/58/11/424925811.db2.gz	ZSUVOKSUBXDSKU-CYBMUJFWSA-N	0	3	318.186	2.219	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)CN(C)[C@@]1(CO)CC[C@@H](C)C1	ZINC000249573266	424887630	/nfs/dbraw/zinc/88/76/30/424887630.db2.gz	OTZWXAGASLCMRX-BEFAXECRSA-N	0	3	318.461	2.436	10	0		DEAEHN
COc1ncc(CNC[C@@H]2CCN(CC(F)(F)F)C2)s1	ZINC000313199059	424895225	/nfs/dbraw/zinc/89/52/25/424895225.db2.gz	YHJROMLLAHKJSP-VIFPVBQESA-N	0	3	309.357	2.126	10	0		DEAEHN
Cc1cc([C@@H](C)NC[C@@H]2CCCO[C@H]2c2ccnn2C)nn1C	ZINC000658268564	425463914	/nfs/dbraw/zinc/46/39/14/425463914.db2.gz	JHQANKOCLOFIPB-JKIFEVAISA-N	0	3	317.437	2.281	10	0		DEAEHN
C[C@@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1csnn1	ZINC000334132161	269023415	/nfs/dbraw/zinc/02/34/15/269023415.db2.gz	VFQPMHIRPRUDQN-GFCCVEGCSA-N	0	3	323.466	2.259	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CC[C@@H](Cc2ccncc2)C1	ZINC000363718804	269073917	/nfs/dbraw/zinc/07/39/17/269073917.db2.gz	NSOAAYXZBHRIRZ-DLBZAZTESA-N	0	3	316.449	2.140	10	0		DEAEHN
CS[C@@H]1CCC[C@@H](NC(=O)N2CC[C@H](N3CC=CC3)C2)C1	ZINC000175034854	274179042	/nfs/dbraw/zinc/17/90/42/274179042.db2.gz	BCOJUQCAVQUJSD-QLFBSQMISA-N	0	3	309.479	2.316	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)N[C@H]2COc3ccccc32)CCN1C	ZINC000246199237	274386434	/nfs/dbraw/zinc/38/64/34/274386434.db2.gz	MXIHQTMFAKKIKS-IPYPFGDCSA-N	0	3	303.406	2.244	10	0		DEAEHN
O=C1NCCC[C@H]1N[C@@H]1CCc2cc(Br)ccc2C1	ZINC000104358114	275023262	/nfs/dbraw/zinc/02/32/62/275023262.db2.gz	SIUJPPZUZAVBMX-ZIAGYGMSSA-N	0	3	323.234	2.175	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCCC[C@@H]2c2cn[nH]c2)C1	ZINC000182440938	276166333	/nfs/dbraw/zinc/16/63/33/276166333.db2.gz	OCAOAXQXMCVXPW-HUUCEWRRSA-N	0	3	305.426	2.131	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H]1CCN(c2ccccc2)C1=O	ZINC000245465973	276377743	/nfs/dbraw/zinc/37/77/43/276377743.db2.gz	IZWRLFMJUKMWCV-IRXDYDNUSA-N	0	3	301.434	2.208	10	0		DEAEHN
CN1CCO[C@@H](CN[C@H]2CCCOc3cc4c(cc32)CCC4)C1	ZINC000246527393	276934080	/nfs/dbraw/zinc/93/40/80/276934080.db2.gz	VBIXOPLPPBTYAT-WMZOPIPTSA-N	0	3	316.445	2.309	10	0		DEAEHN
CN1CC[C@@H]2OCCN(c3ncnc4c5ccccc5oc43)[C@H]2C1	ZINC000284426374	277154656	/nfs/dbraw/zinc/15/46/56/277154656.db2.gz	AEXRXYFGGRFKCH-ZFWWWQNUSA-N	0	3	324.384	2.285	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCC2(O)CCCC2)[C@@H]1c1ccccc1	ZINC000179462097	277166622	/nfs/dbraw/zinc/16/66/22/277166622.db2.gz	TUYHXSNEQHKTGF-HOTGVXAUSA-N	0	3	317.433	2.036	10	0		DEAEHN
CC(C)CN(CCN(C)C)C(=O)N[C@@H]1CCCc2nn(C)cc21	ZINC000375009663	277379596	/nfs/dbraw/zinc/37/95/96/277379596.db2.gz	YXWAMEURABSOMC-OAHLLOKOSA-N	0	3	321.469	2.027	10	0		DEAEHN
COc1cc([C@H](C)N[C@H]2CCc3nc(C)nn3C2)ccc1F	ZINC000153528972	277839287	/nfs/dbraw/zinc/83/92/87/277839287.db2.gz	HGORAFGGDJLJBG-GWCFXTLKSA-N	0	3	304.369	2.400	10	0		DEAEHN
CSc1nc2ncnc(N3CCCN(C4CC4)CC3)c2s1	ZINC000171831388	278180048	/nfs/dbraw/zinc/18/00/48/278180048.db2.gz	DYIKWEIEQWJKKG-UHFFFAOYSA-N	0	3	321.475	2.483	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN1CCC[C@@H](CCC(=O)OC(C)(C)C)C1	ZINC000412059682	278233109	/nfs/dbraw/zinc/23/31/09/278233109.db2.gz	CWHAVBUSRAWIFF-YOEHRIQHSA-N	0	3	313.438	2.160	10	0		DEAEHN
CC(C)C[C@H](C)S(=O)(=O)N1CC[C@H]2[C@@H](CCCN2C)C1	ZINC000246844952	279118289	/nfs/dbraw/zinc/11/82/89/279118289.db2.gz	CIIKSKWOEMYWTR-KKUMJFAQSA-N	0	3	302.484	2.167	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCS[C@@H](C)[C@H]1C	ZINC000246448320	279124962	/nfs/dbraw/zinc/12/49/62/279124962.db2.gz	VFZVPXQOTQNPGA-HZSPNIEDSA-N	0	3	301.500	2.498	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCSC[C@H](C)C1	ZINC000192344255	279124989	/nfs/dbraw/zinc/12/49/89/279124989.db2.gz	KOROKSJVFNFTLV-ZIAGYGMSSA-N	0	3	301.500	2.357	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NC[C@@]1(C)CCCC[C@H]1O	ZINC000246880369	279127649	/nfs/dbraw/zinc/12/76/49/279127649.db2.gz	MQVCRHQYLWPNSZ-BFYDXBDKSA-N	0	3	313.486	2.203	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)N1C[C@H](C)C[C@H](C)C1	ZINC000245477356	279302319	/nfs/dbraw/zinc/30/23/19/279302319.db2.gz	UILNYGISCDVHAH-YYIAUSFCSA-N	0	3	309.498	2.296	10	0		DEAEHN
C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)C1(N)CCOCC1	ZINC000261849488	279973966	/nfs/dbraw/zinc/97/39/66/279973966.db2.gz	MEYBBIOTEFMYAX-GXTWGEPZSA-N	0	3	306.381	2.038	10	0		DEAEHN
Cc1ccc(F)cc1NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000043276419	281435724	/nfs/dbraw/zinc/43/57/24/281435724.db2.gz	LOAJFOOBVNUSIQ-CQSZACIVSA-N	0	3	309.385	2.102	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N(C)C[C@H]1CCCN(C)C1	ZINC000246661491	289081286	/nfs/dbraw/zinc/08/12/86/289081286.db2.gz	GYDDULAJABNCQX-KEYYUXOJSA-N	0	3	302.418	2.351	10	0		DEAEHN
C[C@@](C[NH3+])([N-]S(=O)(=O)c1cccc(Cl)c1Cl)C1CC1	ZINC000130370763	289109124	/nfs/dbraw/zinc/10/91/24/289109124.db2.gz	DVTXYFXYEXBKEN-LBPRGKRZSA-N	0	3	323.245	2.399	10	0		DEAEHN
Cc1nc(CN(C)C2CCN(CCn3cccn3)CC2)oc1C	ZINC000105863564	293258734	/nfs/dbraw/zinc/25/87/34/293258734.db2.gz	FYEMTIYYKCYSOZ-UHFFFAOYSA-N	0	3	317.437	2.084	10	0		DEAEHN
CO[C@H](C)[C@H](C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248888412	294330140	/nfs/dbraw/zinc/33/01/40/294330140.db2.gz	YHDMYIIVLVFHGJ-XRGAULLZSA-N	0	3	305.422	2.154	10	0		DEAEHN
COc1ccc2c(c1)[C@H](NC[C@H](C)N1CCOCC1)CCCO2	ZINC000123246542	295275000	/nfs/dbraw/zinc/27/50/00/295275000.db2.gz	NQMLQVLNQYBAMZ-WMLDXEAASA-N	0	3	320.433	2.219	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccccc1	ZINC000193885111	297130248	/nfs/dbraw/zinc/13/02/48/297130248.db2.gz	ACYWAIRJYCDECL-WBVHZDCISA-N	0	3	304.434	2.249	10	0		DEAEHN
CC[C@H](C)n1ncc(C(=O)N[C@H]2CN(C3CC3)C[C@H]2C)c1C	ZINC000574690359	326178161	/nfs/dbraw/zinc/17/81/61/326178161.db2.gz	BSYGLMVMPYTGNM-WQGACYEGSA-N	0	3	304.438	2.375	10	0		DEAEHN
c1cncc([C@H]2CNCCN2Cc2nnc(C3CC3)n2C2CC2)c1	ZINC000575059722	326215012	/nfs/dbraw/zinc/21/50/12/326215012.db2.gz	HHPLYIWMQKNYGW-MRXNPFEDSA-N	0	3	324.432	2.032	10	0		DEAEHN
c1cc(CN2CCCC[C@@H]2CN2CCOCC2)nc2c1CCC2	ZINC000584396362	337317425	/nfs/dbraw/zinc/31/74/25/337317425.db2.gz	ZATPXKFRUYDJNI-GOSISDBHSA-N	0	3	315.461	2.257	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)NCCN1CCC[C@H](C)C1	ZINC000162084746	521175860	/nfs/dbraw/zinc/17/58/60/521175860.db2.gz	DWNWQIVPVUATAJ-AWEZNQCLSA-N	0	3	324.494	2.449	10	0		DEAEHN
CCN1CC[C@@H]2OCCN(Cc3ncc(Cl)s3)[C@@H]2C1	ZINC000339391771	521716248	/nfs/dbraw/zinc/71/62/48/521716248.db2.gz	IHHNZGXTTMKYOS-MNOVXSKESA-N	0	3	301.843	2.092	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)N1CCC(c2cc[nH]n2)CC1	ZINC000156372480	524329234	/nfs/dbraw/zinc/32/92/34/524329234.db2.gz	QFISGGIGIZCQCQ-CQSZACIVSA-N	0	3	319.453	2.173	10	0		DEAEHN
COc1ccccc1OCCN1CCC[C@H](Cn2cncn2)C1	ZINC000105884345	524673717	/nfs/dbraw/zinc/67/37/17/524673717.db2.gz	UOGWGNYVWNUIAS-HNNXBMFYSA-N	0	3	316.405	2.078	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2noc3c2CCCCC3)CCN1C	ZINC000154338575	525416472	/nfs/dbraw/zinc/41/64/72/525416472.db2.gz	JNIIXAPDBIPJRO-CHWSQXEVSA-N	0	3	305.422	2.498	10	0		DEAEHN
C[C@@H](O)CN1CCN(CCOc2ccccc2Cl)C[C@@H]1C	ZINC000105821073	525796689	/nfs/dbraw/zinc/79/66/89/525796689.db2.gz	YGPBEDOPPVYSSS-UONOGXRCSA-N	0	3	312.841	2.106	10	0		DEAEHN
Cc1cnn([C@H]2CCCN(C[C@H](O)COc3ccccc3)C2)c1	ZINC000105900912	526267672	/nfs/dbraw/zinc/26/76/72/526267672.db2.gz	DRCNGAILOVAOHO-IRXDYDNUSA-N	0	3	315.417	2.268	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@@H](C)C(=O)NC1CCCCC1	ZINC000154579499	527450009	/nfs/dbraw/zinc/45/00/09/527450009.db2.gz	NCRLMXZQAWQAQO-WMLDXEAASA-N	0	3	318.465	2.493	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@H](C)NC[C@@H](C)CS(C)(=O)=O	ZINC000157618799	527588033	/nfs/dbraw/zinc/58/80/33/527588033.db2.gz	FRJZWPDWQZBYJH-NEPJUHHUSA-N	0	3	315.483	2.278	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCN(Cc2ccccc2C)CC1	ZINC000193367150	528618320	/nfs/dbraw/zinc/61/83/20/528618320.db2.gz	WQWHLJBWMBWTLN-IBGZPJMESA-N	0	3	320.477	2.290	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)N[C@@H](C)c1ccncc1OC	ZINC000189852215	529012403	/nfs/dbraw/zinc/01/24/03/529012403.db2.gz	NRDVTDWZCYHWEL-KBPBESRZSA-N	0	3	320.437	2.325	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)CN[C@H]1CCC(=O)N[C@H]1C1CC1	ZINC000328928109	529269713	/nfs/dbraw/zinc/26/97/13/529269713.db2.gz	XPXQKTMCRQGCQO-KEYYUXOJSA-N	0	3	307.438	2.265	10	0		DEAEHN
CC(C)(C)[C@@H](C[NH3+])[N-]S(=O)(=O)c1ccc(F)cc1Cl	ZINC000261558559	535042088	/nfs/dbraw/zinc/04/20/88/535042088.db2.gz	BFJJBBCDRVDINH-LLVKDONJSA-N	0	3	308.806	2.131	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NS(=O)(=O)CC2CCCCC2)C1	ZINC000246482135	535260241	/nfs/dbraw/zinc/26/02/41/535260241.db2.gz	WVZDNLZMOXSLDX-UKRRQHHQSA-N	0	3	302.484	2.215	10	0		DEAEHN
CCC[C@H](C(=O)N1C[C@H](CO)[C@@H](c2ccsc2)C1)N(C)C	ZINC000249527748	535581426	/nfs/dbraw/zinc/58/14/26/535581426.db2.gz	ZEQBVCSXCAYLPD-RBSFLKMASA-N	0	3	310.463	2.013	10	0		DEAEHN
CCOC(=O)[C@H](C)[C@H](C)NCc1ccc2c(c1)sc(=O)n2C	ZINC000192720565	535635560	/nfs/dbraw/zinc/63/55/60/535635560.db2.gz	AMKFGMAYSHIAAF-MNOVXSKESA-N	0	3	322.430	2.277	10	0		DEAEHN
COc1cc2c(cc1OC)[C@H]1[C@@H]3C(=CC[C@@H]1O[C@H]2O)CCN3C	ZINC000014583770	560222404	/nfs/dbraw/zinc/22/24/04/560222404.db2.gz	VHYYSQODIQWPDO-HNONPPJISA-N	0	3	317.385	2.211	10	0	biogenic,in-vitro	DEAEHN
O=S(=O)(/C=C\c1ccccc1)NC[C@H]1CCN(C2CC2)C1	ZINC000254949280	622788618	/nfs/dbraw/zinc/78/86/18/622788618.db2.gz	GEHXPGRPGJZZAA-ZHUYAKLQSA-N	0	3	306.431	2.061	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)S(=O)(=O)/C=C\c2ccccc2)CCN1C	ZINC000255677079	625614464	/nfs/dbraw/zinc/61/44/64/625614464.db2.gz	XJRFVWBOBRTAOG-VGMOZLQASA-N	0	3	308.447	2.402	10	0		DEAEHN
CCn1cncc1CN[C@H]1CCO[C@@H]1c1ccnn1CC1CC1	ZINC000888076036	625048703	/nfs/dbraw/zinc/04/87/03/625048703.db2.gz	QYDGTWKRVQHZPQ-RDJZCZTQSA-N	0	3	315.421	2.129	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@H](C)N2CCc3ccccc32)C1	ZINC000250220044	635153027	/nfs/dbraw/zinc/15/30/27/635153027.db2.gz	ZALLULBHQJNPJD-HOCLYGCPSA-N	0	3	301.434	2.038	10	0		DEAEHN
CCN(C[C@@H]1CCOC1)Cn1ncc2cc(C(=O)OC)ccc21	ZINC000738080523	637968967	/nfs/dbraw/zinc/96/89/67/637968967.db2.gz	GHAJFSOHFNVRES-ZDUSSCGKSA-N	0	3	317.389	2.139	10	0		DEAEHN
COC(=O)/C(C)=C\CN(C)[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000746500336	638350510	/nfs/dbraw/zinc/35/05/10/638350510.db2.gz	SCDDIOJXNLVEBG-RNQWEJQRSA-N	0	3	314.389	2.379	10	0		DEAEHN
C[C@H](OC(=O)c1cccc(CN2CCCC2)c1)c1nncn1C	ZINC000805542372	642027596	/nfs/dbraw/zinc/02/75/96/642027596.db2.gz	NWKRXBAAGBFPHP-ZDUSSCGKSA-N	0	3	314.389	2.329	10	0		DEAEHN
COC(=O)C[C@]1(NCc2ccc([Si](C)(C)C)cc2)CCOC1	ZINC000801941804	645466637	/nfs/dbraw/zinc/46/66/37/645466637.db2.gz	XTPVOEZTLPOVHM-QGZVFWFLSA-N	0	3	321.493	2.044	10	0		DEAEHN
CC[C@H]1CCCCCN1CC(=O)Nc1ccccc1C(N)=O	ZINC000150739283	646085990	/nfs/dbraw/zinc/08/59/90/646085990.db2.gz	FAZBNOUCDIOYKG-ZDUSSCGKSA-N	0	3	303.406	2.379	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cc(Cl)c(N)cc2OC)C1	ZINC000165943541	646511378	/nfs/dbraw/zinc/51/13/78/646511378.db2.gz	OVWSRNXWIZZNCA-SNVBAGLBSA-N	0	3	311.813	2.145	10	0		DEAEHN
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccncc1	ZINC000180528701	648495889	/nfs/dbraw/zinc/49/58/89/648495889.db2.gz	QBMXBOMVEXWWTN-DGCLKSJQSA-N	0	3	322.409	2.464	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cccc(Br)n2)C1	ZINC000182596673	648945607	/nfs/dbraw/zinc/94/56/07/648945607.db2.gz	YQTDJHGJCVZEMS-SNVBAGLBSA-N	0	3	312.211	2.058	10	0		DEAEHN
CNc1ncc(C(=O)N[C@@H](C)CN(C)Cc2ccccc2)s1	ZINC000182642784	648957064	/nfs/dbraw/zinc/95/70/64/648957064.db2.gz	KGBYVBWANHERPX-LBPRGKRZSA-N	0	3	318.446	2.435	10	0		DEAEHN
COC(=O)C[C@@H](C)C(=O)O[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000183173250	649045634	/nfs/dbraw/zinc/04/56/34/649045634.db2.gz	FXUMJHXPOVBBTG-GDBMZVCRSA-N	0	3	319.401	2.393	10	0		DEAEHN
C=CC[C@H](CO)[NH2+]Cc1cc(Br)cc(OC)c1[O-]	ZINC000184273228	649253126	/nfs/dbraw/zinc/25/31/26/649253126.db2.gz	VZXLSTAXGFXYGL-LLVKDONJSA-N	0	3	316.195	2.190	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@H](CN[C@H]2CCn3ccnc32)C1	ZINC000379176399	685390292	/nfs/dbraw/zinc/39/02/92/685390292.db2.gz	QRMFBHXDYMCFRN-OLZOCXBDSA-N	0	3	306.410	2.175	10	0		DEAEHN
[NH3+][C@@H]1CC[C@H](C[N-]S(=O)(=O)c2cccc(Cl)c2Cl)C1	ZINC000388520661	685428639	/nfs/dbraw/zinc/42/86/39/685428639.db2.gz	SOGYHAWXZBLPJS-DTWKUNHWSA-N	0	3	323.245	2.399	10	0		DEAEHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1cn(C)cn1	ZINC000389801253	685435226	/nfs/dbraw/zinc/43/52/26/685435226.db2.gz	BMMFJJJOGFXARF-GXTWGEPZSA-N	0	3	308.426	2.155	10	0		DEAEHN
CCC[C@H](N)c1cn(Cc2ncccc2Br)nn1	ZINC000394073983	685455251	/nfs/dbraw/zinc/45/52/51/685455251.db2.gz	WXBFJTUSEMNWQQ-JTQLQIEISA-N	0	3	310.199	2.284	10	0		DEAEHN
Cc1ccccc1[C@H](C)NCC(=O)Nc1ccccc1C(N)=O	ZINC000125267655	684143956	/nfs/dbraw/zinc/14/39/56/684143956.db2.gz	STCFJIIPVCUPEL-ZDUSSCGKSA-N	0	3	311.385	2.383	10	0		DEAEHN
CCC[C@@H](C(=O)N(C)CCOc1ccccc1OC)N(C)C	ZINC000137231532	684244027	/nfs/dbraw/zinc/24/40/27/684244027.db2.gz	XXOVRHHOFSBPDU-AWEZNQCLSA-N	0	3	308.422	2.263	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)N(CCN(C)C)Cc1cccs1	ZINC000189149914	684374414	/nfs/dbraw/zinc/37/44/14/684374414.db2.gz	MULQOPXUWLAKLP-ZFWWWQNUSA-N	0	3	310.463	2.453	10	0		DEAEHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@H]1CCOC[C@H]1C	ZINC000192515029	684451556	/nfs/dbraw/zinc/45/15/56/684451556.db2.gz	CQIAIUTUGVHSAU-FRRDWIJNSA-N	0	3	316.357	2.015	10	0		DEAEHN
O[C@@H](CN1CCC[C@@H](C2OCCO2)C1)c1ccccc1Cl	ZINC000246069199	685122928	/nfs/dbraw/zinc/12/29/28/685122928.db2.gz	CJBBPOJTNJKZQN-DOMZBBRYSA-N	0	3	311.809	2.458	10	0		DEAEHN
CC[C@H]1CN(C[C@@H](O)c2cc(C)cc(C)c2)CCN1CCOC	ZINC000246810835	685136958	/nfs/dbraw/zinc/13/69/58/685136958.db2.gz	WJVQDVJSGAHRFM-RBUKOAKNSA-N	0	3	320.477	2.379	10	0		DEAEHN
Cc1cc(C)cc([C@H](O)CN2CCN(CC(C)(C)O)[C@@H](C)C2)c1	ZINC000249431528	685179946	/nfs/dbraw/zinc/17/99/46/685179946.db2.gz	ZEWUUNZBCBDLGK-FUHWJXTLSA-N	0	3	320.477	2.114	10	0		DEAEHN
Cc1cnc(CNC[C@@H](O)COCc2ccccc2)c(C)c1	ZINC000724095422	777239783	/nfs/dbraw/zinc/23/97/83/777239783.db2.gz	KKQHQJJSTVNOOQ-QGZVFWFLSA-N	0	3	300.402	2.366	10	0		DEAEHN
CO[C@@H]1CCOC[C@H]1NCc1ccc(Br)c(F)c1	ZINC000724875572	777506406	/nfs/dbraw/zinc/50/64/06/777506406.db2.gz	BJZOYAFZHRMABF-CHWSQXEVSA-N	0	3	318.186	2.482	10	0		DEAEHN
Cc1ccccc1[C@H](C)NC(=O)[C@H](C)N(C)CC1CC(O)C1	ZINC000190201312	786182132	/nfs/dbraw/zinc/18/21/32/786182132.db2.gz	RGOVKSRPAKZHJT-FXQLRMTLSA-N	0	3	304.434	2.263	10	0		DEAEHN
Cn1cc(CNCCc2ccc(O)cc2)c(Br)n1	ZINC000712459183	792189051	/nfs/dbraw/zinc/18/90/51/792189051.db2.gz	LMGXZQPXQHXBFL-UHFFFAOYSA-N	0	3	310.195	2.221	10	0		DEAEHN
Cn1cc(Br)c(CN[C@@H]2CCCc3[nH]ncc32)n1	ZINC000401954735	801858973	/nfs/dbraw/zinc/85/89/73/801858973.db2.gz	SOGBRNXHNSDNIL-SNVBAGLBSA-N	0	3	310.199	2.073	10	0		DEAEHN
c1ccc2c(c1)OC[C@@H](CNCc1ccc3c(c1)OCCO3)O2	ZINC000078371786	1080608317	/nfs/dbraw/zinc/60/83/17/1080608317.db2.gz	OMVATYQYJKQSLT-CQSZACIVSA-N	0	3	313.353	2.387	10	0		DEAEHN
Cc1nn(C)c(Cl)c1CN[C@@H]1CCCN2CCSC[C@H]12	ZINC000720509191	1085262225	/nfs/dbraw/zinc/26/22/25/1085262225.db2.gz	GXXKFWYDYQEMCG-CHWSQXEVSA-N	0	3	314.886	2.051	10	0		DEAEHN
CN1CCC[C@@H]2[C@@H]1CCN2C(=O)c1ccc(Br)nc1	ZINC000720831666	1086194941	/nfs/dbraw/zinc/19/49/41/1086194941.db2.gz	WMBJZICQTOLZGB-NWDGAFQWSA-N	0	3	324.222	2.153	10	0		DEAEHN
Cc1nn(C)cc1CN[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C	ZINC000700736473	1086331711	/nfs/dbraw/zinc/33/17/11/1086331711.db2.gz	GELYTLJKZNPJIJ-OCCSQVGLSA-N	0	3	308.426	2.216	10	0		DEAEHN
CN(CCO)CCN(C)C(=O)c1cc(F)c(Cl)cc1Cl	ZINC000701096952	1086353089	/nfs/dbraw/zinc/35/30/89/1086353089.db2.gz	YIPUXWJSXNFXEJ-UHFFFAOYSA-N	0	3	323.195	2.129	10	0		DEAEHN
O=S1(=O)CCC(NCc2ccsc2C(F)(F)F)CC1	ZINC000704305037	1086577003	/nfs/dbraw/zinc/57/70/03/1086577003.db2.gz	GRTCJWXUKDFREN-UHFFFAOYSA-N	0	3	313.366	2.434	10	0		DEAEHN
COC1(OC)CC[C@H]1N[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000710908959	1086690355	/nfs/dbraw/zinc/69/03/55/1086690355.db2.gz	XUCCUGMXZZARSM-QWHCGFSZSA-N	0	3	314.426	2.127	10	0		DEAEHN
COC1(OC)CC[C@H]1N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C	ZINC000710988334	1086692137	/nfs/dbraw/zinc/69/21/37/1086692137.db2.gz	LHBPPNMMPBLDMA-YNEHKIRRSA-N	0	3	314.426	2.125	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@]23CCC[C@H]2[NH2+]CC3)sc1Cl	ZINC000711622324	1087176779	/nfs/dbraw/zinc/17/67/79/1087176779.db2.gz	JANKZIWKBKQUSZ-BXKDBHETSA-N	0	3	320.867	2.273	10	0		DEAEHN
COC(=O)c1cc(CNC[C@]2(OC)CCSC2)cs1	ZINC000719266321	1088914480	/nfs/dbraw/zinc/91/44/80/1088914480.db2.gz	BATRIFIBSCJKHW-CYBMUJFWSA-N	0	3	301.433	2.146	10	0		DEAEHN
C[C@@H]1[C@H](NC(=O)c2ccc(F)cc2Br)CCN1C	ZINC000719387643	1089058072	/nfs/dbraw/zinc/05/80/72/1089058072.db2.gz	KYWAZBSTGXRJNV-PRHODGIISA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@@H]1[C@H](NC(=O)c2ccc(F)c(Br)c2)CCN1C	ZINC000719384322	1089077127	/nfs/dbraw/zinc/07/71/27/1089077127.db2.gz	CUCAITFCPATXBO-PRHODGIISA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@H](O)[C@H](C)NCc1ccc(Br)cc1[N+](=O)[O-]	ZINC000387016616	1144509174	/nfs/dbraw/zinc/50/91/74/1144509174.db2.gz	ODIWEWFNMIPZGJ-YUMQZZPRSA-N	0	3	303.156	2.216	10	0		DEAEHN
CCc1ccc([C@@H](N)[C@@H](C)SCCS(C)(=O)=O)cc1	ZINC000081768192	192321294	/nfs/dbraw/zinc/32/12/94/192321294.db2.gz	ITQJMAVIFYQECK-RISCZKNCSA-N	0	3	301.477	2.415	10	0		DEAEHN
CN[C@H](c1ccc(OC)cc1)[C@@H](C)SCCS(C)(=O)=O	ZINC000081768867	192322766	/nfs/dbraw/zinc/32/27/66/192322766.db2.gz	ISOBQUCXLVFOPQ-RISCZKNCSA-N	0	3	317.476	2.122	10	0		DEAEHN
CCN[C@@H](CSCCS(C)(=O)=O)c1ccccc1OC	ZINC000081768743	192322978	/nfs/dbraw/zinc/32/29/78/192322978.db2.gz	IOWUFNKKDKNKTR-ZDUSSCGKSA-N	0	3	317.476	2.124	10	0		DEAEHN
CCN[C@H](CSCCS(C)(=O)=O)c1cccc(OC)c1	ZINC000081769106	192323473	/nfs/dbraw/zinc/32/34/73/192323473.db2.gz	TWDRKWBTCUAZHL-CQSZACIVSA-N	0	3	317.476	2.124	10	0		DEAEHN
COc1ccc([C@@H](N)CSc2nnc(N(C)C)s2)cc1	ZINC000081769380	192323520	/nfs/dbraw/zinc/32/35/20/192323520.db2.gz	JRTCQAHCWWTOPY-NSHDSACASA-N	0	3	310.448	2.405	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)[C@@H]1Cc2cc(F)ccc2O1	ZINC000076958659	185060836	/nfs/dbraw/zinc/06/08/36/185060836.db2.gz	XVJUPEMZKFCHLG-WBMJQRKESA-N	0	3	306.381	2.120	10	0		DEAEHN
CCN[C@H](CSCC(=O)OC)c1ccc2c(c1)OCCO2	ZINC000081793186	192324798	/nfs/dbraw/zinc/32/47/98/192324798.db2.gz	FNSIZOQULLXGGS-GFCCVEGCSA-N	0	3	311.403	2.015	10	0		DEAEHN
CCN[C@H]1c2ccccc2OC[C@@H]1Sc1nnc(C)n1C	ZINC000081886243	192334396	/nfs/dbraw/zinc/33/43/96/192334396.db2.gz	KQLGVTNEXYQEQY-KBPBESRZSA-N	0	3	304.419	2.327	10	0		DEAEHN
CSCC[C@H](C)N(C)S(=O)(=O)c1cc(CN)sc1C	ZINC000162568662	197575058	/nfs/dbraw/zinc/57/50/58/197575058.db2.gz	UXHVDTUBVUWDBR-VIFPVBQESA-N	0	3	322.521	2.277	10	0		DEAEHN
COc1ccc(CN)cc1CS(=O)(=O)c1ccc(F)cc1	ZINC000081921105	192338567	/nfs/dbraw/zinc/33/85/67/192338567.db2.gz	DPGLFTIAEXQXBK-UHFFFAOYSA-N	0	3	309.362	2.267	10	0		DEAEHN
COc1ccc(CN)cc1CS(=O)(=O)Cc1ccccc1	ZINC000081923636	192340180	/nfs/dbraw/zinc/34/01/80/192340180.db2.gz	HXKLNMADTJFBOR-UHFFFAOYSA-N	0	3	305.399	2.269	10	0		DEAEHN
CCCN[C@H]1c2ccc(OC)cc2CC[C@H]1S(=O)(=O)CC	ZINC000081925731	192340293	/nfs/dbraw/zinc/34/02/93/192340293.db2.gz	RVXFIXGUCKNMJD-CVEARBPZSA-N	0	3	311.447	2.485	10	0		DEAEHN
CC[C@@H](CS(=O)(=O)c1ccc(Br)cc1)NC	ZINC000081933844	192341006	/nfs/dbraw/zinc/34/10/06/192341006.db2.gz	LWLUIHJBRCSLMB-JTQLQIEISA-N	0	3	306.225	2.221	10	0		DEAEHN
CN(CCC(N)=S)C(=O)CN1CCC[C@@H](C(C)(C)C)CC1	ZINC000079342516	185165951	/nfs/dbraw/zinc/16/59/51/185165951.db2.gz	NOJPUQWUAMCLNG-CYBMUJFWSA-N	0	3	313.511	2.269	10	0		DEAEHN
CCCN[C@H]1c2ccccc2CC[C@H]1S(=O)(=O)CCOC	ZINC000081944549	192345825	/nfs/dbraw/zinc/34/58/25/192345825.db2.gz	URKPGMHITAUUHX-CVEARBPZSA-N	0	3	311.447	2.103	10	0		DEAEHN
CC[C@H](NC(=O)N1CC[C@@H](N(C)C)C1)c1ccc(OC)cc1	ZINC000170826285	282180584	/nfs/dbraw/zinc/18/05/84/282180584.db2.gz	HKHMJPCZIRWQJJ-ZBFHGGJFSA-N	0	3	305.422	2.492	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H](C)C1CCCCC1	ZINC000173176506	282188491	/nfs/dbraw/zinc/18/84/91/282188491.db2.gz	PFIOVPABRRQVOW-GOEBONIOSA-N	0	3	311.470	2.365	10	0		DEAEHN
CCOC(=O)COC[C@H](N)c1sc(C)cc1Br	ZINC000087646364	185229714	/nfs/dbraw/zinc/22/97/14/185229714.db2.gz	CRYADHRKMSCJOW-VIFPVBQESA-N	0	3	322.224	2.399	10	0		DEAEHN
NCc1ccccc1CS(=O)(=O)N1CCC[C@H]2CCC[C@@H]21	ZINC000087768822	185231576	/nfs/dbraw/zinc/23/15/76/185231576.db2.gz	AHODQNHQTWHAEU-CJNGLKHVSA-N	0	3	308.447	2.240	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@@]1(CN)Nc1cccc(Cl)c1	ZINC000087913634	185237301	/nfs/dbraw/zinc/23/73/01/185237301.db2.gz	QFVUFGOXGZMESE-OLZOCXBDSA-N	0	3	302.827	2.047	10	0		DEAEHN
CS(=O)(=O)[C@H]1CCC[C@@]1(CN)Nc1ccccc1Cl	ZINC000087915970	185237321	/nfs/dbraw/zinc/23/73/21/185237321.db2.gz	DYQIUKZHOARAMY-STQMWFEESA-N	0	3	302.827	2.047	10	0		DEAEHN
O=S(=O)([N-]c1ccccc1-c1ccccc1)[C@H]1CC[NH2+]C1	ZINC000088056074	185238437	/nfs/dbraw/zinc/23/84/37/185238437.db2.gz	BTCLUHKEBSXGBL-AWEZNQCLSA-N	0	3	302.399	2.457	10	0		DEAEHN
COc1cc(C)c(Br)cc1[C@@H](N)[C@@H]1COCCO1	ZINC000088078061	185238842	/nfs/dbraw/zinc/23/88/42/185238842.db2.gz	XYGGRDMZEWWWLS-QWHCGFSZSA-N	0	3	316.195	2.181	10	0		DEAEHN
CC[C@@]1(CO)CCCN1CC(=O)N1CCC[C@H](C(F)(F)F)C1	ZINC000189649472	529560938	/nfs/dbraw/zinc/56/09/38/529560938.db2.gz	WTUJWTALHAQUKV-JSGCOSHPSA-N	0	3	322.371	2.024	10	0		DEAEHN
O=S(=O)(C[C@H]1CCCCN1)N1CCCCc2ccccc21	ZINC000088337525	185246423	/nfs/dbraw/zinc/24/64/23/185246423.db2.gz	QJNXXDRSXKYOOT-OAHLLOKOSA-N	0	3	308.447	2.301	10	0		DEAEHN
CC[C@H](CN)S(=O)(=O)N1CCC(Cc2ccccc2)CC1	ZINC000088472436	185252234	/nfs/dbraw/zinc/25/22/34/185252234.db2.gz	RQAXDSIQPKCHHK-MRXNPFEDSA-N	0	3	310.463	2.008	10	0		DEAEHN
N[C@](CO)(CN1CCC[C@H](C(F)(F)F)C1)c1ccccc1	ZINC000088439627	185250663	/nfs/dbraw/zinc/25/06/63/185250663.db2.gz	WXICJBTWNPPIBE-KBPBESRZSA-N	0	3	302.340	2.107	10	0		DEAEHN
CC(C)C[NH2+]Cc1ccc(S(=O)(=O)[N-][C@@H](C)C(C)C)o1	ZINC000088541823	185255875	/nfs/dbraw/zinc/25/58/75/185255875.db2.gz	NITOUYMDEPSYEX-LBPRGKRZSA-N	0	3	302.440	2.348	10	0		DEAEHN
C[N-]S(=O)(=O)c1ccc(C[NH2+][C@@H]2CCCCC[C@H]2C)o1	ZINC000088541011	185255994	/nfs/dbraw/zinc/25/59/94/185255994.db2.gz	DOTPCDUUJKIKJJ-DGCLKSJQSA-N	0	3	300.424	2.246	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@@H](CC)C(C)C)o1	ZINC000088542960	185256064	/nfs/dbraw/zinc/25/60/64/185256064.db2.gz	CANMAWHFVVQUME-ZDUSSCGKSA-N	0	3	302.440	2.492	10	0		DEAEHN
CN[C@@H](C)[C@H](C)S(=O)(=O)c1cccc(Br)c1	ZINC000081982670	192349367	/nfs/dbraw/zinc/34/93/67/192349367.db2.gz	DJCBZUIQSFGMRZ-IUCAKERBSA-N	0	3	306.225	2.219	10	0		DEAEHN
Cc1ccccc1S(=O)(=O)N1CCCC[C@H]1CNC1CC1	ZINC000088716904	185263249	/nfs/dbraw/zinc/26/32/49/185263249.db2.gz	MWHBTUPKBMJIOY-HNNXBMFYSA-N	0	3	308.447	2.290	10	0		DEAEHN
N[C@H](C[S@@](=O)c1ccccc1)c1ccc2c(c1)OCCO2	ZINC000082001211	192352940	/nfs/dbraw/zinc/35/29/40/192352940.db2.gz	KHSQXXOSPLWHSI-SZNDQCEHSA-N	0	3	303.383	2.265	10	0		DEAEHN
N[C@H]1COC[C@@H]1C(=O)Nc1ccccc1SC(F)(F)F	ZINC000090379821	185293602	/nfs/dbraw/zinc/29/36/02/185293602.db2.gz	UGHDQSIRUPYDLE-YUMQZZPRSA-N	0	3	306.309	2.211	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)N(C)Cc1cc(Cl)cc(Cl)c1	ZINC000090435294	185296235	/nfs/dbraw/zinc/29/62/35/185296235.db2.gz	GGFPMKRSCFOZFI-STQMWFEESA-N	0	3	317.216	2.186	10	0		DEAEHN
CSc1nc2ccc(NC(=O)[C@@]3(C)COC[C@H]3N)cc2s1	ZINC000090586070	185305219	/nfs/dbraw/zinc/30/52/19/185305219.db2.gz	ADNVPOAWGCJTJV-RISCZKNCSA-N	0	3	323.443	2.321	10	0		DEAEHN
Cc1ccc(Br)cc1NC(=O)[C@@]1(C)COC[C@@H]1N	ZINC000090588840	185305394	/nfs/dbraw/zinc/30/53/94/185305394.db2.gz	WTVOATUVHSNKHZ-AAEUAGOBSA-N	0	3	313.195	2.060	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)[C@@]1(C)COC[C@H]1N	ZINC000090589950	185305441	/nfs/dbraw/zinc/30/54/41/185305441.db2.gz	DSARACRUQUVKLX-HIFRSBDPSA-N	0	3	312.797	2.431	10	0		DEAEHN
CN(Cc1cccc(Cl)c1Cl)C(=O)[C@]1(C)COC[C@H]1N	ZINC000090590400	185305579	/nfs/dbraw/zinc/30/55/79/185305579.db2.gz	PZBWAJLGHVLQKU-BXUZGUMPSA-N	0	3	317.216	2.316	10	0		DEAEHN
CCN(CC)C(=O)C[C@@H](C)NCc1cn(C)nc1C(F)(F)F	ZINC000090666086	185308454	/nfs/dbraw/zinc/30/84/54/185308454.db2.gz	HCPSTTLTUIZAEG-SNVBAGLBSA-N	0	3	320.359	2.176	10	0		DEAEHN
CN(C[C@H]1CCCN1C)C(=O)C1(C(N)=S)CCCCCC1	ZINC000092631729	185330190	/nfs/dbraw/zinc/33/01/90/185330190.db2.gz	CUIXROXGDJBUFX-CYBMUJFWSA-N	0	3	311.495	2.166	10	0		DEAEHN
CC(C)n1cc(S(=O)(=O)NC2C(C)(C)C2(C)C)cc1CN	ZINC000092833242	185344786	/nfs/dbraw/zinc/34/47/86/185344786.db2.gz	XPYDJMJCHOENIN-UHFFFAOYSA-N	0	3	313.467	2.241	10	0		DEAEHN
CCc1ncc(CN[C@@H]2CCCN(c3ncccn3)C2)s1	ZINC000037924450	539335932	/nfs/dbraw/zinc/33/59/32/539335932.db2.gz	ZFUJHIPYWLSVSR-GFCCVEGCSA-N	0	3	303.435	2.254	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)CC(=O)NCc2cccc(Cl)c2)C1	ZINC000187903892	282294192	/nfs/dbraw/zinc/29/41/92/282294192.db2.gz	GRHUFKMHJSWFHI-DYVFJYSZSA-N	0	3	324.852	2.439	10	0		DEAEHN
Clc1ccc(Br)cc1OC[C@@H]1CNCCO1	ZINC000070834207	539345704	/nfs/dbraw/zinc/34/57/04/539345704.db2.gz	BZJFBUIRGLZAAK-VIFPVBQESA-N	0	3	306.587	2.470	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)C(=O)Nc1ccccc1C	ZINC000190342214	282318611	/nfs/dbraw/zinc/31/86/11/282318611.db2.gz	IGVIQGWWWYWDGP-LSDHHAIUSA-N	0	3	315.417	2.019	10	0		DEAEHN
C[C@H]1CSCCN(CC(=O)N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000190438251	282320816	/nfs/dbraw/zinc/32/08/16/282320816.db2.gz	KSYOQGNPICJQFY-NEPJUHHUSA-N	0	3	324.412	2.472	10	0		DEAEHN
C[C@H]1CC[NH2+]C[C@H]1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000193418372	282350530	/nfs/dbraw/zinc/35/05/30/282350530.db2.gz	HKAISQUQMBXLGA-QPUJVOFHSA-N	0	3	323.245	2.270	10	0		DEAEHN
CN(Cc1cncs1)C[C@@H]1CCCN(C)[C@H]1c1cnn(C)c1	ZINC000328656375	530017197	/nfs/dbraw/zinc/01/71/97/530017197.db2.gz	ZGVPRSRZOSKHCD-XJKSGUPXSA-N	0	3	319.478	2.392	10	0		DEAEHN
COC[C@@H](NC[C@]1(CCO)CCOC1)c1ccc(Cl)cc1	ZINC000194083384	282362479	/nfs/dbraw/zinc/36/24/79/282362479.db2.gz	SAMSBBVHBSQBAC-CVEARBPZSA-N	0	3	313.825	2.406	10	0		DEAEHN
CC(C)(C)OC[C@H](O)CN1CCC[C@@H]1C[C@@H](O)c1ccco1	ZINC000246432505	534985465	/nfs/dbraw/zinc/98/54/65/534985465.db2.gz	DGFAWDMQHLCCNJ-RBSFLKMASA-N	0	3	311.422	2.344	10	0		DEAEHN
CC[C@@H](C)CS(=O)(=O)N1CC[C@H]2CC[C@@H](C1)N2C(C)C	ZINC000245496993	282391979	/nfs/dbraw/zinc/39/19/79/282391979.db2.gz	SODSJGFNQKDIBY-KFWWJZLASA-N	0	3	302.484	2.309	10	0		DEAEHN
CC[C@@H](C(N)=O)N1CCC(CN2CCc3ccccc32)CC1	ZINC000111307303	185578917	/nfs/dbraw/zinc/57/89/17/185578917.db2.gz	KGPDFCGTUIOPLY-INIZCTEOSA-N	0	3	301.434	2.025	10	0		DEAEHN
COc1ccc(CN2CCCN(Cc3cncnc3)CC2)cc1	ZINC000156852260	539567055	/nfs/dbraw/zinc/56/70/55/539567055.db2.gz	RCZWKOMVUPOCPT-UHFFFAOYSA-N	0	3	312.417	2.193	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CC[C@H](c2cccc(CO)c2)C1	ZINC000616611161	362897633	/nfs/dbraw/zinc/89/76/33/362897633.db2.gz	ATRKCWVBIYTPQO-INIZCTEOSA-N	0	3	320.433	2.493	10	0		DEAEHN
Cc1nn(C)c(C)c1CCCNC(=O)[C@@H](C)N1CCCCCC1	ZINC000180372813	539645189	/nfs/dbraw/zinc/64/51/89/539645189.db2.gz	QJCZKJQTGQTVLP-MRXNPFEDSA-N	0	3	320.481	2.350	10	0		DEAEHN
O=C(CCNCc1cccc2cnccc21)NCc1cccnc1	ZINC000181505626	539652072	/nfs/dbraw/zinc/65/20/72/539652072.db2.gz	TZPLLVMGDWTHSR-UHFFFAOYSA-N	0	3	320.396	2.426	10	0		DEAEHN
CN[C@@H](c1cccc2c1OC(C)(C)C2)[C@H]1CCS(=O)(=O)C1	ZINC000080507490	192163359	/nfs/dbraw/zinc/16/33/59/192163359.db2.gz	YZLNFPCBGVIACZ-GXTWGEPZSA-N	0	3	309.431	2.095	10	0		DEAEHN
NC1CN(CCOc2ccc(Cl)cc2Br)C1	ZINC000083636146	192376187	/nfs/dbraw/zinc/37/61/87/192376187.db2.gz	KFJMBQJZOLFPOF-UHFFFAOYSA-N	0	3	305.603	2.124	10	0		DEAEHN
CCCN[C@@H](C[S@](=O)CCOC)c1cc(C)ccc1OC	ZINC000084036269	192396619	/nfs/dbraw/zinc/39/66/19/192396619.db2.gz	GMGWRWOTMQSXRY-BTYIYWSLSA-N	0	3	313.463	2.439	10	0		DEAEHN
COc1cccc2c1CN(Cc1ccc3c(c1)OCO3)[C@H]2CN	ZINC000071683157	191006975	/nfs/dbraw/zinc/00/69/75/191006975.db2.gz	MVXYVOJOTXUCMC-HNNXBMFYSA-N	0	3	312.369	2.440	10	0		DEAEHN
Cn1cc(CN2Cc3c(cccc3C(F)(F)F)[C@@H]2CN)cn1	ZINC000071684183	191007914	/nfs/dbraw/zinc/00/79/14/191007914.db2.gz	AWDKNRSZGTYMOE-AWEZNQCLSA-N	0	3	310.323	2.455	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2	ZINC000291663588	404469009	/nfs/dbraw/zinc/46/90/09/404469009.db2.gz	FKSLWNBMVIKCFF-KURKYZTESA-N	0	3	324.428	2.374	10	0		DEAEHN
CC(C)NCc1cc(F)c(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000138245333	186015289	/nfs/dbraw/zinc/01/52/89/186015289.db2.gz	HEHJGHKLJNNTQS-UHFFFAOYSA-N	0	3	318.389	2.247	10	0		DEAEHN
CCCN(C(C)C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138450698	186017067	/nfs/dbraw/zinc/01/70/67/186017067.db2.gz	NQXIAEXVHCHYGX-UHFFFAOYSA-N	0	3	306.378	2.233	10	0		DEAEHN
CCN[C@H](C)c1ccc(OC)cc1OCCCS(C)(=O)=O	ZINC000138532404	186017839	/nfs/dbraw/zinc/01/78/39/186017839.db2.gz	AWGKITHCQRASFO-GFCCVEGCSA-N	0	3	315.435	2.179	10	0		DEAEHN
CCC[C@H](C)N(C)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138529532	186017874	/nfs/dbraw/zinc/01/78/74/186017874.db2.gz	FZFWUJOPXKXEBC-JTQLQIEISA-N	0	3	320.405	2.493	10	0		DEAEHN
CC[C@@H](C)CN(CC)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000139184958	186020015	/nfs/dbraw/zinc/02/00/15/186020015.db2.gz	UFHQAZOYPDHJOO-SNVBAGLBSA-N	0	3	320.405	2.480	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N2C[C@H](C)C[C@@H]2C)c1	ZINC000139345563	186021545	/nfs/dbraw/zinc/02/15/45/186021545.db2.gz	AURUGNYINFCDLS-ZJUUUORDSA-N	0	3	318.389	2.103	10	0		DEAEHN
CCNCc1cc(F)c(F)c(S(=O)(=O)N2CC=CCC2)c1	ZINC000139351230	186021559	/nfs/dbraw/zinc/02/15/59/186021559.db2.gz	IOFYFCXJSVURSZ-UHFFFAOYSA-N	0	3	316.373	2.025	10	0		DEAEHN
CC/C=C/CC(=O)N1CCC2(CC1)c1ccccc1[C@@H](N)[C@@H]2O	ZINC000072153283	191057330	/nfs/dbraw/zinc/05/73/30/191057330.db2.gz	BTCJOUSWTBESRI-ZGQVYYGYSA-N	0	3	314.429	2.277	10	0		DEAEHN
CCS(=O)(=O)CCC[C@@H](N)c1ccc(Br)cn1	ZINC000140189163	186026037	/nfs/dbraw/zinc/02/60/37/186026037.db2.gz	AELRWRDLAIZMFS-SNVBAGLBSA-N	0	3	321.240	2.059	10	0		DEAEHN
CCC1(CC)[C@H](OC)C[C@@H]1N(C)C[C@@H](C)CS(C)(=O)=O	ZINC000140712117	186028562	/nfs/dbraw/zinc/02/85/62/186028562.db2.gz	NXFWVGJQCPDSRN-HZSPNIEDSA-N	0	3	305.484	2.193	10	0		DEAEHN
CC[C@]1(C)N[C@@H](c2cccs2)N(C2CCN(C)CC2)C1=O	ZINC000141203874	186029233	/nfs/dbraw/zinc/02/92/33/186029233.db2.gz	ZBZNGZCJFSFGRS-ZBFHGGJFSA-N	0	3	307.463	2.441	10	0		DEAEHN
Cc1cc(C)c(S(=O)(=O)NCC(F)F)cc1CNC1CC1	ZINC000148167253	186043055	/nfs/dbraw/zinc/04/30/55/186043055.db2.gz	JVEJIHPGVAQXMG-UHFFFAOYSA-N	0	3	318.389	2.099	10	0		DEAEHN
CCN1CCC[C@H](N2C(=O)C3(CC3)N[C@H]2c2cccs2)C1	ZINC000144309985	186035235	/nfs/dbraw/zinc/03/52/35/186035235.db2.gz	RXZPVNDDSDPQQH-GXTWGEPZSA-N	0	3	305.447	2.195	10	0		DEAEHN
CCN1CCC[C@H](N2C(=O)C3(CC3)N[C@H]2c2ccsc2)C1	ZINC000144278686	186035381	/nfs/dbraw/zinc/03/53/81/186035381.db2.gz	XVCDTNKMYQAZSX-UONOGXRCSA-N	0	3	305.447	2.195	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N(C)C2CCC2)c(F)c1	ZINC000144655433	186035763	/nfs/dbraw/zinc/03/57/63/186035763.db2.gz	LAMXNXRVFMTYMQ-UHFFFAOYSA-N	0	3	300.399	2.108	10	0		DEAEHN
C[C@H]1OCC[C@H]1NCc1cccc(NC(=O)C(F)(F)F)c1	ZINC000149414105	186049814	/nfs/dbraw/zinc/04/98/14/186049814.db2.gz	XXQWZROUCWRFKP-BXKDBHETSA-N	0	3	302.296	2.454	10	0		DEAEHN
CNCc1cc(Cl)cc(Cl)c1OCc1nncn1C	ZINC000150035774	186054290	/nfs/dbraw/zinc/05/42/90/186054290.db2.gz	YDJQVAGUJNAOJP-UHFFFAOYSA-N	0	3	301.177	2.420	10	0		DEAEHN
CC[C@H]1CCCCCN1CC(=O)NC(=O)NCc1ccco1	ZINC000150745082	186062551	/nfs/dbraw/zinc/06/25/51/186062551.db2.gz	LFVCMXMWKHQLMJ-ZDUSSCGKSA-N	0	3	307.394	2.260	10	0		DEAEHN
c1cc(CN[C@@H]2CCCSC2)c(OC[C@@H]2CCOC2)cn1	ZINC000287134003	219336337	/nfs/dbraw/zinc/33/63/37/219336337.db2.gz	AICOBCSAGXPZFK-UKRRQHHQSA-N	0	3	308.447	2.482	10	0		DEAEHN
CCOc1cc(C(=O)NCCN(C)CCCOC)ccc1C	ZINC000152436713	186072395	/nfs/dbraw/zinc/07/23/95/186072395.db2.gz	VLCJBEWDESGSJC-UHFFFAOYSA-N	0	3	308.422	2.092	10	0		DEAEHN
COCCn1ncc(Br)c1[C@](F)(CN)C(C)C	ZINC000164026983	186146402	/nfs/dbraw/zinc/14/64/02/186146402.db2.gz	GENXEHBUSQQVAZ-NSHDSACASA-N	0	3	308.195	2.072	10	0		DEAEHN
COCCn1ncc(Cl)c1C(=O)C[C@@H](N)c1ccccc1	ZINC000164116002	186149069	/nfs/dbraw/zinc/14/90/69/186149069.db2.gz	XGAJBNUXZFPBDE-CYBMUJFWSA-N	0	3	307.781	2.456	10	0		DEAEHN
COc1cc(CNC[C@@H](C)[S@](C)=O)c(SC)cc1OC	ZINC000159610065	186130863	/nfs/dbraw/zinc/13/08/63/186130863.db2.gz	HTLVTRIQQCIWKB-CFMSYZGJSA-N	0	3	317.476	2.282	10	0		DEAEHN
COc1ccc(CNC[C@H](C)[S@@](C)=O)cc1Br	ZINC000159715168	186137007	/nfs/dbraw/zinc/13/70/07/186137007.db2.gz	QCANMSOULHSQPM-XYZCENFISA-N	0	3	320.252	2.314	10	0		DEAEHN
Fc1cccc(COC[C@H]2CNCCO2)c1Br	ZINC000163958553	186143404	/nfs/dbraw/zinc/14/34/04/186143404.db2.gz	IQZDFMNKRAJCDP-SNVBAGLBSA-N	0	3	304.159	2.093	10	0		DEAEHN
Cc1n[nH]c(C)c1[C@H](C)CC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000164253526	186153398	/nfs/dbraw/zinc/15/33/98/186153398.db2.gz	JDSGQZQWFSPEFM-LALPHHSUSA-N	0	3	306.454	2.461	10	0		DEAEHN
COc1ccc(Br)cc1NC(=O)C(C)=C1CNC1	ZINC000164456788	186159354	/nfs/dbraw/zinc/15/93/54/186159354.db2.gz	ZYWLCRYVLAJQOK-UHFFFAOYSA-N	0	3	311.179	2.316	10	0		DEAEHN
CN(C)c1cc(C(=O)N2CCN3CCC[C@H]3C2)c2ccccc2n1	ZINC000186052764	186235922	/nfs/dbraw/zinc/23/59/22/186235922.db2.gz	DPJBYKIZAPEMPF-AWEZNQCLSA-N	0	3	324.428	2.221	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](C)c2ccc3c(c2)OCO3)C1	ZINC000253356086	186300018	/nfs/dbraw/zinc/30/00/18/186300018.db2.gz	WHOVFRXSXIZRSD-OCCSQVGLSA-N	0	3	319.405	2.260	10	0		DEAEHN
Cc1cc(C)cc(OCCNC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000171904107	198004707	/nfs/dbraw/zinc/00/47/07/198004707.db2.gz	QQADZJNHEAULOY-MRXNPFEDSA-N	0	3	317.433	2.172	10	0		DEAEHN
COc1cc(Cl)ccc1CNC(=O)N1CCN2CCC[C@H]2C1	ZINC000171908056	198005694	/nfs/dbraw/zinc/00/56/94/198005694.db2.gz	IJTJVIZLVVDKCL-AWEZNQCLSA-N	0	3	323.824	2.338	10	0		DEAEHN
O=C([C@@H]1C[C@@H]1c1c(F)cccc1F)N1CCN2CCC[C@@H]2C1	ZINC000172290147	198071732	/nfs/dbraw/zinc/07/17/32/198071732.db2.gz	QASYMQWHGBQXQM-FRRDWIJNSA-N	0	3	306.356	2.375	10	0		DEAEHN
CNc1cnc(C[C@@H]2COCCN(Cc3ccccc3)C2)cn1	ZINC000072388210	191146161	/nfs/dbraw/zinc/14/61/61/191146161.db2.gz	CWFBMAWINVEZMS-INIZCTEOSA-N	0	3	312.417	2.209	10	0		DEAEHN
C[C@@H](N[C@@H](C)C(=O)N1CCNC1=O)c1ccc2c(c1)CCCC2	ZINC000072789113	191228435	/nfs/dbraw/zinc/22/84/35/191228435.db2.gz	KYHJSGQDUVBPQR-OLZOCXBDSA-N	0	3	315.417	2.156	10	0		DEAEHN
Cc1ccc(O[C@@H](C)CNC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000173221562	198197462	/nfs/dbraw/zinc/19/74/62/198197462.db2.gz	ZVTCJZOXYAQPAT-JKSUJKDBSA-N	0	3	317.433	2.252	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(C)cc2)[C@H](C)C1	ZINC000173261287	198202773	/nfs/dbraw/zinc/20/27/73/198202773.db2.gz	DQWVQNYQERZOGV-ZBFHGGJFSA-N	0	3	310.463	2.346	10	0		DEAEHN
O=C(NCC1(c2ccccc2)CC1)N1CC[C@H](N2CC=CC2)C1	ZINC000173625678	198233999	/nfs/dbraw/zinc/23/39/99/198233999.db2.gz	MVWIUMNMPPXLCS-KRWDZBQOSA-N	0	3	311.429	2.374	10	0		DEAEHN
COc1cccc(CCNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000173748127	198247701	/nfs/dbraw/zinc/24/77/01/198247701.db2.gz	PLUVRKNMAAFLKM-GOEBONIOSA-N	0	3	319.449	2.362	10	0		DEAEHN
Cc1cccc(CS(=O)(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000173885046	198265560	/nfs/dbraw/zinc/26/55/60/198265560.db2.gz	WCMLPSAXYRMIRG-GOEBONIOSA-N	0	3	310.463	2.143	10	0		DEAEHN
Cc1cccc(O[C@H](C)CNC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000173915657	198267992	/nfs/dbraw/zinc/26/79/92/198267992.db2.gz	QOYWOEYJRQWUBV-HUUCEWRRSA-N	0	3	305.422	2.108	10	0		DEAEHN
COCc1ccccc1CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000173812235	198255876	/nfs/dbraw/zinc/25/58/76/198255876.db2.gz	RNGZYMPZPYMXFC-YOEHRIQHSA-N	0	3	319.449	2.457	10	0		DEAEHN
C[C@@H](Cc1ccccc1F)NC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000174252946	198310758	/nfs/dbraw/zinc/31/07/58/198310758.db2.gz	YVTUVGBKORIGOL-HOCLYGCPSA-N	0	3	317.408	2.412	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NC(=O)NC[C@H](C)N(C)C1CC1	ZINC000174734961	198377292	/nfs/dbraw/zinc/37/72/92/198377292.db2.gz	NGHBGUYDQNQJMI-GJZGRUSLSA-N	0	3	319.449	2.374	10	0		DEAEHN
COC(=O)CCC(=O)N1c2ccc(C)cc2[C@H]2CN(C)CC[C@H]21	ZINC000016037041	354035490	/nfs/dbraw/zinc/03/54/90/354035490.db2.gz	YFIHNSLWCHRTFQ-GDBMZVCRSA-N	0	3	316.401	2.083	10	0		DEAEHN
CCCOc1ccc(C(=O)CCC(=O)N2CCCNCC2)cc1	ZINC000236786470	202007448	/nfs/dbraw/zinc/00/74/48/202007448.db2.gz	TWCSMRYBKHHTIU-UHFFFAOYSA-N	0	3	318.417	2.260	10	0		DEAEHN
COc1cc(N)c(Cl)cc1C(=O)N[C@H]1CCN2CCC[C@H]1C2	ZINC000004626690	181131074	/nfs/dbraw/zinc/13/10/74/181131074.db2.gz	GZSKEXSLDPEFPT-HZMBPMFUSA-N	0	3	323.824	2.145	10	0	investigational	DEAEHN
Cc1cccc(N2CCN(CCC(=O)N[C@@H]3C[C@H]3C)CC2)c1	ZINC000073327899	191304577	/nfs/dbraw/zinc/30/45/77/191304577.db2.gz	OEDREVSACVVDQN-NVXWUHKLSA-N	0	3	301.434	2.032	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H]2C[C@H]2c2cccc(F)c2)C1	ZINC000065507250	354684386	/nfs/dbraw/zinc/68/43/86/354684386.db2.gz	LICJLUIAKMDEEZ-JYJNAYRXSA-N	0	3	305.397	2.465	10	0		DEAEHN
Cc1ccc2c(c1C)OC[C@H]2NC(=O)NC1CCN(C)CC1	ZINC000077511097	355210168	/nfs/dbraw/zinc/21/01/68/355210168.db2.gz	VDWOBLWLUBHFAB-OAHLLOKOSA-N	0	3	303.406	2.130	10	0		DEAEHN
O=C1C[C@@H](NCCc2ccc(F)cc2)C(=O)N1c1ccccc1	ZINC000004954080	181179124	/nfs/dbraw/zinc/17/91/24/181179124.db2.gz	IAWUYAPYBPOPGX-MRXNPFEDSA-N	0	3	312.344	2.290	10	0		DEAEHN
CC[C@@H]1CN(C(=O)N[C@H](CC(C)C)CN(C)C)CCS1	ZINC000073722564	191347651	/nfs/dbraw/zinc/34/76/51/191347651.db2.gz	AMOOEQZTKPHACV-ZIAGYGMSSA-N	0	3	301.500	2.500	10	0		DEAEHN
NC[C@H](NC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F)C(F)(F)F	ZINC000401707414	540141596	/nfs/dbraw/zinc/14/15/96/540141596.db2.gz	FOYJEYJFMUCMNB-PRJMDXOYSA-N	0	3	306.250	2.361	10	0		DEAEHN
NC[C@@H](NC(=O)c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000401715590	540142231	/nfs/dbraw/zinc/14/22/31/540142231.db2.gz	KSWZZGRLAAHDSQ-MRVPVSSYSA-N	0	3	300.202	2.325	10	0		DEAEHN
CC(C)CCN1CCN(c2nccn(CC(C)C)c2=O)CC1	ZINC000094136920	355694567	/nfs/dbraw/zinc/69/45/67/355694567.db2.gz	QYLZYNOEMIWYGV-UHFFFAOYSA-N	0	3	306.454	2.067	10	0		DEAEHN
CC(C)(N)c1cc2nc(Cl)nc(N3CCOCC3)c2s1	ZINC000115747039	355770793	/nfs/dbraw/zinc/77/07/93/355770793.db2.gz	YEFYIJJGHCHMHG-UHFFFAOYSA-N	0	3	312.826	2.375	10	0		DEAEHN
CCN1CCO[C@@H](CNCc2ccccc2OC(F)F)C1	ZINC000134440770	355860209	/nfs/dbraw/zinc/86/02/09/355860209.db2.gz	ZTXYDSSRDSAHQZ-ZDUSSCGKSA-N	0	3	300.349	2.098	10	0		DEAEHN
CCC[C@@H](C)CN(C)CC(=O)N1CCC[C@H](C(=O)OCC)C1	ZINC000180012693	356039238	/nfs/dbraw/zinc/03/92/38/356039238.db2.gz	WGGSMOYHWMFYIM-CABCVRRESA-N	0	3	312.454	2.156	10	0		DEAEHN
CC(C)Oc1cccc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)n1	ZINC000179116463	356015211	/nfs/dbraw/zinc/01/52/11/356015211.db2.gz	QLIQHWXWZLEMJR-KGLIPLIRSA-N	0	3	305.422	2.424	10	0		DEAEHN
CC(C)S(=O)(=O)CCCN[C@H](C)c1ccc2c(c1)OCO2	ZINC000182285278	356119253	/nfs/dbraw/zinc/11/92/53/356119253.db2.gz	RBBAIGISOHRLNP-GFCCVEGCSA-N	0	3	313.419	2.279	10	0		DEAEHN
C[C@H](N[C@@H]1CCCS(=O)(=O)C1)c1cccc(-n2ccnc2)c1	ZINC000183050684	356157837	/nfs/dbraw/zinc/15/78/37/356157837.db2.gz	POLNXLOWXCIYEM-DZGCQCFKSA-N	0	3	319.430	2.100	10	0		DEAEHN
COc1cc(C[NH2+][C@@H](C)CCO)cc(Br)c1[O-]	ZINC000080203864	192012010	/nfs/dbraw/zinc/01/20/10/192012010.db2.gz	RTZLNUBNKHOXOT-QMMMGPOBSA-N	0	3	304.184	2.024	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)C[C@@H](C)c2nccs2)C1	ZINC000182857823	356149297	/nfs/dbraw/zinc/14/92/97/356149297.db2.gz	JSQOHDSOZMXNOT-OLZOCXBDSA-N	0	3	310.467	2.372	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CCc3ccccc3[C@@H]2CN)s1	ZINC000227721807	356280360	/nfs/dbraw/zinc/28/03/60/356280360.db2.gz	UJZXOGAIIRQHQU-AWEZNQCLSA-N	0	3	322.455	2.303	10	0		DEAEHN
C[C@H]1CC[C@@](N)(c2ncncc2I)C1	ZINC000306153627	356402877	/nfs/dbraw/zinc/40/28/77/356402877.db2.gz	BAMRFPVGNRERRF-XVKPBYJWSA-N	0	3	303.147	2.055	10	0		DEAEHN
Brc1cc(CN2CC[C@@H]3OCCN[C@H]3C2)cs1	ZINC000404261629	283164905	/nfs/dbraw/zinc/16/49/05/283164905.db2.gz	OLCPBIJSFNUCAK-QWRGUYRKSA-N	0	3	317.252	2.073	10	0		DEAEHN
Cc1ccc([O-])c(CN(Cc2cccnc2)C[C@H]2CC[NH2+]C2)n1	ZINC000328651047	356467002	/nfs/dbraw/zinc/46/70/02/356467002.db2.gz	VUMWJHSGTPMWJG-INIZCTEOSA-N	0	3	312.417	2.102	10	0		DEAEHN
NC[C@@H](c1ccc(Cl)c(Cl)c1)N1CCn2cnnc2C1	ZINC000081532726	192284805	/nfs/dbraw/zinc/28/48/05/192284805.db2.gz	QESYZLFJFCEXCH-LBPRGKRZSA-N	0	3	312.204	2.101	10	0		DEAEHN
CC[C@@H](NC)c1cccc(S(=O)(=O)N[C@@H](C)CCOC)c1	ZINC000081717820	192316369	/nfs/dbraw/zinc/31/63/69/192316369.db2.gz	MGDGRKFUKGABNJ-SWLSCSKDSA-N	0	3	314.451	2.060	10	0		DEAEHN
CC(C)[C@@H](C)N(C)S(=O)(=O)c1ccc(Cl)c(CN)c1	ZINC000088963577	192671692	/nfs/dbraw/zinc/67/16/92/192671692.db2.gz	MWKQEMMPDDPLIX-SNVBAGLBSA-N	0	3	304.843	2.464	10	0		DEAEHN
Cc1ccccc1C1(C(=O)Nc2cnn(CCN(C)C)c2)CC1	ZINC000588856898	357430419	/nfs/dbraw/zinc/43/04/19/357430419.db2.gz	OIFXOVSUOQSHKG-UHFFFAOYSA-N	0	3	312.417	2.423	10	0		DEAEHN
COCCN(C)CCNC(=O)c1c[nH]c2cc(Cl)ccc12	ZINC000588932695	357435362	/nfs/dbraw/zinc/43/53/62/357435362.db2.gz	MHEPHHVHJSLGJF-UHFFFAOYSA-N	0	3	309.797	2.129	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCCc2ccccn2)[C@@H]1c1ccccc1	ZINC000179383087	199026384	/nfs/dbraw/zinc/02/63/84/199026384.db2.gz	DXUAYNYNSWBWRS-ROUUACIJSA-N	0	3	324.428	2.369	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccc(Cn2cccn2)cc1)N(C)C	ZINC000179436725	199035074	/nfs/dbraw/zinc/03/50/74/199035074.db2.gz	LBGDAZHSSFXXET-QGZVFWFLSA-N	0	3	314.433	2.278	10	0		DEAEHN
CCn1nc(C)c(NC(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1C	ZINC000179549122	199053207	/nfs/dbraw/zinc/05/32/07/199053207.db2.gz	UZEKEXHKELNSGJ-SMDDNHRTSA-N	0	3	307.442	2.370	10	0		DEAEHN
CNC(=O)NC(=O)[C@@H](C)N[C@@H](C)c1ccc(C(C)(C)C)cc1	ZINC000056194650	283361416	/nfs/dbraw/zinc/36/14/16/283361416.db2.gz	QDUDWKXYAXRQKY-NWDGAFQWSA-N	0	3	305.422	2.479	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)N[C@@H]3CCN(CC4CC4)C3)cc2)c1	ZINC000594695178	358320033	/nfs/dbraw/zinc/32/00/33/358320033.db2.gz	MJUOVQASFOUTJL-QGZVFWFLSA-N	0	3	324.428	2.395	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCCCCCCO)[C@@H]1c1ccccc1	ZINC000180997049	199238994	/nfs/dbraw/zinc/23/89/94/199238994.db2.gz	DCQSMHCGTTXXJV-SJORKVTESA-N	0	3	319.449	2.284	10	0		DEAEHN
NC1(C(=O)N2CC3(CCCC3)c3c2cccc3F)CCOCC1	ZINC000261847600	283398019	/nfs/dbraw/zinc/39/80/19/283398019.db2.gz	MDPUTAMYEJNQHV-UHFFFAOYSA-N	0	3	318.392	2.492	10	0		DEAEHN
C[C@H](O)C1CCN(Cc2ccc3c(c2)CCC(=O)N3C)CC1	ZINC000186930501	200033578	/nfs/dbraw/zinc/03/35/78/200033578.db2.gz	FXRMMDJRNABDDE-ZDUSSCGKSA-N	0	3	302.418	2.188	10	0		DEAEHN
CN(C)CCN(C(=O)c1cn2cccnc2n1)C1CCCCC1	ZINC000600489974	359753911	/nfs/dbraw/zinc/75/39/11/359753911.db2.gz	RYYGCLFPABCXOX-UHFFFAOYSA-N	0	3	315.421	2.066	10	0		DEAEHN
Fc1ccccc1-c1noc(CN2CCN3CCC[C@@H]3C2)n1	ZINC000189014601	200335901	/nfs/dbraw/zinc/33/59/01/200335901.db2.gz	HTGNBACRGBXILC-GFCCVEGCSA-N	0	3	302.353	2.156	10	0		DEAEHN
CCCN(C)CC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000610823013	361472127	/nfs/dbraw/zinc/47/21/27/361472127.db2.gz	DGCFBKJBSIWBAB-MRXNPFEDSA-N	0	3	320.433	2.385	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@@H]1CCCc2cccnc21	ZINC000194551998	201250359	/nfs/dbraw/zinc/25/03/59/201250359.db2.gz	XGTAZBUBTFITEE-JKSUJKDBSA-N	0	3	301.434	2.444	10	0		DEAEHN
O=C(NCc1ccc2ncccc2c1)N1CCN2CCC[C@@H]2C1	ZINC000194608349	201262619	/nfs/dbraw/zinc/26/26/19/201262619.db2.gz	YOOMDPWVJIXCQP-MRXNPFEDSA-N	0	3	310.401	2.224	10	0		DEAEHN
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1CCN2CCC[C@H]2C1	ZINC000195202625	201357616	/nfs/dbraw/zinc/35/76/16/201357616.db2.gz	YIHBZWSFUBBLFP-HRCADAONSA-N	0	3	303.381	2.171	10	0		DEAEHN
Cc1cc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)no1	ZINC000195297608	201375310	/nfs/dbraw/zinc/37/53/10/201375310.db2.gz	NUCCGWWVBMUIBE-INIZCTEOSA-N	0	3	300.406	2.332	10	0		DEAEHN
Cc1c(C(=O)N2C[C@H]3CCCN3C[C@H]2C)cnn1-c1ccccc1	ZINC000247482296	202676104	/nfs/dbraw/zinc/67/61/04/202676104.db2.gz	SUECECRERBXQJL-RHSMWYFYSA-N	0	3	324.428	2.489	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2ccc3occc3c2)CC12COC2	ZINC000449356209	240396691	/nfs/dbraw/zinc/39/66/91/240396691.db2.gz	AZOVVEVFTRGFEB-HNNXBMFYSA-N	0	3	315.369	2.444	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2cc(F)ccc2C)CC12COC2	ZINC000449357503	240397400	/nfs/dbraw/zinc/39/74/00/240397400.db2.gz	DOEYGSXCCKORHX-HNNXBMFYSA-N	0	3	307.365	2.146	10	0		DEAEHN
c1c(CNC[C@H]2CCN2C2CCCCC2)nnn1C1CCC1	ZINC000623615061	365100620	/nfs/dbraw/zinc/10/06/20/365100620.db2.gz	NTANQDJMPAWOLH-QGZVFWFLSA-N	0	3	303.454	2.500	10	0		DEAEHN
O=C(C[C@H]1CSCCN1)Nc1ccc(-c2c[nH]cn2)cc1	ZINC000091135101	193000973	/nfs/dbraw/zinc/00/09/73/193000973.db2.gz	NOMMCOIBOHWDKZ-ZDUSSCGKSA-N	0	3	302.403	2.110	10	0		DEAEHN
O[C@H]1COCC[C@@H]1NCc1ccc(Cl)c(Br)c1	ZINC000623767609	365168121	/nfs/dbraw/zinc/16/81/21/365168121.db2.gz	YPZVDADFYSRYRJ-RYUDHWBXSA-N	0	3	320.614	2.342	10	0		DEAEHN
CN1CCOC[C@@H]1CNCc1cc(F)ccc1Br	ZINC000623712165	365141301	/nfs/dbraw/zinc/14/13/01/365141301.db2.gz	ZOWLQPOWOIPUPN-LBPRGKRZSA-N	0	3	317.202	2.008	10	0		DEAEHN
CCN[C@@H](c1cc(Cl)cnc1N)C(C)(C)N1CCOCC1	ZINC000091566826	193073351	/nfs/dbraw/zinc/07/33/51/193073351.db2.gz	DBYCZDWIWBIPJQ-ZDUSSCGKSA-N	0	3	312.845	2.079	10	0		DEAEHN
CCN1CCO[C@H](CN)[C@@H]1c1ccc(Br)c(C)c1	ZINC000091475849	193061687	/nfs/dbraw/zinc/06/16/87/193061687.db2.gz	ZHNGJMWBZMZWNJ-KGLIPLIRSA-N	0	3	313.239	2.478	10	0		DEAEHN
C[NH2+]C1CCC(N(C)Cc2nc(=O)c3sccc3[n-]2)CC1	ZINC000091872929	193120809	/nfs/dbraw/zinc/12/08/09/193120809.db2.gz	MGCXZAVKSCPWTK-UHFFFAOYSA-N	0	3	306.435	2.359	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](O)CN1CC2(C1)CC(F)(F)C2	ZINC000677734310	541623438	/nfs/dbraw/zinc/62/34/38/541623438.db2.gz	UJEKOVHXOGFSES-HNNXBMFYSA-N	0	3	310.388	2.210	10	0		DEAEHN
c1cc2c(cc1OCc1nc(C3CCC3)no1)OCCNC2	ZINC000630505483	367694747	/nfs/dbraw/zinc/69/47/47/367694747.db2.gz	YCZYGKBWUHYPAE-UHFFFAOYSA-N	0	3	301.346	2.398	10	0		DEAEHN
CC[C@@H]1CCCN(S(=O)(=O)c2ccc(CN)cc2F)C1	ZINC000092115714	193163628	/nfs/dbraw/zinc/16/36/28/193163628.db2.gz	WWWPCKPNNGDSDZ-LLVKDONJSA-N	0	3	300.399	2.095	10	0		DEAEHN
C[C@H]1CCCN(S(=O)(=O)c2ccc(CN)cc2F)CC1	ZINC000092116175	193164480	/nfs/dbraw/zinc/16/44/80/193164480.db2.gz	TUSKGCGWEYDCOA-NSHDSACASA-N	0	3	300.399	2.095	10	0		DEAEHN
NCc1ccc(S(=O)(=O)N2CCC[C@@H]3CCC[C@@H]32)c(F)c1	ZINC000092116265	193164534	/nfs/dbraw/zinc/16/45/34/193164534.db2.gz	SXVNLVRDKUDNGY-JSGCOSHPSA-N	0	3	312.410	2.238	10	0		DEAEHN
c1nc2nc(=NCCN3CCCCC3)cc(-c3ccccc3)n2[nH]1	ZINC000631061418	367995320	/nfs/dbraw/zinc/99/53/20/367995320.db2.gz	TYSXJKUDLDLVRM-UHFFFAOYSA-N	0	3	322.416	2.111	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)CN[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)cc1	ZINC000528760181	284003049	/nfs/dbraw/zinc/00/30/49/284003049.db2.gz	WODNKDHWNTWBQD-HEKSYOIISA-N	0	3	304.390	2.229	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N(CC)C[C@@H](C)CC)nc1	ZINC000093265772	193222733	/nfs/dbraw/zinc/22/27/33/193222733.db2.gz	QIVREHWQRLXKFK-ZDUSSCGKSA-N	0	3	313.467	2.248	10	0		DEAEHN
CCCN(CCN(C)C)c1ncc(N)cc1Br	ZINC000093433018	193250599	/nfs/dbraw/zinc/25/05/99/193250599.db2.gz	RBPHVBBRCLCXQR-UHFFFAOYSA-N	0	3	301.232	2.204	10	0		DEAEHN
Cn1cc(CN2C[C@H]3CCC[C@@H](C2)C3O)c(-c2cccnc2)n1	ZINC000093479725	193257414	/nfs/dbraw/zinc/25/74/14/193257414.db2.gz	PXGUDFSKKOUKJQ-MVVMVCHASA-N	0	3	312.417	2.075	10	0		DEAEHN
COc1cc(CN2CC[C@H]3OCCC[C@@H]3C2)cc2c1OCCO2	ZINC000093505732	193261086	/nfs/dbraw/zinc/26/10/86/193261086.db2.gz	RUFLZGPBMMQVPR-HUUCEWRRSA-N	0	3	319.401	2.467	10	0		DEAEHN
CCOC(=O)[C@@]1(N)CCC[C@H]1CCN(C)CCC(F)(F)F	ZINC000093596065	193271702	/nfs/dbraw/zinc/27/17/02/193271702.db2.gz	VMZJFWRMDLBBBD-WCQYABFASA-N	0	3	310.360	2.321	10	0		DEAEHN
COc1c(C)cc(CN2CCN(C[C@@H]3CCOC3)CC2)cc1C	ZINC000093817567	193311561	/nfs/dbraw/zinc/31/15/61/193311561.db2.gz	UUPINJNZIMLDON-KRWDZBQOSA-N	0	3	318.461	2.466	10	0		DEAEHN
NC(=O)[C@@]1(N)CCC[C@H](Oc2ccccc2C(F)(F)F)C1	ZINC000093773817	193304573	/nfs/dbraw/zinc/30/45/73/193304573.db2.gz	RGTHJCFHKYZNIS-TVQRCGJNSA-N	0	3	302.296	2.210	10	0		DEAEHN
Cc1csc(S[C@@H]2CCC[C@](NC3CC3)(C(N)=O)C2)n1	ZINC000093778064	193304782	/nfs/dbraw/zinc/30/47/82/193304782.db2.gz	ZMGDBJDEGUPTAV-BXUZGUMPSA-N	0	3	311.476	2.462	10	0		DEAEHN
CCN[C@]1(C(=O)OCC)CC[C@H](N(C)CCC(F)(F)F)C1	ZINC000093831812	193314355	/nfs/dbraw/zinc/31/43/55/193314355.db2.gz	XTDLLINJQPRBBA-WCQYABFASA-N	0	3	310.360	2.335	10	0		DEAEHN
CN[C@H](c1cccc(C(F)(F)F)c1)[C@@H]1CN(C)CCN1C	ZINC000093894381	193325729	/nfs/dbraw/zinc/32/57/29/193325729.db2.gz	TUTNGVHBTVLJPB-UONOGXRCSA-N	0	3	301.356	2.212	10	0		DEAEHN
Nc1ccc(N2CCN(c3cccc(Cl)c3)CC2)nc1N	ZINC000094259846	193355687	/nfs/dbraw/zinc/35/56/87/193355687.db2.gz	MFSYVGFFYAVTLN-UHFFFAOYSA-N	0	3	303.797	2.226	10	0		DEAEHN
CCN1CCN(c2nc(C(F)(F)F)ccc2CN)C[C@@H]1C	ZINC000094334300	193360224	/nfs/dbraw/zinc/36/02/24/193360224.db2.gz	CWZZMGIOQMOTIW-JTQLQIEISA-N	0	3	302.344	2.090	10	0		DEAEHN
NCc1ccc(C(F)(F)F)nc1N1CCCC[C@H]1CCO	ZINC000094334056	193360544	/nfs/dbraw/zinc/36/05/44/193360544.db2.gz	ZZRDCMCUEDPSRI-NSHDSACASA-N	0	3	303.328	2.300	10	0		DEAEHN
CCS(=O)(=O)CCCOc1ccc(F)cc1[C@H](C)NC	ZINC000094619392	193385618	/nfs/dbraw/zinc/38/56/18/193385618.db2.gz	RYCFLADAOSNGGH-NSHDSACASA-N	0	3	303.399	2.310	10	0		DEAEHN
CCC(CC)([C@H](O)[C@H]1CCC[C@H](S(C)(=O)=O)C1)N(C)C	ZINC000094641352	193388843	/nfs/dbraw/zinc/38/88/43/193388843.db2.gz	TUBBPNDTHMXJJR-MELADBBJSA-N	0	3	305.484	2.071	10	0		DEAEHN
CC(C)(C)NCc1ccn([C@@H]2CCC[C@H](S(C)(=O)=O)C2)n1	ZINC000094644459	193389940	/nfs/dbraw/zinc/38/99/40/193389940.db2.gz	XXFSVPSNEFSNSB-KGLIPLIRSA-N	0	3	313.467	2.300	10	0		DEAEHN
O=C(N[C@H]1CCCOc2ccccc21)N1CCN2CCC[C@@H]2C1	ZINC000171906211	284179196	/nfs/dbraw/zinc/17/91/96/284179196.db2.gz	PDGDUVSXXDWPAP-ZBFHGGJFSA-N	0	3	315.417	2.390	10	0		DEAEHN
CCCNc1snnc1CN1C[C@@H]2CCCCN2C[C@@H]1C	ZINC000094442193	193370249	/nfs/dbraw/zinc/37/02/49/193370249.db2.gz	JEVCGBOLRPGEMF-STQMWFEESA-N	0	3	309.483	2.419	10	0		DEAEHN
Brc1ccc(-c2cnc(N3CCNCC3)nc2)cc1	ZINC000094577242	193381382	/nfs/dbraw/zinc/38/13/82/193381382.db2.gz	ZNTZPTJCYYNOHK-UHFFFAOYSA-N	0	3	319.206	2.316	10	0		DEAEHN
CCN[C@H](C)c1cc(F)ccc1OCCCS(C)(=O)=O	ZINC000094618721	193385293	/nfs/dbraw/zinc/38/52/93/193385293.db2.gz	VIXVUAMNVDFXDW-LLVKDONJSA-N	0	3	303.399	2.310	10	0		DEAEHN
Cc1cc(F)c([C@H](C)NC[C@@H]2CCS(=O)(=O)C2)cc1F	ZINC000094736790	193393632	/nfs/dbraw/zinc/39/36/32/193393632.db2.gz	CQNMVLLQCXLLND-QWRGUYRKSA-N	0	3	303.374	2.359	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2CCC(C)(C)C2)ccc1F	ZINC000094814949	193399709	/nfs/dbraw/zinc/39/97/09/193399709.db2.gz	XZTNEPABTVXYRS-UHFFFAOYSA-N	0	3	314.426	2.356	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H](O)CN2Cc2nc(C)ccc2O)c1	ZINC000282689010	217177612	/nfs/dbraw/zinc/17/76/12/217177612.db2.gz	IVMZNUVHMIMZEA-PBHICJAKSA-N	0	3	314.385	2.412	10	0		DEAEHN
Cc1cc2cn[nH]c2c(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000266078190	205080956	/nfs/dbraw/zinc/08/09/56/205080956.db2.gz	MEGWBOWSHZIKEC-OCCSQVGLSA-N	0	3	300.406	2.426	10	0		DEAEHN
C[C@@H]1CN([C@H](CN)c2ccccc2OC(F)F)C[C@H](C)O1	ZINC000019803238	182151753	/nfs/dbraw/zinc/15/17/53/182151753.db2.gz	YTYCUDHPYYWDSF-NTZNESFSSA-N	0	3	300.349	2.397	10	0		DEAEHN
CC[C@H](CO)NCc1cc(Br)cc(OC)c1OC	ZINC000020933691	182255394	/nfs/dbraw/zinc/25/53/94/182255394.db2.gz	KXFRKJOYVTYGHP-LLVKDONJSA-N	0	3	318.211	2.327	10	0		DEAEHN
CSc1ncc(C(=O)N(C)C2CCN(C)CC2)c(Cl)n1	ZINC000039881148	183022644	/nfs/dbraw/zinc/02/26/44/183022644.db2.gz	NMICWWYTKRKFFO-UHFFFAOYSA-N	0	3	314.842	2.018	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2ccc(OC(C)C)c(Cl)c2)C1	ZINC000040633562	183112057	/nfs/dbraw/zinc/11/20/57/183112057.db2.gz	WWQJLHJJCVTDRK-AAEUAGOBSA-N	0	3	312.797	2.443	10	0		DEAEHN
Cn1ccnc1CCNCc1cc(Cl)c2c(c1)OCCO2	ZINC000040638998	183113352	/nfs/dbraw/zinc/11/33/52/183113352.db2.gz	OGBIPWQOGGCURA-UHFFFAOYSA-N	0	3	307.781	2.177	10	0		DEAEHN
CCOC(=O)c1c(C)c(C)sc1NC(=O)CNCC1CC1	ZINC000040851696	183142269	/nfs/dbraw/zinc/14/22/69/183142269.db2.gz	BPTYKNODCPAKGA-UHFFFAOYSA-N	0	3	310.419	2.480	10	0		DEAEHN
C[C@H](C(=O)NCc1cccc(CN(C)C)c1)C1CCOCC1	ZINC000162403194	291681657	/nfs/dbraw/zinc/68/16/57/291681657.db2.gz	SOSLAHQBFLROSM-AWEZNQCLSA-N	0	3	304.434	2.427	10	0		DEAEHN
CN(C)CCNC(=O)c1cc(C2CC2)n(-c2ccc(F)cc2)n1	ZINC000041453154	183192080	/nfs/dbraw/zinc/19/20/80/183192080.db2.gz	JFCAXCPVVBZYIF-UHFFFAOYSA-N	0	3	316.380	2.180	10	0		DEAEHN
CC[C@H](C)NC(=O)COc1c(Br)cccc1CN	ZINC000042411379	183265148	/nfs/dbraw/zinc/26/51/48/183265148.db2.gz	SSIWWJGXUOWAEY-VIFPVBQESA-N	0	3	315.211	2.201	10	0		DEAEHN
CC(C)NCc1cccc(Br)c1O[C@H](C)C(N)=O	ZINC000042411853	183265887	/nfs/dbraw/zinc/26/58/87/183265887.db2.gz	UZPRMZDQIGFZFS-SECBINFHSA-N	0	3	315.211	2.200	10	0		DEAEHN
CCNCc1cccc(Br)c1OCC(=O)NCC	ZINC000042411686	183266070	/nfs/dbraw/zinc/26/60/70/183266070.db2.gz	RTLUHUYMWOTDCF-UHFFFAOYSA-N	0	3	315.211	2.074	10	0		DEAEHN
CC1(C)COCCN1[C@@H](CN)c1ccc(Br)o1	ZINC000042461404	183272586	/nfs/dbraw/zinc/27/25/86/183272586.db2.gz	MEONEHXBAQIXBS-VIFPVBQESA-N	0	3	303.200	2.153	10	0		DEAEHN
CNC(=O)[C@H]1CCCN1c1cccc(Cl)c1CNC1CC1	ZINC000042395667	183263480	/nfs/dbraw/zinc/26/34/80/183263480.db2.gz	FNEOJSNBJIBMDB-OAHLLOKOSA-N	0	3	307.825	2.307	10	0		DEAEHN
CCN(CC(F)(F)F)[C@@H](C)C(=O)Nc1cccc(CN)c1	ZINC000042739528	183303725	/nfs/dbraw/zinc/30/37/25/183303725.db2.gz	FNALKVNBXAFYDE-JTQLQIEISA-N	0	3	303.328	2.357	10	0		DEAEHN
C[C@H](N)[C@@H](c1cccc(Cl)c1)N(CC(N)=O)C1CCCC1	ZINC000043015964	183327969	/nfs/dbraw/zinc/32/79/69/183327969.db2.gz	ABQGUYAHVHPELO-ZBEGNZNMSA-N	0	3	309.841	2.458	10	0		DEAEHN
CC[C@@H](N)c1cccc(S(=O)(=O)N(CC)[C@@H](C)COC)c1	ZINC000042782204	183308225	/nfs/dbraw/zinc/30/82/25/183308225.db2.gz	QBFSHKVXJNMBOD-SWLSCSKDSA-N	0	3	314.451	2.142	10	0		DEAEHN
CCN([C@H](C)COC)S(=O)(=O)c1cccc([C@@H](C)NC)c1	ZINC000042782202	183308530	/nfs/dbraw/zinc/30/85/30/183308530.db2.gz	APTZPBPICNWBPC-CHWSQXEVSA-N	0	3	314.451	2.013	10	0		DEAEHN
CCC[NH2+][C@@H](C)c1ccccc1[N-]S(=O)(=O)CCOC	ZINC000042808993	183311312	/nfs/dbraw/zinc/31/13/12/183311312.db2.gz	BLYOPNNAOOELJS-LBPRGKRZSA-N	0	3	300.424	2.135	10	0		DEAEHN
CCNC(=O)CN(CC)[C@@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043253637	183348292	/nfs/dbraw/zinc/34/82/92/183348292.db2.gz	OBYPZVGJGYDOAG-NOZJJQNGSA-N	0	3	303.859	2.248	10	0		DEAEHN
C[C@@H](N)[C@@H](c1cc(Br)cs1)N1CCC(O)CC1	ZINC000043284550	183350525	/nfs/dbraw/zinc/35/05/25/183350525.db2.gz	MLEHQINHMFWOSH-PELKAZGASA-N	0	3	319.268	2.356	10	0		DEAEHN
COc1ccc(Cl)c([N-]S(=O)(=O)C[C@H]2CCCC[NH2+]2)c1	ZINC000043318848	183354626	/nfs/dbraw/zinc/35/46/26/183354626.db2.gz	LLCZFPJZVHXWLV-SNVBAGLBSA-N	0	3	318.826	2.232	10	0		DEAEHN
C[C@@H](CNCc1ccc(Br)c(F)c1)[S@@](C)=O	ZINC000159789544	197364202	/nfs/dbraw/zinc/36/42/02/197364202.db2.gz	XJGVFYJOBZOWQB-PWJLMRLQSA-N	0	3	308.216	2.445	10	0		DEAEHN
C[C@H](CNCc1ccc(Br)c(F)c1)[S@](C)=O	ZINC000159789431	197364221	/nfs/dbraw/zinc/36/42/21/197364221.db2.gz	XJGVFYJOBZOWQB-VPTHRUTESA-N	0	3	308.216	2.445	10	0		DEAEHN
C[C@H](Cc1ccsc1)N[C@H]1CC(=O)N(C2CCCC2)C1=O	ZINC000105034571	194065625	/nfs/dbraw/zinc/06/56/25/194065625.db2.gz	MWKYOJOSQPKSOP-RISCZKNCSA-N	0	3	306.431	2.339	10	0		DEAEHN
O=S(=O)(C[C@H]1CCCC[NH2+]1)[N-]c1cccc2ncccc12	ZINC000105232247	194088444	/nfs/dbraw/zinc/08/84/44/194088444.db2.gz	TTWKDRLJGCZQMG-GFCCVEGCSA-N	0	3	305.403	2.119	10	0		DEAEHN
CCc1cccc(OCCN2CCN(C[C@@H](C)O)[C@H](C)C2)c1	ZINC000105822746	194138632	/nfs/dbraw/zinc/13/86/32/194138632.db2.gz	JRGFVHMHPYBXOR-HZPDHXFCSA-N	0	3	306.450	2.015	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)NCc2ccccc2Cl)c1	ZINC000105881472	194155758	/nfs/dbraw/zinc/15/57/58/194155758.db2.gz	XIURKQBZTMESJQ-CYBMUJFWSA-N	0	3	320.824	2.139	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN([C@@H](C)C(=O)N2CCCCC2)C1	ZINC000105922624	194170278	/nfs/dbraw/zinc/17/02/78/194170278.db2.gz	RUEUPRMCKCYMDT-JKSUJKDBSA-N	0	3	318.465	2.483	10	0		DEAEHN
CCOc1ccccc1CN1CCN(C[C@@H](C)O)[C@@H](CC)C1	ZINC000106104633	194185255	/nfs/dbraw/zinc/18/52/55/194185255.db2.gz	DEYLVEJEMGSQSN-WBVHZDCISA-N	0	3	306.450	2.362	10	0		DEAEHN
CC(C)Oc1ccccc1CN1CCN(C[C@@H](C)O)[C@@H](C)C1	ZINC000106097776	194185619	/nfs/dbraw/zinc/18/56/19/194185619.db2.gz	SODHEOOYKMBNFD-JKSUJKDBSA-N	0	3	306.450	2.361	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2cccc(OC(F)F)c2)C[C@H]1C	ZINC000106097982	194186324	/nfs/dbraw/zinc/18/63/24/194186324.db2.gz	RORGIVJUCCUBTF-CHWSQXEVSA-N	0	3	314.376	2.175	10	0		DEAEHN
NC[C@H](c1cnn(-c2ccccc2)c1)N1CCCSCC1	ZINC000048896088	183694669	/nfs/dbraw/zinc/69/46/69/183694669.db2.gz	SXGCSOBYKMUVLH-MRXNPFEDSA-N	0	3	302.447	2.311	10	0		DEAEHN
CN(Cc1cccc(Cl)c1)S(=O)(=O)C[C@H]1CCCCN1	ZINC000049631271	183749117	/nfs/dbraw/zinc/74/91/17/183749117.db2.gz	VOZLAEBTSZTPLD-CQSZACIVSA-N	0	3	316.854	2.244	10	0		DEAEHN
CN[C@@H](C)c1cc(Cl)ccc1O[C@@H](C)C(=O)NCCOC	ZINC000050209684	183777663	/nfs/dbraw/zinc/77/76/63/183777663.db2.gz	PMAMAIHBJAOQCI-QWRGUYRKSA-N	0	3	314.813	2.150	10	0		DEAEHN
CCNCCS(=O)(=O)Nc1ccc(C)c(Br)c1	ZINC000109437518	194263276	/nfs/dbraw/zinc/26/32/76/194263276.db2.gz	HKQFIRYYQVHRRX-UHFFFAOYSA-N	0	3	321.240	2.109	10	0		DEAEHN
CC(C)(C(N)=S)N1CCN(c2nc3ccccc3o2)CC1	ZINC000109471847	194266478	/nfs/dbraw/zinc/26/64/78/194266478.db2.gz	DUNCHTBKZJYQSX-UHFFFAOYSA-N	0	3	304.419	2.015	10	0		DEAEHN
O=C(Nc1cccc(CN[C@H]2CCCOC2)c1)C(F)(F)F	ZINC000109545924	194272486	/nfs/dbraw/zinc/27/24/86/194272486.db2.gz	AFPOAKWRFLVHBT-LBPRGKRZSA-N	0	3	302.296	2.456	10	0		DEAEHN
CCc1ccc(CN2CCN([C@@H](CC)C(N)=S)CC2)cc1	ZINC000109469085	194267056	/nfs/dbraw/zinc/26/70/56/194267056.db2.gz	KKXMWUIEADTXRB-INIZCTEOSA-N	0	3	305.491	2.431	10	0		DEAEHN
COc1cnn(C)c1[C@@H](N)Cc1ccccc1Br	ZINC000159334595	197345874	/nfs/dbraw/zinc/34/58/74/197345874.db2.gz	DOHKGZDUWNFORQ-NSHDSACASA-N	0	3	310.195	2.434	10	0		DEAEHN
Cc1ccc(C(N)=S)c(N2CC[C@@H](N3CCCCC3)C2)n1	ZINC000110278660	194318854	/nfs/dbraw/zinc/31/88/54/194318854.db2.gz	GMLJXFSYJJVTBC-CYBMUJFWSA-N	0	3	304.463	2.089	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)COc1ccccc1O)c1ccccc1	ZINC000111130268	194393237	/nfs/dbraw/zinc/39/32/37/194393237.db2.gz	HZYCQGUNLDMLTO-OAHLLOKOSA-N	0	3	314.385	2.190	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)CN2CCCN(C3CC3)CC2)c1	ZINC000061040951	184160574	/nfs/dbraw/zinc/16/05/74/184160574.db2.gz	KXDVKTRDOCAKTD-UHFFFAOYSA-N	0	3	301.434	2.412	10	0		DEAEHN
C[C@H](C(=O)N(C)[C@@H](C)c1ccc(Cl)cc1)N1CCNCC1	ZINC000062010856	184201152	/nfs/dbraw/zinc/20/11/52/184201152.db2.gz	GIIVCESMCULOGZ-QWHCGFSZSA-N	0	3	309.841	2.153	10	0		DEAEHN
CC[C@@H](NC)c1cccc(S(=O)(=O)N(C)CCCOC)c1	ZINC000062037797	184203015	/nfs/dbraw/zinc/20/30/15/184203015.db2.gz	QSJVKFOTSWHSDY-OAHLLOKOSA-N	0	3	314.451	2.014	10	0		DEAEHN
COCCNCc1ccccc1OCCOCC(F)(F)F	ZINC000062729677	184250509	/nfs/dbraw/zinc/25/05/09/184250509.db2.gz	VRWJTILRWULSST-UHFFFAOYSA-N	0	3	307.312	2.380	10	0		DEAEHN
N[C@H](CNC(=O)c1ccc(Br)o1)c1ccccc1	ZINC000062838059	184255498	/nfs/dbraw/zinc/25/54/98/184255498.db2.gz	UHPLVQCVMILGLW-SNVBAGLBSA-N	0	3	309.163	2.472	10	0		DEAEHN
N[C@@H](CNC(=O)c1cc(Br)c[nH]1)c1ccccc1	ZINC000062837854	184255599	/nfs/dbraw/zinc/25/55/99/184255599.db2.gz	KFMGLWNGIPGZNB-NSHDSACASA-N	0	3	308.179	2.207	10	0		DEAEHN
CS(=O)(=O)c1ccc(SCc2cccnc2C(=N)N)cc1	ZINC000063131383	184272279	/nfs/dbraw/zinc/27/22/79/184272279.db2.gz	NQTBMFBWOHYSPK-UHFFFAOYSA-N	0	3	321.427	2.061	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)Cc1cn(C)c2ncccc12	ZINC000065156016	184312732	/nfs/dbraw/zinc/31/27/32/184312732.db2.gz	CMFSOCBZPKIDMF-AWEZNQCLSA-N	0	3	314.433	2.106	10	0		DEAEHN
CC(C)NCC(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1	ZINC000066215594	184396941	/nfs/dbraw/zinc/39/69/41/184396941.db2.gz	DBDYEGZHFWBJSH-UHFFFAOYSA-N	0	3	317.433	2.495	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@@H](CN(C)C)C1)c1ccccc1	ZINC000116786495	194769661	/nfs/dbraw/zinc/76/96/61/194769661.db2.gz	YTHBFBSBSXNGAC-IRXDYDNUSA-N	0	3	304.434	2.359	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(C(=O)[C@H]3CCCCN3)C2)c1	ZINC000119789206	195037147	/nfs/dbraw/zinc/03/71/47/195037147.db2.gz	OZSDTCAOZVYYKJ-SUMWQHHRSA-N	0	3	318.417	2.162	10	0		DEAEHN
C[C@H](CNC(=O)N1CCO[C@H](c2cccs2)C1)N(C)C1CC1	ZINC000120165859	195109319	/nfs/dbraw/zinc/10/93/19/195109319.db2.gz	QKKLIMBQFRXJOM-OCCSQVGLSA-N	0	3	323.462	2.314	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCC(C)(C)CC2)cc(CN)c1F	ZINC000159113498	197328842	/nfs/dbraw/zinc/32/88/42/197328842.db2.gz	AZADGENUTNTKOP-UHFFFAOYSA-N	0	3	314.426	2.404	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)NCC(C)C)cc(C)c1F	ZINC000159084597	197325546	/nfs/dbraw/zinc/32/55/46/197325546.db2.gz	XAXUKNMTZLGDLL-UHFFFAOYSA-N	0	3	302.415	2.178	10	0		DEAEHN
CNCc1ccc(Sc2ccc(S(C)(=O)=O)cc2)nc1	ZINC000158927490	197312192	/nfs/dbraw/zinc/31/21/92/197312192.db2.gz	QZIWDSDERSWLPK-UHFFFAOYSA-N	0	3	308.428	2.356	10	0		DEAEHN
CN[C@H](Cc1cc(OC)ccc1Br)c1cn[nH]n1	ZINC000158846019	197306801	/nfs/dbraw/zinc/30/68/01/197306801.db2.gz	JPBJJCJAYWSFSX-LLVKDONJSA-N	0	3	311.183	2.079	10	0		DEAEHN
CCC[C@@H]1CCN(CCS(=O)(=O)c2ccc(CN)cc2)C1	ZINC000158752924	197299498	/nfs/dbraw/zinc/29/94/98/197299498.db2.gz	SHIGKSJNLLKSCR-OAHLLOKOSA-N	0	3	310.463	2.041	10	0		DEAEHN
CCN[C@@H](CS(=O)(=O)c1cc(C)ccc1C)[C@H]1CCOC1	ZINC000158734284	197297213	/nfs/dbraw/zinc/29/72/13/197297213.db2.gz	BCPRLACFAZLSEP-GJZGRUSLSA-N	0	3	311.447	2.092	10	0		DEAEHN
NCc1cc(C(F)(F)F)ccc1NC(=O)N[C@@H]1CCOC1	ZINC000158349033	197264461	/nfs/dbraw/zinc/26/44/61/197264461.db2.gz	RMMBHFYXFWIGHX-SNVBAGLBSA-N	0	3	303.284	2.075	10	0		DEAEHN
COCCN(CCN(C)C)C(=O)Nc1ccc2oc(C)nc2c1	ZINC000157911031	197226752	/nfs/dbraw/zinc/22/67/52/197226752.db2.gz	LVULLJNRNVQAJN-UHFFFAOYSA-N	0	3	320.393	2.178	10	0		DEAEHN
CN(C)CCN(Cc1ccccc1)C(=O)c1nnc(Cl)s1	ZINC000157141533	197165736	/nfs/dbraw/zinc/16/57/36/197165736.db2.gz	XAVJYJMURRVHGH-UHFFFAOYSA-N	0	3	324.837	2.396	10	0		DEAEHN
NCc1ccccc1NC(=O)C[S@@](=O)c1cccc(F)c1	ZINC000156083282	197085518	/nfs/dbraw/zinc/08/55/18/197085518.db2.gz	KKJZHRCFRMHRFY-NRFANRHFSA-N	0	3	306.362	2.031	10	0		DEAEHN
C[C@@H](NCc1cc(Br)cc2c1OCC2)[C@H](C)CO	ZINC000156019462	197080702	/nfs/dbraw/zinc/08/07/02/197080702.db2.gz	OIOYUIDFALWOPL-NXEZZACHSA-N	0	3	314.223	2.491	10	0		DEAEHN
CC(C)C(=O)N1CCCN(C[C@](C)(O)c2ccccc2)CC1	ZINC000155070548	197018783	/nfs/dbraw/zinc/01/87/83/197018783.db2.gz	ZYDPYTVVPQWPAO-SFHVURJKSA-N	0	3	304.434	2.084	10	0		DEAEHN
CC[C@H](C)[C@@H](NC(=O)CN[C@@H](C)c1ccccc1C)C(=O)OC	ZINC000155042443	197016110	/nfs/dbraw/zinc/01/61/10/197016110.db2.gz	HNJWGRIOBFSNLV-RVSPLBMKSA-N	0	3	320.433	2.350	10	0		DEAEHN
Cc1cc(F)ccc1NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000120498112	195178314	/nfs/dbraw/zinc/17/83/14/195178314.db2.gz	GITUDKJEWVFVEB-OCCSQVGLSA-N	0	3	321.396	2.014	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c(F)c1	ZINC000120541536	195186270	/nfs/dbraw/zinc/18/62/70/195186270.db2.gz	HSYKRWWVGPVSNM-CHWSQXEVSA-N	0	3	321.396	2.014	10	0		DEAEHN
Cc1noc(C)c1[C@@H](C)CNC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000151480944	196686568	/nfs/dbraw/zinc/68/65/68/196686568.db2.gz	BLVMYGAGMYQDJM-SWLSCSKDSA-N	0	3	318.421	2.051	10	0		DEAEHN
c1cc(CN2CCO[C@H]3[C@H]2CC[C@@H]3OCCN2CCCC2)co1	ZINC000247983306	257113615	/nfs/dbraw/zinc/11/36/15/257113615.db2.gz	XWRCJFTVSNUEPF-SQNIBIBYSA-N	0	3	320.433	2.124	10	0		DEAEHN
COc1ccc(CN2C[C@@H]3CCN(c4cccnc4)C[C@@H]3C2)cn1	ZINC000247873577	257115402	/nfs/dbraw/zinc/11/54/02/257115402.db2.gz	FZRCGPIFTBCJPT-IRXDYDNUSA-N	0	3	324.428	2.444	10	0		DEAEHN
O=C1CCCN1[C@H]1CCO[C@@]2(CCN(Cc3cccs3)C2)C1	ZINC000247848285	257116728	/nfs/dbraw/zinc/11/67/28/257116728.db2.gz	FNXRXHLIJIPFPX-YOEHRIQHSA-N	0	3	320.458	2.494	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C)c(C)c1	ZINC000121814030	195352393	/nfs/dbraw/zinc/35/23/93/195352393.db2.gz	JWGLTXXKZGBXHJ-HNNXBMFYSA-N	0	3	319.449	2.334	10	0		DEAEHN
COc1nccnc1CN1CC[C@H](CNc2cccc(C)n2)C1	ZINC000294688922	533277452	/nfs/dbraw/zinc/27/74/52/533277452.db2.gz	DOSBWGILTSLAOJ-CQSZACIVSA-N	0	3	313.405	2.123	10	0		DEAEHN
CO[C@@H](C)CCC(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190622843	533324939	/nfs/dbraw/zinc/32/49/39/533324939.db2.gz	DASGJGGZERTVOH-RDJZCZTQSA-N	0	3	319.449	2.177	10	0		DEAEHN
CO[C@@H]1COC[C@H]1n1cc(CN[C@@H]2CCCC[C@H]2C(C)C)nn1	ZINC000329509976	533524989	/nfs/dbraw/zinc/52/49/89/533524989.db2.gz	JVJUSDKWYLQUSO-YLFCFFPRSA-N	0	3	322.453	2.169	10	0		DEAEHN
C/C(=C/c1ccc(Cl)cc1)CNCCNC(=O)c1ccn[nH]1	ZINC000355774673	133047112	/nfs/dbraw/zinc/04/71/12/133047112.db2.gz	HFZRBZXUFPVQKO-BENRWUELSA-N	0	3	318.808	2.486	10	0		DEAEHN
CN1CCC(CC(=O)NCc2c(F)cc(F)cc2F)CC1	ZINC000358056979	133117744	/nfs/dbraw/zinc/11/77/44/133117744.db2.gz	BGZCVGFIUPWEOZ-UHFFFAOYSA-N	0	3	300.324	2.452	10	0		DEAEHN
CC[C@H](C(=O)NCCNc1ccncc1)c1ccc(F)cc1	ZINC000359953548	133154854	/nfs/dbraw/zinc/15/48/54/133154854.db2.gz	CRTKGTBKKIMWQK-INIZCTEOSA-N	0	3	301.365	2.365	10	0		DEAEHN
c1cnc(N2CCN(C[C@@H]3CCc4ccccc4C3)CC2)nc1	ZINC000359592882	285546456	/nfs/dbraw/zinc/54/64/56/285546456.db2.gz	ZSWYHUJYEWSXSG-MRXNPFEDSA-N	0	3	308.429	2.404	10	0		DEAEHN
CCS[C@@H]1CCC[C@H](NC(=O)NCCNc2ccncc2)C1	ZINC000361917010	133199493	/nfs/dbraw/zinc/19/94/93/133199493.db2.gz	VRDDUNRYDZYBRD-LSDHHAIUSA-N	0	3	322.478	2.279	10	0		DEAEHN
COC(=O)[C@@H]1CCCN(CCC(=O)Nc2cccc(F)c2C)C1	ZINC000362353098	133225981	/nfs/dbraw/zinc/22/59/81/133225981.db2.gz	LPMGDHFBQWWHHV-CYBMUJFWSA-N	0	3	322.380	2.348	10	0		DEAEHN
O=C(CCN1CCC(n2cncn2)CC1)OCc1ccccc1	ZINC000181442363	144905435	/nfs/dbraw/zinc/90/54/35/144905435.db2.gz	JXDPATBNVAQVLQ-UHFFFAOYSA-N	0	3	314.389	2.049	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2n[nH]c3c2CCCCC3)C1	ZINC000188194326	145008273	/nfs/dbraw/zinc/00/82/73/145008273.db2.gz	HZVXNLPMXXQUQM-DOMZBBRYSA-N	0	3	304.438	2.137	10	0		DEAEHN
O=C(c1cn2ccnc2s1)N1CCC[C@H]1CN1CCCCC1	ZINC000188431987	145012262	/nfs/dbraw/zinc/01/22/62/145012262.db2.gz	QZDAUFLMSSXJOF-ZDUSSCGKSA-N	0	3	318.446	2.486	10	0		DEAEHN
O=C(Cc1cnc2ccccc2c1)N1CCCN(C2CC2)CC1	ZINC000189490500	145028352	/nfs/dbraw/zinc/02/83/52/145028352.db2.gz	QWTLVLSLBLEKSM-UHFFFAOYSA-N	0	3	309.413	2.474	10	0		DEAEHN
CCc1nc(C2CCN(C[C@@H](O)c3ccccc3F)CC2)n[nH]1	ZINC000190694513	145046589	/nfs/dbraw/zinc/04/65/89/145046589.db2.gz	VCZDJCVVYXPPGS-OAHLLOKOSA-N	0	3	318.396	2.419	10	0		DEAEHN
CCc1n[nH]c(C2CCN(C[C@@H](O)c3ccccc3F)CC2)n1	ZINC000190694513	145046591	/nfs/dbraw/zinc/04/65/91/145046591.db2.gz	VCZDJCVVYXPPGS-OAHLLOKOSA-N	0	3	318.396	2.419	10	0		DEAEHN
CCc1nnc(C2CCN(C[C@@H](O)c3ccccc3F)CC2)[nH]1	ZINC000190694513	145046593	/nfs/dbraw/zinc/04/65/93/145046593.db2.gz	VCZDJCVVYXPPGS-OAHLLOKOSA-N	0	3	318.396	2.419	10	0		DEAEHN
Cn1ccnc1[C@H](O)C1CCN(C[C@H](O)CC2CCCC2)CC1	ZINC000190915126	145049756	/nfs/dbraw/zinc/04/97/56/145049756.db2.gz	KVUKAYONXNAZGV-IAGOWNOFSA-N	0	3	321.465	2.107	10	0		DEAEHN
O[C@@H](CN1CCC[C@H](c2nnc3n2CCC3)C1)C1CCCCC1	ZINC000191343570	145056604	/nfs/dbraw/zinc/05/66/04/145056604.db2.gz	DQVCGFQDYRNHIP-HOTGVXAUSA-N	0	3	318.465	2.345	10	0		DEAEHN
CCCOc1cc(OC)ccc1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000191584245	145060971	/nfs/dbraw/zinc/06/09/71/145060971.db2.gz	FQGUEKMMMOLILE-CQSZACIVSA-N	0	3	318.417	2.404	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@H]1C)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000191824175	145065224	/nfs/dbraw/zinc/06/52/24/145065224.db2.gz	XOEJUUVWTZCJFT-SUNKGSAMSA-N	0	3	315.410	2.305	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@H](C)c1nc(C)cc(=O)[nH]1	ZINC000192613475	145076796	/nfs/dbraw/zinc/07/67/96/145076796.db2.gz	QHYMBOCNBBKZJC-TZMCWYRMSA-N	0	3	301.394	2.221	10	0		DEAEHN
C[C@@H](N[C@@H](C)C(=O)NCCc1ccc(F)cc1)[C@H]1CCCO1	ZINC000193128709	145083111	/nfs/dbraw/zinc/08/31/11/145083111.db2.gz	WMHQSRWFQYLASL-DVOMOZLQSA-N	0	3	308.397	2.030	10	0		DEAEHN
C[C@H](NC(=O)N1CCN2CCC[C@H]2C1)[C@H]1COc2ccccc21	ZINC000246221175	145095329	/nfs/dbraw/zinc/09/53/29/145095329.db2.gz	FKXDQOUAINWTTM-OFQRWUPVSA-N	0	3	315.417	2.041	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)[C@H](C)N1CCN2CCC[C@H]2C1	ZINC000246309991	145097954	/nfs/dbraw/zinc/09/79/54/145097954.db2.gz	AHRDPCPOTLJSRJ-HOTGVXAUSA-N	0	3	301.434	2.410	10	0		DEAEHN
O=C(C[C@@H](O)c1ccc(Cl)cc1)N1CCN2CCC[C@H]2C1	ZINC000246369301	145100528	/nfs/dbraw/zinc/10/05/28/145100528.db2.gz	JDQSBDUVJMJHFV-LSDHHAIUSA-N	0	3	308.809	2.070	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)NC[C@@H](C)N(C)C2CC2)c1	ZINC000246390524	145101546	/nfs/dbraw/zinc/10/15/46/145101546.db2.gz	VMJJZJZSJPJFII-DQYPLSBCSA-N	0	3	302.418	2.398	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cccc(-n2cccn2)c1	ZINC000246988016	145121976	/nfs/dbraw/zinc/12/19/76/145121976.db2.gz	LGKHSZHTPZCINV-PBHICJAKSA-N	0	3	310.401	2.181	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)CC1CCCC1	ZINC000246999586	145122588	/nfs/dbraw/zinc/12/25/88/145122588.db2.gz	KPCWIJLDGLLXOH-GJZGRUSLSA-N	0	3	300.468	2.065	10	0		DEAEHN
O[C@]12CCCC[C@H]1CN(Cc1ccc(-n3ccnc3)nc1)CC2	ZINC000247039599	145124590	/nfs/dbraw/zinc/12/45/90/145124590.db2.gz	RCMJQSZYPGNLDI-WMZOPIPTSA-N	0	3	312.417	2.394	10	0		DEAEHN
O[C@H](CN1CCC[C@@H](Cn2cncn2)C1)c1ccccc1Cl	ZINC000247123693	145126916	/nfs/dbraw/zinc/12/69/16/145126916.db2.gz	JWCRISOCQRMDCM-CZUORRHYSA-N	0	3	320.824	2.377	10	0		DEAEHN
C[C@H](C(=O)Nc1ccc(F)c(F)c1)N1CCN2CCC[C@H]2C1	ZINC000247441723	145137041	/nfs/dbraw/zinc/13/70/41/145137041.db2.gz	ZZSPSXBSSGXPSN-YPMHNXCESA-N	0	3	309.360	2.072	10	0		DEAEHN
C[C@@H]1CCC[C@H](C)N1C(=O)CN1CC[C@@]2(O)CCCC[C@@H]2C1	ZINC000248025727	145146878	/nfs/dbraw/zinc/14/68/78/145146878.db2.gz	OXELYCZDTSZMAT-HPFXQQBRSA-N	0	3	308.466	2.403	10	0		DEAEHN
Cc1noc(C)c1CC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248122655	145148314	/nfs/dbraw/zinc/14/83/14/145148314.db2.gz	URMFXSZWTSTRJL-AEFFLSMTSA-N	0	3	313.401	2.396	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000248430543	145154946	/nfs/dbraw/zinc/15/49/46/145154946.db2.gz	AWUQPXFBLTYZLQ-TZMCWYRMSA-N	0	3	304.438	2.255	10	0		DEAEHN
c1ccc(NC[C@H]2CCN(CCO[C@H]3CCCCO3)C2)nc1	ZINC000248538975	145157759	/nfs/dbraw/zinc/15/77/59/145157759.db2.gz	ASCRIVCOWMTXMB-WBVHZDCISA-N	0	3	305.422	2.359	10	0		DEAEHN
C[S@](=O)C[C@H](N[C@@H]1Cc2ccccc2[C@H]1O)c1ccccc1	ZINC000248564263	145159340	/nfs/dbraw/zinc/15/93/40/145159340.db2.gz	KJLUNMJVBQTYQV-FOUBCARRSA-N	0	3	315.438	2.354	10	0		DEAEHN
C[C@@H]1CCC[C@H](NC(=O)CN2CCCN(C3CC3)CC2)[C@H]1C	ZINC000250209822	145192676	/nfs/dbraw/zinc/19/26/76/145192676.db2.gz	MXGIERQLMWWQQY-VYDXJSESSA-N	0	3	307.482	2.097	10	0		DEAEHN
C/C=C\c1ccc(OCC(=O)NC2CCN(C)CC2)c(OC)c1	ZINC000255917050	145205122	/nfs/dbraw/zinc/20/51/22/145205122.db2.gz	YLUQVULOPKVETN-PLNGDYQASA-N	0	3	318.417	2.318	10	0		DEAEHN
c1cncc([C@H]2CNCCN2CCc2ccc3c(c2)CCO3)c1	ZINC000261699211	145218559	/nfs/dbraw/zinc/21/85/59/145218559.db2.gz	JOIZDZUAWDRKHH-GOSISDBHSA-N	0	3	309.413	2.206	10	0		DEAEHN
O=C(Nc1ccc2c(c1F)CCNC2)c1c[nH]c(C2CC2)n1	ZINC000261786487	145226803	/nfs/dbraw/zinc/22/68/03/145226803.db2.gz	TZGIVPZVEDMRMT-UHFFFAOYSA-N	0	3	300.337	2.324	10	0		DEAEHN
Cc1cc(C)c(CCNC(=O)[C@H](N)C2CCOCC2)c(C)c1	ZINC000261799452	145227415	/nfs/dbraw/zinc/22/74/15/145227415.db2.gz	GYRYOFHNIGVZGW-QGZVFWFLSA-N	0	3	304.434	2.024	10	0		DEAEHN
COc1c(C)cc(CN(C)C(=O)[C@H](N)C2CCOCC2)cc1C	ZINC000261827224	145231233	/nfs/dbraw/zinc/23/12/33/145231233.db2.gz	PTRHXGHIBAQYIV-MRXNPFEDSA-N	0	3	320.433	2.024	10	0		DEAEHN
Cc1ccn2c(CN3CCNC[C@H]3c3ccncc3)cnc2c1	ZINC000262115670	145262891	/nfs/dbraw/zinc/26/28/91/145262891.db2.gz	WVWUBIDNXSSSFX-KRWDZBQOSA-N	0	3	307.401	2.184	10	0		DEAEHN
CCc1ccc(CNC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)s1	ZINC000262419570	145282933	/nfs/dbraw/zinc/28/29/33/145282933.db2.gz	DWCDAQWKNKMCQB-JKIFEVAISA-N	0	3	322.474	2.459	10	0		DEAEHN
Cc1cnc([C@H](C)NC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)s1	ZINC000262495038	145288354	/nfs/dbraw/zinc/28/83/54/145288354.db2.gz	LGWOGNZSLRMLFV-PVTKRXDGSA-N	0	3	323.462	2.161	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(Cc2c(F)cccc2Cl)n1	ZINC000263173501	145332484	/nfs/dbraw/zinc/33/24/84/145332484.db2.gz	FZUNTKSXRZPKFU-GFCCVEGCSA-N	0	3	310.760	2.029	10	0		DEAEHN
C[C@H]1CCc2sc(-c3nc([C@@H]4CNCCN4C)no3)cc2C1	ZINC000263200640	145335381	/nfs/dbraw/zinc/33/53/81/145335381.db2.gz	JAIRNQIPVDRXMR-JQWIXIFHSA-N	0	3	318.446	2.499	10	0		DEAEHN
C[C@H](NCCCS(=O)(=O)N(C)C)c1ccc(Cl)s1	ZINC000348261443	146243860	/nfs/dbraw/zinc/24/38/60/146243860.db2.gz	MHRNORSZECMQKQ-VIFPVBQESA-N	0	3	310.872	2.334	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1CCNC(=O)NCCNc1ccncc1	ZINC000358626527	147168876	/nfs/dbraw/zinc/16/88/76/147168876.db2.gz	IILGQIDEYYGOQA-CABCVRRESA-N	0	3	304.438	2.431	10	0		DEAEHN
O=C(NCCNc1ccncc1)NCc1coc2ccccc12	ZINC000358632164	147169724	/nfs/dbraw/zinc/16/97/24/147169724.db2.gz	JIAAIAYESLCEIK-UHFFFAOYSA-N	0	3	310.357	2.161	10	0		DEAEHN
COC(=O)[C@@H](NC[C@@H](C1CC1)N(C)Cc1ccccc1)C1CC1	ZINC000358664461	147177122	/nfs/dbraw/zinc/17/71/22/147177122.db2.gz	UBOPBHUCZPSACU-ROUUACIJSA-N	0	3	316.445	2.438	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCCC[C@H]1[C@H](C)O	ZINC000359138358	147269839	/nfs/dbraw/zinc/26/98/39/147269839.db2.gz	KVUBOHAVADPFCQ-RDJZCZTQSA-N	0	3	304.434	2.270	10	0		DEAEHN
Cn1cc(C[C@H]2CCN(Cc3ccc(-c4cc[nH]n4)o3)C2)cn1	ZINC000369484985	147915993	/nfs/dbraw/zinc/91/59/93/147915993.db2.gz	OQBLCOFCAUWWID-CYBMUJFWSA-N	0	3	311.389	2.468	10	0		DEAEHN
COc1cccc(CNC[C@H]2CCCN2c2cccnn2)c1F	ZINC000370585987	148032947	/nfs/dbraw/zinc/03/29/47/148032947.db2.gz	ZHIRPOVHSYSLEC-CQSZACIVSA-N	0	3	316.380	2.383	10	0		DEAEHN
CCn1cc([C@H](C)NC[C@H]2CCC3(CCOCC3)[C@H]2O)cn1	ZINC000374789991	148290091	/nfs/dbraw/zinc/29/00/91/148290091.db2.gz	ASMWFMOAJPSUHE-LZWOXQAQSA-N	0	3	307.438	2.121	10	0		DEAEHN
C[C@@H]1CCOCCN1CCC(=O)N1CCc2sccc2C1	ZINC000374991785	148313758	/nfs/dbraw/zinc/31/37/58/148313758.db2.gz	ZFVLAVAPPKBXEG-CYBMUJFWSA-N	0	3	308.447	2.134	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1c2ccccc2C[C@H]1C	ZINC000111865939	401726676	/nfs/dbraw/zinc/72/66/76/401726676.db2.gz	XYQCVSQGDYWPOY-ZBFHGGJFSA-N	0	3	317.433	2.258	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1ccc(S(C)(=O)=O)cc1)C(C)(C)C	ZINC000074317824	401735440	/nfs/dbraw/zinc/73/54/40/401735440.db2.gz	HITKTZMAMPTKSD-LLVKDONJSA-N	0	3	312.435	2.053	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)NCCc2cc(F)ccc2F)CN1C1CC1	ZINC000126444859	401694620	/nfs/dbraw/zinc/69/46/20/401694620.db2.gz	LIXQQTXPICYXTH-BXUZGUMPSA-N	0	3	323.387	2.432	10	0		DEAEHN
CCOCCN1CCN(CCCCCn2cc(C)cn2)C[C@@H]1C	ZINC000111228065	401702183	/nfs/dbraw/zinc/70/21/83/401702183.db2.gz	LMRCXXJSCFOIRJ-SFHVURJKSA-N	0	3	322.497	2.404	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cc(Br)c[nH]2)CCN1C	ZINC000127726460	401747544	/nfs/dbraw/zinc/74/75/44/401747544.db2.gz	WKEAFYSXPQGGTE-ONGXEEELSA-N	0	3	314.227	2.332	10	0		DEAEHN
Cc1ccc([C@H](CNC(=O)N(C)C[C@@H]2CCCO2)N(C)C)cc1	ZINC000077007212	401803025	/nfs/dbraw/zinc/80/30/25/401803025.db2.gz	CVHHUGVHLIOKLV-IRXDYDNUSA-N	0	3	319.449	2.418	10	0		DEAEHN
CC1(CNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)COC1	ZINC000112723147	401756596	/nfs/dbraw/zinc/75/65/96/401756596.db2.gz	LSDOLSRFMRGBEH-INIZCTEOSA-N	0	3	317.433	2.159	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(-c2cccs2)n[nH]1	ZINC000113224292	401770795	/nfs/dbraw/zinc/77/07/95/401770795.db2.gz	MJEJCBBFRSLERQ-NWDGAFQWSA-N	0	3	316.430	2.447	10	0		DEAEHN
Cc1nn(C)c2sc(C(=O)N3C[C@@H]4CCCN4C[C@@H]3C)cc12	ZINC000113224851	401770803	/nfs/dbraw/zinc/77/08/03/401770803.db2.gz	PHNJGBGYHJETCL-JQWIXIFHSA-N	0	3	318.446	2.252	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(F)cc2nc[nH]c21	ZINC000113232841	401771183	/nfs/dbraw/zinc/77/11/83/401771183.db2.gz	ZZXIXTYLCMASDW-CMPLNLGQSA-N	0	3	302.353	2.011	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)ccc1C	ZINC000113232924	401771685	/nfs/dbraw/zinc/77/16/85/401771685.db2.gz	ZXAZEECMVZKPLR-XJKSGUPXSA-N	0	3	315.417	2.262	10	0		DEAEHN
CN1CCC(NC(=O)Cc2coc(-c3ccc(F)cc3)n2)CC1	ZINC000113413971	401778812	/nfs/dbraw/zinc/77/88/12/401778812.db2.gz	WLPGHELASNIDFY-UHFFFAOYSA-N	0	3	317.364	2.234	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)NCc1cccc(OC)n1	ZINC000113608302	401783748	/nfs/dbraw/zinc/78/37/48/401783748.db2.gz	MIUZZCMHLDYNJI-HNNXBMFYSA-N	0	3	320.437	2.154	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1c(C)noc1C1CC1	ZINC000129889442	401810958	/nfs/dbraw/zinc/81/09/58/401810958.db2.gz	GEPCQAKMOGKXIK-ZDUSSCGKSA-N	0	3	322.409	2.093	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N2CC[C@H](c3cnn(C)c3)C2)cc1	ZINC000116113307	401842090	/nfs/dbraw/zinc/84/20/90/401842090.db2.gz	MUWRZQHCTJWUJV-INIZCTEOSA-N	0	3	312.417	2.111	10	0		DEAEHN
Cn1cc([C@@H]2CCN([C@H](C(=O)NC3CC3)c3ccccc3)C2)cn1	ZINC000116310905	401848418	/nfs/dbraw/zinc/84/84/18/401848418.db2.gz	CAJKHLSXGNXGPO-QAPCUYQASA-N	0	3	324.428	2.229	10	0		DEAEHN
Cn1cc([C@H]2CCN(CCC(=O)Nc3ccc(F)cc3)C2)cn1	ZINC000116317405	401849267	/nfs/dbraw/zinc/84/92/67/401849267.db2.gz	DVBZNQSAZXWSEG-ZDUSSCGKSA-N	0	3	316.380	2.377	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1ccc(OC)c(C)c1	ZINC000030375367	401862880	/nfs/dbraw/zinc/86/28/80/401862880.db2.gz	OSARNDDXGZEUFY-ZDUSSCGKSA-N	0	3	314.451	2.012	10	0		DEAEHN
Cc1ccc([C@@H](C)NC(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000117036174	401867023	/nfs/dbraw/zinc/86/70/23/401867023.db2.gz	JTUCIAPJLLBRDU-GDBMZVCRSA-N	0	3	305.422	2.028	10	0		DEAEHN
Cc1cc(C)cc([C@H](C)NC(=O)N2CCO[C@H](CN(C)C)C2)c1	ZINC000117047449	401867597	/nfs/dbraw/zinc/86/75/97/401867597.db2.gz	AKBIHHPZVSVTTM-DOTOQJQBSA-N	0	3	319.449	2.336	10	0		DEAEHN
CC(C)OC(=O)c1ccc(CN2C[C@@H](C(N)=O)CC[C@@H]2C)cc1	ZINC000135040985	401925012	/nfs/dbraw/zinc/92/50/12/401925012.db2.gz	QAVLMHYCGDEWTL-BBRMVZONSA-N	0	3	318.417	2.338	10	0		DEAEHN
CCC[C@H](C(=O)NCc1cccnc1OCC(F)F)N(C)C	ZINC000135245590	401931901	/nfs/dbraw/zinc/93/19/01/401931901.db2.gz	NZRWFEMXZYLNSG-GFCCVEGCSA-N	0	3	315.364	2.072	10	0		DEAEHN
CC[C@H](COC)N[C@H](CO)c1cccc(Br)c1	ZINC000119197279	401932586	/nfs/dbraw/zinc/93/25/86/401932586.db2.gz	CCWJZUQGHMTHSO-CHWSQXEVSA-N	0	3	302.212	2.497	10	0		DEAEHN
CC[C@H]1CCCN(C(=O)NC[C@H]2CCCN2CCOC)CC1	ZINC000117495185	401878350	/nfs/dbraw/zinc/87/83/50/401878350.db2.gz	HXZQHVMJZZTNKN-JKSUJKDBSA-N	0	3	311.470	2.319	10	0		DEAEHN
CN(C(=O)C[C@@H]1CCOc2ccccc21)C1CCN(C)CC1	ZINC000117741664	401882829	/nfs/dbraw/zinc/88/28/29/401882829.db2.gz	RBDDSBWHSQKUQA-AWEZNQCLSA-N	0	3	302.418	2.495	10	0		DEAEHN
CC(C)C[C@@H](NC(=O)[C@H](N)C(C)C)C(=O)Nc1ccccc1	ZINC000035653275	401900216	/nfs/dbraw/zinc/90/02/16/401900216.db2.gz	LODYUHYUFPJMPF-HUUCEWRRSA-N	0	3	305.422	2.139	10	0	in-vitro	DEAEHN
COc1cc(C[NH2+]C2CCOCC2)cc(Br)c1[O-]	ZINC000036319163	401904174	/nfs/dbraw/zinc/90/41/74/401904174.db2.gz	AJJHOIORBWJARU-UHFFFAOYSA-N	0	3	316.195	2.432	10	0		DEAEHN
CCC(CC)CC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000150823470	401997792	/nfs/dbraw/zinc/99/77/92/401997792.db2.gz	HNACHAGMBNFGNH-QGZVFWFLSA-N	0	3	309.498	2.441	10	0		DEAEHN
CCC(CC)(CNCC(=O)Nc1ccccc1F)C(=O)OC	ZINC000120684939	401998179	/nfs/dbraw/zinc/99/81/79/401998179.db2.gz	NUXAGZIBXZHWTD-UHFFFAOYSA-N	0	3	310.369	2.333	10	0		DEAEHN
CC[C@H](CSC)N(C)CC(=O)N1CCO[C@H]2CCCC[C@@H]21	ZINC000091099906	401993948	/nfs/dbraw/zinc/99/39/48/401993948.db2.gz	PEBZNTODGYMDRU-ILXRZTDVSA-N	0	3	314.495	2.230	10	0		DEAEHN
CCOC(=O)CCN1C[C@@H](c2ccccc2)C[C@H](C(=O)OC)C1	ZINC000135461295	401940903	/nfs/dbraw/zinc/94/09/03/401940903.db2.gz	AGOVXMGEGTXHKW-HOTGVXAUSA-N	0	3	319.401	2.218	10	0		DEAEHN
C[C@H](C(=O)NC1CCCC1)N1CCN(C[C@@H]2CC=CCC2)CC1	ZINC000093077599	402011002	/nfs/dbraw/zinc/01/10/02/402011002.db2.gz	MHOPZASNJAVUJV-IAGOWNOFSA-N	0	3	319.493	2.408	10	0		DEAEHN
COC(=O)c1sc(N2C[C@H]3CCCN3C[C@@H]2C)nc1Cl	ZINC000094463916	402022577	/nfs/dbraw/zinc/02/25/77/402022577.db2.gz	BEKPCNIKTFUELD-DTWKUNHWSA-N	0	3	315.826	2.256	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCC1(C)Cc2ccccc2C1	ZINC000094038747	402022723	/nfs/dbraw/zinc/02/27/23/402022723.db2.gz	FXOHMPGVWOUBHR-INIZCTEOSA-N	0	3	301.434	2.185	10	0		DEAEHN
CSC[C@@H]1CCCN1C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000121395582	402033008	/nfs/dbraw/zinc/03/30/08/402033008.db2.gz	FSYJKXJHGLNWND-KGLIPLIRSA-N	0	3	301.500	2.500	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NCCc1nccs1)c1ccccc1	ZINC000051756888	402035926	/nfs/dbraw/zinc/03/59/26/402035926.db2.gz	NETCKYGNNCEDNK-CQSZACIVSA-N	0	3	318.446	2.288	10	0		DEAEHN
COc1ccc2c(CC(=O)NCCN3CCCC3)coc2c1	ZINC000052554010	402043559	/nfs/dbraw/zinc/04/35/59/402043559.db2.gz	MQAUCZWTDAQSQN-UHFFFAOYSA-N	0	3	302.374	2.196	10	0		DEAEHN
Cc1noc(C)c1CC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000052555983	402044012	/nfs/dbraw/zinc/04/40/12/402044012.db2.gz	JAFXCOWQTAURJL-INIZCTEOSA-N	0	3	301.390	2.253	10	0		DEAEHN
CSc1ccc(O[C@H](C)C(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000151601703	402045678	/nfs/dbraw/zinc/04/56/78/402045678.db2.gz	CEZCGSIKLQPWIH-CHWSQXEVSA-N	0	3	308.447	2.338	10	0		DEAEHN
O=C(NCCCN1CCC(O)CC1)[C@H]1C[C@H]1C1CCCCC1	ZINC000121626147	402046413	/nfs/dbraw/zinc/04/64/13/402046413.db2.gz	IFEJKSIAGVFWEY-IRXDYDNUSA-N	0	3	308.466	2.166	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC[C@H](C)CN2CCCC2)c(C)s1	ZINC000048672350	402005703	/nfs/dbraw/zinc/00/57/03/402005703.db2.gz	XVEZVUYGUWKQTP-NSHDSACASA-N	0	3	316.492	2.375	10	0		DEAEHN
CCCn1nc(C)c(CN2CCN(CCOC)[C@H](CC)C2)c1C	ZINC000120913799	402006334	/nfs/dbraw/zinc/00/63/34/402006334.db2.gz	VNXVVAMSNJNXTL-QGZVFWFLSA-N	0	3	322.497	2.453	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)CCOc2ccccc2)C1	ZINC000057870144	402097667	/nfs/dbraw/zinc/09/76/67/402097667.db2.gz	KQEJAWJKOQHJTK-HNNXBMFYSA-N	0	3	305.422	2.191	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cc(-c3cccnc3)on2)CCN1C	ZINC000123025798	402106317	/nfs/dbraw/zinc/10/63/17/402106317.db2.gz	SNBAJNHDJOYMNL-TZMCWYRMSA-N	0	3	314.389	2.291	10	0		DEAEHN
C[C@H](CS(C)(=O)=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000152952730	402118632	/nfs/dbraw/zinc/11/86/32/402118632.db2.gz	KLXSUXMXNMNXMX-NVXWUHKLSA-N	0	3	324.490	2.064	10	0		DEAEHN
CN[C@H](C)C(=O)Nc1cccc(Br)c1COC	ZINC000054076028	402062633	/nfs/dbraw/zinc/06/26/33/402062633.db2.gz	DPQQPPKDWBKDLF-MRVPVSSYSA-N	0	3	301.184	2.142	10	0		DEAEHN
CN[C@H](C)C(=O)Nc1ccc(I)cc1C	ZINC000054073840	402062707	/nfs/dbraw/zinc/06/27/07/402062707.db2.gz	CUYKUNBFWNMGOW-MRVPVSSYSA-N	0	3	318.158	2.146	10	0		DEAEHN
COc1cc(OC)cc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000123425544	402127117	/nfs/dbraw/zinc/12/71/17/402127117.db2.gz	PFKJMXKAKWBZHF-GXTWGEPZSA-N	0	3	306.406	2.259	10	0		DEAEHN
COc1ccccc1OCC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000123709896	402142578	/nfs/dbraw/zinc/14/25/78/402142578.db2.gz	CLDDLDHZBDBSDA-ZIAGYGMSSA-N	0	3	306.406	2.015	10	0		DEAEHN
Cc1ccc(NC(=O)NCCN2CCCC[C@@H]2C)cc1C(N)=O	ZINC000067311104	402156133	/nfs/dbraw/zinc/15/61/33/402156133.db2.gz	ZMZTYBSIENYJQT-ZDUSSCGKSA-N	0	3	318.421	2.090	10	0		DEAEHN
CCCCNC(=O)[C@H]1CCCN(Cc2cnn(CCC)c2)C1	ZINC000124925111	402203553	/nfs/dbraw/zinc/20/35/53/402203553.db2.gz	WHGMPHODMQHUEE-INIZCTEOSA-N	0	3	306.454	2.421	10	0		DEAEHN
COC(=O)c1ccc(C(=O)N[C@H](CC(C)C)CN(C)C)cc1	ZINC000068222973	402188114	/nfs/dbraw/zinc/18/81/14/402188114.db2.gz	UTFBXBTUPNMGEK-OAHLLOKOSA-N	0	3	306.406	2.179	10	0		DEAEHN
CCCCNC(=O)[C@@H]1CCCN(Cc2cnn(CCC)c2)C1	ZINC000124924871	402203649	/nfs/dbraw/zinc/20/36/49/402203649.db2.gz	WHGMPHODMQHUEE-MRXNPFEDSA-N	0	3	306.454	2.421	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)CCc2ccc(C(=O)OC)cc2)C1	ZINC000068429910	402197650	/nfs/dbraw/zinc/19/76/50/402197650.db2.gz	BUZQYVGAKNKQFO-MRXNPFEDSA-N	0	3	318.417	2.006	10	0		DEAEHN
Cc1ccn2ncc(C(=O)NCc3cccc(CN(C)C)c3)c2n1	ZINC000068724235	402204121	/nfs/dbraw/zinc/20/41/21/402204121.db2.gz	IIXLPMPXISQBAA-UHFFFAOYSA-N	0	3	323.400	2.029	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](C)c1ccccc1)N(C)CCCn1ccnc1	ZINC000124319031	402174333	/nfs/dbraw/zinc/17/43/33/402174333.db2.gz	ZDMATJKRADKLBF-JKSUJKDBSA-N	0	3	314.433	2.471	10	0		DEAEHN
CN(C)c1nc(CN2CCN(C)CC23CCCCC3)ns1	ZINC000154613071	402221225	/nfs/dbraw/zinc/22/12/25/402221225.db2.gz	LGBAKVDFVNUXQA-UHFFFAOYSA-N	0	3	309.483	2.054	10	0		DEAEHN
Cc1noc(C)c1CCNC(=O)NCCN1CCCC[C@H]1C	ZINC000107077076	402225604	/nfs/dbraw/zinc/22/56/04/402225604.db2.gz	YZAKYESJSFPSOP-GFCCVEGCSA-N	0	3	308.426	2.008	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)c1ccc(-c2ncon2)cc1	ZINC000107218399	402228386	/nfs/dbraw/zinc/22/83/86/402228386.db2.gz	WJOYORODXCRFRZ-CYBMUJFWSA-N	0	3	314.389	2.341	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)[C@H]1CSC(=O)N1)c1ccccc1	ZINC000154798999	402233009	/nfs/dbraw/zinc/23/30/09/402233009.db2.gz	CDJZGUBSQZRGRT-ZIAGYGMSSA-N	0	3	321.446	2.011	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2sc(C)nc2C)C1	ZINC000108562038	402257478	/nfs/dbraw/zinc/25/74/78/402257478.db2.gz	CWFCLPLUQOJOCX-CYBMUJFWSA-N	0	3	310.467	2.086	10	0		DEAEHN
Cc1cnn([C@H]2CCCN(CCC(=O)NC3CCCC3)C2)c1	ZINC000105901606	402210766	/nfs/dbraw/zinc/21/07/66/402210766.db2.gz	RCRLPRXXUFZWAO-INIZCTEOSA-N	0	3	304.438	2.277	10	0		DEAEHN
Cn1ccnc1CC1CCN(CCC(=O)OC(C)(C)C)CC1	ZINC000105918300	402211416	/nfs/dbraw/zinc/21/14/16/402211416.db2.gz	XAAIEKROASKCJA-UHFFFAOYSA-N	0	3	307.438	2.406	10	0		DEAEHN
CC[C@@H](C)Oc1ccc(C(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000176608589	402323299	/nfs/dbraw/zinc/32/32/99/402323299.db2.gz	DCHKTQHQSKUVHE-RHSMWYFYSA-N	0	3	320.433	2.267	10	0		DEAEHN
CCn1cc(Br)cc1C(=O)N1CC[C@@H](N(C)C)C1	ZINC000071140010	402270434	/nfs/dbraw/zinc/27/04/34/402270434.db2.gz	FZBZVFIGZLVGRL-LLVKDONJSA-N	0	3	314.227	2.047	10	0		DEAEHN
Cc1ccc(CCCC(=O)N2CCO[C@@H](CN(C)C)C2)s1	ZINC000176059643	402275098	/nfs/dbraw/zinc/27/50/98/402275098.db2.gz	RWQFZBGAJYWWGT-AWEZNQCLSA-N	0	3	310.463	2.168	10	0		DEAEHN
C[C@@H](O)CC(C)(C)CNC(=O)c1ccccc1OCCN(C)C	ZINC000176128298	402282024	/nfs/dbraw/zinc/28/20/24/402282024.db2.gz	QBZRRSPSSBNSPU-CQSZACIVSA-N	0	3	322.449	2.154	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NOCc1ccc(F)cc1	ZINC000184656541	402289136	/nfs/dbraw/zinc/28/91/36/402289136.db2.gz	FOTPYTUEYZIAEB-HNNXBMFYSA-N	0	3	309.385	2.383	10	0		DEAEHN
CN(C[C@@H]1CCC(C)(C)O1)[C@@H]1CCCN(c2cccnn2)C1	ZINC000184669037	402290492	/nfs/dbraw/zinc/29/04/92/402290492.db2.gz	JKGZCAOHTXCDDX-CABCVRRESA-N	0	3	304.438	2.335	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1ccc(C(=O)OC)cc1	ZINC000176298047	402297706	/nfs/dbraw/zinc/29/77/06/402297706.db2.gz	RFLPAUUVWSIMST-OAHLLOKOSA-N	0	3	319.405	2.421	10	0		DEAEHN
Cc1ccc([O-])c(C[NH2+]CC[C@@H](C)NC(=O)OC(C)(C)C)n1	ZINC000222079293	402305546	/nfs/dbraw/zinc/30/55/46/402305546.db2.gz	ZBQNPJITWDFFKC-GFCCVEGCSA-N	0	3	309.410	2.489	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NC2Cc3ccccc3C2)CCN1C	ZINC000184918501	402309335	/nfs/dbraw/zinc/30/93/35/402309335.db2.gz	FSVUCCZJTJKBQR-GUYCJALGSA-N	0	3	301.434	2.278	10	0		DEAEHN
Cn1cc(-c2cc(CN3CCC(n4ccnc4)CC3)on2)cn1	ZINC000185020082	402317290	/nfs/dbraw/zinc/31/72/90/402317290.db2.gz	KDFUPBDAWZFMJU-UHFFFAOYSA-N	0	3	312.377	2.109	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1ccc(C)c(F)c1	ZINC000176900799	402348307	/nfs/dbraw/zinc/34/83/07/402348307.db2.gz	VNGAKMUYOVZFAD-CQSZACIVSA-N	0	3	321.396	2.015	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc2c(C)nn(C)c2s1	ZINC000177008495	402358593	/nfs/dbraw/zinc/35/85/93/402358593.db2.gz	AOLFUGVNYADNTD-GFCCVEGCSA-N	0	3	320.462	2.500	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccn(-c2ccccc2)n1	ZINC000177021566	402360411	/nfs/dbraw/zinc/36/04/11/402360411.db2.gz	AWTGPDUFDYPALL-MRXNPFEDSA-N	0	3	312.417	2.429	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc(-c2ncon2)cc1	ZINC000177032981	402361791	/nfs/dbraw/zinc/36/17/91/402361791.db2.gz	LHMPNRNRSWQTSZ-HNNXBMFYSA-N	0	3	314.389	2.293	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cccnc2N2CCCC2)C1	ZINC000177135526	402373483	/nfs/dbraw/zinc/37/34/83/402373483.db2.gz	DGANPHWAUVBQID-ZBFHGGJFSA-N	0	3	316.449	2.140	10	0		DEAEHN
COc1cc(C[NH2+]CCC[C@@H](C)O)cc(Br)c1[O-]	ZINC000227954695	402334621	/nfs/dbraw/zinc/33/46/21/402334621.db2.gz	LRZASHZSRGGXMW-SECBINFHSA-N	0	3	318.211	2.414	10	0		DEAEHN
COc1cc(C[NH2+][C@@H](C)C[C@@H](C)O)cc(Br)c1[O-]	ZINC000228072397	402336321	/nfs/dbraw/zinc/33/63/21/402336321.db2.gz	CDEPNDRAJFDWMU-DTWKUNHWSA-N	0	3	318.211	2.412	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)NCCC2=CCCCCC2)CCO1	ZINC000185263975	402339042	/nfs/dbraw/zinc/33/90/42/402339042.db2.gz	AYFDRHJZACIEMS-MRXNPFEDSA-N	0	3	309.454	2.239	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)CCc2cccc3c2OCO3)CCN1C	ZINC000186041760	402398058	/nfs/dbraw/zinc/39/80/58/402398058.db2.gz	RNCQYEVDOUHACE-HIFRSBDPSA-N	0	3	318.417	2.289	10	0		DEAEHN
C[C@]1(CNC(=O)c2cnccn2)CCCN1Cc1ccccc1	ZINC000162379580	402418352	/nfs/dbraw/zinc/41/83/52/402418352.db2.gz	ZKFDIAOULIWEHF-GOSISDBHSA-N	0	3	310.401	2.261	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC(c2cnn(CC)c2)CC1)N(C)C	ZINC000162439458	402419848	/nfs/dbraw/zinc/41/98/48/402419848.db2.gz	VAKNPFDFLOJVMP-INIZCTEOSA-N	0	3	306.454	2.339	10	0		DEAEHN
CCC[C@H]1CN(c2ccnc(C3CC3)n2)CCN1CCOC	ZINC000162478915	402421802	/nfs/dbraw/zinc/42/18/02/402421802.db2.gz	GIGWWDALJZCNQD-HNNXBMFYSA-N	0	3	304.438	2.291	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2ccc(C(=O)OC)o2)C12CCOCC2	ZINC000186338621	402422523	/nfs/dbraw/zinc/42/25/23/402422523.db2.gz	JBIFKBXUNCTYBP-HUUCEWRRSA-N	0	3	323.389	2.130	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)NCc1ccc(Cl)cc1	ZINC000177697124	402427850	/nfs/dbraw/zinc/42/78/50/402427850.db2.gz	ORQOCCSFKGLRJC-INIZCTEOSA-N	0	3	323.868	2.372	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)N1CCc2ccccc21	ZINC000177702561	402428402	/nfs/dbraw/zinc/42/84/02/402428402.db2.gz	DHGHHFCWSXZXQO-DOTOQJQBSA-N	0	3	315.461	2.380	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)N(C)C	ZINC000161540131	402391194	/nfs/dbraw/zinc/39/11/94/402391194.db2.gz	QZPUQQBJZLHLGS-MSOLQXFVSA-N	0	3	317.477	2.498	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H](C)c1ccc(NC(N)=O)cc1)N(C)C	ZINC000161578601	402392519	/nfs/dbraw/zinc/39/25/19/402392519.db2.gz	QXSYAXXEMZWLBK-RISCZKNCSA-N	0	3	306.410	2.085	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](C)c1ccccc1)N1CC[C@@H](N2CCCC2)C1	ZINC000245397683	402455279	/nfs/dbraw/zinc/45/52/79/402455279.db2.gz	PZBJNHGLJCOYKL-LZLYRXPVSA-N	0	3	315.461	2.422	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@H]1COc2ccccc21	ZINC000245426402	402459007	/nfs/dbraw/zinc/45/90/07/402459007.db2.gz	UWMJKCOMSHVYDL-HIFRSBDPSA-N	0	3	303.406	2.246	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@H]1CCOc2ccccc21	ZINC000245428146	402459967	/nfs/dbraw/zinc/45/99/67/402459967.db2.gz	INMBNWOTYLCQHK-HOCLYGCPSA-N	0	3	302.418	2.495	10	0		DEAEHN
C[C@H](CNC(=O)N1CCN2CCC[C@H]2C1)Oc1ccc(F)cc1	ZINC000245482984	402464906	/nfs/dbraw/zinc/46/49/06/402464906.db2.gz	DSGKYNNMIXLUKD-HIFRSBDPSA-N	0	3	321.396	2.083	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@H]1CC(C)(C)OC1(C)C	ZINC000245513655	402467113	/nfs/dbraw/zinc/46/71/13/402467113.db2.gz	APAJOGMQEUQRFR-KGLIPLIRSA-N	0	3	311.470	2.458	10	0		DEAEHN
CCOCc1cc(CN2C[C@@H](C(N)=O)CC[C@H]2C)ccc1OC	ZINC000245549048	402470041	/nfs/dbraw/zinc/47/00/41/402470041.db2.gz	YQWLDKVMEDIWEK-HIFRSBDPSA-N	0	3	320.433	2.318	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N[C@H](C)COCc1ccccc1	ZINC000245592855	402473080	/nfs/dbraw/zinc/47/30/80/402473080.db2.gz	BFQOVZAUBBNZEL-WBVHZDCISA-N	0	3	319.449	2.375	10	0		DEAEHN
CCC[C@H](C(=O)NCCN1c2ccccc2C[C@H]1C)N(C)C	ZINC000245642006	402475863	/nfs/dbraw/zinc/47/58/63/402475863.db2.gz	SNAFZYAKDNWSFO-RHSMWYFYSA-N	0	3	303.450	2.284	10	0		DEAEHN
CN(C[C@@H]1CCOC1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000245642760	402475896	/nfs/dbraw/zinc/47/58/96/402475896.db2.gz	KTZFTRYBLORYOD-BHYGNILZSA-N	0	3	317.433	2.110	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N(C)CC1(N(C)C)CCC1	ZINC000186992013	402476318	/nfs/dbraw/zinc/47/63/18/402476318.db2.gz	AXQALVKGAVXEBF-UHFFFAOYSA-N	0	3	305.422	2.425	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@H](C)Cc2ccc(OC)cc2)C1	ZINC000245655360	402476957	/nfs/dbraw/zinc/47/69/57/402476957.db2.gz	OBDRMUXVRWXRMF-GDBMZVCRSA-N	0	3	304.434	2.474	10	0		DEAEHN
C[C@H](Cc1ccc(O)cc1)NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000245660231	402477032	/nfs/dbraw/zinc/47/70/32/402477032.db2.gz	DAKUDFPRCLMYSK-FMKPAKJESA-N	0	3	319.449	2.447	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCCc2cccnc2)[C@H]1c1ccccc1	ZINC000245663907	402477890	/nfs/dbraw/zinc/47/78/90/402477890.db2.gz	QJDNTCJRCIPASE-ZWKOTPCHSA-N	0	3	324.428	2.369	10	0		DEAEHN
Cn1cc(CN2CC[C@@H]3OCCC[C@H]3C2)c(-c2ccncc2)n1	ZINC000245736710	402483889	/nfs/dbraw/zinc/48/38/89/402483889.db2.gz	KYYAMFKBGXWXDA-RDJZCZTQSA-N	0	3	312.417	2.483	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)CC1CCCC1	ZINC000178354185	402488747	/nfs/dbraw/zinc/48/87/47/402488747.db2.gz	KPCWIJLDGLLXOH-LSDHHAIUSA-N	0	3	300.468	2.065	10	0		DEAEHN
Cc1cc(C(=O)CN2CCN3CCC[C@H]3C2)c(C)n1C1CC1	ZINC000246166437	402514276	/nfs/dbraw/zinc/51/42/76/402514276.db2.gz	FLNQHADJLWMOLW-INIZCTEOSA-N	0	3	301.434	2.403	10	0		DEAEHN
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000170946065	402543629	/nfs/dbraw/zinc/54/36/29/402543629.db2.gz	OPJKOFKZTWKJEY-HYVNUMGLSA-N	0	3	300.402	2.105	10	0		DEAEHN
COC(=O)c1ccccc1N(C)C(=O)CN[C@H](C)C(C)(C)C	ZINC000178866299	402548433	/nfs/dbraw/zinc/54/84/33/402548433.db2.gz	GWOOSBLUJNFRLT-GFCCVEGCSA-N	0	3	306.406	2.460	10	0		DEAEHN
O=C(CN1CCC[C@@H]2CCC[C@@H]21)N1CCO[C@@H]2CCCC[C@@H]21	ZINC000247700726	402574751	/nfs/dbraw/zinc/57/47/51/402574751.db2.gz	XUXCOLHXGUTGAN-LUKYLMHMSA-N	0	3	306.450	2.421	10	0		DEAEHN
CCc1c(C(=O)N2CCN3CCC[C@H]3C2)cnn1CC(C)C	ZINC000178886918	402551026	/nfs/dbraw/zinc/55/10/26/402551026.db2.gz	KFCQSUJOFSTFGU-AWEZNQCLSA-N	0	3	304.438	2.022	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@@](C)(O)[C@@H](C)c2ccccc2)C1	ZINC000246966315	402551383	/nfs/dbraw/zinc/55/13/83/402551383.db2.gz	FYFNSAXNCOBRNI-YEWFCNIMSA-N	0	3	318.461	2.386	10	0		DEAEHN
Cc1cccc(O[C@H](C)C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000247207775	402560158	/nfs/dbraw/zinc/56/01/58/402560158.db2.gz	LWNKIBRCIKFMMG-OAGGEKHMSA-N	0	3	302.418	2.457	10	0		DEAEHN
CCC(CC)NC(=O)[C@H](C)N1CCC[C@H]1Cn1ccnc1C	ZINC000247239445	402560850	/nfs/dbraw/zinc/56/08/50/402560850.db2.gz	ZVENWRRONOBTEM-BBRMVZONSA-N	0	3	306.454	2.349	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@H]1C(=O)N(C)[C@H]1CCN(C)C[C@H]1C	ZINC000247396221	402566060	/nfs/dbraw/zinc/56/60/60/402566060.db2.gz	MHWVOEHIZFBHTH-LNCBFAARSA-N	0	3	302.418	2.350	10	0		DEAEHN
CCCS(=O)(=O)CCN[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000189909573	402566487	/nfs/dbraw/zinc/56/64/87/402566487.db2.gz	JGIWVLVCDQSXJA-CQSZACIVSA-N	0	3	321.446	2.348	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@H]2Cc3cc(F)ccc3O2)CCN1C	ZINC000247415839	402566779	/nfs/dbraw/zinc/56/67/79/402566779.db2.gz	NNOVPMODMPDZPV-DIOULYMOSA-N	0	3	306.381	2.070	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccn(-c2ccccc2)n1	ZINC000247516052	402570858	/nfs/dbraw/zinc/57/08/58/402570858.db2.gz	WGTOFCVPUZOBEK-ZBFHGGJFSA-N	0	3	310.401	2.181	10	0		DEAEHN
CC(=O)CCN1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1	ZINC000171252813	402571539	/nfs/dbraw/zinc/57/15/39/402571539.db2.gz	ZMGCDMXGODNDFB-UHFFFAOYSA-N	0	3	318.373	2.045	10	0		DEAEHN
C[C@@H](C(=O)N1CC[C@@H](Oc2cccnc2)C1)N1[C@H](C)CC[C@@H]1C	ZINC000246195674	402517466	/nfs/dbraw/zinc/51/74/66/402517466.db2.gz	BYTLBUJNFZEGFE-QSJFSLAZSA-N	0	3	317.433	2.323	10	0		DEAEHN
CCN(CC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)C1CC1	ZINC000246195971	402517500	/nfs/dbraw/zinc/51/75/00/402517500.db2.gz	ACTYOUVBBRAXNR-NVXWUHKLSA-N	0	3	315.461	2.250	10	0		DEAEHN
O=C(Nc1nc2c(s1)CCCCC2)c1n[nH]c2c1CNCC2	ZINC000188297032	402518809	/nfs/dbraw/zinc/51/88/09/402518809.db2.gz	DUFQUIIWSUBZTA-UHFFFAOYSA-N	0	3	317.418	2.033	10	0		DEAEHN
C[C@@H](C(=O)NCCC1=CCCCC1)N1CCN2CCC[C@@H]2C1	ZINC000178629096	402519404	/nfs/dbraw/zinc/51/94/04/402519404.db2.gz	QEVDKCXORKOWLJ-DOTOQJQBSA-N	0	3	305.466	2.162	10	0		DEAEHN
C[C@H](CNC(=O)[C@H](C)N1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000178629040	402519717	/nfs/dbraw/zinc/51/97/17/402519717.db2.gz	ZBHRVIDQJHKONQ-SOLBZPMBSA-N	0	3	315.461	2.075	10	0		DEAEHN
CCOc1ccc(NC(=O)[C@H](C)N2CCN3CCC[C@@H]3C2)cc1	ZINC000178636005	402520288	/nfs/dbraw/zinc/52/02/88/402520288.db2.gz	HKPAFACEAHXCML-GOEBONIOSA-N	0	3	317.433	2.192	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)[C@H]2CCN(C)C[C@H]2C)c(C)s1	ZINC000246251541	402520961	/nfs/dbraw/zinc/52/09/61/402520961.db2.gz	SPUVLASLFMNOOO-MFKMUULPSA-N	0	3	316.492	2.326	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)Nc2nnc(C(F)F)s2)C1	ZINC000246362398	402527140	/nfs/dbraw/zinc/52/71/40/402527140.db2.gz	IMHBDZYACUAPNA-JGVFFNPUSA-N	0	3	319.381	2.326	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCc2ccc(OC(F)F)cc2)C1	ZINC000170826383	402529830	/nfs/dbraw/zinc/52/98/30/402529830.db2.gz	NTGWMGQYPXSUQX-GFCCVEGCSA-N	0	3	313.348	2.134	10	0		DEAEHN
Cc1ccc(OCCCCNC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170830071	402530456	/nfs/dbraw/zinc/53/04/56/402530456.db2.gz	DGXVTPUJSBLUPR-INIZCTEOSA-N	0	3	319.449	2.500	10	0		DEAEHN
C[C@H](CNC(=O)N1CC[C@H](N(C)C)C1)COCc1ccccc1	ZINC000170833602	402530889	/nfs/dbraw/zinc/53/08/89/402530889.db2.gz	ZGQQYXQXNOWXIC-WBVHZDCISA-N	0	3	319.449	2.185	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2c[nH]c(=S)n2-c2ccccc2)C1	ZINC000170855927	402533383	/nfs/dbraw/zinc/53/33/83/402533383.db2.gz	CDVPUTUHAZTJTF-ZDUSSCGKSA-N	0	3	316.430	2.311	10	0		DEAEHN
Cc1noc2nc(C3CC3)cc(C(=O)N3CC[C@H](N(C)C)C3)c12	ZINC000170857014	402533538	/nfs/dbraw/zinc/53/35/38/402533538.db2.gz	HZQVZDLTCJCGEZ-LBPRGKRZSA-N	0	3	314.389	2.185	10	0		DEAEHN
C[C@@H](C(=O)N1CCCN(C2CC2)CC1)[C@H](N)c1ccccc1	ZINC000178747361	402533788	/nfs/dbraw/zinc/53/37/88/402533788.db2.gz	FWBYSMQQGPQLAA-PBHICJAKSA-N	0	3	301.434	2.019	10	0		DEAEHN
C[C@@H](C(=O)N1CCCN(C2CC2)CC1)[C@@H](N)c1ccccc1	ZINC000178747381	402533889	/nfs/dbraw/zinc/53/38/89/402533889.db2.gz	FWBYSMQQGPQLAA-RHSMWYFYSA-N	0	3	301.434	2.019	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Cc2cccc(Br)c2)C1	ZINC000170863819	402534308	/nfs/dbraw/zinc/53/43/08/402534308.db2.gz	AFYNMCSSNOAREW-ZDUSSCGKSA-N	0	3	311.223	2.154	10	0		DEAEHN
COc1cccc([C@H](C)N2C[C@@H](C)[C@H](N3CCOCC3)C2)c1	ZINC000246611560	402538743	/nfs/dbraw/zinc/53/87/43/402538743.db2.gz	YDPHHQPQKJVMNE-RVKKMQEKSA-N	0	3	304.434	2.409	10	0		DEAEHN
CC[C@@]1(CO)CCCN(C(=O)N[C@@H](CC(C)C)CN(C)C)C1	ZINC000190286455	402590190	/nfs/dbraw/zinc/59/01/90/402590190.db2.gz	IFNWKXOQZWJHCG-DOTOQJQBSA-N	0	3	313.486	2.157	10	0		DEAEHN
c1cn2c(cccc2CN2CCCC[C@H]2CN2CCOCC2)n1	ZINC000180027489	402605482	/nfs/dbraw/zinc/60/54/82/402605482.db2.gz	TYJLFNNLFGSMPF-INIZCTEOSA-N	0	3	314.433	2.021	10	0		DEAEHN
C[C@@H]1CC[C@@H](CN2CCCN(Cc3noc(C4CC4)n3)CC2)O1	ZINC000190525290	402607517	/nfs/dbraw/zinc/60/75/17/402607517.db2.gz	TXHVSGALOYFZHP-HIFRSBDPSA-N	0	3	320.437	2.022	10	0		DEAEHN
CCOCCCC(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190602240	402612693	/nfs/dbraw/zinc/61/26/93/402612693.db2.gz	ZEWQZGQAEYRBRQ-QGZVFWFLSA-N	0	3	319.449	2.179	10	0		DEAEHN
CCc1nc2n(n1)C[C@H](N[C@@H](C)c1cnn(C(C)C)c1)CC2	ZINC000180632761	402621882	/nfs/dbraw/zinc/62/18/82/402621882.db2.gz	QXVIYPHOMHHBJB-GXTWGEPZSA-N	0	3	302.426	2.284	10	0		DEAEHN
CC[C@@H](N[C@@H]1CCc2nc(C(C)C)nn2C1)c1cnn(C)c1	ZINC000180650831	402622658	/nfs/dbraw/zinc/62/26/58/402622658.db2.gz	NTBXPJJNORSZPJ-ZIAGYGMSSA-N	0	3	302.426	2.191	10	0		DEAEHN
CC[C@H](N[C@@H]1CCc2nc(C(C)C)nn2C1)c1cnn(C)c1	ZINC000180650812	402622695	/nfs/dbraw/zinc/62/26/95/402622695.db2.gz	NTBXPJJNORSZPJ-KGLIPLIRSA-N	0	3	302.426	2.191	10	0		DEAEHN
CCCNC(=O)[C@@H](C)N[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000180660353	402622789	/nfs/dbraw/zinc/62/27/89/402622789.db2.gz	UEGUCJOCKAJBNI-ZIAGYGMSSA-N	0	3	300.406	2.438	10	0		DEAEHN
Cc1c(-c2cc(CN(C)[C@]3(CO)CC[C@@H](C)C3)on2)cnn1C	ZINC000249529884	402633695	/nfs/dbraw/zinc/63/36/95/402633695.db2.gz	ASBYZQPYSPAALC-SJKOYZFVSA-N	0	3	318.421	2.366	10	0		DEAEHN
Cc1ccc(OC2CCN(C[C@@H](O)COCC(C)C)CC2)nc1	ZINC000181543766	402649327	/nfs/dbraw/zinc/64/93/27/402649327.db2.gz	FBFMKULDZHYLEB-MRXNPFEDSA-N	0	3	322.449	2.267	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)CN[C@H]2CCCC[C@H]2n2cccn2)C1	ZINC000251927432	402651219	/nfs/dbraw/zinc/65/12/19/402651219.db2.gz	XQFQYOZWZRTGJZ-OWCLPIDISA-N	0	3	304.438	2.215	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)CN2CCCN(C3CC3)CC2)c1	ZINC000172347388	402651296	/nfs/dbraw/zinc/65/12/96/402651296.db2.gz	GCSIPGABOJIDIV-UHFFFAOYSA-N	0	3	301.434	2.412	10	0		DEAEHN
Cc1ccccc1NC(=O)[C@@H](C)N1CCCN(C2CC2)CC1	ZINC000172346772	402651810	/nfs/dbraw/zinc/65/18/10/402651810.db2.gz	JMEVPXKGWOMQHW-OAHLLOKOSA-N	0	3	301.434	2.492	10	0		DEAEHN
CN(CC(F)(F)F)C(=O)CN(C[C@@H]1CCCO1)C1CCCC1	ZINC000173577958	402703411	/nfs/dbraw/zinc/70/34/11/402703411.db2.gz	XPZUTXLYWAYYCL-ZDUSSCGKSA-N	0	3	322.371	2.431	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cccc(Br)c1F	ZINC000192106505	402711958	/nfs/dbraw/zinc/71/19/58/402711958.db2.gz	LGSFMGHTKKPMNY-VIFPVBQESA-N	0	3	315.186	2.412	10	0		DEAEHN
CCc1nc(CNC(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)cs1	ZINC000182766256	402714919	/nfs/dbraw/zinc/71/49/19/402714919.db2.gz	QRXBOWNELLXJMS-TZMCWYRMSA-N	0	3	322.478	2.331	10	0		DEAEHN
Cc1cnc([C@H](NC(=O)N2CC[C@@H](N(C)C)C2)C2CC2)s1	ZINC000173914778	402718638	/nfs/dbraw/zinc/71/86/38/402718638.db2.gz	ALZIXDDOGDHXJD-CHWSQXEVSA-N	0	3	308.451	2.248	10	0		DEAEHN
CN(Cc1cccs1)C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C	ZINC000253206003	402661955	/nfs/dbraw/zinc/66/19/55/402661955.db2.gz	GDJCQJFTQWDONG-WOSRLPQWSA-N	0	3	308.447	2.239	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2c[nH]c(=O)c3ccccc23)C1	ZINC000253587058	402669220	/nfs/dbraw/zinc/66/92/20/402669220.db2.gz	UKRHOWFXCDUVAS-BLLLJJGKSA-N	0	3	313.401	2.399	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N[C@H]1CCC(=O)N(C)C1)CCS2	ZINC000191516747	402675427	/nfs/dbraw/zinc/67/54/27/402675427.db2.gz	RMHVPVIZBNFHBM-SMDDNHRTSA-N	0	3	306.431	2.443	10	0		DEAEHN
CCCC[C@@H](COC)N[C@H]1CCCN(c2cc(C)nn2C)C1=O	ZINC000182352507	402682876	/nfs/dbraw/zinc/68/28/76/402682876.db2.gz	YFPDIUCHTSEGOU-GJZGRUSLSA-N	0	3	322.453	2.019	10	0		DEAEHN
Cc1cccc(OCCNC(=O)N2CC[C@@H](N3CC=CC3)C2)c1	ZINC000173228202	402688732	/nfs/dbraw/zinc/68/87/32/402688732.db2.gz	CJTHQKGAYHXQAZ-MRXNPFEDSA-N	0	3	315.417	2.030	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCc3c(cccc3OC)C2)C1	ZINC000182584578	402701078	/nfs/dbraw/zinc/70/10/78/402701078.db2.gz	CAIMQHQNQFXMFW-HNNXBMFYSA-N	0	3	317.433	2.247	10	0		DEAEHN
Cc1cc(N2CC[C@@H](N3CCCC(C)(C)CC3)C2=O)n(C)n1	ZINC000173532383	402702059	/nfs/dbraw/zinc/70/20/59/402702059.db2.gz	CWVPKUDMLMJQRI-CQSZACIVSA-N	0	3	304.438	2.346	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)C[C@@H](C)C1	ZINC000262505513	402726687	/nfs/dbraw/zinc/72/66/87/402726687.db2.gz	MJPZHEXSLXUCCA-BJXUOIJQSA-N	0	3	308.466	2.460	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1ccc(N2CCCC2)cc1)[C@H]1CCCO1	ZINC000183115898	402740159	/nfs/dbraw/zinc/74/01/59/402740159.db2.gz	OTEPQIISQWGXBA-RHSMWYFYSA-N	0	3	317.433	2.382	10	0		DEAEHN
CCCCNC(=O)[C@H](C)N[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000192622364	402741330	/nfs/dbraw/zinc/74/13/30/402741330.db2.gz	OJFLHIJTDYFIIQ-KBPBESRZSA-N	0	3	315.421	2.223	10	0		DEAEHN
CCCC[C@@H](CC)CNC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000192803970	402750886	/nfs/dbraw/zinc/75/08/86/402750886.db2.gz	ZFLUPXFLMJVLKC-HZPDHXFCSA-N	0	3	313.486	2.349	10	0		DEAEHN
COc1ccccc1N1CC[C@H](N[C@@H](C)c2ccnn2C)C1	ZINC000192952907	402758038	/nfs/dbraw/zinc/75/80/38/402758038.db2.gz	BVWNHYRVIXVGBL-KBPBESRZSA-N	0	3	300.406	2.358	10	0		DEAEHN
Cn1cc(CN2CCC[C@@H](Cn3cncn3)C2)c(C(C)(C)C)n1	ZINC000183406967	402764330	/nfs/dbraw/zinc/76/43/30/402764330.db2.gz	CGXMJKBSYHGFCX-CQSZACIVSA-N	0	3	316.453	2.221	10	0		DEAEHN
CN(CC(=O)NC(C)(C)C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000174948873	402765311	/nfs/dbraw/zinc/76/53/11/402765311.db2.gz	CXAGFFSDZYSOEP-KRWDZBQOSA-N	0	3	317.477	2.498	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)CSCc1ccncc1	ZINC000174972119	402768138	/nfs/dbraw/zinc/76/81/38/402768138.db2.gz	NLQXNEHEVKVIIQ-JKSUJKDBSA-N	0	3	319.474	2.400	10	0		DEAEHN
COC(=O)c1cccc(NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000175012282	402771314	/nfs/dbraw/zinc/77/13/14/402771314.db2.gz	GLEQNUSPFDQZLF-DOMZBBRYSA-N	0	3	319.405	2.420	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cnn(C(C)(C)C)c1	ZINC000175013215	402771403	/nfs/dbraw/zinc/77/14/03/402771403.db2.gz	CASOFIADTFVKAN-HUUCEWRRSA-N	0	3	304.438	2.337	10	0		DEAEHN
COC[C@H](NC[C@H](C)CS(C)(=O)=O)c1ccc(Cl)cc1	ZINC000193677641	402775525	/nfs/dbraw/zinc/77/55/25/402775525.db2.gz	OUBOCTUXUDMSDM-FZMZJTMJSA-N	0	3	319.854	2.298	10	0		DEAEHN
C[C@@H](NCC(=O)NC(C)(C)C)c1cccc(-n2cccn2)c1	ZINC000183575078	402777802	/nfs/dbraw/zinc/77/78/02/402777802.db2.gz	PXNVUTJKVDJJSA-CYBMUJFWSA-N	0	3	300.406	2.438	10	0		DEAEHN
COc1cccc(OC)c1C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000175104736	402779806	/nfs/dbraw/zinc/77/98/06/402779806.db2.gz	QUGAXLBULRNIMJ-STQMWFEESA-N	0	3	306.406	2.259	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)NCc1cccc(Cl)c1	ZINC000175357334	402799588	/nfs/dbraw/zinc/79/95/88/402799588.db2.gz	FCXHLCMVOCOSMM-MRXNPFEDSA-N	0	3	323.868	2.372	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)N(C)Cc1ccccc1C	ZINC000175361872	402800215	/nfs/dbraw/zinc/80/02/15/402800215.db2.gz	TYNWCTIXAOHBLS-SFHVURJKSA-N	0	3	317.477	2.370	10	0		DEAEHN
COc1ccc(CCCC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000194524413	402801272	/nfs/dbraw/zinc/80/12/72/402801272.db2.gz	ALTQFNZXSSJVBE-INIZCTEOSA-N	0	3	302.418	2.325	10	0		DEAEHN
O=C(c1csc(-c2ccccn2)n1)N1CCN2CCC[C@@H]2C1	ZINC000194524499	402801531	/nfs/dbraw/zinc/80/15/31/402801531.db2.gz	PCWVTYJFKWFHML-GFCCVEGCSA-N	0	3	314.414	2.125	10	0		DEAEHN
COc1cccc2cc([C@@H](C)NC[C@@H]3CN(C)CCO3)oc21	ZINC000175424498	402805963	/nfs/dbraw/zinc/80/59/63/402805963.db2.gz	BXRBPTORODVYKP-TZMCWYRMSA-N	0	3	304.390	2.423	10	0		DEAEHN
CC1(C)CCC(NC(=O)NC[C@H](O)CN2CCCCC2)CC1	ZINC000175446782	402807135	/nfs/dbraw/zinc/80/71/35/402807135.db2.gz	OPHAKQVOLHXXIB-HNNXBMFYSA-N	0	3	311.470	2.101	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)Cc1cccc(C(F)(F)F)c1	ZINC000194733920	402813868	/nfs/dbraw/zinc/81/38/68/402813868.db2.gz	CYJOHHQXRZKCED-ZDUSSCGKSA-N	0	3	300.324	2.458	10	0		DEAEHN
Cc1nc2ccccc2n1CC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000194919865	402822672	/nfs/dbraw/zinc/82/26/72/402822672.db2.gz	GNPPUDAKYPXRDV-HNNXBMFYSA-N	0	3	316.449	2.437	10	0		DEAEHN
COc1ccc2c(c1)CCN2C(=O)NCCN1CCC(C)CC1	ZINC000195137699	402833499	/nfs/dbraw/zinc/83/34/99/402833499.db2.gz	PEDBZADNWKLBEZ-UHFFFAOYSA-N	0	3	317.433	2.499	10	0		DEAEHN
CCN1CCN(C[C@H](C)CNC(=O)N2CCCC(C)(C)C2)CC1	ZINC000175818504	402835171	/nfs/dbraw/zinc/83/51/71/402835171.db2.gz	CKHIYJMMBIYBBM-MRXNPFEDSA-N	0	3	324.513	2.092	10	0		DEAEHN
Cc1cccc(O[C@H](C)CNC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000176048398	402850081	/nfs/dbraw/zinc/85/00/81/402850081.db2.gz	DSQSSRUKKTZDLD-HZPDHXFCSA-N	0	3	317.433	2.252	10	0		DEAEHN
Brc1ccc2c(c1)[C@H](NCCn1cncn1)CC2	ZINC000282793733	403159898	/nfs/dbraw/zinc/15/98/98/403159898.db2.gz	QTAKQNHCCJRKDE-CYBMUJFWSA-N	0	3	307.195	2.318	10	0		DEAEHN
CC(=O)c1cc(C(=O)NCCN2[C@@H](C)CCC[C@@H]2C)n(C)c1	ZINC000343164486	403484250	/nfs/dbraw/zinc/48/42/50/403484250.db2.gz	LAMZOHRIKQPCHE-STQMWFEESA-N	0	3	305.422	2.220	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)C12CCC2	ZINC000175670496	286347179	/nfs/dbraw/zinc/34/71/79/286347179.db2.gz	HREUFLGZELPWDJ-LVQVYYBASA-N	0	3	323.481	2.458	10	0		DEAEHN
C[C@@H](N[C@H]1CCc2nnnn2CC1)c1nc2c(s1)CCCC2	ZINC000333681688	403814129	/nfs/dbraw/zinc/81/41/29/403814129.db2.gz	FGNZGXYUKUVHEV-MNOVXSKESA-N	0	3	318.450	2.064	10	0		DEAEHN
CO[C@@H]1COC[C@H]1n1cc(CN[C@@H]2CCC(C)(C)C[C@@H]2C)nn1	ZINC000329545250	404371766	/nfs/dbraw/zinc/37/17/66/404371766.db2.gz	ZHAUQEALZOAGBA-LCGIIJARSA-N	0	3	322.453	2.169	10	0		DEAEHN
Cc1nn(-c2ccncc2)cc1CN1CCC([C@@H](C)O)CC1	ZINC000329764853	404445249	/nfs/dbraw/zinc/44/52/49/404445249.db2.gz	WGQAKTQESIAUKA-CQSZACIVSA-N	0	3	300.406	2.169	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@H]1COc2ccccc2C1	ZINC000291994555	404618020	/nfs/dbraw/zinc/61/80/20/404618020.db2.gz	UGVSXDHFRWFOPX-QGZVFWFLSA-N	0	3	320.396	2.420	10	0		DEAEHN
CCOC(=O)[C@@]1(C(C)C)CCN(C[C@H](O)CC(F)(F)F)C1	ZINC000373914250	404637343	/nfs/dbraw/zinc/63/73/43/404637343.db2.gz	XZNAUWDBBRKMLC-YPMHNXCESA-N	0	3	311.344	2.211	10	0		DEAEHN
O=C(CN1CCCC[C@H](CO)C1)N(Cc1ccccc1)C1CC1	ZINC000374038019	404676180	/nfs/dbraw/zinc/67/61/80/404676180.db2.gz	MNUADBWCSMYHNT-KRWDZBQOSA-N	0	3	316.445	2.272	10	0		DEAEHN
CCOC(=O)[C@@H]1CN([C@H](C)c2ccc(F)cc2)CC12COC2	ZINC000451141764	404878823	/nfs/dbraw/zinc/87/88/23/404878823.db2.gz	VZYSQZPURXZUNX-DOMZBBRYSA-N	0	3	307.365	2.398	10	0		DEAEHN
C[C@@H]1OCC[C@]1(O)CNCc1ccsc1Br	ZINC000388965557	405036194	/nfs/dbraw/zinc/03/61/94/405036194.db2.gz	HMPTUXSSCSHHNH-KWQFWETISA-N	0	3	306.225	2.140	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)c2ccc(F)cc2Br)C1	ZINC000389991150	405043345	/nfs/dbraw/zinc/04/33/45/405043345.db2.gz	NIVQXKYBGKTIFC-SNVBAGLBSA-N	0	3	315.186	2.412	10	0		DEAEHN
C[C@H]1CCOCCN1C[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000367460163	405056198	/nfs/dbraw/zinc/05/61/98/405056198.db2.gz	YYGYOZSLWUJJDX-HKUYNNGSSA-N	0	3	318.461	2.388	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)CCN2CCOCC[C@@H]2C)cc1	ZINC000367660569	405117526	/nfs/dbraw/zinc/11/75/26/405117526.db2.gz	IRDZYVNOBKIJNT-ZDUSSCGKSA-N	0	3	304.390	2.329	10	0		DEAEHN
C[C@H](C(=O)NCCNc1ccncc1)c1ccc(F)c(F)c1	ZINC000439069964	405264755	/nfs/dbraw/zinc/26/47/55/405264755.db2.gz	VLMKLAAIASJBIK-NSHDSACASA-N	0	3	305.328	2.114	10	0		DEAEHN
COCCOc1ccccc1CN[C@@H](C)C1(OC)CCOCC1	ZINC000453069408	405281237	/nfs/dbraw/zinc/28/12/37/405281237.db2.gz	NZKIYVAPVGQLGS-HNNXBMFYSA-N	0	3	323.433	2.386	10	0		DEAEHN
CN(C)CC(C)(C)NC(=O)Nc1ccc(N2CCCC2)nc1	ZINC000454372631	405337105	/nfs/dbraw/zinc/33/71/05/405337105.db2.gz	ZOASSMWHVAMPKI-UHFFFAOYSA-N	0	3	305.426	2.144	10	0		DEAEHN
c1ccc(CN2CCCO[C@@H](CN3CC[C@@]34CCOC4)C2)cc1	ZINC000421016985	405430918	/nfs/dbraw/zinc/43/09/18/405430918.db2.gz	JPVFPBBLGWESEE-MOPGFXCFSA-N	0	3	316.445	2.142	10	0		DEAEHN
CO[C@@H](C)[C@@H](C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000577790833	405513759	/nfs/dbraw/zinc/51/37/59/405513759.db2.gz	SRNSHNBTYMQRQL-VYDXJSESSA-N	0	3	319.449	2.374	10	0		DEAEHN
CCN1CCN(CC(C)(C)NC(=O)Cc2ccsc2C)CC1	ZINC000456883548	405605235	/nfs/dbraw/zinc/60/52/35/405605235.db2.gz	QMRZWGZZWCIKIY-UHFFFAOYSA-N	0	3	323.506	2.131	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNCCC[C@@H]1CCOC1	ZINC000449692079	405696035	/nfs/dbraw/zinc/69/60/35/405696035.db2.gz	ZYRVFJPJERJRBH-MRXNPFEDSA-N	0	3	300.406	2.233	10	0		DEAEHN
Cc1oncc1CN(C)C[C@@H]1CCCN(C)[C@H]1c1cncn1C	ZINC000583620186	405777983	/nfs/dbraw/zinc/77/79/83/405777983.db2.gz	RZOYKLBBXKOKHS-WMLDXEAASA-N	0	3	317.437	2.231	10	0		DEAEHN
CCN(Cc1cnnn1CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000459397330	405886951	/nfs/dbraw/zinc/88/69/51/405886951.db2.gz	HFYYMMFLVRYGRW-QGZVFWFLSA-N	0	3	313.449	2.394	10	0		DEAEHN
OCC[C@@H]1CSCCN1CCc1nc(-c2ccccc2)no1	ZINC000531840939	406014009	/nfs/dbraw/zinc/01/40/09/406014009.db2.gz	GIPPYCWOVKKEMC-CQSZACIVSA-N	0	3	319.430	2.079	10	0		DEAEHN
c1nc(CN[C@@H](C2CC2)[C@@H]2CCCCO2)cc2c1OCCO2	ZINC000639297285	406028570	/nfs/dbraw/zinc/02/85/70/406028570.db2.gz	RHMYQBJMDLVJLR-YOEHRIQHSA-N	0	3	304.390	2.290	10	0		DEAEHN
CN(Cc1ccncc1Br)[C@H]1CN2CCC1CC2	ZINC000639392468	406079411	/nfs/dbraw/zinc/07/94/11/406079411.db2.gz	HMKFXOUJPVFLTF-AWEZNQCLSA-N	0	3	310.239	2.370	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(CCCN1CCCC1=O)CC2	ZINC000533767516	406162079	/nfs/dbraw/zinc/16/20/79/406162079.db2.gz	NQHVBUFMSGDOFS-UHFFFAOYSA-N	0	3	314.429	2.302	10	0		DEAEHN
CO[C@@H]1CC[C@H](NC(=O)Nc2cccc(OCCN(C)C)c2)C1	ZINC000472339898	406138200	/nfs/dbraw/zinc/13/82/00/406138200.db2.gz	MNJJYAODFPRELQ-LSDHHAIUSA-N	0	3	321.421	2.316	10	0		DEAEHN
O=C1C[C@H]2CC[C@@H](CN1)N2Cc1ccc(OCC2CC2)cc1	ZINC000483279231	406178364	/nfs/dbraw/zinc/17/83/64/406178364.db2.gz	LITSEOBWIAMNQP-CVEARBPZSA-N	0	3	300.402	2.328	10	0		DEAEHN
Cn1ncc(Br)c1CNC1(CCO)CCCCC1	ZINC000487339771	406224596	/nfs/dbraw/zinc/22/45/96/406224596.db2.gz	YTOVVKVJJIOERP-UHFFFAOYSA-N	0	3	316.243	2.358	10	0		DEAEHN
Cc1cc(C[C@H](C)NC(=O)NC[C@H](C)N2CCCC[C@@H]2C)[nH]n1	ZINC000487549256	406244896	/nfs/dbraw/zinc/24/48/96/406244896.db2.gz	HJAXNIBVERYZHM-QEJZJMRPSA-N	0	3	321.469	2.211	10	0		DEAEHN
c1nc2nc(N3C[C@H]4CCC[C@@H](C3)N4)cc(-c3ccccc3)n2n1	ZINC000634807551	406293594	/nfs/dbraw/zinc/29/35/94/406293594.db2.gz	SAYRGQRHPKTNBA-GASCZTMLSA-N	0	3	320.400	2.122	10	0		DEAEHN
CC(C)N(Cc1ccccc1)C(=O)CN1CC[C@@H](CO)[C@@H]1C	ZINC000488730807	406341819	/nfs/dbraw/zinc/34/18/19/406341819.db2.gz	HYNZTFJCAXAWPC-RDJZCZTQSA-N	0	3	304.434	2.126	10	0		DEAEHN
CCNC(=O)N1CC[C@H](NCc2c[nH]nc2-c2ccsc2)C1	ZINC000548034292	406470169	/nfs/dbraw/zinc/47/01/69/406470169.db2.gz	UKRYHAMDUYLNOP-ZDUSSCGKSA-N	0	3	319.434	2.032	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NCCC1CCCC1	ZINC000637925123	406480536	/nfs/dbraw/zinc/48/05/36/406480536.db2.gz	IEHRQGJBAPMYBC-KRWDZBQOSA-N	0	3	303.450	2.142	10	0		DEAEHN
C[C@H](N(C)C(=O)[C@@H](N)CN(C)Cc1ccccc1)C(C)(C)C	ZINC000637930079	406482730	/nfs/dbraw/zinc/48/27/30/406482730.db2.gz	SMPKFAVUQMMTBJ-HOCLYGCPSA-N	0	3	305.466	2.339	10	0		DEAEHN
COC[C@@]1(C(=O)NCc2ccc(Cl)s2)CCCCN1	ZINC000637932262	406483851	/nfs/dbraw/zinc/48/38/51/406483851.db2.gz	ZKZHGEDAEALOFU-CYBMUJFWSA-N	0	3	302.827	2.176	10	0		DEAEHN
c1c(CN2CCC[C@H]2C2CCCC2)nnn1C[C@H]1CCOC1	ZINC000637966289	406500461	/nfs/dbraw/zinc/50/04/61/406500461.db2.gz	XDWKADJCVXUOIR-PBHICJAKSA-N	0	3	304.438	2.469	10	0		DEAEHN
C[C@H]1Cc2ccccc2N1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637868527	406454271	/nfs/dbraw/zinc/45/42/71/406454271.db2.gz	OMMGWNQODDUFKC-MAUKXSAKSA-N	0	3	323.440	2.424	10	0		DEAEHN
CC(C)CC[C@H](C)NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637873533	406456856	/nfs/dbraw/zinc/45/68/56/406456856.db2.gz	PCMHLDDPPSNJNF-RDJZCZTQSA-N	0	3	305.466	2.387	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CCC[C@H]1C1CCC1	ZINC000637968962	406501967	/nfs/dbraw/zinc/50/19/67/406501967.db2.gz	CUMCNYZDJKZNHD-ROUUACIJSA-N	0	3	315.461	2.237	10	0		DEAEHN
C[C@H](C1CC1)N(Cc1ccccc1)C(=O)[C@H]1CNCCOC1	ZINC000643617667	407017580	/nfs/dbraw/zinc/01/75/80/407017580.db2.gz	LXLLJQIRVFKGMW-PBHICJAKSA-N	0	3	302.418	2.050	10	0		DEAEHN
CCCNc1cc(C)ncc1C(=O)N[C@@H](C)CC[S@](C)=O	ZINC000129660310	196065753	/nfs/dbraw/zinc/06/57/53/196065753.db2.gz	KSJNVKTVAKJDSL-WIUDPPPLSA-N	0	3	311.451	2.099	10	0		DEAEHN
C[C@H](N[C@H]1CCc2ccccc2C1)C(=O)NCC(F)(F)F	ZINC000130503549	196086606	/nfs/dbraw/zinc/08/66/06/196086606.db2.gz	QSBMEDHYRJRALH-GWCFXTLKSA-N	0	3	300.324	2.201	10	0		DEAEHN
CCN[C@H](Cc1nccn1C)c1ccc(Br)cn1	ZINC000130871890	196118564	/nfs/dbraw/zinc/11/85/64/196118564.db2.gz	TWYPRTQPQBPRPC-GFCCVEGCSA-N	0	3	309.211	2.471	10	0		DEAEHN
c1[nH]nc2cc(CN3CCCC[C@H]3CN3CCOCC3)ccc12	ZINC000130977630	196128932	/nfs/dbraw/zinc/12/89/32/196128932.db2.gz	RYZCOTWWPQCEEV-KRWDZBQOSA-N	0	3	314.433	2.250	10	0		DEAEHN
Brc1cccc(Cc2ncc3c(n2)CCNC3)c1	ZINC000131085955	196138561	/nfs/dbraw/zinc/13/85/61/196138561.db2.gz	QWFHWFQAPVYOMM-UHFFFAOYSA-N	0	3	304.191	2.476	10	0		DEAEHN
CCN[C@H](C)c1c(CC)nn([C@@H]2CCS(=O)(=O)C2)c1CC	ZINC000131105899	196140242	/nfs/dbraw/zinc/14/02/42/196140242.db2.gz	SSFOZFNQEVSOCG-VXGBXAGGSA-N	0	3	313.467	2.038	10	0		DEAEHN
CCCNc1nc(Cl)nc(N[C@H](CN(C)C)C(C)C)n1	ZINC000131125914	196142030	/nfs/dbraw/zinc/14/20/30/196142030.db2.gz	UCCXONQEYWLFLU-SNVBAGLBSA-N	0	3	300.838	2.345	10	0		DEAEHN
O=S1(=O)CCC[C@H](NC2=NCC3(CCCCC3)CS2)C1	ZINC000131154340	196144903	/nfs/dbraw/zinc/14/49/03/196144903.db2.gz	UJYZNDUMEDOAQL-LBPRGKRZSA-N	0	3	316.492	2.207	10	0		DEAEHN
C[C@@H](CN1CCCC1)NC(=O)c1sc2cccnc2c1N	ZINC000132212690	196236271	/nfs/dbraw/zinc/23/62/71/196236271.db2.gz	WKIKZVAXNLXFIF-JTQLQIEISA-N	0	3	304.419	2.093	10	0		DEAEHN
NC1(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)CCOCC1	ZINC000132224938	196237423	/nfs/dbraw/zinc/23/74/23/196237423.db2.gz	OBXYHUZRDHUBOX-UHFFFAOYSA-N	0	3	306.259	2.291	10	0		DEAEHN
Nc1ccncc1CC(=O)c1cc(Br)ccc1N	ZINC000132814017	196286356	/nfs/dbraw/zinc/28/63/56/196286356.db2.gz	HDWVDOQPPPYRLE-UHFFFAOYSA-N	0	3	306.163	2.434	10	0		DEAEHN
N[C@@H]1COC[C@H]1c1nc(-c2ccc(Cl)c(Cl)c2)no1	ZINC000133030583	196306315	/nfs/dbraw/zinc/30/63/15/196306315.db2.gz	RUZUPNXYCANEDH-GMSGAONNSA-N	0	3	300.145	2.485	10	0		DEAEHN
CN1C(=O)C[C@@H](N)[C@H]1c1ccc(Cl)c(Br)c1	ZINC000137255843	196570371	/nfs/dbraw/zinc/57/03/71/196570371.db2.gz	HSWWSBMMOZEASC-MWLCHTKSSA-N	0	3	303.587	2.333	10	0		DEAEHN
C[C@H](NCCO[C@H]1CCCCO1)c1ccc(-n2ccnn2)cc1	ZINC000193092393	225151101	/nfs/dbraw/zinc/15/11/01/225151101.db2.gz	JGASNIBBUVLYOB-YOEHRIQHSA-N	0	3	316.405	2.461	10	0		DEAEHN
Cc1ccc(Cl)cc1NC(=O)Cn1cc(C(C)(C)N)nn1	ZINC000070117900	424842091	/nfs/dbraw/zinc/84/20/91/424842091.db2.gz	PFXQYPVYZABOJY-UHFFFAOYSA-N	0	3	307.785	2.072	10	0		DEAEHN
O[C@@H](CN1CCC[C@H](Cn2cncn2)C1)c1ccccc1Cl	ZINC000105884120	424849430	/nfs/dbraw/zinc/84/94/30/424849430.db2.gz	JWCRISOCQRMDCM-BBRMVZONSA-N	0	3	320.824	2.377	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)Nc2ccc(C)c(F)c2)c1	ZINC000105881486	424849457	/nfs/dbraw/zinc/84/94/57/424849457.db2.gz	GIDUOWUCPCXFDI-CYBMUJFWSA-N	0	3	304.369	2.256	10	0		DEAEHN
Cc1cc(CN[C@H]2CN(C(C)C)C[C@H]2C)ccc1S(C)(=O)=O	ZINC000108104917	424851180	/nfs/dbraw/zinc/85/11/80/424851180.db2.gz	BYVQXGCEJBHBSS-ZBFHGGJFSA-N	0	3	324.490	2.217	10	0		DEAEHN
Cc1ccc(CNCC[C@@]2(O)CCOC2)c(Br)c1	ZINC000404212359	424925898	/nfs/dbraw/zinc/92/58/98/424925898.db2.gz	QTUAUABOWTYBNW-CQSZACIVSA-N	0	3	314.223	2.389	10	0		DEAEHN
O[C@]1(CCNCc2ccc(Br)c(F)c2)CCOC1	ZINC000404208125	424925977	/nfs/dbraw/zinc/92/59/77/424925977.db2.gz	OHBWZAASKFDHBV-CYBMUJFWSA-N	0	3	318.186	2.219	10	0		DEAEHN
NCc1cc(-c2cccc(I)c2)ncn1	ZINC000409436619	424935177	/nfs/dbraw/zinc/93/51/77/424935177.db2.gz	NQHLNPMEIITAIE-UHFFFAOYSA-N	0	3	311.126	2.207	10	0		DEAEHN
Brc1ccc2c(c1)ncnc2NCCN1CCCC1	ZINC000450223769	425065691	/nfs/dbraw/zinc/06/56/91/425065691.db2.gz	PNBXVXYJYZIACN-UHFFFAOYSA-N	0	3	321.222	2.900	10	0		DEAEHN
CN1C[C@@H](CNCc2ccc(Br)cc2F)CC1=O	ZINC000657695004	425387560	/nfs/dbraw/zinc/38/75/60/425387560.db2.gz	SXQASJHBKAMXGI-SECBINFHSA-N	0	3	315.186	2.156	10	0		DEAEHN
C[C@H](NC(=O)N1CCC[C@@H]1CN1CCCCC1)c1csnn1	ZINC000334119643	269021458	/nfs/dbraw/zinc/02/14/58/269021458.db2.gz	KFEPXNKOOPXDGH-QWHCGFSZSA-N	0	3	323.466	2.259	10	0		DEAEHN
C[C@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1csnn1	ZINC000334132162	269023677	/nfs/dbraw/zinc/02/36/77/269023677.db2.gz	VFQPMHIRPRUDQN-LBPRGKRZSA-N	0	3	323.466	2.259	10	0		DEAEHN
CCN1CCCN(C(=O)c2cccc(CN3CCCC3)c2)CC1	ZINC000363398551	269055760	/nfs/dbraw/zinc/05/57/60/269055760.db2.gz	LDQNYQUVHISRFO-UHFFFAOYSA-N	0	3	315.461	2.450	10	0		DEAEHN
Cc1cnc(NCC2(O)CCN(Cc3ccccc3)CC2)nc1	ZINC000397583082	269107020	/nfs/dbraw/zinc/10/70/20/269107020.db2.gz	HUACIOCJNSRQCH-UHFFFAOYSA-N	0	3	312.417	2.224	10	0		DEAEHN
C[C@@H]1CN(C[C@@H](O)c2ccc(Cl)cc2)C[C@H]1N1CCOCC1	ZINC000246563784	274350000	/nfs/dbraw/zinc/35/00/00/274350000.db2.gz	UYLYWNJUQYJLOX-KBRIMQKVSA-N	0	3	324.852	2.026	10	0		DEAEHN
Brc1cccc2c1CC[C@@H]2NCCn1cncn1	ZINC000271732106	275373934	/nfs/dbraw/zinc/37/39/34/275373934.db2.gz	CJMAHJVMVACONT-ZDUSSCGKSA-N	0	3	307.195	2.318	10	0		DEAEHN
CC(C)c1nnc2n1C[C@H](N[C@H]1CCCc3c1cnn3C)CC2	ZINC000180506897	275777267	/nfs/dbraw/zinc/77/72/67/275777267.db2.gz	NNFUEIRAUQAEDG-OCCSQVGLSA-N	0	3	314.437	2.117	10	0		DEAEHN
CCC(CC)(CC(=O)OC)NCC(=O)Nc1nc(C)cs1	ZINC000440900927	275953652	/nfs/dbraw/zinc/95/36/52/275953652.db2.gz	XLPJUIYXONLJDH-UHFFFAOYSA-N	0	3	313.423	2.102	10	0		DEAEHN
CCN(CC)Cc1cccc(NC(=O)[C@@H]2CSC(=O)N2)c1	ZINC000154953639	276110633	/nfs/dbraw/zinc/11/06/33/276110633.db2.gz	CCQLGEVJRLPLFH-ZDUSSCGKSA-N	0	3	307.419	2.292	10	0		DEAEHN
CCN1CCC[C@H](N[C@H](C)c2cnc3cc(C)nn3c2C)C1	ZINC000249614577	276179256	/nfs/dbraw/zinc/17/92/56/276179256.db2.gz	PULRBHDLZPJKTQ-HIFRSBDPSA-N	0	3	301.438	2.481	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NC[C@@H](OC)c1ccccc1	ZINC000245430254	276180182	/nfs/dbraw/zinc/18/01/82/276180182.db2.gz	ZPKYARBVLAAQPS-DLBZAZTESA-N	0	3	319.449	2.500	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H]1CCC[C@H]2OCC[C@H]21	ZINC000247476650	276369984	/nfs/dbraw/zinc/36/99/84/276369984.db2.gz	QRAHPYPTIHYENE-QKPAOTATSA-N	0	3	309.454	2.070	10	0		DEAEHN
CC(=O)[C@@H]1C[C@H](C(=O)NC2C[C@H]3CCC[C@@H](C2)N3C)C1(C)C	ZINC000154669406	277096122	/nfs/dbraw/zinc/09/61/22/277096122.db2.gz	GCACMOATHBVAIW-GWONACJQSA-N	0	3	306.450	2.369	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)c2nc3cccnc3s2)C1	ZINC000248757929	277181669	/nfs/dbraw/zinc/18/16/69/277181669.db2.gz	XGDIBWNFCCMIRJ-AAEUAGOBSA-N	0	3	316.430	2.248	10	0		DEAEHN
CS[C@@H](C)CNC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000122972671	278141369	/nfs/dbraw/zinc/14/13/69/278141369.db2.gz	WKTNGXCPWNJRTG-ZFWWWQNUSA-N	0	3	309.479	2.210	10	0		DEAEHN
CC[C@H](NCCc1nc(C)no1)c1ccc2c(c1)OCCO2	ZINC000089518341	288042562	/nfs/dbraw/zinc/04/25/62/288042562.db2.gz	HXJXTCLOTRACAX-ZDUSSCGKSA-N	0	3	303.362	2.433	10	0		DEAEHN
C[C@@H]1CN(C(=O)C2(N)CCCC2)C[C@@H](c2ccc(F)cc2)O1	ZINC000237552489	278638671	/nfs/dbraw/zinc/63/86/71/278638671.db2.gz	LMZPAWHWNQNEIL-DOMZBBRYSA-N	0	3	306.381	2.386	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCCC[C@@H]2c2ncc[nH]2)C1	ZINC000106541544	279318770	/nfs/dbraw/zinc/31/87/70/279318770.db2.gz	LYZGZCZJTQQDPV-UONOGXRCSA-N	0	3	305.426	2.131	10	0		DEAEHN
O=C([C@H]1CSCCS1)N1CCCC[C@@H](N2CCCC2)C1	ZINC000107531318	280147818	/nfs/dbraw/zinc/14/78/18/280147818.db2.gz	FBMPDXFDVQMOBE-ZIAGYGMSSA-N	0	3	314.520	2.312	10	0		DEAEHN
CC(C)c1nnc2n1C[C@@H](N[C@H]1CCCc3c1cnn3C)CC2	ZINC000180506923	280732036	/nfs/dbraw/zinc/73/20/36/280732036.db2.gz	NNFUEIRAUQAEDG-JSGCOSHPSA-N	0	3	314.437	2.117	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)NCCC3CC3)cc2)CC1	ZINC000075179574	281560827	/nfs/dbraw/zinc/56/08/27/281560827.db2.gz	ZHNGABMXOIOLFE-UHFFFAOYSA-N	0	3	301.434	2.358	10	0		DEAEHN
CN1CCC(NC(=O)N2CC3(CCCC3)OC(C)(C)C2)CC1	ZINC000188173191	289884096	/nfs/dbraw/zinc/88/40/96/289884096.db2.gz	MNFJGCZJWVXYLP-UHFFFAOYSA-N	0	3	309.454	2.214	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)N2CCCc3ccccc32)c1	ZINC000105881083	293002849	/nfs/dbraw/zinc/00/28/49/293002849.db2.gz	JIWGDTKNVSIHBN-OAHLLOKOSA-N	0	3	312.417	2.149	10	0		DEAEHN
Cc1nnc([C@@H]2CCCCN2C(=O)CN2[C@H](C)CC[C@H]2C)[nH]1	ZINC000328703916	293361236	/nfs/dbraw/zinc/36/12/36/293361236.db2.gz	YCDVQXBSZSHOBP-BZPMIXESSA-N	0	3	305.426	2.040	10	0		DEAEHN
CC[C@H](C)n1ncc(C(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)c1C	ZINC000574690356	326177944	/nfs/dbraw/zinc/17/79/44/326177944.db2.gz	BSYGLMVMPYTGNM-MQIPJXDCSA-N	0	3	304.438	2.375	10	0		DEAEHN
Cc1cccc2c(N[C@@H](CO)CN3CCCCC3)ncnc12	ZINC000575092403	326217395	/nfs/dbraw/zinc/21/73/95/326217395.db2.gz	ILFLVIMPBGMURI-CQSZACIVSA-N	0	3	300.406	2.197	10	0		DEAEHN
C[C@H]1CC[C@@](CO)(N(C)CC(=O)NCc2ccc(Cl)cc2)C1	ZINC000187954642	533728856	/nfs/dbraw/zinc/72/88/56/533728856.db2.gz	RVPKWBAXLPJOEN-SUMWQHHRSA-N	0	3	324.852	2.439	10	0		DEAEHN
CC(=O)c1cccc(OCC(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000158864585	518450135	/nfs/dbraw/zinc/45/01/35/518450135.db2.gz	YBUSDHHVQCZTEV-GUYCJALGSA-N	0	3	318.417	2.113	10	0		DEAEHN
CC(C)Nc1ncccc1C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000247273651	519742534	/nfs/dbraw/zinc/74/25/34/519742534.db2.gz	KACQNKPWEAUPPE-DZGCQCFKSA-N	0	3	304.438	2.360	10	0		DEAEHN
CCO[C@@H]1C[C@](N)(C(=O)N[C@@H](CC)c2nccs2)C1(C)C	ZINC000229572100	520452687	/nfs/dbraw/zinc/45/26/87/520452687.db2.gz	NEUFZBRCMQEDNR-RWSFTLGLSA-N	0	3	311.451	2.243	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)NC[C@@H](O)c1ccc2ccccc2c1	ZINC000246243961	521835369	/nfs/dbraw/zinc/83/53/69/521835369.db2.gz	JBHYJZSNDJDMJC-JCURWCKSSA-N	0	3	300.402	2.363	10	0		DEAEHN
O=C(c1cc(-c2cccs2)on1)N1CCN2CCC[C@@H]2C1	ZINC000195325033	534656930	/nfs/dbraw/zinc/65/69/30/534656930.db2.gz	JMINPPOTACHSOR-LLVKDONJSA-N	0	3	303.387	2.323	10	0		DEAEHN
CC(C(=O)N1CC[C@@H](C)[C@H]1c1cccc(F)c1)S(C)(=O)=O	ZINC000245408755	524134863	/nfs/dbraw/zinc/13/48/63/524134863.db2.gz	ITNBQYGJNZRPES-SUNKGSAMSA-N	0	3	313.394	2.168	10	0		DEAEHN
CC(=O)c1cc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c(C)nc1C	ZINC000362761133	534806025	/nfs/dbraw/zinc/80/60/25/534806025.db2.gz	VPSXILKFKCHSMN-NHYWBVRUSA-N	0	3	317.433	2.456	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)CSCc2ccncc2)CCN1C	ZINC000127504157	524787558	/nfs/dbraw/zinc/78/75/58/524787558.db2.gz	YZHTWVFGSRGBKW-ZFWWWQNUSA-N	0	3	307.463	2.256	10	0		DEAEHN
Cc1cc(F)cc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000249194108	524941683	/nfs/dbraw/zinc/94/16/83/524941683.db2.gz	PWGHNLVGHVQMKV-WFASDCNBSA-N	0	3	321.396	2.014	10	0		DEAEHN
C/C=C/C[C@H](NC(=O)[C@H](C)N1[C@H](C)CC[C@H]1C)C(=O)OCC	ZINC000444309630	526295221	/nfs/dbraw/zinc/29/52/21/526295221.db2.gz	AQZXKOYQBULULT-HRYQKYCXSA-N	0	3	310.438	2.262	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@@H](C)NC[C@H](C)CS(C)(=O)=O	ZINC000157618943	527585355	/nfs/dbraw/zinc/58/53/55/527585355.db2.gz	FRJZWPDWQZBYJH-NWDGAFQWSA-N	0	3	315.483	2.278	10	0		DEAEHN
CC(C)c1nc(N[C@@H]2CN(C(C)C)C[C@@H]2C)nc(N(C)C)n1	ZINC000301968657	528296027	/nfs/dbraw/zinc/29/60/27/528296027.db2.gz	PSWMWQOOYDIJRK-QWHCGFSZSA-N	0	3	306.458	2.202	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)COc1ccc(F)cc1F	ZINC000176987781	535544852	/nfs/dbraw/zinc/54/48/52/535544852.db2.gz	JYSDUBLVWBMYHO-CYBMUJFWSA-N	0	3	312.360	2.286	10	0		DEAEHN
CCc1cccc(S(=O)(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1	ZINC000247340107	535909489	/nfs/dbraw/zinc/90/94/89/535909489.db2.gz	HNYOXOLNUBYNCH-DOTOQJQBSA-N	0	3	322.474	2.354	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)NC[C@H]1[C@@H]2c3ccccc3C[C@H]12	ZINC000248589526	536365247	/nfs/dbraw/zinc/36/52/47/536365247.db2.gz	XWPQMWIPMODHRM-KZNAEPCWSA-N	0	3	313.445	2.308	10	0		DEAEHN
COc1ccc(F)cc1[C@H](C)NC(=O)N1CCN2CCC[C@H]2C1	ZINC000247486337	536636559	/nfs/dbraw/zinc/63/65/59/536636559.db2.gz	KTQGKJOAIFYJED-JSGCOSHPSA-N	0	3	321.396	2.385	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COc2cccc3[nH]ccc32)CC[C@@H]1C	ZINC000251704503	536731200	/nfs/dbraw/zinc/73/12/00/536731200.db2.gz	KDLWMIYWDJLIIU-SUNYJGFJSA-N	0	3	318.417	2.264	10	0		DEAEHN
CC(C)[C@H](NCc1ccc(F)c(Br)c1)C(N)=O	ZINC000107322880	563566832	/nfs/dbraw/zinc/56/68/32/563566832.db2.gz	COXCDXJJAWOWNS-NSHDSACASA-N	0	3	303.175	2.188	10	0		DEAEHN
CN(CCN1CCCC2(C1)OCCO2)Cc1ccc(F)cc1	ZINC000160892365	624145490	/nfs/dbraw/zinc/14/54/90/624145490.db2.gz	YWFOZVCFDGUNCU-UHFFFAOYSA-N	0	3	308.397	2.096	10	0		DEAEHN
CCc1ccccc1-c1noc(CN2CCCC[C@H](N)C2=O)n1	ZINC000888078469	625059176	/nfs/dbraw/zinc/05/91/76/625059176.db2.gz	UXMCOLZYDJQPJC-AWEZNQCLSA-N	0	3	314.389	2.139	10	0		DEAEHN
CNC(=O)[C@H](NCc1ccc2c(c1)COC(C)(C)O2)C(C)C	ZINC000186399616	634202634	/nfs/dbraw/zinc/20/26/34/634202634.db2.gz	GXBOESIZEOZAMR-OAHLLOKOSA-N	0	3	306.406	2.192	10	0		DEAEHN
CCN(C[C@@H]1CCN(C/C=C(\C)C(=O)OC)C1)CC(F)(F)F	ZINC000748825828	638596105	/nfs/dbraw/zinc/59/61/05/638596105.db2.gz	ZHAFJWWACVXBKR-YFTXEMMHSA-N	0	3	322.371	2.312	10	0		DEAEHN
COCC[C@@H](N)C(=O)Nc1cccc(Br)c1C	ZINC000232211177	646796264	/nfs/dbraw/zinc/79/62/64/646796264.db2.gz	QQDLSMXENYEESX-SNVBAGLBSA-N	0	3	301.184	2.060	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCc1nc2cc(F)ccc2n1C	ZINC000732108631	647542632	/nfs/dbraw/zinc/54/26/32/647542632.db2.gz	ACZQWWYRSSXQOU-HNNXBMFYSA-N	0	3	318.396	2.203	10	0		DEAEHN
CCN(CC)C(=O)[C@H]1CCCN1Cc1cc(OC)ccc1O	ZINC000179864500	648428605	/nfs/dbraw/zinc/42/86/05/648428605.db2.gz	GBXCWZQNVLNJSR-OAHLLOKOSA-N	0	3	306.406	2.234	10	0		DEAEHN
C[C@H]([NH2+]CCCOC(=O)N=C(N)[O-])C12CC3CC(CC(C3)C1)C2	ZINC000183642199	649126084	/nfs/dbraw/zinc/12/60/84/649126084.db2.gz	XPHFROVYNRSZRU-GVMDUPDNSA-N	0	3	323.437	2.376	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2ccc(C(C)(C)O)cc2)C1	ZINC000184678479	649344437	/nfs/dbraw/zinc/34/44/37/649344437.db2.gz	HUZLSLDEFCXZDO-MRXNPFEDSA-N	0	3	319.449	2.198	10	0		DEAEHN
C#CCCCCCOC(=O)C1CC[C@@H](C(F)(F)F)NC1=O	ZINC000185336019	649499157	/nfs/dbraw/zinc/49/91/57/649499157.db2.gz	YHLXXEGQTOHREW-QWRGUYRKSA-N	0	3	305.296	2.180	10	0		DEAEHN
CC(C)c1cnc(CN2CCC(CN3CCOCC3)CC2)o1	ZINC000733309316	649540509	/nfs/dbraw/zinc/54/05/09/649540509.db2.gz	JMMJRIQURVLHNP-UHFFFAOYSA-N	0	3	307.438	2.342	10	0		DEAEHN
COC(=O)/C(C)=C\CN1CCN(Cc2ccccc2)C[C@H]1C	ZINC000382562592	685404596	/nfs/dbraw/zinc/40/45/96/685404596.db2.gz	XVJTYQSVYFSUEL-QOBZYLRHSA-N	0	3	302.418	2.312	10	0		DEAEHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@@H]1CCCO[C@@H]1C	ZINC000192197973	684444043	/nfs/dbraw/zinc/44/40/43/684444043.db2.gz	JTIFEBOVROEBMC-JHJVBQTASA-N	0	3	316.357	2.158	10	0		DEAEHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@H]1CCCO[C@@H]1C	ZINC000192197985	684444249	/nfs/dbraw/zinc/44/42/49/684444249.db2.gz	JTIFEBOVROEBMC-FRRDWIJNSA-N	0	3	316.357	2.158	10	0		DEAEHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCO[C@@H]2C)cc1	ZINC000192198688	684444464	/nfs/dbraw/zinc/44/44/64/684444464.db2.gz	AAGCBZHNUFUDSM-KCPJHIHWSA-N	0	3	316.357	2.158	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccc(-n2cc[nH]c2=S)cc1	ZINC000194696950	685074896	/nfs/dbraw/zinc/07/48/96/685074896.db2.gz	WRHRYRWDSJVQBK-AWEZNQCLSA-N	0	3	316.430	2.359	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(N)=O)CN1C[C@@H](O)c1ccc(F)cc1Cl	ZINC000248589995	685162804	/nfs/dbraw/zinc/16/28/04/685162804.db2.gz	ZDDXCSDIRRMEOC-GPCCPHFNSA-N	0	3	314.788	2.098	10	0		DEAEHN
C[C@](O)(CN1CC[C@]2(CCOC2)C1)C(F)(F)C(F)(F)F	ZINC000724109852	777242318	/nfs/dbraw/zinc/24/23/18/777242318.db2.gz	PQPRKSLQWITOLJ-UWVGGRQHSA-N	0	3	303.271	2.047	10	0		DEAEHN
C[C@@H]1C[C@@H](CNCc2cn(C)nc2Br)C[C@H](C)O1	ZINC000724264453	777269553	/nfs/dbraw/zinc/26/95/53/777269553.db2.gz	JSPUOIVUZNBPQE-JGPRNRPPSA-N	0	3	316.243	2.476	10	0		DEAEHN
Cc1noc([C@H]2CN(C[C@H]3CCc4ccccc43)CCN2C)n1	ZINC000606442342	779353166	/nfs/dbraw/zinc/35/31/66/779353166.db2.gz	FSBTUSQUQVSORH-NVXWUHKLSA-N	0	3	312.417	2.397	10	0		DEAEHN
CO[C@@]1(CN[C@@H](C)c2ccc(Cl)cc2)CCS(=O)(=O)C1	ZINC000721258572	781017052	/nfs/dbraw/zinc/01/70/52/781017052.db2.gz	IDZPMQYSCJXICF-SMDDNHRTSA-N	0	3	317.838	2.194	10	0		DEAEHN
CC1(C)C[NH2+]C[C@H]1[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000721893059	781582666	/nfs/dbraw/zinc/58/26/66/781582666.db2.gz	WLLWKOPYYMLJON-SNVBAGLBSA-N	0	3	323.245	2.270	10	0		DEAEHN
C[C@H](N[C@@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C)c1cn(C)nn1	ZINC000715858050	792527553	/nfs/dbraw/zinc/52/75/53/792527553.db2.gz	VQGZSZCLYBTAGN-YNEHKIRRSA-N	0	3	323.441	2.159	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](NCc2cncnc2)C12CCC2	ZINC000404634140	802026332	/nfs/dbraw/zinc/02/63/32/802026332.db2.gz	HKHSFWOURHNZKR-ZIAGYGMSSA-N	0	3	318.421	2.402	10	0		DEAEHN
CS[C@H](CO)[C@H](C)NCc1ccc(Br)nc1	ZINC000309928582	802213800	/nfs/dbraw/zinc/21/38/00/802213800.db2.gz	WSGBIVJUQPXPNM-WCBMZHEXSA-N	0	3	305.241	2.046	10	0		DEAEHN
CCN(C(C)=O)c1nc(CNC[C@@H]2CCCCN2C)cs1	ZINC000044561265	1078341565	/nfs/dbraw/zinc/34/15/65/1078341565.db2.gz	QFKQLIZOGOOZAB-AWEZNQCLSA-N	0	3	310.467	2.090	10	0		DEAEHN
CC(C)[C@@H]1C[C@@H](NCc2cn(C)nc2Br)CCO1	ZINC000720661161	1085821165	/nfs/dbraw/zinc/82/11/65/1085821165.db2.gz	QZIZVPUMQPWEQO-RYUDHWBXSA-N	0	3	316.243	2.476	10	0		DEAEHN
COc1cncc(CN[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)c1	ZINC000700056113	1086307901	/nfs/dbraw/zinc/30/79/01/1086307901.db2.gz	JQDOCQPVCRRZHB-RYUDHWBXSA-N	0	3	309.410	2.482	10	0		DEAEHN
C[C@H]1O[C@@H](C)[C@H](C)[C@H]1NCCS(=O)(=O)C1CCCCC1	ZINC000701028033	1086347542	/nfs/dbraw/zinc/34/75/42/1086347542.db2.gz	VWIRHCTXLJWJFB-RMRHIDDWSA-N	0	3	303.468	2.135	10	0		DEAEHN
C[C@H](NC(=O)[C@@H](N)CN(C)C)c1ccc(Cl)cc1Cl	ZINC000702389462	1086426045	/nfs/dbraw/zinc/42/60/45/1086426045.db2.gz	XZNCCBIJOAJNRL-UFBFGSQYSA-N	0	3	304.221	2.060	10	0		DEAEHN
CO[C@@](C)(CNc1cc(C)nc(N)n1)COCc1ccccc1	ZINC000702945260	1086473282	/nfs/dbraw/zinc/47/32/82/1086473282.db2.gz	FYVRJPACDQWEBR-KRWDZBQOSA-N	0	3	316.405	2.401	10	0		DEAEHN
C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)[C@@H](N)CN(C)C	ZINC000705405603	1086615642	/nfs/dbraw/zinc/61/56/42/1086615642.db2.gz	MRKKICPSJLYLFC-ZANVPECISA-N	0	3	318.248	2.402	10	0		DEAEHN
O=S(=O)([N-][C@@]12CCC[C@H]1[NH2+]CC2)c1cccc(Cl)c1F	ZINC000711639411	1087175833	/nfs/dbraw/zinc/17/58/33/1087175833.db2.gz	LHBRCCJAHSWESE-DGCLKSJQSA-N	0	3	318.801	2.042	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC(CNCc2nccn2C2CC2)C1	ZINC000711822293	1087203753	/nfs/dbraw/zinc/20/37/53/1087203753.db2.gz	VYGSQKKYOCPOLA-UHFFFAOYSA-N	0	3	306.410	2.175	10	0		DEAEHN
C[C@H]1[C@H](NC(=O)c2ccc(F)cc2Br)CCN1C	ZINC000719387646	1089060848	/nfs/dbraw/zinc/06/08/48/1089060848.db2.gz	KYWAZBSTGXRJNV-QPUJVOFHSA-N	0	3	315.186	2.411	10	0		DEAEHN
CCCCc1ncc([C@@H]2C[C@H]3CN(C)C(=O)[C@]34CCCN24)[nH]1	ZINC000095501927	185374980	/nfs/dbraw/zinc/37/49/80/185374980.db2.gz	INDSBXAWOODIMY-JDFRZJQESA-N	0	3	302.422	2.120	10	0		DEAEHN
CCN[C@H](CC)[C@H](C)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000081935458	192342934	/nfs/dbraw/zinc/34/29/34/192342934.db2.gz	JXJKRZJZAPGQPN-WCQYABFASA-N	0	3	313.419	2.008	10	0		DEAEHN
CN[C@@H](CS(=O)(=O)c1cccc(C(F)(F)F)c1)C1CC1	ZINC000081935678	192343067	/nfs/dbraw/zinc/34/30/67/192343067.db2.gz	UAMKHCUZNBUHNW-LBPRGKRZSA-N	0	3	307.337	2.477	10	0		DEAEHN
CCN[C@H](C)[C@@H](C)S(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000081936146	192343397	/nfs/dbraw/zinc/34/33/97/192343397.db2.gz	YYHVNYYOKMGJPU-VXGBXAGGSA-N	0	3	313.419	2.008	10	0		DEAEHN
CCN[C@H]1c2ccccc2CCC[C@@H]1S(=O)(=O)CCOC	ZINC000081944013	192343677	/nfs/dbraw/zinc/34/36/77/192343677.db2.gz	FGZSHDCRALHLBK-HOTGVXAUSA-N	0	3	311.447	2.103	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@@H](C)Oc1cccc(CO)c1	ZINC000152911917	282157253	/nfs/dbraw/zinc/15/72/53/282157253.db2.gz	JRIGINWMMVBJQW-GDBMZVCRSA-N	0	3	322.449	2.039	10	0		DEAEHN
C[C@@H]1CNCCN1c1cccc(I)c1	ZINC000083086703	185213016	/nfs/dbraw/zinc/21/30/16/185213016.db2.gz	WYUWVAIXTDPNRQ-SECBINFHSA-N	0	3	302.159	2.089	10	0		DEAEHN
CCn1cc([C@H]2OCCC[C@@H]2[NH2+]Cc2nc(C)ccc2[O-])cn1	ZINC000328653171	231290842	/nfs/dbraw/zinc/29/08/42/231290842.db2.gz	WUDWZPIJRWAYGS-WMLDXEAASA-N	0	3	316.405	2.322	10	0		DEAEHN
CC(C)[C@H](C[NH3+])[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000087404838	185224163	/nfs/dbraw/zinc/22/41/63/185224163.db2.gz	YXMRXYTWTNXHHU-VIFPVBQESA-N	0	3	311.234	2.255	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@H](C)C1CCCCC1	ZINC000173176494	282188344	/nfs/dbraw/zinc/18/83/44/282188344.db2.gz	PFIOVPABRRQVOW-ZBFHGGJFSA-N	0	3	311.470	2.365	10	0		DEAEHN
CC1(C)CCCN(S(=O)(=O)Cc2ccccc2CN)CC1	ZINC000087657296	185229701	/nfs/dbraw/zinc/22/97/01/185229701.db2.gz	WBWDVYLSKWWTQB-UHFFFAOYSA-N	0	3	310.463	2.487	10	0		DEAEHN
CC(C)(N)CS(=O)(=O)Cc1ccc(Br)cc1	ZINC000088072280	185238932	/nfs/dbraw/zinc/23/89/32/185238932.db2.gz	NAVGNYKMNDJIQO-UHFFFAOYSA-N	0	3	306.225	2.101	10	0		DEAEHN
C[C@@H]1CCC[C@H](C)N1C(=O)CN[C@H]1CCC(=O)N[C@@H]1C1CC1	ZINC000328919431	231387595	/nfs/dbraw/zinc/38/75/95/231387595.db2.gz	SLTWYJZKKOXZHY-GMIGKAJZSA-N	0	3	307.438	2.263	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@@H](Cc2ccccc2)C2CC2)C1	ZINC000154169299	282197577	/nfs/dbraw/zinc/19/75/77/282197577.db2.gz	FXTLHNAPFXKPBN-SJORKVTESA-N	0	3	301.434	2.353	10	0		DEAEHN
CC[C@@H](C)Oc1cccc(NS(=O)(=O)[C@@H](CC)CN)c1	ZINC000088473795	185252160	/nfs/dbraw/zinc/25/21/60/185252160.db2.gz	NMJPYDVJVFBFSN-RISCZKNCSA-N	0	3	300.424	2.343	10	0		DEAEHN
Cc1ccc2c(N)c(C(=O)NCCN(C)C3CC3)sc2n1	ZINC000088643308	185261184	/nfs/dbraw/zinc/26/11/84/185261184.db2.gz	DYFOUUNXBJOWRX-UHFFFAOYSA-N	0	3	304.419	2.011	10	0		DEAEHN
COCCCS(=O)(=O)[C@H]1C[C@H](c2ccccc2)CC[C@@H]1N	ZINC000081986032	192349452	/nfs/dbraw/zinc/34/94/52/192349452.db2.gz	DLTQWHAUQSTCQN-PMPSAXMXSA-N	0	3	311.447	2.101	10	0		DEAEHN
NC[C@@H](c1cc(Cl)ccc1Br)N1CCOCC1	ZINC000090251418	185288303	/nfs/dbraw/zinc/28/83/03/185288303.db2.gz	LIQJLRALHGJIEE-LBPRGKRZSA-N	0	3	319.630	2.435	10	0		DEAEHN
CC[C@H](NC[C@](C)(O)CO)c1cccc(Br)c1	ZINC000090284462	185289398	/nfs/dbraw/zinc/28/93/98/185289398.db2.gz	QONJQHUWRPGOTB-STQMWFEESA-N	0	3	302.212	2.233	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1ccc(CC(C)C)cc1	ZINC000090293189	185289786	/nfs/dbraw/zinc/28/97/86/185289786.db2.gz	BAHFBRLTFWYRLK-UHFFFAOYSA-N	0	3	310.463	2.258	10	0		DEAEHN
N[C@H]1COC[C@H]1c1nc(CSc2ccc(Cl)cc2)no1	ZINC000090365061	185292685	/nfs/dbraw/zinc/29/26/85/185292685.db2.gz	CTEPPMZYCDNDTI-MNOVXSKESA-N	0	3	311.794	2.456	10	0		DEAEHN
CN(Cc1ccccc1Br)[C@@H](CN)c1cncn1C	ZINC000090167508	185284722	/nfs/dbraw/zinc/28/47/22/185284722.db2.gz	BYQZYLJCYIZCPG-ZDUSSCGKSA-N	0	3	323.238	2.314	10	0		DEAEHN
CN[C@H]1COC[C@@H]1c1nc(Cc2ccc(F)cc2Cl)no1	ZINC000090423979	185295635	/nfs/dbraw/zinc/29/56/35/185295635.db2.gz	HZJRSJYYHBBCTP-JQWIXIFHSA-N	0	3	311.744	2.155	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1ccccc1SC(F)F	ZINC000090431540	185295937	/nfs/dbraw/zinc/29/59/37/185295937.db2.gz	WDXFWDIPHDYRFZ-WCBMZHEXSA-N	0	3	302.346	2.174	10	0		DEAEHN
N[C@@H](C[S@@](=O)c1ccc(F)cc1)c1ccc2c(c1)OCO2	ZINC000082003192	192353691	/nfs/dbraw/zinc/35/36/91/192353691.db2.gz	PSBLMGVTILAOBQ-ZSEKCTLFSA-N	0	3	307.346	2.362	10	0		DEAEHN
C[C@]1(C(=O)Nc2ccc(SC(F)F)cc2)COC[C@@H]1N	ZINC000090585414	185305252	/nfs/dbraw/zinc/30/52/52/185305252.db2.gz	IXXBDEMFALRKIZ-GWCFXTLKSA-N	0	3	302.346	2.304	10	0		DEAEHN
COC(=O)C1CCC(C(=O)NC[C@H](C)N2CCC(C)CC2)CC1	ZINC000179482293	282226750	/nfs/dbraw/zinc/22/67/50/282226750.db2.gz	PFTXDJFCNPWFRV-FHERZECASA-N	0	3	324.465	2.202	10	0		DEAEHN
C[C@@H](Oc1ccccc1)C(=O)N1CCCSC[C@@H]1CN(C)C	ZINC000090699925	185310646	/nfs/dbraw/zinc/31/06/46/185310646.db2.gz	LOAKKQBORCVDHK-CABCVRRESA-N	0	3	322.474	2.350	10	0		DEAEHN
Cc1cc(CNC2CCS(=O)(=O)CC2)c2ccccc2n1	ZINC000092345503	185313407	/nfs/dbraw/zinc/31/34/07/185313407.db2.gz	XAIWEQCZAINEIT-UHFFFAOYSA-N	0	3	304.415	2.210	10	0		DEAEHN
CCN1CCN(c2cccc(NC(=O)[C@@H](C)COC)c2)CC1	ZINC000184257722	282249741	/nfs/dbraw/zinc/24/97/41/282249741.db2.gz	KXNIFKFJEUGZNR-AWEZNQCLSA-N	0	3	305.422	2.050	10	0		DEAEHN
Cc1ccc(S(=O)(=O)NCC2C(C)(C)C2(C)C)cc1CN	ZINC000092833142	185345005	/nfs/dbraw/zinc/34/50/05/185345005.db2.gz	GBQPNJHBJWPEAW-UHFFFAOYSA-N	0	3	310.463	2.414	10	0		DEAEHN
COCCC[C@@H](C)C(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000181403973	199291833	/nfs/dbraw/zinc/29/18/33/199291833.db2.gz	XTFMNUHEARHJQS-NVXWUHKLSA-N	0	3	306.450	2.338	10	0		DEAEHN
CN(C)c1ccccc1CN1CCCC[C@H]1CN1CCOCC1	ZINC000075969143	282300413	/nfs/dbraw/zinc/30/04/13/282300413.db2.gz	WWWGCBVYCJSTJR-SFHVURJKSA-N	0	3	317.477	2.439	10	0		DEAEHN
COC(=O)CC1(CC(=O)N[C@H]2CCN(CC3CC3)C2)CCCC1	ZINC000615565841	362642193	/nfs/dbraw/zinc/64/21/93/362642193.db2.gz	FLDAJPHXWRLRSQ-HNNXBMFYSA-N	0	3	322.449	2.101	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCC(C)(C)c2ccncc2)C1	ZINC000129164655	539488897	/nfs/dbraw/zinc/48/88/97/539488897.db2.gz	RLCPRXNNXQNXEK-HNNXBMFYSA-N	0	3	304.438	2.143	10	0		DEAEHN
COC(=O)C(C)(C)[C@H]1CCCN(C[C@H](O)CC(F)(F)F)C1	ZINC000615794712	362704394	/nfs/dbraw/zinc/70/43/94/362704394.db2.gz	PCOMMJZSQACRJX-WDEREUQCSA-N	0	3	311.344	2.211	10	0		DEAEHN
CC(C)(N)c1cn(Cc2cc(Br)cs2)nn1	ZINC000069679777	190805236	/nfs/dbraw/zinc/80/52/36/190805236.db2.gz	PLNIHPMYPOMOJX-UHFFFAOYSA-N	0	3	301.213	2.344	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)NC[C@@H]1CCCN1CC	ZINC000159000715	539580326	/nfs/dbraw/zinc/58/03/26/539580326.db2.gz	LARCDFBIHITYKT-ZDUSSCGKSA-N	0	3	310.467	2.201	10	0		DEAEHN
CCNCc1cc(Br)cnc1O[C@H](C)COC	ZINC000070209003	190871994	/nfs/dbraw/zinc/87/19/94/190871994.db2.gz	HVDVBOCQPGQTGT-SECBINFHSA-N	0	3	303.200	2.367	10	0		DEAEHN
CCN1CCO[C@@H](CNCc2cc(Cl)cc3c2OCC3)C1	ZINC000167387678	539612163	/nfs/dbraw/zinc/61/21/63/539612163.db2.gz	IICBFFNEAPNQEI-HNNXBMFYSA-N	0	3	310.825	2.085	10	0		DEAEHN
Cc1ccc([C@H](C)NC[C@@H](O)COC2CCOCC2)cc1F	ZINC000181343608	539651106	/nfs/dbraw/zinc/65/11/06/539651106.db2.gz	ZJUWBXGYVHNVPA-DZGCQCFKSA-N	0	3	311.397	2.341	10	0		DEAEHN
Cc1cccc(OCCCNC(=O)CN[C@@H](C)[C@H]2CCCO2)c1	ZINC000183197328	539660505	/nfs/dbraw/zinc/66/05/05/539660505.db2.gz	VCENULKSKXABJG-DOTOQJQBSA-N	0	3	320.433	2.037	10	0		DEAEHN
CN[C@H](c1cccc2c1OC(C)(C)C2)[C@H]1CCS(=O)(=O)C1	ZINC000080507493	192164256	/nfs/dbraw/zinc/16/42/56/192164256.db2.gz	YZLNFPCBGVIACZ-JSGCOSHPSA-N	0	3	309.431	2.095	10	0		DEAEHN
O=C([C@H]1C[C@H](F)CN1)N1CCC(OCc2ccc(F)cc2)CC1	ZINC000188992657	539685464	/nfs/dbraw/zinc/68/54/64/539685464.db2.gz	ZKWVBWZWQXHOOL-GOEBONIOSA-N	0	3	324.371	2.033	10	0		DEAEHN
Cc1sc(Br)cc1[C@@H](N)[C@@H]1CCS(=O)(=O)C1	ZINC000084006094	192395639	/nfs/dbraw/zinc/39/56/39/192395639.db2.gz	UKWKGDRVTCVDFX-XCBNKYQSSA-N	0	3	324.265	2.254	10	0		DEAEHN
CCCN[C@H](C[S@@](=O)CCOC)c1cc(C)ccc1OC	ZINC000084036268	192396711	/nfs/dbraw/zinc/39/67/11/192396711.db2.gz	GMGWRWOTMQSXRY-QVKFZJNVSA-N	0	3	313.463	2.439	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccc(C(=O)OCC)cc1)N(C)C	ZINC000138406455	186016484	/nfs/dbraw/zinc/01/64/84/186016484.db2.gz	XGBCZDDMOPWHEU-OAHLLOKOSA-N	0	3	306.406	2.210	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N(C)[C@@H](C)C(C)C)c1	ZINC000138521725	186017648	/nfs/dbraw/zinc/01/76/48/186017648.db2.gz	BIHUCVPVQULCSE-JTQLQIEISA-N	0	3	320.405	2.349	10	0		DEAEHN
NCC1(c2nc(-c3ncccc3Br)no2)CCC1	ZINC000139864170	186024325	/nfs/dbraw/zinc/02/43/25/186024325.db2.gz	PZXSBDOBVFOZPB-UHFFFAOYSA-N	0	3	309.167	2.275	10	0		DEAEHN
Cc1ccc([C@H]2NC3(CCCC3)C(=O)N2CCN(C)C)s1	ZINC000140014778	186025225	/nfs/dbraw/zinc/02/52/25/186025225.db2.gz	PSPYFUSWPOFPFT-AWEZNQCLSA-N	0	3	307.463	2.361	10	0		DEAEHN
CCCn1ncnc1C[C@H](N)c1ncccc1Br	ZINC000140363745	186026840	/nfs/dbraw/zinc/02/68/40/186026840.db2.gz	QILVMKLAHXPJAW-JTQLQIEISA-N	0	3	310.199	2.088	10	0		DEAEHN
Cc1cnc(NN)nc1OCc1cccc(Br)c1	ZINC000147821036	186041849	/nfs/dbraw/zinc/04/18/49/186041849.db2.gz	JDPQXGKNQIMOSI-UHFFFAOYSA-N	0	3	309.167	2.412	10	0		DEAEHN
Cn1ncc(Br)c1C(=O)C[C@@H](N)c1ccccc1	ZINC000164114546	186149198	/nfs/dbraw/zinc/14/91/98/186149198.db2.gz	BFAZTPVURNEVEE-LLVKDONJSA-N	0	3	308.179	2.455	10	0		DEAEHN
NCc1ccccc1NC(=O)C[S@](=O)c1ccc(F)cc1	ZINC000155918281	186122964	/nfs/dbraw/zinc/12/29/64/186122964.db2.gz	AADZKNXOXYCRLH-OAQYLSRUSA-N	0	3	306.362	2.031	10	0		DEAEHN
COc1cccc(CNC[C@@H](C)[S@](C)=O)c1OC(F)F	ZINC000159670381	186134166	/nfs/dbraw/zinc/13/41/66/186134166.db2.gz	WLTIDMRCPBQHMS-GSDQLPOLSA-N	0	3	307.362	2.153	10	0		DEAEHN
COCCCN1CCC(NC(=O)N(C)Cc2ccc(C)o2)CC1	ZINC000194254977	186273303	/nfs/dbraw/zinc/27/33/03/186273303.db2.gz	YOFLFQRIGIGXRK-UHFFFAOYSA-N	0	3	323.437	2.230	10	0		DEAEHN
CC(C)CO[C@@H](C)c1noc(CN2CCCN(C3CC3)CC2)n1	ZINC000080627705	192175489	/nfs/dbraw/zinc/17/54/89/192175489.db2.gz	IRFWFUXWUHUNLG-AWEZNQCLSA-N	0	3	322.453	2.473	10	0		DEAEHN
CN(C(=O)c1ncccc1N)[C@H]1CCN(Cc2ccccc2)C1	ZINC000309728847	539878470	/nfs/dbraw/zinc/87/84/70/539878470.db2.gz	QWAVZIWWZPLVGG-HNNXBMFYSA-N	0	3	310.401	2.010	10	0		DEAEHN
CCN(C(=O)c1cncc(Br)c1)[C@@H]1CCN(C)C1	ZINC000617561081	363189798	/nfs/dbraw/zinc/18/97/98/363189798.db2.gz	DMSAEYWKRVIJRO-GFCCVEGCSA-N	0	3	312.211	2.010	10	0		DEAEHN
COc1ccccc1CCNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000173425785	198213327	/nfs/dbraw/zinc/21/33/27/198213327.db2.gz	RWSHTTBZGBBIDG-HOCLYGCPSA-N	0	3	319.449	2.362	10	0		DEAEHN
O=C(NCCSc1ccccc1)N1CC[C@@H](N2CC=CC2)C1	ZINC000173501515	198221291	/nfs/dbraw/zinc/22/12/91/198221291.db2.gz	YCHIJQIQFCMPCN-OAHLLOKOSA-N	0	3	317.458	2.434	10	0		DEAEHN
Cc1sc(NC(=O)CN2CCN3CCC[C@@H]3C2)c(C)c1C	ZINC000173652277	198236355	/nfs/dbraw/zinc/23/63/55/198236355.db2.gz	ZUVJRLURHNIFAJ-CQSZACIVSA-N	0	3	307.463	2.392	10	0		DEAEHN
CSc1ccc(OCCN2CCN(C[C@@H](C)O)[C@@H](C)C2)cc1	ZINC000173675990	198238712	/nfs/dbraw/zinc/23/87/12/198238712.db2.gz	DIZMGQGRQCCEMY-LSDHHAIUSA-N	0	3	324.490	2.174	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N(C(=O)C(=O)Nc2cccc(CN(C)C)c2)C1	ZINC000173826816	198257724	/nfs/dbraw/zinc/25/77/24/198257724.db2.gz	COPGRAYMOZGOCO-ZIAGYGMSSA-N	0	3	317.433	2.334	10	0		DEAEHN
COc1ncc(C)cc1NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000174964629	198408607	/nfs/dbraw/zinc/40/86/07/198408607.db2.gz	QFBILLIQMZHTAG-CHWSQXEVSA-N	0	3	306.410	2.345	10	0		DEAEHN
C[C@@H](CNC[C@@H](O)c1ccccc1)NC(=O)Cc1ccccc1	ZINC000040504049	354169313	/nfs/dbraw/zinc/16/93/13/354169313.db2.gz	NMIXRSULZCHUEE-MAUKXSAKSA-N	0	3	312.413	2.057	10	0		DEAEHN
Cc1nnc([C@@H](C)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)o1	ZINC000069016743	354844648	/nfs/dbraw/zinc/84/46/48/354844648.db2.gz	HFPSEYRFWDXUQG-HZSPNIEDSA-N	0	3	322.453	2.260	10	0		DEAEHN
O[C@H](Cc1ccccc1C(F)(F)F)CN1CCCOCC1	ZINC000443624026	540184608	/nfs/dbraw/zinc/18/46/08/540184608.db2.gz	HUDMEDHNKRPFRH-CYBMUJFWSA-N	0	3	303.324	2.331	10	0		DEAEHN
CC1(C)O[C@H]2O[C@H](CN3CCC[C@H]3c3ccccc3)[C@@H](O)[C@@H]2O1	ZINC000106385025	355722025	/nfs/dbraw/zinc/72/20/25/355722025.db2.gz	FXRSTNMDEDRDHF-JZAWBGDQSA-N	0	3	319.401	2.061	10	0		DEAEHN
CC(=O)N1C[C@@H](CO)C2(C1)CCN(Cc1ccc(C)s1)CC2	ZINC000169751550	355980393	/nfs/dbraw/zinc/98/03/93/355980393.db2.gz	XERVCDIXDVZKKF-HNNXBMFYSA-N	0	3	322.474	2.109	10	0		DEAEHN
CCCc1cc(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)[nH]n1	ZINC000155329139	355947878	/nfs/dbraw/zinc/94/78/78/355947878.db2.gz	QWUKERJRNRBKFR-INIZCTEOSA-N	0	3	314.433	2.265	10	0		DEAEHN
CCC[C@@H](C)CN1CCN([C@H](C)C(=O)NC2CCCC2)CC1	ZINC000180046527	356041164	/nfs/dbraw/zinc/04/11/64/356041164.db2.gz	KMJRNHWBRONHDG-HZPDHXFCSA-N	0	3	309.498	2.488	10	0		DEAEHN
Cc1cccc(CNC(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)n1	ZINC000182419707	356125971	/nfs/dbraw/zinc/12/59/71/356125971.db2.gz	VILJLPLTPLSXRT-ZBFHGGJFSA-N	0	3	302.422	2.016	10	0		DEAEHN
CCS(=O)(=O)C[C@H](C)N[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000183050900	356157795	/nfs/dbraw/zinc/15/77/95/356157795.db2.gz	RLABPUUJUNVLGV-UONOGXRCSA-N	0	3	321.446	2.346	10	0		DEAEHN
CCS(=O)(=O)C[C@@H](C)N[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000183050885	356157959	/nfs/dbraw/zinc/15/79/59/356157959.db2.gz	RLABPUUJUNVLGV-ZIAGYGMSSA-N	0	3	321.446	2.346	10	0		DEAEHN
Cc1nn(C)c(C)c1CCCN[C@H](c1nccn1C)C1CC1	ZINC000183368368	356169456	/nfs/dbraw/zinc/16/94/56/356169456.db2.gz	QXGYRFOCUKAIJL-INIZCTEOSA-N	0	3	301.438	2.444	10	0		DEAEHN
C[C@H](C(=O)N1CCCCCC1)N(CC(N)=S)C1CCCC1	ZINC000080222357	192013541	/nfs/dbraw/zinc/01/35/41/192013541.db2.gz	YADYQHGQMGVOFU-CYBMUJFWSA-N	0	3	311.495	2.308	10	0		DEAEHN
O=C(CN1CCCC12CCC2)NCc1ccc2c(c1)OCO2	ZINC000373100988	283141213	/nfs/dbraw/zinc/14/12/13/283141213.db2.gz	USIBKNHWOLAZQG-UHFFFAOYSA-N	0	3	302.374	2.050	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@@H](C)NC(=O)CC2CCCCC2)C1	ZINC000195183578	356250683	/nfs/dbraw/zinc/25/06/83/356250683.db2.gz	IDTMJJLBBUEYRK-GDBMZVCRSA-N	0	3	323.481	2.062	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2cc(F)cc(F)c2)C1	ZINC000194557467	356241135	/nfs/dbraw/zinc/24/11/35/356241135.db2.gz	COPHQTVAVCSMOE-OAHLLOKOSA-N	0	3	311.376	2.291	10	0		DEAEHN
C[C@H]1CN[C@@H](C(=O)N(Cc2ccccc2)Cc2ccccc2)CN1	ZINC000307733902	356409127	/nfs/dbraw/zinc/40/91/27/356409127.db2.gz	UCAGOTDVYANPQO-QFBILLFUSA-N	0	3	323.440	2.165	10	0		DEAEHN
CN(Cc1nc2ccccc2n1C)C[C@H]1CCc2nccn2C1	ZINC000328625313	356462654	/nfs/dbraw/zinc/46/26/54/356462654.db2.gz	CYWZGNCTJLGYQB-CQSZACIVSA-N	0	3	309.417	2.464	10	0		DEAEHN
NC[C@@H](c1cccc(Cl)c1Cl)N1CCn2cnnc2C1	ZINC000081532937	192285377	/nfs/dbraw/zinc/28/53/77/192285377.db2.gz	HZGSFJRZHLBZLT-NSHDSACASA-N	0	3	312.204	2.101	10	0		DEAEHN
CCCNCc1c(Cl)cccc1N1CCn2cnnc2C1	ZINC000081537613	192286412	/nfs/dbraw/zinc/28/64/12/192286412.db2.gz	CFZAIODDSNBHLX-UHFFFAOYSA-N	0	3	305.813	2.451	10	0		DEAEHN
Brc1ccc(CN2CC[C@@H]3OCCN[C@@H]3C2)cc1	ZINC000404064901	356731785	/nfs/dbraw/zinc/73/17/85/356731785.db2.gz	JKBOJESEVASRLX-KGLIPLIRSA-N	0	3	311.223	2.012	10	0		DEAEHN
CC[C@]1(O)CCOC2(CCN(Cc3cnn(C)c3C)CC2)C1	ZINC000409419915	356736120	/nfs/dbraw/zinc/73/61/20/356736120.db2.gz	PXLUWGWFLBBYIA-INIZCTEOSA-N	0	3	307.438	2.015	10	0		DEAEHN
C(Cc1nc(C23CC4CC(CC(C4)C2)C3)no1)OC1CNC1	ZINC000579931287	357053937	/nfs/dbraw/zinc/05/39/37/357053937.db2.gz	BQOFKZSJAOCVPX-UHFFFAOYSA-N	0	3	303.406	2.068	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)c2ncsc2Br)CCN1C	ZINC000581962731	357276274	/nfs/dbraw/zinc/27/62/74/357276274.db2.gz	ACKCSGCTKLFMGE-HTQZYQBOSA-N	0	3	318.240	2.118	10	0		DEAEHN
CC[C@@H]1CN(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CCO1	ZINC000179268096	199007257	/nfs/dbraw/zinc/00/72/57/199007257.db2.gz	VJQGXCFAPMPSKQ-IXDOHACOSA-N	0	3	317.433	2.252	10	0		DEAEHN
Cc1nn(C)c2ncc(CN3CCC[C@H]3Cn3ccnc3)cc12	ZINC000179271574	199007770	/nfs/dbraw/zinc/00/77/70/199007770.db2.gz	RWWFHCINOZSBRE-HNNXBMFYSA-N	0	3	310.405	2.138	10	0		DEAEHN
CCOC(=O)C(C)(C)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179427815	199033395	/nfs/dbraw/zinc/03/33/95/199033395.db2.gz	YQLSAUMKCAANCG-HUUCEWRRSA-N	0	3	318.417	2.137	10	0		DEAEHN
CC[C@H](C)Oc1cc(CNC(=O)N2CC[C@@H](N(C)C)C2)ccn1	ZINC000180668293	199193424	/nfs/dbraw/zinc/19/34/24/199193424.db2.gz	ANORSKXMOMAEAU-DZGCQCFKSA-N	0	3	320.437	2.104	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)NC(CC)(CC)CC)nc1	ZINC000089049279	192720746	/nfs/dbraw/zinc/72/07/46/192720746.db2.gz	CIBHTYNWESWWKI-UHFFFAOYSA-N	0	3	313.467	2.438	10	0		DEAEHN
CC(=O)N1CC[C@H](NCC[C@H](C)[S@](C)=O)c2ccccc21	ZINC000598679101	359287712	/nfs/dbraw/zinc/28/77/12/359287712.db2.gz	XCXWCSCVYSTBIO-QOKQMOMRSA-N	0	3	308.447	2.231	10	0		DEAEHN
Cc1csc([C@H](C)CNC(=O)N2CC[C@H](N3CC=CC3)C2)n1	ZINC000186809602	200014272	/nfs/dbraw/zinc/01/42/72/200014272.db2.gz	IRJLPUOFCHHMEB-OCCSQVGLSA-N	0	3	320.462	2.211	10	0		DEAEHN
Cc1nc([C@H]2CCCN2C(=O)NC2CCN(C)CC2)cs1	ZINC000187033805	200050459	/nfs/dbraw/zinc/05/04/59/200050459.db2.gz	OCYUNLHCDJOEMN-CQSZACIVSA-N	0	3	308.451	2.392	10	0		DEAEHN
CCC[C@@H](C(=O)N(C)C[C@H]1COc2ccccc2O1)N(C)C	ZINC000179186697	283459788	/nfs/dbraw/zinc/45/97/88/283459788.db2.gz	DWOQHWYUQSWKSL-KBPBESRZSA-N	0	3	306.406	2.015	10	0		DEAEHN
Cc1cnccc1CNC(=O)c1ccccc1OCCN(C)C	ZINC000187437102	200112222	/nfs/dbraw/zinc/11/22/22/200112222.db2.gz	IKPJZIWGTXDYHV-UHFFFAOYSA-N	0	3	313.401	2.260	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000187889597	200172110	/nfs/dbraw/zinc/17/21/10/200172110.db2.gz	GAOGQMYHCVZMEZ-DOMZBBRYSA-N	0	3	323.412	2.458	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H]1COC2(CCC(C)CC2)O1)N(C)C	ZINC000180871395	283474115	/nfs/dbraw/zinc/47/41/15/283474115.db2.gz	KYJSIJLLIJMJCD-DGNOSDGRSA-N	0	3	312.454	2.155	10	0		DEAEHN
CO[C@@H](C)c1cccc(NC(=O)c2n[nH]c3c2CNCC3)c1	ZINC000188503347	200257031	/nfs/dbraw/zinc/25/70/31/200257031.db2.gz	BTMKZDORQLZOEW-JTQLQIEISA-N	0	3	300.362	2.015	10	0		DEAEHN
CC(=O)CC(C)(C)CC(=O)N1CCC(N2CCCOCC2)CC1	ZINC000627741572	366608532	/nfs/dbraw/zinc/60/85/32/366608532.db2.gz	NROCSGDYBFJZCI-UHFFFAOYSA-N	0	3	324.465	2.095	10	0		DEAEHN
C[C@H]1CC[NH2+]C[C@H]1[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000193403013	201045768	/nfs/dbraw/zinc/04/57/68/201045768.db2.gz	WDQGSBGYICKKPB-GZMMTYOYSA-N	0	3	323.245	2.270	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CCCc3cccnc32)CCN1C	ZINC000194450901	201229871	/nfs/dbraw/zinc/22/98/71/201229871.db2.gz	WDAUDRHNOZRJGQ-FVQBIDKESA-N	0	3	301.434	2.443	10	0		DEAEHN
COCC1(C)CN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000447880440	239150356	/nfs/dbraw/zinc/15/03/56/239150356.db2.gz	FOUKSYJGVCGEOB-UHFFFAOYSA-N	0	3	302.418	2.391	10	0		DEAEHN
c1nnn(-c2ccccc2)c1CNC[C@@H]1CCN1C1CCCC1	ZINC000623729201	365152055	/nfs/dbraw/zinc/15/20/55/365152055.db2.gz	SDVAMOJVCNVEQI-KRWDZBQOSA-N	0	3	311.433	2.374	10	0		DEAEHN
O[C@H]1COCC[C@H]1NCc1ccc(Br)c(Cl)c1	ZINC000623767227	365167143	/nfs/dbraw/zinc/16/71/43/365167143.db2.gz	SHTHVXJDZYQGFQ-NEPJUHHUSA-N	0	3	320.614	2.342	10	0		DEAEHN
CS(=O)(=O)CCC[C@@H](N)c1cc(F)cc(Br)c1	ZINC000091331500	193041546	/nfs/dbraw/zinc/04/15/46/193041546.db2.gz	MEXMMSCENLAOIK-LLVKDONJSA-N	0	3	324.215	2.413	10	0		DEAEHN
CN(Cc1ccc(Br)cc1)c1cncc(CN)n1	ZINC000091421018	193054346	/nfs/dbraw/zinc/05/43/46/193054346.db2.gz	BZIDXYHJPYMRDN-UHFFFAOYSA-N	0	3	307.195	2.334	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@@H]1O)c1cc(Br)cs1	ZINC000624238178	365347432	/nfs/dbraw/zinc/34/74/32/365347432.db2.gz	LWEYOMCZQINJLP-HGNGGELXSA-N	0	3	306.225	2.311	10	0		DEAEHN
Cn1ccnc1[C@H](NC[C@@H]1CCCO[C@H]1c1cn[nH]c1)C1CC1	ZINC000624241235	365348563	/nfs/dbraw/zinc/34/85/63/365348563.db2.gz	CKMPXTLIJUKZCF-NUEKZKHPSA-N	0	3	315.421	2.352	10	0		DEAEHN
CN[C@H](c1cc(Cl)ccc1OC)[C@@H]1CN2CCC[C@@H]2CO1	ZINC000091721309	193097356	/nfs/dbraw/zinc/09/73/56/193097356.db2.gz	RDSJSWZEAKLZAZ-UHOFOFEASA-N	0	3	310.825	2.472	10	0		DEAEHN
CCS(=O)(=O)CCOc1ccc(C)nc1CNC(C)(C)C	ZINC000091996254	193138592	/nfs/dbraw/zinc/13/85/92/193138592.db2.gz	ZMYPVTOYMFUJMY-UHFFFAOYSA-N	0	3	314.451	2.092	10	0		DEAEHN
CNCc1cc(Cl)cc(Cl)c1OC[C@H]1CN(C)CCO1	ZINC000092054311	193149523	/nfs/dbraw/zinc/14/95/23/193149523.db2.gz	TWYKIGFDORXHJP-GFCCVEGCSA-N	0	3	319.232	2.422	10	0		DEAEHN
COc1c(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)c(C)nn1C	ZINC000092066732	193152931	/nfs/dbraw/zinc/15/29/31/193152931.db2.gz	IPBXHHZBYLBSBH-PBHICJAKSA-N	0	3	318.465	2.186	10	0		DEAEHN
Cc1ccccc1[C@@H](C)N(C)C[C@H](O)CC1(O)CCOCC1	ZINC000630039923	367449648	/nfs/dbraw/zinc/44/96/48/367449648.db2.gz	ZKKCRMHUADQDMR-HZPDHXFCSA-N	0	3	307.434	2.280	10	0		DEAEHN
CCNCc1ccc(F)c(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)c1	ZINC000092113459	193161532	/nfs/dbraw/zinc/16/15/32/193161532.db2.gz	PLDXHFDLOIEUHN-RYUDHWBXSA-N	0	3	314.426	2.212	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)c(C)cc1C	ZINC000092113387	193161627	/nfs/dbraw/zinc/16/16/27/193161627.db2.gz	IYMDTPLVFLRMTM-KBPBESRZSA-N	0	3	310.463	2.299	10	0		DEAEHN
CC(C)NCc1ccc(S(=O)(=O)N(C)C2CC2)c(F)c1	ZINC000092115582	193163638	/nfs/dbraw/zinc/16/36/38/193163638.db2.gz	ZBTABVASEGKUPC-UHFFFAOYSA-N	0	3	300.399	2.107	10	0		DEAEHN
COCCN(CCO)Cc1cccc(OCc2ccccn2)c1	ZINC000093006258	193192622	/nfs/dbraw/zinc/19/26/22/193192622.db2.gz	FDHDNCHIOYOOKG-UHFFFAOYSA-N	0	3	316.401	2.101	10	0		DEAEHN
CC[C@H](C)CN(CC)S(=O)(=O)c1ccc(F)c(CN)c1	ZINC000093252451	193220620	/nfs/dbraw/zinc/22/06/20/193220620.db2.gz	YBWPVCVFSVOYRG-NSHDSACASA-N	0	3	302.415	2.341	10	0		DEAEHN
CC[C@H](C)CN(CC)S(=O)(=O)c1cc(CN)ccc1F	ZINC000093265744	193222474	/nfs/dbraw/zinc/22/24/74/193222474.db2.gz	HLIMGXDIJTXCLG-NSHDSACASA-N	0	3	302.415	2.341	10	0		DEAEHN
CN[C@@H](Cc1ccc(F)c(Br)c1)C(OC)OC	ZINC000093304905	193228038	/nfs/dbraw/zinc/22/80/38/193228038.db2.gz	WTDNWMKIEXKMLH-NSHDSACASA-N	0	3	306.175	2.338	10	0		DEAEHN
C[C@@H](Cc1cccs1)N(C)S(=O)(=O)c1ccccc1CN	ZINC000093294590	193226201	/nfs/dbraw/zinc/22/62/01/193226201.db2.gz	BJKOBZJTQXRHFF-LBPRGKRZSA-N	0	3	324.471	2.459	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1[C@H]1CCCN(C(C)C)C1=O	ZINC000248770244	284168488	/nfs/dbraw/zinc/16/84/88/284168488.db2.gz	SNOXGZGFXOLFEW-FZKCQIBNSA-N	0	3	322.449	2.192	10	0		DEAEHN
CN[C@]1(C(N)=O)CCC[C@@H](Sc2nc3ccccc3o2)C1	ZINC000093777942	193305266	/nfs/dbraw/zinc/30/52/66/193305266.db2.gz	MAYSBZNLYIKTBH-MEBBXXQBSA-N	0	3	305.403	2.306	10	0		DEAEHN
Cc1ccc2[nH]c(S[C@H]3CCC[C@](N)(C(N)=O)C3)nc2c1	ZINC000093779493	193305602	/nfs/dbraw/zinc/30/56/02/193305602.db2.gz	JYPRALNDSKZNAM-ZUZCIYMTSA-N	0	3	304.419	2.089	10	0		DEAEHN
Cc1ccc2nc(S[C@H]3CCC[C@](N)(C(N)=O)C3)[nH]c2c1	ZINC000093779493	193305604	/nfs/dbraw/zinc/30/56/04/193305604.db2.gz	JYPRALNDSKZNAM-ZUZCIYMTSA-N	0	3	304.419	2.089	10	0		DEAEHN
NC(=O)COC[C@H](N)c1ccc(Br)c2ccccc21	ZINC000093658369	193285246	/nfs/dbraw/zinc/28/52/46/193285246.db2.gz	MZALHMIXEOIHNC-ZDUSSCGKSA-N	0	3	323.190	2.104	10	0		DEAEHN
CN[C@@]1(C(N)=O)CC[C@@H](Sc2nc3ccccc3s2)C1	ZINC000093849280	193317480	/nfs/dbraw/zinc/31/74/80/193317480.db2.gz	WYQPCHNPQQETFG-OTYXRUKQSA-N	0	3	307.444	2.384	10	0		DEAEHN
NC(=O)[C@]1(N)CC[C@H](Sc2cccc(Br)c2)C1	ZINC000093852772	193318627	/nfs/dbraw/zinc/31/86/27/193318627.db2.gz	KAHMPLRQHCQHFP-JQWIXIFHSA-N	0	3	315.236	2.277	10	0		DEAEHN
CCN[C@]1(C(N)=O)CC[C@H](Sc2nc3ccccc3o2)C1	ZINC000093850869	193319070	/nfs/dbraw/zinc/31/90/70/193319070.db2.gz	ARWSKPXZFKUNCV-ZUZCIYMTSA-N	0	3	305.403	2.306	10	0		DEAEHN
NC(=O)[C@@]1(NC2CC2)CC[C@@H](Sc2ccc(Cl)cn2)C1	ZINC000093854037	193319622	/nfs/dbraw/zinc/31/96/22/193319622.db2.gz	KIAYUTZGLCQHDU-BXUZGUMPSA-N	0	3	311.838	2.356	10	0		DEAEHN
CC(C)NCc1cc2ccccc2nc1SC[C@@H](O)CO	ZINC000093960617	193332376	/nfs/dbraw/zinc/33/23/76/193332376.db2.gz	VDIZBUIWZCVTAN-AWEZNQCLSA-N	0	3	306.431	2.178	10	0		DEAEHN
CCN[C@@H](c1cc(C)c(F)cc1F)[C@@H]1CCS(=O)(=O)C1	ZINC000094077962	193344132	/nfs/dbraw/zinc/34/41/32/193344132.db2.gz	ZFQRTMAGRWTXCM-QMTHXVAHSA-N	0	3	303.374	2.359	10	0		DEAEHN
CC[C@@](C)(N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2	ZINC000094237028	193353485	/nfs/dbraw/zinc/35/34/85/193353485.db2.gz	YUDNWAZXDIKDAI-OAHLLOKOSA-N	0	3	310.419	2.479	10	0		DEAEHN
CCC(N)(CC)C(=O)Nc1cc2c(cc1Cl)NC(=O)CO2	ZINC000094243991	193354282	/nfs/dbraw/zinc/35/42/82/193354282.db2.gz	QCHUNHFSBBQDPN-UHFFFAOYSA-N	0	3	311.769	2.127	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@H](Oc2c(F)cc(CN)cc2F)C1	ZINC000094634586	193386642	/nfs/dbraw/zinc/38/66/42/193386642.db2.gz	DKCOEOZJIRZVCR-WDEREUQCSA-N	0	3	319.373	2.158	10	0		DEAEHN
CC[NH2+]C[C@@H](C)C(=O)Nc1cc(Br)ccc1[O-]	ZINC000094573596	193381417	/nfs/dbraw/zinc/38/14/17/193381417.db2.gz	IAGAVHZXZNKBQX-MRVPVSSYSA-N	0	3	301.184	2.339	10	0		DEAEHN
CCN1CCC[C@@H](Nc2nc3c(Br)cccn3n2)C1	ZINC000094603790	193383513	/nfs/dbraw/zinc/38/35/13/193383513.db2.gz	NWBBNHBJFOQLIS-SNVBAGLBSA-N	0	3	324.226	2.388	10	0		DEAEHN
CCS(=O)(=O)CCCOc1ccc(F)cc1[C@@H](C)NC	ZINC000094619391	193385382	/nfs/dbraw/zinc/38/53/82/193385382.db2.gz	RYCFLADAOSNGGH-LLVKDONJSA-N	0	3	303.399	2.310	10	0		DEAEHN
CC1(C)CCN(S(=O)(=O)c2cc(Cl)cc(CN)c2F)C1	ZINC000094814856	193399752	/nfs/dbraw/zinc/39/97/52/193399752.db2.gz	JEOSPJUORBAJNH-UHFFFAOYSA-N	0	3	320.817	2.358	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2CCC(C)(C)C2)cn1CC	ZINC000094814865	193399837	/nfs/dbraw/zinc/39/98/37/193399837.db2.gz	HKGCKSPWVUUQMG-UHFFFAOYSA-N	0	3	313.467	2.038	10	0		DEAEHN
CCn1ccnc1CNC1CCN(c2nc(C)cs2)CC1	ZINC000453294573	245062848	/nfs/dbraw/zinc/06/28/48/245062848.db2.gz	UHWUHHYRAXUFMD-UHFFFAOYSA-N	0	3	305.451	2.427	10	0		DEAEHN
O=C(Nc1ccc(Br)cc1)c1n[nH]c2c1CNCC2	ZINC000082807319	284297166	/nfs/dbraw/zinc/29/71/66/284297166.db2.gz	IQXHBHHKGQSRTA-UHFFFAOYSA-N	0	3	321.178	2.070	10	0		DEAEHN
CC[C@H](CO)N1CCN(c2ncnc3cc(Cl)ccc32)CC1	ZINC000266230626	205201831	/nfs/dbraw/zinc/20/18/31/205201831.db2.gz	UIBCFUCITYBEOB-CYBMUJFWSA-N	0	3	320.824	2.176	10	0		DEAEHN
COc1ccccc1N1CCN([C@H](CN)c2ccco2)CC1	ZINC000019795791	182151121	/nfs/dbraw/zinc/15/11/21/182151121.db2.gz	QOPSQUZULYZSTN-OAHLLOKOSA-N	0	3	301.390	2.110	10	0		DEAEHN
[NH3+]Cc1ccc(S(=O)(=O)[N-]c2ccc(F)c(F)c2F)cc1	ZINC000020014942	182178352	/nfs/dbraw/zinc/17/83/52/182178352.db2.gz	DJFCDMXHZNYXAJ-UHFFFAOYSA-N	0	3	316.304	2.363	10	0		DEAEHN
NC[C@H](c1ccc(Br)cc1)N1CCSCC1	ZINC000020257083	182200431	/nfs/dbraw/zinc/20/04/31/182200431.db2.gz	UXLABRDIVJMMIM-GFCCVEGCSA-N	0	3	301.253	2.498	10	0		DEAEHN
CCOCCCNCc1ccccc1OCC(=O)NC(C)(C)C	ZINC000020872402	182250851	/nfs/dbraw/zinc/25/08/51/182250851.db2.gz	NDGRTPOJMKKSBZ-UHFFFAOYSA-N	0	3	322.449	2.496	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)NCCOC)c1ccc(OC)cc1	ZINC000040654256	183114426	/nfs/dbraw/zinc/11/44/26/183114426.db2.gz	BQLKLNXHDXLUEB-MRXNPFEDSA-N	0	3	323.437	2.024	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)[C@@H]1C[C@@H](OC)CN1	ZINC000040634272	183111336	/nfs/dbraw/zinc/11/13/36/183111336.db2.gz	SPAPNYLKJMOGKM-YPMHNXCESA-N	0	3	312.797	2.444	10	0		DEAEHN
CCOC(=O)COC[C@H](N)c1ccc(Br)s1	ZINC000041044555	183159482	/nfs/dbraw/zinc/15/94/82/183159482.db2.gz	OJDCELDRMKGDPP-ZETCQYMHSA-N	0	3	308.197	2.090	10	0		DEAEHN
COCCCN(CCOC)[C@H](CN)c1c(F)cccc1Cl	ZINC000042421004	183267780	/nfs/dbraw/zinc/26/77/80/183267780.db2.gz	DXEHZPOVWSPIBF-CQSZACIVSA-N	0	3	318.820	2.464	10	0		DEAEHN
COCCN(CCOC)c1cc(Br)ccc1CN	ZINC000042442834	183271427	/nfs/dbraw/zinc/27/14/27/183271427.db2.gz	BWXSDURULJQOBE-UHFFFAOYSA-N	0	3	317.227	2.007	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccc(Cl)cc1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000042945267	183319754	/nfs/dbraw/zinc/31/97/54/183319754.db2.gz	YVUFUAKSUZBBDL-DFBGVHRSSA-N	0	3	309.841	2.281	10	0		DEAEHN
C[C@@H](N)[C@H](c1cccs1)N1CCN(c2nccs2)CC1	ZINC000043102889	183338304	/nfs/dbraw/zinc/33/83/04/183338304.db2.gz	MQXYXONKZSXHLG-DGCLKSJQSA-N	0	3	308.476	2.415	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(C)s1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043240622	183346156	/nfs/dbraw/zinc/34/61/56/183346156.db2.gz	NTLGGNCZQGRULR-GUTXKFCHSA-N	0	3	309.479	2.388	10	0		DEAEHN
CC[C@@H](N)[C@H](c1sccc1C)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043248011	183346763	/nfs/dbraw/zinc/34/67/63/183346763.db2.gz	CKTDYXVTKLAENH-MGPQQGTHSA-N	0	3	309.479	2.388	10	0		DEAEHN
CCNC(=O)CN(CC)[C@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043253638	183347784	/nfs/dbraw/zinc/34/77/84/183347784.db2.gz	OBYPZVGJGYDOAG-RNCFNFMXSA-N	0	3	303.859	2.248	10	0		DEAEHN
CC(C)NC(=O)CN(C)[C@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043254105	183347877	/nfs/dbraw/zinc/34/78/77/183347877.db2.gz	XXGCYRJZVQQAAJ-RNCFNFMXSA-N	0	3	303.859	2.246	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)s1)N1CCS(=O)CC1	ZINC000043253567	183347992	/nfs/dbraw/zinc/34/79/92/183347992.db2.gz	GLSFXWAZRITGFY-CABZTGNLSA-N	0	3	306.884	2.244	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccc(Br)s1)N(CCO)C1CC1	ZINC000043262755	183349160	/nfs/dbraw/zinc/34/91/60/183349160.db2.gz	HHBKVKQXDBDIJW-PRHODGIISA-N	0	3	319.268	2.356	10	0		DEAEHN
CN[C@@H](c1ccccc1C(F)(F)F)[C@@H]1CCS(=O)(=O)C1	ZINC000043300412	183352276	/nfs/dbraw/zinc/35/22/76/183352276.db2.gz	HQXKFGXZUQWNFW-BXKDBHETSA-N	0	3	307.337	2.401	10	0		DEAEHN
CN[C@@H](c1ccccc1Br)[C@H]1CCS(=O)(=O)C1	ZINC000043300419	183352419	/nfs/dbraw/zinc/35/24/19/183352419.db2.gz	MMIPAHJMZRJOBK-JOYOIKCWSA-N	0	3	318.236	2.144	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccco1)N1CCN(c2nccs2)CC1	ZINC000043334565	183356222	/nfs/dbraw/zinc/35/62/22/183356222.db2.gz	ORLQLYRPQCKOFA-JSGCOSHPSA-N	0	3	306.435	2.337	10	0		DEAEHN
CCN1CCC[C@H](Nc2nc3c(cc2C(N)=S)CCC3)C1	ZINC000043408859	183359785	/nfs/dbraw/zinc/35/97/85/183359785.db2.gz	YBQYJXITAKKDRI-LBPRGKRZSA-N	0	3	304.463	2.101	10	0		DEAEHN
CN[C@@H](CN(C)CC(F)(F)F)c1ccc2c(c1)OCCO2	ZINC000043900631	183389394	/nfs/dbraw/zinc/38/93/94/183389394.db2.gz	FZZWYIWURDMRHR-NSHDSACASA-N	0	3	304.312	2.212	10	0		DEAEHN
CCN1CCC(NC(=O)c2ccc3nc(N)sc3c2)CC1	ZINC000105739212	194123037	/nfs/dbraw/zinc/12/30/37/194123037.db2.gz	WUBDMUXHGNJIAT-UHFFFAOYSA-N	0	3	304.419	2.093	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)Cc2ccccc2)C[C@@H]1CC	ZINC000105838168	194144507	/nfs/dbraw/zinc/14/45/07/194144507.db2.gz	UABCTPMNXYBCIV-RBUKOAKNSA-N	0	3	320.477	2.023	10	0		DEAEHN
CC[C@H]1CN(Cc2cccc(NC(C)=O)c2)CCN1CCOC	ZINC000105837398	194144915	/nfs/dbraw/zinc/14/49/15/194144915.db2.gz	NYLJAFDZPNKRGH-SFHVURJKSA-N	0	3	319.449	2.188	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)NC[C@H](C)c2ccccc2)c1	ZINC000105881303	194156352	/nfs/dbraw/zinc/15/63/52/194156352.db2.gz	RKYRUBKPDPYUDK-JKSUJKDBSA-N	0	3	314.433	2.090	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCCC[C@@H]2c2ncc[nH]2)C1	ZINC000106541545	194227439	/nfs/dbraw/zinc/22/74/39/194227439.db2.gz	LYZGZCZJTQQDPV-ZIAGYGMSSA-N	0	3	305.426	2.131	10	0		DEAEHN
O=C1CCCN1C[C@H](O)CN[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000127987649	284791326	/nfs/dbraw/zinc/79/13/26/284791326.db2.gz	PMDHFXMTWKQMIT-WBVHZDCISA-N	0	3	322.836	2.364	10	0		DEAEHN
O=S(=O)(C[C@H]1CCC[NH2+]C1)[N-]c1ccc(Cl)c(F)c1	ZINC000049645435	183750930	/nfs/dbraw/zinc/75/09/30/183750930.db2.gz	WKZYCWCKHDSDGO-VIFPVBQESA-N	0	3	306.790	2.220	10	0		DEAEHN
C[C@@H](N)c1cc(Cl)ccc1OCC(=O)NCC(F)(F)F	ZINC000050209499	183777508	/nfs/dbraw/zinc/77/75/08/183777508.db2.gz	JEPAYMLCHYDZTD-SSDOTTSWSA-N	0	3	310.703	2.417	10	0		DEAEHN
C[C@@H](C(N)=S)N1CCN(c2ccc3ccccc3n2)CC1	ZINC000109471117	194267462	/nfs/dbraw/zinc/26/74/62/194267462.db2.gz	PRORYEFZHFUCML-LBPRGKRZSA-N	0	3	300.431	2.031	10	0		DEAEHN
O=c1[nH]c(CNCC2CCOCC2)nc2cc(Cl)ccc21	ZINC000111162733	194397185	/nfs/dbraw/zinc/39/71/85/194397185.db2.gz	JFEIDNOPBISMIQ-UHFFFAOYSA-N	0	3	307.781	2.093	10	0		DEAEHN
COCCC[C@@H](N)C(=O)N1CCc2sccc2[C@H]1C1CC1	ZINC000159304891	197344045	/nfs/dbraw/zinc/34/40/45/197344045.db2.gz	PQVPJUIFZQQFKN-UKRRQHHQSA-N	0	3	308.447	2.338	10	0		DEAEHN
Cc1ccc(OCc2nc3c(c(N4CCNCC4)n2)CCC3)cc1	ZINC000057328739	184033506	/nfs/dbraw/zinc/03/35/06/184033506.db2.gz	UMWWUBRSQHRUHY-UHFFFAOYSA-N	0	3	324.428	2.262	10	0		DEAEHN
CC(C)c1ccc([C@H](C)NCC(=O)NC(=O)NC2CC2)cc1	ZINC000057880051	184060578	/nfs/dbraw/zinc/06/05/78/184060578.db2.gz	VMDLMTIATAPBAG-LBPRGKRZSA-N	0	3	303.406	2.449	10	0		DEAEHN
COc1cc(CNCCc2nccs2)cc2c1OCCO2	ZINC000060230224	184145724	/nfs/dbraw/zinc/14/57/24/184145724.db2.gz	FGBOPDVKCJQDKJ-UHFFFAOYSA-N	0	3	306.387	2.255	10	0		DEAEHN
CCCN(CCN(C)C)c1nc(Cl)nc(OC(C)C)n1	ZINC000061541612	184174341	/nfs/dbraw/zinc/17/43/41/184174341.db2.gz	MURBGLIRROKJIC-UHFFFAOYSA-N	0	3	301.822	2.090	10	0		DEAEHN
COC(=O)c1sccc1NC(=O)[C@H](CN)c1ccccc1	ZINC000061612680	184178762	/nfs/dbraw/zinc/17/87/62/184178762.db2.gz	SREKSCSCXUZKHD-LLVKDONJSA-N	0	3	304.371	2.216	10	0		DEAEHN
CC(C)(CC(N)=O)C[C@@H](N)c1cc2c(cc1Cl)NC(=O)C2	ZINC000061825499	184188875	/nfs/dbraw/zinc/18/88/75/184188875.db2.gz	WILSVEQOGTWEMT-LLVKDONJSA-N	0	3	309.797	2.126	10	0		DEAEHN
Nc1cc(NC(=O)CCCN2CCCOCC2)ccc1Cl	ZINC000061913792	184195066	/nfs/dbraw/zinc/19/50/66/184195066.db2.gz	KQVOHOKSTSYYNT-UHFFFAOYSA-N	0	3	311.813	2.363	10	0		DEAEHN
C[C@H]1CN([C@@H](CN)c2ccc(Br)o2)CCCO1	ZINC000061916361	184195306	/nfs/dbraw/zinc/19/53/06/184195306.db2.gz	MMXVEGGDCFUWNF-UWVGGRQHSA-N	0	3	303.200	2.153	10	0		DEAEHN
CN(c1cccc(CN)c1)S(=O)(=O)c1ccc(F)c(F)c1	ZINC000061950490	184198537	/nfs/dbraw/zinc/19/85/37/184198537.db2.gz	HIVSQGXDJXUQQQ-UHFFFAOYSA-N	0	3	312.341	2.249	10	0		DEAEHN
CC(C)(C)N1C(=O)C[C@H](N)[C@@H]1c1ccc(Br)o1	ZINC000062210196	184220848	/nfs/dbraw/zinc/22/08/48/184220848.db2.gz	NDBAJMCSMUVBKY-WRWORJQWSA-N	0	3	301.184	2.441	10	0		DEAEHN
COCCN1C(=O)CC[C@H](N)[C@@H]1c1c(F)cccc1Cl	ZINC000062213717	184222077	/nfs/dbraw/zinc/22/20/77/184222077.db2.gz	GPFIHYJXOHVICC-SMDDNHRTSA-N	0	3	300.761	2.116	10	0		DEAEHN
CN(C)[C@@H]1CCN(CC(=O)c2sccc2Br)C1	ZINC000062966752	184263032	/nfs/dbraw/zinc/26/30/32/184263032.db2.gz	HYNLCCDGVTZLEF-SECBINFHSA-N	0	3	317.252	2.329	10	0		DEAEHN
COC[C@@H](C)CN1CCCN(C(=O)Cc2cccc(F)c2)CC1	ZINC000189807119	335045619	/nfs/dbraw/zinc/04/56/19/335045619.db2.gz	ZGMWGBCJVZLVJQ-HNNXBMFYSA-N	0	3	322.424	2.185	10	0		DEAEHN
N[C@@H]1CC(=O)N(c2ccccc2OCCOc2ccccc2)C1	ZINC000066055710	184385845	/nfs/dbraw/zinc/38/58/45/184385845.db2.gz	CKIVXBPAPCDVCJ-CQSZACIVSA-N	0	3	312.369	2.208	10	0		DEAEHN
CCCNCc1ccc(OC)cc1OC[C@@H](O)C(F)(F)F	ZINC000068877044	184498488	/nfs/dbraw/zinc/49/84/88/184498488.db2.gz	JTALRWQBGLLCNF-CYBMUJFWSA-N	0	3	307.312	2.497	10	0		DEAEHN
Cc1c(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cnn1CC(C)C	ZINC000119799355	195039169	/nfs/dbraw/zinc/03/91/69/195039169.db2.gz	ZHUGJWAPEPIQQR-BBRMVZONSA-N	0	3	306.454	2.306	10	0		DEAEHN
CC[C@@H]1CN[C@@H](c2ccccc2)CN1C1CCS(=O)CC1	ZINC000159195607	197334700	/nfs/dbraw/zinc/33/47/00/197334700.db2.gz	RWFRRTJKZAFQBW-HRXNXTQESA-N	0	3	306.475	2.323	10	0		DEAEHN
CCC[C@H](N)C(=O)Nc1nnc(Cc2ccc(F)cc2)s1	ZINC000158935557	197312356	/nfs/dbraw/zinc/31/23/56/197312356.db2.gz	HWLCBDVBLJGJIS-NSHDSACASA-N	0	3	308.382	2.334	10	0		DEAEHN
CN[C@@H](Cc1ccc(OC)c(Br)c1)c1cn[nH]n1	ZINC000158875863	197308807	/nfs/dbraw/zinc/30/88/07/197308807.db2.gz	RAVXMYOJXZFHJN-JTQLQIEISA-N	0	3	311.183	2.079	10	0		DEAEHN
CCN[C@H](CC)c1c(Br)cnn1CCN(C)C	ZINC000158736558	197298165	/nfs/dbraw/zinc/29/81/65/197298165.db2.gz	YLXLYEGJHAZRPT-LLVKDONJSA-N	0	3	303.248	2.268	10	0		DEAEHN
CCc1nn(C)c(C[C@@H](N)c2cscn2)c1Br	ZINC000158539277	197281867	/nfs/dbraw/zinc/28/18/67/197281867.db2.gz	SDSWOFMUJHZALK-SSDOTTSWSA-N	0	3	315.240	2.444	10	0		DEAEHN
COc1cnn(C)c1[C@@H](N)Cc1ccc(Br)cc1	ZINC000158398381	197268979	/nfs/dbraw/zinc/26/89/79/197268979.db2.gz	VDFBYHZYBQCRDN-NSHDSACASA-N	0	3	310.195	2.434	10	0		DEAEHN
COC(=O)c1cc(NC(=O)[C@H](N)C(C)(C)C)c(F)cc1F	ZINC000158260435	197257585	/nfs/dbraw/zinc/25/75/85/197257585.db2.gz	MFDPNWRINNYAJT-NSHDSACASA-N	0	3	300.305	2.063	10	0		DEAEHN
C[C@@H](CCO)NC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000157986359	197233419	/nfs/dbraw/zinc/23/34/19/197233419.db2.gz	UFSXISJHSOQMLR-DOTOQJQBSA-N	0	3	319.449	2.111	10	0		DEAEHN
CC[C@](C)([C@H](O)c1c(Br)cnn1C)N1CCCC1	ZINC000157632012	197203572	/nfs/dbraw/zinc/20/35/72/197203572.db2.gz	SDQYLOMSJZSENV-CHWSQXEVSA-N	0	3	316.243	2.481	10	0		DEAEHN
CC[C@H](C(=O)N[C@@H](C)c1ccccc1-n1cccn1)N(C)C	ZINC000157468985	197189993	/nfs/dbraw/zinc/18/99/93/197189993.db2.gz	RUJUVMUXEHDGQO-DZGCQCFKSA-N	0	3	300.406	2.390	10	0		DEAEHN
CCCN[C@](C)(C[C@@H](C)N(C)CCOCC)C(=O)OCC	ZINC000157474171	197189852	/nfs/dbraw/zinc/18/98/52/197189852.db2.gz	OWVMEWMTOGJCAC-GDBMZVCRSA-N	0	3	302.459	2.055	10	0		DEAEHN
CCCN[C@@](C)(C[C@H](C)N(C)CCOC(C)C)C(=O)OC	ZINC000157519525	197193075	/nfs/dbraw/zinc/19/30/75/197193075.db2.gz	LYSJRTPJOGAICI-HOCLYGCPSA-N	0	3	302.459	2.053	10	0		DEAEHN
CC(C)C[C@H](N)C(=O)N[C@H](C)c1ccccc1-n1cccn1	ZINC000157438740	197186883	/nfs/dbraw/zinc/18/68/83/197186883.db2.gz	PVJHNUIRUUNZJV-HIFRSBDPSA-N	0	3	300.406	2.423	10	0		DEAEHN
COc1ccc2[nH]c(=S)n(C[C@@H]3CCN(C(C)C)C3)c2n1	ZINC000157044522	197158087	/nfs/dbraw/zinc/15/80/87/197158087.db2.gz	YFFUXCZIFHMAGF-LLVKDONJSA-N	0	3	306.435	2.459	10	0		DEAEHN
CCO[C@H]1C[C@](N)(C(=O)N(CC(F)(F)F)C(C)C)C1(C)C	ZINC000156952738	197152694	/nfs/dbraw/zinc/15/26/94/197152694.db2.gz	VHQOOYWREBVNMS-GWCFXTLKSA-N	0	3	310.360	2.318	10	0		DEAEHN
Cc1ccc([C@H](C)NC(=O)N2CCO[C@H](CN(C)C)C2)cc1F	ZINC000156805656	197141916	/nfs/dbraw/zinc/14/19/16/197141916.db2.gz	QHOTWRVZYUSHBI-DZGCQCFKSA-N	0	3	323.412	2.167	10	0		DEAEHN
Cc1cc(Oc2ccc(S(C)(=O)=O)cc2)c(CN)c(C)n1	ZINC000156507701	197118985	/nfs/dbraw/zinc/11/89/85/197118985.db2.gz	ILLHMCDCOZFHFT-UHFFFAOYSA-N	0	3	306.387	2.353	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)Nn2cnc3ccccc32)[C@@H](C)C1	ZINC000156364958	197108106	/nfs/dbraw/zinc/10/81/06/197108106.db2.gz	MJKBJNSTVRFQIR-JSGCOSHPSA-N	0	3	301.394	2.018	10	0		DEAEHN
CN(C[C@H]1CC=CCC1)C(=O)NCCCCN1CCN(C)CC1	ZINC000542264036	285215861	/nfs/dbraw/zinc/21/58/61/285215861.db2.gz	VGTYFBZTXYRNGY-KRWDZBQOSA-N	0	3	322.497	2.012	10	0		DEAEHN
Cc1ccccc1[S@@](=O)CC(=O)Nc1cccc(CN)c1	ZINC000156013692	197080980	/nfs/dbraw/zinc/08/09/80/197080980.db2.gz	BVFQKJAJDXLWLN-OAQYLSRUSA-N	0	3	302.399	2.200	10	0		DEAEHN
CCOc1ccc(OCC(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1	ZINC000155421570	197052867	/nfs/dbraw/zinc/05/28/67/197052867.db2.gz	CRSPZHOJWWZJCA-WMLDXEAASA-N	0	3	320.433	2.309	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1C	ZINC000120495016	195177227	/nfs/dbraw/zinc/17/72/27/195177227.db2.gz	AVMKDGWCMDJIGB-GDBMZVCRSA-N	0	3	317.433	2.183	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1F	ZINC000120786453	195237920	/nfs/dbraw/zinc/23/79/20/195237920.db2.gz	UGMWBGUJTLVFEV-OLZOCXBDSA-N	0	3	321.396	2.014	10	0		DEAEHN
Cn1nccc1CCC(=O)N1C[C@@H]2CCCN2Cc2ccccc21	ZINC000120912039	195263472	/nfs/dbraw/zinc/26/34/72/195263472.db2.gz	LQPFSDBADFCZGN-KRWDZBQOSA-N	0	3	324.428	2.364	10	0		DEAEHN
O=C1[C@@H]2CN(Cc3ccc(F)cc3)C[C@@H]2CN1c1cccnc1	ZINC000247955929	257113403	/nfs/dbraw/zinc/11/34/03/257113403.db2.gz	NKAKCNHTGBSJTJ-RHSMWYFYSA-N	0	3	311.360	2.316	10	0		DEAEHN
c1nnc(N2CC[C@H]3[C@H]2CCN3CCc2ccccc2)s1	ZINC000253588573	257105504	/nfs/dbraw/zinc/10/55/04/257105504.db2.gz	INDVBTIEZQAKKU-LSDHHAIUSA-N	0	3	300.431	2.434	10	0		DEAEHN
CN(C)CCO[C@@H]1CN(Cc2ccc(F)cc2)[C@H]2CCCO[C@H]12	ZINC000503716205	257209516	/nfs/dbraw/zinc/20/95/16/257209516.db2.gz	FJCKEDGBPJKYGA-KSZLIROESA-N	0	3	322.424	2.136	10	0		DEAEHN
CCc1cccc(NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000121827019	195357016	/nfs/dbraw/zinc/35/70/16/195357016.db2.gz	DKMVLMGHZAHOQF-INIZCTEOSA-N	0	3	319.449	2.280	10	0		DEAEHN
C[C@H]1CC[C@H](C(=O)NC2CCN(Cc3ccccc3)CC2)O1	ZINC000122021804	195390187	/nfs/dbraw/zinc/39/01/87/195390187.db2.gz	GWPBOVMLBYQMHB-WMLDXEAASA-N	0	3	302.418	2.335	10	0		DEAEHN
CCN1CCN(CCC(=O)Nc2ccc3oc(C)nc3c2)CC1	ZINC000122055449	195395854	/nfs/dbraw/zinc/39/58/54/195395854.db2.gz	DAFKXANTGBNTIA-UHFFFAOYSA-N	0	3	316.405	2.102	10	0		DEAEHN
CCN(CCCO)[C@@H](CN)c1ccc(Br)s1	ZINC000124409525	195638733	/nfs/dbraw/zinc/63/87/33/195638733.db2.gz	DEAIFWDOUJNBIV-VIFPVBQESA-N	0	3	307.257	2.215	10	0		DEAEHN
NCc1ccc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)c(Cl)c1	ZINC000126498687	195844865	/nfs/dbraw/zinc/84/48/65/195844865.db2.gz	PIGDMRXULRGHCZ-VXGBXAGGSA-N	0	3	314.838	2.219	10	0		DEAEHN
C[C@@H](NCC1(CCO)CC1)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000188068075	533356949	/nfs/dbraw/zinc/35/69/49/533356949.db2.gz	DLCJKVXKVRCBHX-LLVKDONJSA-N	0	3	315.410	2.042	10	0		DEAEHN
COC(=O)COc1ccccc1[C@H](C)NCC1(CCO)CC1	ZINC000188056959	533573493	/nfs/dbraw/zinc/57/34/93/533573493.db2.gz	URKGJOQGDODOOV-ZDUSSCGKSA-N	0	3	307.390	2.052	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc(OC[C@@H]2CCCO2)cc1	ZINC000175852584	132515545	/nfs/dbraw/zinc/51/55/45/132515545.db2.gz	NJGAKXHEZQGWSM-ZWKOTPCHSA-N	0	3	323.433	2.122	10	0		DEAEHN
CC(C)N1CCN(Cc2ccc3c(c2)sc(=O)n3C)CC1	ZINC000194982356	132543368	/nfs/dbraw/zinc/54/33/68/132543368.db2.gz	RQVWCTBRDGEWGD-UHFFFAOYSA-N	0	3	305.447	2.126	10	0		DEAEHN
CC[C@@H](C(=O)Nc1ccc(OC)cc1)N1CCN2CCC[C@H]2C1	ZINC000245466951	132565579	/nfs/dbraw/zinc/56/55/79/132565579.db2.gz	JREROTMUKGNMJC-RDJZCZTQSA-N	0	3	317.433	2.192	10	0		DEAEHN
C[C@@H](NCCN1CCN(C(=O)C2CCC2)CC1)c1ccsc1	ZINC000358144064	133124024	/nfs/dbraw/zinc/12/40/24/133124024.db2.gz	VKEYMGCPAUISOT-CQSZACIVSA-N	0	3	321.490	2.343	10	0		DEAEHN
CC1=CCN(CCNC(=O)NC[C@@H](C)N2CCC(C)CC2)CC1	ZINC000358188811	133127365	/nfs/dbraw/zinc/12/73/65/133127365.db2.gz	LSWPJPIKFSVDFK-QGZVFWFLSA-N	0	3	322.497	2.058	10	0		DEAEHN
O=C1[C@H](N[C@H]2CCc3ccccc32)CCN1C1CCOCC1	ZINC000358201216	133128076	/nfs/dbraw/zinc/12/80/76/133128076.db2.gz	JKTWXPCNBJDWBP-DLBZAZTESA-N	0	3	300.402	2.043	10	0		DEAEHN
CCNc1ccc(Cl)cc1C(=O)NCCNc1ccncc1	ZINC000361889835	133198055	/nfs/dbraw/zinc/19/80/55/133198055.db2.gz	BXEBKRXDZQMNLV-UHFFFAOYSA-N	0	3	318.808	2.431	10	0		DEAEHN
COC(=O)[C@H]1CCCN(CCC(=O)Nc2cccc(F)c2C)C1	ZINC000362353099	133225544	/nfs/dbraw/zinc/22/55/44/133225544.db2.gz	LPMGDHFBQWWHHV-ZDUSSCGKSA-N	0	3	322.380	2.348	10	0		DEAEHN
CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1CC1(C)C	ZINC000373533900	133394525	/nfs/dbraw/zinc/39/45/25/133394525.db2.gz	MGJVVZASXYJYHI-LPHOPBHVSA-N	0	3	316.445	2.128	10	0		DEAEHN
N#Cc1cnccc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000547503135	285593185	/nfs/dbraw/zinc/59/31/85/285593185.db2.gz	NYMWTUAADRBXSX-UHFFFAOYSA-N	0	3	322.412	2.462	10	0		DEAEHN
C[C@@H]1CCC[C@H]1C(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000344986534	404485052	/nfs/dbraw/zinc/48/50/52/404485052.db2.gz	DFNRXBFXIOPFSI-SZVBFZGTSA-N	0	3	316.445	2.176	10	0		DEAEHN
CN(C)CCN(CC1CCCCC1)C(=O)N[C@H]1CCCOC1	ZINC000172584714	144824927	/nfs/dbraw/zinc/82/49/27/144824927.db2.gz	OMBUYLIETDDJSB-INIZCTEOSA-N	0	3	311.470	2.319	10	0		DEAEHN
CCc1onc(C)c1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1	ZINC000187772575	145003388	/nfs/dbraw/zinc/00/33/88/145003388.db2.gz	SBPPNXWYUBPJKN-STQMWFEESA-N	0	3	323.437	2.165	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1n[nH]c2c1CCCCC2	ZINC000188021170	145005943	/nfs/dbraw/zinc/00/59/43/145005943.db2.gz	WYXHUJKNIURHGR-CYBMUJFWSA-N	0	3	304.438	2.235	10	0		DEAEHN
Cn1cnc(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)c1	ZINC000188253010	145009516	/nfs/dbraw/zinc/00/95/16/145009516.db2.gz	PWIVHJAOAKVZJJ-GOSISDBHSA-N	0	3	312.417	2.205	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1ccc(-c2ncon2)cc1	ZINC000188756063	145016943	/nfs/dbraw/zinc/01/69/43/145016943.db2.gz	FRKVCLCKNIIDQY-UHFFFAOYSA-N	0	3	320.352	2.270	10	0		DEAEHN
Cc1nc(CC(C)C)oc1C(=O)N1CC[C@H]2CC[C@@H](C1)N2C	ZINC000188928957	145019999	/nfs/dbraw/zinc/01/99/99/145019999.db2.gz	UMSWQUZTFBLSEL-KGLIPLIRSA-N	0	3	305.422	2.490	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(C[C@H](O)CC(F)(F)F)C1	ZINC000189218410	145023786	/nfs/dbraw/zinc/02/37/86/145023786.db2.gz	BCIAMICAYRAERD-NWDGAFQWSA-N	0	3	305.344	2.396	10	0		DEAEHN
C[C@@H]1CN(Cc2cccc(-c3cccnc3)c2)CCN1CCO	ZINC000190243596	145039687	/nfs/dbraw/zinc/03/96/87/145039687.db2.gz	RTJRNYQEWIGJRI-MRXNPFEDSA-N	0	3	311.429	2.247	10	0		DEAEHN
Cc1nc(CC(C)C)oc1C(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000190427740	145042329	/nfs/dbraw/zinc/04/23/29/145042329.db2.gz	CVMFDUUSOUVZTA-JSGCOSHPSA-N	0	3	305.422	2.490	10	0		DEAEHN
C[C@H](CCNC(=O)N1CCO[C@H](CN(C)C)C1)CC(C)(C)C	ZINC000190991912	145051771	/nfs/dbraw/zinc/05/17/71/145051771.db2.gz	WLTDUIKYNNARTC-HUUCEWRRSA-N	0	3	313.486	2.421	10	0		DEAEHN
CCc1nc(C2CCN(Cc3cc(C(=O)OC)co3)CC2)n[nH]1	ZINC000191693284	145062957	/nfs/dbraw/zinc/06/29/57/145062957.db2.gz	MZQZYRAHUBABHH-UHFFFAOYSA-N	0	3	318.377	2.126	10	0		DEAEHN
CCc1n[nH]c(C2CCN(Cc3cc(C(=O)OC)co3)CC2)n1	ZINC000191693284	145062958	/nfs/dbraw/zinc/06/29/58/145062958.db2.gz	MZQZYRAHUBABHH-UHFFFAOYSA-N	0	3	318.377	2.126	10	0		DEAEHN
CCc1nnc(C2CCN(Cc3cc(C(=O)OC)co3)CC2)[nH]1	ZINC000191693284	145062959	/nfs/dbraw/zinc/06/29/59/145062959.db2.gz	MZQZYRAHUBABHH-UHFFFAOYSA-N	0	3	318.377	2.126	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NS(=O)(=O)CC2CCCCC2)C1	ZINC000246482119	145104343	/nfs/dbraw/zinc/10/43/43/145104343.db2.gz	WVZDNLZMOXSLDX-DZGCQCFKSA-N	0	3	302.484	2.215	10	0		DEAEHN
C[C@@H](C(=O)Nc1cccc(Cl)c1)N1CCN2CCC[C@H]2C1	ZINC000246284929	145097178	/nfs/dbraw/zinc/09/71/78/145097178.db2.gz	IDONSLSDIJYFQS-WFASDCNBSA-N	0	3	307.825	2.447	10	0		DEAEHN
O=C(C[C@H](O)c1ccc(Cl)cc1)N1CCN2CCC[C@H]2C1	ZINC000246369285	145100096	/nfs/dbraw/zinc/10/00/96/145100096.db2.gz	JDQSBDUVJMJHFV-GJZGRUSLSA-N	0	3	308.809	2.070	10	0		DEAEHN
CCc1nc([C@@H](C)NC(=O)N2CCN3CCC[C@H]3C2)cs1	ZINC000246667405	145110344	/nfs/dbraw/zinc/11/03/44/145110344.db2.gz	SXFGEBPVVPOZTJ-NEPJUHHUSA-N	0	3	308.451	2.256	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)c2cccc(C)c2)[C@@H](C)C1	ZINC000246685619	145110519	/nfs/dbraw/zinc/11/05/19/145110519.db2.gz	YLPZDBAJDKJMTQ-HOCLYGCPSA-N	0	3	310.463	2.346	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)CSCc2ccccn2)C1	ZINC000246828727	145115969	/nfs/dbraw/zinc/11/59/69/145115969.db2.gz	DSPIJWSIHNYILP-DZGCQCFKSA-N	0	3	307.463	2.160	10	0		DEAEHN
C[C@H](c1nc(-c2cccnc2)no1)N(C)C[C@H]1CCCN(C)C1	ZINC000247017556	145123727	/nfs/dbraw/zinc/12/37/27/145123727.db2.gz	QPRGECHOGJIENJ-KGLIPLIRSA-N	0	3	315.421	2.466	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1CCCN1C[C@@H](O)COC(C)(C)C	ZINC000247175281	145128448	/nfs/dbraw/zinc/12/84/48/145128448.db2.gz	NDGPHZIXXMIEOG-HUUCEWRRSA-N	0	3	309.454	2.350	10	0		DEAEHN
Cc1cc(C)cc(OCCCN2CCN(C[C@@H](C)O)[C@@H](C)C2)c1	ZINC000247214903	145130005	/nfs/dbraw/zinc/13/00/05/145130005.db2.gz	PYXGSKRNQVNDFM-ZWKOTPCHSA-N	0	3	320.477	2.459	10	0		DEAEHN
C[C@@H]1CC[C@@H](CC(=O)N2CCCC[C@@H](N3CCN(C)CC3)C2)C1	ZINC000247309541	145132769	/nfs/dbraw/zinc/13/27/69/145132769.db2.gz	FRYQCIMYNAWYRT-KZNAEPCWSA-N	0	3	321.509	2.441	10	0		DEAEHN
Cc1ccc(OCCCN2CCN(C[C@H](C)O)[C@H](C)C2)cc1C	ZINC000247404728	145136133	/nfs/dbraw/zinc/13/61/33/145136133.db2.gz	YYCQFOMMNUKDAK-MSOLQXFVSA-N	0	3	320.477	2.459	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1C1CCCCC1	ZINC000247429333	145136776	/nfs/dbraw/zinc/13/67/76/145136776.db2.gz	ONCUQGKHJPJGTA-IXDOHACOSA-N	0	3	308.466	2.430	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N2CCO[C@@H](c3ccco3)C2)C1	ZINC000247486736	145139088	/nfs/dbraw/zinc/13/90/88/145139088.db2.gz	WORZEVZXSQIWKZ-IIAWOOMASA-N	0	3	321.421	2.091	10	0		DEAEHN
Cc1cccc(CS(=O)(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1	ZINC000247537463	145140117	/nfs/dbraw/zinc/14/01/17/145140117.db2.gz	PTDAOCHPPHTERL-DLBZAZTESA-N	0	3	322.474	2.241	10	0		DEAEHN
CCCC(=O)N1CCCC[C@@H]1C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000247556285	145140666	/nfs/dbraw/zinc/14/06/66/145140666.db2.gz	ZFGWZLRMVAEONE-HRCADAONSA-N	0	3	323.481	2.109	10	0		DEAEHN
COCCN1CCN(CCCCCn2cc(C)cn2)C[C@@H]1C	ZINC000247728098	145143789	/nfs/dbraw/zinc/14/37/89/145143789.db2.gz	TVTSQEUKQJODMW-KRWDZBQOSA-N	0	3	308.470	2.014	10	0		DEAEHN
Cc1cccc(C)c1OC[C@@H](O)CN1CCN2CCCC[C@H]2C1	ZINC000248370317	145152047	/nfs/dbraw/zinc/15/20/47/145152047.db2.gz	XILKERCIDTVUQE-ROUUACIJSA-N	0	3	318.461	2.213	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cnn(CC(C)C)c1	ZINC000248459112	145156148	/nfs/dbraw/zinc/15/61/48/145156148.db2.gz	VLCXMMUVULAJML-CVEARBPZSA-N	0	3	304.438	2.238	10	0		DEAEHN
C[C@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)[C@@H]1CCCO1	ZINC000248775830	145166699	/nfs/dbraw/zinc/16/66/99/145166699.db2.gz	TWPXMWJWRXQPKD-IMJJTQAJSA-N	0	3	305.422	2.156	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCSCC1	ZINC000248884914	145172372	/nfs/dbraw/zinc/17/23/72/145172372.db2.gz	SAANZHUZBHYYBD-GOEBONIOSA-N	0	3	319.474	2.265	10	0		DEAEHN
CCN(CCO)CCNC(=O)N[C@H]1CC[C@@H](C)c2ccccc21	ZINC000248986362	145174798	/nfs/dbraw/zinc/17/47/98/145174798.db2.gz	KADICSSBIJCDOD-PBHICJAKSA-N	0	3	319.449	2.238	10	0		DEAEHN
COc1ccccc1C[C@@H]1CCCN1CCN1CCO[C@@H](C)C1	ZINC000249061241	145177314	/nfs/dbraw/zinc/17/73/14/145177314.db2.gz	PRRFAKLYXGESGZ-WMZOPIPTSA-N	0	3	318.461	2.423	10	0		DEAEHN
C[C@H](Oc1ccccc1Cl)C(=O)N1CCN2CCC[C@H]2C1	ZINC000249835033	145190692	/nfs/dbraw/zinc/19/06/92/145190692.db2.gz	RPSCJOGAGKTFPL-STQMWFEESA-N	0	3	308.809	2.414	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NC[C@H]2CCCN2C)c1	ZINC000253356512	145201855	/nfs/dbraw/zinc/20/18/55/145201855.db2.gz	ROSRITZBLOQOJF-DAXOMENPSA-N	0	3	315.417	2.105	10	0		DEAEHN
CN(Cc1cccc(F)c1)C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C	ZINC000261613262	145210400	/nfs/dbraw/zinc/21/04/00/145210400.db2.gz	BGFZMOGVKSKMJW-RLFYNMQTSA-N	0	3	320.408	2.317	10	0		DEAEHN
c1cn(-c2ccccc2)nc1CN1CCNC[C@H]1c1cccnc1	ZINC000261794986	145227308	/nfs/dbraw/zinc/22/73/08/145227308.db2.gz	QLUYTPHNNHCGGA-IBGZPJMESA-N	0	3	319.412	2.414	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)N[C@H](C)C[C@H]2COCCN2)c1	ZINC000261822046	145230487	/nfs/dbraw/zinc/23/04/87/145230487.db2.gz	ASAQAJBUKBMMNN-RDBSUJKOSA-N	0	3	308.422	2.121	10	0		DEAEHN
C[C@@H](NC(=O)[C@H](N)C1CCOCC1)c1ccc(Cl)s1	ZINC000261851923	145233636	/nfs/dbraw/zinc/23/36/36/145233636.db2.gz	RPXFYKAJZCKQMZ-PRHODGIISA-N	0	3	302.827	2.333	10	0		DEAEHN
C[C@H](NC(=O)[C@H](N)C1CCOCC1)c1ccc(Cl)s1	ZINC000261851925	145233842	/nfs/dbraw/zinc/23/38/42/145233842.db2.gz	RPXFYKAJZCKQMZ-QPUJVOFHSA-N	0	3	302.827	2.333	10	0		DEAEHN
NC1(C(=O)N2CCC(Cc3ccc(F)cc3)CC2)CCOCC1	ZINC000261866261	145235203	/nfs/dbraw/zinc/23/52/03/145235203.db2.gz	NOCDFZGHGVTDCU-UHFFFAOYSA-N	0	3	320.408	2.115	10	0		DEAEHN
Cc1nc(-c2cccc(NC(=O)[C@H]3NCCCC3(C)C)c2)n[nH]1	ZINC000261881013	145236660	/nfs/dbraw/zinc/23/66/60/145236660.db2.gz	MMZYBKKWRAOTGU-CQSZACIVSA-N	0	3	313.405	2.497	10	0		DEAEHN
COc1cc(NC(=O)[C@H]2NCCCC2(C)C)cc(OC)c1OC	ZINC000261942445	145244960	/nfs/dbraw/zinc/24/49/60/145244960.db2.gz	UYGFOXYYQCILSL-OAHLLOKOSA-N	0	3	322.405	2.429	10	0		DEAEHN
c1cc2c(c(CN3CCC(O[C@H]4CCOC4)CC3)c1)NCC2	ZINC000261944825	145245070	/nfs/dbraw/zinc/24/50/70/145245070.db2.gz	NDUOVJLZRADSNQ-KRWDZBQOSA-N	0	3	302.418	2.425	10	0		DEAEHN
CCN(C)c1ccc(CN2CCNC[C@H]2c2cccnc2)cn1	ZINC000262039424	145256312	/nfs/dbraw/zinc/25/63/12/145256312.db2.gz	YEJQAIYFLZOZTN-KRWDZBQOSA-N	0	3	311.433	2.079	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC(=O)[C@H]2C[C@H](C)CCN2)c1	ZINC000262490922	145287152	/nfs/dbraw/zinc/28/71/52/145287152.db2.gz	LAQFSFXDILFOAN-TYNCELHUSA-N	0	3	306.406	2.269	10	0		DEAEHN
C[C@@H]1CCC[C@H](CNC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)C1	ZINC000262506829	145288668	/nfs/dbraw/zinc/28/86/68/145288668.db2.gz	MMTTVHVUSDMAKQ-KQVLKZGSSA-N	0	3	308.466	2.461	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)Nc1nc(C2CC2)cs1	ZINC000262530278	145290686	/nfs/dbraw/zinc/29/06/86/145290686.db2.gz	PLIFECKXOCSYGB-KANYHAFZSA-N	0	3	321.446	2.492	10	0		DEAEHN
C[C@@H](NC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C)c1ccccc1	ZINC000262587099	145295796	/nfs/dbraw/zinc/29/57/96/145295796.db2.gz	ZWJPMQRMFMRBNS-OYUZRVEBSA-N	0	3	302.418	2.396	10	0		DEAEHN
Cc1csc(C2(NC(=O)C[C@H]3CSCCN3)CCC2)n1	ZINC000262745083	145303097	/nfs/dbraw/zinc/30/30/97/145303097.db2.gz	FSCSXUPANUAWFX-NSHDSACASA-N	0	3	311.476	2.042	10	0		DEAEHN
Cc1ccc(O[C@H](C)c2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263135512	145327909	/nfs/dbraw/zinc/32/79/09/145327909.db2.gz	CAIOJPHALQYCDP-OCCSQVGLSA-N	0	3	302.378	2.094	10	0		DEAEHN
Cc1ccc(O[C@@H](C)c2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263135496	145328193	/nfs/dbraw/zinc/32/81/93/145328193.db2.gz	CAIOJPHALQYCDP-JSGCOSHPSA-N	0	3	302.378	2.094	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2cc(F)c(F)cc2Cl)n1	ZINC000263151997	145330530	/nfs/dbraw/zinc/33/05/30/145330530.db2.gz	DDWHKIQZFDPFSY-LLVKDONJSA-N	0	3	314.723	2.244	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(Cc2coc3cc(F)ccc23)n1	ZINC000263188000	145334479	/nfs/dbraw/zinc/33/44/79/145334479.db2.gz	HOZFUBBGBWBSQU-CYBMUJFWSA-N	0	3	316.336	2.122	10	0		DEAEHN
C[C@H](Oc1cccc(Cl)c1)c1nc([C@H]2CNCCN2C)no1	ZINC000263217861	145337257	/nfs/dbraw/zinc/33/72/57/145337257.db2.gz	LFRZWZZWQWRHKV-GXFFZTMASA-N	0	3	322.796	2.439	10	0		DEAEHN
C[C@H](CN(C)C)NC(=O)N1C[C@H](C)O[C@@H](c2ccccc2)C1	ZINC000358509029	147147476	/nfs/dbraw/zinc/14/74/76/147147476.db2.gz	VTIMQGNROVCPKK-IJEWVQPXSA-N	0	3	305.422	2.108	10	0		DEAEHN
CCCN(CCN(C)C)C(=O)c1ncsc1Br	ZINC000358654494	147174470	/nfs/dbraw/zinc/17/44/70/147174470.db2.gz	SVYBNYDMCTUANR-UHFFFAOYSA-N	0	3	320.256	2.319	10	0		DEAEHN
O=C1[C@@H](NCc2ccc(C3CC3)cc2)CCN1C1CCOCC1	ZINC000359079508	147258287	/nfs/dbraw/zinc/25/82/87/147258287.db2.gz	GSTAPYWLJZZTCH-SFHVURJKSA-N	0	3	314.429	2.434	10	0		DEAEHN
CN(C)C1(CNC(=O)NC[C@@](C)(O)C2CCCCC2)CCC1	ZINC000359303871	147303926	/nfs/dbraw/zinc/30/39/26/147303926.db2.gz	JUHWSDMJWJVLKQ-MRXNPFEDSA-N	0	3	311.470	2.101	10	0		DEAEHN
c1ncn(-c2ccc(CN3CCC(c4cn[nH]c4)CC3)cc2)n1	ZINC000371385321	148096538	/nfs/dbraw/zinc/09/65/38/148096538.db2.gz	XCPHCMPVASIBNQ-UHFFFAOYSA-N	0	3	308.389	2.370	10	0		DEAEHN
CC[C@H](C(=O)N1CCCC[C@H]1c1nnc2n1CCCC2)N(C)C	ZINC000408472462	148611121	/nfs/dbraw/zinc/61/11/21/148611121.db2.gz	VJCXIVHJJCIYNO-KGLIPLIRSA-N	0	3	319.453	2.008	10	0		DEAEHN
CCOCCN(C)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000246306248	286074736	/nfs/dbraw/zinc/07/47/36/286074736.db2.gz	DLQGOVSQCXXLIX-HOTGVXAUSA-N	0	3	305.422	2.110	10	0		DEAEHN
Cc1ccccc1[C@H](C)NC(=O)NCC1CCN(CCO)CC1	ZINC000111789311	401723877	/nfs/dbraw/zinc/72/38/77/401723877.db2.gz	IXMJFLBVJFNRPF-HNNXBMFYSA-N	0	3	319.449	2.060	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1C[C@H](C)c2ccccc21	ZINC000111867872	401726396	/nfs/dbraw/zinc/72/63/96/401726396.db2.gz	NZKQDGRVKDLPAL-GJZGRUSLSA-N	0	3	317.433	2.431	10	0		DEAEHN
CC(C)COC1CCN(C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)CC1	ZINC000127322894	401729112	/nfs/dbraw/zinc/72/91/12/401729112.db2.gz	PCZLBUMIWYBKBY-GJZGRUSLSA-N	0	3	323.481	2.458	10	0		DEAEHN
CC[C@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1nccs1	ZINC000074365777	401737098	/nfs/dbraw/zinc/73/70/98/401737098.db2.gz	QGWZCXXQOPWSGA-AGIUHOORSA-N	0	3	308.451	2.472	10	0		DEAEHN
C[C@H](CCc1cccn1C)NC(=O)N1CCCN(C2CC2)CC1	ZINC000074746712	401744205	/nfs/dbraw/zinc/74/42/05/401744205.db2.gz	CAQFOHBPLHVATQ-OAHLLOKOSA-N	0	3	318.465	2.226	10	0		DEAEHN
C[C@H]1CN(C[C@H](O)COc2cccc3[nH]ccc32)CCS1	ZINC000127038564	401717400	/nfs/dbraw/zinc/71/74/00/401717400.db2.gz	RWLKKRBKFNYTCG-STQMWFEESA-N	0	3	306.431	2.345	10	0		DEAEHN
CN(C)CCOc1cccc(CNC(=O)N(C)C2CCC2)c1	ZINC000073621850	401719300	/nfs/dbraw/zinc/71/93/00/401719300.db2.gz	JHCTVNVSWFHWQE-UHFFFAOYSA-N	0	3	305.422	2.321	10	0		DEAEHN
Cc1ncc(CNCC[C@H](C)[S@@](C)=O)n1-c1ccccc1	ZINC000129318294	401802335	/nfs/dbraw/zinc/80/23/35/401802335.db2.gz	GMESAEGRBBTVBC-ZSEKCTLFSA-N	0	3	305.447	2.427	10	0		DEAEHN
C[C@H](Oc1cncc(N2CCNCC2)n1)c1cccc(F)c1	ZINC000013972073	401805678	/nfs/dbraw/zinc/80/56/78/401805678.db2.gz	VIVXNAQRWKTJPF-LBPRGKRZSA-N	0	3	302.353	2.165	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCN(c3cccs3)CC2)C1	ZINC000128072475	401761877	/nfs/dbraw/zinc/76/18/77/401761877.db2.gz	XPXMTTHMDUGQJV-AWEZNQCLSA-N	0	3	322.478	2.064	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2ccc3c(c2)CC(C)(C)O3)CCO1	ZINC000128119781	401763231	/nfs/dbraw/zinc/76/32/31/401763231.db2.gz	YXLPWMRXXZMKHY-INIZCTEOSA-N	0	3	304.434	2.163	10	0		DEAEHN
Cc1csc(C2CCN(CCCN3CCOCC3)CC2)n1	ZINC000075678910	401766199	/nfs/dbraw/zinc/76/61/99/401766199.db2.gz	ICHGKQDJJIAIPO-UHFFFAOYSA-N	0	3	309.479	2.353	10	0		DEAEHN
CCOc1cc(C(=O)Nc2ccn(CCN(C)C)n2)ccc1C	ZINC000113040123	401766762	/nfs/dbraw/zinc/76/67/62/401766762.db2.gz	QGRIDINHLVPMKX-UHFFFAOYSA-N	0	3	316.405	2.404	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)CSCc1ccccn1	ZINC000113232833	401771485	/nfs/dbraw/zinc/77/14/85/401771485.db2.gz	OYYNWSDIDCNWNO-UKRRQHHQSA-N	0	3	305.447	2.010	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1Cc1nc(Cc2ccccc2)no1	ZINC000113269697	401773981	/nfs/dbraw/zinc/77/39/81/401773981.db2.gz	UJEZQHMYKHKBIQ-GDBMZVCRSA-N	0	3	312.417	2.329	10	0		DEAEHN
Cc1ccn2c(CN3CCC[C@H](Cn4cncn4)C3)cnc2c1	ZINC000128508494	401780006	/nfs/dbraw/zinc/78/00/06/401780006.db2.gz	QWILRAOBWFWBBZ-HNNXBMFYSA-N	0	3	310.405	2.146	10	0		DEAEHN
O=C(NCCN1CCCCCC1)[C@@H]1CC(=O)Nc2ccccc21	ZINC000076249742	401788517	/nfs/dbraw/zinc/78/85/17/401788517.db2.gz	CXTOTYGGZZRMQZ-OAHLLOKOSA-N	0	3	315.417	2.105	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@H]1COc2ccccc2C1	ZINC000077729988	401827722	/nfs/dbraw/zinc/82/77/22/401827722.db2.gz	UISSMDHSUFKBJB-CVEARBPZSA-N	0	3	304.434	2.330	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)N[C@H](C)[C@@H](C)CO)c1ccccc1	ZINC000077754138	401828969	/nfs/dbraw/zinc/82/89/69/401828969.db2.gz	FZJMACVFSMZZAC-ZMSDIMECSA-N	0	3	321.465	2.386	10	0		DEAEHN
CC(C)CC[C@@](C)(O)CNC(=O)NCCN1CCC(C)CC1	ZINC000077774340	401830189	/nfs/dbraw/zinc/83/01/89/401830189.db2.gz	NRUBXFFCXXADSJ-QGZVFWFLSA-N	0	3	313.486	2.205	10	0		DEAEHN
CN1C[C@@H](NCc2csc(Br)c2)CCC1=O	ZINC000077900139	401835966	/nfs/dbraw/zinc/83/59/66/401835966.db2.gz	XFQXVTAURDOINL-VIFPVBQESA-N	0	3	303.225	2.221	10	0		DEAEHN
CNC(=O)NC(=O)[C@@H](C)N[C@@H](C)c1ccc(CC(C)C)cc1	ZINC000028877666	401853284	/nfs/dbraw/zinc/85/32/84/401853284.db2.gz	COODCLLYQAJYIL-QWHCGFSZSA-N	0	3	305.422	2.380	10	0		DEAEHN
COCCN(C)CCCNC(=O)N1CCC[C@@H]1c1ccco1	ZINC000116532525	401854148	/nfs/dbraw/zinc/85/41/48/401854148.db2.gz	YCFWPHNLXLUVAU-CQSZACIVSA-N	0	3	309.410	2.094	10	0		DEAEHN
Cc1nc2ccccc2n1CC(=O)NCCN1CCCCCC1	ZINC000078870714	401867550	/nfs/dbraw/zinc/86/75/50/401867550.db2.gz	JMQGOVDXMXUJER-UHFFFAOYSA-N	0	3	314.433	2.337	10	0		DEAEHN
CC(=O)Nc1ccc(Cl)c(C(=O)NC[C@@H]2CCCN2C)c1	ZINC000135249234	401932127	/nfs/dbraw/zinc/93/21/27/401932127.db2.gz	LPIPYTOOAGXBDC-LBPRGKRZSA-N	0	3	309.797	2.122	10	0		DEAEHN
CC[C@H](COC)N[C@@H](CO)c1cccc(Br)c1	ZINC000119197113	401932647	/nfs/dbraw/zinc/93/26/47/401932647.db2.gz	CCWJZUQGHMTHSO-OLZOCXBDSA-N	0	3	302.212	2.497	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc(-n2nc(C)cc2C)cc1	ZINC000079921490	401883783	/nfs/dbraw/zinc/88/37/83/401883783.db2.gz	DXBWMCKECKBBIS-SFHVURJKSA-N	0	3	317.433	2.366	10	0		DEAEHN
O=C(C[C@H]1CSCCN1)N1CCCC[C@@H]1c1nccs1	ZINC000133673094	401893230	/nfs/dbraw/zinc/89/32/30/401893230.db2.gz	SFKCUYCZRFWSEA-NWDGAFQWSA-N	0	3	311.476	2.292	10	0		DEAEHN
COCCCN(Cc1ccc(F)cc1)C[C@@H](O)COC(C)C	ZINC000036095466	401901972	/nfs/dbraw/zinc/90/19/72/401901972.db2.gz	AOBHZAHGAYSIFA-QGZVFWFLSA-N	0	3	313.413	2.450	10	0		DEAEHN
C[C@@H](NC[C@@H](O)Cn1cccn1)c1cccc(Br)c1	ZINC000038012402	401920333	/nfs/dbraw/zinc/92/03/33/401920333.db2.gz	OMWDVJFAIGZDIZ-BXUZGUMPSA-N	0	3	324.222	2.357	10	0		DEAEHN
CCN(CCO)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000119594017	401960922	/nfs/dbraw/zinc/96/09/22/401960922.db2.gz	WGECWGKQUZGXSK-GOSISDBHSA-N	0	3	319.449	2.065	10	0		DEAEHN
C[C@H](NC(=O)N1CCN(C2CCCCC2)CC1)[C@H]1CCCO1	ZINC000136968690	401976710	/nfs/dbraw/zinc/97/67/10/401976710.db2.gz	ZUTWQXQXXWZFRH-GOEBONIOSA-N	0	3	309.454	2.214	10	0		DEAEHN
C[C@@H](NCCOc1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000120143508	401979726	/nfs/dbraw/zinc/97/97/26/401979726.db2.gz	IJGCZUIZQMUDLY-CYBMUJFWSA-N	0	3	320.414	2.064	10	0		DEAEHN
Cc1cccc(F)c1NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000120533620	401993237	/nfs/dbraw/zinc/99/32/37/401993237.db2.gz	UAVIWJBQBKKOBK-OLZOCXBDSA-N	0	3	321.396	2.014	10	0		DEAEHN
COC(=O)CCCN1C[C@@H](c2ccccc2)C[C@H](C(=O)OC)C1	ZINC000135464622	401940467	/nfs/dbraw/zinc/94/04/67/401940467.db2.gz	FNTQTZPQYNQYAQ-HOTGVXAUSA-N	0	3	319.401	2.218	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H](C)N1CCc2ccccc2C1)N(C)C	ZINC000135516370	401943223	/nfs/dbraw/zinc/94/32/23/401943223.db2.gz	HXFJGDITFWWHQD-MAUKXSAKSA-N	0	3	317.477	2.280	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(=O)N(CCN(C)C)Cc2ccc(F)cc2)O1	ZINC000151040343	402012714	/nfs/dbraw/zinc/01/27/14/402012714.db2.gz	RSQAIOMPUQTQJP-CJNGLKHVSA-N	0	3	308.397	2.283	10	0		DEAEHN
C[C@@H]1CC[C@H](C(=O)N(CCN(C)C)Cc2ccc(F)cc2)O1	ZINC000151040252	402012772	/nfs/dbraw/zinc/01/27/72/402012772.db2.gz	RSQAIOMPUQTQJP-CZUORRHYSA-N	0	3	308.397	2.283	10	0		DEAEHN
CCC(C)(C)c1ccc(CNC(=O)C(C)S(C)(=O)=O)cc1	ZINC000151821813	402059175	/nfs/dbraw/zinc/05/91/75/402059175.db2.gz	VAYJIHOJXBECMJ-LBPRGKRZSA-N	0	3	311.447	2.424	10	0		DEAEHN
COc1c2ccccc2c2c(c1CCC[NH+](C)C)C(=O)[N-]C2=O	ZINC000095932823	402034684	/nfs/dbraw/zinc/03/46/84/402034684.db2.gz	FKSHUMFNCSANBA-UHFFFAOYSA-N	0	3	312.369	2.226	10	0		DEAEHN
CC(C)c1cc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc(=O)[nH]1	ZINC000121547930	402043523	/nfs/dbraw/zinc/04/35/23/402043523.db2.gz	KAOVIWPIRUHZKA-TZMCWYRMSA-N	0	3	305.422	2.465	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)N1CC[C@H]2OCCC[C@@H]2C1	ZINC000150965971	402007687	/nfs/dbraw/zinc/00/76/87/402007687.db2.gz	QTWMJXCJZGSUGK-BZUAXINKSA-N	0	3	309.454	2.071	10	0		DEAEHN
CCCn1cc(CN2CCN(CCOCC)[C@H](CC)C2)cn1	ZINC000120998499	402010003	/nfs/dbraw/zinc/01/00/03/402010003.db2.gz	YIUOQWLEHMTWCC-QGZVFWFLSA-N	0	3	308.470	2.226	10	0		DEAEHN
CC(C)N(CCN1CCCCCC1)C(=O)[C@@H](C)N1CCCC1=O	ZINC000055169112	402076991	/nfs/dbraw/zinc/07/69/91/402076991.db2.gz	CAOCHICGJPYUKC-MRXNPFEDSA-N	0	3	323.481	2.110	10	0		DEAEHN
COCc1ccc(C(=O)NC[C@@H](c2ccccc2)N(C)C)o1	ZINC000096990172	402100033	/nfs/dbraw/zinc/10/00/33/402100033.db2.gz	LECJINVWEUTVBP-HNNXBMFYSA-N	0	3	302.374	2.459	10	0		DEAEHN
COc1cccc(OCC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000123008069	402105418	/nfs/dbraw/zinc/10/54/18/402105418.db2.gz	GIPDBMSVHPKOEJ-ZIAGYGMSSA-N	0	3	306.406	2.015	10	0		DEAEHN
CC(=O)Oc1ccc(CN2CCC[C@H](Cn3cncn3)C2)cc1	ZINC000123129762	402112328	/nfs/dbraw/zinc/11/23/28/402112328.db2.gz	LPIOIMMAXWKUGQ-INIZCTEOSA-N	0	3	314.389	2.116	10	0		DEAEHN
COc1ccc(OC)c([C@@H](C)NC[C@H](C)N2CCOCC2)c1	ZINC000123253118	402118081	/nfs/dbraw/zinc/11/80/81/402118081.db2.gz	MGELOZXIYQVUKJ-UONOGXRCSA-N	0	3	308.422	2.075	10	0		DEAEHN
CCOc1ccc(CN2CCN(C[C@](C)(O)CC)CC2)cc1	ZINC000123254910	402118267	/nfs/dbraw/zinc/11/82/67/402118267.db2.gz	RBGZWMMMQQICKX-GOSISDBHSA-N	0	3	306.450	2.364	10	0		DEAEHN
Nc1cc(C(=O)NCCN2CCCC2)cc(Cl)c1Cl	ZINC000054110446	402062795	/nfs/dbraw/zinc/06/27/95/402062795.db2.gz	TUXQWKXLKUMEGZ-UHFFFAOYSA-N	0	3	302.205	2.401	10	0		DEAEHN
Cc1cccc(NC(=O)[C@@H]2CCCN(CCOC(C)C)C2)n1	ZINC000054204423	402064421	/nfs/dbraw/zinc/06/44/21/402064421.db2.gz	MJHJCTMOCDUPSZ-OAHLLOKOSA-N	0	3	305.422	2.466	10	0		DEAEHN
CC[C@@](C)(O)CN1CCN(Cc2ccc(OC)c(F)c2)CC1	ZINC000123289123	402119841	/nfs/dbraw/zinc/11/98/41/402119841.db2.gz	DVZGCESWBZPERO-QGZVFWFLSA-N	0	3	310.413	2.113	10	0		DEAEHN
CC[C@](C)(O)CN(C)C[C@@H](c1cccs1)N1CCOCC1	ZINC000123558186	402134611	/nfs/dbraw/zinc/13/46/11/402134611.db2.gz	FMDDEWRKSZWLRS-HOCLYGCPSA-N	0	3	312.479	2.214	10	0		DEAEHN
COC(=O)c1ccccc1NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000153405953	402143469	/nfs/dbraw/zinc/14/34/69/402143469.db2.gz	XFAWPCIPQBIJHW-QWHCGFSZSA-N	0	3	319.405	2.420	10	0		DEAEHN
CC(C)[C@@H](O)CNC(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000153511359	402150251	/nfs/dbraw/zinc/15/02/51/402150251.db2.gz	SZGHBQAVGMSZLF-SJORKVTESA-N	0	3	319.449	2.140	10	0		DEAEHN
CN(CCN1CCCC1)C(=O)c1coc(Br)c1	ZINC000103117918	402178947	/nfs/dbraw/zinc/17/89/47/402178947.db2.gz	VIXMVOWBGZHIIE-UHFFFAOYSA-N	0	3	301.184	2.210	10	0		DEAEHN
CC[C@@H](O)C[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000124542788	402185161	/nfs/dbraw/zinc/18/51/61/402185161.db2.gz	LJCCYTAGQJVPBI-SECBINFHSA-N	0	3	304.184	2.024	10	0		DEAEHN
C[C@@H](CNC(=O)c1coc(Br)c1)N(C)C1CC1	ZINC000068216620	402187528	/nfs/dbraw/zinc/18/75/28/402187528.db2.gz	WQGIGBMSXPZLQC-QMMMGPOBSA-N	0	3	301.184	2.255	10	0		DEAEHN
O=C(Nc1ccc2n[nH]cc2c1)[C@@H]1CCCN1C1CCOCC1	ZINC000154150530	402195169	/nfs/dbraw/zinc/19/51/69/402195169.db2.gz	LQIYLJAABXBONL-INIZCTEOSA-N	0	3	314.389	2.145	10	0		DEAEHN
CCc1ccc([C@H]2CCCCN2CCCN2C(=O)CNC2=O)o1	ZINC000124830993	402199651	/nfs/dbraw/zinc/19/96/51/402199651.db2.gz	GYTRWCLYSFPMTQ-CQSZACIVSA-N	0	3	319.405	2.311	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)COc1cc(C)ccc1F	ZINC000124188170	402168210	/nfs/dbraw/zinc/16/82/10/402168210.db2.gz	XHZHJXDEFWJACV-AWEZNQCLSA-N	0	3	308.397	2.456	10	0		DEAEHN
COc1cccc(OCCN2CC[C@H](c3cnn(C)c3)C2)c1	ZINC000153832171	402173941	/nfs/dbraw/zinc/17/39/41/402173941.db2.gz	ZXXOBXWGDWJVBV-AWEZNQCLSA-N	0	3	301.390	2.297	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N(C)CCCn1ccnc1)c1ccccc1	ZINC000124319450	402174251	/nfs/dbraw/zinc/17/42/51/402174251.db2.gz	ZDMATJKRADKLBF-HOTGVXAUSA-N	0	3	314.433	2.471	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@H]2OCCc3ccccc32)C1	ZINC000124340845	402175387	/nfs/dbraw/zinc/17/53/87/402175387.db2.gz	PSJJNWJLBXVLOT-COXVUDFISA-N	0	3	302.418	2.145	10	0		DEAEHN
COc1ccc([C@@H](C)NC[C@@H]2CCCN2C)cc1NC(C)=O	ZINC000154609161	402220979	/nfs/dbraw/zinc/22/09/79/402220979.db2.gz	AFBONLIWTZTVDP-DOMZBBRYSA-N	0	3	305.422	2.398	10	0		DEAEHN
CC(C)N(C)CC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000154833210	402234576	/nfs/dbraw/zinc/23/45/76/402234576.db2.gz	KZJPVVITJJUPFA-IBGZPJMESA-N	0	3	317.477	2.498	10	0		DEAEHN
O=S(=O)(Cc1ccccc1)N1CCCC[C@H](N2CCCC2)C1	ZINC000107707749	402239181	/nfs/dbraw/zinc/23/91/81/402239181.db2.gz	BZGBEEOPUNZUDD-KRWDZBQOSA-N	0	3	322.474	2.467	10	0		DEAEHN
COc1cc(CN2CCN(C[C@@H](C)O)[C@@H](C)C2)ccc1SC	ZINC000109328813	402271228	/nfs/dbraw/zinc/27/12/28/402271228.db2.gz	HMFPXKGVXLWYNX-UONOGXRCSA-N	0	3	324.490	2.304	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(C(=O)C(C3CC3)C3CC3)C2)CC1	ZINC000157078039	402291749	/nfs/dbraw/zinc/29/17/49/402291749.db2.gz	IUXWQOFBOKIDRB-KRWDZBQOSA-N	0	3	319.493	2.051	10	0		DEAEHN
CN1CCC(N2CCN(c3ccc(N)cc3Cl)CC2)CC1	ZINC000217658212	402293345	/nfs/dbraw/zinc/29/33/45/402293345.db2.gz	BZYAWQDGVLFOSZ-UHFFFAOYSA-N	0	3	308.857	2.138	10	0		DEAEHN
CCc1cnc(CN(C)C(=O)N[C@H]2CCCN(CC)C2)s1	ZINC000176257513	402294596	/nfs/dbraw/zinc/29/45/96/402294596.db2.gz	LLLNCIJQRGEMJI-LBPRGKRZSA-N	0	3	310.467	2.331	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000176294957	402297597	/nfs/dbraw/zinc/29/75/97/402297597.db2.gz	BZDXGXNXLUHDMF-PBHICJAKSA-N	0	3	319.449	2.366	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)[C@H](C)OCc2ccccc2)[C@@H](C)C1	ZINC000184762582	402298285	/nfs/dbraw/zinc/29/82/85/402298285.db2.gz	GBBBQYJWDPRGHV-ZOBUZTSGSA-N	0	3	304.434	2.437	10	0		DEAEHN
CC(C)C[C@H](C)C(=O)NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000184863224	402305386	/nfs/dbraw/zinc/30/53/86/402305386.db2.gz	HXCFZVFOTJZFDP-MAUKXSAKSA-N	0	3	318.461	2.204	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)NCCc1cc(F)ccc1F	ZINC000176401000	402306053	/nfs/dbraw/zinc/30/60/53/402306053.db2.gz	MFGXPEJXVZXERE-AWEZNQCLSA-N	0	3	311.376	2.291	10	0		DEAEHN
CCN1CCN(c2cccc(NC(=O)N[C@@H]3C[C@@H]3C)c2)CC1	ZINC000184919532	402309064	/nfs/dbraw/zinc/30/90/64/402309064.db2.gz	PJBCQBJNTUPMNC-XJKSGUPXSA-N	0	3	302.422	2.358	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2Cc1cc(-c2cnn(C)c2)no1	ZINC000185020784	402317470	/nfs/dbraw/zinc/31/74/70/402317470.db2.gz	FCTRQTPVBATZOR-CABCVRRESA-N	0	3	315.421	2.134	10	0		DEAEHN
CCN(CC)C(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000176650049	402326391	/nfs/dbraw/zinc/32/63/91/402326391.db2.gz	OPKUCTPPZAVIJW-UHFFFAOYSA-N	0	3	319.449	2.195	10	0		DEAEHN
COC(C)(C)C(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1	ZINC000185335034	402344371	/nfs/dbraw/zinc/34/43/71/402344371.db2.gz	KIDWYQHFBOBSJS-INIZCTEOSA-N	0	3	304.434	2.438	10	0		DEAEHN
COC(=O)c1coc(C(=O)N[C@@H](C)CN2CCCCCC2)c1	ZINC000185443683	402352333	/nfs/dbraw/zinc/35/23/33/402352333.db2.gz	ZYBFFNSBJYJDOI-LBPRGKRZSA-N	0	3	308.378	2.061	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccn(-c2ccccc2)n1	ZINC000177021578	402360490	/nfs/dbraw/zinc/36/04/90/402360490.db2.gz	AWTGPDUFDYPALL-INIZCTEOSA-N	0	3	312.417	2.429	10	0		DEAEHN
COC[C@@H](C)OC[C@H](O)CN[C@H](C)c1cccc(Cl)c1	ZINC000234866023	402361678	/nfs/dbraw/zinc/36/16/78/402361678.db2.gz	YMGLCSLLSWCIRV-LALPHHSUSA-N	0	3	301.814	2.403	10	0		DEAEHN
CCO[C@H]1C[C@H](NCc2cnn3ccccc23)C12CCOCC2	ZINC000185663946	402368073	/nfs/dbraw/zinc/36/80/73/402368073.db2.gz	BDTLOMOUBIBMIM-IRXDYDNUSA-N	0	3	315.417	2.398	10	0		DEAEHN
C[C@H]1OCC[C@]1(O)CNCc1ccc(Br)c(F)c1	ZINC000227971169	402334749	/nfs/dbraw/zinc/33/47/49/402334749.db2.gz	WRDZQEYXZLCCPA-RNCFNFMXSA-N	0	3	318.186	2.218	10	0		DEAEHN
COc1cc(C[NH2+][C@H](C)C[C@H](C)O)cc(Br)c1[O-]	ZINC000228072424	402335824	/nfs/dbraw/zinc/33/58/24/402335824.db2.gz	CDEPNDRAJFDWMU-BDAKNGLRSA-N	0	3	318.211	2.412	10	0		DEAEHN
COc1cccc(F)c1[C@@H](C)NC(=O)C[C@H]1CSCCN1	ZINC000237282717	402402277	/nfs/dbraw/zinc/40/22/77/402402277.db2.gz	FWEMQZKWKBMAOT-MNOVXSKESA-N	0	3	312.410	2.107	10	0		DEAEHN
Cc1ccc(CNC(=O)[C@@]2(F)CCNC2)c(OC(C)(C)C)c1	ZINC000161912486	402403185	/nfs/dbraw/zinc/40/31/85/402403185.db2.gz	GNLKUWJTZHOCJQ-QGZVFWFLSA-N	0	3	308.397	2.490	10	0		DEAEHN
C[C@@H](NC(=O)C1(N)CCCCC1)c1cn(-c2ccccc2)nn1	ZINC000237496711	402410211	/nfs/dbraw/zinc/41/02/11/402410211.db2.gz	KXRQOSXDGOKNAE-CYBMUJFWSA-N	0	3	313.405	2.106	10	0		DEAEHN
Cc1cnn(CCN[C@@H]2CCCN(c3ccccc3F)C2=O)c1	ZINC000162117218	402410428	/nfs/dbraw/zinc/41/04/28/402410428.db2.gz	LTRQLGMMNXKWGP-OAHLLOKOSA-N	0	3	316.380	2.116	10	0		DEAEHN
CC1(C)[C@H](N[C@@H]2CCS(=O)(=O)c3ccccc32)[C@@H]2CCO[C@@H]21	ZINC000186210677	402410615	/nfs/dbraw/zinc/41/06/15/402410615.db2.gz	RGEASEOVDYMELY-XNISGKROSA-N	0	3	321.442	2.308	10	0		DEAEHN
CCC[C@@H](C(=O)NC1CCN(c2cccc(C)n2)CC1)N(C)C	ZINC000162183551	402412700	/nfs/dbraw/zinc/41/27/00/402412700.db2.gz	ZEDZUWUIGPXMJG-INIZCTEOSA-N	0	3	318.465	2.205	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(C)C[C@@H]2CCCN2CC)s1	ZINC000177556416	402415704	/nfs/dbraw/zinc/41/57/04/402415704.db2.gz	KCHVAVLSYWHPNE-ZDUSSCGKSA-N	0	3	324.494	2.374	10	0		DEAEHN
CCO[C@H]1C[C@@H](N[C@@H]2c3ccccc3C[C@@H]2O)C12CCOCC2	ZINC000186271297	402416632	/nfs/dbraw/zinc/41/66/32/402416632.db2.gz	WJOJPPJKOUTQRI-XWTMOSNGSA-N	0	3	317.429	2.209	10	0		DEAEHN
CCC[C@H](C(=O)NCCc1nc2cc(F)ccc2[nH]1)N(C)C	ZINC000162369822	402417838	/nfs/dbraw/zinc/41/78/38/402417838.db2.gz	BRFIJJDDTATMGX-CQSZACIVSA-N	0	3	306.385	2.091	10	0		DEAEHN
CCC[C@H](C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)N(C)C	ZINC000162377187	402418301	/nfs/dbraw/zinc/41/83/01/402418301.db2.gz	YLPNFTNTBZMAMD-GFCCVEGCSA-N	0	3	315.458	2.136	10	0		DEAEHN
CCO[C@H]1C[C@H](NCc2c(C)nn(C)c2C)C12CCOCC2	ZINC000186304332	402419291	/nfs/dbraw/zinc/41/92/91/402419291.db2.gz	CHVKAVJLPQOXLZ-HOTGVXAUSA-N	0	3	307.438	2.101	10	0		DEAEHN
C[C@@H](NCC1(O)CCOCC1)c1ccccc1OC(F)F	ZINC000162609153	402426145	/nfs/dbraw/zinc/42/61/45/402426145.db2.gz	QTRXTQZUIRNBFJ-LLVKDONJSA-N	0	3	301.333	2.480	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H]1CCN(c2ccccc2)C1=O	ZINC000177702619	402428646	/nfs/dbraw/zinc/42/86/46/402428646.db2.gz	IZWRLFMJUKMWCV-DLBZAZTESA-N	0	3	301.434	2.208	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)NCc1ccn2ccnc2c1	ZINC000177712427	402429556	/nfs/dbraw/zinc/42/95/56/402429556.db2.gz	XRSGIKMMBNSWFI-AWEZNQCLSA-N	0	3	315.421	2.008	10	0		DEAEHN
c1ccc(OCc2n[nH]c(CN[C@@H]3CCCSC3)n2)cc1	ZINC000186421560	402430241	/nfs/dbraw/zinc/43/02/41/402430241.db2.gz	XUUUXFUCPNVSBC-GFCCVEGCSA-N	0	3	304.419	2.369	10	0		DEAEHN
CCOC[C@@H](C)NCc1ccc(Cn2ccccc2=O)cc1	ZINC000177931605	402444878	/nfs/dbraw/zinc/44/48/78/402444878.db2.gz	VVVZHBNHEQZEPR-OAHLLOKOSA-N	0	3	300.402	2.411	10	0		DEAEHN
C[C@]1(C(N)=O)CCCCN1CCC(=O)Nc1cccc(Cl)c1	ZINC000185922721	402389634	/nfs/dbraw/zinc/38/96/34/402389634.db2.gz	ADACWYJPTKRZRR-MRXNPFEDSA-N	0	3	323.824	2.399	10	0		DEAEHN
CCOCCC1(CNC(=O)N(C)C[C@@H]2CCCN2CC)CC1	ZINC000161615518	402393448	/nfs/dbraw/zinc/39/34/48/402393448.db2.gz	VEVKEUKQQFAJFT-HNNXBMFYSA-N	0	3	311.470	2.319	10	0		DEAEHN
Brc1ccsc1CNCCCn1ccnn1	ZINC000163758018	402457396	/nfs/dbraw/zinc/45/73/96/402457396.db2.gz	DECIHOUDLQKCBA-UHFFFAOYSA-N	0	3	301.213	2.282	10	0		DEAEHN
CCO[C@H](CCNC(=O)N1CCN2CCC[C@H]2C1)C1CCCC1	ZINC000245480826	402464887	/nfs/dbraw/zinc/46/48/87/402464887.db2.gz	XPUHWEUUVQUSSR-DLBZAZTESA-N	0	3	323.481	2.461	10	0		DEAEHN
CC[C@@H]1CN(Cc2csc(C3CC3)n2)CCN1C[C@H](C)O	ZINC000245588438	402472507	/nfs/dbraw/zinc/47/25/07/402472507.db2.gz	FMRYXCGASYQHNT-SWLSCSKDSA-N	0	3	309.479	2.298	10	0		DEAEHN
COCCCN(C)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000245648129	402476466	/nfs/dbraw/zinc/47/64/66/402476466.db2.gz	MDXAECCBIPIIEY-HZPDHXFCSA-N	0	3	305.422	2.110	10	0		DEAEHN
c1cc(N2CC[C@H](OCCN3CCCCC3)C2)nc(C2CC2)n1	ZINC000165674290	402477783	/nfs/dbraw/zinc/47/77/83/402477783.db2.gz	GQXXQGBYMSHWDI-INIZCTEOSA-N	0	3	316.449	2.435	10	0		DEAEHN
c1cc(N2CC[C@@H](OCCN3CCCCC3)C2)nc(C2CC2)n1	ZINC000165674436	402477824	/nfs/dbraw/zinc/47/78/24/402477824.db2.gz	GQXXQGBYMSHWDI-MRXNPFEDSA-N	0	3	316.449	2.435	10	0		DEAEHN
C[C@@H]1[C@H](C)OCCN1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245685517	402479234	/nfs/dbraw/zinc/47/92/34/402479234.db2.gz	WDBPVGRITHZDFY-WTTBNOFXSA-N	0	3	317.433	2.251	10	0		DEAEHN
C[C@H](CO)N(C)C[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000245685679	402479383	/nfs/dbraw/zinc/47/93/83/402479383.db2.gz	PPPOZEVNNTZJCG-NXEZZACHSA-N	0	3	308.205	2.046	10	0		DEAEHN
CCC(C)(C)NC(=O)[C@@H](C)N1CCC[C@@H]1Cn1ccnc1C	ZINC000178291125	402480467	/nfs/dbraw/zinc/48/04/67/402480467.db2.gz	GFYKTKVHSZTWRA-UKRRQHHQSA-N	0	3	306.454	2.349	10	0		DEAEHN
CC[C@H]1CN(CC2=Cc3ccccc3OC2)CCN1C[C@H](C)O	ZINC000245701559	402480998	/nfs/dbraw/zinc/48/09/98/402480998.db2.gz	DFJYOXLCMQDABV-YJBOKZPZSA-N	0	3	316.445	2.239	10	0		DEAEHN
COc1ccccc1C[C@@H](NCc1nnc(C)n1C)C(C)C	ZINC000178308734	402483326	/nfs/dbraw/zinc/48/33/26/402483326.db2.gz	ZWECLOYWJYOPJR-OAHLLOKOSA-N	0	3	302.422	2.489	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1Cc1nnc(-c2ccco2)o1	ZINC000178309209	402483622	/nfs/dbraw/zinc/48/36/22/402483622.db2.gz	KZKOKHYHRHJHNP-CYBMUJFWSA-N	0	3	313.361	2.499	10	0		DEAEHN
CC(C)[C@H](C(=O)NCc1ccc(CO)c(F)c1)N1CCCCC1	ZINC000178313072	402484097	/nfs/dbraw/zinc/48/40/97/402484097.db2.gz	XWLFUMUBVUDCBG-QGZVFWFLSA-N	0	3	322.424	2.445	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N1CCCC[C@@H]1C	ZINC000178314645	402484194	/nfs/dbraw/zinc/48/41/94/402484194.db2.gz	BLOGNWTZFMIPJV-HOCLYGCPSA-N	0	3	304.438	2.057	10	0		DEAEHN
COC(=O)CCN1CCN(C[C@H](C)c2ccccc2)[C@@H](C)C1	ZINC000245841695	402490240	/nfs/dbraw/zinc/49/02/40/402490240.db2.gz	CRBJBJAGRVBHFP-HOTGVXAUSA-N	0	3	304.434	2.359	10	0		DEAEHN
CN(C[C@@H]1COc2ccccc2O1)[C@H]1Cc2ccccc2[C@H]1O	ZINC000245868635	402492723	/nfs/dbraw/zinc/49/27/23/402492723.db2.gz	QWZPKFVUXGRVBN-SIXWZSSISA-N	0	3	311.381	2.417	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCCc2ccsc2)C1	ZINC000245906041	402496283	/nfs/dbraw/zinc/49/62/83/402496283.db2.gz	FHUUSOOKMDZRLZ-LSDHHAIUSA-N	0	3	307.463	2.416	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](N[C@H](C)CS(=O)(=O)c2ccccc2)C1	ZINC000245921899	402497844	/nfs/dbraw/zinc/49/78/44/402497844.db2.gz	YAMUUOOIEFKCSK-BFYDXBDKSA-N	0	3	324.490	2.167	10	0		DEAEHN
COc1cc(C[NH2+][C@@H](C)CN(C)C)cc(Br)c1[O-]	ZINC000168715751	402498130	/nfs/dbraw/zinc/49/81/30/402498130.db2.gz	UTDSBLNEBOWHQG-VIFPVBQESA-N	0	3	317.227	2.203	10	0		DEAEHN
Cc1cccc(S(=O)(=O)NC[C@H]2CCCN2CC(C)C)c1	ZINC000178815692	402542982	/nfs/dbraw/zinc/54/29/82/402542982.db2.gz	GCUNCWJHSULXLD-OAHLLOKOSA-N	0	3	310.463	2.394	10	0		DEAEHN
CC[C@H]1CN(Cc2cc(-c3ccco3)on2)CCN1C[C@H](C)O	ZINC000247007497	402553414	/nfs/dbraw/zinc/55/34/14/402553414.db2.gz	BWHHUNPDIYSXRN-ZFWWWQNUSA-N	0	3	319.405	2.212	10	0		DEAEHN
CC(C)Oc1cccc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)n1	ZINC000247155637	402558789	/nfs/dbraw/zinc/55/87/89/402558789.db2.gz	XMDKUOKXXWFTHS-KGLIPLIRSA-N	0	3	303.406	2.178	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1coc(Br)c1	ZINC000247270571	402562294	/nfs/dbraw/zinc/56/22/94/402562294.db2.gz	FMWKGZQKSLINES-MWLCHTKSSA-N	0	3	315.211	2.454	10	0		DEAEHN
COCCN(C)CCNC(=O)N[C@H](C)c1cccc(Cl)c1	ZINC000171190789	402564969	/nfs/dbraw/zinc/56/49/69/402564969.db2.gz	FMILXWHQFJZILL-GFCCVEGCSA-N	0	3	313.829	2.278	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000189958670	402568190	/nfs/dbraw/zinc/56/81/90/402568190.db2.gz	YPASLEHCGXPLRL-UONOGXRCSA-N	0	3	322.453	2.427	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)[C@H]1CCOc2ccccc21	ZINC000247538424	402571561	/nfs/dbraw/zinc/57/15/61/402571561.db2.gz	YECHKHWNRWYYFC-YCPHGPKFSA-N	0	3	300.402	2.248	10	0		DEAEHN
C[C@H](NCC1(O)CCOCC1)c1cccc(N2CCCC2=O)c1	ZINC000178636853	402520116	/nfs/dbraw/zinc/52/01/16/402520116.db2.gz	YGHGTXWDPFZCDG-AWEZNQCLSA-N	0	3	318.417	2.006	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cn2ccnc2s1	ZINC000188616868	402521408	/nfs/dbraw/zinc/52/14/08/402521408.db2.gz	RUVIWAGEEJMPAH-NWDGAFQWSA-N	0	3	304.419	2.095	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)N[C@H]1COc2ccccc21	ZINC000246273803	402522052	/nfs/dbraw/zinc/52/20/52/402522052.db2.gz	JCOPEMLUQQSADJ-VHDGCEQUSA-N	0	3	303.406	2.102	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N[C@H]2Cc3ccccc3[C@H]2O)cc1	ZINC000178705950	402528789	/nfs/dbraw/zinc/52/87/89/402528789.db2.gz	PDBCEIFQXNKGJZ-ZWKOTPCHSA-N	0	3	310.397	2.136	10	0		DEAEHN
C[C@@H](OCCCNC(=O)N1CC[C@@H](N(C)C)C1)c1ccccc1	ZINC000170826977	402529945	/nfs/dbraw/zinc/52/99/45/402529945.db2.gz	DLXLAZCPOOLRNG-NVXWUHKLSA-N	0	3	319.449	2.500	10	0		DEAEHN
COc1ccc(C(C)(C)CNC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170835207	402530800	/nfs/dbraw/zinc/53/08/00/402530800.db2.gz	PKYRAMISQLLFNB-HNNXBMFYSA-N	0	3	319.449	2.318	10	0		DEAEHN
COc1cccc2c1CC[C@@H]2NC(=O)NC[C@@H]1CCCN1C	ZINC000246450996	402531772	/nfs/dbraw/zinc/53/17/72/402531772.db2.gz	LNBIBQLZVWSNEQ-WFASDCNBSA-N	0	3	303.406	2.076	10	0		DEAEHN
COCCn1cc(C(=O)N2CC[C@@H](N(C)C)C2)c2ccccc21	ZINC000170855250	402533074	/nfs/dbraw/zinc/53/30/74/402533074.db2.gz	QYERWXKZCDEHHP-CQSZACIVSA-N	0	3	315.417	2.064	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cc(Br)cs2)C1	ZINC000170864437	402535213	/nfs/dbraw/zinc/53/52/13/402535213.db2.gz	AZZWFMBVTSEXHE-SECBINFHSA-N	0	3	303.225	2.287	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)CCN1C	ZINC000246691834	402541123	/nfs/dbraw/zinc/54/11/23/402541123.db2.gz	MXGXKRHEUPLWHK-IBEHDNSVSA-N	0	3	321.465	2.068	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NCc1cn(C(C)(C)C)nn1	ZINC000190840425	402626486	/nfs/dbraw/zinc/62/64/86/402626486.db2.gz	IMMKUJUPBQEMCJ-INIZCTEOSA-N	0	3	315.465	2.296	10	0		DEAEHN
Cc1nn(C)c2ncc(CN3CC[C@]4(O)CCCC[C@H]4C3)cc12	ZINC000247943690	402578777	/nfs/dbraw/zinc/57/87/77/402578777.db2.gz	DHBIVVUTUAKABU-MAUKXSAKSA-N	0	3	314.433	2.404	10	0		DEAEHN
CCO[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCCN(CC)C2)C12CCC2	ZINC000248043616	402581127	/nfs/dbraw/zinc/58/11/27/402581127.db2.gz	ULBGJKLRDCPLHG-HRCADAONSA-N	0	3	323.481	2.460	10	0		DEAEHN
CC(C)CN(C(=O)CN1CC[C@@]2(O)CCCC[C@H]2C1)C1CC1	ZINC000248064608	402581223	/nfs/dbraw/zinc/58/12/23/402581223.db2.gz	MDGJSSZKPFEURK-YJBOKZPZSA-N	0	3	308.466	2.260	10	0		DEAEHN
CC(C)C(=O)N1CCC(NCc2cn3ccccc3n2)CC1	ZINC000171378159	402582631	/nfs/dbraw/zinc/58/26/31/402582631.db2.gz	VVUWCWBVJVCJKM-UHFFFAOYSA-N	0	3	300.406	2.071	10	0		DEAEHN
CNC(=O)c1cccc(CN2CC[C@]3(O)CCCC[C@H]3C2)c1	ZINC000248152706	402584318	/nfs/dbraw/zinc/58/43/18/402584318.db2.gz	QXSRRRXYELMDFT-FUHWJXTLSA-N	0	3	302.418	2.173	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(Cc2cnn(C)c2)C1	ZINC000190462532	402603053	/nfs/dbraw/zinc/60/30/53/402603053.db2.gz	OBODJKBCSQVZMN-AWEZNQCLSA-N	0	3	319.478	2.139	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(Cc2nccs2)C1	ZINC000190472694	402603373	/nfs/dbraw/zinc/60/33/73/402603373.db2.gz	HCZYKYIPXOQAKZ-HNNXBMFYSA-N	0	3	302.447	2.492	10	0		DEAEHN
CCO[C@H]1C[C@H](O)C12CCN(Cc1ccc(O)c(OC)c1)CC2	ZINC000180086753	402606835	/nfs/dbraw/zinc/60/68/35/402606835.db2.gz	FQNKSMFTKZPHSV-IRXDYDNUSA-N	0	3	321.417	2.153	10	0		DEAEHN
CCCn1nc(C)c(CN2C[C@@H](C)[C@H](N3CCOCC3)C2)c1C	ZINC000180224860	402610524	/nfs/dbraw/zinc/61/05/24/402610524.db2.gz	XKAIBTCDGKHAIF-RDTXWAMCSA-N	0	3	320.481	2.062	10	0		DEAEHN
Cc1ccc([C@H](CNC(=O)[C@@H]2CCOC[C@H]2C)N(C)C)cc1	ZINC000248838939	402610591	/nfs/dbraw/zinc/61/05/91/402610591.db2.gz	PMUROGIIBRWQBQ-OIISXLGYSA-N	0	3	304.434	2.387	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248840643	402610620	/nfs/dbraw/zinc/61/06/20/402610620.db2.gz	QNZNMKLTLBCBCR-XBVQOTNRSA-N	0	3	302.418	2.221	10	0		DEAEHN
CC[C@@H](N[C@H]1CCc2ncnn2C1)c1ccc2c(c1)OCCO2	ZINC000180595798	402620899	/nfs/dbraw/zinc/62/08/99/402620899.db2.gz	JDFNGGCAKQIOGL-UONOGXRCSA-N	0	3	314.389	2.105	10	0		DEAEHN
CCn1cc([C@H](C)N[C@@H]2CCc3nc(C(C)C)nn3C2)cn1	ZINC000180653682	402622734	/nfs/dbraw/zinc/62/27/34/402622734.db2.gz	CLPTVXYYTRXSKJ-GXTWGEPZSA-N	0	3	302.426	2.284	10	0		DEAEHN
O=C(NCCOc1cccc(Cl)c1)N1CCN2CCC[C@@H]2C1	ZINC000171902508	402632607	/nfs/dbraw/zinc/63/26/07/402632607.db2.gz	YINGEXHETYQCAI-CQSZACIVSA-N	0	3	323.824	2.208	10	0		DEAEHN
COc1ccc(C[C@@H](C)CN2CCN(CCO)[C@@H](C)C2)cc1F	ZINC000249880133	402643210	/nfs/dbraw/zinc/64/32/10/402643210.db2.gz	HMSYMDINFHLHNB-CABCVRRESA-N	0	3	324.440	2.011	10	0		DEAEHN
C[C@]1(c2ccccc2)CC[C@@H](N2CC[C@@H](NS(C)(=O)=O)C2)C1	ZINC000249942006	402643551	/nfs/dbraw/zinc/64/35/51/402643551.db2.gz	TUGBNZNCHYEFJB-ZACQAIPSSA-N	0	3	322.474	2.120	10	0		DEAEHN
COC[C@H](N[C@@H](CO)c1cccc(Br)c1)C1CC1	ZINC000181391001	402644000	/nfs/dbraw/zinc/64/40/00/402644000.db2.gz	XOIBIQOHMKBJEW-KBPBESRZSA-N	0	3	314.223	2.497	10	0		DEAEHN
CC(C)[C@@H](C)CNC(=O)N(CCN(C)C)Cc1ccccn1	ZINC000172502955	402659315	/nfs/dbraw/zinc/65/93/15/402659315.db2.gz	KUWPWVPRBQTLDO-HNNXBMFYSA-N	0	3	306.454	2.447	10	0		DEAEHN
CCN(CC)C(=O)[C@@H]1CCCN1C(=O)[C@H](C)N1CCCCCC1	ZINC000172365026	402652597	/nfs/dbraw/zinc/65/25/97/402652597.db2.gz	CDDJPIILEBYDDA-HOTGVXAUSA-N	0	3	323.481	2.110	10	0		DEAEHN
CC(C)[C@H](C)CNC(=O)C(=O)Nc1cccc(CN(C)C)c1	ZINC000172531231	402660889	/nfs/dbraw/zinc/66/08/89/402660889.db2.gz	ZYLKKSGDOJCQMF-CYBMUJFWSA-N	0	3	305.422	2.095	10	0		DEAEHN
C[C@@H](C(=O)N(C)Cc1ccccc1)N1CCCN(C2CC2)CC1	ZINC000172541825	402661516	/nfs/dbraw/zinc/66/15/16/402661516.db2.gz	NZALXBKBTTXBFK-INIZCTEOSA-N	0	3	315.461	2.204	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc2ccccc2[nH]c1=O	ZINC000253544387	402668297	/nfs/dbraw/zinc/66/82/97/402668297.db2.gz	NJFTZWMCYUVHNP-MLGOLLRUSA-N	0	3	313.401	2.353	10	0		DEAEHN
Cc1ccccc1OCCCN1CC[C@H](N2CCOCC2)C1	ZINC000173929804	402719234	/nfs/dbraw/zinc/71/92/34/402719234.db2.gz	PIYOAFCBKUMYPX-KRWDZBQOSA-N	0	3	304.434	2.170	10	0		DEAEHN
CN(Cc1ccc(F)cc1)C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000261974008	402720783	/nfs/dbraw/zinc/72/07/83/402720783.db2.gz	ZJYWFYKKGDZVSU-RVKKMQEKSA-N	0	3	320.408	2.317	10	0		DEAEHN
COCc1ccsc1C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000182553813	402699080	/nfs/dbraw/zinc/69/90/80/402699080.db2.gz	PPJOAXBEKLHMKG-OCCSQVGLSA-N	0	3	308.447	2.451	10	0		DEAEHN
Cc1cnc([C@@H](NC(=O)N2CCN3CCC[C@@H]3C2)C2CC2)s1	ZINC000173507283	402700608	/nfs/dbraw/zinc/70/06/08/402700608.db2.gz	SHELAARZQHBWPD-KGLIPLIRSA-N	0	3	320.462	2.392	10	0		DEAEHN
CCc1cnc(CCNC(=O)N[C@H]2CCCN(CC)C2)s1	ZINC000174232561	402732683	/nfs/dbraw/zinc/73/26/83/402732683.db2.gz	ZBVOWUHHELPVSF-LBPRGKRZSA-N	0	3	310.467	2.032	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H](C)Oc2ccccc2F)C1	ZINC000174235562	402733203	/nfs/dbraw/zinc/73/32/03/402733203.db2.gz	LPYUAHGYJVIAEX-KGLIPLIRSA-N	0	3	323.412	2.377	10	0		DEAEHN
CCO[C@H](CCNC(=O)N1CC[C@@H](N2CC=CC2)C1)C(C)C	ZINC000174324521	402736536	/nfs/dbraw/zinc/73/65/36/402736536.db2.gz	FREGVLPPANEOQL-HZPDHXFCSA-N	0	3	309.454	2.093	10	0		DEAEHN
C[C@@H](NCC(=O)N1CCSc2ccccc21)[C@@H]1CCCO1	ZINC000183087034	402737772	/nfs/dbraw/zinc/73/77/72/402737772.db2.gz	WGLGVOSXLWHIEN-OCCSQVGLSA-N	0	3	306.431	2.282	10	0		DEAEHN
COc1ccc2c(c1)CCCN2C(=O)CN[C@H](C)[C@@H]1CCCO1	ZINC000183119946	402740752	/nfs/dbraw/zinc/74/07/52/402740752.db2.gz	MCNVJFMSOAALKV-DYVFJYSZSA-N	0	3	318.417	2.132	10	0		DEAEHN
C[C@@H](NCC(=O)N(C)CCCOc1ccccc1)[C@@H]1CCCO1	ZINC000183124596	402741090	/nfs/dbraw/zinc/74/10/90/402741090.db2.gz	VCPRSCAAYOHKKK-WBVHZDCISA-N	0	3	320.433	2.071	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(F)(F)c1ncccc1C	ZINC000192672862	402744034	/nfs/dbraw/zinc/74/40/34/402744034.db2.gz	AHARBCFCDIAATK-ZDUSSCGKSA-N	0	3	311.376	2.425	10	0		DEAEHN
Cc1ccc([C@@H](O)CN2CCC[C@H](Cn3cncn3)C2)cc1	ZINC000174788100	402757594	/nfs/dbraw/zinc/75/75/94/402757594.db2.gz	BGRIBPCMCBHGDC-RDJZCZTQSA-N	0	3	300.406	2.032	10	0		DEAEHN
CCOc1cccnc1C(=O)NCC(C)(C)N1CCCCC1	ZINC000175909556	402841995	/nfs/dbraw/zinc/84/19/95/402841995.db2.gz	CXOVPBLSNYWHLV-UHFFFAOYSA-N	0	3	305.422	2.475	10	0		DEAEHN
CCOC(=O)c1ccc(NC(=O)N[C@H]2CCCN(CC)C2)cc1	ZINC000194310888	402791579	/nfs/dbraw/zinc/79/15/79/402791579.db2.gz	OEJRXZWDNSLREY-HNNXBMFYSA-N	0	3	319.405	2.469	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)N(C)Cc1ccccc1	ZINC000175342234	402798429	/nfs/dbraw/zinc/79/84/29/402798429.db2.gz	PBYNZURMAMKFPR-KRWDZBQOSA-N	0	3	303.450	2.061	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)CCCOCCc1ccccc1	ZINC000194693261	402811093	/nfs/dbraw/zinc/81/10/93/402811093.db2.gz	SSXGNDSCULILSI-KRWDZBQOSA-N	0	3	304.434	2.236	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)COc1ccc(C(F)(F)F)cc1	ZINC000194695175	402811188	/nfs/dbraw/zinc/81/11/88/402811188.db2.gz	QYSYEQVUCFZDCH-LBPRGKRZSA-N	0	3	316.323	2.295	10	0		DEAEHN
C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC[C@@H]2CCCN2C)c1	ZINC000194702268	402811247	/nfs/dbraw/zinc/81/12/47/402811247.db2.gz	ROSRITZBLOQOJF-KCXAZCMYSA-N	0	3	315.417	2.105	10	0		DEAEHN
COc1ccc(C(=O)NC[C@@H]2CCCN2C)cc1OC(F)F	ZINC000194697623	402811266	/nfs/dbraw/zinc/81/12/66/402811266.db2.gz	YCYASTVPDATESN-NSHDSACASA-N	0	3	314.332	2.121	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)NCc3ccoc3)cc2)CC1	ZINC000175690211	402825556	/nfs/dbraw/zinc/82/55/56/402825556.db2.gz	NCUWXGVLBKBMPH-UHFFFAOYSA-N	0	3	313.401	2.352	10	0		DEAEHN
C[C@@H]1C[C@@H](C(=O)NCC2CCN(CCO)CC2)CC(C)(C)C1	ZINC000184233635	402828584	/nfs/dbraw/zinc/82/85/84/402828584.db2.gz	VIWINJXNVRZKLS-GDBMZVCRSA-N	0	3	310.482	2.269	10	0		DEAEHN
C[C@@H](O)c1ccc(CNC(=O)N2CCCN(C3CC3)CC2)cc1	ZINC000195090223	402831199	/nfs/dbraw/zinc/83/11/99/402831199.db2.gz	XWJKKXGHWLURRG-CQSZACIVSA-N	0	3	317.433	2.120	10	0		DEAEHN
C[S@@](=O)c1ccc(NC(=O)NCCN2CCCCC2)cc1	ZINC000175785792	402832158	/nfs/dbraw/zinc/83/21/58/402832158.db2.gz	XVXVONGQOITMAL-OAQYLSRUSA-N	0	3	309.435	2.031	10	0		DEAEHN
CCOc1ccc(C(=O)N2CCN3CCC[C@@H]3C2)cc1OC	ZINC000195311945	402841662	/nfs/dbraw/zinc/84/16/62/402841662.db2.gz	IFBGRPWJXGJMEL-CQSZACIVSA-N	0	3	304.390	2.014	10	0		DEAEHN
O=C(c1cccnc1SC(F)F)N1CCN2CCC[C@@H]2C1	ZINC000195318416	402841706	/nfs/dbraw/zinc/84/17/06/402841706.db2.gz	GPKVRPXVZBLXPG-SNVBAGLBSA-N	0	3	313.373	2.317	10	0		DEAEHN
CC[C@@H](CNC(=O)N1CC[C@@H](N(C)C)C1)Oc1ccccc1F	ZINC000175957013	402844994	/nfs/dbraw/zinc/84/49/94/402844994.db2.gz	AUTWEHLJCQEPFX-KGLIPLIRSA-N	0	3	323.412	2.329	10	0		DEAEHN
O=C(NC[C@@H](O)CN1CCCCC1)Nc1ccc2[nH]ccc2c1	ZINC000195527726	402850631	/nfs/dbraw/zinc/85/06/31/402850631.db2.gz	AYRZWHMZBFROCP-OAHLLOKOSA-N	0	3	316.405	2.136	10	0		DEAEHN
COc1cc(C[NH2+]CCC(C)(C)O)cc(Br)c1[O-]	ZINC000274746263	403083822	/nfs/dbraw/zinc/08/38/22/403083822.db2.gz	LKNUIJDFZPAXCT-UHFFFAOYSA-N	0	3	318.211	2.414	10	0		DEAEHN
NC(=O)N1CCC(NCc2ccsc2Br)CC1	ZINC000282183178	403130208	/nfs/dbraw/zinc/13/02/08/403130208.db2.gz	GLDQLZFGFOODJD-UHFFFAOYSA-N	0	3	318.240	2.143	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@H]1NCc1sccc1Br	ZINC000282216295	403133216	/nfs/dbraw/zinc/13/32/16/403133216.db2.gz	DRRVARWJVQKOHF-VXNVDRBHSA-N	0	3	303.225	2.267	10	0		DEAEHN
C[C@@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cn[nH]c1	ZINC000285084462	403277686	/nfs/dbraw/zinc/27/76/86/403277686.db2.gz	JSWBJIXJABRAMI-QAPCUYQASA-N	0	3	314.433	2.351	10	0		DEAEHN
CN1CC[C@H](C(=O)N2CCc3c2cccc3Br)C1	ZINC000566908742	292276006	/nfs/dbraw/zinc/27/60/06/292276006.db2.gz	CPNSUVKQONKEGF-JTQLQIEISA-N	0	3	309.207	2.290	10	0		DEAEHN
O=C1COc2ccc(CN3CCOC[C@@H](C4CCC4)C3)cc2N1	ZINC000293997004	403619671	/nfs/dbraw/zinc/61/96/71/403619671.db2.gz	SMRDUZDWTLDLIR-HNNXBMFYSA-N	0	3	316.401	2.266	10	0		DEAEHN
COc1ccccc1[C@H]1[C@@H](N)CCCN1C(=O)[C@@H]1CCCCO1	ZINC000333630436	403797475	/nfs/dbraw/zinc/79/74/75/403797475.db2.gz	ARBQZZULUUTLSD-XIRDDKMYSA-N	0	3	318.417	2.255	10	0		DEAEHN
CS(=O)(=O)NCCCNCc1cc(Cl)sc1Cl	ZINC000312553796	403972582	/nfs/dbraw/zinc/97/25/82/403972582.db2.gz	FHWDEJMMPMJWKI-UHFFFAOYSA-N	0	3	317.263	2.084	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)CCN(C[C@H](O)C(F)(F)F)C1	ZINC000323892147	404096565	/nfs/dbraw/zinc/09/65/65/404096565.db2.gz	GALHLXGFMIILOJ-HIFRSBDPSA-N	0	3	316.367	2.364	10	0		DEAEHN
C[C@@H]1CCN(CC(=O)N2CCC[C@H](C(N)=O)C2)CC12CCC2	ZINC000329157354	404248074	/nfs/dbraw/zinc/24/80/74/404248074.db2.gz	WFSBXTRYFVUDGS-KGLIPLIRSA-N	0	3	307.438	2.272	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)CC2CCN(C)CC2)c1	ZINC000291873273	404559217	/nfs/dbraw/zinc/55/92/17/404559217.db2.gz	HQZACTWQPQEPBU-UHFFFAOYSA-N	0	3	303.406	2.340	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)[C@H](C)N[C@@H]2CCOC2(C)C)cc1	ZINC000451238818	404915229	/nfs/dbraw/zinc/91/52/29/404915229.db2.gz	FAQGVOQRLFCCMM-XHDPSFHLSA-N	0	3	304.390	2.373	10	0		DEAEHN
CCN1CC[C@@H](CNC(=O)[C@@H](C)CC(=O)c2ccccc2F)C1	ZINC000361364070	405040288	/nfs/dbraw/zinc/04/02/88/405040288.db2.gz	ABSLJZCCSLYAJJ-KBPBESRZSA-N	0	3	320.408	2.493	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N2CC[C@@H]3[C@H](CCCN3C3CC3)C2)[nH]1	ZINC000408025448	405091763	/nfs/dbraw/zinc/09/17/63/405091763.db2.gz	BWGAUTNWIQPZOO-CXAGYDPISA-N	0	3	315.417	2.306	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)CC[N@@H+]1C	ZINC000408410588	405200430	/nfs/dbraw/zinc/20/04/30/405200430.db2.gz	VCFIFIAMXSZUQM-DGCLKSJQSA-N	0	3	318.417	2.318	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)CC[N@H+]1C	ZINC000408410588	405200436	/nfs/dbraw/zinc/20/04/36/405200436.db2.gz	VCFIFIAMXSZUQM-DGCLKSJQSA-N	0	3	318.417	2.318	10	0		DEAEHN
COc1cc(C2(C(=O)N3C[C@@H]4CCN(C)[C@@H]4C3)CC2)ccc1C	ZINC000453043371	405278976	/nfs/dbraw/zinc/27/89/76/405278976.db2.gz	WVVIILRMTBIDDX-GOEBONIOSA-N	0	3	314.429	2.198	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCc1csc([C@H](C)OC)n1	ZINC000438411462	405245968	/nfs/dbraw/zinc/24/59/68/405245968.db2.gz	YRFZMHMISQHANB-WCQYABFASA-N	0	3	311.451	2.341	10	0		DEAEHN
CN(C)CCc1ccccc1NC(=O)c1cccc2ncnn21	ZINC000438561436	405250673	/nfs/dbraw/zinc/25/06/73/405250673.db2.gz	KGKGILHTCLYHNF-UHFFFAOYSA-N	0	3	309.373	2.086	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)Nc2ccc(N3CCC3=O)cc2)CCN1C	ZINC000439970430	405298236	/nfs/dbraw/zinc/29/82/36/405298236.db2.gz	ZZSOSOQDCONBQR-TZMCWYRMSA-N	0	3	316.405	2.028	10	0		DEAEHN
c1ccc(CN2CCCO[C@H](CN3CC[C@@]34CCOC4)C2)cc1	ZINC000421016988	405431162	/nfs/dbraw/zinc/43/11/62/405431162.db2.gz	JPVFPBBLGWESEE-OALUTQOASA-N	0	3	316.445	2.142	10	0		DEAEHN
O=C(c1nc2ccccc2nc1C1CC1)N1CCN2CCC[C@H]2C1	ZINC000448924176	405464731	/nfs/dbraw/zinc/46/47/31/405464731.db2.gz	XQULKVPAMWHTLU-AWEZNQCLSA-N	0	3	322.412	2.427	10	0		DEAEHN
CN(CC[C@H]1CCCCN1C)Cc1cccc(S(C)(=O)=O)c1	ZINC000449032310	405508355	/nfs/dbraw/zinc/50/83/55/405508355.db2.gz	XACXYWAFFYUMRA-MRXNPFEDSA-N	0	3	324.490	2.396	10	0		DEAEHN
Cc1nc(CN[C@H]2CN(C)C[C@@H]2C)sc1Br	ZINC000449404364	405548483	/nfs/dbraw/zinc/54/84/83/405548483.db2.gz	ZHSOQNLHTXUTJU-CBAPKCEASA-N	0	3	304.257	2.254	10	0		DEAEHN
Cc1c(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)nnn1C(C)C	ZINC000557837389	405632026	/nfs/dbraw/zinc/63/20/26/405632026.db2.gz	SBZSAOXEJIOMDY-ZDUSSCGKSA-N	0	3	319.453	2.114	10	0		DEAEHN
COC(=O)C(C)(C)N1CCN(CCCc2ccccc2)CC1	ZINC000494404607	405691686	/nfs/dbraw/zinc/69/16/86/405691686.db2.gz	KTMGDYZEVKNOQZ-UHFFFAOYSA-N	0	3	304.434	2.188	10	0		DEAEHN
CC(C)COCCC(=O)N(CCN(C)C)Cc1cccc(O)c1	ZINC000494770704	405761075	/nfs/dbraw/zinc/76/10/75/405761075.db2.gz	PNRYUXQSMOMPET-UHFFFAOYSA-N	0	3	322.449	2.345	10	0		DEAEHN
C[C@@H]1CCCN1C(=O)CCN1CC[C@H](c2nc(C3CC3)no2)C1	ZINC000560367032	405799687	/nfs/dbraw/zinc/79/96/87/405799687.db2.gz	CUYTXZQHWDFPST-OCCSQVGLSA-N	0	3	318.421	2.137	10	0		DEAEHN
C[C@@H](CC1CCC1)NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638994803	405807830	/nfs/dbraw/zinc/80/78/30/405807830.db2.gz	OXYUMNWHIBQMRB-WMLDXEAASA-N	0	3	303.450	2.141	10	0		DEAEHN
CN(C)CCN1CCC(NC(=O)NCC2CCCCCC2)CC1	ZINC000457634148	405929096	/nfs/dbraw/zinc/92/90/96/405929096.db2.gz	HLVFSIQCBSQVMP-UHFFFAOYSA-N	0	3	324.513	2.282	10	0		DEAEHN
c1cc2c(cc1C1(NC[C@H]3COCCO3)CCCC1)OCCO2	ZINC000450522732	405941033	/nfs/dbraw/zinc/94/10/33/405941033.db2.gz	ZQWDAHQLNYNEHL-HNNXBMFYSA-N	0	3	319.401	2.232	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N[C@@H](C)C2=CCN(C)CC2)c1	ZINC000457686531	405949898	/nfs/dbraw/zinc/94/98/98/405949898.db2.gz	AGFLGSDZTQZOSW-ZDUSSCGKSA-N	0	3	316.401	2.162	10	0		DEAEHN
c1c(CN(CC2CC2)CC2CCC2)nnn1C[C@@H]1CCOC1	ZINC000639129567	405909576	/nfs/dbraw/zinc/90/95/76/405909576.db2.gz	UUUUUJJKCBEVNO-INIZCTEOSA-N	0	3	304.438	2.327	10	0		DEAEHN
c1cnc(N[C@H]2CCN(Cc3ccc4nccnc4c3)C2)nc1	ZINC000639280829	406019597	/nfs/dbraw/zinc/01/95/97/406019597.db2.gz	FUASAWHTGNLAPF-AWEZNQCLSA-N	0	3	306.373	2.106	10	0		DEAEHN
C[C@H]1CCN(C(=O)NCCOCCN(C)C)[C@@H](c2ccco2)C1	ZINC000471631994	406102602	/nfs/dbraw/zinc/10/26/02/406102602.db2.gz	ADLRLUDOFCQAEJ-LSDHHAIUSA-N	0	3	323.437	2.340	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@@H]1CC[C@H]2CCC[C@H]2C1	ZINC000533816335	406163490	/nfs/dbraw/zinc/16/34/90/406163490.db2.gz	SHBBHUYRWBLJMR-IJEWVQPXSA-N	0	3	302.422	2.183	10	0		DEAEHN
C[C@H](Cc1ccccc1F)C(=O)NCCNc1ccncc1	ZINC000535261223	406217577	/nfs/dbraw/zinc/21/75/77/406217577.db2.gz	NMCPELPYDRFTJU-CYBMUJFWSA-N	0	3	301.365	2.050	10	0		DEAEHN
CCC(CC)(CCO)CNCc1c(Br)cnn1C	ZINC000487329991	406223803	/nfs/dbraw/zinc/22/38/03/406223803.db2.gz	CZPKXERVXDJVDY-UHFFFAOYSA-N	0	3	318.259	2.461	10	0		DEAEHN
CN(C)CCCN(C)C(=O)CCC(=O)c1ccc(F)cc1F	ZINC000537214950	406286021	/nfs/dbraw/zinc/28/60/21/406286021.db2.gz	GKJDSJVNRBGUNE-UHFFFAOYSA-N	0	3	312.360	2.338	10	0		DEAEHN
COC[C@@H](O)CN1CCC[C@@H](c2nc3ccccc3s2)C1	ZINC000537516690	406292937	/nfs/dbraw/zinc/29/29/37/406292937.db2.gz	FSLUXLNCMRMBHK-OLZOCXBDSA-N	0	3	306.431	2.483	10	0		DEAEHN
CSc1ccc(CN(C)C(=O)CN2CC[C@H](CO)[C@H]2C)cc1	ZINC000488809417	406351201	/nfs/dbraw/zinc/35/12/01/406351201.db2.gz	TXDLRVKXTWEVHW-UKRRQHHQSA-N	0	3	322.474	2.070	10	0		DEAEHN
CC=CC[C@@H]1NC(=O)N([C@@H]2CCN(Cc3ccccc3)C2)C1=O	ZINC000521528084	406351235	/nfs/dbraw/zinc/35/12/35/406351235.db2.gz	ULVGYIGQEBKHGI-JIYQYTEPSA-N	0	3	313.401	2.148	10	0		DEAEHN
c1ccc(N2CC[C@@H](CN3CCN(c4ncccn4)CC3)C2)cc1	ZINC000637836772	406439613	/nfs/dbraw/zinc/43/96/13/406439613.db2.gz	UCTCUZVUOCEUGG-KRWDZBQOSA-N	0	3	323.444	2.125	10	0		DEAEHN
COc1ccccc1NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637869022	406455180	/nfs/dbraw/zinc/45/51/80/406455180.db2.gz	KNHSWHZIQSCHHW-HNNXBMFYSA-N	0	3	313.401	2.093	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637874245	406456722	/nfs/dbraw/zinc/45/67/22/406456722.db2.gz	GFALMFXGXDBFEH-OIISXLGYSA-N	0	3	303.450	2.141	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)N1C[C@H](C)N(C)C[C@@H]1C)CC2	ZINC000526010068	406533104	/nfs/dbraw/zinc/53/31/04/406533104.db2.gz	NFFYGVBIAGLKDH-MELADBBJSA-N	0	3	318.465	2.189	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N1C[C@H](C)N(C)C[C@@H]1C)C2	ZINC000526010068	406533108	/nfs/dbraw/zinc/53/31/08/406533108.db2.gz	NFFYGVBIAGLKDH-MELADBBJSA-N	0	3	318.465	2.189	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N(C(=O)[C@@H](N)CN(C)Cc2ccccc2)C1	ZINC000638007410	406520608	/nfs/dbraw/zinc/52/06/08/406520608.db2.gz	NJMNNTFUYLHKSB-INMHGKMJSA-N	0	3	303.450	2.093	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N(CC1CC1)CC1CC1	ZINC000638007260	406520703	/nfs/dbraw/zinc/52/07/03/406520703.db2.gz	LCGWLURUCBMLRK-SFHVURJKSA-N	0	3	315.461	2.094	10	0		DEAEHN
Cn1nnc2cc(CN3CC[C@H](c4nc(C5CC5)no4)C3)ccc21	ZINC000551927044	406654168	/nfs/dbraw/zinc/65/41/68/406654168.db2.gz	LKKVGYYJFHWZDW-ZDUSSCGKSA-N	0	3	324.388	2.218	10	0		DEAEHN
OCC1(CNCc2ccsc2Br)CCOCC1	ZINC000527680766	406714428	/nfs/dbraw/zinc/71/44/28/406714428.db2.gz	HHXCQIOTZAYXNJ-UHFFFAOYSA-N	0	3	320.252	2.389	10	0		DEAEHN
C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000247364136	287212307	/nfs/dbraw/zinc/21/23/07/287212307.db2.gz	QWJSAEXKLRAQSH-QLFBSQMISA-N	0	3	311.470	2.173	10	0		DEAEHN
O=C1CCCN1CCN1CCC(Nc2ccccc2F)CC1	ZINC000129013928	196012351	/nfs/dbraw/zinc/01/23/51/196012351.db2.gz	YGHIXMAUXXYJOV-UHFFFAOYSA-N	0	3	305.397	2.324	10	0		DEAEHN
CCSc1ccccc1NC(=O)C(C)(C)N1CCNCC1	ZINC000129641786	196063731	/nfs/dbraw/zinc/06/37/31/196063731.db2.gz	KIVXLDLTDNFJJM-UHFFFAOYSA-N	0	3	307.463	2.421	10	0		DEAEHN
CC(C)(C(=O)N1CCC[C@@H]1c1ccsc1)N1CCNCC1	ZINC000129655757	196065349	/nfs/dbraw/zinc/06/53/49/196065349.db2.gz	ODLIMIMVCMZHMU-CQSZACIVSA-N	0	3	307.463	2.095	10	0		DEAEHN
C[C@@H](NC(=O)C(C)(C)N1CCNCC1)c1cccc(Cl)c1	ZINC000129672277	196066522	/nfs/dbraw/zinc/06/65/22/196066522.db2.gz	CQILZKOALCRKST-GFCCVEGCSA-N	0	3	309.841	2.201	10	0		DEAEHN
CC(C)N(Cc1cccs1)C(=O)C(C)(C)N1CCNCC1	ZINC000129704677	196069498	/nfs/dbraw/zinc/06/94/98/196069498.db2.gz	VSOUPSURRKGOJD-UHFFFAOYSA-N	0	3	309.479	2.169	10	0		DEAEHN
CCCn1ncnc1C[C@H](NC)c1ccc(Br)cn1	ZINC000130845970	196115647	/nfs/dbraw/zinc/11/56/47/196115647.db2.gz	CSFKCXDGFIDCSW-LBPRGKRZSA-N	0	3	324.226	2.349	10	0		DEAEHN
CN[C@H](c1ncccc1F)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000131548208	196178573	/nfs/dbraw/zinc/17/85/73/196178573.db2.gz	GYAPQBMIGZPOMF-GVXVVHGQSA-N	0	3	300.399	2.085	10	0		DEAEHN
COCC[C@H](N)C(=O)Nc1ccc(Cl)cc1Br	ZINC000131545047	196178880	/nfs/dbraw/zinc/17/88/80/196178880.db2.gz	CRUPUTOQVXHSAE-VIFPVBQESA-N	0	3	321.602	2.405	10	0		DEAEHN
Cn1cc(CN)c(NC(=O)C2CCC(C(F)(F)F)CC2)n1	ZINC000131855191	196204355	/nfs/dbraw/zinc/20/43/55/196204355.db2.gz	KPFYNQGFNQCPBI-UHFFFAOYSA-N	0	3	304.316	2.186	10	0		DEAEHN
CCCN[C@H](Cc1ccc(F)cc1C)[C@H](C)S(C)(=O)=O	ZINC000131922260	196210879	/nfs/dbraw/zinc/21/08/79/196210879.db2.gz	PCJHAVGKZLZCSE-SWLSCSKDSA-N	0	3	301.427	2.478	10	0		DEAEHN
NC1(C(=O)Nc2ccc(-c3nccs3)cc2)CCOCC1	ZINC000132144443	196229571	/nfs/dbraw/zinc/22/95/71/196229571.db2.gz	HSKWBQTWZBTKTA-UHFFFAOYSA-N	0	3	303.387	2.257	10	0		DEAEHN
Cc1cc(CNCCNC(=O)N(C)C)ccc1Br	ZINC000132163026	196231224	/nfs/dbraw/zinc/23/12/24/196231224.db2.gz	ODHZKIHCWWBQON-UHFFFAOYSA-N	0	3	314.227	2.118	10	0		DEAEHN
CN(CCN1CCCC1)C(=O)c1sc2cccnc2c1N	ZINC000132266115	196239446	/nfs/dbraw/zinc/23/94/46/196239446.db2.gz	XNGMODVSMNZQEC-UHFFFAOYSA-N	0	3	304.419	2.046	10	0		DEAEHN
CCCN(CC(F)(F)F)c1nc(N)nc(N(CC)CC)n1	ZINC000132605816	196270298	/nfs/dbraw/zinc/27/02/98/196270298.db2.gz	HHTMRHMYOWPMOH-UHFFFAOYSA-N	0	3	306.336	2.079	10	0		DEAEHN
NCc1ccccc1CC(=O)N1CCC[C@H](C(F)(F)F)C1	ZINC000133245246	196324204	/nfs/dbraw/zinc/32/42/04/196324204.db2.gz	QJXLNMXPLQQNGR-ZDUSSCGKSA-N	0	3	300.324	2.489	10	0		DEAEHN
CC1(NS(=O)(=O)c2cc(CNC3CC3)ccc2Cl)CC1	ZINC000134132461	196363949	/nfs/dbraw/zinc/36/39/49/196363949.db2.gz	SABYVLBBMHBIPY-UHFFFAOYSA-N	0	3	314.838	2.423	10	0		DEAEHN
N[C@@H](Cc1ccc(Cl)cc1F)[C@H]1CCCCS1(=O)=O	ZINC000134222737	196372061	/nfs/dbraw/zinc/37/20/61/196372061.db2.gz	LGYXDICJTJWYQH-QWHCGFSZSA-N	0	3	305.802	2.316	10	0		DEAEHN
CN1CCC[C@@]2(CC(=O)NC(=O)[C@@H]2c2ccccc2Cl)C1	ZINC000134373007	196382651	/nfs/dbraw/zinc/38/26/51/196382651.db2.gz	OZJQLPKTUKEVSJ-GOEBONIOSA-N	0	3	306.793	2.182	10	0		DEAEHN
CC[C@@H](CCO)NCC(=O)Nc1ccccc1Br	ZINC000134399514	196386173	/nfs/dbraw/zinc/38/61/73/196386173.db2.gz	ASPXMBMNWDZJHM-JTQLQIEISA-N	0	3	315.211	2.138	10	0		DEAEHN
C[C@H]1C[C@H](N(C)S(=O)(=O)CCc2cccs2)CCN1C	ZINC000195384106	225204340	/nfs/dbraw/zinc/20/43/40/225204340.db2.gz	ZCPWSSPSNHCOFM-QWHCGFSZSA-N	0	3	316.492	2.035	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC[C@H](n2ccc(N)n2)CC1	ZINC000616630504	422517393	/nfs/dbraw/zinc/51/73/93/422517393.db2.gz	ZSEWPUIBWQTGDJ-ZDUSSCGKSA-N	0	3	323.441	2.017	10	0		DEAEHN
CC(C)N(C(=O)CN1CCC(Cc2nccn2C)CC1)C(C)C	ZINC000105875639	424849728	/nfs/dbraw/zinc/84/97/28/424849728.db2.gz	WNOJZHZTRCPMGP-UHFFFAOYSA-N	0	3	320.481	2.320	10	0		DEAEHN
CCC1CCC(NC(=O)NC[C@H](O)CN2CCCCC2)CC1	ZINC000194452167	424876351	/nfs/dbraw/zinc/87/63/51/424876351.db2.gz	ZLOUTBUOZYXXQV-GPANFISMSA-N	0	3	311.470	2.101	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Cc2ccc(OC(F)F)cc2)C1	ZINC000194637987	424877576	/nfs/dbraw/zinc/87/75/76/424877576.db2.gz	OEGPYATVRVJVLQ-ZDUSSCGKSA-N	0	3	312.360	2.431	10	0		DEAEHN
Cc1nc(N)nc(N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)n1	ZINC000379686926	424907673	/nfs/dbraw/zinc/90/76/73/424907673.db2.gz	BYFJHDNUQYRWBW-DOMZBBRYSA-N	0	3	312.421	2.227	10	0		DEAEHN
CN(C[C@@H]1CCCN1C)C(=O)c1coc(Br)c1	ZINC000383278647	424910603	/nfs/dbraw/zinc/91/06/03/424910603.db2.gz	ICHAUPSZLWWPPW-JTQLQIEISA-N	0	3	301.184	2.208	10	0		DEAEHN
CN(C)C1(CNC(=O)c2nscc2Br)CCC1	ZINC000404795354	424929607	/nfs/dbraw/zinc/92/96/07/424929607.db2.gz	IQTJSBYWBRXLIO-UHFFFAOYSA-N	0	3	318.240	2.120	10	0		DEAEHN
CN1CCC(NC(=O)Nc2cc(C3(C)CCCC3)on2)CC1	ZINC000572711316	424936652	/nfs/dbraw/zinc/93/66/52/424936652.db2.gz	ZFVAECCYUGEPPP-UHFFFAOYSA-N	0	3	306.410	2.722	10	0		DEAEHN
C[C@H](CO)N(Cc1ccc(C(=O)OC(C)(C)C)cc1)C[C@H](C)O	ZINC000248998234	424886651	/nfs/dbraw/zinc/88/66/51/424886651.db2.gz	YFZYMFJFEXQIJW-KGLIPLIRSA-N	0	3	323.433	2.206	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)Cc1ccccc1N	ZINC000309920463	424893715	/nfs/dbraw/zinc/89/37/15/424893715.db2.gz	VTJUAMFSWXXTLW-HNNXBMFYSA-N	0	3	311.429	2.448	10	0		DEAEHN
CCc1ncnc(NC[C@@H]2CCN(C)[C@H]2c2cccnc2)c1F	ZINC000328628934	424901549	/nfs/dbraw/zinc/90/15/49/424901549.db2.gz	OEVLGKDDMVSELY-BBRMVZONSA-N	0	3	315.396	2.678	10	0		DEAEHN
O[C@@H]1C[C@H](NCc2cccc(-c3cccnc3)c2)[C@H]1n1cccn1	ZINC000657515908	425355360	/nfs/dbraw/zinc/35/53/60/425355360.db2.gz	PRNYFLMRORNVGJ-IPMKNSEASA-N	0	3	320.396	2.409	10	0		DEAEHN
CN(C(=O)COc1ccccc1Cl)[C@@H](CN)C(F)(F)F	ZINC000662976711	425770725	/nfs/dbraw/zinc/77/07/25/425770725.db2.gz	PTHLMJBVKNGCQL-JTQLQIEISA-N	0	3	310.703	2.067	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NCc1cnc(N(C)C)n1C	ZINC000390527410	269097477	/nfs/dbraw/zinc/09/74/77/269097477.db2.gz	JWWKKUUQKYSXOY-AWEZNQCLSA-N	0	3	302.422	2.181	10	0		DEAEHN
CCc1nnc(CNC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)[nH]1	ZINC000392375861	269099644	/nfs/dbraw/zinc/09/96/44/269099644.db2.gz	OTLHTMQDXWOHQH-GFCCVEGCSA-N	0	3	323.441	2.104	10	0		DEAEHN
CCc1nnc(C[NH2+]C[C@H]2CCCN(C(=O)OC(C)(C)C)C2)[n-]1	ZINC000392375861	269099645	/nfs/dbraw/zinc/09/96/45/269099645.db2.gz	OTLHTMQDXWOHQH-GFCCVEGCSA-N	0	3	323.441	2.104	10	0		DEAEHN
C[C@H](C(=O)NCC1(O)CCN(Cc2ccccc2)CC1)C1CC1	ZINC000397615559	269106854	/nfs/dbraw/zinc/10/68/54/269106854.db2.gz	GUROXWAUDHWCMB-HNNXBMFYSA-N	0	3	316.445	2.176	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cncc(Cl)n1	ZINC000189555653	274213191	/nfs/dbraw/zinc/21/31/91/274213191.db2.gz	RTUYJXGEYYJGDL-LBPRGKRZSA-N	0	3	318.808	2.380	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)N[C@@H]1CCc2ccccc21	ZINC000261943393	275888220	/nfs/dbraw/zinc/88/82/20/275888220.db2.gz	VBSRCXMVMSTWHT-WFXMFSGNSA-N	0	3	314.429	2.323	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccccc1-n1cccn1)N(C)C	ZINC000179686238	276021418	/nfs/dbraw/zinc/02/14/18/276021418.db2.gz	MUEHKQHVPORDMB-INIZCTEOSA-N	0	3	300.406	2.219	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@H]1CCOc2ccccc21	ZINC000245428147	276169180	/nfs/dbraw/zinc/16/91/80/276169180.db2.gz	INMBNWOTYLCQHK-ZBFHGGJFSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCN1CCN(C(=O)[C@H](C)N[C@@H](C)c2ccccc2C)CC1	ZINC000120952286	276191332	/nfs/dbraw/zinc/19/13/32/276191332.db2.gz	JPWZULNMERBOMO-HOTGVXAUSA-N	0	3	303.450	2.198	10	0		DEAEHN
COC(=O)CC1(CN2CCc3cccc(OC)c3CC2)CC1	ZINC000440537708	277314193	/nfs/dbraw/zinc/31/41/93/277314193.db2.gz	QLRQBSCTJHZUHR-UHFFFAOYSA-N	0	3	303.402	2.439	10	0		DEAEHN
COC(=O)[C@H](NC[C@@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000358851771	277384782	/nfs/dbraw/zinc/38/47/82/277384782.db2.gz	MWXJABMLUAPWTL-DLBZAZTESA-N	0	3	302.418	2.192	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N[C@@H]1CCC[C@H]2OCC[C@H]21	ZINC000247471002	277478849	/nfs/dbraw/zinc/47/88/49/277478849.db2.gz	QGPVCBUCEBXUBM-QKPAOTATSA-N	0	3	311.470	2.220	10	0		DEAEHN
C[C@@H](NC(=O)c1ccccc1OCCN(C)C)C1CCOCC1	ZINC000152332871	277613130	/nfs/dbraw/zinc/61/31/30/277613130.db2.gz	YMUWWBQLMZMKOD-CQSZACIVSA-N	0	3	320.433	2.172	10	0		DEAEHN
C[C@@H]1CC[C@H](NC(=O)NC[C@](C)(O)CN(C)C)c2ccccc21	ZINC000153150048	277795731	/nfs/dbraw/zinc/79/57/31/277795731.db2.gz	JJBAXKYOMMQCOV-SKDZVZGDSA-N	0	3	319.449	2.237	10	0		DEAEHN
Cc1ccc2c(c1)[C@@H](N[C@@H](C)CN1CCN(C)CC1)CCCO2	ZINC000155013995	278885298	/nfs/dbraw/zinc/88/52/98/278885298.db2.gz	RJODDYCCWQMVLD-WMZOPIPTSA-N	0	3	317.477	2.434	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCSC(C)(C)C1	ZINC000083710849	278970762	/nfs/dbraw/zinc/97/07/62/278970762.db2.gz	AKGQHIKDNRZVEC-ZDUSSCGKSA-N	0	3	301.500	2.500	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H](c1ccccc1)N(C)C	ZINC000137111385	278972845	/nfs/dbraw/zinc/97/28/45/278972845.db2.gz	LBCIXODEBOHKAJ-DLBZAZTESA-N	0	3	305.466	2.382	10	0		DEAEHN
CCN(CC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)C1CC1	ZINC000248137036	279055783	/nfs/dbraw/zinc/05/57/83/279055783.db2.gz	XQQYFKKXCTWFTE-AEFFLSMTSA-N	0	3	301.434	2.032	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCSCC[C@H]1C	ZINC000191119660	279125087	/nfs/dbraw/zinc/12/50/87/279125087.db2.gz	QXEPDAZIGQOGKH-ZIAGYGMSSA-N	0	3	301.500	2.500	10	0		DEAEHN
CC(C)Cc1ccc([C@@H](NCC(=O)NC(N)=O)C2CC2)cc1	ZINC000152628673	279242680	/nfs/dbraw/zinc/24/26/80/279242680.db2.gz	RTTVTTRBLNCXGJ-MRXNPFEDSA-N	0	3	303.406	2.121	10	0		DEAEHN
CC[C@@H](O)CN1CCN(C[C@@H](C)c2ccc(OC)cc2)CC1	ZINC000180163559	280207901	/nfs/dbraw/zinc/20/79/01/280207901.db2.gz	GHJZZDSKBVDTOA-NVXWUHKLSA-N	0	3	306.450	2.187	10	0		DEAEHN
Cc1cc(C)cc(OC[C@H](O)CN2[C@H](C)CC(O)C[C@H]2C)c1	ZINC000249106396	280424196	/nfs/dbraw/zinc/42/41/96/280424196.db2.gz	XDPNGICWRDXHHY-BFYDXBDKSA-N	0	3	307.434	2.277	10	0		DEAEHN
COc1cccc(OC)c1CC(=O)NCCN1CCCC[C@H]1C	ZINC000156001438	295309284	/nfs/dbraw/zinc/30/92/84/295309284.db2.gz	JCNJRIOCMQYPTA-CQSZACIVSA-N	0	3	320.433	2.237	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000247496123	300312609	/nfs/dbraw/zinc/31/26/09/300312609.db2.gz	UQNYMMQLXAHDFE-SRXPKIRMSA-N	0	3	304.434	2.077	10	0		DEAEHN
NC(=O)c1ccc(CN(C[C@H]2CCCO2)[C@@H]2CCSC2)cc1	ZINC000123626000	303343192	/nfs/dbraw/zinc/34/31/92/303343192.db2.gz	WIDXNGBZRRDRKQ-HZPDHXFCSA-N	0	3	320.458	2.272	10	0		DEAEHN
c1c(CNCC[C@H]2COc3ccccc3O2)nc2ncccn12	ZINC000584396424	337317577	/nfs/dbraw/zinc/31/75/77/337317577.db2.gz	PLXRSWZQGMFBBJ-AWEZNQCLSA-N	0	3	310.357	2.049	10	0		DEAEHN
CC/C=C/CCOC[C@@H](O)CNCCOc1ccccc1OC	ZINC000584627943	337376280	/nfs/dbraw/zinc/37/62/80/337376280.db2.gz	XTAYPQWLULFLFP-APHBUQMISA-N	0	3	323.433	2.397	10	0		DEAEHN
C[C@H](N[C@@H]1CCN(c2ncccc2Cl)C1)c1ccnn1C	ZINC000192953532	533988341	/nfs/dbraw/zinc/98/83/41/533988341.db2.gz	UGYFALPRUOBASN-NWDGAFQWSA-N	0	3	305.813	2.398	10	0		DEAEHN
CCN(CC)c1ncc(CNCC[C@H](O)C(F)(F)F)s1	ZINC000349315171	535693053	/nfs/dbraw/zinc/69/30/53/535693053.db2.gz	KUIJJAJRHIFVLZ-JTQLQIEISA-N	0	3	311.373	2.392	10	0		DEAEHN
CC(C)c1ccccc1OC[C@H](O)CN1CCC[C@](C)(O)C1	ZINC000245916777	519847457	/nfs/dbraw/zinc/84/74/57/519847457.db2.gz	NHBKRIFZIKKERN-QAPCUYQASA-N	0	3	307.434	2.397	10	0		DEAEHN
CCCOc1ccc(CN2CCO[C@H](CN(C)C)C2)cc1OC	ZINC000128077818	520352545	/nfs/dbraw/zinc/35/25/45/520352545.db2.gz	XIYWHGHLKPCXNJ-MRXNPFEDSA-N	0	3	322.449	2.246	10	0		DEAEHN
CCC(C)(C)[C@H]1CCCN1CC(=O)N1CCC[C@H](NC(C)=O)C1	ZINC000156974220	521364572	/nfs/dbraw/zinc/36/45/72/521364572.db2.gz	DKXGRACBUQOOHA-JKSUJKDBSA-N	0	3	323.481	2.014	10	0		DEAEHN
CCCN(C[C@@H]1CCCCO1)C(=O)NCCN(CC)C1CC1	ZINC000106555580	521675596	/nfs/dbraw/zinc/67/55/96/521675596.db2.gz	XOLQGVVBYLCCPH-INIZCTEOSA-N	0	3	311.470	2.461	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000131235398	522101840	/nfs/dbraw/zinc/10/18/40/522101840.db2.gz	REZGAZSNHDKVBS-INIZCTEOSA-N	0	3	301.434	2.355	10	0		DEAEHN
COc1cc(C)cc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1O	ZINC000247477581	522234674	/nfs/dbraw/zinc/23/46/74/522234674.db2.gz	UCFOPZREHDYVDU-QWHCGFSZSA-N	0	3	306.406	2.264	10	0		DEAEHN
COC(=O)COc1c(C)cc(CN(C)C[C@H]2CCCO2)cc1C	ZINC000128124634	523215732	/nfs/dbraw/zinc/21/57/32/523215732.db2.gz	OJXOZASBXOEGKC-MRXNPFEDSA-N	0	3	321.417	2.466	10	0		DEAEHN
CC[C@H]1CN(CCOc2ccccc2OC)CCN1CCOC	ZINC000105837204	523281891	/nfs/dbraw/zinc/28/18/91/523281891.db2.gz	ROKUZLYEXPJYCS-INIZCTEOSA-N	0	3	322.449	2.117	10	0		DEAEHN
CC[C@@H]1CN(CCOc2ccccc2OC)CCN1CCOC	ZINC000105837202	523444411	/nfs/dbraw/zinc/44/44/11/523444411.db2.gz	ROKUZLYEXPJYCS-MRXNPFEDSA-N	0	3	322.449	2.117	10	0		DEAEHN
CC(=O)Nc1ccc(N[C@@H]2CCC[C@@H]2[C@H]2COCCN2)cc1	ZINC000262031916	534746686	/nfs/dbraw/zinc/74/66/86/534746686.db2.gz	XQHOROMUEHSZAW-GVDBMIGSSA-N	0	3	303.406	2.214	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)N2CCC(c3cc[nH]n3)CC2)C1	ZINC000156335829	524223950	/nfs/dbraw/zinc/22/39/50/524223950.db2.gz	QZVFKTMGQRIBTG-CQSZACIVSA-N	0	3	319.453	2.031	10	0		DEAEHN
C[C@@H](NC(C)(C)CNC(=O)[C@H]1CSC(=O)N1)c1ccccc1	ZINC000155776348	525385902	/nfs/dbraw/zinc/38/59/02/525385902.db2.gz	FESGACUJDONZFV-DGCLKSJQSA-N	0	3	321.446	2.057	10	0		DEAEHN
C[C@@H]1C[C@H]1NC(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000111599433	525491404	/nfs/dbraw/zinc/49/14/04/525491404.db2.gz	OSMNNRZUMINHGL-NVXWUHKLSA-N	0	3	301.434	2.113	10	0		DEAEHN
C[C@H](c1cnn(C)c1)N(C)C(=O)N[C@@H](C)CN1CCC[C@@H](C)C1	ZINC000245927216	526166113	/nfs/dbraw/zinc/16/61/13/526166113.db2.gz	SXXGBAFEYIACAK-QLFBSQMISA-N	0	3	321.469	2.243	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)NC1CCN(C)CC1	ZINC000154344514	527586428	/nfs/dbraw/zinc/58/64/28/527586428.db2.gz	RCRAQXGJZOBCTR-LBPRGKRZSA-N	0	3	321.469	2.401	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1ccn([C@@H](C)COC)n1	ZINC000189879338	529096859	/nfs/dbraw/zinc/09/68/59/529096859.db2.gz	PJKKODIEZAMPIG-KBPBESRZSA-N	0	3	323.441	2.039	10	0		DEAEHN
CCO[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCCN(CC)C2)C1(C)C	ZINC000247079155	535452502	/nfs/dbraw/zinc/45/25/02/535452502.db2.gz	VIJNQHWPNOSAMW-QLFBSQMISA-N	0	3	311.470	2.316	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)N1CCN(c2ccc(F)cc2OC)CC1	ZINC000262701799	535526021	/nfs/dbraw/zinc/52/60/21/535526021.db2.gz	IYZDZAJYPPPYOI-QGZVFWFLSA-N	0	3	323.412	2.000	10	0		DEAEHN
CCOCCN(C)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000248699678	535566652	/nfs/dbraw/zinc/56/66/52/535566652.db2.gz	ACBSXNFOWNYYDS-NVXWUHKLSA-N	0	3	319.449	2.185	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)NCc1cc(OC)nc2ccccc12	ZINC000262708631	535847623	/nfs/dbraw/zinc/84/76/23/535847623.db2.gz	OEPHTRKCYGQBLK-MEDUHNTESA-N	0	3	301.390	2.233	10	0		DEAEHN
CN1CC[C@H](N2CCC[C@@H](c3nc(-c4ccccc4)c[nH]3)C2)C1=O	ZINC000247539356	536478212	/nfs/dbraw/zinc/47/82/12/536478212.db2.gz	QNXHJKYBSBOPML-WBVHZDCISA-N	0	3	324.428	2.487	10	0		DEAEHN
COc1cc(CNCCN2CC=C(C)CC2)cc(OC)c1OC	ZINC000358165412	536797910	/nfs/dbraw/zinc/79/79/10/536797910.db2.gz	LJHBASUDCCMQOI-UHFFFAOYSA-N	0	3	320.433	2.454	10	0		DEAEHN
COCCOCCC(=O)O[C@H]1CCCN(Cc2ccccc2)C1	ZINC000183175154	625294892	/nfs/dbraw/zinc/29/48/92/625294892.db2.gz	ZMCTVTPIRNPETR-KRWDZBQOSA-N	0	3	321.417	2.247	10	0		DEAEHN
COCC[C@@H](N)C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000052792490	625103535	/nfs/dbraw/zinc/10/35/35/625103535.db2.gz	NYTNZRUVJSKOOH-BXKDBHETSA-N	0	3	304.312	2.246	10	0		DEAEHN
COCC[C@H](N)C(=O)N(C)Cc1ccc(Cl)cc1Cl	ZINC000052808485	625104722	/nfs/dbraw/zinc/10/47/22/625104722.db2.gz	HTFHCCNGKZYUOS-LBPRGKRZSA-N	0	3	305.205	2.316	10	0		DEAEHN
Cc1nc2c(nccc2C(=O)N(CCN(C)C)c2ccccc2)[nH]1	ZINC000435684868	642530127	/nfs/dbraw/zinc/53/01/27/642530127.db2.gz	WLNBEUZQNPYCDE-UHFFFAOYSA-N	0	3	323.400	2.475	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H](C)CC(=O)OCc1ccccc1)N(C)C	ZINC000121527976	650906978	/nfs/dbraw/zinc/90/69/78/650906978.db2.gz	GTKCIPUAUAQYRH-HOCLYGCPSA-N	0	3	320.433	2.355	10	0		DEAEHN
COC(=O)C[C@@]1(NCc2ccc([Si](C)(C)C)cc2)CCOC1	ZINC000801941803	645466605	/nfs/dbraw/zinc/46/66/05/645466605.db2.gz	XTPVOEZTLPOVHM-KRWDZBQOSA-N	0	3	321.493	2.044	10	0		DEAEHN
CCCN(CCN1CCCCC1)C(=O)[C@H]1CCCC12OCCO2	ZINC000804567337	645791446	/nfs/dbraw/zinc/79/14/46/645791446.db2.gz	LXMNRFKPZXAPAP-MRXNPFEDSA-N	0	3	324.465	2.254	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000185301256	649490930	/nfs/dbraw/zinc/49/09/30/649490930.db2.gz	WVCFMTTULFVSEH-CYBMUJFWSA-N	0	3	302.758	2.125	10	0		DEAEHN
C#CCCCCCOC(=O)C1CC[C@H](C(F)(F)F)NC1=O	ZINC000185335966	649499394	/nfs/dbraw/zinc/49/93/94/649499394.db2.gz	YHLXXEGQTOHREW-GHMZBOCLSA-N	0	3	305.296	2.180	10	0		DEAEHN
Cc1nc(CC(=O)N[C@@H](CN(C)C)c2ccccc2)cs1	ZINC000111139362	652514216	/nfs/dbraw/zinc/51/42/16/652514216.db2.gz	MGTOGGSKOUZHEK-HNNXBMFYSA-N	0	3	303.431	2.413	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NCc1nc(Br)c[nH]1	ZINC000380079731	685394378	/nfs/dbraw/zinc/39/43/78/685394378.db2.gz	RWWHAKKTEXLYTC-JTQLQIEISA-N	0	3	301.232	2.136	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCCO[C@@H](CNCc2ccoc2)C1	ZINC000389806505	685436103	/nfs/dbraw/zinc/43/61/03/685436103.db2.gz	LMUQSFRLIHKSKG-AWEZNQCLSA-N	0	3	310.394	2.395	10	0		DEAEHN
CC1(OCC(=O)Nc2ccccc2SC(F)F)CNC1	ZINC000098060505	684056428	/nfs/dbraw/zinc/05/64/28/684056428.db2.gz	NISZFHZGPZVGQN-UHFFFAOYSA-N	0	3	302.346	2.318	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CN1C(=O)C(C)(C)C1(C)C	ZINC000176073407	684332567	/nfs/dbraw/zinc/33/25/67/684332567.db2.gz	BBZAVMCIXNCGMS-AWEZNQCLSA-N	0	3	304.438	2.260	10	0		DEAEHN
COC[C@@H](C)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000187530032	684340191	/nfs/dbraw/zinc/34/01/91/684340191.db2.gz	LQWWVVNIJWJUTL-INIZCTEOSA-N	0	3	321.465	2.007	10	0		DEAEHN
CN(C)C1(CN(C)S(=O)(=O)/C=C/c2ccccc2)CCC1	ZINC000189135852	684373789	/nfs/dbraw/zinc/37/37/89/684373789.db2.gz	MJFILVQEUMZEQS-JLHYYAGUSA-N	0	3	308.447	2.403	10	0		DEAEHN
CCNS(=O)(=O)CCN[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000223163153	685107244	/nfs/dbraw/zinc/10/72/44/685107244.db2.gz	IHUCOAVMWHDFDG-AWEZNQCLSA-N	0	3	316.854	2.320	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)C[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000246285318	685127169	/nfs/dbraw/zinc/12/71/69/685127169.db2.gz	BWURVULUHSCUPK-LSDHHAIUSA-N	0	3	310.825	2.364	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCC[C@@](C)(O)c2ccccc2)C1	ZINC000249137304	685175635	/nfs/dbraw/zinc/17/56/35/685175635.db2.gz	HROFMMXHAASSPC-SJLPKXTDSA-N	0	3	319.449	2.068	10	0		DEAEHN
Cn1cc(O[C@@H]2COC[C@@H]2NCc2ccc3occc3c2)cn1	ZINC000862495805	686311132	/nfs/dbraw/zinc/31/11/32/686311132.db2.gz	DRKGFIGRZJPODA-DOTOQJQBSA-N	0	3	313.357	2.102	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1CN[C@@H](C)c1ccn(C)n1	ZINC000886095539	692002586	/nfs/dbraw/zinc/00/25/86/692002586.db2.gz	ZSDKYCNPDNRAFU-KHIZAZIESA-N	0	3	317.437	2.199	10	0		DEAEHN
C[C@@](O)(CN1CCC[C@H](CO)CC1)C(F)(F)C(F)(F)F	ZINC000724041295	777228371	/nfs/dbraw/zinc/22/83/71/777228371.db2.gz	NGCWVMDLZJTNAO-VHSXEESVSA-N	0	3	305.287	2.029	10	0		DEAEHN
CCO[C@@H]1C[C@](CO)(NCc2cnc3cc(C)ccn23)C1(C)C	ZINC000186578278	784405053	/nfs/dbraw/zinc/40/50/53/784405053.db2.gz	ZWZZDDGIUXYMAA-CRAIPNDOSA-N	0	3	317.433	2.298	10	0		DEAEHN
COc1cncc(CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)c1	ZINC000721860229	787324249	/nfs/dbraw/zinc/32/42/49/787324249.db2.gz	KKVGOHXVZYTAAR-IUODEOHRSA-N	0	3	321.421	2.435	10	0		DEAEHN
Cc1nccnc1[C@@H](C)NCC1CN(C(=O)OC(C)(C)C)C1	ZINC000397637152	790207740	/nfs/dbraw/zinc/20/77/40/790207740.db2.gz	PVPKSKOPQKAIQI-GFCCVEGCSA-N	0	3	306.410	2.303	10	0		DEAEHN
Cc1ccc([O-])c(C[NH2+]C[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)n1	ZINC000715146258	792398072	/nfs/dbraw/zinc/39/80/72/792398072.db2.gz	LQJQBNLJXLIIIM-BETUJISGSA-N	0	3	321.421	2.489	10	0		DEAEHN
NC(=O)C1CC(NCc2cccc(Br)c2Cl)C1	ZINC000716699322	793001445	/nfs/dbraw/zinc/00/14/45/793001445.db2.gz	PRECCPCXLQUXTF-UHFFFAOYSA-N	0	3	317.614	2.456	10	0		DEAEHN
O[C@]1(CCNCc2ccc(CSC(F)F)o2)CCOC1	ZINC000404203378	802008506	/nfs/dbraw/zinc/00/85/06/802008506.db2.gz	SDUBQLWDQORHLV-CYBMUJFWSA-N	0	3	307.362	2.367	10	0		DEAEHN
O[C@@]1(CCNCc2ccc(CSC(F)F)o2)CCOC1	ZINC000404203379	802008886	/nfs/dbraw/zinc/00/88/86/802008886.db2.gz	SDUBQLWDQORHLV-ZDUSSCGKSA-N	0	3	307.362	2.367	10	0		DEAEHN
CO[C@@H]1CCC[C@H](NCc2cn(C)nc2Br)C1	ZINC000720645731	1085803561	/nfs/dbraw/zinc/80/35/61/1085803561.db2.gz	LZIFYTOSECNBSV-WDEREUQCSA-N	0	3	302.216	2.230	10	0		DEAEHN
CN1CCC[C@H]2[C@H]1CCN2C(=O)c1ccc(Br)cn1	ZINC000720819085	1086168813	/nfs/dbraw/zinc/16/88/13/1086168813.db2.gz	YFTOEBIZYRDAMV-OLZOCXBDSA-N	0	3	324.222	2.153	10	0		DEAEHN
CN1CCC[C@@H]2[C@@H]1CCN2C(=O)c1ccncc1Br	ZINC000720831073	1086193803	/nfs/dbraw/zinc/19/38/03/1086193803.db2.gz	SBQWAQIFNXHVIA-QWHCGFSZSA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)[C@@H](N)CN(C)C	ZINC000705405600	1086615621	/nfs/dbraw/zinc/61/56/21/1086615621.db2.gz	MRKKICPSJLYLFC-RNCFNFMXSA-N	0	3	318.248	2.402	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@@]2(NCc3cncnc3)CCC[C@H]12	ZINC000711639363	1087175822	/nfs/dbraw/zinc/17/58/22/1087175822.db2.gz	KOGQPVRYQRJKSB-YOEHRIQHSA-N	0	3	318.421	2.498	10	0		DEAEHN
CCN[C@@H](CSCCS(C)(=O)=O)c1ccc(C)cc1	ZINC000081769099	192322638	/nfs/dbraw/zinc/32/26/38/192322638.db2.gz	WGJJWCGHUQCTAZ-AWEZNQCLSA-N	0	3	301.477	2.423	10	0		DEAEHN
CN[C@H](CSCCS(C)(=O)=O)c1cc2ccccc2o1	ZINC000081769094	192322759	/nfs/dbraw/zinc/32/27/59/192322759.db2.gz	GFSRAAUXQOWFCL-GFCCVEGCSA-N	0	3	313.444	2.471	10	0		DEAEHN
CCCc1ccc([C@@H](N)CSCCS(C)(=O)=O)cc1	ZINC000081768931	192323436	/nfs/dbraw/zinc/32/34/36/192323436.db2.gz	XHMCDSDGNPGZGF-AWEZNQCLSA-N	0	3	301.477	2.417	10	0		DEAEHN
CCCN[C@H]1CCOC[C@H]1S(=O)(=O)c1ccc(Cl)cc1	ZINC000081920246	192338970	/nfs/dbraw/zinc/33/89/70/192338970.db2.gz	USNOKJSILKTHLW-UONOGXRCSA-N	0	3	317.838	2.271	10	0		DEAEHN
CCOc1ccc2c(c1)[C@H](N[C@H]1CCC(=O)N(C)C1)CCO2	ZINC000152387422	282143603	/nfs/dbraw/zinc/14/36/03/282143603.db2.gz	LUAJGWNRDNFAJY-SWLSCSKDSA-N	0	3	304.390	2.119	10	0		DEAEHN
CCCN[C@@](CSc1ccc(Cl)cn1)(C(N)=O)C1CC1	ZINC000079448476	185172325	/nfs/dbraw/zinc/17/23/25/185172325.db2.gz	XHRLWBXXHARYDP-CQSZACIVSA-N	0	3	313.854	2.461	10	0		DEAEHN
CC(C)NCCS(=O)(=O)N1CCC[C@@H](C(C)(C)C)CC1	ZINC000079358465	185166973	/nfs/dbraw/zinc/16/69/73/185166973.db2.gz	NOTIIRHEHMDRJI-CQSZACIVSA-N	0	3	304.500	2.462	10	0		DEAEHN
CCc1noc(CC)c1CC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000153039046	282160125	/nfs/dbraw/zinc/16/01/25/282160125.db2.gz	WMHMQVWEUIKXJE-OLZOCXBDSA-N	0	3	307.438	2.283	10	0		DEAEHN
CN1CCN(c2ccc(Nc3ncnc4[nH]ccc43)cc2)CC1	ZINC000082359431	185177741	/nfs/dbraw/zinc/17/77/41/185177741.db2.gz	HDDVDICYSWQRQV-UHFFFAOYSA-N	0	3	308.389	2.453	10	0		DEAEHN
COc1ccc(Br)c(C[C@@H](N)c2ccn(C)n2)c1	ZINC000087795866	185232219	/nfs/dbraw/zinc/23/22/19/185232219.db2.gz	HFUDJKYDDFXLSW-GFCCVEGCSA-N	0	3	310.195	2.434	10	0		DEAEHN
CC[C@@H](N)CS(=O)(=O)Cc1cccc(Br)c1	ZINC000088075040	185238937	/nfs/dbraw/zinc/23/89/37/185238937.db2.gz	PKKGKTUSNKDIJZ-LLVKDONJSA-N	0	3	306.225	2.101	10	0		DEAEHN
COCCCN(CCOC)Cc1ccc2nc(N)sc2c1	ZINC000087848092	185233235	/nfs/dbraw/zinc/23/32/35/185233235.db2.gz	SPCMQUBPHOKXBA-UHFFFAOYSA-N	0	3	309.435	2.363	10	0		DEAEHN
C[C@H](CN1CCCC1)NC(=O)c1ccc2nc(N)sc2c1	ZINC000087847492	185233262	/nfs/dbraw/zinc/23/32/62/185233262.db2.gz	PZNFJNCJTMKCHW-SNVBAGLBSA-N	0	3	304.419	2.093	10	0		DEAEHN
CN[C@@](C)(C[C@@H](C)N1CCC(C(F)(F)F)CC1)C(=O)OC	ZINC000088435530	185250485	/nfs/dbraw/zinc/25/04/85/185250485.db2.gz	YUYXQXOFVMFROW-MFKMUULPSA-N	0	3	310.360	2.190	10	0		DEAEHN
CCC(C)(C)[C@H]1CC[C@@H](N)[C@H](S(=O)(=O)CCCOC)C1	ZINC000081986387	192349247	/nfs/dbraw/zinc/34/92/47/192349247.db2.gz	LRHZHTUOBBUMSL-BFHYXJOUSA-N	0	3	305.484	2.370	10	0		DEAEHN
c1cnn(C[C@@H](NCCOC2CCOCC2)c2ccccc2)c1	ZINC000625254091	365698523	/nfs/dbraw/zinc/69/85/23/365698523.db2.gz	HYTKHJOWOUTKNQ-GOSISDBHSA-N	0	3	315.417	2.410	10	0		DEAEHN
CCC[C@H](C(=O)NCC[C@@H](C)NC(=O)OC(C)(C)C)N(C)C	ZINC000179148296	282216150	/nfs/dbraw/zinc/21/61/50/282216150.db2.gz	WSPRYLBDFAPRLW-CHWSQXEVSA-N	0	3	315.458	2.136	10	0		DEAEHN
C[C@@H](N[C@@H]1CCCS(=O)(=O)C1)c1ccccc1-n1cccn1	ZINC000090016376	185278394	/nfs/dbraw/zinc/27/83/94/185278394.db2.gz	MHVQAAQSVPAWPQ-ZIAGYGMSSA-N	0	3	319.430	2.100	10	0		DEAEHN
N[C@@H]1COC[C@@H]1c1nc(-c2ccc(Br)s2)no1	ZINC000090364814	185292874	/nfs/dbraw/zinc/29/28/74/185292874.db2.gz	GASXRQZMWHFCFF-NTSWFWBYSA-N	0	3	316.180	2.002	10	0		DEAEHN
CN[C@@H]1COC[C@H]1c1nc(-c2ccc(Br)cc2)no1	ZINC000090423226	185295373	/nfs/dbraw/zinc/29/53/73/185295373.db2.gz	DVNRYDISQNTSBQ-GHMZBOCLSA-N	0	3	324.178	2.201	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)N(C)Cc1cc(Cl)cc(Cl)c1	ZINC000090435295	185296450	/nfs/dbraw/zinc/29/64/50/185296450.db2.gz	GGFPMKRSCFOZFI-CHWSQXEVSA-N	0	3	317.216	2.186	10	0		DEAEHN
C[C@]1(C(=O)Nc2nc3ccc(Cl)cc3s2)COC[C@H]1N	ZINC000090580320	185304981	/nfs/dbraw/zinc/30/49/81/185304981.db2.gz	LFBCPXSGCSWRBI-MFKMUULPSA-N	0	3	311.794	2.252	10	0		DEAEHN
C[C@@]1(C(=O)Nc2ccc(Cl)c3ncccc23)COC[C@@H]1N	ZINC000090588953	185305560	/nfs/dbraw/zinc/30/55/60/185305560.db2.gz	FMFDPSNHDSRVHH-SWLSCSKDSA-N	0	3	305.765	2.191	10	0		DEAEHN
CN(Cc1cc(Cl)cc(Cl)c1)C(=O)[C@]1(C)COC[C@H]1N	ZINC000090593642	185305817	/nfs/dbraw/zinc/30/58/17/185305817.db2.gz	MRBRZIVGYPMDGB-TZMCWYRMSA-N	0	3	317.216	2.316	10	0		DEAEHN
CC(C)S(=O)(=O)N1CCCSC[C@H]1CN1CCCCC1	ZINC000090701909	185310526	/nfs/dbraw/zinc/31/05/26/185310526.db2.gz	KOQPNJXAEWXBIB-CQSZACIVSA-N	0	3	320.524	2.018	10	0		DEAEHN
C[C@H](Oc1ccccc1)C(=O)N1CCCSC[C@H]1CN(C)C	ZINC000090699926	185310534	/nfs/dbraw/zinc/31/05/34/185310534.db2.gz	LOAKKQBORCVDHK-LSDHHAIUSA-N	0	3	322.474	2.350	10	0		DEAEHN
Cc1ccc(CCC(=O)N[C@@H](C)CCN2CCN(C)CC2)cc1	ZINC000184358658	282252746	/nfs/dbraw/zinc/25/27/46/282252746.db2.gz	YZMNLWQTFLJELV-KRWDZBQOSA-N	0	3	317.477	2.070	10	0		DEAEHN
COC(=O)c1cc2cc(CN(C)CC3(CO)CC3)ccc2o1	ZINC000186788927	282284000	/nfs/dbraw/zinc/28/40/00/282284000.db2.gz	SEDPETOTFXUCRB-UHFFFAOYSA-N	0	3	303.358	2.424	10	0		DEAEHN
COc1ccc(C[C@H](C)CN2CCCNC(=O)[C@@H]2C)cc1F	ZINC000189082807	282307399	/nfs/dbraw/zinc/30/73/99/282307399.db2.gz	HKRBMZARSZXTMN-STQMWFEESA-N	0	3	308.397	2.223	10	0		DEAEHN
CN(C[C@@H](O)Cc1ccccc1C(F)(F)F)[C@H]1CCOC1	ZINC000443622939	529944081	/nfs/dbraw/zinc/94/40/81/529944081.db2.gz	XXLMOLLPAGIWLZ-STQMWFEESA-N	0	3	303.324	2.330	10	0		DEAEHN
COC[C@@H](O)CN[C@H](C)c1ccc(Br)cc1OC	ZINC000190435103	282320516	/nfs/dbraw/zinc/32/05/16/282320516.db2.gz	QNVZBYMRZGXJKE-KOLCDFICSA-N	0	3	318.211	2.116	10	0		DEAEHN
CS[C@@H]1CN(C(=O)c2cc(C)[nH]c2C)C[C@H]1N1CCCC1	ZINC000614279332	362338234	/nfs/dbraw/zinc/33/82/34/362338234.db2.gz	VBQZMBPXCWWLCG-HUUCEWRRSA-N	0	3	307.463	2.283	10	0		DEAEHN
CCN(CC)Cc1cccc(NC(=O)C(=O)N(CC)CC)c1	ZINC000193763417	282355858	/nfs/dbraw/zinc/35/58/58/282355858.db2.gz	GWJDMNVRQZIJQF-UHFFFAOYSA-N	0	3	305.422	2.335	10	0		DEAEHN
CC1(OCC(=O)N2CCC[C@H]2c2ccccc2Cl)CNC1	ZINC000098060913	539436062	/nfs/dbraw/zinc/43/60/62/539436062.db2.gz	NNAGKZNYFZMMPC-AWEZNQCLSA-N	0	3	308.809	2.382	10	0		DEAEHN
CN(Cc1ccccc1OC(F)(F)F)C[C@H]1CNCCO1	ZINC000125419431	539472648	/nfs/dbraw/zinc/47/26/48/539472648.db2.gz	QVDKHGRKJFHOQY-GFCCVEGCSA-N	0	3	304.312	2.005	10	0		DEAEHN
C[C@H](C(=O)Nc1ccc(C(N)=O)cc1)N1C[C@@H]2CCCC[C@H]2C1	ZINC000246429215	282443374	/nfs/dbraw/zinc/44/33/74/282443374.db2.gz	STXKJBDXMWYIQW-SNPRPXQTSA-N	0	3	315.417	2.235	10	0		DEAEHN
Cc1nscc1C(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000181823010	199357658	/nfs/dbraw/zinc/35/76/58/199357658.db2.gz	AXIPWFIAPBEZMF-CQSZACIVSA-N	0	3	303.431	2.354	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CC[C@@H](c2ccccc2CO)C1	ZINC000616626090	362899620	/nfs/dbraw/zinc/89/96/20/362899620.db2.gz	QQJRRBLCCXOWRL-CQSZACIVSA-N	0	3	320.433	2.493	10	0		DEAEHN
COc1ccnc(C(=O)N[C@@H](C)CN(C)Cc2ccccc2)c1	ZINC000182089848	539655144	/nfs/dbraw/zinc/65/51/44/539655144.db2.gz	AWCMNWVKYKQLDO-AWEZNQCLSA-N	0	3	313.401	2.341	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1ccc(OC(F)F)cc1)[C@H]1CCCO1	ZINC000183179788	539660356	/nfs/dbraw/zinc/66/03/56/539660356.db2.gz	MEFJBAURILISTG-ZWNOBZJWSA-N	0	3	314.332	2.384	10	0		DEAEHN
FC(F)(F)COc1ccc(CCNCc2cncnc2)cn1	ZINC000187570336	539679579	/nfs/dbraw/zinc/67/95/79/539679579.db2.gz	ZNEQWBCZEBCEIZ-UHFFFAOYSA-N	0	3	312.295	2.145	10	0		DEAEHN
CN(C)c1cccc2c1CN(CCc1nccs1)[C@@H]2CN	ZINC000071683383	191007192	/nfs/dbraw/zinc/00/71/92/191007192.db2.gz	JBXLXPDNQDAVPQ-OAHLLOKOSA-N	0	3	302.447	2.267	10	0		DEAEHN
C[C@@H](O)CN1Cc2ccc(OCc3ccccc3)cc2[C@@H]1CN	ZINC000071684833	191008058	/nfs/dbraw/zinc/00/80/58/191008058.db2.gz	NNAJFTIZVZKGCL-KUHUBIRLSA-N	0	3	312.413	2.462	10	0		DEAEHN
Cn1cc(CN2Cc3ccc(C(F)(F)F)cc3[C@@H]2CN)cn1	ZINC000071684070	191008808	/nfs/dbraw/zinc/00/88/08/191008808.db2.gz	IDXBWVPWEPCTGW-AWEZNQCLSA-N	0	3	310.323	2.455	10	0		DEAEHN
CCNCc1cc(F)c(F)c(S(=O)(=O)N(CC)C(C)C)c1	ZINC000138442948	186016946	/nfs/dbraw/zinc/01/69/46/186016946.db2.gz	NETQGWACFOTYNO-UHFFFAOYSA-N	0	3	320.405	2.493	10	0		DEAEHN
CCN(CC(C)C)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138460568	186016960	/nfs/dbraw/zinc/01/69/60/186016960.db2.gz	IGRDMNSFWWQKCR-UHFFFAOYSA-N	0	3	320.405	2.351	10	0		DEAEHN
CCCCCN(C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138466655	186016985	/nfs/dbraw/zinc/01/69/85/186016985.db2.gz	AIDFEHJNBPTBEU-UHFFFAOYSA-N	0	3	306.378	2.234	10	0		DEAEHN
CN[C@@H](Cc1ccnc(N)c1)c1ncccc1Br	ZINC000140386487	186026690	/nfs/dbraw/zinc/02/66/90/186026690.db2.gz	RGZQKRYYKZNAIN-NSHDSACASA-N	0	3	307.195	2.325	10	0		DEAEHN
CCc1nn(C)c(C[C@H](N)c2cncs2)c1Br	ZINC000147550204	186040889	/nfs/dbraw/zinc/04/08/89/186040889.db2.gz	FPVWXVWYGIFCAZ-ZETCQYMHSA-N	0	3	315.240	2.444	10	0		DEAEHN
CC(C)(C(N)=S)N1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000147661699	186040930	/nfs/dbraw/zinc/04/09/30/186040930.db2.gz	OCTPLRYYFPKPSZ-UHFFFAOYSA-N	0	3	313.417	2.147	10	0		DEAEHN
CC[C@@H]1N[C@H](c2ccsc2)N(C[C@@H]2CCCN(C)C2)C1=O	ZINC000144252840	186034707	/nfs/dbraw/zinc/03/47/07/186034707.db2.gz	QRWMOSUDKLTOHD-SNPRPXQTSA-N	0	3	307.463	2.299	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N(C)C2CCC2)c(C)s1	ZINC000144635653	186036059	/nfs/dbraw/zinc/03/60/59/186036059.db2.gz	BSLUHACAEIZUBE-UHFFFAOYSA-N	0	3	302.465	2.339	10	0		DEAEHN
C[C@H](O)C(C)(C)NCC(=O)Nc1ccccc1Br	ZINC000145021576	186036555	/nfs/dbraw/zinc/03/65/55/186036555.db2.gz	FFFCUNGIDBKSFG-VIFPVBQESA-N	0	3	315.211	2.137	10	0		DEAEHN
Cc1ccc(C)c(OC[C@H](O)CN2CCCN(C3CC3)CC2)c1	ZINC000145737821	186037918	/nfs/dbraw/zinc/03/79/18/186037918.db2.gz	KKVJSAGKSMLZOG-GOSISDBHSA-N	0	3	318.461	2.213	10	0		DEAEHN
O=C(c1cc(-c2ccccc2)[nH]n1)N1CCCN(C2CC2)CC1	ZINC000149113116	186047771	/nfs/dbraw/zinc/04/77/71/186047771.db2.gz	XFAXGUOSVYLOLI-UHFFFAOYSA-N	0	3	310.401	2.387	10	0		DEAEHN
N[C@H](Cc1cn2ccsc2n1)[C@@H]1COc2ccccc2O1	ZINC000149186173	186048744	/nfs/dbraw/zinc/04/87/44/186048744.db2.gz	ZNYSWBQISIMJOM-RISCZKNCSA-N	0	3	301.371	2.106	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)NC[C@H]2C[C@@H]2c2ccccc2)C1	ZINC000252441994	539784244	/nfs/dbraw/zinc/78/42/44/539784244.db2.gz	FYUFMLWIAFPIIA-DJIMGWMZSA-N	0	3	301.434	2.431	10	0		DEAEHN
CCCN[C@H](c1cc(F)cc(F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000150179617	186055298	/nfs/dbraw/zinc/05/52/98/186055298.db2.gz	UBHUJNFKCPZDSS-HZMBPMFUSA-N	0	3	303.374	2.440	10	0		DEAEHN
CCc1nn(C)c(Cl)c1C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000155710272	186105786	/nfs/dbraw/zinc/10/57/86/186105786.db2.gz	HQKNLFGFEORYPK-JQWIXIFHSA-N	0	3	312.845	2.094	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@](C)(O)c1ccccc1Cl)N(C)C	ZINC000155866007	186118698	/nfs/dbraw/zinc/11/86/98/186118698.db2.gz	TVTDMZZPRSZTSC-GOEBONIOSA-N	0	3	312.841	2.394	10	0		DEAEHN
CCCN(CCN(C)C)C(=O)[C@@H](C(=O)OCC)C(C)(C)C	ZINC000164322890	186156238	/nfs/dbraw/zinc/15/62/38/186156238.db2.gz	YHQUGHGPINDSCC-ZDUSSCGKSA-N	0	3	300.443	2.012	10	0		DEAEHN
C[C@@H]1CC[C@@](CO)(N(C)CC(=O)N(C)Cc2ccccc2)C1	ZINC000188004668	186241985	/nfs/dbraw/zinc/24/19/85/186241985.db2.gz	IAJFCDKJJJTVAJ-CRAIPNDOSA-N	0	3	304.434	2.128	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)CC(=O)N(C)Cc2ccccc2)C1	ZINC000188004725	186242125	/nfs/dbraw/zinc/24/21/25/186242125.db2.gz	IAJFCDKJJJTVAJ-QAPCUYQASA-N	0	3	304.434	2.128	10	0		DEAEHN
COC(=O)c1coc(C(=O)N[C@H](CN(C)C)c2ccccc2)c1	ZINC000183866413	186225082	/nfs/dbraw/zinc/22/50/82/186225082.db2.gz	WOIGNZCFXAPOSS-CQSZACIVSA-N	0	3	316.357	2.099	10	0		DEAEHN
COCc1csc(NC(=O)C2Oc3ccccc3O[C@@H]2C)n1	ZINC000172152638	198047943	/nfs/dbraw/zinc/04/79/43/198047943.db2.gz	OZCURHAARLSBKI-NOZJJQNGSA-N	0	3	320.370	2.457	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)CCN2CC[C@@H]3CC[C@@H](O)[C@@H]32)cc1	ZINC000626139570	366073070	/nfs/dbraw/zinc/07/30/70/366073070.db2.gz	QMFGSTJURZMHAP-YXJHDRRASA-N	0	3	316.401	2.063	10	0		DEAEHN
Cc1nc(C)c(Br)c(N2CCC[C@@H]2CN(C)C)n1	ZINC000323190582	539905606	/nfs/dbraw/zinc/90/56/06/539905606.db2.gz	MGYDWFGFGMXXTF-LLVKDONJSA-N	0	3	313.243	2.386	10	0		DEAEHN
Cc1ccc(O[C@H](C)CNC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000173221579	198197358	/nfs/dbraw/zinc/19/73/58/198197358.db2.gz	ZVTCJZOXYAQPAT-HZPDHXFCSA-N	0	3	317.433	2.252	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)c2cccc(F)c2)[C@H](C)C1	ZINC000173256322	198202731	/nfs/dbraw/zinc/20/27/31/198202731.db2.gz	RYOLLJHINLBBSO-DOMZBBRYSA-N	0	3	314.426	2.177	10	0		DEAEHN
C[C@@H]1CN(C(=O)Nc2ccc3c(c2F)CCNC3)C[C@@H](C)O1	ZINC000333305184	539955095	/nfs/dbraw/zinc/95/50/95/539955095.db2.gz	KWCWPTSPJMXPSL-GHMZBOCLSA-N	0	3	307.369	2.113	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN(CCC(=O)OC(C)C)C2)n1	ZINC000173779660	198250499	/nfs/dbraw/zinc/25/04/99/198250499.db2.gz	RLGZJVUWLNMISK-OAHLLOKOSA-N	0	3	305.422	2.466	10	0		DEAEHN
CO[C@@H](CNC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccccc1	ZINC000173701370	198242442	/nfs/dbraw/zinc/24/24/42/198242442.db2.gz	ZTTJCUSCFJKMOS-SJORKVTESA-N	0	3	315.417	2.030	10	0		DEAEHN
Cc1ccccc1O[C@H](C)CNC(=O)N1CC[C@H](N(C)C)C1	ZINC000173916896	198268467	/nfs/dbraw/zinc/26/84/67/198268467.db2.gz	OGYCRSFAPCDYGU-CABCVRRESA-N	0	3	305.422	2.108	10	0		DEAEHN
CCC[C@@H](N)C(=O)Nc1ccc(Cl)c(C[S@@](C)=O)c1	ZINC000236782269	202006758	/nfs/dbraw/zinc/00/67/58/202006758.db2.gz	BBIUYQABKCXAKX-CWTRNNRKSA-N	0	3	302.827	2.284	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N(CC(=O)NCCCN2CCCCCC2=O)C1	ZINC000076150154	355129972	/nfs/dbraw/zinc/12/99/72/355129972.db2.gz	RUUJALDWOTUIMR-CVEARBPZSA-N	0	3	323.481	2.016	10	0		DEAEHN
COc1ccc2c(c1)CN(C(=O)CC1CCN(C)CC1)CC2	ZINC000362613893	283089173	/nfs/dbraw/zinc/08/91/73/283089173.db2.gz	FHHLAMGSVONJOU-UHFFFAOYSA-N	0	3	302.418	2.312	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)c1ccc2cc(OC)ccc2n1	ZINC000073698961	191343679	/nfs/dbraw/zinc/34/36/79/191343679.db2.gz	ZVKQRSLLQUHMML-AWEZNQCLSA-N	0	3	313.401	2.458	10	0		DEAEHN
CCc1cnc(CNC(=O)N2CCCN(C3CC3)CC2)s1	ZINC000074843309	191372348	/nfs/dbraw/zinc/37/23/48/191372348.db2.gz	WNLVZUKQFHFVGQ-UHFFFAOYSA-N	0	3	308.451	2.085	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)N[C@H](C)[C@H]2CCCO2)o1	ZINC000079620061	355322111	/nfs/dbraw/zinc/32/21/11/355322111.db2.gz	OUMGWUZITRMJJB-GDBMZVCRSA-N	0	3	323.437	2.229	10	0		DEAEHN
CCN1CCN([C@@H](C)CNC(=O)Nc2ccc(C)s2)CC1	ZINC000075409770	191471922	/nfs/dbraw/zinc/47/19/22/191471922.db2.gz	LYLXGIHOTBIKBA-LBPRGKRZSA-N	0	3	310.467	2.204	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)N[C@@H]2COc3ccccc32)C1	ZINC000182523996	283096711	/nfs/dbraw/zinc/09/67/11/283096711.db2.gz	RFUIITOZQHAUMI-FVQBIDKESA-N	0	3	315.417	2.246	10	0		DEAEHN
C[C@@H](CSC(C)(C)C)N[C@@H]1CCN(C2CCOCC2)C1=O	ZINC000367413105	283113521	/nfs/dbraw/zinc/11/35/21/283113521.db2.gz	PEEJIZBAPQFKHO-GXTWGEPZSA-N	0	3	314.495	2.276	10	0		DEAEHN
CCN1CCCN(C(=O)c2ccc3c(c2O)OC(C)(C)C3)CC1	ZINC000094125536	355693816	/nfs/dbraw/zinc/69/38/16/355693816.db2.gz	ROOVXKRDNYQERD-UHFFFAOYSA-N	0	3	318.417	2.274	10	0		DEAEHN
CC(C)[C@H](N)C(=O)N1CC[C@@]2(CC[C@H](CBr)C2)C1	ZINC000095087993	355696399	/nfs/dbraw/zinc/69/63/99/355696399.db2.gz	TYDGVJSORRQXLJ-SGMGOOAPSA-N	0	3	317.271	2.383	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccccc2)[C@H](O)C1	ZINC000114082922	355761211	/nfs/dbraw/zinc/76/12/11/355761211.db2.gz	ZDIVZXZUIPLHNP-HUUCEWRRSA-N	0	3	306.406	2.147	10	0		DEAEHN
CCc1ccc(CN2CCN(C(=O)CN(C)C(C)C)CC2)s1	ZINC000128675142	355830306	/nfs/dbraw/zinc/83/03/06/355830306.db2.gz	PDMPJYBYKMGISU-UHFFFAOYSA-N	0	3	323.506	2.295	10	0		DEAEHN
CC(=O)N1C[C@H](CO)C2(C1)CCN(Cc1ccc(C)s1)CC2	ZINC000169751551	355980131	/nfs/dbraw/zinc/98/01/31/355980131.db2.gz	XERVCDIXDVZKKF-OAHLLOKOSA-N	0	3	322.474	2.109	10	0		DEAEHN
CCC[C@@H](C)CN(C)CC(=O)N1CCC(C(=O)OCC)CC1	ZINC000180013034	356039588	/nfs/dbraw/zinc/03/95/88/356039588.db2.gz	ZQBMYKGAPBZTDJ-CQSZACIVSA-N	0	3	312.454	2.156	10	0		DEAEHN
CC[C@@H]1COCCN1C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179468473	356026696	/nfs/dbraw/zinc/02/66/96/356026696.db2.gz	CQDUFDVWRIWYTH-IXDOHACOSA-N	0	3	317.433	2.252	10	0		DEAEHN
CCc1cnc(CCN[C@@H]2CCCC[C@@H]2S(C)(=O)=O)s1	ZINC000183046463	356157529	/nfs/dbraw/zinc/15/75/29/356157529.db2.gz	NFAURWGSFHMRJY-OLZOCXBDSA-N	0	3	316.492	2.193	10	0		DEAEHN
CCO[C@H](CCNC(=O)N1CCCN(C2CC2)CC1)C(C)C	ZINC000080726658	192186482	/nfs/dbraw/zinc/18/64/82/192186482.db2.gz	AAQQYUXPJJYNPS-MRXNPFEDSA-N	0	3	311.470	2.317	10	0		DEAEHN
NCc1ccc(I)nc1OC(F)(F)F	ZINC000238681158	356305289	/nfs/dbraw/zinc/30/52/89/356305289.db2.gz	URPYDALUUJQGHS-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
C[C@H]1CC[C@](N)(c2ncncc2I)C1	ZINC000306153618	356403091	/nfs/dbraw/zinc/40/30/91/356403091.db2.gz	BAMRFPVGNRERRF-OIBJUYFYSA-N	0	3	303.147	2.055	10	0		DEAEHN
NCc1c(I)cncc1C(F)(F)F	ZINC000307020087	356405798	/nfs/dbraw/zinc/40/57/98/356405798.db2.gz	SQFZNPCIBPVEKH-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
C[C@@H](CCc1ccco1)N[C@@H]1CCCN(c2ncc[nH]c2=O)C1	ZINC000328625900	356463015	/nfs/dbraw/zinc/46/30/15/356463015.db2.gz	DQVFYYHFVKEDNJ-UONOGXRCSA-N	0	3	316.405	2.355	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000236909793	202067689	/nfs/dbraw/zinc/06/76/89/202067689.db2.gz	PJDJAGBYMJQAFX-LNSITVRQSA-N	0	3	309.841	2.408	10	0		DEAEHN
CCC[C@@H](N)C(=O)N[C@H](C)c1ccc(N2CCCC2=O)cc1	ZINC000236995645	202113889	/nfs/dbraw/zinc/11/38/89/202113889.db2.gz	VXCYOZBWSKJFQB-IUODEOHRSA-N	0	3	303.406	2.118	10	0		DEAEHN
CC[C@@H]([NH2+]Cc1cc(Br)c([O-])c(OC)c1)[C@H](C)O	ZINC000386718951	356698495	/nfs/dbraw/zinc/69/84/95/356698495.db2.gz	RMXPUIUEVNTNPT-GZMMTYOYSA-N	0	3	318.211	2.412	10	0		DEAEHN
CN(Cc1ccc(Br)cc1)C[C@@H]1CN(C)CCO1	ZINC000404187780	356732469	/nfs/dbraw/zinc/73/24/69/356732469.db2.gz	BGAYRRQZCRAQOS-AWEZNQCLSA-N	0	3	313.239	2.212	10	0		DEAEHN
COC(=O)COc1c(C)cc(CN[C@H]2CCCOC2)cc1C	ZINC000237175121	202176965	/nfs/dbraw/zinc/17/69/65/202176965.db2.gz	QEQPOGLHNBZFRC-HNNXBMFYSA-N	0	3	307.390	2.124	10	0		DEAEHN
O[C@H](COC[C@H]1CCCO1)CN1CC[C@H](c2ccccc2F)C1	ZINC000582015115	357287108	/nfs/dbraw/zinc/28/71/08/357287108.db2.gz	HZRGVXUKNLROAX-HRCADAONSA-N	0	3	323.408	2.172	10	0		DEAEHN
C=Cn1cc(CNCC2(C(=O)OC(C)(C)C)CCOCC2)cn1	ZINC000592372711	357868072	/nfs/dbraw/zinc/86/80/72/357868072.db2.gz	LPVOMPVEQHEBJZ-UHFFFAOYSA-N	0	3	321.421	2.212	10	0		DEAEHN
CN(Cc1ccc2c[nH]nc2c1)[C@@H]1CCCN(c2cccnn2)C1	ZINC000179495648	199045705	/nfs/dbraw/zinc/04/57/05/199045705.db2.gz	MBTNINOQLOINHT-MRXNPFEDSA-N	0	3	322.416	2.454	10	0		DEAEHN
CC(C)C[C@@H](C)N(C)S(=O)(=O)c1cc(CN)ccc1F	ZINC000089004839	192692485	/nfs/dbraw/zinc/69/24/85/192692485.db2.gz	VXPZMKATGADPNM-LLVKDONJSA-N	0	3	302.415	2.340	10	0		DEAEHN
Cc1ccc(CC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cn1	ZINC000180163147	199124744	/nfs/dbraw/zinc/12/47/44/199124744.db2.gz	ZHKJDMDVVHJCCR-IEBWSBKVSA-N	0	3	309.413	2.494	10	0		DEAEHN
Cc1cc(C(=O)N2CC[C@H](N(C)C)C2)nn1-c1ccc(C)cc1	ZINC000180253415	199136950	/nfs/dbraw/zinc/13/69/50/199136950.db2.gz	DPEUDWQFIOJRIV-INIZCTEOSA-N	0	3	312.417	2.265	10	0		DEAEHN
C[C@H](N[C@H]1CCc2ncnn2C1)c1cnn(Cc2ccccc2)c1	ZINC000180580968	199179770	/nfs/dbraw/zinc/17/97/70/199179770.db2.gz	OPILHUJNVBVQDW-YOEHRIQHSA-N	0	3	322.416	2.189	10	0		DEAEHN
COc1cc(C)c([C@@H](C)N[C@@H]2CCc3ncnn3C2)cc1OC	ZINC000180606155	199183452	/nfs/dbraw/zinc/18/34/52/199183452.db2.gz	RKHBFTAURRYPED-CHWSQXEVSA-N	0	3	316.405	2.269	10	0		DEAEHN
COc1c(C)ccc(NC(=O)N2CCO[C@@H](CN(C)C)C2)c1C	ZINC000181161601	199258682	/nfs/dbraw/zinc/25/86/82/199258682.db2.gz	GOLODIGTTLIQOR-AWEZNQCLSA-N	0	3	321.421	2.106	10	0		DEAEHN
C[C@@H]1C[C@@H]1CN(C)S(=O)(=O)c1ccc(Cl)c(CN)c1	ZINC000089038890	192713618	/nfs/dbraw/zinc/71/36/18/192713618.db2.gz	ABADVOFPUFZBQE-MWLCHTKSSA-N	0	3	302.827	2.075	10	0		DEAEHN
CCOc1cccc2[nH]cc(CC(=O)N3CC[C@@H](N(C)C)C3)c21	ZINC000187448505	200113568	/nfs/dbraw/zinc/11/35/68/200113568.db2.gz	YLDDUBVSUXEQML-CQSZACIVSA-N	0	3	315.417	2.272	10	0		DEAEHN
CCC[C@@H](C)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000187684716	200144569	/nfs/dbraw/zinc/14/45/69/200144569.db2.gz	SJWOLEOBRYCLLJ-IAGOWNOFSA-N	0	3	306.450	2.233	10	0		DEAEHN
C[C@@H]1CC[C@@](CO)(N(C)CC(=O)N2CCc3sccc3C2)C1	ZINC000187944387	200180281	/nfs/dbraw/zinc/18/02/81/200180281.db2.gz	XEIWJGKEVGCXLD-CXAGYDPISA-N	0	3	322.474	2.116	10	0		DEAEHN
CO[C@H]1CN(CCC(=O)NC(=O)Nc2ccccc2)CC[C@H]1C	ZINC000189263765	200372438	/nfs/dbraw/zinc/37/24/38/200372438.db2.gz	QLHIMNIHDIBBGO-HIFRSBDPSA-N	0	3	319.405	2.082	10	0		DEAEHN
CN(C)Cc1c2ccccc2oc1C(=O)N(C)CC1(CO)CC1	ZINC000189160126	200358387	/nfs/dbraw/zinc/35/83/87/200358387.db2.gz	ZTTVNZCJDJUMMH-UHFFFAOYSA-N	0	3	316.401	2.339	10	0		DEAEHN
COc1ccc([C@@H](C)NC(=O)N[C@@H]2CCN(C3CC3)C2)cc1F	ZINC000604161807	360887481	/nfs/dbraw/zinc/88/74/81/360887481.db2.gz	NFCNOKQFVHKMJL-DGCLKSJQSA-N	0	3	321.396	2.431	10	0		DEAEHN
O=C(CN1CCC[C@H]1CCCO)NC12CC3CC(CC(C3)C1)C2	ZINC000607733495	361110364	/nfs/dbraw/zinc/11/03/64/361110364.db2.gz	WWLPJEBETXDRAH-WCWCZOKXSA-N	0	3	320.477	2.308	10	0		DEAEHN
CSCC[C@@H](C)N(C)C(=O)Nc1cnn(CCN(C)C)c1	ZINC000610478447	361405207	/nfs/dbraw/zinc/40/52/07/361405207.db2.gz	YEHSPXQMIUADEM-GFCCVEGCSA-N	0	3	313.471	2.050	10	0		DEAEHN
COC(=O)[C@H](O)C1CCN(Cc2ccccc2C2CC2)CC1	ZINC000611286386	361572892	/nfs/dbraw/zinc/57/28/92/361572892.db2.gz	XUMWGILUIQSUJJ-QGZVFWFLSA-N	0	3	303.402	2.310	10	0		DEAEHN
O=C1[C@H](NC[C@@H]2CCC=CO2)CCN1Cc1ccc(F)cc1	ZINC000194885879	201305959	/nfs/dbraw/zinc/30/59/59/201305959.db2.gz	LYDMSNLWVFWHFY-JKSUJKDBSA-N	0	3	304.365	2.209	10	0		DEAEHN
C[C@H](C(=O)N[C@@H]1CCO[C@H]1c1cccnc1)N1CCCCCC1	ZINC000623139544	364896635	/nfs/dbraw/zinc/89/66/35/364896635.db2.gz	RDCCCMREKRSMFT-OIISXLGYSA-N	0	3	317.433	2.292	10	0		DEAEHN
CCn1c(C[C@H]2CNCCO2)nc2cc(Br)ccc21	ZINC000091293254	193033414	/nfs/dbraw/zinc/03/34/14/193033414.db2.gz	BRQICKVDDXEWFS-NSHDSACASA-N	0	3	324.222	2.350	10	0		DEAEHN
O=C(CCN1CC(CO)C1)Nc1c(Cl)cccc1Cl	ZINC000091478415	193062404	/nfs/dbraw/zinc/06/24/04/193062404.db2.gz	WGCMZYQEDHIMDJ-UHFFFAOYSA-N	0	3	303.189	2.246	10	0		DEAEHN
C[C@@H](NC[C@@H]1COCCN1C)c1sccc1Br	ZINC000624173042	365317947	/nfs/dbraw/zinc/31/79/47/365317947.db2.gz	ZKMZRSUHAUYSKW-NXEZZACHSA-N	0	3	319.268	2.492	10	0		DEAEHN
C[C@@H](NC[C@H]1CN(C)CCO1)c1cccc(Br)c1	ZINC000091666884	193087590	/nfs/dbraw/zinc/08/75/90/193087590.db2.gz	YBZFUXJCOJLHOY-RISCZKNCSA-N	0	3	313.239	2.430	10	0		DEAEHN
CN[C@H](c1ccccc1OC(F)(F)F)[C@H]1CN(C)CCO1	ZINC000091717989	193097454	/nfs/dbraw/zinc/09/74/54/193097454.db2.gz	RSNWCVQPQSJPLX-CHWSQXEVSA-N	0	3	304.312	2.176	10	0		DEAEHN
CN1CCO[C@@H](COc2c(Cl)cc(Cl)cc2CN)C1	ZINC000092054306	193149726	/nfs/dbraw/zinc/14/97/26/193149726.db2.gz	GYOCJCTZGRQMKR-LLVKDONJSA-N	0	3	305.205	2.162	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)c2cccc(C(F)(F)F)n2)CCN1C	ZINC000449941309	241272129	/nfs/dbraw/zinc/27/21/29/241272129.db2.gz	PICFJDCYEDNAQF-VHSXEESVSA-N	0	3	301.312	2.313	10	0		DEAEHN
c1c(CN2CCN(CC3CCCCC3)CC2)nnn1CC1CC1	ZINC000450299826	241660438	/nfs/dbraw/zinc/66/04/38/241660438.db2.gz	QVTDFPQGGSIGSF-UHFFFAOYSA-N	0	3	317.481	2.386	10	0		DEAEHN
CC[C@@H]1C[C@H]1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450819795	242267345	/nfs/dbraw/zinc/26/73/45/242267345.db2.gz	MBCDTLRMWRPNAP-ZHALLVOQSA-N	0	3	316.445	2.128	10	0		DEAEHN
COC[C@@H](N)Cc1cn(-c2ccc(Cl)cc2Cl)nn1	ZINC000630586517	367741610	/nfs/dbraw/zinc/74/16/10/367741610.db2.gz	YWZWUKJAPBQPCC-VIFPVBQESA-N	0	3	301.177	2.090	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)cs1	ZINC000092113671	193161359	/nfs/dbraw/zinc/16/13/59/193161359.db2.gz	ZHXVBYNJIRCLOR-PHIMTYICSA-N	0	3	302.465	2.134	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)cs1	ZINC000092113672	193161450	/nfs/dbraw/zinc/16/14/50/193161450.db2.gz	ZHXVBYNJIRCLOR-GHMZBOCLSA-N	0	3	302.465	2.134	10	0		DEAEHN
CCCNCc1cc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)c(C)o1	ZINC000092113406	193161841	/nfs/dbraw/zinc/16/18/41/193161841.db2.gz	USIACLILMWVPIR-TXEJJXNPSA-N	0	3	314.451	2.364	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCCCC2)c(F)c1	ZINC000092115539	193163442	/nfs/dbraw/zinc/16/34/42/193163442.db2.gz	CAUWVLDOAZIPOS-UHFFFAOYSA-N	0	3	300.399	2.110	10	0		DEAEHN
CC[NH2+]Cc1ccc(S(=O)(=O)[N-]C[C@H](C)CC)c(F)c1	ZINC000092116107	193164075	/nfs/dbraw/zinc/16/40/75/193164075.db2.gz	HWXHEXJMFMZOGP-LLVKDONJSA-N	0	3	302.415	2.260	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)CN[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)c1	ZINC000528757632	284001509	/nfs/dbraw/zinc/00/15/09/284001509.db2.gz	NDUSDBSOKGHRKA-HEKSYOIISA-N	0	3	304.390	2.229	10	0		DEAEHN
c1cc(CN[C@H]2CCO[C@@]3(CCOC3)C2)n(CC2CCC2)n1	ZINC000631105919	368019652	/nfs/dbraw/zinc/01/96/52/368019652.db2.gz	PGKHQPXCMPWSSP-RDJZCZTQSA-N	0	3	305.422	2.111	10	0		DEAEHN
c1cc(CN[C@@H]2CCO[C@@]3(CCOC3)C2)n(CC2CCC2)n1	ZINC000631105922	368019771	/nfs/dbraw/zinc/01/97/71/368019771.db2.gz	PGKHQPXCMPWSSP-WBVHZDCISA-N	0	3	305.422	2.111	10	0		DEAEHN
CC[C@H](C)N[C@@H](CNC(=O)Cc1cn(C)nc1C)c1ccco1	ZINC000451676582	243293190	/nfs/dbraw/zinc/29/31/90/243293190.db2.gz	SSNMNEGJQCDPSS-WFASDCNBSA-N	0	3	318.421	2.110	10	0		DEAEHN
CCC[C@]1(COC)CCCN1C(=O)N[C@@H]1CCCN(CC)C1	ZINC000193471728	284079967	/nfs/dbraw/zinc/07/99/67/284079967.db2.gz	YPXWIVAFZDIVBD-NVXWUHKLSA-N	0	3	311.470	2.461	10	0		DEAEHN
CCC[C@](C)(N)C(=O)NC[C@@H](c1ccco1)N1CCCCC1	ZINC000262297149	203252747	/nfs/dbraw/zinc/25/27/47/203252747.db2.gz	JIBCGCKFPRPJEM-YOEHRIQHSA-N	0	3	307.438	2.440	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO	ZINC000262587922	203341522	/nfs/dbraw/zinc/34/15/22/203341522.db2.gz	TXMBZXDZMRFVQL-MAUKXSAKSA-N	0	3	306.450	2.422	10	0		DEAEHN
Nc1c(C(=O)NCCN2CCCC2)sc2cccc(F)c12	ZINC000093412208	193245594	/nfs/dbraw/zinc/24/55/94/193245594.db2.gz	RGWWLMKHRFCAIB-UHFFFAOYSA-N	0	3	307.394	2.448	10	0		DEAEHN
C[C@H](C[C@@H]1CCC[NH2+]1)Nc1ccc(F)c([N-]S(C)(=O)=O)c1	ZINC000093464390	193256146	/nfs/dbraw/zinc/25/61/46/193256146.db2.gz	LILCWTLGWZGFQY-MNOVXSKESA-N	0	3	315.414	2.140	10	0		DEAEHN
COc1cc(CN2CC[C@@]3(CCOC3)C2)cc2c1OCCO2	ZINC000093820172	193312596	/nfs/dbraw/zinc/31/25/96/193312596.db2.gz	JITSQMCPDNVTNJ-QGZVFWFLSA-N	0	3	305.374	2.079	10	0		DEAEHN
NC(=O)[C@]1(N)CC[C@@H](Sc2ccccc2Br)C1	ZINC000093849007	193317345	/nfs/dbraw/zinc/31/73/45/193317345.db2.gz	MYDLRLCXMAGURA-PELKAZGASA-N	0	3	315.236	2.277	10	0		DEAEHN
CC(C)([C@@H](N)Cc1nc2ccccc2s1)N1CCOCC1	ZINC000094251475	193355238	/nfs/dbraw/zinc/35/52/38/193355238.db2.gz	DPQVZHFSOGYBMV-AWEZNQCLSA-N	0	3	305.447	2.277	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccccc1Cl)N(C)CCS(C)(=O)=O	ZINC000094297395	193356710	/nfs/dbraw/zinc/35/67/10/193356710.db2.gz	VOILHYLVCXBHMJ-KBPBESRZSA-N	0	3	318.870	2.095	10	0		DEAEHN
CN1CCC[C@@H](Nc2nc(C(F)(F)F)ccc2C(N)=S)C1	ZINC000094336014	193360044	/nfs/dbraw/zinc/36/00/44/193360044.db2.gz	VPCKYFVOZNKTNQ-MRVPVSSYSA-N	0	3	318.368	2.241	10	0		DEAEHN
CCC[C@@H](C)NC(=O)[C@H](C)Oc1c(F)cc(CN)cc1F	ZINC000094346196	193363095	/nfs/dbraw/zinc/36/30/95/193363095.db2.gz	QGSGSOPLEMABND-ZJUUUORDSA-N	0	3	300.349	2.496	10	0		DEAEHN
CC(C)NCc1cc(F)c(O[C@@H]2CCS(=O)(=O)C2)c(F)c1	ZINC000094347468	193363347	/nfs/dbraw/zinc/36/33/47/193363347.db2.gz	JLSWNRGBFYONAR-LLVKDONJSA-N	0	3	319.373	2.029	10	0		DEAEHN
CNCc1cc(F)c(OCC(=O)NCCC(C)C)c(F)c1	ZINC000094346615	193363564	/nfs/dbraw/zinc/36/35/64/193363564.db2.gz	IPOXPYVXZHRMRL-UHFFFAOYSA-N	0	3	300.349	2.225	10	0		DEAEHN
CCCN[C@@H](CCCS(=O)(=O)CC)c1ccc(F)cn1	ZINC000094048076	193341802	/nfs/dbraw/zinc/34/18/02/193341802.db2.gz	UPUTZMKSSVXMMV-ZDUSSCGKSA-N	0	3	302.415	2.476	10	0		DEAEHN
CCS(=O)(=O)CCCOc1ccc(CNC(C)(C)C)nc1	ZINC000094211688	193349513	/nfs/dbraw/zinc/34/95/13/193349513.db2.gz	YIRSTAFITZVMSV-UHFFFAOYSA-N	0	3	314.451	2.173	10	0		DEAEHN
CC[C@@](C)(N)C(=O)NCc1cc(F)ccc1Br	ZINC000094235829	193353568	/nfs/dbraw/zinc/35/35/68/193353568.db2.gz	YXAIUVMTFVTVNK-GFCCVEGCSA-N	0	3	303.175	2.332	10	0		DEAEHN
CS(=O)(=O)[C@H]1CCC[C@@H](Oc2c(F)cc(CN)cc2F)C1	ZINC000094634589	193386605	/nfs/dbraw/zinc/38/66/05/193386605.db2.gz	DKCOEOZJIRZVCR-MNOVXSKESA-N	0	3	319.373	2.158	10	0		DEAEHN
CCNCc1c(C)nn([C@@H]2CCC[C@H](S(C)(=O)=O)C2)c1C	ZINC000094643981	193390057	/nfs/dbraw/zinc/39/00/57/193390057.db2.gz	BRGCSZQZOQXFBE-KGLIPLIRSA-N	0	3	313.467	2.138	10	0		DEAEHN
CCN(C)CCNC(=O)c1cc(C(F)(F)F)ccc1NC	ZINC000094596067	193382261	/nfs/dbraw/zinc/38/22/61/193382261.db2.gz	OQJQBXXDPKXVFU-UHFFFAOYSA-N	0	3	303.328	2.429	10	0		DEAEHN
CNc1c(C(=O)NC[C@H](C)N(C)C)cccc1C(F)(F)F	ZINC000094598813	193383158	/nfs/dbraw/zinc/38/31/58/193383158.db2.gz	WDJINNISRNSVPN-VIFPVBQESA-N	0	3	303.328	2.427	10	0		DEAEHN
CC1(CNCC(=O)Nc2ccccc2Br)COC1	ZINC000094722250	193394274	/nfs/dbraw/zinc/39/42/74/193394274.db2.gz	AJYYIHKMAGFLJG-UHFFFAOYSA-N	0	3	313.195	2.014	10	0		DEAEHN
CCn1c(-c2cc(C)oc2C)nnc1N1CCN2CCC[C@H]2C1	ZINC000282774445	217242034	/nfs/dbraw/zinc/24/20/34/217242034.db2.gz	MCHPJRXFSBHTDC-AWEZNQCLSA-N	0	3	315.421	2.459	10	0		DEAEHN
Cc1ccc(CN)cc1S(=O)(=O)NCc1ccccc1F	ZINC000020189412	182195698	/nfs/dbraw/zinc/19/56/98/182195698.db2.gz	DRMYSWCOZPABOL-UHFFFAOYSA-N	0	3	308.378	2.071	10	0		DEAEHN
CC(C)[C@@H]1OCC[C@H]1CN[C@H](C(=O)N(C)C)c1ccccc1	ZINC000267441041	206069369	/nfs/dbraw/zinc/06/93/69/206069369.db2.gz	PDSWPAJXBIVFLT-ULQDDVLXSA-N	0	3	304.434	2.467	10	0		DEAEHN
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccccc1CN	ZINC000022154140	182311364	/nfs/dbraw/zinc/31/13/64/182311364.db2.gz	PWRLOJQQHXCXRG-GFCCVEGCSA-N	0	3	302.399	2.285	10	0		DEAEHN
O=C1C(CNCCc2ccccc2)=CC2=CC=C[C@@H]3CCN1[C@@H]23	ZINC000039287464	183016742	/nfs/dbraw/zinc/01/67/42/183016742.db2.gz	KLIANTXYBOVEAE-VQIMIIECSA-N	0	3	306.409	2.472	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2ccc(SC(F)F)cc2)C1	ZINC000040632700	183111798	/nfs/dbraw/zinc/11/17/98/183111798.db2.gz	CLTZUFLCIYQZQE-ONGXEEELSA-N	0	3	302.346	2.317	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)Nc1sc2c(c1C(=O)OC)CCC2	ZINC000040858863	183143360	/nfs/dbraw/zinc/14/33/60/183143360.db2.gz	DUSJSOHXMZELNL-PRHODGIISA-N	0	3	310.419	2.335	10	0		DEAEHN
CN(C)c1ccc(Br)cc1NC(=O)C(C)(C)N	ZINC000040922311	183149091	/nfs/dbraw/zinc/14/90/91/183149091.db2.gz	LWOYYNZXWTXHDJ-UHFFFAOYSA-N	0	3	300.200	2.191	10	0		DEAEHN
CC(C)NCc1cccc(Br)c1O[C@@H](C)C(N)=O	ZINC000042411852	183265988	/nfs/dbraw/zinc/26/59/88/183265988.db2.gz	UZPRMZDQIGFZFS-VIFPVBQESA-N	0	3	315.211	2.200	10	0		DEAEHN
CC(C)N(CCCO)[C@@H](C)C(=O)Nc1ccc(N)cc1Cl	ZINC000042482887	183275349	/nfs/dbraw/zinc/27/53/49/183275349.db2.gz	WZUKOEOTFJZENC-NSHDSACASA-N	0	3	313.829	2.342	10	0		DEAEHN
CC(C)N(CC(=O)Nc1cccc(C(N)=S)c1)CC1CC1	ZINC000042583336	183286449	/nfs/dbraw/zinc/28/64/49/183286449.db2.gz	QZMJTRLUVGETRP-UHFFFAOYSA-N	0	3	305.447	2.380	10	0		DEAEHN
CC(C)CN(C(C)C)S(=O)(=O)c1cccc2c1CCNC2	ZINC000042592598	183289004	/nfs/dbraw/zinc/28/90/04/183289004.db2.gz	XMTNFZXSDBNBAD-UHFFFAOYSA-N	0	3	310.463	2.387	10	0		DEAEHN
C[C@H]1CCCC[C@@H]1N(C)S(=O)(=O)Cc1ccccc1CN	ZINC000042609409	183290539	/nfs/dbraw/zinc/29/05/39/183290539.db2.gz	RXQDASQPQYSKKO-BBRMVZONSA-N	0	3	310.463	2.486	10	0		DEAEHN
Cc1ccccc1[C@H](CN)Oc1ccc(S(C)(=O)=O)cc1	ZINC000043040299	183332274	/nfs/dbraw/zinc/33/22/74/183332274.db2.gz	UOUWCGJVRCBMOU-INIZCTEOSA-N	0	3	305.399	2.477	10	0		DEAEHN
CCN(CC(F)(F)F)S(=O)(=O)c1cccc([C@H](C)N)c1	ZINC000042782186	183308643	/nfs/dbraw/zinc/30/86/43/183308643.db2.gz	XOAPXSBQHJRTRX-VIFPVBQESA-N	0	3	310.341	2.279	10	0		DEAEHN
CCCN(CC(=O)N(C)C)[C@@H](CN)c1ccc(Cl)s1	ZINC000043253750	183347661	/nfs/dbraw/zinc/34/76/61/183347661.db2.gz	JMNCMYQSWLXWPH-JTQLQIEISA-N	0	3	303.859	2.202	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)s1)N1CCS(=O)CC1	ZINC000043253570	183347829	/nfs/dbraw/zinc/34/78/29/183347829.db2.gz	GLSFXWAZRITGFY-JOYOIKCWSA-N	0	3	306.884	2.244	10	0		DEAEHN
CC[C@@H](N)[C@@H](Oc1ccc(S(C)(=O)=O)cc1)C(F)(F)F	ZINC000043385213	183358225	/nfs/dbraw/zinc/35/82/25/183358225.db2.gz	WJGSMWSWCUCONZ-GHMZBOCLSA-N	0	3	311.325	2.137	10	0		DEAEHN
NC[C@@H](c1ccccc1Br)N1CCC(CO)CC1	ZINC000043091151	183335551	/nfs/dbraw/zinc/33/55/51/183335551.db2.gz	LHIYLZYBDXJNTF-AWEZNQCLSA-N	0	3	313.239	2.153	10	0		DEAEHN
CC(C)(C)OCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000308511237	291691800	/nfs/dbraw/zinc/69/18/00/291691800.db2.gz	GXXGUWJXTBWPKB-ZDUSSCGKSA-N	0	3	301.814	2.484	10	0		DEAEHN
CCN[C@@](C)(CSc1ccccc1Br)C(N)=O	ZINC000045552451	183515798	/nfs/dbraw/zinc/51/57/98/183515798.db2.gz	SLBDHLJKZXIMTA-LBPRGKRZSA-N	0	3	317.252	2.395	10	0		DEAEHN
Cc1noc(CCNCc2cc(Cl)c3c(c2)OCCO3)n1	ZINC000105470372	194105271	/nfs/dbraw/zinc/10/52/71/194105271.db2.gz	VBVFNESPQPONHO-UHFFFAOYSA-N	0	3	309.753	2.135	10	0		DEAEHN
C[C@H]1CC(=O)N(C[C@H](N)c2cccc(C(F)(F)F)c2)C1=O	ZINC000105677550	194119227	/nfs/dbraw/zinc/11/92/27/194119227.db2.gz	AYWWYLZGZHJAAV-KWQFWETISA-N	0	3	300.280	2.100	10	0		DEAEHN
Cc1cccc(OCCN2CCCN(c3cccnn3)CC2)c1	ZINC000105798209	194130493	/nfs/dbraw/zinc/13/04/93/194130493.db2.gz	XOXNQWHLVNJWDJ-UHFFFAOYSA-N	0	3	312.417	2.376	10	0		DEAEHN
CC1(C)Cc2cc(CNC[C@@H]3CN(C4CC4)CCO3)ccc2O1	ZINC000106379595	194204772	/nfs/dbraw/zinc/20/47/72/194204772.db2.gz	PDLJGFAOBSIXDX-QGZVFWFLSA-N	0	3	316.445	2.353	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@H]1CCc2cc(F)ccc21	ZINC000533811726	284808013	/nfs/dbraw/zinc/80/80/13/284808013.db2.gz	ICMNCSSBKSZTSM-INIZCTEOSA-N	0	3	314.364	2.041	10	0		DEAEHN
O=C(c1ncncc1Cl)N1CCC[C@@H]1CN1CCCCC1	ZINC000176157700	296307136	/nfs/dbraw/zinc/30/71/36/296307136.db2.gz	WGMRMEBVMGEDKW-GFCCVEGCSA-N	0	3	308.813	2.221	10	0		DEAEHN
CCNc1ncc(C(=O)N[C@H](C)CN2CCCC2)cc1Cl	ZINC000050787871	183804051	/nfs/dbraw/zinc/80/40/51/183804051.db2.gz	OLYHXHNCLFNFMR-LLVKDONJSA-N	0	3	310.829	2.381	10	0		DEAEHN
O=C(CN[C@H]1CCCOC1)Nc1ccc(Br)cc1	ZINC000109546810	194272939	/nfs/dbraw/zinc/27/29/39/194272939.db2.gz	QNMGCPLMSTWSBF-LBPRGKRZSA-N	0	3	313.195	2.156	10	0		DEAEHN
CCC[C@@H](C(N)=S)N1CCN(Cc2ccccc2F)CC1	ZINC000109470285	194267427	/nfs/dbraw/zinc/26/74/27/194267427.db2.gz	ZFOXXQPHBJGPML-HNNXBMFYSA-N	0	3	309.454	2.398	10	0		DEAEHN
Brc1cnc(O[C@H]2CCOC2)c(CNC2CC2)c1	ZINC000110532517	194337428	/nfs/dbraw/zinc/33/74/28/194337428.db2.gz	BXXYYWGPWQXOHH-LBPRGKRZSA-N	0	3	313.195	2.264	10	0		DEAEHN
CCCN([C@H]1CCCNC1)S(=O)(=O)c1cc(F)cc(F)c1	ZINC000110942430	194371986	/nfs/dbraw/zinc/37/19/86/194371986.db2.gz	GNKNHUFPHVPKFW-ZDUSSCGKSA-N	0	3	318.389	2.118	10	0		DEAEHN
CCCN[C@H](c1cccc(F)c1F)[C@@H]1CCS(=O)(=O)C1	ZINC000111037646	194386573	/nfs/dbraw/zinc/38/65/73/194386573.db2.gz	GDJSXROCKVKNDR-YGRLFVJLSA-N	0	3	303.374	2.440	10	0		DEAEHN
CN(C)CCN(C)CC(=O)Nc1c(Cl)cc(N)cc1Cl	ZINC000111129414	194393656	/nfs/dbraw/zinc/39/36/56/194393656.db2.gz	QSCLHWVYBHJZLX-UHFFFAOYSA-N	0	3	319.236	2.008	10	0		DEAEHN
CN(C)CCN(C)c1ccc(C(F)(F)F)cc1C(N)=S	ZINC000111138991	194393960	/nfs/dbraw/zinc/39/39/60/194393960.db2.gz	AVZVYXDKMAQSBM-UHFFFAOYSA-N	0	3	305.369	2.337	10	0		DEAEHN
CN(C[C@H]1CCCOC1)c1ncc(Br)cc1CN	ZINC000111173935	194398696	/nfs/dbraw/zinc/39/86/96/194398696.db2.gz	OXYXSYAQRNEYEH-SNVBAGLBSA-N	0	3	314.227	2.166	10	0		DEAEHN
CN1CCC(NC(=O)NC[C@@H]2CCN(C)c3ccccc32)CC1	ZINC000057336324	184033635	/nfs/dbraw/zinc/03/36/35/184033635.db2.gz	GRTVJHCJZWQKGF-AWEZNQCLSA-N	0	3	316.449	2.004	10	0		DEAEHN
CCCN[C@](C)(C[C@@H](C)N(C)CCOC(C)C)C(=O)OC	ZINC000157519368	197192538	/nfs/dbraw/zinc/19/25/38/197192538.db2.gz	LYSJRTPJOGAICI-GDBMZVCRSA-N	0	3	302.459	2.053	10	0		DEAEHN
O=C1NCCC[C@H]1N[C@@H]1CCc2c1cccc2Br	ZINC000221799024	284886163	/nfs/dbraw/zinc/88/61/63/284886163.db2.gz	JPXMLTJMHFNHMK-CHWSQXEVSA-N	0	3	309.207	2.305	10	0		DEAEHN
Cc1ccccc1CCNC(=O)N1CCCN(C2CC2)CC1	ZINC000057987916	184065019	/nfs/dbraw/zinc/06/50/19/184065019.db2.gz	IVBZQTYQUVKVBU-UHFFFAOYSA-N	0	3	301.434	2.417	10	0		DEAEHN
COc1ccccc1C[C@@H]1CCCN1CC(=O)N(C)C1CC1	ZINC000058525364	184121434	/nfs/dbraw/zinc/12/14/34/184121434.db2.gz	UCNJVCDIROLOGN-INIZCTEOSA-N	0	3	302.418	2.323	10	0		DEAEHN
CCNC(C)(C)C(=O)Nc1cc(C(=O)OC)c(F)cc1F	ZINC000061292911	184167921	/nfs/dbraw/zinc/16/79/21/184167921.db2.gz	KKPJQIODXMXSES-UHFFFAOYSA-N	0	3	300.305	2.078	10	0		DEAEHN
Cc1nc(-c2ccc(CNC(=O)NCCN(C)C)cc2)cs1	ZINC000535660370	284902747	/nfs/dbraw/zinc/90/27/47/284902747.db2.gz	BDACYOBAEDLBRG-UHFFFAOYSA-N	0	3	318.446	2.479	10	0		DEAEHN
N[C@H]1CCCc2nc(N3CCN(CC(F)(F)F)CC3)sc21	ZINC000061948535	184197783	/nfs/dbraw/zinc/19/77/83/184197783.db2.gz	SLFWDXSLBPKXKR-VIFPVBQESA-N	0	3	320.384	2.164	10	0		DEAEHN
CN(c1cccc(CN)c1)S(=O)(=O)c1cc(F)ccc1F	ZINC000061950491	184198460	/nfs/dbraw/zinc/19/84/60/184198460.db2.gz	NHMPDGAEVKPGIT-UHFFFAOYSA-N	0	3	312.341	2.249	10	0		DEAEHN
CN1CC[C@H](Nc2ccc(I)cc2)C1	ZINC000061984925	184199902	/nfs/dbraw/zinc/19/99/02/184199902.db2.gz	FUHAHKUGMJQXOO-NSHDSACASA-N	0	3	302.159	2.407	10	0		DEAEHN
C[C@H](c1ccc(Cl)cc1)N(C)CC(=O)N1CCCNCC1	ZINC000062014404	184200999	/nfs/dbraw/zinc/20/09/99/184200999.db2.gz	FXQHRAWUVCPMFK-CYBMUJFWSA-N	0	3	309.841	2.155	10	0		DEAEHN
COCCN1C(=O)C[C@@H](N)[C@H]1c1ccc(Cl)cc1Cl	ZINC000062210253	184220735	/nfs/dbraw/zinc/22/07/35/184220735.db2.gz	SYVQMSYSVBMYKP-DGCLKSJQSA-N	0	3	303.189	2.241	10	0		DEAEHN
CN1CCN(c2nc3sccn3c2CNC(C)(C)C)CC1	ZINC000062734219	184251088	/nfs/dbraw/zinc/25/10/88/184251088.db2.gz	TZBORZSEFWHXTA-UHFFFAOYSA-N	0	3	307.467	2.036	10	0		DEAEHN
CC(C)(C)NCc1c(N2CCC[C@@H](O)C2)nc2sccn12	ZINC000062737123	184251188	/nfs/dbraw/zinc/25/11/88/184251188.db2.gz	FTAXPYTWLAHVJY-LLVKDONJSA-N	0	3	308.451	2.245	10	0		DEAEHN
COCCNCc1c(N(C)CC(F)(F)F)nc2sccn12	ZINC000062736381	184251336	/nfs/dbraw/zinc/25/13/36/184251336.db2.gz	BDEMQSFEHRZVQX-UHFFFAOYSA-N	0	3	322.356	2.130	10	0		DEAEHN
[NH3+][C@@H]1CCCCC[C@H]1[N-]S(=O)(=O)c1cccc(Cl)c1F	ZINC000063213658	184279042	/nfs/dbraw/zinc/27/90/42/184279042.db2.gz	ABXIMJXUVKVXSM-GHMZBOCLSA-N	0	3	320.817	2.417	10	0		DEAEHN
CCCNc1ccc(Cl)c(C(=O)N2CC[C@@H](N(C)C)C2)n1	ZINC000062984767	184264755	/nfs/dbraw/zinc/26/47/55/184264755.db2.gz	VMONGLIDTRGKGK-LLVKDONJSA-N	0	3	310.829	2.333	10	0		DEAEHN
CC[C@@H]1CN(c2ccccc2)CCN1CCC(=O)N(C)CC	ZINC000184021326	207364776	/nfs/dbraw/zinc/36/47/76/207364776.db2.gz	HKTFVKPTRQAIPJ-MRXNPFEDSA-N	0	3	303.450	2.456	10	0		DEAEHN
C[C@H](N[C@H]1CCN(c2ncccc2Cl)C1)c1cnn(C)c1	ZINC000119968150	195071316	/nfs/dbraw/zinc/07/13/16/195071316.db2.gz	WQEGHWMUNACSAU-AAEUAGOBSA-N	0	3	305.813	2.398	10	0		DEAEHN
CNCc1ccc(Cl)c(S(=O)(=O)NC2(C)CCC2)c1	ZINC000159263048	197341344	/nfs/dbraw/zinc/34/13/44/197341344.db2.gz	WGFFYUPCMRJHQC-UHFFFAOYSA-N	0	3	302.827	2.280	10	0		DEAEHN
CCc1nn(C)c(Cl)c1C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000159219319	197337453	/nfs/dbraw/zinc/33/74/53/197337453.db2.gz	NCBQJQRQZCZWLB-LLVKDONJSA-N	0	3	314.861	2.342	10	0		DEAEHN
Cc1cc(S(=O)(=O)N[C@@H]2C[C@H]2C)cc(CNC(C)C)c1F	ZINC000159110341	197328510	/nfs/dbraw/zinc/32/85/10/197328510.db2.gz	SLRIBBTYAVBLIC-QMTHXVAHSA-N	0	3	314.426	2.319	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)N(C)C	ZINC000158991095	197317526	/nfs/dbraw/zinc/31/75/26/197317526.db2.gz	DTXCLPIVPHQDPC-MSOLQXFVSA-N	0	3	317.477	2.498	10	0		DEAEHN
CCCN[C@@H](C)c1c(Br)cnn1CCN(C)C	ZINC000158739470	197298192	/nfs/dbraw/zinc/29/81/92/197298192.db2.gz	RTDHXYMSVIZESO-JTQLQIEISA-N	0	3	303.248	2.268	10	0		DEAEHN
COCCNCc1ccc(-n2cc(C(F)(F)F)cn2)nc1	ZINC000158355917	197265455	/nfs/dbraw/zinc/26/54/55/197265455.db2.gz	JYIIXQYUWJNWLS-UHFFFAOYSA-N	0	3	300.284	2.022	10	0		DEAEHN
COCc1cc([C@@H](C)NC2CCS(=O)CC2)ccc1OC	ZINC000158014133	197236170	/nfs/dbraw/zinc/23/61/70/197236170.db2.gz	OFMWMTUVDKSDJS-XTXYDCKCSA-N	0	3	311.447	2.403	10	0		DEAEHN
CC(C)OCCN(C)[C@@H](CN)c1ccc(Br)o1	ZINC000157828263	197219093	/nfs/dbraw/zinc/21/90/93/197219093.db2.gz	FEFYQILNXINCII-JTQLQIEISA-N	0	3	305.216	2.399	10	0		DEAEHN
C[C@@](F)(Cc1cncc(Br)c1)C[C@@H]1COCCN1	ZINC000157668543	197206873	/nfs/dbraw/zinc/20/68/73/197206873.db2.gz	BCKRHLCLXSHDOM-CHWSQXEVSA-N	0	3	317.202	2.493	10	0		DEAEHN
CCN[C@@H](Cc1ccc(OC)c(F)c1)C(C)(C)S(C)(=O)=O	ZINC000157290667	197176969	/nfs/dbraw/zinc/17/69/69/197176969.db2.gz	MUSFHJCZPJHEBJ-AWEZNQCLSA-N	0	3	317.426	2.178	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)Cc1c[nH]c2ncccc12	ZINC000157123427	197163628	/nfs/dbraw/zinc/16/36/28/197163628.db2.gz	RBQXTQHJGQWJSK-AWEZNQCLSA-N	0	3	302.422	2.198	10	0		DEAEHN
C[C@](O)(Cc1ccc(Br)cc1)C[C@H]1COCCN1	ZINC000156909715	197149149	/nfs/dbraw/zinc/14/91/49/197149149.db2.gz	ZHXGFDPHHCLFOX-KBPBESRZSA-N	0	3	314.223	2.121	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccc(OCCOC)cc1)N(C)C	ZINC000156891578	197148106	/nfs/dbraw/zinc/14/81/06/197148106.db2.gz	VFMWIAMCYKBOQB-MRXNPFEDSA-N	0	3	308.422	2.058	10	0		DEAEHN
CN[C@@H](Cc1c(Br)c(C)nn1C)c1ccnc(C)n1	ZINC000156574987	197124817	/nfs/dbraw/zinc/12/48/17/197124817.db2.gz	QAAXITDEDRBWLO-NSHDSACASA-N	0	3	324.226	2.093	10	0		DEAEHN
C[C@@H](N)c1cccc(S(=O)(=O)NC[C@H]2CCCCS2)c1	ZINC000156468994	197115637	/nfs/dbraw/zinc/11/56/37/197115637.db2.gz	PVKLESURKRKQIB-DGCLKSJQSA-N	0	3	314.476	2.270	10	0		DEAEHN
CC[C@H](Nc1nc(N)nc(N2CCCC2)n1)c1nccs1	ZINC000156141064	197088625	/nfs/dbraw/zinc/08/86/25/197088625.db2.gz	FMOKIFXCLJBBOE-VIFPVBQESA-N	0	3	305.411	2.074	10	0		DEAEHN
CC[C@H](C)CN1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000120593605	195197792	/nfs/dbraw/zinc/19/77/92/195197792.db2.gz	COPQHNAUIJJITR-IRXDYDNUSA-N	0	3	306.450	2.090	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)Nc2cccc3c2OCCO3)C1	ZINC000120884947	195257220	/nfs/dbraw/zinc/25/72/20/195257220.db2.gz	UXCMMVGFCNPBHS-OCCSQVGLSA-N	0	3	319.405	2.308	10	0		DEAEHN
C[C@H]1C[C@H]1c1ccc(CNC(=O)NCCNc2ccncc2)o1	ZINC000560752824	291946269	/nfs/dbraw/zinc/94/62/69/291946269.db2.gz	PVLSWUAFRSYZSL-SWLSCSKDSA-N	0	3	314.389	2.131	10	0		DEAEHN
CN1CCC(CN2C(=O)C3(CC3)N[C@H]2c2ccsc2)CC1	ZINC000121984081	195385646	/nfs/dbraw/zinc/38/56/46/195385646.db2.gz	NKTVCIGSQNNXTN-CQSZACIVSA-N	0	3	305.447	2.053	10	0		DEAEHN
COc1nccnc1CN1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000294688920	533278324	/nfs/dbraw/zinc/27/83/24/533278324.db2.gz	DOSBWGILTSLAOJ-AWEZNQCLSA-N	0	3	313.405	2.123	10	0		DEAEHN
COc1ccc(C(=O)N2CC[C@@H](N(C)C)C2)c(OCC2CC2)c1	ZINC000188400114	533308823	/nfs/dbraw/zinc/30/88/23/533308823.db2.gz	JDEBEHSXCLHBRH-CQSZACIVSA-N	0	3	318.417	2.260	10	0		DEAEHN
C/C=C(\CC)C(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000191649424	533436984	/nfs/dbraw/zinc/43/69/84/533436984.db2.gz	HGTFUFNLFRJZQS-FZSIALSZSA-N	0	3	316.449	2.148	10	0		DEAEHN
CO[C@@H]1COC[C@H]1n1cc(CN[C@H]2C[C@@H](C)CC(C)(C)C2)nn1	ZINC000329544928	533524087	/nfs/dbraw/zinc/52/40/87/533524087.db2.gz	ZCJLXCQDRRSIEJ-OCVGTWLNSA-N	0	3	322.453	2.169	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)N3CCC[C@@H]3C)cc2)CC1	ZINC000175832848	132515490	/nfs/dbraw/zinc/51/54/90/132515490.db2.gz	RHXKUXDDMUMWDC-HNNXBMFYSA-N	0	3	301.434	2.453	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(CCc2ccccc2Cl)n1	ZINC000263301540	132581302	/nfs/dbraw/zinc/58/13/02/132581302.db2.gz	XBKLCXSNBVQQBR-CYBMUJFWSA-N	0	3	306.797	2.084	10	0		DEAEHN
c1ccc2c(c1)CC[C@@H](CN1CCN(C[C@@H]3CCOC3)CC1)C2	ZINC000359591333	133132446	/nfs/dbraw/zinc/13/24/46/133132446.db2.gz	WCBLOZHLBSGXPX-MSOLQXFVSA-N	0	3	314.473	2.446	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NC[C@@H](C)Oc1cccc(OC)c1	ZINC000359606287	133134427	/nfs/dbraw/zinc/13/44/27/133134427.db2.gz	WFZHUJFFUJERRM-PBHICJAKSA-N	0	3	320.433	2.453	10	0		DEAEHN
COC(=O)c1cc(CNCC[C@H]2COc3ccccc3O2)c[nH]1	ZINC000360277045	133173034	/nfs/dbraw/zinc/17/30/34/133173034.db2.gz	ZSOGBDTXHBDDCD-ZDUSSCGKSA-N	0	3	316.357	2.121	10	0		DEAEHN
O=C(NCCCN1CCC(O)CC1)[C@@H]1C[C@H]1C1CCCCC1	ZINC000121626413	144684574	/nfs/dbraw/zinc/68/45/74/144684574.db2.gz	IFEJKSIAGVFWEY-DLBZAZTESA-N	0	3	308.466	2.166	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@@H]1CCO[C@H](C2CC2)C1	ZINC000291703139	404485313	/nfs/dbraw/zinc/48/53/13/404485313.db2.gz	KIGZHONNIOJXQA-AEFFLSMTSA-N	0	3	312.417	2.374	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2scnc2C2CCCC2)CCO1	ZINC000184898351	144951213	/nfs/dbraw/zinc/95/12/13/144951213.db2.gz	BRYMJHWXQPGXNI-ZDUSSCGKSA-N	0	3	323.462	2.203	10	0		DEAEHN
O=C([C@H]1CCCO[C@H]1c1ccccc1)N1CCN2CCC1CC2	ZINC000188624165	145014500	/nfs/dbraw/zinc/01/45/00/145014500.db2.gz	QTXAOLDTFAJWMG-ROUUACIJSA-N	0	3	314.429	2.461	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1cc(F)cc2nccnc21	ZINC000188753646	145016995	/nfs/dbraw/zinc/01/69/95/145016995.db2.gz	UYJQIIGKWGBFAM-UHFFFAOYSA-N	0	3	322.343	2.302	10	0		DEAEHN
O=C(Cc1ccc(F)c(F)c1)NCc1ccc2c(c1)CNC2	ZINC000188761566	145017431	/nfs/dbraw/zinc/01/74/31/145017431.db2.gz	USZDYQQWMXCLOZ-UHFFFAOYSA-N	0	3	302.324	2.427	10	0		DEAEHN
CO[C@H](C)[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C)o1	ZINC000190675791	145046464	/nfs/dbraw/zinc/04/64/64/145046464.db2.gz	RWBZKSZOBJJKBQ-UONOGXRCSA-N	0	3	311.426	2.085	10	0		DEAEHN
CCOC(=O)CC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000190751068	145047511	/nfs/dbraw/zinc/04/75/11/145047511.db2.gz	UILMYHPMTSWKLB-SFHVURJKSA-N	0	3	318.417	2.111	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)NCc2ccc(C3CC3)cc2)CCO1	ZINC000191604206	145061520	/nfs/dbraw/zinc/06/15/20/145061520.db2.gz	MCSYDAPNSJRVSD-KRWDZBQOSA-N	0	3	317.433	2.036	10	0		DEAEHN
C[C@@H](C(=O)/N=c1/sccn1Cc1ccccc1F)[C@H](C)N	ZINC000192086089	145070948	/nfs/dbraw/zinc/07/09/48/145070948.db2.gz	TTWJYBOBNMWVCD-PYMGFVNVSA-N	0	3	307.394	2.148	10	0		DEAEHN
COCc1ccc(NC(=O)[C@H]2CCCN2C2CCOCC2)cc1	ZINC000193030442	145081772	/nfs/dbraw/zinc/08/17/72/145081772.db2.gz	FSMVUZKILJBCTO-QGZVFWFLSA-N	0	3	318.417	2.415	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC(c2cnn(CC)c2)CC1	ZINC000193376037	145085391	/nfs/dbraw/zinc/08/53/91/145085391.db2.gz	CNOSCAKHKVWSKT-QGZVFWFLSA-N	0	3	309.454	2.260	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1occc1Br	ZINC000246557365	145105926	/nfs/dbraw/zinc/10/59/26/145105926.db2.gz	UPAFMXZCBVHGNO-UWVGGRQHSA-N	0	3	313.195	2.351	10	0		DEAEHN
C[C@H](C(=O)Nc1cccc(Cl)c1)N1CCN2CCC[C@H]2C1	ZINC000246284907	145097248	/nfs/dbraw/zinc/09/72/48/145097248.db2.gz	IDONSLSDIJYFQS-DOMZBBRYSA-N	0	3	307.825	2.447	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000246283093	145097288	/nfs/dbraw/zinc/09/72/88/145097288.db2.gz	BRDKQGQCZMCIDB-ZBFHGGJFSA-N	0	3	317.433	2.087	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H](c2ccccc2)CN(C[C@H]2CCCO2)C1	ZINC000246347046	145099696	/nfs/dbraw/zinc/09/96/96/145099696.db2.gz	VNRCAVXMQWQXIN-BRWVUGGUSA-N	0	3	303.402	2.444	10	0		DEAEHN
CO[C@H](CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1)c1ccccc1	ZINC000246368824	145100547	/nfs/dbraw/zinc/10/05/47/145100547.db2.gz	QEDYSBYAJLVVAA-BHYGNILZSA-N	0	3	319.449	2.498	10	0		DEAEHN
CN(C)c1cccc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1	ZINC000246538066	145106570	/nfs/dbraw/zinc/10/65/70/145106570.db2.gz	SEUZRMWVPHCPRA-RDJZCZTQSA-N	0	3	301.434	2.309	10	0		DEAEHN
COc1ccc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c(OC)c1	ZINC000246741313	145112861	/nfs/dbraw/zinc/11/28/61/145112861.db2.gz	GSSJWMPJYCHYDQ-BBRMVZONSA-N	0	3	318.417	2.260	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@H]1C[C@H](C)C[C@H](C)C1	ZINC000246827836	145115889	/nfs/dbraw/zinc/11/58/89/145115889.db2.gz	GNLNNZYVYQDFDW-FXUDXRNXSA-N	0	3	311.470	2.221	10	0		DEAEHN
C[C@H]1CN(CCc2ccc(F)c(F)c2)C[C@H]1N1CCOCC1	ZINC000246837647	145116338	/nfs/dbraw/zinc/11/63/38/145116338.db2.gz	SSZTUWSXMNZKSC-SUMWQHHRSA-N	0	3	310.388	2.160	10	0		DEAEHN
Fc1ccc(-c2noc(CN3CCN4CCC[C@H]4C3)n2)cc1F	ZINC000246891329	145118460	/nfs/dbraw/zinc/11/84/60/145118460.db2.gz	MBCDFHOIEYTQQI-LBPRGKRZSA-N	0	3	320.343	2.295	10	0		DEAEHN
O=C(N[C@@H](Cc1ccccc1)C1CC1)N1CCN2CCC[C@H]2C1	ZINC000247086826	145126356	/nfs/dbraw/zinc/12/63/56/145126356.db2.gz	ZVXZVIRHZQNKKU-ROUUACIJSA-N	0	3	313.445	2.497	10	0		DEAEHN
Cc1cnc([C@@H](NC(=O)N2CCN3CCC[C@H]3C2)C2CC2)s1	ZINC000247183735	145128482	/nfs/dbraw/zinc/12/84/82/145128482.db2.gz	SHELAARZQHBWPD-KBPBESRZSA-N	0	3	320.462	2.392	10	0		DEAEHN
COC(=O)Nc1ccc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1	ZINC000247192805	145128655	/nfs/dbraw/zinc/12/86/55/145128655.db2.gz	LHOJYUILKSZIPA-DOMZBBRYSA-N	0	3	317.389	2.174	10	0		DEAEHN
COC(=O)c1csc(NC(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000247288283	145132222	/nfs/dbraw/zinc/13/22/22/145132222.db2.gz	ZACUTAWNGKJSBO-JQWIXIFHSA-N	0	3	323.418	2.235	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N1CCN2CCC[C@H]2C1)c1ccc(F)cc1	ZINC000247392877	145136044	/nfs/dbraw/zinc/13/60/44/145136044.db2.gz	XJZUBZQCNGFKLU-ZQIUZPCESA-N	0	3	319.424	2.171	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)N1CCC[C@H]1c1cnn(C)c1	ZINC000247471427	145138348	/nfs/dbraw/zinc/13/83/48/145138348.db2.gz	HBBZCHXAFUAJRY-HOTGVXAUSA-N	0	3	319.453	2.141	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1	ZINC000248651794	145163646	/nfs/dbraw/zinc/16/36/46/145163646.db2.gz	NAROCYUJUKZADN-HUUCEWRRSA-N	0	3	322.453	2.039	10	0		DEAEHN
CN(CCN(C)[C@H]1CCN(c2ccccc2Cl)C1=O)C1CC1	ZINC000248701528	145164357	/nfs/dbraw/zinc/16/43/57/145164357.db2.gz	KYLWVGCHKMVUIQ-INIZCTEOSA-N	0	3	321.852	2.471	10	0		DEAEHN
CCOC1CC(CCNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)C1	ZINC000248862926	145170636	/nfs/dbraw/zinc/17/06/36/145170636.db2.gz	BKMIGLBZIISAKM-JWMHWRSXSA-N	0	3	311.470	2.316	10	0		DEAEHN
CN(Cc1cc(-c2cnn(C)c2)no1)C[C@H]1CCCC[C@H]1O	ZINC000248976477	145174612	/nfs/dbraw/zinc/17/46/12/145174612.db2.gz	HRQHLZBNLKCQCX-MLGOLLRUSA-N	0	3	304.394	2.058	10	0		DEAEHN
COc1ccc(F)c(C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1OC	ZINC000248986724	145175362	/nfs/dbraw/zinc/17/53/62/145175362.db2.gz	FEHOPYPHGAYUEM-DGCLKSJQSA-N	0	3	324.396	2.301	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2n[nH]c3c2CCCCC3)C1	ZINC000249050761	145176885	/nfs/dbraw/zinc/17/68/85/145176885.db2.gz	HZVXNLPMXXQUQM-SWLSCSKDSA-N	0	3	304.438	2.137	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)C(=O)Nc1ccccc1C	ZINC000249155637	145180440	/nfs/dbraw/zinc/18/04/40/145180440.db2.gz	IGVIQGWWWYWDGP-GJZGRUSLSA-N	0	3	315.417	2.019	10	0		DEAEHN
CO[C@@H]1CCCN(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)C1	ZINC000252801352	145200977	/nfs/dbraw/zinc/20/09/77/145200977.db2.gz	CPQNHWNWWYADNV-IXDOHACOSA-N	0	3	317.433	2.252	10	0		DEAEHN
Cc1cc(=O)[nH]cc1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000253556149	145203190	/nfs/dbraw/zinc/20/31/90/145203190.db2.gz	RNCYKLVIEKHQSO-WBVHZDCISA-N	0	3	311.385	2.271	10	0		DEAEHN
CN(CC(=O)N1CCNCC1)Cc1ccc(-c2ccccc2)cc1	ZINC000261620404	145211459	/nfs/dbraw/zinc/21/14/59/145211459.db2.gz	CBDLDIHESAWQPE-UHFFFAOYSA-N	0	3	323.440	2.217	10	0		DEAEHN
NC1(C(=O)Nc2ccc(Oc3ccccc3)nc2)CCOCC1	ZINC000261689836	145217010	/nfs/dbraw/zinc/21/70/10/145217010.db2.gz	DDXGZWAAFYSUAU-UHFFFAOYSA-N	0	3	313.357	2.320	10	0		DEAEHN
Cc1cccc(CCNC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000261839532	145232479	/nfs/dbraw/zinc/23/24/79/145232479.db2.gz	IQVPMAKNELEVIG-TXPKVOOTSA-N	0	3	316.445	2.186	10	0		DEAEHN
N[C@H](CC1CCCCC1)C(=O)NC[C@@H]1COc2ccccc2O1	ZINC000261882777	145236820	/nfs/dbraw/zinc/23/68/20/145236820.db2.gz	MUOPOGYMKPLSDC-HUUCEWRRSA-N	0	3	318.417	2.240	10	0		DEAEHN
CCn1cc(CN2CCNC[C@@H]2c2ccccc2OC)cn1	ZINC000261898586	145239553	/nfs/dbraw/zinc/23/95/53/145239553.db2.gz	WILJIYKDLHFQLQ-MRXNPFEDSA-N	0	3	300.406	2.058	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)NCc1ccc(Cl)cc1	ZINC000262498045	145288024	/nfs/dbraw/zinc/28/80/24/145288024.db2.gz	LRASTTIFBPIFRY-VBQJREDUSA-N	0	3	322.836	2.489	10	0		DEAEHN
C[C@@H]1CCC[C@H](CNC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)C1	ZINC000262506830	145289204	/nfs/dbraw/zinc/28/92/04/145289204.db2.gz	MMTTVHVUSDMAKQ-SUKQMUEJSA-N	0	3	308.466	2.461	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N1CCc2sccc2C1	ZINC000262573126	145294507	/nfs/dbraw/zinc/29/45/07/145294507.db2.gz	XQCOPBZJAOVVRO-QEORTHHSSA-N	0	3	320.458	2.165	10	0		DEAEHN
C[C@@H](NC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C)c1ccccc1	ZINC000262587098	145295735	/nfs/dbraw/zinc/29/57/35/145295735.db2.gz	ZWJPMQRMFMRBNS-MJXUCMMTSA-N	0	3	302.418	2.396	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(CCc2cc3ccccc3o2)n1	ZINC000263182009	145333488	/nfs/dbraw/zinc/33/34/88/145333488.db2.gz	GUSKCTDFOWGCMO-CQSZACIVSA-N	0	3	312.373	2.177	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(Cc2coc3cc(F)ccc23)n1	ZINC000263188002	145334396	/nfs/dbraw/zinc/33/43/96/145334396.db2.gz	HOZFUBBGBWBSQU-ZDUSSCGKSA-N	0	3	316.336	2.122	10	0		DEAEHN
CC[C@H](NC(=O)N1CC[C@H]2CCN(C)C[C@H]21)c1c(C)noc1C	ZINC000332842178	145389902	/nfs/dbraw/zinc/38/99/02/145389902.db2.gz	NXZSWSCVANQGGU-QLFBSQMISA-N	0	3	320.437	2.478	10	0		DEAEHN
O=C(N[C@@H]1CCN(C2CC2)C1)[C@@H]1C[C@@H]1c1cc(F)ccc1F	ZINC000357056631	147032154	/nfs/dbraw/zinc/03/21/54/147032154.db2.gz	SLBXDLLDUJIRKH-UXIGCNINSA-N	0	3	306.356	2.421	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@@H](C)N2CCC(C)CC2)C1	ZINC000358582194	147160267	/nfs/dbraw/zinc/16/02/67/147160267.db2.gz	SOPRURKIHKGKIZ-OAHLLOKOSA-N	0	3	311.470	2.175	10	0		DEAEHN
C[C@@H]1CN(C(=O)c2cccc(CN3CCCC3)c2)C[C@@H](C)N1C	ZINC000358672469	147178224	/nfs/dbraw/zinc/17/82/24/147178224.db2.gz	ZRROCERYJACXMT-HZPDHXFCSA-N	0	3	315.461	2.447	10	0		DEAEHN
CS(=O)(=O)C1(CN[C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1	ZINC000359029503	147249409	/nfs/dbraw/zinc/24/94/09/147249409.db2.gz	LHYUSQLGPRTLID-HOCLYGCPSA-N	0	3	323.458	2.321	10	0		DEAEHN
Cn1ccc([C@@H](NCCN2CCCC2)c2ccc(F)cc2)n1	ZINC000359224705	147285992	/nfs/dbraw/zinc/28/59/92/147285992.db2.gz	FOCVRHOWQCFKEF-KRWDZBQOSA-N	0	3	302.397	2.334	10	0		DEAEHN
COc1cccc(CNC[C@@H]2CCCN2c2cccnn2)c1F	ZINC000370585986	148033358	/nfs/dbraw/zinc/03/33/58/148033358.db2.gz	ZHIRPOVHSYSLEC-AWEZNQCLSA-N	0	3	316.380	2.383	10	0		DEAEHN
C[C@H](c1cccnc1)N1CCC(c2ccnn2CCO)CC1	ZINC000371488521	148109124	/nfs/dbraw/zinc/10/91/24/148109124.db2.gz	QWIRHJUFRISKQP-CQSZACIVSA-N	0	3	300.406	2.211	10	0		DEAEHN
CC(C)n1nccc1CNC[C@@H]1CCC2(CCOCC2)[C@@H]1O	ZINC000374684623	148277735	/nfs/dbraw/zinc/27/77/35/148277735.db2.gz	AQJWBHURFSNTGP-GOEBONIOSA-N	0	3	307.438	2.121	10	0		DEAEHN
Cc1nn(C)c(C)c1CN1CC[C@@H](c2nc(C3CC3)no2)C1	ZINC000375399212	148367444	/nfs/dbraw/zinc/36/74/44/148367444.db2.gz	ACTCGCKIUVOFAL-CYBMUJFWSA-N	0	3	301.394	2.287	10	0		DEAEHN
O=C1OCC[C@H]1CCN1CCC(c2ccccc2CO)CC1	ZINC000375571882	148387240	/nfs/dbraw/zinc/38/72/40/148387240.db2.gz	QGINRBWLQGUJMH-OAHLLOKOSA-N	0	3	303.402	2.312	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)NCCc2cc(F)ccc2F)CN1C1CC1	ZINC000126445087	401694365	/nfs/dbraw/zinc/69/43/65/401694365.db2.gz	LIXQQTXPICYXTH-SMDDNHRTSA-N	0	3	323.387	2.432	10	0		DEAEHN
Cc1cccc(CNC(=O)NC[C@@H](C)N2CCC(C)CC2)n1	ZINC000128994792	401797155	/nfs/dbraw/zinc/79/71/55/401797155.db2.gz	XVRIAZZHPNBGNW-OAHLLOKOSA-N	0	3	304.438	2.310	10	0		DEAEHN
Cc1ccc([C@H](CNC(=O)N(C)C[C@H]2CCCO2)N(C)C)cc1	ZINC000077007218	401802858	/nfs/dbraw/zinc/80/28/58/401802858.db2.gz	CVHHUGVHLIOKLV-SJORKVTESA-N	0	3	319.449	2.418	10	0		DEAEHN
C[C@@H](CCNCc1cnn(Cc2ccccc2)c1)[S@@](C)=O	ZINC000129507267	401805360	/nfs/dbraw/zinc/80/53/60/401805360.db2.gz	OMGVFGFCDDHBRV-QKKBWIMNSA-N	0	3	305.447	2.178	10	0		DEAEHN
CC1(CNC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)COC1	ZINC000112693832	401753843	/nfs/dbraw/zinc/75/38/43/401753843.db2.gz	LVSZHFPJCVMQMS-HNNXBMFYSA-N	0	3	320.408	2.190	10	0		DEAEHN
COC[C@@H]1CCCN(CC(=O)N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000112985424	401763727	/nfs/dbraw/zinc/76/37/27/401763727.db2.gz	LKQHZTNPPBKRQF-OLZOCXBDSA-N	0	3	322.371	2.146	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Cc2coc(-c3ccc(F)cc3)n2)C1	ZINC000113170030	401768688	/nfs/dbraw/zinc/76/86/88/401768688.db2.gz	GQSHUAYMZSOPRD-HNNXBMFYSA-N	0	3	317.364	2.186	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c(C)c1	ZINC000113306088	401776210	/nfs/dbraw/zinc/77/62/10/401776210.db2.gz	CXCJVRJOXBPWMZ-GJZGRUSLSA-N	0	3	308.447	2.161	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)NC[C@H]2CCCC[C@H]2O)c1	ZINC000077516055	401818649	/nfs/dbraw/zinc/81/86/49/401818649.db2.gz	HWWNAGIBXPWLGO-GDBMZVCRSA-N	0	3	305.422	2.421	10	0		DEAEHN
CCc1ccc([C@H](CNC(=O)N[C@H](C)[C@@H](C)CO)N(C)C)cc1	ZINC000077753995	401828879	/nfs/dbraw/zinc/82/88/79/401828879.db2.gz	USJOHNIXSLDGIL-VBQJREDUSA-N	0	3	321.465	2.168	10	0		DEAEHN
C[C@@H]1CC(NC(=O)c2ccccc2OCCN(C)C)C[C@@H](C)O1	ZINC000130676191	401837241	/nfs/dbraw/zinc/83/72/41/401837241.db2.gz	BNDYGGWRJBTLBC-ZIAGYGMSSA-N	0	3	320.433	2.313	10	0		DEAEHN
CN(C)[C@@H]1CCCN(S(=O)(=O)c2c(F)cccc2Cl)C1	ZINC000131795836	401856734	/nfs/dbraw/zinc/85/67/34/401856734.db2.gz	LLTVAHJCBBMTFH-SNVBAGLBSA-N	0	3	320.817	2.194	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2)CCO1	ZINC000116785331	401858794	/nfs/dbraw/zinc/85/87/94/401858794.db2.gz	HONIGCODNCXWFP-OAGGEKHMSA-N	0	3	322.836	2.233	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)c1cc(C)n(-c2ccccc2)n1	ZINC000078767956	401865379	/nfs/dbraw/zinc/86/53/79/401865379.db2.gz	IPKYWNQLHJDQLT-INIZCTEOSA-N	0	3	312.417	2.395	10	0		DEAEHN
CCc1ccc([C@@H](C)NC(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000117025568	401867001	/nfs/dbraw/zinc/86/70/01/401867001.db2.gz	GXFWSJBEJASHOC-RHSMWYFYSA-N	0	3	319.449	2.282	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)CSCc2cscn2)CCN1C	ZINC000132538412	401869043	/nfs/dbraw/zinc/86/90/43/401869043.db2.gz	RSRNEVPRSPYIAK-DGCLKSJQSA-N	0	3	313.492	2.317	10	0		DEAEHN
C[C@@H]1CCC[C@@H](CN2CCN(c3ccc4nncn4n3)CC2)C1	ZINC000133384448	401884068	/nfs/dbraw/zinc/88/40/68/401884068.db2.gz	FKCYVEBJYXLNHB-HUUCEWRRSA-N	0	3	314.437	2.073	10	0		DEAEHN
CCN1CCN(C[C@H](C)CNC(=O)N2C[C@@H](C)CC[C@@H]2C)CC1	ZINC000080434018	401889561	/nfs/dbraw/zinc/88/95/61/401889561.db2.gz	VYQSFPDJMRIYJR-BBWFWOEESA-N	0	3	324.513	2.090	10	0		DEAEHN
[NH3+]C1(C[N-]S(=O)(=O)c2cc(F)cc(F)c2)CCCCCC1	ZINC000036266813	401903769	/nfs/dbraw/zinc/90/37/69/401903769.db2.gz	LJYALPAMCKBYTE-UHFFFAOYSA-N	0	3	318.389	2.295	10	0		DEAEHN
COc1cc(C[NH2+]CC[C@H](C)O)cc(Br)c1[O-]	ZINC000085984242	401919734	/nfs/dbraw/zinc/91/97/34/401919734.db2.gz	WALBMRWSNBNATK-QMMMGPOBSA-N	0	3	304.184	2.024	10	0		DEAEHN
COCCC1(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)CCC1	ZINC000119497467	401954322	/nfs/dbraw/zinc/95/43/22/401954322.db2.gz	LCUSZIJHRZMVOW-CABCVRRESA-N	0	3	311.470	2.317	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCc3ccc(F)cc3C2)C1	ZINC000136522824	401969046	/nfs/dbraw/zinc/96/90/46/401969046.db2.gz	AMLLVEUIXSBOPJ-MRXNPFEDSA-N	0	3	305.397	2.378	10	0		DEAEHN
COc1ccccc1OCCC(=O)NCCN1CCCC[C@@H]1C	ZINC000046859314	401974315	/nfs/dbraw/zinc/97/43/15/401974315.db2.gz	IVHCZIFBTJTJHJ-HNNXBMFYSA-N	0	3	320.433	2.455	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1sc(COC)nc1C	ZINC000136941142	401976185	/nfs/dbraw/zinc/97/61/85/401976185.db2.gz	HHELGXQBCDHFKM-CHWSQXEVSA-N	0	3	323.462	2.297	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H]1CCN(C)c2ccccc21)N(C)C	ZINC000137717338	401985247	/nfs/dbraw/zinc/98/52/47/401985247.db2.gz	FECJXLLRYQLVAX-PBHICJAKSA-N	0	3	303.450	2.457	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1cccc(Cn2cccn2)c1)N(C)C	ZINC000137636683	401985350	/nfs/dbraw/zinc/98/53/50/401985350.db2.gz	USPZJERFIJZAJB-KRWDZBQOSA-N	0	3	314.433	2.278	10	0		DEAEHN
CC(C)(C)[C@H](N)C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1	ZINC000119347920	401943453	/nfs/dbraw/zinc/94/34/53/401943453.db2.gz	WNTDMOQMSKLYDL-IINYFYTJSA-N	0	3	311.376	2.033	10	0		DEAEHN
C[C@H]1CC[C@H](C(=O)N(CCN(C)C)Cc2cccc(F)c2)O1	ZINC000151044531	402012777	/nfs/dbraw/zinc/01/27/77/402012777.db2.gz	PHJBILORVRZZPF-XJKSGUPXSA-N	0	3	308.397	2.283	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)NCC1(CC(C)C)CC1	ZINC000121186335	402019364	/nfs/dbraw/zinc/01/93/64/402019364.db2.gz	RWZCWWRMYNHBEP-HNNXBMFYSA-N	0	3	311.470	2.223	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@H](CNCC(=O)c2ccc[nH]2)C1	ZINC000095083943	402024899	/nfs/dbraw/zinc/02/48/99/402024899.db2.gz	RIULAXQHBAQVIW-GFCCVEGCSA-N	0	3	307.394	2.044	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(CCOC)Cc2ccccc2)C1	ZINC000052592802	402044346	/nfs/dbraw/zinc/04/43/46/402044346.db2.gz	LKSDXDCQAFODEZ-QGZVFWFLSA-N	0	3	319.449	2.329	10	0		DEAEHN
CCCn1nc(C)c(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1C	ZINC000151619333	402047012	/nfs/dbraw/zinc/04/70/12/402047012.db2.gz	JXYNLWSDKMIEIA-SWLSCSKDSA-N	0	3	306.454	2.368	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2cccc(-c3nccn3C)c2)C1	ZINC000150867221	402001149	/nfs/dbraw/zinc/00/11/49/402001149.db2.gz	OEYBLGMEHQIVSI-HNNXBMFYSA-N	0	3	313.405	2.255	10	0		DEAEHN
CCOCCN1CCN(CCCCn2ccnc2C)C[C@@H]1CC	ZINC000120771799	402001696	/nfs/dbraw/zinc/00/16/96/402001696.db2.gz	MQWNIEMHKREFQP-SFHVURJKSA-N	0	3	322.497	2.404	10	0		DEAEHN
COCCOc1ccc(CN2CCC(n3cncn3)CC2)cc1	ZINC000092648170	402007282	/nfs/dbraw/zinc/00/72/82/402007282.db2.gz	ZFMDWGFLBQFHLF-UHFFFAOYSA-N	0	3	316.405	2.140	10	0		DEAEHN
CC(C)N(C)CC(=O)N1C[C@H](C)O[C@@H](c2ccc(F)cc2)C1	ZINC000152194367	402080832	/nfs/dbraw/zinc/08/08/32/402080832.db2.gz	KRGWTELGHNNQKH-XJKSGUPXSA-N	0	3	308.397	2.454	10	0		DEAEHN
Cc1c2cc(C)ccc2[nH]c1C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000152220430	402082851	/nfs/dbraw/zinc/08/28/51/402082851.db2.gz	NQZXGVHVLRYGAJ-CQSZACIVSA-N	0	3	315.417	2.187	10	0		DEAEHN
O[C@@H](COCc1ccccc1)CN1CCC(c2cc[nH]n2)CC1	ZINC000058246124	402099701	/nfs/dbraw/zinc/09/97/01/402099701.db2.gz	ALUXVTALQABCFR-QGZVFWFLSA-N	0	3	315.417	2.167	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)O1	ZINC000153006005	402121790	/nfs/dbraw/zinc/12/17/90/402121790.db2.gz	QILBKAMRGOCVNV-DOMZBBRYSA-N	0	3	319.405	2.061	10	0		DEAEHN
CC(C)[C@H](O)CNC(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000152767554	402107587	/nfs/dbraw/zinc/10/75/87/402107587.db2.gz	BRXRBFNWLAHYAD-DLBZAZTESA-N	0	3	319.449	2.140	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1nc(-c2ccccc2)c[nH]1)N(C)C	ZINC000123054077	402108523	/nfs/dbraw/zinc/10/85/23/402108523.db2.gz	QSRBKVJNCSLTSU-HNNXBMFYSA-N	0	3	300.406	2.423	10	0		DEAEHN
CCOC(=O)c1cnc2c(F)cc(F)cc2c1N1CCNCC1	ZINC000053994925	402061227	/nfs/dbraw/zinc/06/12/27/402061227.db2.gz	RVVCAPMHVRKPIO-UHFFFAOYSA-N	0	3	321.327	2.099	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccccc1NCCOC)N(C)C	ZINC000153092574	402126744	/nfs/dbraw/zinc/12/67/44/402126744.db2.gz	FMURXLIHLUOHLP-MRXNPFEDSA-N	0	3	307.438	2.091	10	0		DEAEHN
CN1CC[C@H](CNC(=O)c2cnn(-c3cccc(Cl)c3)c2)C1	ZINC000066652124	402138903	/nfs/dbraw/zinc/13/89/03/402138903.db2.gz	HDVVQVMAEJDSMR-GFCCVEGCSA-N	0	3	318.808	2.207	10	0		DEAEHN
c1cn(-c2ccc(CN3CCC(n4cncn4)CC3)cc2)cn1	ZINC000101548167	402147312	/nfs/dbraw/zinc/14/73/12/402147312.db2.gz	VKWNPCZXMHZCGG-UHFFFAOYSA-N	0	3	308.389	2.301	10	0		DEAEHN
CC(C)c1ccc([C@H](C)N[C@H](C)C(=O)N2CCNC2=O)cc1	ZINC000067127593	402152779	/nfs/dbraw/zinc/15/27/79/402152779.db2.gz	NZBBQCQUDLERIV-QWHCGFSZSA-N	0	3	303.406	2.401	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2ccc3c(c2)OCCO3)CCN1C	ZINC000124826731	402199212	/nfs/dbraw/zinc/19/92/12/402199212.db2.gz	KDBFSSYKXQFSKA-JSGCOSHPSA-N	0	3	304.390	2.013	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)C1	ZINC000067731604	402170288	/nfs/dbraw/zinc/17/02/88/402170288.db2.gz	LICJLUIAKMDEEZ-ARFHVFGLSA-N	0	3	305.397	2.465	10	0		DEAEHN
C[C@@H](CC1=CCN(CCO)CC1)NC(=O)c1cc(F)ccc1F	ZINC000067894440	402177642	/nfs/dbraw/zinc/17/76/42/402177642.db2.gz	WICSWODJIOBYRO-LBPRGKRZSA-N	0	3	324.371	2.098	10	0		DEAEHN
CC(C)Cn1ncc(C(=O)NC[C@@H]2CCCN2C)c1C1CC1	ZINC000154631893	402222527	/nfs/dbraw/zinc/22/25/27/402222527.db2.gz	NEWXYQBTSLYYJV-AWEZNQCLSA-N	0	3	304.438	2.241	10	0		DEAEHN
CC(=O)Nc1cccc([C@@H](C)NC[C@]2(CCO)CCOC2)c1	ZINC000125436105	402232665	/nfs/dbraw/zinc/23/26/65/402232665.db2.gz	NIBLYOZBSHBBOK-DYVFJYSZSA-N	0	3	306.406	2.085	10	0		DEAEHN
COC(=O)[C@H]1CCN(CCC(=O)Nc2cccc(Cl)c2)C1	ZINC000107823917	402241462	/nfs/dbraw/zinc/24/14/62/402241462.db2.gz	NIUGZGHCPVDXDN-NSHDSACASA-N	0	3	310.781	2.164	10	0		DEAEHN
Cc1csc([C@@H](C)NC(=O)N2CCCN(C3CC3)CC2)n1	ZINC000069828848	402246405	/nfs/dbraw/zinc/24/64/05/402246405.db2.gz	ZJPXCOGSMIEBOJ-GFCCVEGCSA-N	0	3	308.451	2.392	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)NCc2cccc(CN(C)C)c2)n1	ZINC000125748556	402248248	/nfs/dbraw/zinc/24/82/48/402248248.db2.gz	RLBAYEMKUUGVQL-OAHLLOKOSA-N	0	3	314.433	2.439	10	0		DEAEHN
CCOCCN1CCN(CCC(=O)OC(C)(C)C)C[C@H]1CC	ZINC000105914773	402211168	/nfs/dbraw/zinc/21/11/68/402211168.db2.gz	NASUKSGZWVKLRY-OAHLLOKOSA-N	0	3	314.470	2.151	10	0		DEAEHN
CCOc1cc(C)ccc1CNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000176605236	402322663	/nfs/dbraw/zinc/32/26/63/402322663.db2.gz	HIYYSTJDHNEYIJ-MRXNPFEDSA-N	0	3	317.433	2.383	10	0		DEAEHN
Cc1cccc2[nH]c(CCC(=O)N3CCC[C@@H](N(C)C)C3)nc21	ZINC000176116894	402280739	/nfs/dbraw/zinc/28/07/39/402280739.db2.gz	IJPAEAGVCWJEEV-CQSZACIVSA-N	0	3	314.433	2.357	10	0		DEAEHN
CCc1ccc(NC(=O)NC[C@@H]2CCCN2CCOC)cc1	ZINC000110085407	402280795	/nfs/dbraw/zinc/28/07/95/402280795.db2.gz	LWKCFXKMLGBARX-INIZCTEOSA-N	0	3	305.422	2.481	10	0		DEAEHN
CCCCCS(=O)(=O)N1CC[C@H]2CC[C@@H](C1)N2C(C)C	ZINC000184613745	402283992	/nfs/dbraw/zinc/28/39/92/402283992.db2.gz	STLLLVYFRLSALX-CABCVRRESA-N	0	3	302.484	2.454	10	0		DEAEHN
Cc1c(-c2cc(CN3CC[C@@H]4OCCC[C@@H]4C3)on2)cnn1C	ZINC000184628987	402286144	/nfs/dbraw/zinc/28/61/44/402286144.db2.gz	IREBYDRLPLDQAV-DYVFJYSZSA-N	0	3	316.405	2.384	10	0		DEAEHN
C[C@H](NCC(=O)N1CC(=O)Nc2ccccc21)C1CCCC1	ZINC000184648070	402288248	/nfs/dbraw/zinc/28/82/48/402288248.db2.gz	NZMHSFUSVFFOIY-LBPRGKRZSA-N	0	3	301.390	2.140	10	0		DEAEHN
CCOc1cccnc1C(=O)NC[C@@H](C)N1CCC(C)CC1	ZINC000176192747	402288965	/nfs/dbraw/zinc/28/89/65/402288965.db2.gz	GGYJCFTWMLEAPF-CQSZACIVSA-N	0	3	305.422	2.331	10	0		DEAEHN
O=C(N[C@H]1CCOC2(CCCC2)C1)N1CC[C@@H](N2CC=CC2)C1	ZINC000157251720	402293516	/nfs/dbraw/zinc/29/35/16/402293516.db2.gz	LBVFYFYIPUCSAI-JKSUJKDBSA-N	0	3	319.449	2.134	10	0		DEAEHN
COCCCOc1ccc(C(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000176282448	402296859	/nfs/dbraw/zinc/29/68/59/402296859.db2.gz	ICFPIMBDOMSIEP-MRXNPFEDSA-N	0	3	318.417	2.022	10	0		DEAEHN
O=C(c1ncncc1Cl)N1CCCC[C@H](N2CCCC2)C1	ZINC000176314985	402298830	/nfs/dbraw/zinc/29/88/30/402298830.db2.gz	MDVOQBDMUGFCPG-LBPRGKRZSA-N	0	3	308.813	2.221	10	0		DEAEHN
Cn1cc(-c2cc(CN(C[C@H]3CCOC3)C3CC3)on2)cn1	ZINC000184981590	402314789	/nfs/dbraw/zinc/31/47/89/402314789.db2.gz	PAOIZBIISSZPLJ-GFCCVEGCSA-N	0	3	302.378	2.076	10	0		DEAEHN
CCn1cnnc1CN[C@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000228791352	402340227	/nfs/dbraw/zinc/34/02/27/402340227.db2.gz	RYFATFXINFZVJO-ZDUSSCGKSA-N	0	3	323.441	2.177	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(NC(C)=O)cc1	ZINC000176994897	402357624	/nfs/dbraw/zinc/35/76/24/402357624.db2.gz	JRCMCPDVMXGDFW-MRXNPFEDSA-N	0	3	303.406	2.201	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(-c2ccco2)on1	ZINC000177004943	402358545	/nfs/dbraw/zinc/35/85/45/402358545.db2.gz	PWXGDZFCYVXFIY-GFCCVEGCSA-N	0	3	303.362	2.491	10	0		DEAEHN
CN(C[C@@H]1CCN(C)C1)C(=O)c1ccoc1Br	ZINC000234345785	402359645	/nfs/dbraw/zinc/35/96/45/402359645.db2.gz	CDCLOYMFLYQQQB-SECBINFHSA-N	0	3	301.184	2.066	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCc1ccc(F)cc1	ZINC000177024748	402360723	/nfs/dbraw/zinc/36/07/23/402360723.db2.gz	USLQHNAUWHOSIQ-INIZCTEOSA-N	0	3	307.413	2.494	10	0		DEAEHN
COC[C@H](C)OC[C@@H](O)CN(C)Cc1ccc(Cl)cc1	ZINC000234698859	402360911	/nfs/dbraw/zinc/36/09/11/402360911.db2.gz	GPJKYYCXCRTLCX-WFASDCNBSA-N	0	3	301.814	2.184	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc2c(c1)OCCCO2	ZINC000177029970	402360959	/nfs/dbraw/zinc/36/09/59/402360959.db2.gz	AQOLZHKDZZZMQB-OAHLLOKOSA-N	0	3	318.417	2.404	10	0		DEAEHN
C[C@@]1(CNC(=O)N[C@@H]2CCOC2)CCCN1Cc1ccccc1	ZINC000344996472	404491323	/nfs/dbraw/zinc/49/13/23/404491323.db2.gz	CIEZBZLJQBEWNR-AEFFLSMTSA-N	0	3	317.433	2.129	10	0		DEAEHN
C/C(=C\c1ccc(F)cc1)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000176739858	402332336	/nfs/dbraw/zinc/33/23/36/402332336.db2.gz	OVRRSDGJDGAXRJ-ISBHARSQSA-N	0	3	306.381	2.018	10	0		DEAEHN
COc1cc(C[NH2+][C@H](C)C[C@@H](C)O)cc(Br)c1[O-]	ZINC000228072406	402336064	/nfs/dbraw/zinc/33/60/64/402336064.db2.gz	CDEPNDRAJFDWMU-RKDXNWHRSA-N	0	3	318.211	2.412	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)NCCC2=CCCCCC2)CCO1	ZINC000185263987	402339341	/nfs/dbraw/zinc/33/93/41/402339341.db2.gz	AYFDRHJZACIEMS-INIZCTEOSA-N	0	3	309.454	2.239	10	0		DEAEHN
CC[C@@H]1CN(Cc2csc(C3CC3)n2)CCN1C[C@@H](C)O	ZINC000161671342	402395438	/nfs/dbraw/zinc/39/54/38/402395438.db2.gz	FMRYXCGASYQHNT-IUODEOHRSA-N	0	3	309.479	2.298	10	0		DEAEHN
COCCN1CCC(NC(=O)[C@@H]2C[C@@H]2C2CCCCC2)CC1	ZINC000161793283	402399769	/nfs/dbraw/zinc/39/97/69/402399769.db2.gz	TZKSBYNOXYSWHV-IAGOWNOFSA-N	0	3	308.466	2.430	10	0		DEAEHN
O=C(CC1CCSCC1)NCCCNCc1cccnc1	ZINC000161876080	402402539	/nfs/dbraw/zinc/40/25/39/402402539.db2.gz	UMMQJYHTLBXBDX-UHFFFAOYSA-N	0	3	307.463	2.211	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1c(C)cccc1F	ZINC000186270518	402416605	/nfs/dbraw/zinc/41/66/05/402416605.db2.gz	QMIAYTHBKOWRRL-LBPRGKRZSA-N	0	3	302.415	2.143	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2ccc(OC)c(O)c2)C12CCOCC2	ZINC000186306497	402419225	/nfs/dbraw/zinc/41/92/25/402419225.db2.gz	OPCWSDMCBCCOFI-DLBZAZTESA-N	0	3	321.417	2.465	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)Nc1ccc(Cl)cn1	ZINC000177697784	402428134	/nfs/dbraw/zinc/42/81/34/402428134.db2.gz	ZWUWSFJXAJFKJB-CYBMUJFWSA-N	0	3	310.829	2.090	10	0		DEAEHN
CN(CCN1CCC[C@@]12CCOC2=O)Cc1ccc(F)cc1	ZINC000186657588	402452328	/nfs/dbraw/zinc/45/23/28/402452328.db2.gz	AIUSAPWOIYGUHX-KRWDZBQOSA-N	0	3	306.381	2.039	10	0		DEAEHN
COc1cccc([C@H]2C[C@H]2C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c1	ZINC000245455062	402461834	/nfs/dbraw/zinc/46/18/34/402461834.db2.gz	SJFRDAOLIFJCEO-CYGHRXIMSA-N	0	3	314.429	2.494	10	0		DEAEHN
C[C@@H]1CC[C@H]([N-]S(=O)(=O)c2ccccc2C(F)(F)F)C[NH2+]1	ZINC000164748457	402468195	/nfs/dbraw/zinc/46/81/95/402468195.db2.gz	VPYQKNRKOLCUEJ-ZJUUUORDSA-N	0	3	322.352	2.124	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CC[C@@H](Nc2ccccc2)C1	ZINC000245590109	402473360	/nfs/dbraw/zinc/47/33/60/402473360.db2.gz	AXWQXGQJYFMSJS-IAGOWNOFSA-N	0	3	316.449	2.367	10	0		DEAEHN
Cc1cccc(Cl)c1NC(=O)CN1CCN2CCC[C@H]2C1	ZINC000245650183	402476448	/nfs/dbraw/zinc/47/64/48/402476448.db2.gz	JTXVESDZPHXNDN-ZDUSSCGKSA-N	0	3	307.825	2.367	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCc2cccnc2)[C@H]1c1ccccc1	ZINC000245660323	402477441	/nfs/dbraw/zinc/47/74/41/402477441.db2.gz	PNGDXVXJMDTSOP-DLBZAZTESA-N	0	3	310.401	2.326	10	0		DEAEHN
CN(C)C1(CN(C)C(=O)CCc2nc(C(C)(C)C)no2)CCC1	ZINC000187016493	402478373	/nfs/dbraw/zinc/47/83/73/402478373.db2.gz	HYAPJFDYEHRPJL-UHFFFAOYSA-N	0	3	322.453	2.242	10	0		DEAEHN
C[C@H](C(=O)N[C@H]1Cc2ccccc2[C@@H]1O)N1CCCCCC1	ZINC000178298793	402482029	/nfs/dbraw/zinc/48/20/29/402482029.db2.gz	RGERTJXGYUXHEW-COXVUDFISA-N	0	3	302.418	2.025	10	0		DEAEHN
CN(CCN1CC[C@](O)(C(F)(F)F)C1)Cc1ccc(F)cc1	ZINC000187134665	402484629	/nfs/dbraw/zinc/48/46/29/402484629.db2.gz	LTEKMSOLPJKOGK-CQSZACIVSA-N	0	3	320.330	2.257	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)CC1CCCC1	ZINC000178354172	402488782	/nfs/dbraw/zinc/48/87/82/402488782.db2.gz	KPCWIJLDGLLXOH-HUUCEWRRSA-N	0	3	300.468	2.065	10	0		DEAEHN
C[C@H]1CN(C)CC[C@H]1N(C)C(=O)NCc1ccc(Cl)cn1	ZINC000245847182	402491524	/nfs/dbraw/zinc/49/15/24/402491524.db2.gz	FTQPJPJIODYUCY-SMDDNHRTSA-N	0	3	310.829	2.217	10	0		DEAEHN
COc1ccc([C@H](C)CN2CCN(C[C@H](C)O)[C@H](C)C2)cc1	ZINC000245867689	402492592	/nfs/dbraw/zinc/49/25/92/402492592.db2.gz	QRVXRWLDQARHTO-OAGGEKHMSA-N	0	3	306.450	2.186	10	0		DEAEHN
C[C@]1(c2ccccc2)CC[C@@H](N2CC[C@H](NS(C)(=O)=O)C2)C1	ZINC000187334006	402494481	/nfs/dbraw/zinc/49/44/81/402494481.db2.gz	TUGBNZNCHYEFJB-BBWFWOEESA-N	0	3	322.474	2.120	10	0		DEAEHN
COc1cccc(CNC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1	ZINC000245931968	402499031	/nfs/dbraw/zinc/49/90/31/402499031.db2.gz	PNMCEYRCGLCBKW-DOTOQJQBSA-N	0	3	317.433	2.321	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccn(C2CCCC2)n1	ZINC000245964760	402500993	/nfs/dbraw/zinc/50/09/93/402500993.db2.gz	DLMKSXRJJNEXJU-HIFRSBDPSA-N	0	3	302.422	2.307	10	0		DEAEHN
COc1cc(CN(C)C[C@@H]2CCCC[C@H]2O)cc2c1OCCO2	ZINC000245991224	402502709	/nfs/dbraw/zinc/50/27/09/402502709.db2.gz	QUASEJRATYKPGH-LSDHHAIUSA-N	0	3	321.417	2.449	10	0		DEAEHN
C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000246038218	402504996	/nfs/dbraw/zinc/50/49/96/402504996.db2.gz	WNRRZMGFOSBGMF-WQVCFCJDSA-N	0	3	315.417	2.057	10	0		DEAEHN
NC(=O)c1coc(CN[C@H]2CCCN(Cc3ccccc3)C2)c1	ZINC000187718391	402509323	/nfs/dbraw/zinc/50/93/23/402509323.db2.gz	GWMAENULZOYCOS-INIZCTEOSA-N	0	3	313.401	2.133	10	0		DEAEHN
COC(=O)Nc1ccccc1C(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000246756088	402543689	/nfs/dbraw/zinc/54/36/89/402543689.db2.gz	AJWXBTWPTSTWNQ-STQMWFEESA-N	0	3	317.389	2.174	10	0		DEAEHN
CN(C)c1nc(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)ns1	ZINC000246793275	402545047	/nfs/dbraw/zinc/54/50/47/402545047.db2.gz	MJZPZFFDZCIDJJ-GXTWGEPZSA-N	0	3	321.494	2.053	10	0		DEAEHN
C[C@@H](CNC(=O)OC(C)(C)C)N(C)C[C@@H](O)COC(C)(C)C	ZINC000246849864	402547451	/nfs/dbraw/zinc/54/74/51/402547451.db2.gz	PBPSRHOFWXCKJH-QWHCGFSZSA-N	0	3	318.458	2.007	10	0		DEAEHN
CCOC(=O)Nc1ccc(NC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000171076871	402555200	/nfs/dbraw/zinc/55/52/00/402555200.db2.gz	NZDKSYGKLKVCDQ-AWEZNQCLSA-N	0	3	320.393	2.423	10	0		DEAEHN
COCCOc1cccc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000247123729	402557366	/nfs/dbraw/zinc/55/73/66/402557366.db2.gz	JDQVFEJHTQDHJE-ZBFHGGJFSA-N	0	3	318.417	2.021	10	0		DEAEHN
Cc1ccc(OCCCNC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000171191111	402565220	/nfs/dbraw/zinc/56/52/20/402565220.db2.gz	JSNNTLNBHYXBON-HNNXBMFYSA-N	0	3	305.422	2.157	10	0		DEAEHN
COc1ccc(CC[C@@H](C)NC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000171193562	402565862	/nfs/dbraw/zinc/56/58/62/402565862.db2.gz	FFKGWIBRQRROFT-ZBFHGGJFSA-N	0	3	319.449	2.410	10	0		DEAEHN
C[C@@H](NCC(=O)N(C)CC1CC1)c1cccc(-n2ccnc2)c1	ZINC000189911296	402566282	/nfs/dbraw/zinc/56/62/82/402566282.db2.gz	ZWXITNHJQKWHRM-CQSZACIVSA-N	0	3	312.417	2.391	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(-c2cccnc2)on1	ZINC000247461398	402567549	/nfs/dbraw/zinc/56/75/49/402567549.db2.gz	QVNQTKMGCLSMDY-JSGCOSHPSA-N	0	3	312.373	2.045	10	0		DEAEHN
COc1cc(C)c(C(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1OC	ZINC000246182648	402515943	/nfs/dbraw/zinc/51/59/43/402515943.db2.gz	NEONEPKTUQWSSO-ZIAGYGMSSA-N	0	3	318.417	2.321	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@@H]1CCC(C)(C)O1	ZINC000188179673	402516490	/nfs/dbraw/zinc/51/64/90/402516490.db2.gz	ZVILJVMKUZSDCE-ILXRZTDVSA-N	0	3	309.454	2.212	10	0		DEAEHN
CCC[C@H](NC(=O)CN1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000178623099	402518438	/nfs/dbraw/zinc/51/84/38/402518438.db2.gz	GFMCAWFJUAVCPP-MSOLQXFVSA-N	0	3	315.461	2.424	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@H](C)N2CCN3CCC[C@@H]3C2)cc1C	ZINC000178622969	402518539	/nfs/dbraw/zinc/51/85/39/402518539.db2.gz	NTROCMZVJVNXNO-NVXWUHKLSA-N	0	3	301.434	2.410	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]23)C1	ZINC000246278767	402522634	/nfs/dbraw/zinc/52/26/34/402522634.db2.gz	ZVOQBHLFIXVWIF-DZJNRPSUSA-N	0	3	313.445	2.498	10	0		DEAEHN
COc1cc(C)cc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1O	ZINC000246282978	402522962	/nfs/dbraw/zinc/52/29/62/402522962.db2.gz	BQJJQLXYCAMHBC-OCCSQVGLSA-N	0	3	306.406	2.168	10	0		DEAEHN
CC(C)NC(=O)NC(=O)[C@H](C)N1CCC[C@]2(CC=CCC2)C1	ZINC000246293050	402523588	/nfs/dbraw/zinc/52/35/88/402523588.db2.gz	BFMKHMWJGUNIIV-WMLDXEAASA-N	0	3	307.438	2.431	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N[C@@H]2CCCN(CC)C2)C12CCC2	ZINC000246336251	402526166	/nfs/dbraw/zinc/52/61/66/402526166.db2.gz	OQVFNNCIKYPKNP-QLFBSQMISA-N	0	3	309.454	2.118	10	0		DEAEHN
Cc1ccccc1C1(CNC(=O)N2CC[C@H](N(C)C)C2)CC1	ZINC000170836655	402531623	/nfs/dbraw/zinc/53/16/23/402531623.db2.gz	NAGHEEKYNAXOJB-HNNXBMFYSA-N	0	3	301.434	2.372	10	0		DEAEHN
CC(=O)c1ccc(OCCCC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170859836	402533572	/nfs/dbraw/zinc/53/35/72/402533572.db2.gz	ZPDAUOFMZDAEQZ-MRXNPFEDSA-N	0	3	318.417	2.211	10	0		DEAEHN
COc1ccc(OCCCC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170862356	402534266	/nfs/dbraw/zinc/53/42/66/402534266.db2.gz	MPQILUVQOXHLLL-CQSZACIVSA-N	0	3	306.406	2.017	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)CCCOCCc2ccccc2)C1	ZINC000170865173	402535153	/nfs/dbraw/zinc/53/51/53/402535153.db2.gz	YDRJSFAJJJCPJI-KRWDZBQOSA-N	0	3	304.434	2.188	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCCCc1ccccn1	ZINC000179175176	402578252	/nfs/dbraw/zinc/57/82/52/402578252.db2.gz	XANROCVPYGXBFH-MRXNPFEDSA-N	0	3	306.454	2.290	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCC(C)(C)CCO)[C@@H]1c1ccccc1	ZINC000247977840	402579145	/nfs/dbraw/zinc/57/91/45/402579145.db2.gz	GUDWFADEPIGBNV-HOTGVXAUSA-N	0	3	319.449	2.140	10	0		DEAEHN
CN(C[C@@H]1CCCO1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000179263219	402583647	/nfs/dbraw/zinc/58/36/47/402583647.db2.gz	GRCOVSNOMGJPPH-BBWFWOEESA-N	0	3	317.433	2.252	10	0		DEAEHN
Cc1n[nH]c(C)c1[C@@H](C)CC(=O)N1CCCN(C2CC2)CC1	ZINC000179726097	402598708	/nfs/dbraw/zinc/59/87/08/402598708.db2.gz	QMUVXHGCBBXCON-LBPRGKRZSA-N	0	3	304.438	2.217	10	0		DEAEHN
Cc1ccc(NC(=O)[C@H](C)N2CCN3CCC[C@@H]3C2)c(C)c1	ZINC000171639475	402604318	/nfs/dbraw/zinc/60/43/18/402604318.db2.gz	XEMWYTRKEYBVTM-JKSUJKDBSA-N	0	3	301.434	2.410	10	0		DEAEHN
C[C@H](O)CN1CCN(CCSCc2ccccc2)C[C@H]1C	ZINC000248708323	402604880	/nfs/dbraw/zinc/60/48/80/402604880.db2.gz	BMKAORYSPCKVLK-CVEARBPZSA-N	0	3	308.491	2.307	10	0		DEAEHN
O=C1O[C@H](CN2C[C@@H](c3ccsc3)[C@H](CO)C2)CC12CCC2	ZINC000248846880	402611014	/nfs/dbraw/zinc/61/10/14/402611014.db2.gz	NJTFVROSJYRSSB-KKUMJFAQSA-N	0	3	321.442	2.242	10	0		DEAEHN
Cc1cc(C(=O)N2CCN3CCC[C@H]3C2)nn1-c1ccc(C)cc1	ZINC000180284953	402611911	/nfs/dbraw/zinc/61/19/11/402611911.db2.gz	ATVXAFCOKGJFAG-KRWDZBQOSA-N	0	3	324.428	2.409	10	0		DEAEHN
O=C([C@H]1CCCc2c(O)cccc21)N1CCN2CCC[C@H]2C1	ZINC000248914462	402614629	/nfs/dbraw/zinc/61/46/29/402614629.db2.gz	SJKAXFHAMCVHLW-BBRMVZONSA-N	0	3	300.402	2.119	10	0		DEAEHN
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)NC(C)(C)C)C1	ZINC000190677663	402617794	/nfs/dbraw/zinc/61/77/94/402617794.db2.gz	ZRGSLMFGTBNJRD-OAHLLOKOSA-N	0	3	304.438	2.343	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(C(=O)Nc3ccsc3)C2)CC1	ZINC000180573185	402620186	/nfs/dbraw/zinc/62/01/86/402620186.db2.gz	VWYGQTSNZBUBLC-OAHLLOKOSA-N	0	3	322.478	2.382	10	0		DEAEHN
CCc1cc(NC(=O)C(=O)NC[C@H](C)N(C)C2CC2)ccc1C	ZINC000180599016	402621581	/nfs/dbraw/zinc/62/15/81/402621581.db2.gz	PTDHEPWHNGJRDG-ZDUSSCGKSA-N	0	3	317.433	2.095	10	0		DEAEHN
c1cn(-c2ccccc2)c(CNCCCCN2CCOCC2)n1	ZINC000190774684	402622252	/nfs/dbraw/zinc/62/22/52/402622252.db2.gz	LORPHAVJELLWLZ-UHFFFAOYSA-N	0	3	314.433	2.074	10	0		DEAEHN
C[C@H](CNC(=O)NC[C@@H]1CCC(C)(C)O1)N1CCC[C@@H](C)C1	ZINC000249281667	402624879	/nfs/dbraw/zinc/62/48/79/402624879.db2.gz	PYNBIEFPDLDACD-KFWWJZLASA-N	0	3	311.470	2.364	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cccnc2N2CCCCC2)C1	ZINC000171319436	402577684	/nfs/dbraw/zinc/57/76/84/402577684.db2.gz	NWZKZQRZUGXQCU-HNNXBMFYSA-N	0	3	316.449	2.286	10	0		DEAEHN
CC1CCN(CCNC(=O)NCCCc2ccccn2)CC1	ZINC000179170829	402577708	/nfs/dbraw/zinc/57/77/08/402577708.db2.gz	KLDFXLNTRLZWAF-UHFFFAOYSA-N	0	3	304.438	2.045	10	0		DEAEHN
O=C(NCCCOc1ccc(F)cc1)N1CCN2CCC[C@H]2C1	ZINC000171905307	402632403	/nfs/dbraw/zinc/63/24/03/402632403.db2.gz	GOMMMKFIVBYFLQ-HNNXBMFYSA-N	0	3	321.396	2.084	10	0		DEAEHN
COCCOc1ccc(C(=O)NCCN2CCCC[C@@H]2C)cc1	ZINC000171959921	402635436	/nfs/dbraw/zinc/63/54/36/402635436.db2.gz	GLZOXCUXQXPTDH-HNNXBMFYSA-N	0	3	320.433	2.316	10	0		DEAEHN
CCOc1ccccc1CCNC(=O)N1CCN2CCC[C@H]2C1	ZINC000171906907	402632968	/nfs/dbraw/zinc/63/29/68/402632968.db2.gz	SRWMTLYHTJFCGY-INIZCTEOSA-N	0	3	317.433	2.117	10	0		DEAEHN
CN(Cc1cnn(C)c1)C(=O)CN1CCC[C@@]2(CC=CCC2)C1	ZINC000172282418	402647897	/nfs/dbraw/zinc/64/78/97/402647897.db2.gz	JXGIXBBLFGPOPP-SFHVURJKSA-N	0	3	316.449	2.201	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1ccn([C@H](C)COC)n1	ZINC000251847630	402650105	/nfs/dbraw/zinc/65/01/05/402650105.db2.gz	PJKKODIEZAMPIG-ZIAGYGMSSA-N	0	3	323.441	2.039	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NC[C@@H](O)CC(C)(C)C	ZINC000172326697	402650197	/nfs/dbraw/zinc/65/01/97/402650197.db2.gz	FFFGZHHRPJKYQN-KBPBESRZSA-N	0	3	301.475	2.059	10	0		DEAEHN
CN1C(=O)C[C@@H](NCCn2cccn2)[C@H]1c1ccc(Cl)cc1	ZINC000192151174	402714468	/nfs/dbraw/zinc/71/44/68/402714468.db2.gz	MSKMMKIUYDQVRC-GDBMZVCRSA-N	0	3	318.808	2.098	10	0		DEAEHN
COC(=O)CCCN[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1	ZINC000192150661	402714683	/nfs/dbraw/zinc/71/46/83/402714683.db2.gz	KCYAHDYQFODTIZ-XJKSGUPXSA-N	0	3	324.808	2.155	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)NCC2(C)OCCCO2)c1	ZINC000192192021	402716210	/nfs/dbraw/zinc/71/62/10/402716210.db2.gz	OMADZBGCXVEGJT-UHFFFAOYSA-N	0	3	307.394	2.023	10	0		DEAEHN
CC[C@H](CCO)CNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000252801547	402661367	/nfs/dbraw/zinc/66/13/67/402661367.db2.gz	UBJHDMRLAXOOBL-PVAVHDDUSA-N	0	3	319.449	2.140	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@H]2Oc3ccccc3O[C@H]2C)CCN1C	ZINC000172619348	402666890	/nfs/dbraw/zinc/66/68/90/402666890.db2.gz	UQWFOXUOYFFRGV-FHIRATQRSA-N	0	3	318.417	2.156	10	0		DEAEHN
C[C@H](NC(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21)c1ccncc1	ZINC000182206887	402671851	/nfs/dbraw/zinc/67/18/51/402671851.db2.gz	OSAIGCCNNHFGTQ-IMJJTQAJSA-N	0	3	302.422	2.268	10	0		DEAEHN
CN(C)C(=O)CC1CCN(C[C@@](C)(O)c2ccccc2)CC1	ZINC000182226277	402673863	/nfs/dbraw/zinc/67/38/63/402673863.db2.gz	BXHSDHFYNXVKAY-GOSISDBHSA-N	0	3	304.434	2.084	10	0		DEAEHN
Cc1ccc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)c(C)c1O	ZINC000261944485	402720074	/nfs/dbraw/zinc/72/00/74/402720074.db2.gz	VGPMDZOMPXEPFP-HNJNHCNJSA-N	0	3	318.417	2.480	10	0		DEAEHN
COC[C@@H](C)N1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000173253011	402689669	/nfs/dbraw/zinc/68/96/69/402689669.db2.gz	PWFHUZPQLVTIMH-CQSZACIVSA-N	0	3	302.418	2.323	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)s1	ZINC000173391208	402695642	/nfs/dbraw/zinc/69/56/42/402695642.db2.gz	AGQBTZVDMPOESY-CHWSQXEVSA-N	0	3	324.494	2.372	10	0		DEAEHN
Cc1cccc2c1OCC[C@H]2NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000191908960	402698207	/nfs/dbraw/zinc/69/82/07/402698207.db2.gz	HPZFIZVTCWLAKE-GDBMZVCRSA-N	0	3	315.417	2.308	10	0		DEAEHN
CC(C)(C)c1nnsc1C(=O)NC[C@H]1CCN(C2CC2)C1	ZINC000191952723	402700838	/nfs/dbraw/zinc/70/08/38/402700838.db2.gz	RURCFKDGKACSDM-SNVBAGLBSA-N	0	3	308.451	2.050	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H](C)CCc2cccn2C)C1	ZINC000174238048	402733245	/nfs/dbraw/zinc/73/32/45/402733245.db2.gz	QYRGXKCITCBTKR-LSDHHAIUSA-N	0	3	306.454	2.130	10	0		DEAEHN
COc1ccc(NC(=O)CN[C@@H](C)[C@H]2CCCO2)cc1Cl	ZINC000183222867	402748754	/nfs/dbraw/zinc/74/87/54/402748754.db2.gz	MOCWKKFZMJPRDK-GXFFZTMASA-N	0	3	312.797	2.444	10	0		DEAEHN
O=C(NCCCC1CCCC1)NC[C@H](O)CN1CCCCC1	ZINC000192804626	402751092	/nfs/dbraw/zinc/75/10/92/402751092.db2.gz	OHNUHMQBPLZRIF-INIZCTEOSA-N	0	3	311.470	2.103	10	0		DEAEHN
CC(C)Oc1ccccc1Cc1nc([C@@H]2CNCCN2C)no1	ZINC000263276856	402753106	/nfs/dbraw/zinc/75/31/06/402753106.db2.gz	SYOKBKLZNGUGHF-AWEZNQCLSA-N	0	3	316.405	2.024	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cc(C(=O)OC)ccc2C)C1	ZINC000194320975	402792477	/nfs/dbraw/zinc/79/24/77/402792477.db2.gz	WNAXUUCEDNZRSN-CQSZACIVSA-N	0	3	319.405	2.387	10	0		DEAEHN
CCc1c(C(=O)N2CCN3CCC[C@@H]3C2)cnn1-c1ccccc1	ZINC000195329232	402842428	/nfs/dbraw/zinc/84/24/28/402842428.db2.gz	MZIVLCFKQYMOLO-MRXNPFEDSA-N	0	3	324.428	2.355	10	0		DEAEHN
O[C@H]1c2ccccc2C[C@@H]1N1CCCN(c2ccccn2)CC1	ZINC000183811417	402799725	/nfs/dbraw/zinc/79/97/25/402799725.db2.gz	QXMPTOBGJORKTR-HKUYNNGSSA-N	0	3	309.413	2.252	10	0		DEAEHN
O=C(c1cc(F)cc2[nH]c(=S)[nH]c21)N1CCN2CCC[C@H]2C1	ZINC000195336102	402842504	/nfs/dbraw/zinc/84/25/04/402842504.db2.gz	ZWCSOHGTRYUKRI-JTQLQIEISA-N	0	3	320.393	2.285	10	0		DEAEHN
COc1ccc2[nH]cc(CC(=O)N3CCN4CCC[C@@H]4C3)c2c1	ZINC000195332304	402842522	/nfs/dbraw/zinc/84/25/22/402842522.db2.gz	BZRCMJHVWLIKNJ-CQSZACIVSA-N	0	3	313.401	2.026	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCC[C@H](n2cc(C)cn2)C1	ZINC000175377430	402801461	/nfs/dbraw/zinc/80/14/61/402801461.db2.gz	RUWRASANEUATMV-CVEARBPZSA-N	0	3	319.453	2.022	10	0		DEAEHN
COc1ccc2[nH]cc(CC(=O)N3CCN4CCC[C@H]4C3)c2c1	ZINC000195332316	402842563	/nfs/dbraw/zinc/84/25/63/402842563.db2.gz	BZRCMJHVWLIKNJ-AWEZNQCLSA-N	0	3	313.401	2.026	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)S(=O)(=O)Cc1cccc(F)c1	ZINC000175392589	402802362	/nfs/dbraw/zinc/80/23/62/402802362.db2.gz	JPCPWSMNQLVUJP-OAHLLOKOSA-N	0	3	314.426	2.072	10	0		DEAEHN
C[C@@]1(CNC(=O)NCCCCO)CCCN1Cc1ccccc1	ZINC000194574667	402803264	/nfs/dbraw/zinc/80/32/64/402803264.db2.gz	GLLIFRHXNCGEMJ-SFHVURJKSA-N	0	3	319.449	2.113	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1cn(C)nc1-c1ccccc1)N(C)C	ZINC000183960609	402808869	/nfs/dbraw/zinc/80/88/69/402808869.db2.gz	TWNJDMDTKWWADN-INIZCTEOSA-N	0	3	314.433	2.434	10	0		DEAEHN
COCCN(C)CCNC(=O)NCc1ccc(C(F)F)cc1	ZINC000184102822	402818470	/nfs/dbraw/zinc/81/84/70/402818470.db2.gz	OOALTLSZIXFQQQ-UHFFFAOYSA-N	0	3	315.364	2.002	10	0		DEAEHN
CC(C)NC(=O)CCN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000195197108	402835799	/nfs/dbraw/zinc/83/57/99/402835799.db2.gz	CIKAGEOGMCHAQC-UHFFFAOYSA-N	0	3	323.481	2.062	10	0		DEAEHN
CCCOc1ccc(OCCN[C@H](C(=O)NC)C(C)C)cc1	ZINC000183639341	402784247	/nfs/dbraw/zinc/78/42/47/402784247.db2.gz	VBHHDXVZUZMVFZ-INIZCTEOSA-N	0	3	308.422	2.214	10	0		DEAEHN
Cc1ccc(C(=O)CCC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000195313670	402841820	/nfs/dbraw/zinc/84/18/20/402841820.db2.gz	FIBHEWNQMYZGSO-MRXNPFEDSA-N	0	3	300.402	2.265	10	0		DEAEHN
C[C@@H](CCc1cccn1C)NC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000176032809	402849188	/nfs/dbraw/zinc/84/91/88/402849188.db2.gz	MIIVFEZUQLKJNV-RDJZCZTQSA-N	0	3	316.449	2.002	10	0		DEAEHN
C[C@@H](CN1CCN(C)CC1)Nc1ncnc2cc(Cl)ccc21	ZINC000264422551	402877225	/nfs/dbraw/zinc/87/72/25/402877225.db2.gz	RJALRMAVWFVDHK-LBPRGKRZSA-N	0	3	319.840	2.331	10	0		DEAEHN
CC(=O)c1ccc(CC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000265947332	402964319	/nfs/dbraw/zinc/96/43/19/402964319.db2.gz	KBUNWJKECHIQAZ-SUMWQHHRSA-N	0	3	302.418	2.373	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCc2cn3ccsc3n2)CCN1C	ZINC000266637210	402980238	/nfs/dbraw/zinc/98/02/38/402980238.db2.gz	BCUGGPVKFSIDJC-WCQYABFASA-N	0	3	321.450	2.020	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N[C@@H]2c3ccccc3C[C@@H]2O)C12CCOCC2	ZINC000186271281	286290663	/nfs/dbraw/zinc/29/06/63/286290663.db2.gz	WJOJPPJKOUTQRI-BSDSXHPESA-N	0	3	317.429	2.209	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@H]1NCc1sccc1Br	ZINC000282216293	403133106	/nfs/dbraw/zinc/13/31/06/403133106.db2.gz	DRRVARWJVQKOHF-IONNQARKSA-N	0	3	303.225	2.267	10	0		DEAEHN
CN(C(=O)c1coc(Br)c1)C1CCN(C)CC1	ZINC000298278513	403348971	/nfs/dbraw/zinc/34/89/71/403348971.db2.gz	AIIJXVNWUPXEHO-UHFFFAOYSA-N	0	3	301.184	2.208	10	0		DEAEHN
Cc1cc(C)n(-c2cncc(NCCN3CCC(C)CC3)n2)n1	ZINC000301164361	403596641	/nfs/dbraw/zinc/59/66/41/403596641.db2.gz	IBHWXRQNXBHNFE-UHFFFAOYSA-N	0	3	314.437	2.423	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)N[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000343512706	403618442	/nfs/dbraw/zinc/61/84/42/403618442.db2.gz	NEASBKMTLVPJDE-IUODEOHRSA-N	0	3	318.421	2.274	10	0		DEAEHN
O=C1COc2ccc(CN3CCOC[C@H](C4CCC4)C3)cc2N1	ZINC000293997006	403619995	/nfs/dbraw/zinc/61/99/95/403619995.db2.gz	SMRDUZDWTLDLIR-OAHLLOKOSA-N	0	3	316.401	2.266	10	0		DEAEHN
Cc1cc(C)n(-c2cncc(NCCN3CCC[C@@H](C)C3)n2)n1	ZINC000301504992	403638688	/nfs/dbraw/zinc/63/86/88/403638688.db2.gz	GMQWGNDXRQYGOB-CYBMUJFWSA-N	0	3	314.437	2.423	10	0		DEAEHN
C(CN1CCCCC1)O[C@@H]1CCN(c2nnc(C3CC3)s2)C1	ZINC000301858462	403691878	/nfs/dbraw/zinc/69/18/78/403691878.db2.gz	SGGCTZVGVPGHSI-CQSZACIVSA-N	0	3	322.478	2.497	10	0		DEAEHN
CC(C)c1nc([C@H]2CCCN2C(=O)NC[C@@H]2CCCN2C)no1	ZINC000333038478	403650882	/nfs/dbraw/zinc/65/08/82/403650882.db2.gz	YBLRINTZGHELEN-QWHCGFSZSA-N	0	3	321.425	2.134	10	0		DEAEHN
CCC[C@H](N)c1cn(CC(=O)N(CC)Cc2ccccc2)nn1	ZINC000304085212	403766730	/nfs/dbraw/zinc/76/67/30/403766730.db2.gz	LSXMFSJAULKGFE-HNNXBMFYSA-N	0	3	315.421	2.127	10	0		DEAEHN
CCN(C)[C@@H]1CCN(c2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000302755827	403722179	/nfs/dbraw/zinc/72/21/79/403722179.db2.gz	IQIDPCCHYDEVJM-GFCCVEGCSA-N	0	3	318.389	2.213	10	0		DEAEHN
COCCN1CCC[C@@H]1CNc1ncnc2c(F)cccc12	ZINC000302916614	403743704	/nfs/dbraw/zinc/74/37/04/403743704.db2.gz	WGJOLXWLQMTRCM-GFCCVEGCSA-N	0	3	304.369	2.292	10	0		DEAEHN
CCC[C@H](O)CN1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000295948820	404024333	/nfs/dbraw/zinc/02/43/33/404024333.db2.gz	LQDKVSRUVDVUGG-HOTGVXAUSA-N	0	3	319.449	2.296	10	0		DEAEHN
Cc1c[nH]nc1CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000289464040	403975432	/nfs/dbraw/zinc/97/54/32/403975432.db2.gz	IJMBBDBVNJTCJZ-OLZOCXBDSA-N	0	3	308.426	2.453	10	0		DEAEHN
CO[C@H]1C[C@@H](CO)N(CCc2cccc(OC(F)(F)F)c2)C1	ZINC000344726071	404333410	/nfs/dbraw/zinc/33/34/10/404333410.db2.gz	SYICTKNCGDZTMC-JSGCOSHPSA-N	0	3	319.323	2.209	10	0		DEAEHN
CO[C@@H]1C[C@@H](CO)N(Cc2ccccc2OCC(F)(F)F)C1	ZINC000344668424	404295214	/nfs/dbraw/zinc/29/52/14/404295214.db2.gz	ANUYXMOXKQQAMD-QWHCGFSZSA-N	0	3	319.323	2.209	10	0		DEAEHN
CN(C)c1ccc(NC(=O)N2CCCC23CCN(C)CC3)cn1	ZINC000371404804	404459300	/nfs/dbraw/zinc/45/93/00/404459300.db2.gz	VFAWLGJIESBLKB-UHFFFAOYSA-N	0	3	317.437	2.240	10	0		DEAEHN
COC[C@H](C)N1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1	ZINC000373808145	404595286	/nfs/dbraw/zinc/59/52/86/404595286.db2.gz	ZQRVZOUTOUHGIH-DXCKQFNASA-N	0	3	305.422	2.411	10	0		DEAEHN
CC(=O)c1cccc(OC[C@@H](O)CN(C(C)C)[C@@H]2CCOC2)c1	ZINC000291953163	404598076	/nfs/dbraw/zinc/59/80/76/404598076.db2.gz	UQDHVGGJMKPNKV-SJORKVTESA-N	0	3	321.417	2.128	10	0		DEAEHN
Cc1cnc([C@H](C)N2CCC[C@@H]2[C@H]2COCC[C@]2(C)O)cn1	ZINC000330245915	404599690	/nfs/dbraw/zinc/59/96/90/404599690.db2.gz	KXMMOYBZBFUSLY-ABFRBSLYSA-N	0	3	305.422	2.098	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(CCCc2ccsc2)CC12COC2	ZINC000451141291	404877984	/nfs/dbraw/zinc/87/79/84/404877984.db2.gz	VEJUWICHDPTBIS-AWEZNQCLSA-N	0	3	309.431	2.192	10	0		DEAEHN
Cc1ncc2c(n1)CC[C@@H](NCc1ccc(-c3cc[nH]n3)o1)C2	ZINC000378218140	404897829	/nfs/dbraw/zinc/89/78/29/404897829.db2.gz	GMDZQSHGPZLBKB-CYBMUJFWSA-N	0	3	309.373	2.415	10	0		DEAEHN
COC[C@H](CCO)NCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000360955301	404861033	/nfs/dbraw/zinc/86/10/33/404861033.db2.gz	QRHOZAMGLXQYCS-HNNXBMFYSA-N	0	3	309.406	2.129	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)[C@H](C)N[C@H]2CCOC2(C)C)cc1	ZINC000451238817	404915514	/nfs/dbraw/zinc/91/55/14/404915514.db2.gz	FAQGVOQRLFCCMM-NHYWBVRUSA-N	0	3	304.390	2.373	10	0		DEAEHN
COC(=O)CCCN1CCC(Nc2cn(C)nc2C(C)C)CC1	ZINC000361135884	404937891	/nfs/dbraw/zinc/93/78/91/404937891.db2.gz	JKCOVVDWIGJAAS-UHFFFAOYSA-N	0	3	322.453	2.373	10	0		DEAEHN
CC(=O)c1cccc(CN2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)c1	ZINC000451304294	404947982	/nfs/dbraw/zinc/94/79/82/404947982.db2.gz	ODWNJHKNECWAIX-RCCFBDPRSA-N	0	3	303.402	2.251	10	0		DEAEHN
C/C=C\CNC[C@H](O)COc1cccc(Br)c1	ZINC000385061321	405034378	/nfs/dbraw/zinc/03/43/78/405034378.db2.gz	UUUWVNDJSZSAHF-DLGQBQFBSA-N	0	3	300.196	2.355	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N[C@@H](CC(C)C)CN(C)C)cc1O	ZINC000436654553	405118702	/nfs/dbraw/zinc/11/87/02/405118702.db2.gz	ARJBKALDWVIYQC-AWEZNQCLSA-N	0	3	306.406	2.301	10	0		DEAEHN
CC(=O)CCc1ccc(OC[C@@H](O)CN2CC[C@@H]2C2CC2)cc1	ZINC000453043664	405278800	/nfs/dbraw/zinc/27/88/00/405278800.db2.gz	UNFQCBPTZZMYDE-PKOBYXMFSA-N	0	3	317.429	2.432	10	0		DEAEHN
O=C(CNC1(c2ccccc2)CCCCC1)N1CCOCC1	ZINC000440914091	405331123	/nfs/dbraw/zinc/33/11/23/405331123.db2.gz	RRIUSHUCUXKHEX-UHFFFAOYSA-N	0	3	302.418	2.294	10	0		DEAEHN
c1cc(-c2noc(CN3CCNC[C@H]3c3ccccc3)n2)co1	ZINC000420415261	405347334	/nfs/dbraw/zinc/34/73/34/405347334.db2.gz	UYLXRVGRMBGAQR-HNNXBMFYSA-N	0	3	310.357	2.476	10	0		DEAEHN
Cc1csc([C@@H](C)NC(=O)Nc2ccnn2CCN(C)C)n1	ZINC000455667819	405442553	/nfs/dbraw/zinc/44/25/53/405442553.db2.gz	KKOLMJFDWSVCFA-LLVKDONJSA-N	0	3	322.438	2.092	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2ccc(C)cc2OC)CC12COC2	ZINC000449363837	405524985	/nfs/dbraw/zinc/52/49/85/405524985.db2.gz	MKPKUAIPHWXZNZ-HNNXBMFYSA-N	0	3	319.401	2.015	10	0		DEAEHN
c1cc(CN[C@@H](Cc2ccccc2)CN2CCOCC2)sn1	ZINC000638638884	405586800	/nfs/dbraw/zinc/58/68/00/405586800.db2.gz	KTCWZBMZSAUOMD-INIZCTEOSA-N	0	3	317.458	2.176	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1C[C@@H]2CCCC[C@@]21C	ZINC000638757327	405651827	/nfs/dbraw/zinc/65/18/27/405651827.db2.gz	LGSLNKKUAABIIS-LNLFQRSKSA-N	0	3	315.461	2.237	10	0		DEAEHN
COC(=O)C(C)(C)N1CCN(C[C@@H](C)c2ccccc2)CC1	ZINC000494385524	405687106	/nfs/dbraw/zinc/68/71/06/405687106.db2.gz	KRGOWPVWLCRTNH-OAHLLOKOSA-N	0	3	304.434	2.359	10	0		DEAEHN
Cn1ccc(N2CCC[C@H](N[C@H]3CC[C@H]3C3CCC3)C2=O)n1	ZINC000558696370	405692187	/nfs/dbraw/zinc/69/21/87/405692187.db2.gz	UHUGSZYLQONHLW-KKUMJFAQSA-N	0	3	302.422	2.084	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N[C@@H]2C[C@@H](N(C)C)C2(C)C)c1C	ZINC000636087319	405728291	/nfs/dbraw/zinc/72/82/91/405728291.db2.gz	OUQKKFDCRJPTBA-CHWSQXEVSA-N	0	3	305.422	2.293	10	0		DEAEHN
CC(C)Cn1ncc2cc(C(=O)NC(C)(C)CN(C)C)cnc21	ZINC000457214588	405756954	/nfs/dbraw/zinc/75/69/54/405756954.db2.gz	WZVFVWPBWMXEHV-UHFFFAOYSA-N	0	3	317.437	2.157	10	0		DEAEHN
C[C@@H](CC1CCC1)NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638994804	405808043	/nfs/dbraw/zinc/80/80/43/405808043.db2.gz	OXYUMNWHIBQMRB-YOEHRIQHSA-N	0	3	303.450	2.141	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N(C)C[C@@H]2CCCN(C)C2)c1	ZINC000457557498	405895746	/nfs/dbraw/zinc/89/57/46/405895746.db2.gz	FNFBQORZGPSABG-CQSZACIVSA-N	0	3	318.417	2.195	10	0		DEAEHN
Cc1ccc2c(c1)[C@H](N[C@@H](C)CN1CCN(C)CC1)CCCO2	ZINC000155013900	292368703	/nfs/dbraw/zinc/36/87/03/292368703.db2.gz	RJODDYCCWQMVLD-FUHWJXTLSA-N	0	3	317.477	2.434	10	0		DEAEHN
COc1cccc2c1ccnc2N1CCO[C@H](CN(C)C)C1	ZINC000450321928	405833767	/nfs/dbraw/zinc/83/37/67/405833767.db2.gz	WCBCFJYHOKJAIB-CYBMUJFWSA-N	0	3	301.390	2.010	10	0		DEAEHN
c1c2c(cc3c1OCCC[C@@H]3NC[C@@H]1CNCCO1)CCCC2	ZINC000423531130	405845531	/nfs/dbraw/zinc/84/55/31/405845531.db2.gz	XOYDROQNQXJOHJ-WMZOPIPTSA-N	0	3	316.445	2.357	10	0		DEAEHN
O[C@H](CNCc1ccc(C2CCCC2)cc1)Cn1ccnn1	ZINC000459701994	406010190	/nfs/dbraw/zinc/01/01/90/406010190.db2.gz	FNKQQCJMIYSCPM-QGZVFWFLSA-N	0	3	300.406	2.086	10	0		DEAEHN
c1ccc(N2CC[C@H](CN3CC[C@H](Nc4ncccn4)C3)C2)cc1	ZINC000639282098	406020105	/nfs/dbraw/zinc/02/01/05/406020105.db2.gz	NDOBAGSYPDDHTE-SJORKVTESA-N	0	3	323.444	2.489	10	0		DEAEHN
c1nc(CN[C@H](C2CC2)[C@H]2CCCCO2)cc2c1OCCO2	ZINC000639297283	406028749	/nfs/dbraw/zinc/02/87/49/406028749.db2.gz	RHMYQBJMDLVJLR-RHSMWYFYSA-N	0	3	304.390	2.290	10	0		DEAEHN
Cc1cc(C[C@@H](C)NC(=O)N2CCCN(C(C)(C)C)CC2)[nH]n1	ZINC000531771043	406004719	/nfs/dbraw/zinc/00/47/19/406004719.db2.gz	YJNBEFNIJIIAPJ-CYBMUJFWSA-N	0	3	321.469	2.165	10	0		DEAEHN
CC(C)(C)OC(=O)C[C@H]1CCCN(CCCN2CCCC2=O)C1	ZINC000532125039	406048226	/nfs/dbraw/zinc/04/82/26/406048226.db2.gz	RZZSBXXAQMOWCG-OAHLLOKOSA-N	0	3	324.465	2.443	10	0		DEAEHN
C[C@@H]1OCC[C@@H]1N[C@@H](CO)c1ccc(Br)cc1	ZINC000536831856	406278918	/nfs/dbraw/zinc/27/89/18/406278918.db2.gz	ISTOYRDBEQRAIS-XDTLVQLUSA-N	0	3	300.196	2.250	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)NCCN3CC[C@H](C)C3)cc2)c1	ZINC000524774615	406459253	/nfs/dbraw/zinc/45/92/53/406459253.db2.gz	RHPAMRVKQJXTSB-AWEZNQCLSA-N	0	3	312.417	2.252	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N(C)Cc1ccsc1	ZINC000637891140	406465088	/nfs/dbraw/zinc/46/50/88/406465088.db2.gz	ATLKVIPNAXHGJJ-MRXNPFEDSA-N	0	3	317.458	2.166	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)[C@@H]1C	ZINC000637971502	406502888	/nfs/dbraw/zinc/50/28/88/406502888.db2.gz	WCKAOOCEEAUYQY-BFYDXBDKSA-N	0	3	303.450	2.093	10	0		DEAEHN
C[C@@H](NC(=O)c1cn2cccnc2n1)[C@H](c1ccccc1)N(C)C	ZINC000548432756	406514573	/nfs/dbraw/zinc/51/45/73/406514573.db2.gz	XMOUUJGKVLTFOT-CZUORRHYSA-N	0	3	323.400	2.151	10	0		DEAEHN
CC[C@H](C)C[C@H](C)NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638002293	406518247	/nfs/dbraw/zinc/51/82/47/406518247.db2.gz	CRTHHPYPZCKSHL-YQQAZPJKSA-N	0	3	305.466	2.387	10	0		DEAEHN
Cc1ccc([O-])c(C[N@@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)n1	ZINC000551795659	406636954	/nfs/dbraw/zinc/63/69/54/406636954.db2.gz	OZOMHDFEIDORAB-GFCCVEGCSA-N	0	3	300.362	2.346	10	0		DEAEHN
Cc1ccc([O-])c(C[N@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)n1	ZINC000551795659	406636957	/nfs/dbraw/zinc/63/69/57/406636957.db2.gz	OZOMHDFEIDORAB-GFCCVEGCSA-N	0	3	300.362	2.346	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CCC[C@@H](CCF)C1	ZINC000638420929	406762573	/nfs/dbraw/zinc/76/25/73/406762573.db2.gz	WKNXTOQJYBBGJV-IRXDYDNUSA-N	0	3	321.440	2.044	10	0		DEAEHN
C[C@@H](CN[C@@H](C)c1ccc(F)cc1N(C)C)N1CCOCC1	ZINC000123468328	286876741	/nfs/dbraw/zinc/87/67/41/286876741.db2.gz	YNSMASNFZLCMQJ-KBPBESRZSA-N	0	3	309.429	2.263	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccccc1F	ZINC000246078992	287231565	/nfs/dbraw/zinc/23/15/65/287231565.db2.gz	FRLIHXSSWMKRSI-OLZOCXBDSA-N	0	3	312.410	2.073	10	0		DEAEHN
COc1ccc(Oc2ccc(CN)nn2)c(Br)c1	ZINC000129625400	196062911	/nfs/dbraw/zinc/06/29/11/196062911.db2.gz	MXZHAKBDSRWUMP-UHFFFAOYSA-N	0	3	310.151	2.499	10	0		DEAEHN
COC[C@H](C)NCCOc1ccc(OC)cc1Br	ZINC000129642132	196064387	/nfs/dbraw/zinc/06/43/87/196064387.db2.gz	GUAGEPGDZYZZRC-JTQLQIEISA-N	0	3	318.211	2.461	10	0		DEAEHN
CCn1ncnc1C[C@H](N)c1sccc1Br	ZINC000130753089	196107290	/nfs/dbraw/zinc/10/72/90/196107290.db2.gz	HTOJHRHFCLHEQT-QMMMGPOBSA-N	0	3	301.213	2.365	10	0		DEAEHN
Cc1cc(C(=O)N2CCO[C@H](CN(C)C)C2)c(Cl)cc1F	ZINC000130880549	196119715	/nfs/dbraw/zinc/11/97/15/196119715.db2.gz	WOMGMWBSNNCKEZ-LLVKDONJSA-N	0	3	314.788	2.190	10	0		DEAEHN
c1[nH]nc2cc(CN3CCCC[C@@H]3CN3CCOCC3)ccc12	ZINC000130977418	196128625	/nfs/dbraw/zinc/12/86/25/196128625.db2.gz	RYZCOTWWPQCEEV-QGZVFWFLSA-N	0	3	314.433	2.250	10	0		DEAEHN
O=S1(=O)CCC(NC2=NCC3(CCCCC3)CS2)CC1	ZINC000131109220	196141047	/nfs/dbraw/zinc/14/10/47/196141047.db2.gz	FCHQXCSHHOZGEA-UHFFFAOYSA-N	0	3	316.492	2.207	10	0		DEAEHN
COCC[C@@H](N)C(=O)Nc1cc(Cl)ccc1Br	ZINC000131642716	196186885	/nfs/dbraw/zinc/18/68/85/196186885.db2.gz	NKXZJHPDXJHWFU-SECBINFHSA-N	0	3	321.602	2.405	10	0		DEAEHN
C[S@](=O)CCCNCc1ccc(Br)c(F)c1	ZINC000131652002	196188050	/nfs/dbraw/zinc/18/80/50/196188050.db2.gz	QBNGZDYXCOIXAU-MRXNPFEDSA-N	0	3	308.216	2.446	10	0		DEAEHN
COc1ccc(CN(C)[C@H]2CCCC[C@@H]2O)cc1C(N)=S	ZINC000131717460	196193773	/nfs/dbraw/zinc/19/37/73/196193773.db2.gz	QMEOUEGXCLCECD-KBPBESRZSA-N	0	3	308.447	2.065	10	0		DEAEHN
Cc1ccc(NC(=O)C2(N)CCOCC2)cc1C(F)(F)F	ZINC000132244246	196238600	/nfs/dbraw/zinc/23/86/00/196238600.db2.gz	WBBCGBJWFSJISG-UHFFFAOYSA-N	0	3	302.296	2.460	10	0		DEAEHN
OCCN[C@@H]1CCCc2sc(I)cc21	ZINC000132258009	196239541	/nfs/dbraw/zinc/23/95/41/196239541.db2.gz	SMNIZFDVZSWWKE-MRVPVSSYSA-N	0	3	323.199	2.312	10	0		DEAEHN
C[C@@H](CNC(=O)c1sc2cccnc2c1N)N1CCCC1	ZINC000132332301	196246018	/nfs/dbraw/zinc/24/60/18/196246018.db2.gz	VDZUVJWFWLZTQH-JTQLQIEISA-N	0	3	304.419	2.093	10	0		DEAEHN
CC[S@@](=O)CCNCc1cccc(NC(=O)C(F)(F)F)c1	ZINC000132495095	196259994	/nfs/dbraw/zinc/25/99/94/196259994.db2.gz	QPGYHOLOGYSGRC-NRFANRHFSA-N	0	3	322.352	2.046	10	0		DEAEHN
Cc1cc(F)ccc1CCNC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000132676070	196275254	/nfs/dbraw/zinc/27/52/54/196275254.db2.gz	CBHAMQYBXCDXFV-KRWDZBQOSA-N	0	3	317.408	2.332	10	0		DEAEHN
C[C@H](NCCn1c(=O)cccc1C(F)(F)F)[C@@H]1CCCO1	ZINC000132826697	196287674	/nfs/dbraw/zinc/28/76/74/196287674.db2.gz	WDGGJKOBRVVWGR-QWRGUYRKSA-N	0	3	304.312	2.024	10	0		DEAEHN
C[S@@](=O)CCN[C@@H]1CCc2cc(Br)ccc21	ZINC000133788820	196335881	/nfs/dbraw/zinc/33/58/81/196335881.db2.gz	FZNLYBSYMCUOGT-WBMJQRKESA-N	0	3	302.237	2.405	10	0		DEAEHN
COc1ccc2c(c1)[C@H](NC[C@@H]1CCCS1(=O)=O)CCC2	ZINC000133952015	196348961	/nfs/dbraw/zinc/34/89/61/196348961.db2.gz	ARLAHZJULHCRIZ-GOEBONIOSA-N	0	3	309.431	2.239	10	0		DEAEHN
O=C(NCC1(CCO)CC1)c1cccc(CN2CCCC2)c1	ZINC000187928967	225003473	/nfs/dbraw/zinc/00/34/73/225003473.db2.gz	VBBWJRGMVLUOBZ-UHFFFAOYSA-N	0	3	302.418	2.175	10	0		DEAEHN
COCCN(CCN(C)C)C(=O)Nc1ccc2cc[nH]c2c1	ZINC000194317556	225177756	/nfs/dbraw/zinc/17/77/56/225177756.db2.gz	XUBXBZFCNSPSBI-UHFFFAOYSA-N	0	3	304.394	2.210	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)S(=O)(=O)CCc2cccs2)CCN1C	ZINC000195384115	225203391	/nfs/dbraw/zinc/20/33/91/225203391.db2.gz	ZCPWSSPSNHCOFM-STQMWFEESA-N	0	3	316.492	2.035	10	0		DEAEHN
C[C@H](NC1CCS(=O)(=O)CC1)c1cccc(-n2ccnc2)c1	ZINC000291104673	222141235	/nfs/dbraw/zinc/14/12/35/222141235.db2.gz	JSKUWEMZIPPUAH-ZDUSSCGKSA-N	0	3	319.430	2.100	10	0		DEAEHN
CC(C)Cc1ccc([C@@H](C)NC(=O)C(C)S(C)(=O)=O)cc1	ZINC000045765840	424817850	/nfs/dbraw/zinc/81/78/50/424817850.db2.gz	CDCLEDDNDKIMPK-CHWSQXEVSA-N	0	3	311.447	2.495	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)N2CCCc3ccccc32)c1	ZINC000105881080	424849230	/nfs/dbraw/zinc/84/92/30/424849230.db2.gz	JIWGDTKNVSIHBN-HNNXBMFYSA-N	0	3	312.417	2.149	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)Nc2ccc(Cl)cc2)c1	ZINC000105881159	424849412	/nfs/dbraw/zinc/84/94/12/424849412.db2.gz	UZTBJQLSEZCOBG-LBPRGKRZSA-N	0	3	306.797	2.462	10	0		DEAEHN
COc1cc(CNC(=O)N[C@@H](CC(C)C)CN(C)C)ccc1O	ZINC000193191763	424867608	/nfs/dbraw/zinc/86/76/08/424867608.db2.gz	CMRPPYDFGPABJP-AWEZNQCLSA-N	0	3	323.437	2.176	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)NC[C@@H]1Cc2ccccc21	ZINC000193696282	424870623	/nfs/dbraw/zinc/87/06/23/424870623.db2.gz	IKBFJBSECKREKX-HOCLYGCPSA-N	0	3	301.434	2.500	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1n[nH]c2c1CCCC2)c1ccccc1	ZINC000126741894	424856191	/nfs/dbraw/zinc/85/61/91/424856191.db2.gz	LWIZGNQSWPUYJK-MRXNPFEDSA-N	0	3	312.417	2.321	10	0		DEAEHN
CNc1ncc(C(=O)NC[C@@H]2CCCN2C2CCCCC2)s1	ZINC000373839301	424887819	/nfs/dbraw/zinc/88/78/19/424887819.db2.gz	NCIYDHYIWGHFCI-ZDUSSCGKSA-N	0	3	322.478	2.712	10	0		DEAEHN
Nc1cc(CN2CCC[C@H](C(=O)N3CCCCCC3)C2)ccn1	ZINC000373899117	424888436	/nfs/dbraw/zinc/88/84/36/424888436.db2.gz	UJXXXWMTTCDJLO-INIZCTEOSA-N	0	3	316.449	2.278	10	0		DEAEHN
COc1cc(C[NH2+]C2CC(CO)C2)cc(Br)c1[O-]	ZINC000657808533	425405371	/nfs/dbraw/zinc/40/53/71/425405371.db2.gz	KDYCYOBMIOWIOU-UHFFFAOYSA-N	0	3	316.195	2.024	10	0		DEAEHN
CN(C(=O)CSc1ccc(F)cc1)[C@@H](CN)C(F)(F)F	ZINC000662977428	425770049	/nfs/dbraw/zinc/77/00/49/425770049.db2.gz	UAZZGNLBALEYPV-JTQLQIEISA-N	0	3	310.316	2.266	10	0		DEAEHN
CN(C(=O)c1occc1Br)[C@@H](CN)C(F)(F)F	ZINC000662982636	425771810	/nfs/dbraw/zinc/77/18/10/425771810.db2.gz	JHNULZMPBSKLCG-LURJTMIESA-N	0	3	315.089	2.004	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)N2CCC[C@H]2c2noc(C(C)C)n2)C1	ZINC000334110196	269020102	/nfs/dbraw/zinc/02/01/02/269020102.db2.gz	BDAOKGJBHDMDPI-OLZOCXBDSA-N	0	3	321.425	2.134	10	0		DEAEHN
Cc1oc(Br)cc1C(=O)N1CCN2CCC[C@H]2C1	ZINC000396751502	269104507	/nfs/dbraw/zinc/10/45/07/269104507.db2.gz	SZEDCMDLGGHRLN-JTQLQIEISA-N	0	3	313.195	2.271	10	0		DEAEHN
N[C@@H](C(=O)NCc1ccccc1OC(F)(F)F)C1CCC1	ZINC000398988890	269110862	/nfs/dbraw/zinc/11/08/62/269110862.db2.gz	JDCTWHAAXXLQLJ-GFCCVEGCSA-N	0	3	302.296	2.329	10	0		DEAEHN
Cc1noc(CN2CCN(C[C@H]3C(C)=CCC[C@H]3C)CC2)n1	ZINC000443404525	269137445	/nfs/dbraw/zinc/13/74/45/269137445.db2.gz	GHBGWMOTDOPZDY-ZBFHGGJFSA-N	0	3	304.438	2.488	10	0		DEAEHN
CC(C)c1ccc([C@@H](C)N(C)CC(=O)N2CCNCC2)cc1	ZINC000261969975	276055542	/nfs/dbraw/zinc/05/55/42/276055542.db2.gz	PYAFPQCNGGDNGC-OAHLLOKOSA-N	0	3	303.450	2.235	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)Nc1ccc(F)cc1F	ZINC000177707507	276169340	/nfs/dbraw/zinc/16/93/40/276169340.db2.gz	QDACNUYNBWVJNF-CYBMUJFWSA-N	0	3	311.376	2.319	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H]1COC2(CCC(C)CC2)O1)N(C)C	ZINC000180871430	276268854	/nfs/dbraw/zinc/26/88/54/276268854.db2.gz	KYJSIJLLIJMJCD-GWUWNPHMSA-N	0	3	312.454	2.155	10	0		DEAEHN
CCOc1ccc2c(c1)[C@H](NC1CCN(C(N)=O)CC1)CCO2	ZINC000178178639	276377833	/nfs/dbraw/zinc/37/78/33/276377833.db2.gz	JHSVMOMJUGWGHY-OAHLLOKOSA-N	0	3	319.405	2.042	10	0		DEAEHN
CCOC(C)(C)CNC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000187242922	276448188	/nfs/dbraw/zinc/44/81/88/276448188.db2.gz	PSIYRKJTRIRWGC-OAHLLOKOSA-N	0	3	307.438	2.404	10	0		DEAEHN
CN(C)c1nc2sc(C(=O)N3CC[C@H](N(C)C)C3)cc2s1	ZINC000170864933	276896936	/nfs/dbraw/zinc/89/69/36/276896936.db2.gz	ZSUGLYLWDVFVSD-VIFPVBQESA-N	0	3	324.475	2.200	10	0		DEAEHN
CN(c1cccnn1)C1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000105806686	277003329	/nfs/dbraw/zinc/00/33/29/277003329.db2.gz	GCWKCYAULHMKBC-QGZVFWFLSA-N	0	3	312.417	2.111	10	0		DEAEHN
CC(=O)c1ccccc1OCCN(C[C@H]1CCC(=O)N1)C(C)C	ZINC000412088855	277115897	/nfs/dbraw/zinc/11/58/97/277115897.db2.gz	SPHFOZHJXNINIA-OAHLLOKOSA-N	0	3	318.417	2.257	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)C[C@@H]1c2ccccc2NC1=O	ZINC000126818880	277477852	/nfs/dbraw/zinc/47/78/52/277477852.db2.gz	UDLPVLFBCKBIBB-UKRRQHHQSA-N	0	3	317.433	2.205	10	0		DEAEHN
CC(C)C[C@H](C)C(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000184827566	279082914	/nfs/dbraw/zinc/08/29/14/279082914.db2.gz	XFBFIFSOMGOCAC-DLBZAZTESA-N	0	3	309.498	2.297	10	0		DEAEHN
Cc1nc2cc(F)ccc2cc1C(=O)N1CC[C@@H](N(C)C)C1	ZINC000170857113	279121457	/nfs/dbraw/zinc/12/14/57/279121457.db2.gz	JKBXSDMCBYLHKB-CQSZACIVSA-N	0	3	301.365	2.458	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NC[C@]1(C)CCCC[C@@H]1O	ZINC000178563311	279127868	/nfs/dbraw/zinc/12/78/68/279127868.db2.gz	MQVCRHQYLWPNSZ-VYDXJSESSA-N	0	3	313.486	2.203	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)[C@@H](C)COC)c1cccc(OC)c1	ZINC000103362473	279163934	/nfs/dbraw/zinc/16/39/34/279163934.db2.gz	ZCULCLSKBCROSI-WMLDXEAASA-N	0	3	322.449	2.477	10	0		DEAEHN
Clc1ccc2[nH]c(-c3ccc(N4CCNCC4)nn3)nc2c1	ZINC000165553875	279293826	/nfs/dbraw/zinc/29/38/26/279293826.db2.gz	AGTVTJKSWQZHDE-UHFFFAOYSA-N	0	3	314.780	2.083	10	0		DEAEHN
CCS(=O)(=O)NCCN[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000109324670	280026471	/nfs/dbraw/zinc/02/64/71/280026471.db2.gz	MHVIZNIPUGLNRR-AWEZNQCLSA-N	0	3	316.854	2.320	10	0		DEAEHN
Cc1cc(C)c(N2CC[C@H](N[C@H]3CCO[C@@H]3C)C2=O)c(C)c1	ZINC000189456329	280388314	/nfs/dbraw/zinc/38/83/14/280388314.db2.gz	QJBMTILOHKMQSC-PMPSAXMXSA-N	0	3	302.418	2.484	10	0		DEAEHN
CC[C@H]1CN(CCc2ccc(OC)cc2)CCN1C[C@H](C)O	ZINC000247178773	281168699	/nfs/dbraw/zinc/16/86/99/281168699.db2.gz	NKGJYNLGUOBCMR-RDJZCZTQSA-N	0	3	306.450	2.015	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)[C@H]2CCCCN2Cc2ccccc2)C1	ZINC000174583504	289315455	/nfs/dbraw/zinc/31/54/55/289315455.db2.gz	FCKXKICYNHJOEE-QZTJIDSGSA-N	0	3	315.461	2.204	10	0		DEAEHN
C[C@H](C(=O)N[C@@H]1CCCC[C@H]1C)N1C[C@H]2CCC[C@@H](C1)C2O	ZINC000246955714	289362033	/nfs/dbraw/zinc/36/20/33/289362033.db2.gz	JLKUOAVMYAFSCO-DAUWQXBBSA-N	0	3	308.466	2.163	10	0		DEAEHN
Cc1csc2c1ncnc2NC[C@@H](O)CN1CCCCC1	ZINC000192496301	293070203	/nfs/dbraw/zinc/07/02/03/293070203.db2.gz	LAHGZHIDEOEQTF-GFCCVEGCSA-N	0	3	306.435	2.258	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1C(=O)C1CCN(C2CC2)CC1	ZINC000194726011	293655561	/nfs/dbraw/zinc/65/55/61/293655561.db2.gz	UNWYNCZVGWNULU-QGZVFWFLSA-N	0	3	316.449	2.057	10	0		DEAEHN
N[C@@H]1Cc2ccccc2N(S(=O)(=O)CCCC(F)(F)F)C1	ZINC000211854812	295326198	/nfs/dbraw/zinc/32/61/98/295326198.db2.gz	KFLWOCYETLKYMS-LLVKDONJSA-N	0	3	322.352	2.049	10	0		DEAEHN
N[C@H](C(=O)NCCC12CC3CC(CC(C3)C1)C2)C1CCOCC1	ZINC000261915705	295328732	/nfs/dbraw/zinc/32/87/32/295328732.db2.gz	YBJPYHWEJPFNQK-QBNKABOXSA-N	0	3	320.477	2.463	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cccnc1C(F)(F)F	ZINC000252736436	300318915	/nfs/dbraw/zinc/31/89/15/300318915.db2.gz	VOFKMGOYHGFVSF-QWRGUYRKSA-N	0	3	313.323	2.409	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H]2C[NH2+]CC[C@@H]2C)c(Cl)cc1F	ZINC000193399895	301399531	/nfs/dbraw/zinc/39/95/31/301399531.db2.gz	XTEAGIINMUMSMZ-QPUJVOFHSA-N	0	3	320.817	2.064	10	0		DEAEHN
Brc1ccn2cc(CNCCCN3CCC3)nc2c1	ZINC000576957989	326332904	/nfs/dbraw/zinc/33/29/04/326332904.db2.gz	VHYLLDSCQMIEAP-UHFFFAOYSA-N	0	3	323.238	2.282	10	0		DEAEHN
COC[C@H](C)CN1CCC(n2c3ccccc3[nH]c2=O)CC1	ZINC000189592844	333151058	/nfs/dbraw/zinc/15/10/58/333151058.db2.gz	SYBYXXYXUAPTPS-CYBMUJFWSA-N	0	3	303.406	2.249	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)c2csc(C(F)(F)F)n2)C1	ZINC000193197854	333305327	/nfs/dbraw/zinc/30/53/27/333305327.db2.gz	MMXDNNDVVUSWDY-QMMMGPOBSA-N	0	3	307.341	2.234	10	0		DEAEHN
O=C(NCCOc1ccc(F)cc1F)C1CCN(C2CC2)CC1	ZINC000192477322	341840907	/nfs/dbraw/zinc/84/09/07/341840907.db2.gz	CUEMAZNRVCMLQA-UHFFFAOYSA-N	0	3	324.371	2.334	10	0		DEAEHN
FC(F)(F)Cn1nnnc1CNC1C2CC3CC(C2)CC1C3	ZINC000328765209	534400573	/nfs/dbraw/zinc/40/05/73/534400573.db2.gz	GQNXPFXSVQKRKO-UHFFFAOYSA-N	0	3	315.343	2.150	10	0		DEAEHN
CC(C)N(CC(=O)N(C)Cc1ccc(Cl)s1)C[C@@H](C)O	ZINC000107050204	519635205	/nfs/dbraw/zinc/63/52/05/519635205.db2.gz	VEKUIDWTIXAJRI-LLVKDONJSA-N	0	3	318.870	2.451	10	0		DEAEHN
CC(=O)Nc1ccc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1	ZINC000247339692	519710695	/nfs/dbraw/zinc/71/06/95/519710695.db2.gz	NLXKNRMSKDTVSK-BLLLJJGKSA-N	0	3	303.406	2.104	10	0		DEAEHN
CCCOc1cc(CN2CCO[C@@H](CN(C)C)C2)ccc1OC	ZINC000128213110	520306112	/nfs/dbraw/zinc/30/61/12/520306112.db2.gz	JVSWGSLYHAUAGS-INIZCTEOSA-N	0	3	322.449	2.246	10	0		DEAEHN
CCCCNC(=O)[C@@H](C)N1CCC[C@H](n2ccnc2CC)C1	ZINC000105897268	520648659	/nfs/dbraw/zinc/64/86/59/520648659.db2.gz	LCJLKVIEKQWQAT-CABCVRRESA-N	0	3	306.454	2.387	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N2CC[C@H](c3cnn(C)c3)C2)c1	ZINC000156560255	521912211	/nfs/dbraw/zinc/91/22/11/521912211.db2.gz	BQMOIQUSVGYPFW-INIZCTEOSA-N	0	3	312.417	2.111	10	0		DEAEHN
COCc1nc(C)c(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)s1	ZINC000247982008	523186861	/nfs/dbraw/zinc/18/68/61/523186861.db2.gz	HQZGEOIFNYRZSP-PWSUYJOCSA-N	0	3	311.451	2.056	10	0		DEAEHN
Cc1cc(C)cc(OC[C@@H](O)CN2[C@H](C)C[C@@H](O)C[C@@H]2C)c1	ZINC000249106400	524450497	/nfs/dbraw/zinc/45/04/97/524450497.db2.gz	XDPNGICWRDXHHY-YVSFHVDLSA-N	0	3	307.434	2.277	10	0		DEAEHN
Cc1cccc2[nH]c(CCC(=O)N3CCN4CCC3CC4)nc21	ZINC000188838013	524911014	/nfs/dbraw/zinc/91/10/14/524911014.db2.gz	XIULFYMJYBPMQY-UHFFFAOYSA-N	0	3	312.417	2.111	10	0		DEAEHN
Cc1cccc2nc(CCC(=O)N3CCN4CCC3CC4)[nH]c21	ZINC000188838013	524911024	/nfs/dbraw/zinc/91/10/24/524911024.db2.gz	XIULFYMJYBPMQY-UHFFFAOYSA-N	0	3	312.417	2.111	10	0		DEAEHN
Cc1ccc(OCCN(C)C(=O)NC[C@H](C)N(C)C2CC2)cc1	ZINC000105266436	525416298	/nfs/dbraw/zinc/41/62/98/525416298.db2.gz	GBRBTPVAZYCLSW-HNNXBMFYSA-N	0	3	319.449	2.498	10	0		DEAEHN
CCO[C@H](C)c1noc(CN2C[C@H]3CCCCN3C[C@H]2C)n1	ZINC000328681226	528022677	/nfs/dbraw/zinc/02/26/77/528022677.db2.gz	VBEUZEMJAHQDII-MGPQQGTHSA-N	0	3	308.426	2.226	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCN(CCC(C)(C)C)CC1	ZINC000193373984	528617699	/nfs/dbraw/zinc/61/76/99/528617699.db2.gz	MSXIMHFBYISWLJ-INIZCTEOSA-N	0	3	300.487	2.218	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)CN[C@@H]1CCC(=O)N[C@H]1C1CC1	ZINC000328928106	529269813	/nfs/dbraw/zinc/26/98/13/529269813.db2.gz	XPXQKTMCRQGCQO-CPUCHLNUSA-N	0	3	307.438	2.265	10	0		DEAEHN
CC(C)(CNC(=O)C1(N)CCOCC1)c1ccccc1Cl	ZINC000261789823	535092917	/nfs/dbraw/zinc/09/29/17/535092917.db2.gz	IBGZBDMEGGCONK-UHFFFAOYSA-N	0	3	310.825	2.242	10	0		DEAEHN
CC(C)[C@@H]1CCC[C@H](NC(=O)N2CCO[C@@H](CN(C)C)C2)C1	ZINC000247274214	535248019	/nfs/dbraw/zinc/24/80/19/535248019.db2.gz	ZQUOHACUABOASH-PMPSAXMXSA-N	0	3	311.470	2.173	10	0		DEAEHN
CC(C)C[C@@H](C)S(=O)(=O)N1CC[C@@H](CN2CCCC2)C1	ZINC000246235605	535273625	/nfs/dbraw/zinc/27/36/25/535273625.db2.gz	TTXIDHDZRGPQRI-CABCVRRESA-N	0	3	302.484	2.169	10	0		DEAEHN
CC(C)C[C@@H](CO)N(C)C(=O)NCC(C)(C)N1CCCCC1	ZINC000188190081	535276919	/nfs/dbraw/zinc/27/69/19/535276919.db2.gz	NFDOQUMOGYKQHI-HNNXBMFYSA-N	0	3	313.486	2.299	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)N1CCN(c2ccccc2F)CC1	ZINC000261839487	535296374	/nfs/dbraw/zinc/29/63/74/535296374.db2.gz	IQTPFVCFQRVCNF-MRXNPFEDSA-N	0	3	319.424	2.253	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC[C@H](c2noc(C3CC3)n2)C1)N(C)C	ZINC000360692449	535310922	/nfs/dbraw/zinc/31/09/22/535310922.db2.gz	PQJZSFRZMVXYIS-KBPBESRZSA-N	0	3	320.437	2.383	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@](C)(CO)C2CCCCC2)C1	ZINC000120202177	535531657	/nfs/dbraw/zinc/53/16/57/535531657.db2.gz	ANIVHSATGJOUDB-WBVHZDCISA-N	0	3	311.470	2.101	10	0		DEAEHN
CCCc1noc(CCCC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)n1	ZINC000247539663	535556134	/nfs/dbraw/zinc/55/61/34/535556134.db2.gz	XXHGZJUEKZMGFN-KBPBESRZSA-N	0	3	322.453	2.286	10	0		DEAEHN
CN(C(=O)CN1CC[C@]2(O)CCCC[C@H]2C1)C1CCCCC1	ZINC000248043509	535991377	/nfs/dbraw/zinc/99/13/77/535991377.db2.gz	UGIFMCUSAGUZFN-MAUKXSAKSA-N	0	3	308.466	2.405	10	0		DEAEHN
CC[C@H](Oc1ccccc1C)c1nc([C@@H]2CNCCN2C)no1	ZINC000263131019	536052200	/nfs/dbraw/zinc/05/22/00/536052200.db2.gz	BRHGCWRGEWLRQL-KBPBESRZSA-N	0	3	316.405	2.484	10	0		DEAEHN
CNC(=O)Cc1nc(CN2C[C@H](C)[C@H]3CCCC[C@H]32)cs1	ZINC000248444268	536303129	/nfs/dbraw/zinc/30/31/29/536303129.db2.gz	WBBBOVGJJKSHEL-IACUBPJLSA-N	0	3	307.463	2.442	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)c2cnc[nH]2)[C@H]1c1cccs1	ZINC000357219375	536363835	/nfs/dbraw/zinc/36/38/35/536363835.db2.gz	KXDBYVNUSVDRMS-FZMZJTMJSA-N	0	3	304.419	2.284	10	0		DEAEHN
CN(C[C@H]1CCCN(C)C1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000247067626	536445236	/nfs/dbraw/zinc/44/52/36/536445236.db2.gz	CBJCUPALWWXZRL-HOCLYGCPSA-N	0	3	317.433	2.493	10	0		DEAEHN
COC1(CNCc2cccc(N3CCOCC3)n2)CCCCC1	ZINC000359671437	536680268	/nfs/dbraw/zinc/68/02/68/536680268.db2.gz	BHTLMOFPUHPUSN-UHFFFAOYSA-N	0	3	319.449	2.357	10	0		DEAEHN
COCCOc1cccc(NC(=O)[C@@H]2NCCCC2(C)C)c1	ZINC000262575869	536726250	/nfs/dbraw/zinc/72/62/50/536726250.db2.gz	YDNQCDLINWKXQH-HNNXBMFYSA-N	0	3	306.406	2.429	10	0		DEAEHN
COc1ccc2c(c1NC(=O)N1CC[C@@H](N(C)C)C1)CCC2	ZINC000191354482	537022884	/nfs/dbraw/zinc/02/28/84/537022884.db2.gz	LDFWELZJXUBWSW-CYBMUJFWSA-N	0	3	303.406	2.352	10	0		DEAEHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCCO[C@H]2C)cc1	ZINC000192198705	625563874	/nfs/dbraw/zinc/56/38/74/625563874.db2.gz	AAGCBZHNUFUDSM-TUKIKUTGSA-N	0	3	316.357	2.158	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1Cn1c2ccccc2oc1=O	ZINC000176072106	624612728	/nfs/dbraw/zinc/61/27/28/624612728.db2.gz	LYOSHAOGCVVJSR-CQSZACIVSA-N	0	3	312.373	2.222	10	0		DEAEHN
F[C@@H]1CC2(CC[C@@H]1N1CCC(c3cc[nH]n3)CC1)OCCO2	ZINC000891891046	624647134	/nfs/dbraw/zinc/64/71/34/624647134.db2.gz	KXKSXUAHCDABHW-HIFRSBDPSA-N	0	3	309.385	2.223	10	0		DEAEHN
COCC[C@@H](N)C(=O)N(C)Cc1ccc(Cl)cc1Cl	ZINC000052808484	625105104	/nfs/dbraw/zinc/10/51/04/625105104.db2.gz	HTFHCCNGKZYUOS-GFCCVEGCSA-N	0	3	305.205	2.316	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)c2ncccn2)[C@H]1c1cccs1	ZINC000743568496	638157628	/nfs/dbraw/zinc/15/76/28/638157628.db2.gz	WCCPCFFUMSEPNS-OCCSQVGLSA-N	0	3	316.430	2.351	10	0		DEAEHN
CC[S@@](=O)CCN[C@H](C)c1ccc(NC(C)=O)cc1OC	ZINC000747870022	638486629	/nfs/dbraw/zinc/48/66/29/638486629.db2.gz	BVTOXTLOIXYUCE-WSVYEEACSA-N	0	3	312.435	2.073	10	0		DEAEHN
C[C@H]1[C@H](OC(=O)c2cccc(CN3CCCC3)c2)CC(=O)N1C	ZINC000806080597	644650713	/nfs/dbraw/zinc/65/07/13/644650713.db2.gz	HSVIYJIRHROJBL-XJKSGUPXSA-N	0	3	316.401	2.058	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NC[C@H](O)c1cc(C)cc(C)c1	ZINC000801532694	645409952	/nfs/dbraw/zinc/40/99/52/645409952.db2.gz	CWKXPPKVKJZSTG-IRXDYDNUSA-N	0	3	304.434	2.327	10	0		DEAEHN
CCCN(C)CC(=O)N[C@H](C)c1ccc(N2CCCC2=O)cc1	ZINC000730281246	646888186	/nfs/dbraw/zinc/88/81/86/646888186.db2.gz	RRUNSFDHZBVBBK-CQSZACIVSA-N	0	3	317.433	2.332	10	0		DEAEHN
CCN(CC)C(=O)[C@@H]1CCCN1Cc1cc(OC)ccc1O	ZINC000179864484	648428634	/nfs/dbraw/zinc/42/86/34/648428634.db2.gz	GBXCWZQNVLNJSR-HNNXBMFYSA-N	0	3	306.406	2.234	10	0		DEAEHN
Cc1nc([C@@H](C)NC[C@H]2CCCN2C(=O)OC(C)(C)C)n[nH]1	ZINC000392387795	685449791	/nfs/dbraw/zinc/44/97/91/685449791.db2.gz	YUUUYMGOLZKBPX-ZYHUDNBSSA-N	0	3	309.414	2.163	10	0		DEAEHN
O=C(c1cc(Cl)nc(Cl)c1)N1CCN2CCC[C@@H]2C1	ZINC000038107481	683887015	/nfs/dbraw/zinc/88/70/15/683887015.db2.gz	RWNGPEJLHSDDLH-SNVBAGLBSA-N	0	3	300.189	2.309	10	0		DEAEHN
C[C@@](CO)(NC[C@H]1CCCO1)c1cccc(Br)c1	ZINC000038114503	683887339	/nfs/dbraw/zinc/88/73/39/683887339.db2.gz	YIQPNODIINXMMA-KGLIPLIRSA-N	0	3	314.223	2.425	10	0		DEAEHN
CC(C)Nc1ncnc2c1ncn2CN1CCS[C@@H](C)CC1	ZINC000191668572	684434206	/nfs/dbraw/zinc/43/42/06/684434206.db2.gz	VBQYVCNMFPWKOM-LBPRGKRZSA-N	0	3	320.466	2.432	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cc(F)cc2[nH]c(=S)[nH]c21	ZINC000194693019	685075236	/nfs/dbraw/zinc/07/52/36/685075236.db2.gz	INNYWCFLEGSPDS-VIFPVBQESA-N	0	3	308.382	2.189	10	0		DEAEHN
CCC[C@H]1CC(=O)N(CN2CCC[C@H]2Cn2ccnc2C)C1	ZINC000246155582	685124376	/nfs/dbraw/zinc/12/43/76/685124376.db2.gz	IBYGZNRGQYFWGE-HOTGVXAUSA-N	0	3	304.438	2.262	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCC2(O)CCCC2)[C@H]1c1ccccc1	ZINC000248088210	685154957	/nfs/dbraw/zinc/15/49/57/685154957.db2.gz	TUYHXSNEQHKTGF-JKSUJKDBSA-N	0	3	317.433	2.036	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCC[C@@](C)(O)c2ccccc2)C1	ZINC000249137299	685175781	/nfs/dbraw/zinc/17/57/81/685175781.db2.gz	HROFMMXHAASSPC-FUHWJXTLSA-N	0	3	319.449	2.068	10	0		DEAEHN
CN1C[C@H](CCNCc2ccccc2Br)CC1=O	ZINC000723565131	777124871	/nfs/dbraw/zinc/12/48/71/777124871.db2.gz	CAMOKRISDKLXSH-LLVKDONJSA-N	0	3	311.223	2.407	10	0		DEAEHN
CN1C[C@@H](CCNCc2ccccc2Br)CC1=O	ZINC000723565133	777124935	/nfs/dbraw/zinc/12/49/35/777124935.db2.gz	CAMOKRISDKLXSH-NSHDSACASA-N	0	3	311.223	2.407	10	0		DEAEHN
CC[C@@H](NCc1nc(Br)c[nH]1)[C@H]1CCCOC1	ZINC000724011148	777220615	/nfs/dbraw/zinc/22/06/15/777220615.db2.gz	CYGJJKQEOHRUGN-VHSXEESVSA-N	0	3	302.216	2.467	10	0		DEAEHN
COC[C@H]1CCCN(C[C@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724109839	777242161	/nfs/dbraw/zinc/24/21/61/777242161.db2.gz	ADGPJXCOVYYKPJ-UWVGGRQHSA-N	0	3	305.287	2.293	10	0		DEAEHN
CCOC[C@@H]1CCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724113658	777243826	/nfs/dbraw/zinc/24/38/26/777243826.db2.gz	GAAOOZWSTJBOBC-NXEZZACHSA-N	0	3	305.287	2.293	10	0		DEAEHN
CN(C[C@@H]1CCCCO1)C[C@@](C)(O)C(F)(F)C(F)(F)F	ZINC000724112556	777244065	/nfs/dbraw/zinc/24/40/65/777244065.db2.gz	ULOOJYSYNBCYPK-VHSXEESVSA-N	0	3	305.287	2.436	10	0		DEAEHN
Cc1cnn(C)c1CN[C@H]1CN(C(=O)OC(C)(C)C)CC1(C)C	ZINC000721856964	780391365	/nfs/dbraw/zinc/39/13/65/780391365.db2.gz	XASQAOBDFNFIIE-AWEZNQCLSA-N	0	3	322.453	2.464	10	0		DEAEHN
CC[C@@H](NCc1cn(C)nc1Br)[C@@H]1CCCOC1	ZINC000723959422	787346211	/nfs/dbraw/zinc/34/62/11/787346211.db2.gz	QYGPCPUAVZCUSE-ZYHUDNBSSA-N	0	3	316.243	2.477	10	0		DEAEHN
Cn1cc(CNCC[C@H]2CCCCO2)c(Br)n1	ZINC000712484084	792191015	/nfs/dbraw/zinc/19/10/15/792191015.db2.gz	ZKPOTJUVGZTNET-LLVKDONJSA-N	0	3	302.216	2.231	10	0		DEAEHN
Cc1nc(C)c([C@H](C)NCC[C@H]2CCCS2(=O)=O)s1	ZINC000714335096	792309090	/nfs/dbraw/zinc/30/90/90/792309090.db2.gz	OXMXQZYXOQFAMD-JOYOIKCWSA-N	0	3	302.465	2.378	10	0		DEAEHN
C[C@@H]1C[C@H](NCc2cncn2C)CN(C(=O)OC(C)(C)C)C1	ZINC000401765052	801849435	/nfs/dbraw/zinc/84/94/35/801849435.db2.gz	XWJMNPSFQVRXIC-OLZOCXBDSA-N	0	3	308.426	2.155	10	0		DEAEHN
Cc1nn(C)c(Cl)c1CN[C@H]1CCCN2CCSC[C@@H]12	ZINC000720509199	1085263510	/nfs/dbraw/zinc/26/35/10/1085263510.db2.gz	GXXKFWYDYQEMCG-STQMWFEESA-N	0	3	314.886	2.051	10	0		DEAEHN
CN1CCC[C@@H]2[C@H]1CCN2C(=O)c1ncccc1Br	ZINC000720818276	1086169554	/nfs/dbraw/zinc/16/95/54/1086169554.db2.gz	UNRZOFUHJCAAJJ-VXGBXAGGSA-N	0	3	324.222	2.153	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N(CCN(C)C)C(C)C)cc1	ZINC000278281917	214066063	/nfs/dbraw/zinc/06/60/63/214066063.db2.gz	BUHLAFPHULENNY-UHFFFAOYSA-N	0	3	305.422	2.082	10	0		DEAEHN
CN(C)CCn1ccc(NCc2cc(-c3ccccc3)n[nH]2)n1	ZINC000136325546	282086826	/nfs/dbraw/zinc/08/68/26/282086826.db2.gz	SQLFFCQJUMCPMX-UHFFFAOYSA-N	0	3	310.405	2.447	10	0		DEAEHN
CCOCc1ccc(CNC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000139565089	282101692	/nfs/dbraw/zinc/10/16/92/282101692.db2.gz	SWHCARXPEXOMQV-INIZCTEOSA-N	0	3	305.422	2.117	10	0		DEAEHN
Cc1cnc(SC[C@@H](N)c2ccc3c(c2)OCCO3)nc1	ZINC000081893957	192334321	/nfs/dbraw/zinc/33/43/21/192334321.db2.gz	CBXBTDDRQVXWBX-GFCCVEGCSA-N	0	3	303.387	2.348	10	0		DEAEHN
CCCN[C@H]1CCOC[C@@H]1S(=O)(=O)c1ccccc1Cl	ZINC000081920550	192338493	/nfs/dbraw/zinc/33/84/93/192338493.db2.gz	DVSQGTKQZVIJDW-JSGCOSHPSA-N	0	3	317.838	2.271	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CCO1	ZINC000152216000	282124995	/nfs/dbraw/zinc/12/49/95/282124995.db2.gz	UKKVCIBZAPYFHI-YLFCFFPRSA-N	0	3	308.466	2.382	10	0		DEAEHN
CC(C)(C)[C@@H]1CCN(S(=O)(=O)c2cc(CN)cs2)C1	ZINC000163505271	197635046	/nfs/dbraw/zinc/63/50/46/197635046.db2.gz	OJPMBTSCILXEDZ-LLVKDONJSA-N	0	3	302.465	2.264	10	0		DEAEHN
N[C@@H]1CCCC[C@H]1S(=O)(=O)c1ccc(Br)cc1	ZINC000081933824	192341064	/nfs/dbraw/zinc/34/10/64/192341064.db2.gz	DEQFBIQIBIFBGC-VXGBXAGGSA-N	0	3	318.236	2.493	10	0		DEAEHN
CC[C@@H](CS(=O)(=O)c1ccccc1Br)NC	ZINC000081932029	192341757	/nfs/dbraw/zinc/34/17/57/192341757.db2.gz	BUDQRBFWGVTNBU-VIFPVBQESA-N	0	3	306.225	2.221	10	0		DEAEHN
CCCN[C@@H](CC)CS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000081935510	192342780	/nfs/dbraw/zinc/34/27/80/192342780.db2.gz	IJRIJSSNWMQZSW-LBPRGKRZSA-N	0	3	313.419	2.010	10	0		DEAEHN
CCCN[C@@H](C)CS(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000081936232	192343005	/nfs/dbraw/zinc/34/30/05/192343005.db2.gz	XGMSVGDCKRXRHJ-LBPRGKRZSA-N	0	3	313.419	2.010	10	0		DEAEHN
CCc1ccc(NC(=O)CCN2CCN(CC)CC2)cc1F	ZINC000152408318	282143770	/nfs/dbraw/zinc/14/37/70/282143770.db2.gz	HBAZHSGTXVBYDR-UHFFFAOYSA-N	0	3	307.413	2.354	10	0		DEAEHN
Cc1ncc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c(C(C)C)n1	ZINC000177143574	282147215	/nfs/dbraw/zinc/14/72/15/282147215.db2.gz	BRUSBCFSVSGWTB-WFASDCNBSA-N	0	3	304.438	2.367	10	0		DEAEHN
CCCN[C@](CSc1ncccc1Cl)(C(N)=O)C1CC1	ZINC000079449141	185172167	/nfs/dbraw/zinc/17/21/67/185172167.db2.gz	MJDJDVJZGQIDQO-AWEZNQCLSA-N	0	3	313.854	2.461	10	0		DEAEHN
CCN[C@H](c1ccc(CC)cc1)[C@@H](C)S(=O)(=O)CCOC	ZINC000081944993	192346101	/nfs/dbraw/zinc/34/61/01/192346101.db2.gz	OOHJJPSXYOBMNH-CJNGLKHVSA-N	0	3	313.463	2.349	10	0		DEAEHN
CNCc1cccc(C)c1O[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000165129232	197670163	/nfs/dbraw/zinc/67/01/63/197670163.db2.gz	CGJFUNGCQKBTMW-GJZGRUSLSA-N	0	3	311.447	2.449	10	0		DEAEHN
CCc1nn(C)cc1CN[C@H]1CCCO[C@@H]1c1cnn(CC)c1	ZINC000328625699	231256843	/nfs/dbraw/zinc/25/68/43/231256843.db2.gz	DKXNIMLDNAQPQY-DLBZAZTESA-N	0	3	317.437	2.209	10	0		DEAEHN
COc1ccc(Br)cc1C[C@@H](N)c1ccn(C)n1	ZINC000087424101	185224391	/nfs/dbraw/zinc/22/43/91/185224391.db2.gz	FEJXIMWWEAJEBQ-LLVKDONJSA-N	0	3	310.195	2.434	10	0		DEAEHN
CCCN[C@H](CC(N)=O)c1ccc(OC)c(OC(F)F)c1	ZINC000087551803	185228251	/nfs/dbraw/zinc/22/82/51/185228251.db2.gz	DBIGYHIAWBIQDO-SNVBAGLBSA-N	0	3	302.321	2.213	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@@]1(CN)Nc1ccccc1Cl	ZINC000087915969	185237352	/nfs/dbraw/zinc/23/73/52/185237352.db2.gz	DYQIUKZHOARAMY-OLZOCXBDSA-N	0	3	302.827	2.047	10	0		DEAEHN
NC[C@H](NC[C@H]1CCCO1)c1ccc(Br)cc1F	ZINC000087928581	185237579	/nfs/dbraw/zinc/23/75/79/185237579.db2.gz	FCIKQTIYEWDMAR-MFKMUULPSA-N	0	3	317.202	2.357	10	0		DEAEHN
C[C@H](CNC(=O)N1CC[C@H](N(C)C)C1)c1ccc(F)cc1F	ZINC000173509836	282191158	/nfs/dbraw/zinc/19/11/58/282191158.db2.gz	CBNAZHHAXRIXBD-YPMHNXCESA-N	0	3	311.376	2.414	10	0		DEAEHN
CC1CC(=O)N(c2ccc(CN)c(C(F)(F)F)c2)C(=O)C1	ZINC000088191311	185241299	/nfs/dbraw/zinc/24/12/99/185241299.db2.gz	HRODZJIABHRGJV-UHFFFAOYSA-N	0	3	300.280	2.454	10	0		DEAEHN
C[C@@H]1CCC[C@H](C)N1C(=O)CN[C@@H]1CCC(=O)N[C@H]1C1CC1	ZINC000328919432	231386824	/nfs/dbraw/zinc/38/68/24/231386824.db2.gz	SLTWYJZKKOXZHY-GNNTXSLPSA-N	0	3	307.438	2.263	10	0		DEAEHN
CC[C@H](CN)S(=O)(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000088472147	185252389	/nfs/dbraw/zinc/25/23/89/185252389.db2.gz	UKMNLTZYMQYUJQ-SNVBAGLBSA-N	0	3	312.313	2.064	10	0		DEAEHN
CCC(C)(C)[C@@H]1CC[C@H](N)[C@H](S(=O)(=O)CCCOC)C1	ZINC000081986377	192349979	/nfs/dbraw/zinc/34/99/79/192349979.db2.gz	LRHZHTUOBBUMSL-HZSPNIEDSA-N	0	3	305.484	2.370	10	0		DEAEHN
CCN[C@@H](c1ccccc1)[C@@H](C)S(=O)(=O)C1CCOCC1	ZINC000081989516	192351413	/nfs/dbraw/zinc/35/14/13/192351413.db2.gz	MMRFEZFNCDIPFR-CZUORRHYSA-N	0	3	311.447	2.320	10	0		DEAEHN
N[C@@H]1COC[C@H]1C(=O)Nc1ccc(C(F)(F)F)cc1Cl	ZINC000090380500	185293720	/nfs/dbraw/zinc/29/37/20/185293720.db2.gz	CMVABRZEWQCGQO-VXNVDRBHSA-N	0	3	308.687	2.271	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1ccc(OC(F)F)c(Cl)c1	ZINC000090436574	185296060	/nfs/dbraw/zinc/29/60/60/185296060.db2.gz	SPRCFJLCMGKOEU-SCZZXKLOSA-N	0	3	320.723	2.114	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1ccc2nc(SC)sc2c1	ZINC000090433009	185296104	/nfs/dbraw/zinc/29/61/04/185296104.db2.gz	YXPFUKYYRIFPKT-KOLCDFICSA-N	0	3	323.443	2.191	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)N(C)Cc1cc(Cl)cc(Cl)c1	ZINC000090435293	185296330	/nfs/dbraw/zinc/29/63/30/185296330.db2.gz	GGFPMKRSCFOZFI-QWHCGFSZSA-N	0	3	317.216	2.186	10	0		DEAEHN
CC(C)Oc1ccc(NC(=O)[C@@]2(C)COC[C@@H]2N)cc1Cl	ZINC000090588727	185305338	/nfs/dbraw/zinc/30/53/38/185305338.db2.gz	RGKOLTABLDODMJ-ZFWWWQNUSA-N	0	3	312.797	2.430	10	0		DEAEHN
C[C@@]1(c2nc(-c3ccc(Br)cc3)no2)COC[C@H]1N	ZINC000090573325	185304272	/nfs/dbraw/zinc/30/42/72/185304272.db2.gz	GSDMEUJYBQNVKN-ZWNOBZJWSA-N	0	3	324.178	2.114	10	0		DEAEHN
C[C@@]1(c2nc(Cc3ccc(F)cc3Cl)no2)COC[C@@H]1N	ZINC000090573790	185304410	/nfs/dbraw/zinc/30/44/10/185304410.db2.gz	MQGCAMZQXGNLPF-SMDDNHRTSA-N	0	3	311.744	2.068	10	0		DEAEHN
CCn1c2ccc(Br)cc2nc1[C@]1(C)COC[C@@H]1N	ZINC000090571760	185304492	/nfs/dbraw/zinc/30/44/92/185304492.db2.gz	SXEJPMZIKOSAKY-GXTWGEPZSA-N	0	3	324.222	2.434	10	0		DEAEHN
O=C(NCc1ccccc1)C1CCN(CC2=CCCOC2)CC1	ZINC000179749952	282233183	/nfs/dbraw/zinc/23/31/83/282233183.db2.gz	RMMQUDDEXXNAMD-UHFFFAOYSA-N	0	3	314.429	2.362	10	0		DEAEHN
Cc1nn(-c2ccccc2)cc1CN1C[C@H](C(N)=O)CC[C@H]1C	ZINC000245538323	282244899	/nfs/dbraw/zinc/24/48/99/282244899.db2.gz	JULHMLITUBKBHF-UKRRQHHQSA-N	0	3	312.417	2.267	10	0		DEAEHN
COCCOc1ccc(CN2CCN3CCCC[C@@H]3C2)cc1	ZINC000092616213	185329425	/nfs/dbraw/zinc/32/94/25/185329425.db2.gz	HWTPRQBZICLHJC-QGZVFWFLSA-N	0	3	304.434	2.382	10	0		DEAEHN
O=C(NC1CCN(CC2=CCCOC2)CC1)C1CCCCC1	ZINC000092644819	185330812	/nfs/dbraw/zinc/33/08/12/185330812.db2.gz	ZPSNGVKVYKYDKC-UHFFFAOYSA-N	0	3	306.450	2.494	10	0		DEAEHN
CNCc1sc(S(=O)(=O)NC2C(C)(C)C2(C)C)cc1C	ZINC000092833285	185344853	/nfs/dbraw/zinc/34/48/53/185344853.db2.gz	QRVXPPATSACXCI-UHFFFAOYSA-N	0	3	316.492	2.489	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N)[C@@H](Sc1nnc(N(C)C)s1)C2	ZINC000092860055	185347060	/nfs/dbraw/zinc/34/70/60/185347060.db2.gz	MRWOGIHTEYCPJI-NWDGAFQWSA-N	0	3	322.459	2.330	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)Cc1ccc(Cl)cc1	ZINC000036076817	539334066	/nfs/dbraw/zinc/33/40/66/539334066.db2.gz	ZDUNZVDFDUJOTM-LBPRGKRZSA-N	0	3	318.870	2.490	10	0		DEAEHN
CN(Cc1ccc(OC[C@@H]2CCCO2)cc1)CC1(CO)CC1	ZINC000186784031	282283773	/nfs/dbraw/zinc/28/37/73/282283773.db2.gz	CWCPOSCWNQEZOF-KRWDZBQOSA-N	0	3	305.418	2.449	10	0		DEAEHN
C[C@H](CNC(=O)c1coc(Br)c1)N1CCCC1	ZINC000078595631	539368407	/nfs/dbraw/zinc/36/84/07/539368407.db2.gz	SMPCURWEUPMJDE-SECBINFHSA-N	0	3	301.184	2.256	10	0		DEAEHN
Cc1nn(C)cc1CN1CCC(c2nnc3ccccn32)CC1	ZINC000120888250	539453140	/nfs/dbraw/zinc/45/31/40/539453140.db2.gz	NJXLJGFUOHRECF-UHFFFAOYSA-N	0	3	310.405	2.151	10	0		DEAEHN
C[C@@H]1OCC[C@]1(O)CNCc1ccc(Br)c(F)c1	ZINC000227971157	201809253	/nfs/dbraw/zinc/80/92/53/201809253.db2.gz	WRDZQEYXZLCCPA-ZANVPECISA-N	0	3	318.186	2.218	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(C(=O)N[C@H](CC(C)C)CN(C)C)c1	ZINC000068224456	190756019	/nfs/dbraw/zinc/75/60/19/190756019.db2.gz	AQOOKHMJEMWHRD-CQSZACIVSA-N	0	3	323.412	2.490	10	0		DEAEHN
CCCCNC(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190676757	539696159	/nfs/dbraw/zinc/69/61/59/539696159.db2.gz	UUJKIUMETXYYCB-MRXNPFEDSA-N	0	3	304.438	2.345	10	0		DEAEHN
CCn1c(=O)[nH]nc1Sc1cccc(OC)c1[C@@H](C)NC	ZINC000130355070	185958789	/nfs/dbraw/zinc/95/87/89/185958789.db2.gz	WNEFIGFDDBZARI-SECBINFHSA-N	0	3	308.407	2.032	10	0		DEAEHN
N[C@H](C[S@@](=O)Cc1ccccc1)c1ccc2c(c1)OCO2	ZINC000084004311	192395030	/nfs/dbraw/zinc/39/50/30/192395030.db2.gz	TYEOPWRJOFTCEF-SPLOXXLWSA-N	0	3	303.383	2.364	10	0		DEAEHN
Cc1nn(C)c(C)c1CN1Cc2c(cccc2N(C)C)[C@@H]1CN	ZINC000071683403	191006786	/nfs/dbraw/zinc/00/67/86/191006786.db2.gz	SEUBENHWWAXAFH-SFHVURJKSA-N	0	3	313.449	2.119	10	0		DEAEHN
COc1cc2c(c(OC)c1)[C@H](CN)N(CCCOC(C)C)C2	ZINC000071683938	191008146	/nfs/dbraw/zinc/00/81/46/191008146.db2.gz	RPSLCDDMWFTJRC-HNNXBMFYSA-N	0	3	308.422	2.334	10	0		DEAEHN
COc1ccc(Cl)c2c1CN(C1CCC(O)CC1)[C@H]2CN	ZINC000071684021	191008783	/nfs/dbraw/zinc/00/87/83/191008783.db2.gz	RLBOEZCIIQSDOY-MGULZYLOSA-N	0	3	310.825	2.468	10	0		DEAEHN
CN(C(=O)c1ccc2nc(N)sc2c1)C1CCN(C)CC1	ZINC000071698012	191009483	/nfs/dbraw/zinc/00/94/83/191009483.db2.gz	SDPOKSCFPMREMA-UHFFFAOYSA-N	0	3	304.419	2.045	10	0		DEAEHN
CCCCN(C)S(=O)(=O)c1cc(CNCC)cc(F)c1F	ZINC000138306049	186015949	/nfs/dbraw/zinc/01/59/49/186015949.db2.gz	BQLWOZOSRIIHFL-UHFFFAOYSA-N	0	3	320.405	2.495	10	0		DEAEHN
CCC(C)(C)N(C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000139094352	186020076	/nfs/dbraw/zinc/02/00/76/186020076.db2.gz	XYQQZCFTIGHHSA-UHFFFAOYSA-N	0	3	306.378	2.233	10	0		DEAEHN
CC(C)Cn1ncnc1C[C@H](N)c1ncccc1Br	ZINC000140341930	186026066	/nfs/dbraw/zinc/02/60/66/186026066.db2.gz	KYXXQTHHSAXFFN-NSHDSACASA-N	0	3	324.226	2.334	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@H](C)C(=O)N2C[C@@H]2CCCCN2C)s1	ZINC000144329871	186034684	/nfs/dbraw/zinc/03/46/84/186034684.db2.gz	FULWTAVEWPYHFZ-VNHYZAJKSA-N	0	3	307.463	2.360	10	0		DEAEHN
CCNCc1ccc(F)c(S(=O)(=O)N(C)C2CCC2)c1	ZINC000144616636	186035577	/nfs/dbraw/zinc/03/55/77/186035577.db2.gz	LELJJORALKSZBA-UHFFFAOYSA-N	0	3	300.399	2.108	10	0		DEAEHN
C[C@@H](CN1C(=O)C2(CCCC2)N[C@H]1c1cccs1)N(C)C	ZINC000144941831	186035741	/nfs/dbraw/zinc/03/57/41/186035741.db2.gz	NFQQEWGKFRKAOH-GXTWGEPZSA-N	0	3	307.463	2.441	10	0		DEAEHN
N[C@@H](c1cccc(OC(F)(F)F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000150018406	186053949	/nfs/dbraw/zinc/05/39/49/186053949.db2.gz	KMGXRNVLMFTQNZ-KOLCDFICSA-N	0	3	309.309	2.020	10	0		DEAEHN
CCOC(=O)C1CCN(C(=O)CN2CCCCC[C@H]2CC)CC1	ZINC000150743813	186062481	/nfs/dbraw/zinc/06/24/81/186062481.db2.gz	DCCLPAMJWZDYAO-MRXNPFEDSA-N	0	3	324.465	2.443	10	0		DEAEHN
COc1ccc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc1OC	ZINC000155687629	186103201	/nfs/dbraw/zinc/10/32/01/186103201.db2.gz	BHCHYLOVBJDDOB-JSGCOSHPSA-N	0	3	306.406	2.162	10	0		DEAEHN
CC[NH2+]Cc1ccc(S(=O)(=O)[N-]C2CC(C)C2)c(F)c1	ZINC000163993029	186145280	/nfs/dbraw/zinc/14/52/80/186145280.db2.gz	RTZYVYLLACGJIY-UHFFFAOYSA-N	0	3	300.399	2.012	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000164135224	186149830	/nfs/dbraw/zinc/14/98/30/186149830.db2.gz	LJIJUGNQBBDCNE-GJZGRUSLSA-N	0	3	317.433	2.425	10	0		DEAEHN
C[C@H](C[S@@](C)=O)NCc1ccc(Br)c(F)c1	ZINC000164322093	186155629	/nfs/dbraw/zinc/15/56/29/186155629.db2.gz	RLCZBHHEYUVWKA-BCTVWOGZSA-N	0	3	308.216	2.445	10	0		DEAEHN
Cn1c2ccc(S(C)(=O)=O)cc2nc1[C@@H]1CCCCCN1	ZINC000164371295	186157639	/nfs/dbraw/zinc/15/76/39/186157639.db2.gz	YATHURVPDVVYBL-LBPRGKRZSA-N	0	3	307.419	2.182	10	0		DEAEHN
Cc1ccc(CNC(=O)CN(C)[C@@]2(CO)CC[C@H](C)C2)cc1F	ZINC000188012200	186243627	/nfs/dbraw/zinc/24/36/27/186243627.db2.gz	NHHANRDWSKQPMP-UGSOOPFHSA-N	0	3	322.424	2.233	10	0		DEAEHN
O=C(Nc1cc2c(cc1Cl)OCO2)N1CCN2CCC[C@@H]2C1	ZINC000171887830	198001961	/nfs/dbraw/zinc/00/19/61/198001961.db2.gz	XGKRGFFNBUUTRB-SNVBAGLBSA-N	0	3	323.780	2.381	10	0		DEAEHN
O=C(Nc1ccccc1-n1cccn1)N1CCN2CCC[C@H]2C1	ZINC000171889670	198002250	/nfs/dbraw/zinc/00/22/50/198002250.db2.gz	MNMFCYKRKOPPID-AWEZNQCLSA-N	0	3	311.389	2.184	10	0		DEAEHN
O=C(NCCc1c[nH]c2ccccc12)N1CCN2CCC[C@@H]2C1	ZINC000171897335	198004423	/nfs/dbraw/zinc/00/44/23/198004423.db2.gz	RANWZDHZKDSNCI-OAHLLOKOSA-N	0	3	312.417	2.200	10	0		DEAEHN
CC(C)(C)c1csc(CNC(=O)N2CCN3CCC[C@H]3C2)n1	ZINC000171907492	198005902	/nfs/dbraw/zinc/00/59/02/198005902.db2.gz	MXOBEHGTUYHTLN-LBPRGKRZSA-N	0	3	322.478	2.430	10	0		DEAEHN
CC(C)c1csc(NC(=O)N2CCO[C@@H](CN(C)C)C2)n1	ZINC000172046662	198030857	/nfs/dbraw/zinc/03/08/57/198030857.db2.gz	RBPPMAJVJJYYAW-NSHDSACASA-N	0	3	312.439	2.061	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N[C@@H]2CCN(C(C)(C)C)C2)cc1	ZINC000617345058	363101375	/nfs/dbraw/zinc/10/13/75/363101375.db2.gz	WJTYKBOEMYISAF-OAHLLOKOSA-N	0	3	317.433	2.272	10	0		DEAEHN
COC(=O)[C@H](c1ccccc1F)N1CCCN(C2CC2)CC1	ZINC000072635998	191205148	/nfs/dbraw/zinc/20/51/48/191205148.db2.gz	OTNHRIZGGQMRTL-INIZCTEOSA-N	0	3	306.381	2.210	10	0		DEAEHN
C[C@@H](NCC(=O)NC12CC3CC(CC(C3)C1)C2)[C@H]1CCCO1	ZINC000332896682	539943104	/nfs/dbraw/zinc/94/31/04/539943104.db2.gz	KZYPUVDDJSVGGQ-CDJLDAARSA-N	0	3	306.450	2.229	10	0		DEAEHN
O=C(NCCc1ccccc1F)N1CC[C@H](N2CC=CC2)C1	ZINC000173441111	198215255	/nfs/dbraw/zinc/21/52/55/198215255.db2.gz	URGBTOGDTIZQKH-HNNXBMFYSA-N	0	3	303.381	2.024	10	0		DEAEHN
COCc1ccc(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000173810996	198255258	/nfs/dbraw/zinc/25/52/58/198255258.db2.gz	FULLKBGBODEYDT-YOEHRIQHSA-N	0	3	319.449	2.457	10	0		DEAEHN
Cc1ccc([C@@H](O)CN2CCC(Nc3cccnn3)CC2)cc1	ZINC000174781219	198384370	/nfs/dbraw/zinc/38/43/70/198384370.db2.gz	URIYGTNAVOOYCL-KRWDZBQOSA-N	0	3	312.417	2.395	10	0		DEAEHN
O=C(NC[C@@H]1C[C@H]1c1ccccc1)N1CC[C@H](N2CC=CC2)C1	ZINC000174845244	198392733	/nfs/dbraw/zinc/39/27/33/198392733.db2.gz	FIRCHDVXPPSKCU-BZSNNMDCSA-N	0	3	311.429	2.446	10	0		DEAEHN
COc1cccc(C[C@H](c2ccccc2)N(CCO)CCO)c1	ZINC000039233825	354168792	/nfs/dbraw/zinc/16/87/92/354168792.db2.gz	RNVHGLPRCVJZRG-LJQANCHMSA-N	0	3	315.413	2.266	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)NCc2cscn2)o1	ZINC000051751754	354388943	/nfs/dbraw/zinc/38/89/43/354388943.db2.gz	BGTWFMQZSYVZHT-UHFFFAOYSA-N	0	3	322.434	2.318	10	0		DEAEHN
CC(C)NC(=O)c1cccnc1N1CCN[C@H](c2ccccc2)C1	ZINC000065255734	354680722	/nfs/dbraw/zinc/68/07/22/354680722.db2.gz	GOUIHPBFTMKCBD-KRWDZBQOSA-N	0	3	324.428	2.371	10	0		DEAEHN
CCOC(=O)CCCN1CCC(c2nnc3ccccn32)CC1	ZINC000071117790	354896956	/nfs/dbraw/zinc/89/69/56/354896956.db2.gz	SOYWWBHESYCGRE-UHFFFAOYSA-N	0	3	316.405	2.252	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CSCCS1	ZINC000177009662	198649572	/nfs/dbraw/zinc/64/95/72/198649572.db2.gz	RABRVZAASNOWPP-CABCVRRESA-N	0	3	324.515	2.124	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(-n2cccn2)cc1	ZINC000177029142	198652014	/nfs/dbraw/zinc/65/20/14/198652014.db2.gz	ZASIQWKAIVOEGK-QGZVFWFLSA-N	0	3	312.417	2.429	10	0		DEAEHN
C[C@@H](N[C@H]1CCC(F)(F)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000380307159	540122285	/nfs/dbraw/zinc/12/22/85/540122285.db2.gz	JGVGZAXCGDBZLU-KOLCDFICSA-N	0	3	304.362	2.172	10	0		DEAEHN
CC[C@H]1CN(C(=O)N[C@H](CC(C)C)CN(C)C)CCS1	ZINC000073722566	191347893	/nfs/dbraw/zinc/34/78/93/191347893.db2.gz	AMOOEQZTKPHACV-KGLIPLIRSA-N	0	3	301.500	2.500	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NC[C@@H]2CCC(C)(C)O2)C1	ZINC000249391690	283092512	/nfs/dbraw/zinc/09/25/12/283092512.db2.gz	ADDSDCOKWQPHDD-SOUVJXGZSA-N	0	3	309.454	2.070	10	0		DEAEHN
CCN1C[C@H](NCc2ncc(Br)s2)[C@@H](C)C1	ZINC000390481851	540133658	/nfs/dbraw/zinc/13/36/58/540133658.db2.gz	NDZZKMZJKKEINN-IUCAKERBSA-N	0	3	304.257	2.335	10	0		DEAEHN
NC[C@@H](NC(=O)c1cccc(Br)c1)C(F)(F)F	ZINC000401877888	540143201	/nfs/dbraw/zinc/14/32/01/540143201.db2.gz	ORAYOOGPUMVMCT-MRVPVSSYSA-N	0	3	311.101	2.069	10	0		DEAEHN
Cc1cccc(CNC(=O)NC[C@H](C)N2CCC[C@H](C)C2)n1	ZINC000123977793	355806913	/nfs/dbraw/zinc/80/69/13/355806913.db2.gz	WXBNGGKUEUFGFS-ZFWWWQNUSA-N	0	3	304.438	2.310	10	0		DEAEHN
CC(C)C(=O)N1CCC(N[C@H](c2nccn2C)C2CC2)CC1	ZINC000127565173	355822787	/nfs/dbraw/zinc/82/27/87/355822787.db2.gz	VSJBOVGZODBIKO-HNNXBMFYSA-N	0	3	304.438	2.108	10	0		DEAEHN
C[C@@H](NC[C@H]1CN(C)CCO1)c1ccc(Br)cc1	ZINC000078469453	191867780	/nfs/dbraw/zinc/86/77/80/191867780.db2.gz	ORTZTRPHUBFWBC-RISCZKNCSA-N	0	3	313.239	2.430	10	0		DEAEHN
CC(=O)N1CC[C@@H](CN(C)Cc2cnc(-c3ccccc3)[nH]2)C1	ZINC000180825872	356061633	/nfs/dbraw/zinc/06/16/33/356061633.db2.gz	MJHXKNCWJICWIX-HNNXBMFYSA-N	0	3	312.417	2.377	10	0		DEAEHN
C[C@H](NCCOCC(F)(F)F)c1ccc(-n2ccnn2)cc1	ZINC000182006310	356104954	/nfs/dbraw/zinc/10/49/54/356104954.db2.gz	MCQJPLGNZKVMQX-NSHDSACASA-N	0	3	314.311	2.497	10	0		DEAEHN
COC(=O)CCN1CCN(C[C@@H](C)c2ccccc2)[C@H](C)C1	ZINC000182109591	356109449	/nfs/dbraw/zinc/10/94/49/356109449.db2.gz	CRBJBJAGRVBHFP-HZPDHXFCSA-N	0	3	304.434	2.359	10	0		DEAEHN
C[C@H](CNC(=O)NCCN1CCCC[C@H]1C)c1nccs1	ZINC000183045525	356158103	/nfs/dbraw/zinc/15/81/03/356158103.db2.gz	YBYDPRALCCUUPY-CHWSQXEVSA-N	0	3	310.467	2.420	10	0		DEAEHN
COc1ccc([C@@](C)(O)[C@H]2CCCN2Cc2ccnn2C)cc1	ZINC000225546120	356276623	/nfs/dbraw/zinc/27/66/23/356276623.db2.gz	JXTZPCVZWCWXAV-QZTJIDSGSA-N	0	3	315.417	2.301	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)N2CCO[C@@H](c3cccs3)C2)C1	ZINC000246010221	356311458	/nfs/dbraw/zinc/31/14/58/356311458.db2.gz	KUVZJVIOQCEEQM-UONOGXRCSA-N	0	3	323.462	2.173	10	0		DEAEHN
O=C(Nc1cc2c(cc1Cl)NC(=O)C2)[C@H]1CCCCCN1	ZINC000080994851	192209987	/nfs/dbraw/zinc/20/99/87/192209987.db2.gz	RLOJTTFIXZEVBE-LLVKDONJSA-N	0	3	307.781	2.305	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)Nc1ccc(C(=O)NC(C)C)c(C)c1	ZINC000236897733	202059509	/nfs/dbraw/zinc/05/95/09/202059509.db2.gz	FBJQOEDSDYEXTE-XHDPSFHLSA-N	0	3	305.422	2.445	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)NC[C@@H](c1ccco1)N1CCCCC1	ZINC000237044161	202133588	/nfs/dbraw/zinc/13/35/88/202133588.db2.gz	PKKXRFZEJRHVPU-DZKIICNBSA-N	0	3	307.438	2.296	10	0		DEAEHN
COc1cc(C[NH2+][C@@H]2CO[C@@H](C)C2)cc(Br)c1[O-]	ZINC000402030762	356728809	/nfs/dbraw/zinc/72/88/09/356728809.db2.gz	YUWZIYSAOPZMRM-WPRPVWTQSA-N	0	3	316.195	2.430	10	0		DEAEHN
c1nc(-c2ccccn2)sc1CNCCN1CCCOCC1	ZINC000579408650	356968723	/nfs/dbraw/zinc/96/87/23/356968723.db2.gz	LIBXXEKICREABC-UHFFFAOYSA-N	0	3	318.446	2.017	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2CCCC[C@H]2C)ccc1F	ZINC000088907434	192653481	/nfs/dbraw/zinc/65/34/81/192653481.db2.gz	GOAJHVFMTZWSRU-GFCCVEGCSA-N	0	3	314.426	2.498	10	0		DEAEHN
CC(C)NCc1ccc(F)c(S(=O)(=O)N(C)C2CC2)c1	ZINC000088941332	192663151	/nfs/dbraw/zinc/66/31/51/192663151.db2.gz	RCHPPOGVYNHCRK-UHFFFAOYSA-N	0	3	300.399	2.107	10	0		DEAEHN
COCCC1(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CC1	ZINC000180198433	199129282	/nfs/dbraw/zinc/12/92/82/199129282.db2.gz	ZKYSDXMRLJYCGK-HOTGVXAUSA-N	0	3	302.418	2.365	10	0		DEAEHN
COC1CCN(C(C)(C)CNC(=O)c2cc(C)[nH]c2C)CC1	ZINC000593919722	358172669	/nfs/dbraw/zinc/17/26/69/358172669.db2.gz	AFHWYDNRRZRVIH-UHFFFAOYSA-N	0	3	307.438	2.251	10	0		DEAEHN
CNCc1ccccc1S(=O)(=O)NCc1ccc(C)s1	ZINC000089021444	192700279	/nfs/dbraw/zinc/70/02/79/192700279.db2.gz	RFEFLZNARDKKQL-UHFFFAOYSA-N	0	3	310.444	2.254	10	0		DEAEHN
CN(C[C@H](O)COc1cccc2ccccc21)CC1(CO)CC1	ZINC000186793156	200012139	/nfs/dbraw/zinc/01/21/39/200012139.db2.gz	LSUOPSUTROLUKW-INIZCTEOSA-N	0	3	315.413	2.284	10	0		DEAEHN
CN(C)C1(CN(C)C(=O)NCCCc2ccccn2)CCC1	ZINC000187319720	200094910	/nfs/dbraw/zinc/09/49/10/200094910.db2.gz	CUITUIVZZOOGQB-UHFFFAOYSA-N	0	3	304.438	2.140	10	0		DEAEHN
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NCC[C@@H](C)O	ZINC000187480177	200117464	/nfs/dbraw/zinc/11/74/64/200117464.db2.gz	FJFLDPXGYITATH-WBVHZDCISA-N	0	3	321.465	2.213	10	0		DEAEHN
CCOC[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)C(C)C	ZINC000189363921	200387914	/nfs/dbraw/zinc/38/79/14/200387914.db2.gz	AFNRKVSPOYBUBP-WFASDCNBSA-N	0	3	314.451	2.046	10	0		DEAEHN
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN(C)CCCO	ZINC000440957374	238000423	/nfs/dbraw/zinc/00/04/23/238000423.db2.gz	LRWMOSVOZKZBHR-MRXNPFEDSA-N	0	3	309.450	2.346	10	0		DEAEHN
C[C@@H](NC(=O)N[C@H]1CCN(C2CC2)C1)c1ccc2c(c1)OCO2	ZINC000604165061	360888057	/nfs/dbraw/zinc/88/80/57/360888057.db2.gz	YPKJDZTTZDNROZ-YPMHNXCESA-N	0	3	317.389	2.012	10	0		DEAEHN
CC(=O)Nc1cccc([C@H](C)NC[C@H](O)COC(C)(C)C)c1	ZINC000193430513	201049517	/nfs/dbraw/zinc/04/95/17/201049517.db2.gz	SSBIEJXKKANGKA-LRDDRELGSA-N	0	3	308.422	2.472	10	0		DEAEHN
COC(=O)[C@H](C1CC1)N1CC[C@@H](N(C)Cc2ccccc2)C1	ZINC000611668765	361654740	/nfs/dbraw/zinc/65/47/40/361654740.db2.gz	QQOQFPALOBGAGW-SJORKVTESA-N	0	3	302.418	2.144	10	0		DEAEHN
COCCNCc1cccc(SCC(=O)NCC(C)C)c1	ZINC000090873282	192940576	/nfs/dbraw/zinc/94/05/76/192940576.db2.gz	NBJYKTBYOJRRFN-UHFFFAOYSA-N	0	3	310.463	2.287	10	0		DEAEHN
COc1ccc(-n2cc(CN3CC[C@H](CO)[C@H]3C)cn2)cc1	ZINC000449290822	240318978	/nfs/dbraw/zinc/31/89/78/240318978.db2.gz	YYGOMCILQWNXEO-UKRRQHHQSA-N	0	3	301.390	2.084	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2ccc(F)cc2C)CC12COC2	ZINC000449359115	240392184	/nfs/dbraw/zinc/39/21/84/240392184.db2.gz	GHZFAXOBDMLUHP-OAHLLOKOSA-N	0	3	307.365	2.146	10	0		DEAEHN
NCc1nc2cc(Oc3ccc4[nH]c(CN)nc4c3)ccc2[nH]1	ZINC000006813652	181394355	/nfs/dbraw/zinc/39/43/55/181394355.db2.gz	OIZFZQVYJDIEEK-UHFFFAOYSA-N	0	3	308.345	2.149	10	0		DEAEHN
CCOc1ccc([C@H](C)NC(=O)C[C@@H]2CSCCN2)cc1	ZINC000091135311	193001223	/nfs/dbraw/zinc/00/12/23/193001223.db2.gz	BMTXKTMHANMIGM-GXTWGEPZSA-N	0	3	308.447	2.358	10	0		DEAEHN
C[C@H](C1CC1)N(CC(F)(F)F)C(=O)C[C@H]1CSCCN1	ZINC000091135898	193001437	/nfs/dbraw/zinc/00/14/37/193001437.db2.gz	TYSOLLSDLVNOCH-KOLCDFICSA-N	0	3	310.385	2.271	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)N[C@@H]1CCCC[C@@H]1C(F)(F)F	ZINC000091135271	193001987	/nfs/dbraw/zinc/00/19/87/193001987.db2.gz	WCDISYWZMPAVQG-OUAUKWLOSA-N	0	3	310.385	2.319	10	0		DEAEHN
C[C@@H](NC[C@H]1COCCN1C)c1ccc(Br)s1	ZINC000623713383	365141341	/nfs/dbraw/zinc/14/13/41/365141341.db2.gz	ZNTYHROHAZZTRH-ZJUUUORDSA-N	0	3	319.268	2.492	10	0		DEAEHN
CN(CC1CC(O)C1)[C@H](CN)c1ccccc1Br	ZINC000091451469	193058469	/nfs/dbraw/zinc/05/84/69/193058469.db2.gz	OXLKWBQNFFBWIB-QIMFLAQGSA-N	0	3	313.239	2.152	10	0		DEAEHN
CCCc1c(CNC(C)(C)C)cnn1[C@H]1CCS(=O)(=O)C1	ZINC000091336109	193042470	/nfs/dbraw/zinc/04/24/70/193042470.db2.gz	ARVNSFAFRQRTOI-ZDUSSCGKSA-N	0	3	313.467	2.083	10	0		DEAEHN
Cc1cc(CNC[C@@H]2CN(C)CCO2)ccc1Br	ZINC000091667586	193088316	/nfs/dbraw/zinc/08/83/16/193088316.db2.gz	HXKXGMPLFAJNAS-CYBMUJFWSA-N	0	3	313.239	2.178	10	0		DEAEHN
CN[C@H](c1ccccc1OC(F)(F)F)[C@@H]1CN(C)CCO1	ZINC000091717987	193097295	/nfs/dbraw/zinc/09/72/95/193097295.db2.gz	RSNWCVQPQSJPLX-QWHCGFSZSA-N	0	3	304.312	2.176	10	0		DEAEHN
C[NH2+]C1CCC([N-]S(=O)(=O)c2cccc(Cl)c2F)CC1	ZINC000091872472	193121332	/nfs/dbraw/zinc/12/13/32/193121332.db2.gz	HDWSBTZGOMNUEG-UHFFFAOYSA-N	0	3	320.817	2.288	10	0		DEAEHN
CC(C)O[C@H](C(=O)NCCNc1ccncc1)c1ccccc1	ZINC000449813707	241115157	/nfs/dbraw/zinc/11/51/57/241115157.db2.gz	INUDMTLGZCHASZ-KRWDZBQOSA-N	0	3	313.401	2.198	10	0		DEAEHN
c1c(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)nnn1CC1CC1	ZINC000450605020	242006432	/nfs/dbraw/zinc/00/64/32/242006432.db2.gz	YDAHVZBHLBPXMF-QAPCUYQASA-N	0	3	315.465	2.137	10	0		DEAEHN
CCNCc1ccc(C)c(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)c1	ZINC000092113569	193161071	/nfs/dbraw/zinc/16/10/71/193161071.db2.gz	ZJUKSJXEJSDAHX-OKILXGFUSA-N	0	3	310.463	2.381	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCCC2(C)C)c(F)c1	ZINC000092116149	193164394	/nfs/dbraw/zinc/16/43/94/193164394.db2.gz	BXRVMEDSAZTWAK-UHFFFAOYSA-N	0	3	300.399	2.108	10	0		DEAEHN
c1c(CNC[C@H]2CCc3ccccc32)nnn1C[C@H]1CCOC1	ZINC000631069102	368000222	/nfs/dbraw/zinc/00/02/22/368000222.db2.gz	MGIWYHWHOPHMJM-GDBMZVCRSA-N	0	3	312.417	2.134	10	0		DEAEHN
Cn1cc(CN[C@@H]2CCCCCN(Cc3ccccc3)C2)nn1	ZINC000631205173	368076555	/nfs/dbraw/zinc/07/65/55/368076555.db2.gz	LCEBIELQSCHXTP-QGZVFWFLSA-N	0	3	313.449	2.350	10	0		DEAEHN
c1cnc2c(c1)[C@H](NCc1ccc(-c3nncnn3)cc1)CCC2	ZINC000631644556	368324791	/nfs/dbraw/zinc/32/47/91/368324791.db2.gz	UVMHTXFQZPHGGT-QGZVFWFLSA-N	0	3	318.384	2.496	10	0		DEAEHN
CCN(CC(C)(C)O)[C@@H](C)C(=O)Nc1ccc(N)cc1Cl	ZINC000092964691	193189898	/nfs/dbraw/zinc/18/98/98/193189898.db2.gz	HCGLFQROUPEXDG-JTQLQIEISA-N	0	3	313.829	2.342	10	0		DEAEHN
COc1ccccc1CN1CCCC[C@H]1CN1CCOCC1	ZINC000093012093	193193183	/nfs/dbraw/zinc/19/31/83/193193183.db2.gz	UIMJPAIWFBKJKR-KRWDZBQOSA-N	0	3	304.434	2.382	10	0		DEAEHN
COCCOc1ccc(CN2C[C@H]3CCC[C@@H](C2)C3O)cc1	ZINC000093479887	193257695	/nfs/dbraw/zinc/25/76/95/193257695.db2.gz	ZNJBCKUIUGJLSD-BYICEURKSA-N	0	3	305.418	2.305	10	0		DEAEHN
CN[C@@]1(C(=O)OC)CCC[C@@H]1CCN(C)CCC(F)(F)F	ZINC000093596099	193270995	/nfs/dbraw/zinc/27/09/95/193270995.db2.gz	AXJVCBISPJOTNW-YPMHNXCESA-N	0	3	310.360	2.192	10	0		DEAEHN
CCCN[C@@]1(C(=O)OC)CC[C@@H](N(C)CCC(F)(F)F)C1	ZINC000093831865	193314466	/nfs/dbraw/zinc/31/44/66/193314466.db2.gz	GOLDLXKAIDQKKJ-YPMHNXCESA-N	0	3	310.360	2.335	10	0		DEAEHN
CCN[C@@]1(C(=O)OCC)CC[C@@H](N(C)CCC(F)(F)F)C1	ZINC000093831815	193314918	/nfs/dbraw/zinc/31/49/18/193314918.db2.gz	XTDLLINJQPRBBA-YPMHNXCESA-N	0	3	310.360	2.335	10	0		DEAEHN
CN1C[C@H](NCc2cc(F)cc(Br)c2)CCC1=O	ZINC000093982453	193333572	/nfs/dbraw/zinc/33/35/72/193333572.db2.gz	WXZRHQCFUBMVBI-GFCCVEGCSA-N	0	3	315.186	2.299	10	0		DEAEHN
NCc1ccc(C(F)(F)F)nc1N1CCCC[C@@H]1CCO	ZINC000094334055	193360205	/nfs/dbraw/zinc/36/02/05/193360205.db2.gz	ZZRDCMCUEDPSRI-LLVKDONJSA-N	0	3	303.328	2.300	10	0		DEAEHN
CC[C@@H](C)NC(=O)[C@H](C)Oc1c(F)cc(CNC)cc1F	ZINC000094346450	193363301	/nfs/dbraw/zinc/36/33/01/193363301.db2.gz	WLGKNTHAISUGCG-ZJUUUORDSA-N	0	3	300.349	2.366	10	0		DEAEHN
CCOC(=O)COC[C@H](N)c1ccc(F)c(Br)c1	ZINC000094071861	193343549	/nfs/dbraw/zinc/34/35/49/193343549.db2.gz	WEXSBFWLLPEXCO-NSHDSACASA-N	0	3	320.158	2.168	10	0		DEAEHN
CN[C@@H](c1cc(Br)ccc1F)[C@@H]1COCCO1	ZINC000094108713	193345573	/nfs/dbraw/zinc/34/55/73/193345573.db2.gz	WSOKDRLTDBBFHU-RYUDHWBXSA-N	0	3	304.159	2.264	10	0		DEAEHN
C[C@]1(c2nc(-c3ncc(Cl)cc3Cl)no2)COC[C@@H]1N	ZINC000094199327	193348712	/nfs/dbraw/zinc/34/87/12/193348712.db2.gz	HYMMURRUEZVWMM-UFBFGSQYSA-N	0	3	315.160	2.054	10	0		DEAEHN
CCC(N)(CC)C(=O)Nc1ccccc1S(=O)(=O)C(F)F	ZINC000094244214	193354368	/nfs/dbraw/zinc/35/43/68/193354368.db2.gz	BJPJESKVGBWHMI-UHFFFAOYSA-N	0	3	320.361	2.139	10	0		DEAEHN
CNCc1cc(C)ccc1O[C@@H]1CCC[C@@H](S(C)(=O)=O)C1	ZINC000094634524	193386527	/nfs/dbraw/zinc/38/65/27/193386527.db2.gz	VGEDMOJIUOFAKA-HUUCEWRRSA-N	0	3	311.447	2.449	10	0		DEAEHN
CCCN[C@H](c1ccncn1)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094642342	193388669	/nfs/dbraw/zinc/38/86/69/193388669.db2.gz	QGCHQQVUPQHGNB-YDHLFZDLSA-N	0	3	311.451	2.121	10	0		DEAEHN
CC(C)(C)NCc1ccn([C@H]2CCC[C@@H](S(C)(=O)=O)C2)n1	ZINC000094644462	193389910	/nfs/dbraw/zinc/38/99/10/193389910.db2.gz	XXFSVPSNEFSNSB-UONOGXRCSA-N	0	3	313.467	2.300	10	0		DEAEHN
CCOC(=O)[C@@]1(NCCN(CC)CC)CSCCC1(C)C	ZINC000094484676	193372907	/nfs/dbraw/zinc/37/29/07/193372907.db2.gz	UCYKSKMRXOZPOW-INIZCTEOSA-N	0	3	316.511	2.383	10	0		DEAEHN
CCN1CCC[C@H]1CNc1nc(Br)cn2ccnc12	ZINC000094486814	193373070	/nfs/dbraw/zinc/37/30/70/193373070.db2.gz	OGLCVXZPDGPPTP-JTQLQIEISA-N	0	3	324.226	2.388	10	0		DEAEHN
CCCN[C@H]1CCCc2sc([C@H]3CN4CCN3CC4)nc21	ZINC000094511099	193375114	/nfs/dbraw/zinc/37/51/14/193375114.db2.gz	CJNANCRKOWUXQC-QWHCGFSZSA-N	0	3	306.479	2.192	10	0		DEAEHN
CN(C)Cc1cccc(N2CCN(C(=O)C(C)(C)C)CC2)c1	ZINC000096563418	193680256	/nfs/dbraw/zinc/68/02/56/193680256.db2.gz	SQKHGFJHTMZVHG-UHFFFAOYSA-N	0	3	303.450	2.443	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cc3ccccc3c(=O)[nH]2)CCN1C	ZINC000266124455	205118111	/nfs/dbraw/zinc/11/81/11/205118111.db2.gz	YNCKZOYHQHODRP-JSGCOSHPSA-N	0	3	313.401	2.495	10	0		DEAEHN
O=S1(=O)C[C@@H](NCc2ccccc2)[C@H](c2ccccc2)C1	ZINC000019794339	182150392	/nfs/dbraw/zinc/15/03/92/182150392.db2.gz	VMIVEXMISUDXGH-DLBZAZTESA-N	0	3	301.411	2.357	10	0		DEAEHN
NCc1cc(S(=O)(=O)N2CCc3ccccc32)ccc1F	ZINC000020189220	182195652	/nfs/dbraw/zinc/19/56/52/182195652.db2.gz	PEQCQUPKYUUXFJ-UHFFFAOYSA-N	0	3	306.362	2.036	10	0		DEAEHN
Cc1ccc(N2C(=O)C[C@H](NC3Cc4ccccc4C3)C2=O)cc1	ZINC000021344481	182272614	/nfs/dbraw/zinc/27/26/14/182272614.db2.gz	QQPPCGGCQKIXJQ-SFHVURJKSA-N	0	3	320.392	2.384	10	0		DEAEHN
Cc1cc(C)c(CNC(=O)NCCN2CC=C(C)CC2)cn1	ZINC000454792788	246159804	/nfs/dbraw/zinc/15/98/04/246159804.db2.gz	TZZYQZHYHQSKRM-UHFFFAOYSA-N	0	3	302.422	2.150	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2ccc(Br)o2)C[C@H](C)O1	ZINC000022215189	182313738	/nfs/dbraw/zinc/31/37/38/182313738.db2.gz	RQKWILGPCSQRSX-AEJSXWLSSA-N	0	3	303.200	2.151	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)NC(C)(C)CN(C)C)c1	ZINC000454907957	246249291	/nfs/dbraw/zinc/24/92/91/246249291.db2.gz	UOCBWCLABLOOSJ-UHFFFAOYSA-N	0	3	306.410	2.131	10	0		DEAEHN
Cc1cc(NC(=O)NC[C@H]2C[C@H]2C)n(C2CCN(C)CC2)n1	ZINC000531189472	284524056	/nfs/dbraw/zinc/52/40/56/284524056.db2.gz	BIJKJYCUYYOEDY-DGCLKSJQSA-N	0	3	305.426	2.236	10	0		DEAEHN
C[C@@H]1CN(C(=O)c2ccccc2Cl)C[C@H](C)N1CCN(C)C	ZINC000036126273	182804996	/nfs/dbraw/zinc/80/49/96/182804996.db2.gz	BKTQZRCNIPNBSZ-OKILXGFUSA-N	0	3	323.868	2.436	10	0		DEAEHN
CCOC(=O)C[C@H](N)c1cc2c(c(Br)c1)OCO2	ZINC000036897267	182851228	/nfs/dbraw/zinc/85/12/28/182851228.db2.gz	LXDSJMPBAFLKCR-VIFPVBQESA-N	0	3	316.151	2.131	10	0		DEAEHN
Cc1cc(C)n(CC(=O)N(CCN(C)C)Cc2ccsc2)n1	ZINC000458210350	248208029	/nfs/dbraw/zinc/20/80/29/248208029.db2.gz	ZVUGTGRMFLPMQF-UHFFFAOYSA-N	0	3	320.462	2.152	10	0		DEAEHN
C[C@@H](CNCc1ccc(Br)cc1F)[S@](C)=O	ZINC000159808883	197366578	/nfs/dbraw/zinc/36/65/78/197366578.db2.gz	CJSAOKZXCOLHHC-ZKANADHPSA-N	0	3	308.216	2.445	10	0		DEAEHN
COC(=O)c1sc(OCC[C@@H]2CCCN2C)nc1Cl	ZINC000040240555	183048733	/nfs/dbraw/zinc/04/87/33/183048733.db2.gz	RQWPQBDVCMJWLY-QMMMGPOBSA-N	0	3	304.799	2.446	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)[C@H]1C[C@@H](OC)CN1	ZINC000040634275	183111817	/nfs/dbraw/zinc/11/18/17/183111817.db2.gz	SPAPNYLKJMOGKM-DGCLKSJQSA-N	0	3	312.797	2.444	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2ccc(OC(C)C)c(Cl)c2)C1	ZINC000040633564	183111845	/nfs/dbraw/zinc/11/18/45/183111845.db2.gz	WWQJLHJJCVTDRK-YPMHNXCESA-N	0	3	312.797	2.443	10	0		DEAEHN
CCCC[C@H](N)C(=O)NCCc1ccc(OC(F)F)cc1	ZINC000040832839	183139191	/nfs/dbraw/zinc/13/91/91/183139191.db2.gz	ZVLLWAXGAWWVFQ-ZDUSSCGKSA-N	0	3	300.349	2.464	10	0		DEAEHN
CC(C)[C@H](N)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000040834185	183140373	/nfs/dbraw/zinc/14/03/73/183140373.db2.gz	XPGGGUQJGQUPRL-AWEZNQCLSA-N	0	3	309.797	2.389	10	0		DEAEHN
CCCC[C@H](N)C(=O)Nc1sc2c(c1C(=O)OC)CCC2	ZINC000040858915	183142922	/nfs/dbraw/zinc/14/29/22/183142922.db2.gz	PALXPFIIYZHKOI-JTQLQIEISA-N	0	3	310.419	2.479	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)Nc1sc2c(c1C(=O)OC)CCC2	ZINC000040858866	183143081	/nfs/dbraw/zinc/14/30/81/183143081.db2.gz	DUSJSOHXMZELNL-QPUJVOFHSA-N	0	3	310.419	2.335	10	0		DEAEHN
Nc1c(NCCN2CCCCC2)ncnc1N1CCCCCC1	ZINC000040725439	183124436	/nfs/dbraw/zinc/12/44/36/183124436.db2.gz	IUVOHJKOFKTXOQ-UHFFFAOYSA-N	0	3	318.469	2.337	10	0		DEAEHN
CN1CCN(CC[C@H](O)c2ccc(Br)cc2)CC1	ZINC000041145246	183176339	/nfs/dbraw/zinc/17/63/39/183176339.db2.gz	TUGWQWPWICJIBY-AWEZNQCLSA-N	0	3	313.239	2.120	10	0		DEAEHN
CC[C@H](CO)Nc1c2ccccc2nc(C)c1CC(=O)OC	ZINC000041473229	183192967	/nfs/dbraw/zinc/19/29/67/183192967.db2.gz	RVFYKUWRTJIYRH-GFCCVEGCSA-N	0	3	302.374	2.442	10	0		DEAEHN
CCN(CCOc1ccc(CC(N)=S)cc1)[C@@H](C)COC	ZINC000042765875	183306355	/nfs/dbraw/zinc/30/63/55/183306355.db2.gz	SMNAOTKANKZJSL-ZDUSSCGKSA-N	0	3	310.463	2.251	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccccc1Cl)N1CCCC[C@@H]1C(N)=O	ZINC000043052362	183333155	/nfs/dbraw/zinc/33/31/55/183333155.db2.gz	ZCALABZPAGXTBD-ZNMIVQPWSA-N	0	3	309.841	2.458	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)cc1)N1CCCC[C@@H]1C(N)=O	ZINC000042946465	183320812	/nfs/dbraw/zinc/32/08/12/183320812.db2.gz	NRGSUZIVQQOQER-RRFJBIMHSA-N	0	3	309.841	2.458	10	0		DEAEHN
NC[C@H](c1ccc(Br)cc1)N1CCC(CO)CC1	ZINC000042952715	183322176	/nfs/dbraw/zinc/32/21/76/183322176.db2.gz	OPCOWTQIAISRNT-CQSZACIVSA-N	0	3	313.239	2.153	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)NCc1cccc(OCCN(C)C)c1	ZINC000043068002	183333511	/nfs/dbraw/zinc/33/35/11/183333511.db2.gz	ZGMCBFGDDVYOFY-CQSZACIVSA-N	0	3	307.438	2.471	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)s1)N1CCC[C@@H]1C(N)=O	ZINC000043252233	183346570	/nfs/dbraw/zinc/34/65/70/183346570.db2.gz	PCPVIGAHYJYSNN-LNLATYFQSA-N	0	3	301.843	2.130	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccc(Br)s1)N1CCOCC1	ZINC000043258520	183347631	/nfs/dbraw/zinc/34/76/31/183347631.db2.gz	BJGPKJWDBUZDSZ-KCJUWKMLSA-N	0	3	305.241	2.231	10	0		DEAEHN
C[C@@H](N)[C@@H](c1cc(Br)cs1)N1CCN(C)CC1	ZINC000043284395	183350294	/nfs/dbraw/zinc/35/02/94/183350294.db2.gz	UVZPUVAQXAQHLZ-SKDRFNHKSA-N	0	3	318.284	2.146	10	0		DEAEHN
COc1ccc(Cl)c([N-]S(=O)(=O)C[C@@H]2CCC[NH2+]C2)c1	ZINC000043318850	183354329	/nfs/dbraw/zinc/35/43/29/183354329.db2.gz	XRMSHMUCGJFWLO-SNVBAGLBSA-N	0	3	318.826	2.090	10	0		DEAEHN
Cc1ccc(-n2c(O)c3onc(-c4ccccc4)c3c2O)cc1	ZINC000105592280	194112802	/nfs/dbraw/zinc/11/28/02/194112802.db2.gz	DUSCDCLNXOSETO-GDBMZVCRSA-N	0	3	306.321	2.288	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)c1ccc2nc(N)sc2c1	ZINC000105739053	194122573	/nfs/dbraw/zinc/12/25/73/194122573.db2.gz	FYPSAJNCUZUWBK-NSHDSACASA-N	0	3	304.419	2.093	10	0		DEAEHN
CC[C@@H]1CN(CCCOc2ccccc2)CCN1C[C@@H](C)O	ZINC000105825902	194138566	/nfs/dbraw/zinc/13/85/66/194138566.db2.gz	OQNBXYLOEBMZOT-IAGOWNOFSA-N	0	3	306.450	2.233	10	0		DEAEHN
COC(=O)c1sc(N[C@@H](C)CN2CCCC2)nc1Cl	ZINC000048738696	183683639	/nfs/dbraw/zinc/68/36/39/183683639.db2.gz	CXANMFRIAYXZEY-QMMMGPOBSA-N	0	3	303.815	2.479	10	0		DEAEHN
CN[C@H](C)C(=O)Nc1ccc(C)c(I)c1	ZINC000054073832	183922979	/nfs/dbraw/zinc/92/29/79/183922979.db2.gz	IPFISMMSYRIKGE-MRVPVSSYSA-N	0	3	318.158	2.146	10	0		DEAEHN
CC(C)CNCc1c(Cl)cccc1N1CCNC(=O)[C@H]1C	ZINC000110662290	194348406	/nfs/dbraw/zinc/34/84/06/194348406.db2.gz	SRNKVOSNIUNHDQ-GFCCVEGCSA-N	0	3	309.841	2.410	10	0		DEAEHN
CCN(CCOC)[C@@H](CN)c1ccc(OC)c(OC)c1Cl	ZINC000110829159	194361916	/nfs/dbraw/zinc/36/19/16/194361916.db2.gz	MNTAFUAGXRYYRA-LBPRGKRZSA-N	0	3	316.829	2.325	10	0		DEAEHN
CCCN([C@H]1CCCNC1)S(=O)(=O)c1ccccc1Cl	ZINC000110942189	194372787	/nfs/dbraw/zinc/37/27/87/194372787.db2.gz	SQGVAJRMSFHUKO-LBPRGKRZSA-N	0	3	316.854	2.493	10	0		DEAEHN
C[C@@](O)(Cc1cccc(C(F)(F)F)c1)C[C@H]1COCCN1	ZINC000156778118	197140743	/nfs/dbraw/zinc/14/07/43/197140743.db2.gz	XODUCFHAOXANQH-UONOGXRCSA-N	0	3	303.324	2.377	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC[C@@H]2c2cccn2C)C1	ZINC000057870670	184059669	/nfs/dbraw/zinc/05/96/69/184059669.db2.gz	SYXDYXDBBBWGAP-GOEBONIOSA-N	0	3	304.438	2.356	10	0		DEAEHN
CCCN[C@H](Cc1ccc(F)cc1Cl)CS(C)(=O)=O	ZINC000060706258	184154398	/nfs/dbraw/zinc/15/43/98/184154398.db2.gz	FCKKUAVNKMYQDH-GFCCVEGCSA-N	0	3	307.818	2.434	10	0		DEAEHN
[NH3+]Cc1cccc(S(=O)(=O)[N-]c2cc(F)c(F)cc2F)c1	ZINC000061094192	184161651	/nfs/dbraw/zinc/16/16/51/184161651.db2.gz	MKQPIUVXXZPINS-UHFFFAOYSA-N	0	3	316.304	2.363	10	0		DEAEHN
CC(C)Oc1nc(Cl)nc(N[C@H](CN(C)C)C(C)C)n1	ZINC000061539287	184173740	/nfs/dbraw/zinc/17/37/40/184173740.db2.gz	IVOVGSGHQOQRPN-SNVBAGLBSA-N	0	3	301.822	2.310	10	0		DEAEHN
O=c1ccn(CCNCc2cc(Br)cs2)cc1	ZINC000061628659	184179107	/nfs/dbraw/zinc/17/91/07/184179107.db2.gz	RLAXHQHFELUECK-UHFFFAOYSA-N	0	3	313.220	2.462	10	0		DEAEHN
CC[C@H](Oc1ccc(Br)cc1[C@H](C)NC)C(N)=O	ZINC000061676074	184181881	/nfs/dbraw/zinc/18/18/81/184181881.db2.gz	BJXHBNBKGDMTNX-KWQFWETISA-N	0	3	315.211	2.372	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2ccc(Br)o2)CCCO1	ZINC000061916360	184195153	/nfs/dbraw/zinc/19/51/53/184195153.db2.gz	MMXVEGGDCFUWNF-ZJUUUORDSA-N	0	3	303.200	2.153	10	0		DEAEHN
NC[C@H](c1cc(Br)cs1)N1CCCOCC1	ZINC000061914530	184195166	/nfs/dbraw/zinc/19/51/66/184195166.db2.gz	ZQDZZVHUJYRPEI-SNVBAGLBSA-N	0	3	305.241	2.233	10	0		DEAEHN
COC(=O)[C@]1(Nc2cccc(Br)c2)CCN(C)C1	ZINC000061991481	184199758	/nfs/dbraw/zinc/19/97/58/184199758.db2.gz	LRRXDDOMNFAKGX-ZDUSSCGKSA-N	0	3	313.195	2.108	10	0		DEAEHN
C[C@H](c1ccccc1Cl)N(C)CC(=O)N1CCCNCC1	ZINC000062014438	184201133	/nfs/dbraw/zinc/20/11/33/184201133.db2.gz	SVHQTFQOQUEXDE-CYBMUJFWSA-N	0	3	309.841	2.155	10	0		DEAEHN
COCCCN(C)[C@H](CN)c1cc(Cl)c2c(c1)OCCO2	ZINC000062029984	184202167	/nfs/dbraw/zinc/20/21/67/184202167.db2.gz	HWDVEKHSEQCHAA-CYBMUJFWSA-N	0	3	314.813	2.079	10	0		DEAEHN
C[C@H](C(=O)N(C)[C@H](C)c1ccccc1Cl)N1CCNCC1	ZINC000062028181	184202468	/nfs/dbraw/zinc/20/24/68/184202468.db2.gz	NVXFJIJOBXMQLB-CHWSQXEVSA-N	0	3	309.841	2.153	10	0		DEAEHN
COCCN1C(=O)C[C@@H](N)[C@H]1c1c(Cl)cccc1Cl	ZINC000062210261	184220628	/nfs/dbraw/zinc/22/06/28/184220628.db2.gz	FCMGBGIVIDXCLS-MFKMUULPSA-N	0	3	303.189	2.241	10	0		DEAEHN
COCCNCc1cc(Cl)ccc1OCC(=O)OC(C)C	ZINC000062731123	184251166	/nfs/dbraw/zinc/25/11/66/184251166.db2.gz	NFIKDKMSSXAWLH-UHFFFAOYSA-N	0	3	315.797	2.406	10	0		DEAEHN
CN[C@@H](C)c1ccc(F)cc1OCC(=O)NCC(F)(F)F	ZINC000062746170	184252148	/nfs/dbraw/zinc/25/21/48/184252148.db2.gz	ZZGBLEZTCMRPRN-QMMMGPOBSA-N	0	3	308.275	2.163	10	0		DEAEHN
COCCn1ncc(Br)c1[C@@H](N)CC(F)(F)F	ZINC000158903415	197310555	/nfs/dbraw/zinc/31/05/55/197310555.db2.gz	HQUJMHACKKFGDA-ZETCQYMHSA-N	0	3	316.121	2.244	10	0		DEAEHN
Cc1cc(C)c2c(c1)[C@@H](NC[C@@H]1CN(C)CCO1)CCCO2	ZINC000180493092	291834278	/nfs/dbraw/zinc/83/42/78/291834278.db2.gz	GUSRVZFLBXYCCT-WBVHZDCISA-N	0	3	304.434	2.437	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)CCCc1nc(C2CC2)no1	ZINC000119827773	195043383	/nfs/dbraw/zinc/04/33/83/195043383.db2.gz	PQVULHNKQQRERT-CQSZACIVSA-N	0	3	322.453	2.362	10	0		DEAEHN
COc1ccnc(N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)n1	ZINC000328626198	533059160	/nfs/dbraw/zinc/05/91/60/533059160.db2.gz	LMGKDPYAZKPLJS-HOCLYGCPSA-N	0	3	313.405	2.009	10	0		DEAEHN
CCN(CC(C)C)S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159066615	197323290	/nfs/dbraw/zinc/32/32/90/197323290.db2.gz	JQGPBFYLIRZXIM-UHFFFAOYSA-N	0	3	302.415	2.259	10	0		DEAEHN
CC(C)(C)NCc1cc(S(=O)(=O)N2CCCC2)ccc1F	ZINC000159048112	197322136	/nfs/dbraw/zinc/32/21/36/197322136.db2.gz	UFNVJMYOGOKBJW-UHFFFAOYSA-N	0	3	314.426	2.498	10	0		DEAEHN
CCN[C@@H](CS(=O)(=O)c1ccccc1Cl)[C@@H]1CCOC1	ZINC000158718788	197296571	/nfs/dbraw/zinc/29/65/71/197296571.db2.gz	RGULCPGHJQQHPM-YPMHNXCESA-N	0	3	317.838	2.128	10	0		DEAEHN
CCn1ncc(Br)c1[C@@H](C[C@@H]1CCCO1)NC	ZINC000158642334	197290312	/nfs/dbraw/zinc/29/03/12/197290312.db2.gz	CCLYVZPKIDGKAX-GXSJLCMTSA-N	0	3	302.216	2.495	10	0		DEAEHN
C[C@@H](NC(=O)NC[C@](C)(O)CN(C)C)c1cccc(Cl)c1	ZINC000120252430	195127536	/nfs/dbraw/zinc/12/75/36/195127536.db2.gz	YUGICVBVFJEFON-ABAIWWIYSA-N	0	3	313.829	2.013	10	0		DEAEHN
Cc1ccc(Cl)cc1NC(=O)CNC1CCS(=O)CC1	ZINC000158155901	197248702	/nfs/dbraw/zinc/24/87/02/197248702.db2.gz	SDYLBLBGHBYPCH-UHFFFAOYSA-N	0	3	314.838	2.088	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@H](c2cccc(OC)c2)C1)N(C)C	ZINC000158071655	197240913	/nfs/dbraw/zinc/24/09/13/197240913.db2.gz	UPXIEPRTLRXMOS-IRXDYDNUSA-N	0	3	320.433	2.325	10	0		DEAEHN
C[C@H]1C[C@H](Nc2nc3c(cc2C(N)=S)CCC3)CCN1C	ZINC000158059859	197239530	/nfs/dbraw/zinc/23/95/30/197239530.db2.gz	JOIJUUWXZILAMG-CMPLNLGQSA-N	0	3	304.463	2.099	10	0		DEAEHN
C[C@@H](CCO)NC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000157986063	197232647	/nfs/dbraw/zinc/23/26/47/197232647.db2.gz	UFSXISJHSOQMLR-RDJZCZTQSA-N	0	3	319.449	2.111	10	0		DEAEHN
O[C@@H](CNc1cc(Cl)nc(C2CC2)n1)CN1CCCCC1	ZINC000157819553	197217299	/nfs/dbraw/zinc/21/72/99/197217299.db2.gz	QULNUMSVIBNDAR-LBPRGKRZSA-N	0	3	310.829	2.266	10	0		DEAEHN
C[C@@H]1CN([C@H](CN)c2cc3c(c(Cl)c2)OCO3)C[C@H](C)O1	ZINC000157766721	197214021	/nfs/dbraw/zinc/21/40/21/197214021.db2.gz	GAGDMKVSSLIADW-GBIKHYSHSA-N	0	3	312.797	2.178	10	0		DEAEHN
CC(C)(N)c1cn(Cc2cccc(F)c2Br)nn1	ZINC000157570953	197198819	/nfs/dbraw/zinc/19/88/19/197198819.db2.gz	KMSMDRNOJQCKCL-UHFFFAOYSA-N	0	3	313.174	2.422	10	0		DEAEHN
CCc1nn(C)c(C[C@](C)(F)C[C@@H]2COCCN2)c1Cl	ZINC000157545911	197196200	/nfs/dbraw/zinc/19/62/00/197196200.db2.gz	CETXVUHYOSOKHD-QMTHXVAHSA-N	0	3	303.809	2.285	10	0		DEAEHN
CS(=O)(=O)c1ccc(N[C@@H]2C[C@H](N)c3ccccc32)cn1	ZINC000157305122	197178384	/nfs/dbraw/zinc/17/83/84/197178384.db2.gz	MMLBPOQZNMNTJK-UONOGXRCSA-N	0	3	303.387	2.042	10	0		DEAEHN
CCCN[C@@H](Cc1ccc(OC)c(F)c1)[C@H](C)S(C)(=O)=O	ZINC000157284008	197176591	/nfs/dbraw/zinc/17/65/91/197176591.db2.gz	GVYJRDSVVTZKHW-FZMZJTMJSA-N	0	3	317.426	2.178	10	0		DEAEHN
C[C@]1(CNC(=O)c2c[nH]c(=NN)c(Cl)c2)CCCS1	ZINC000157175566	197167346	/nfs/dbraw/zinc/16/73/46/197167346.db2.gz	PQRWNCLOZPZFGQ-GFCCVEGCSA-N	0	3	300.815	2.036	10	0		DEAEHN
COC(=O)c1sccc1NC(=O)c1ccc2c(c1)CNC2	ZINC000156731748	197136843	/nfs/dbraw/zinc/13/68/43/197136843.db2.gz	CNDRHJQOXOEJFL-UHFFFAOYSA-N	0	3	302.355	2.390	10	0		DEAEHN
COCCN[C@@]1(c2nc3c(s2)CCC3)CCN(C)[C@@H](C)C1	ZINC000156688845	197134377	/nfs/dbraw/zinc/13/43/77/197134377.db2.gz	QAVILSAGNKVFII-LRDDRELGSA-N	0	3	309.479	2.177	10	0		DEAEHN
Cc1cc(N(CCO)C2CCCCC2)c(C(N)=S)c(C)n1	ZINC000156653696	197129998	/nfs/dbraw/zinc/12/99/98/197129998.db2.gz	NMMAGWIROMCDTL-UHFFFAOYSA-N	0	3	307.463	2.464	10	0		DEAEHN
O=C1C[C@@H](NC[C@H]2CCCCS2)C(=O)N1C1CCCCC1	ZINC000156412082	197110963	/nfs/dbraw/zinc/11/09/63/197110963.db2.gz	QYGHIWDWUMLNBT-ZIAGYGMSSA-N	0	3	310.463	2.322	10	0		DEAEHN
C[C@H]1C[C@H](Nc2ccc(F)c([N-]S(C)(=O)=O)c2)CC[N@@H+]1C	ZINC000155962942	197077227	/nfs/dbraw/zinc/07/72/27/197077227.db2.gz	YBCBYQRJWONPDP-CMPLNLGQSA-N	0	3	315.414	2.092	10	0		DEAEHN
C[C@H]1C[C@H](Nc2ccc(F)c([N-]S(C)(=O)=O)c2)CC[N@H+]1C	ZINC000155962942	197077229	/nfs/dbraw/zinc/07/72/29/197077229.db2.gz	YBCBYQRJWONPDP-CMPLNLGQSA-N	0	3	315.414	2.092	10	0		DEAEHN
Cc1c(F)cccc1NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000120521729	195182975	/nfs/dbraw/zinc/18/29/75/195182975.db2.gz	HQKXYUISLIYBRX-YPMHNXCESA-N	0	3	321.396	2.014	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2cccc3c2OC(C)(C)C3)C[C@@H]1C	ZINC000120606762	195200192	/nfs/dbraw/zinc/20/01/92/195200192.db2.gz	OMNOOIAXVPTYOB-LSDHHAIUSA-N	0	3	318.461	2.287	10	0		DEAEHN
Cc1ccc(F)c(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000120681065	195215814	/nfs/dbraw/zinc/21/58/14/195215814.db2.gz	VXEPFJCUYXJBHO-CHWSQXEVSA-N	0	3	321.396	2.014	10	0		DEAEHN
c1ccc(CN2CC[C@]3(C[C@H](Oc4ncccn4)CO3)C2)cc1	ZINC000096218731	256553516	/nfs/dbraw/zinc/55/35/16/256553516.db2.gz	IWMCLRATHVHFTO-WMZOPIPTSA-N	0	3	311.385	2.289	10	0		DEAEHN
C[C@@H](NCc1cc2c(cc1Br)OCO2)[C@H](C)CO	ZINC000123241851	195559912	/nfs/dbraw/zinc/55/99/12/195559912.db2.gz	BGBSYQYMZVYBKP-RKDXNWHRSA-N	0	3	316.195	2.284	10	0		DEAEHN
CC(C)[C@@H](NC(=O)OC(C)(C)C)[C@@]1(C)NCCc2ncn(C)c21	ZINC000725242732	542770065	/nfs/dbraw/zinc/77/00/65/542770065.db2.gz	NYPJEEIYIPBFDI-CXAGYDPISA-N	0	3	322.453	2.330	10	0		DEAEHN
COC(=O)C1C(=O)Nc2cc(Cl)c(Br)cc21	ZINC000725255743	542770596	/nfs/dbraw/zinc/77/05/96/542770596.db2.gz	LBFWUADNLXYTKC-QMMMGPOBSA-N	0	3	304.527	2.311	10	0		DEAEHN
C[C@H](Cc1ccccc1)C(=O)NCCN1CCN(C)C(C)(C)C1	ZINC000357685810	133093749	/nfs/dbraw/zinc/09/37/49/133093749.db2.gz	HNEIPSVDXKNOKC-MRXNPFEDSA-N	0	3	317.477	2.007	10	0		DEAEHN
C[C@H](C(=O)N1C[C@]2(CCOC2)OC(C)(C)C1)N1CCCCCC1	ZINC000358228828	133129758	/nfs/dbraw/zinc/12/97/58/133129758.db2.gz	SZPPYKBPZFRRNA-QAPCUYQASA-N	0	3	324.465	2.047	10	0		DEAEHN
CCS[C@H]1CCC[C@@H](NC(=O)NCCNc2ccncc2)C1	ZINC000361917007	133199510	/nfs/dbraw/zinc/19/95/10/133199510.db2.gz	VRDDUNRYDZYBRD-CABCVRRESA-N	0	3	322.478	2.279	10	0		DEAEHN
Cc1ccc([C@H]2CCCN2C[C@H](O)COC2CCOCC2)o1	ZINC000368549488	133277770	/nfs/dbraw/zinc/27/77/70/133277770.db2.gz	QCRYAFWYURYLBX-GOEBONIOSA-N	0	3	309.406	2.281	10	0		DEAEHN
C[NH+](C)CC1CCC(NC(=O)NCc2ccc([O-])c(F)c2)CC1	ZINC000125449012	144721935	/nfs/dbraw/zinc/72/19/35/144721935.db2.gz	FDKSQMONKLTVJD-UHFFFAOYSA-N	0	3	323.412	2.451	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)N1CCCN(C2CC2)CC1	ZINC000187501132	145000403	/nfs/dbraw/zinc/00/04/03/145000403.db2.gz	PMMBNRVHPHKDPT-CYBMUJFWSA-N	0	3	318.421	2.031	10	0		DEAEHN
Cc1c2ccccc2[nH]c(=O)c1C(=O)N1CCN2CCC1CC2	ZINC000188843974	145018526	/nfs/dbraw/zinc/01/85/26/145018526.db2.gz	CZVRMOVEQACGAE-UHFFFAOYSA-N	0	3	311.385	2.169	10	0		DEAEHN
CCOC1CC(CCNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)C1	ZINC000191716664	145063451	/nfs/dbraw/zinc/06/34/51/145063451.db2.gz	BKMIGLBZIISAKM-CIDNJEQPSA-N	0	3	311.470	2.316	10	0		DEAEHN
c1ccc(CSCCN2CC[C@@H](N3CCOCC3)C2)cc1	ZINC000192603170	145075949	/nfs/dbraw/zinc/07/59/49/145075949.db2.gz	UKXJMHHJHIVSFD-QGZVFWFLSA-N	0	3	306.475	2.326	10	0		DEAEHN
COC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1CCC(=O)NC1CCCC1	ZINC000193753987	145089841	/nfs/dbraw/zinc/08/98/41/145089841.db2.gz	TXEFUCWUQRGZCC-KBMXLJTQSA-N	0	3	322.449	2.241	10	0		DEAEHN
CC(C)N1CCCC[C@H]1C(=O)N1CC[C@@H](Oc2cccnc2)C1	ZINC000246304619	145098019	/nfs/dbraw/zinc/09/80/19/145098019.db2.gz	YJQGLOJFVLIYOR-SJORKVTESA-N	0	3	317.433	2.324	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@H]2C[C@@H]2c2cccc(OC)c2)C1	ZINC000246354621	145100395	/nfs/dbraw/zinc/10/03/95/145100395.db2.gz	OFLOSZSXGRMHEZ-UAGQMJEPSA-N	0	3	302.418	2.399	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)NC[C@@](C)(O)CCC(C)C	ZINC000246926162	145119790	/nfs/dbraw/zinc/11/97/90/145119790.db2.gz	DMZPSZGQIMHLKT-RDJZCZTQSA-N	0	3	313.486	2.347	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCO[C@@H](c2ccc(C)o2)C1	ZINC000246956144	145120010	/nfs/dbraw/zinc/12/00/10/145120010.db2.gz	SMSPYRLRDNPGNY-GOEBONIOSA-N	0	3	321.421	2.155	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cccc(-n2cccn2)c1	ZINC000246988039	145122541	/nfs/dbraw/zinc/12/25/41/145122541.db2.gz	LGKHSZHTPZCINV-YOEHRIQHSA-N	0	3	310.401	2.181	10	0		DEAEHN
C[C@@H](c1nc(-c2cccnc2)no1)N(C)C[C@H]1CCCN(C)C1	ZINC000247017545	145124030	/nfs/dbraw/zinc/12/40/30/145124030.db2.gz	QPRGECHOGJIENJ-KBPBESRZSA-N	0	3	315.421	2.466	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1C[C@@H](O)COc1ccccc1	ZINC000247088133	145126596	/nfs/dbraw/zinc/12/65/96/145126596.db2.gz	PQHHMPKESOHVEG-DLBZAZTESA-N	0	3	315.417	2.096	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1C	ZINC000247126891	145126797	/nfs/dbraw/zinc/12/67/97/145126797.db2.gz	JFTYEHIXZOKDOJ-HUUCEWRRSA-N	0	3	308.447	2.161	10	0		DEAEHN
O=C(CCN1CCS[C@@H]2COCC[C@H]21)Nc1cccc(F)c1	ZINC000247316150	145133343	/nfs/dbraw/zinc/13/33/43/145133343.db2.gz	VWIXIRCKXQBQMY-HUUCEWRRSA-N	0	3	324.421	2.361	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1OCCNC(=O)N1CCN2CCC[C@H]2C1	ZINC000247473154	145138365	/nfs/dbraw/zinc/13/83/65/145138365.db2.gz	HOVGJAWRFSTUOY-OWCLPIDISA-N	0	3	309.454	2.071	10	0		DEAEHN
CC[S@](=O)c1ccccc1C(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000247481954	145138652	/nfs/dbraw/zinc/13/86/52/145138652.db2.gz	WFKLNDXCIIWQBO-QCPUYCGNSA-N	0	3	322.474	2.273	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CCC[C@H]1C1CCC1	ZINC000247495802	145139156	/nfs/dbraw/zinc/13/91/56/145139156.db2.gz	MPPKZDVICNDKQN-HOTGVXAUSA-N	0	3	309.454	2.071	10	0		DEAEHN
CCCC(=O)N1CCCC[C@@H]1C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000247556279	145140735	/nfs/dbraw/zinc/14/07/35/145140735.db2.gz	ZFGWZLRMVAEONE-ARFHVFGLSA-N	0	3	323.481	2.109	10	0		DEAEHN
C[C@H](C(=O)NC1CCCCC1)N1CC[C@@]2(O)CCCC[C@@H]2C1	ZINC000247968047	145145284	/nfs/dbraw/zinc/14/52/84/145145284.db2.gz	IJGPTBQBQJJMQV-RKVPGOIHSA-N	0	3	308.466	2.451	10	0		DEAEHN
Cc1cc(-c2noc(CN3CCN4CCC[C@H]4C3)n2)ccc1F	ZINC000247956247	145145533	/nfs/dbraw/zinc/14/55/33/145145533.db2.gz	FPJSIPPBFMTMQT-AWEZNQCLSA-N	0	3	316.380	2.464	10	0		DEAEHN
CN1CC[C@H](NC(=O)CC2CCOCC2)[C@H]1c1ccccc1	ZINC000248048978	145147945	/nfs/dbraw/zinc/14/79/45/145147945.db2.gz	NKLXNNOBJQXNHL-FUHWJXTLSA-N	0	3	302.418	2.365	10	0		DEAEHN
CC[C@H]1CN(C[C@@H](O)CCc2ccccc2)CCN1CCOC	ZINC000248581081	145159267	/nfs/dbraw/zinc/15/92/67/145159267.db2.gz	OTLTVZWOJRZHPF-OALUTQOASA-N	0	3	320.477	2.023	10	0		DEAEHN
CCSCc1cc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)no1	ZINC000248567749	145159642	/nfs/dbraw/zinc/15/96/42/145159642.db2.gz	JWNBECQEXRELDZ-NEPJUHHUSA-N	0	3	309.435	2.236	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC[C@H]1c1c(C)nn(C)c1C	ZINC000248641110	145162746	/nfs/dbraw/zinc/16/27/46/145162746.db2.gz	CIXMKQYUSZUPNQ-CVEARBPZSA-N	0	3	309.454	2.351	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@H](C)c1nc(C)cc(=O)[nH]1	ZINC000248759101	145166821	/nfs/dbraw/zinc/16/68/21/145166821.db2.gz	QHYMBOCNBBKZJC-OCCSQVGLSA-N	0	3	301.394	2.221	10	0		DEAEHN
O=C1O[C@@H](CN2CC[C@H](Oc3cccnc3)C2)CC12CCC2	ZINC000248828688	145169299	/nfs/dbraw/zinc/16/92/99/145169299.db2.gz	HPXGJGKAUMHQLG-LSDHHAIUSA-N	0	3	302.374	2.021	10	0		DEAEHN
CCN(C[C@@H](O)COC(C)(C)C)C[C@H]1COc2ccccc2O1	ZINC000249372168	145182673	/nfs/dbraw/zinc/18/26/73/145182673.db2.gz	DCORKMQWYRVKEN-CABCVRRESA-N	0	3	323.433	2.324	10	0		DEAEHN
Cc1ccc(OCC(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1C	ZINC000252443829	145198968	/nfs/dbraw/zinc/19/89/68/145198968.db2.gz	PAWQQTHDTBZAGY-HZPDHXFCSA-N	0	3	302.418	2.377	10	0		DEAEHN
COc1ccccc1[C@@H]1CNCCN1CCOCC(F)(F)F	ZINC000261647856	145213108	/nfs/dbraw/zinc/21/31/08/145213108.db2.gz	GCJAMIISNRVVBE-ZDUSSCGKSA-N	0	3	318.339	2.220	10	0		DEAEHN
COC(=O)C(C)(C)CCN1CCNC[C@@H]1c1ccccc1OC	ZINC000261652190	145213422	/nfs/dbraw/zinc/21/34/22/145213422.db2.gz	BBYSCBDUNHEDCK-OAHLLOKOSA-N	0	3	320.433	2.231	10	0		DEAEHN
COc1cccc(CN2CCNC[C@@H]2c2cccnc2)c1OC	ZINC000261676229	145215612	/nfs/dbraw/zinc/21/56/12/145215612.db2.gz	JNOFFZVYRXKCPE-MRXNPFEDSA-N	0	3	313.401	2.245	10	0		DEAEHN
COc1ccc(CN2CCNC[C@H]2c2cccnc2)cc1OC	ZINC000261728437	145220381	/nfs/dbraw/zinc/22/03/81/145220381.db2.gz	NZCGCFLANIPUBF-INIZCTEOSA-N	0	3	313.401	2.245	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N1CC(=O)Nc1ccc2c(c1F)CCNC2	ZINC000261722319	145220618	/nfs/dbraw/zinc/22/06/18/145220618.db2.gz	LQLGKCKRCANCGX-TXEJJXNPSA-N	0	3	305.397	2.283	10	0		DEAEHN
C[C@@H]1CN(C(=O)[C@@H](N)C2CCOCC2)CC[C@H]1c1ccccc1	ZINC000261762037	145223149	/nfs/dbraw/zinc/22/31/49/145223149.db2.gz	LUGUTOBYTDINEZ-OLMNPRSZSA-N	0	3	316.445	2.393	10	0		DEAEHN
CC(=O)N1CCc2cc(NC(=O)[C@@H]3NCCCC3(C)C)ccc21	ZINC000261891281	145238470	/nfs/dbraw/zinc/23/84/70/145238470.db2.gz	NURQSYSMFWWKQE-INIZCTEOSA-N	0	3	315.417	2.312	10	0		DEAEHN
N[C@@H](C(=O)Nc1ccc(OCC(F)F)cc1)C1CCOCC1	ZINC000261901793	145239786	/nfs/dbraw/zinc/23/97/86/145239786.db2.gz	WNCUMUIUTLCRPJ-CQSZACIVSA-N	0	3	314.332	2.023	10	0		DEAEHN
COc1ccc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)c(C)c1	ZINC000261937585	145244017	/nfs/dbraw/zinc/24/40/17/145244017.db2.gz	UGIYWJVFPSREHD-QIIPPGSGSA-N	0	3	318.417	2.475	10	0		DEAEHN
C[C@H](CNC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C)c1ccccc1	ZINC000261946347	145245383	/nfs/dbraw/zinc/24/53/83/145245383.db2.gz	VRBRUMDLCUIXGC-PSFFPDNBSA-N	0	3	316.445	2.439	10	0		DEAEHN
NC1(C(=O)Nc2ncc(Cc3ccccc3)s2)CCOCC1	ZINC000261951243	145246114	/nfs/dbraw/zinc/24/61/14/145246114.db2.gz	YZGPVAYMVPLHNS-UHFFFAOYSA-N	0	3	317.414	2.180	10	0		DEAEHN
CC(=O)N[C@H](C)C1CCN(Cc2cccc3c2NCC3)CC1	ZINC000262038180	145255995	/nfs/dbraw/zinc/25/59/95/145255995.db2.gz	XXYDDVDAQCAWIS-CYBMUJFWSA-N	0	3	301.434	2.391	10	0		DEAEHN
CCc1ccc([C@@H]2CNCCN2CC(=O)Nc2ccncc2)cc1	ZINC000262164325	145266625	/nfs/dbraw/zinc/26/66/25/145266625.db2.gz	HFJLDZAGLAXZIU-SFHVURJKSA-N	0	3	324.428	2.229	10	0		DEAEHN
C[C@H](Cc1cccs1)NC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C	ZINC000262398940	145281631	/nfs/dbraw/zinc/28/16/31/145281631.db2.gz	CDPBLEOHFMRECV-ABYLEIOUSA-N	0	3	322.474	2.328	10	0		DEAEHN
Cc1ccc(O)c(NC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)c1	ZINC000262425973	145283333	/nfs/dbraw/zinc/28/33/33/145283333.db2.gz	FKGQVQCCVOYFQP-FABXCBLPSA-N	0	3	304.390	2.172	10	0		DEAEHN
CC[NH2+][C@H](C)C[N-]S(=O)(=O)c1cc(C)c(F)cc1Cl	ZINC000262429949	145283490	/nfs/dbraw/zinc/28/34/90/145283490.db2.gz	DTFHLMWLYVSGRI-SECBINFHSA-N	0	3	308.806	2.064	10	0		DEAEHN
CN(C)C(=O)c1cccc(NC(=O)[C@@H]2NCCCC2(C)C)c1	ZINC000262448637	145284224	/nfs/dbraw/zinc/28/42/24/145284224.db2.gz	HOBCSARVVGYFBD-AWEZNQCLSA-N	0	3	303.406	2.105	10	0		DEAEHN
COc1cc(-c2noc([C@@H]3C[C@@H]4CCCC[C@H]4N3)n2)ncn1	ZINC000262516603	145290090	/nfs/dbraw/zinc/29/00/90/145290090.db2.gz	NPWRDKKULXRKJY-UMNHJUIQSA-N	0	3	301.350	2.128	10	0		DEAEHN
CC(C)[C@@H](c1nc([C@H]2CNCCN2C)no1)c1ccccc1	ZINC000263174533	145333069	/nfs/dbraw/zinc/33/30/69/145333069.db2.gz	GCAAGDWKVIPXJX-HUUCEWRRSA-N	0	3	300.406	2.434	10	0		DEAEHN
COCC[C@@H](COC)NCc1cnn(Cc2ccccc2)c1	ZINC000309699741	145351162	/nfs/dbraw/zinc/35/11/62/145351162.db2.gz	ABRSJNIDOAKXAR-KRWDZBQOSA-N	0	3	303.406	2.073	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N2CCCC[C@@H]2c2cc[nH]n2)C1	ZINC000332832972	145389826	/nfs/dbraw/zinc/38/98/26/145389826.db2.gz	BIZFMIKVXIJETA-FVQBIDKESA-N	0	3	319.453	2.375	10	0		DEAEHN
CCN1CCN([C@H](C)CNC(=O)[C@@H](C)Cc2ccccc2)CC1	ZINC000358457972	147137847	/nfs/dbraw/zinc/13/78/47/147137847.db2.gz	SPXIYCMIQSJZAU-DLBZAZTESA-N	0	3	317.477	2.007	10	0		DEAEHN
C[C@H]1CCCC[C@@H]1CCNC(=O)NCCNc1ccncc1	ZINC000358626534	147168436	/nfs/dbraw/zinc/16/84/36/147168436.db2.gz	IILGQIDEYYGOQA-LSDHHAIUSA-N	0	3	304.438	2.431	10	0		DEAEHN
CCCCn1cc(CNC(=O)[C@H]2CCCN2CCC)c(C)n1	ZINC000358723514	147190770	/nfs/dbraw/zinc/19/07/70/147190770.db2.gz	WEACNRUDCPWRGM-MRXNPFEDSA-N	0	3	306.454	2.482	10	0		DEAEHN
COC(=O)[C@H](N[C@H](CN1CCCC1)c1ccccc1)C1CC1	ZINC000358810516	147210762	/nfs/dbraw/zinc/21/07/62/147210762.db2.gz	FZVCWNRIDFRULD-IAGOWNOFSA-N	0	3	302.418	2.365	10	0		DEAEHN
COC(=O)[C@@H](Nc1cccc(CN2CCC(O)CC2)c1)C1CC1	ZINC000358826779	147214105	/nfs/dbraw/zinc/21/41/05/147214105.db2.gz	YCYWWFOFQFAJFP-KRWDZBQOSA-N	0	3	318.417	2.007	10	0		DEAEHN
CC(C)Cn1cc(CNC[C@H]2CCC3(CCOCC3)[C@H]2O)cn1	ZINC000374687618	148278554	/nfs/dbraw/zinc/27/85/54/148278554.db2.gz	OTTGQLHHFRQSMA-SJORKVTESA-N	0	3	321.465	2.196	10	0		DEAEHN
O=C(NCCN1CCCC1)c1ccc(NC(=O)C2CCC2)cc1	ZINC000112256279	401734431	/nfs/dbraw/zinc/73/44/31/401734431.db2.gz	WVKOEQPNPLLKOC-UHFFFAOYSA-N	0	3	315.417	2.251	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cc(F)cc3nc[nH]c32)CCN1C	ZINC000127634877	401743384	/nfs/dbraw/zinc/74/33/84/401743384.db2.gz	NYMRPTFDUUZBKS-JQWIXIFHSA-N	0	3	304.369	2.257	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2cncc(Br)c2)C1	ZINC000126417548	401693168	/nfs/dbraw/zinc/69/31/68/401693168.db2.gz	YRJKSRIMVXBURZ-NSHDSACASA-N	0	3	313.199	2.012	10	0		DEAEHN
Cc1ccc(N2CCCN(Cc3ccc4c(c3)CCO4)CC2)nn1	ZINC000111227229	401702395	/nfs/dbraw/zinc/70/23/95/401702395.db2.gz	BHXITNYVOHQZJK-UHFFFAOYSA-N	0	3	324.428	2.432	10	0		DEAEHN
COCCN1CCC[C@@H]1CN[C@H](c1ncc[nH]1)c1ccccc1	ZINC000126673243	401703848	/nfs/dbraw/zinc/70/38/48/401703848.db2.gz	JBROTAPHLLFFGL-SJORKVTESA-N	0	3	314.433	2.200	10	0		DEAEHN
CC1CCN(CC(=O)N[C@@H](CN(C)C)c2ccccc2)CC1	ZINC000126749219	401706806	/nfs/dbraw/zinc/70/68/06/401706806.db2.gz	FOOOSEAKZIUWQQ-KRWDZBQOSA-N	0	3	303.450	2.137	10	0		DEAEHN
Cc1csc(NC(=O)CN[C@@H]2CCCC[C@@H]2n2cccn2)n1	ZINC000129106300	401798757	/nfs/dbraw/zinc/79/87/57/401798757.db2.gz	WPIXXQCZULNZCP-OLZOCXBDSA-N	0	3	319.434	2.360	10	0		DEAEHN
CCCc1nc(CN2CCN(C[C@@H](C)O)[C@H](CC)C2)cs1	ZINC000114719647	401807361	/nfs/dbraw/zinc/80/73/61/401807361.db2.gz	AZXVQWQUSHESHW-UKRRQHHQSA-N	0	3	311.495	2.373	10	0		DEAEHN
COc1ccccc1NCC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000112881651	401760809	/nfs/dbraw/zinc/76/08/09/401760809.db2.gz	CUVBJBRENNLXSS-CQSZACIVSA-N	0	3	307.438	2.200	10	0		DEAEHN
CC(C)OC(=O)CCN1CCC(C(=O)N[C@@H](C)C(C)C)CC1	ZINC000075677613	401766127	/nfs/dbraw/zinc/76/61/27/401766127.db2.gz	HAJUTTGMOITTHH-AWEZNQCLSA-N	0	3	312.454	2.201	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1c(C)noc1C1CC1	ZINC000129889663	401810795	/nfs/dbraw/zinc/81/07/95/401810795.db2.gz	GEPCQAKMOGKXIK-CYBMUJFWSA-N	0	3	322.409	2.093	10	0		DEAEHN
CCN1CCN([C@@H](C)CNC(=O)C(C)(C)c2cccs2)CC1	ZINC000115383627	401825962	/nfs/dbraw/zinc/82/59/62/401825962.db2.gz	WPVMUOFUNJHURZ-AWEZNQCLSA-N	0	3	323.506	2.168	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000115837865	401838333	/nfs/dbraw/zinc/83/83/33/401838333.db2.gz	UBXUSRFVGBSYLM-RDJZCZTQSA-N	0	3	316.449	2.001	10	0		DEAEHN
Cc1[nH]c2c(cccc2C(=O)N2CCO[C@@H](CN(C)C)C2)c1C	ZINC000116793551	401859171	/nfs/dbraw/zinc/85/91/71/401859171.db2.gz	HLSSPXYHEJRPNS-AWEZNQCLSA-N	0	3	315.417	2.187	10	0		DEAEHN
C[C@@H](C(=O)N1CCC(Cn2cccn2)CC1)N1[C@H](C)CC[C@H]1C	ZINC000131961722	401860235	/nfs/dbraw/zinc/86/02/35/401860235.db2.gz	NVFPWTRHOYJCFV-OAGGEKHMSA-N	0	3	318.465	2.383	10	0		DEAEHN
CN(C(=O)CCN1CC[C@@](O)(C(F)(F)F)C1)c1ccccc1	ZINC000135130372	401927867	/nfs/dbraw/zinc/92/78/67/401927867.db2.gz	HQDLRGZEGHMKTG-AWEZNQCLSA-N	0	3	316.323	2.039	10	0		DEAEHN
CCOCC[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000036228617	401903955	/nfs/dbraw/zinc/90/39/55/401903955.db2.gz	SPDZLMKYCVEYIY-UHFFFAOYSA-N	0	3	304.184	2.289	10	0		DEAEHN
CCCOc1ccccc1NC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000118794965	401907836	/nfs/dbraw/zinc/90/78/36/401907836.db2.gz	KMLOKUBYBOJEFZ-CQSZACIVSA-N	0	3	321.421	2.270	10	0		DEAEHN
CSCc1ccc(NC(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000118817280	401909336	/nfs/dbraw/zinc/90/93/36/401909336.db2.gz	OBJIKYGSKOIZIM-OAHLLOKOSA-N	0	3	323.462	2.344	10	0		DEAEHN
CCNC(=O)CCN1CCC[C@@H]1CC(=O)c1ccc(F)cc1	ZINC000134842890	401916816	/nfs/dbraw/zinc/91/68/16/401916816.db2.gz	WZUATXUSJIBJSS-OAHLLOKOSA-N	0	3	306.381	2.389	10	0		DEAEHN
CN(C)c1nc(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)ns1	ZINC000134895546	401918773	/nfs/dbraw/zinc/91/87/73/401918773.db2.gz	MJZPZFFDZCIDJJ-TZMCWYRMSA-N	0	3	321.494	2.053	10	0		DEAEHN
Cc1nnc(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)n1C1CC1	ZINC000134916273	401919670	/nfs/dbraw/zinc/91/96/70/401919670.db2.gz	CJGVWAAIYGSJNS-PBHICJAKSA-N	0	3	315.465	2.370	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@H](C)N[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000119488852	401953871	/nfs/dbraw/zinc/95/38/71/401953871.db2.gz	SEVUWSVEUUVOKI-IHRRRGAJSA-N	0	3	315.421	2.221	10	0		DEAEHN
Cc1nccn1-c1ccc([C@@H](C)N[C@@H](C)CS(C)(=O)=O)cc1	ZINC000089633102	401954803	/nfs/dbraw/zinc/95/48/03/401954803.db2.gz	RHTMOVXOFDGJAB-QWHCGFSZSA-N	0	3	321.446	2.264	10	0		DEAEHN
C[C@@H]1CC[C@@H](CC(=O)N2CCCC[C@H](N3CCN(C)CC3)C2)C1	ZINC000150823380	401997897	/nfs/dbraw/zinc/99/78/97/401997897.db2.gz	FRYQCIMYNAWYRT-KURKYZTESA-N	0	3	321.509	2.441	10	0		DEAEHN
CCCCOC(=O)CCN1CC[C@@H]2[C@H](CCC(=O)N2C2CC2)C1	ZINC000119756209	401965886	/nfs/dbraw/zinc/96/58/86/401965886.db2.gz	XXDNVZPVJGLYHG-GDBMZVCRSA-N	0	3	322.449	2.195	10	0		DEAEHN
Cn1ccnc1C[C@H]1CCCN(CC(=O)NCCC(C)(C)C)C1	ZINC000090003974	401977996	/nfs/dbraw/zinc/97/79/96/401977996.db2.gz	IFYCTVPOQRXUFY-OAHLLOKOSA-N	0	3	320.481	2.227	10	0		DEAEHN
O=C(NCCC1=CCCCC1)NC[C@H](O)CN1CCCCC1	ZINC000049172387	402013498	/nfs/dbraw/zinc/01/34/98/402013498.db2.gz	NLOJRHKTGMCXMN-INIZCTEOSA-N	0	3	309.454	2.023	10	0		DEAEHN
CC(C)CNC(=O)[C@@H](C)N[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000121103729	402015041	/nfs/dbraw/zinc/01/50/41/402015041.db2.gz	XJGWTROBYBEBBG-ZIAGYGMSSA-N	0	3	315.421	2.079	10	0		DEAEHN
CCCCCNC(=O)CN1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000151114079	402016916	/nfs/dbraw/zinc/01/69/16/402016916.db2.gz	SHXFYIZSDHQYKD-INIZCTEOSA-N	0	3	318.465	2.430	10	0		DEAEHN
COC(=O)C(C)(C)CN[C@@H](C)C(=O)N[C@@H](C)c1ccccc1	ZINC000151802400	402057505	/nfs/dbraw/zinc/05/75/05/402057505.db2.gz	HQZCJKNUHOTBSE-STQMWFEESA-N	0	3	306.406	2.041	10	0		DEAEHN
CC[N@@H+]1CC[C@H](N(C)C(=O)c2cc(OC)ccc2[O-])[C@H](C)C1	ZINC000122293393	402070424	/nfs/dbraw/zinc/07/04/24/402070424.db2.gz	NRGIMLIIYAMLJE-DOMZBBRYSA-N	0	3	306.406	2.203	10	0		DEAEHN
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(OC)ccc2[O-])[C@H](C)C1	ZINC000122293393	402070427	/nfs/dbraw/zinc/07/04/27/402070427.db2.gz	NRGIMLIIYAMLJE-DOMZBBRYSA-N	0	3	306.406	2.203	10	0		DEAEHN
CCN1CC[C@@H](N(C)C(=O)c2cc(C(C)=O)cn2C)[C@H](C)C1	ZINC000122346408	402074063	/nfs/dbraw/zinc/07/40/63/402074063.db2.gz	ZWHMWZNEVWNQBI-IUODEOHRSA-N	0	3	305.422	2.030	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N(C)CCc1nccs1	ZINC000122437242	402078508	/nfs/dbraw/zinc/07/85/08/402078508.db2.gz	JRIAMAYBTLCTFI-CYBMUJFWSA-N	0	3	312.483	2.303	10	0		DEAEHN
CC(=O)c1cccc(OCC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000123131634	402112145	/nfs/dbraw/zinc/11/21/45/402112145.db2.gz	ZUGDTIGDQPWBFP-XJKSGUPXSA-N	0	3	318.417	2.209	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2ccc(-n3cccn3)cc2)CCN1C	ZINC000123377052	402124488	/nfs/dbraw/zinc/12/44/88/402124488.db2.gz	BXWZQBCIMPADEH-RHSMWYFYSA-N	0	3	312.417	2.427	10	0		DEAEHN
Cc1ccc([C@@H]2CCCCN2CCC(=O)N2CCOCC2)o1	ZINC000124601662	402187360	/nfs/dbraw/zinc/18/73/60/402187360.db2.gz	ZQWORRBCPGIAHX-HNNXBMFYSA-N	0	3	306.406	2.364	10	0		DEAEHN
COC[C@H](C)C(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1	ZINC000103432741	402187831	/nfs/dbraw/zinc/18/78/31/402187831.db2.gz	OMAOYFXLIYWQIR-LBPRGKRZSA-N	0	3	314.376	2.138	10	0		DEAEHN
COC[C@@H](C)C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000103433017	402188204	/nfs/dbraw/zinc/18/82/04/402188204.db2.gz	YBRYMRXRNQGFER-KGLIPLIRSA-N	0	3	310.463	2.359	10	0		DEAEHN
CCN(CC)C(=O)[C@@H]1CCCN1CCCOCC(F)(F)F	ZINC000067652863	402166652	/nfs/dbraw/zinc/16/66/52/402166652.db2.gz	LKXBCUAICOIAIW-LBPRGKRZSA-N	0	3	310.360	2.288	10	0		DEAEHN
CC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000124273737	402171769	/nfs/dbraw/zinc/17/17/69/402171769.db2.gz	GAMRRTRACOJABQ-BLLLJJGKSA-N	0	3	303.406	2.200	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC(c2nncn2C2CC2)CC1)N(C)C	ZINC000153822272	402172349	/nfs/dbraw/zinc/17/23/49/402172349.db2.gz	XYYHQICFRXCVLM-OAHLLOKOSA-N	0	3	319.453	2.049	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@](C)(c2ccccc2)C1)N(C)C	ZINC000154567244	402218997	/nfs/dbraw/zinc/21/89/97/402218997.db2.gz	VJABEEXVDGZRCS-WMZOPIPTSA-N	0	3	304.434	2.491	10	0		DEAEHN
CC[C@@H](C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1)N(C)C	ZINC000125258222	402222207	/nfs/dbraw/zinc/22/22/07/402222207.db2.gz	XILYEFQGIKVGNL-PBHICJAKSA-N	0	3	319.449	2.120	10	0		DEAEHN
CCC(CC)(CC)CNC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000154719588	402227656	/nfs/dbraw/zinc/22/76/56/402227656.db2.gz	JZNWJDVLBXVMRW-OAHLLOKOSA-N	0	3	313.486	2.349	10	0		DEAEHN
C[C@@H](Cc1ccccc1Cl)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000155121442	402245621	/nfs/dbraw/zinc/24/56/21/402245621.db2.gz	RLAUWPMUZJQNTA-ZFWWWQNUSA-N	0	3	324.852	2.308	10	0		DEAEHN
COc1ccc2nc(C(=O)NC[C@@H]3CCCN(C)C3)ccc2c1	ZINC000108326786	402249563	/nfs/dbraw/zinc/24/95/63/402249563.db2.gz	XCONCKMQRVATRN-ZDUSSCGKSA-N	0	3	313.401	2.315	10	0		DEAEHN
CC[C@@H](C(=O)NCCc1coc(-c2ccc(F)cc2)n1)N(C)C	ZINC000125058143	402210946	/nfs/dbraw/zinc/21/09/46/402210946.db2.gz	RSRMKIRDYRHBKG-HNNXBMFYSA-N	0	3	319.380	2.480	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@](C)(O)c1cccc(Cl)c1)N(C)C	ZINC000185076620	402322727	/nfs/dbraw/zinc/32/27/27/402322727.db2.gz	SFSSFRQIMCKLDQ-GOEBONIOSA-N	0	3	312.841	2.394	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1ccc2[nH]ccc2c1	ZINC000110091839	402281408	/nfs/dbraw/zinc/28/14/08/402281408.db2.gz	JRLNTHLLTMOSJB-HNNXBMFYSA-N	0	3	316.405	2.400	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1	ZINC000157122528	402292255	/nfs/dbraw/zinc/29/22/55/402292255.db2.gz	GPWUXMORYVIOIU-RDJZCZTQSA-N	0	3	315.417	2.201	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@](C)(O)[C@@H](C)c2ccccc2)C1	ZINC000176235541	402293252	/nfs/dbraw/zinc/29/32/52/402293252.db2.gz	IRTSBQYLCAWBGW-QILLFSRXSA-N	0	3	304.434	2.142	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)CCc2nc3c(cccc3C)[nH]2)C1	ZINC000176267005	402295811	/nfs/dbraw/zinc/29/58/11/402295811.db2.gz	CDOABUVCHHXKOE-CQSZACIVSA-N	0	3	314.433	2.404	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)CCc2nc3cccc(C)c3[nH]2)C1	ZINC000176267005	402295812	/nfs/dbraw/zinc/29/58/12/402295812.db2.gz	CDOABUVCHHXKOE-CQSZACIVSA-N	0	3	314.433	2.404	10	0		DEAEHN
C[C@H](CNC(=O)NCCc1cc(F)ccc1F)N(C)C1CC1	ZINC000176329921	402299944	/nfs/dbraw/zinc/29/99/44/402299944.db2.gz	MOPLTOWKOWBYQU-LLVKDONJSA-N	0	3	311.376	2.289	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)N2CC[C@@H](N3CCCC3)C2)s1	ZINC000176399488	402305991	/nfs/dbraw/zinc/30/59/91/402305991.db2.gz	RVQLLBSVIKZWCX-CHWSQXEVSA-N	0	3	323.462	2.469	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2scnc2C2CCCC2)CCO1	ZINC000184898332	402307221	/nfs/dbraw/zinc/30/72/21/402307221.db2.gz	BRYMJHWXQPGXNI-CYBMUJFWSA-N	0	3	323.462	2.203	10	0		DEAEHN
O=C(NCCc1cc(F)ccc1F)N1CCCN(C2CC2)CC1	ZINC000176460654	402311606	/nfs/dbraw/zinc/31/16/06/402311606.db2.gz	AUVBCJRFNRHERM-UHFFFAOYSA-N	0	3	323.387	2.387	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)C1	ZINC000184949789	402312080	/nfs/dbraw/zinc/31/20/80/402312080.db2.gz	SNNYFJPHLWEOKD-UTUOFQBUSA-N	0	3	312.335	2.370	10	0		DEAEHN
CC[C@H](O)[C@H]1CCCCN1Cc1cc(-c2cnn(C)c2)no1	ZINC000185008043	402316948	/nfs/dbraw/zinc/31/69/48/402316948.db2.gz	LUOJZFPDHTXDSF-CVEARBPZSA-N	0	3	304.394	2.201	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1cccc(C)c1C	ZINC000176905158	402348921	/nfs/dbraw/zinc/34/89/21/402348921.db2.gz	LYZUXEDVVAWHJQ-OAHLLOKOSA-N	0	3	317.433	2.185	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(=O)[nH]c2ccccc21	ZINC000176974705	402355849	/nfs/dbraw/zinc/35/58/49/402355849.db2.gz	TUSKASDXCFMXHK-ZDUSSCGKSA-N	0	3	313.401	2.497	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1ccc(Cl)cc1	ZINC000177004888	402358795	/nfs/dbraw/zinc/35/87/95/402358795.db2.gz	NNWYOGIJTXQPRM-AWEZNQCLSA-N	0	3	323.824	2.221	10	0		DEAEHN
CCC1CCC(NC(=O)N[C@@H](C)CCN2CCN(C)CC2)CC1	ZINC000185569346	402361953	/nfs/dbraw/zinc/36/19/53/402361953.db2.gz	GYZZMNAVWVMHSC-GTPINHCMSA-N	0	3	324.513	2.280	10	0		DEAEHN
CC(C)[C@@H](C)CC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000176674902	402327821	/nfs/dbraw/zinc/32/78/21/402327821.db2.gz	SEWWSQUYAUVKTR-DLBZAZTESA-N	0	3	309.498	2.297	10	0		DEAEHN
O=C(c1c([O-])cnc2ccccc21)N1CCC[N@@H+](C2CC2)CC1	ZINC000176724219	402331120	/nfs/dbraw/zinc/33/11/20/402331120.db2.gz	HFFKHVOJCHFWFW-UHFFFAOYSA-N	0	3	311.385	2.251	10	0		DEAEHN
O=C(c1c([O-])cnc2ccccc21)N1CCC[N@H+](C2CC2)CC1	ZINC000176724219	402331123	/nfs/dbraw/zinc/33/11/23/402331123.db2.gz	HFFKHVOJCHFWFW-UHFFFAOYSA-N	0	3	311.385	2.251	10	0		DEAEHN
O=C(c1c(O)cnc2ccccc21)N1CCCN(C2CC2)CC1	ZINC000176724219	402331127	/nfs/dbraw/zinc/33/11/27/402331127.db2.gz	HFFKHVOJCHFWFW-UHFFFAOYSA-N	0	3	311.385	2.251	10	0		DEAEHN
CCOCCN1CCN(CCCCn2ccnc2C)C[C@@H]1C	ZINC000161676704	402395229	/nfs/dbraw/zinc/39/52/29/402395229.db2.gz	BFIVQIRVEMEMKJ-INIZCTEOSA-N	0	3	308.470	2.014	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC[C@@H]1Cn1ccnc1	ZINC000177413136	402400040	/nfs/dbraw/zinc/40/00/40/402400040.db2.gz	ZQJAFDAVLVCHLC-JKSUJKDBSA-N	0	3	321.469	2.033	10	0		DEAEHN
CCC(=O)N(C)CC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000177467920	402406251	/nfs/dbraw/zinc/40/62/51/402406251.db2.gz	NYYQFWVHGXYKGT-KRWDZBQOSA-N	0	3	304.434	2.300	10	0		DEAEHN
C[C@H](NC(=O)[C@@H](CN)c1ccccc1)c1ccc2c(c1)OCO2	ZINC000237427785	402407840	/nfs/dbraw/zinc/40/78/40/402407840.db2.gz	AZWYPFBWMQNGAP-WFASDCNBSA-N	0	3	312.369	2.335	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCCCn1ccnc1C	ZINC000177545091	402414644	/nfs/dbraw/zinc/41/46/44/402414644.db2.gz	BYKZZNSUFXHSSJ-MRXNPFEDSA-N	0	3	321.469	2.097	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2ccc(CO)c(F)c2)C12CCOCC2	ZINC000186271098	402416790	/nfs/dbraw/zinc/41/67/90/402416790.db2.gz	RLBWPRKMADAWOD-DLBZAZTESA-N	0	3	323.408	2.382	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N[C@@H](C)c2cn(C)nc2C)C12CCOCC2	ZINC000186319610	402421231	/nfs/dbraw/zinc/42/12/31/402421231.db2.gz	UTLRUBNYHOLKCU-APHBMKBZSA-N	0	3	307.438	2.353	10	0		DEAEHN
COCCC1(CNC(=O)NC[C@@H]2CCCN2C)CCCCC1	ZINC000186333426	402421986	/nfs/dbraw/zinc/42/19/86/402421986.db2.gz	VRXNSJBUYNPHMN-HNNXBMFYSA-N	0	3	311.470	2.367	10	0		DEAEHN
CCC[C@@H](C(=O)NCCCOc1cccc(OC)c1)N(C)C	ZINC000162572956	402424917	/nfs/dbraw/zinc/42/49/17/402424917.db2.gz	ZHTWYPGPHQDAEC-INIZCTEOSA-N	0	3	308.422	2.311	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H](C)c1ccc(NC(N)=O)cc1)N(C)C	ZINC000161578487	402392718	/nfs/dbraw/zinc/39/27/18/402392718.db2.gz	QXSYAXXEMZWLBK-SMDDNHRTSA-N	0	3	306.410	2.085	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H](C)c1ccc(NC(N)=O)cc1)N(C)C	ZINC000161578372	402392726	/nfs/dbraw/zinc/39/27/26/402392726.db2.gz	QXSYAXXEMZWLBK-FZMZJTMJSA-N	0	3	306.410	2.085	10	0		DEAEHN
CCO[C@H]1C[C@](N)(C(=O)N(C)Cc2ccc(F)cc2)C1(C)C	ZINC000186706525	402457711	/nfs/dbraw/zinc/45/77/11/402457711.db2.gz	YAGZTUKXVIVYJX-YOEHRIQHSA-N	0	3	308.397	2.317	10	0		DEAEHN
C[C@H](c1ccccc1)[C@](C)(O)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000245428250	402459839	/nfs/dbraw/zinc/45/98/39/402459839.db2.gz	WYKKYLTWMLBLQB-LFEHRJTNSA-N	0	3	318.461	2.482	10	0		DEAEHN
C[C@H](CC(=O)N1CCN2CCC[C@H]2C1)C(=O)c1cccc(F)c1	ZINC000245461220	402462602	/nfs/dbraw/zinc/46/26/02/402462602.db2.gz	MRQQRRAUCAXLJD-CJNGLKHVSA-N	0	3	318.392	2.341	10	0		DEAEHN
C[C@H](CCOc1ccccc1)C(=O)N1CCN2CCC[C@H]2C1	ZINC000245458077	402462846	/nfs/dbraw/zinc/46/28/46/402462846.db2.gz	USMARJMDVIBHDT-CVEARBPZSA-N	0	3	302.418	2.398	10	0		DEAEHN
COCC[C@@H](Cc1cccc(F)c1)N[C@@H]1CCCn2ncnc21	ZINC000164663288	402467095	/nfs/dbraw/zinc/46/70/95/402467095.db2.gz	JBATXHUNBWUTST-JKSUJKDBSA-N	0	3	318.396	2.490	10	0		DEAEHN
C[C@@H](N[C@H]1CCCN(c2ncccn2)C1)c1cncc(F)c1	ZINC000178194829	402469974	/nfs/dbraw/zinc/46/99/74/402469974.db2.gz	KZWFDTKBQYDWOG-DOMZBBRYSA-N	0	3	301.369	2.330	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCC[C@@H](C(F)(F)F)C1	ZINC000245651837	402477284	/nfs/dbraw/zinc/47/72/84/402477284.db2.gz	BZSNJWFGPVOXJU-VXGBXAGGSA-N	0	3	307.360	2.455	10	0		DEAEHN
C[C@@H]1OCCN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)[C@H]1C	ZINC000245685515	402479128	/nfs/dbraw/zinc/47/91/28/402479128.db2.gz	WDBPVGRITHZDFY-DIECFANBSA-N	0	3	317.433	2.251	10	0		DEAEHN
Cc1cnc([C@@H](C)CNC(=O)N2CCCN(C3CC3)CC2)s1	ZINC000187079796	402481573	/nfs/dbraw/zinc/48/15/73/402481573.db2.gz	PJMOXLXWKUXATE-LBPRGKRZSA-N	0	3	322.478	2.435	10	0		DEAEHN
Cc1ccc(CN2CCCC[C@@H]2CN2CCOCC2)c(C)n1	ZINC000187096140	402482769	/nfs/dbraw/zinc/48/27/69/402482769.db2.gz	BCJLJOIKNJEZEF-GOSISDBHSA-N	0	3	303.450	2.385	10	0		DEAEHN
C[C@@H]1CN(C/C=C/c2ccc(F)cc2)C[C@H]1N1CCOCC1	ZINC000245749911	402485534	/nfs/dbraw/zinc/48/55/34/402485534.db2.gz	NPFRMSZNGHEVIQ-YPXCQQABSA-N	0	3	304.409	2.491	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)N[C@@H]1CCC[C@@H]2OCC[C@H]21	ZINC000245748387	402485797	/nfs/dbraw/zinc/48/57/97/402485797.db2.gz	AMJFGYXVTPPNLM-QXSJWSMHSA-N	0	3	309.454	2.118	10	0		DEAEHN
CN(Cc1ccccc1)C(=O)CN[C@@H]1[C@H]2CCCO[C@H]2C1(C)C	ZINC000245884217	402494245	/nfs/dbraw/zinc/49/42/45/402494245.db2.gz	LGJPQAZXFHGTFJ-KBAYOESNSA-N	0	3	316.445	2.438	10	0		DEAEHN
Cc1n[nH]c(C)c1CC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245910828	402497114	/nfs/dbraw/zinc/49/71/14/402497114.db2.gz	REJHLSDBVVVYJV-WMZOPIPTSA-N	0	3	312.417	2.131	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCc2cccc(F)c2)C1	ZINC000245934218	402499023	/nfs/dbraw/zinc/49/90/23/402499023.db2.gz	IRYFPNHPILAVEG-GOEBONIOSA-N	0	3	305.397	2.451	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)[C@H]1C[C@@H]1c1sccc1C	ZINC000245959683	402500872	/nfs/dbraw/zinc/50/08/72/402500872.db2.gz	RVJGSAMXSKMGQO-ILXRZTDVSA-N	0	3	322.474	2.387	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)N1CC[C@H](N2CCCC2)C1	ZINC000187476369	402502314	/nfs/dbraw/zinc/50/23/14/402502314.db2.gz	CCKVIUMLLUCFPN-KGLIPLIRSA-N	0	3	318.421	2.031	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)N(CCN(C)C)C(C)C	ZINC000187496733	402502617	/nfs/dbraw/zinc/50/26/17/402502617.db2.gz	WINCJRKGJVIXJS-CYBMUJFWSA-N	0	3	308.426	2.133	10	0		DEAEHN
Cc1c(O)ccc2c(CN(C)C[C@H]3CCCO3)cc(=O)oc12	ZINC000170688120	402514180	/nfs/dbraw/zinc/51/41/80/402514180.db2.gz	YXJJSAQRYSNVRQ-CYBMUJFWSA-N	0	3	303.358	2.418	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NC[C@H](CCO)CC(C)C	ZINC000246734047	402542517	/nfs/dbraw/zinc/54/25/17/402542517.db2.gz	XUGCIDRHJSLFME-HZPDHXFCSA-N	0	3	313.486	2.157	10	0		DEAEHN
CC(C)CN1CCC[C@@H]1CNS(=O)(=O)CC1CCCC1	ZINC000178816676	402543460	/nfs/dbraw/zinc/54/34/60/402543460.db2.gz	SDGUXFHIOKGJEY-OAHLLOKOSA-N	0	3	302.484	2.216	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2cc(-c3ccncc3)on2)C1	ZINC000246827142	402545993	/nfs/dbraw/zinc/54/59/93/402545993.db2.gz	DQQZYWCEVRYIIM-SWLSCSKDSA-N	0	3	314.389	2.195	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)[C@H](Cc1ccccc1)N(C)C	ZINC000246961062	402550926	/nfs/dbraw/zinc/55/09/26/402550926.db2.gz	BQVHZRMLNLMZTC-WMZOPIPTSA-N	0	3	317.477	2.150	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cnn(Cc2ccccc2)c1	ZINC000247158012	402558912	/nfs/dbraw/zinc/55/89/12/402558912.db2.gz	KGTXFJUMULAJRC-QAPCUYQASA-N	0	3	324.428	2.240	10	0		DEAEHN
Cc1cc(C)cc(OC[C@@H](O)CN2CCN3CCCC[C@@H]3C2)c1	ZINC000178973083	402560621	/nfs/dbraw/zinc/56/06/21/402560621.db2.gz	SMQLJNPDELQLPY-MSOLQXFVSA-N	0	3	318.461	2.213	10	0		DEAEHN
C[C@H](Oc1cccc(F)c1)C(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000247520359	402570665	/nfs/dbraw/zinc/57/06/65/402570665.db2.gz	WQQWLVYMBRPNJE-IPYPFGDCSA-N	0	3	306.381	2.288	10	0		DEAEHN
CC(C)(CNC(=O)c1cn2ccnc2s1)N1CCCCC1	ZINC000188217681	402517678	/nfs/dbraw/zinc/51/76/78/402517678.db2.gz	SKLDWGKEZWYNGA-UHFFFAOYSA-N	0	3	306.435	2.390	10	0		DEAEHN
CCOC(=O)CCN1C[C@H](C(=O)OC)C[C@@H](c2ccccc2)C1	ZINC000246196087	402517881	/nfs/dbraw/zinc/51/78/81/402517881.db2.gz	AGOVXMGEGTXHKW-HZPDHXFCSA-N	0	3	319.401	2.218	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccc(Cl)cc1)N1CCN2CCC[C@@H]2C1	ZINC000178623942	402519206	/nfs/dbraw/zinc/51/92/06/402519206.db2.gz	PGBCQMKWMZUGGJ-SWLSCSKDSA-N	0	3	307.825	2.447	10	0		DEAEHN
CN(Cc1ccccc1C(F)(F)F)C(=O)[C@H]1C[C@H](F)CN1	ZINC000188307543	402519520	/nfs/dbraw/zinc/51/95/20/402519520.db2.gz	IUKHKPLFEAUNKH-CMPLNLGQSA-N	0	3	304.287	2.364	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)c2cccc(F)c2)[C@@H](C)C1	ZINC000246243484	402519797	/nfs/dbraw/zinc/51/97/97/402519797.db2.gz	RYOLLJHINLBBSO-SWLSCSKDSA-N	0	3	314.426	2.177	10	0		DEAEHN
C[C@H](CNC(=O)NCCCc1ccccn1)N1CCC[C@H](C)C1	ZINC000246258483	402521625	/nfs/dbraw/zinc/52/16/25/402521625.db2.gz	WPMAWNCQMFSXBS-JKSUJKDBSA-N	0	3	318.465	2.434	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@H](C)NC(=O)CC(C)(C)C	ZINC000188619080	402522009	/nfs/dbraw/zinc/52/20/09/402522009.db2.gz	WTLFEOLSCXUVCQ-UONOGXRCSA-N	0	3	313.486	2.020	10	0		DEAEHN
CN(C)CCN(Cc1ccco1)C(=O)c1cn2ccnc2s1	ZINC000188642857	402522450	/nfs/dbraw/zinc/52/24/50/402522450.db2.gz	WJRQTBWUJUOMFN-UHFFFAOYSA-N	0	3	318.402	2.193	10	0		DEAEHN
CC(C)Oc1ccc(CNC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170828471	402530518	/nfs/dbraw/zinc/53/05/18/402530518.db2.gz	ZZCAPPVZFXVFBO-HNNXBMFYSA-N	0	3	305.422	2.319	10	0		DEAEHN
Cc1cccc(C)c1OC[C@@H](C)NC(=O)N1CC[C@H](N(C)C)C1	ZINC000170833978	402531141	/nfs/dbraw/zinc/53/11/41/402531141.db2.gz	FEQOYQBLXVONTP-CVEARBPZSA-N	0	3	319.449	2.416	10	0		DEAEHN
Cc1cc(C)c(CCNC(=O)N2CC[C@@H](N(C)C)C2)c(C)c1	ZINC000170831876	402531146	/nfs/dbraw/zinc/53/11/46/402531146.db2.gz	PTNJVLIZKSSKLN-MRXNPFEDSA-N	0	3	303.450	2.500	10	0		DEAEHN
CCOc1ccccc1OCCCC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170859407	402533544	/nfs/dbraw/zinc/53/35/44/402533544.db2.gz	NXTFJMRLUJPOSI-OAHLLOKOSA-N	0	3	320.433	2.407	10	0		DEAEHN
COc1ccc2cc(C(=O)N3CC[C@H](N(C)C)C3)c(C)nc2c1	ZINC000170857276	402533644	/nfs/dbraw/zinc/53/36/44/402533644.db2.gz	NLMURDMGJWFBDQ-AWEZNQCLSA-N	0	3	313.401	2.328	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)COc2ccc(F)cc2Cl)C1	ZINC000170859838	402533706	/nfs/dbraw/zinc/53/37/06/402533706.db2.gz	FABLIOOXJTZOOA-NSHDSACASA-N	0	3	300.761	2.020	10	0		DEAEHN
COc1cc(C(=O)N2CC[C@H](N(C)C)C2)ccc1OC(F)F	ZINC000170862180	402534297	/nfs/dbraw/zinc/53/42/97/402534297.db2.gz	GPVAOBUTULGHSX-NSHDSACASA-N	0	3	314.332	2.073	10	0		DEAEHN
Cc1ccc(C)c(C(=O)CCC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000170862173	402534356	/nfs/dbraw/zinc/53/43/56/402534356.db2.gz	SQIUGMAFWGAIMW-OAHLLOKOSA-N	0	3	302.418	2.429	10	0		DEAEHN
CC(C)n1cc(CN2CCC(N3CCO[C@H](C)C3)CC2)cn1	ZINC000179345707	402586500	/nfs/dbraw/zinc/58/65/00/402586500.db2.gz	XNMCEQGZHUJNPZ-OAHLLOKOSA-N	0	3	306.454	2.149	10	0		DEAEHN
O=C(NCCc1ccc(F)c(F)c1)N1CC[C@H](N2CC=CC2)C1	ZINC000190332356	402593404	/nfs/dbraw/zinc/59/34/04/402593404.db2.gz	UUVJZAZKSALPOQ-AWEZNQCLSA-N	0	3	321.371	2.163	10	0		DEAEHN
CCOCCN(C)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179569617	402595430	/nfs/dbraw/zinc/59/54/30/402595430.db2.gz	DLQGOVSQCXXLIX-HZPDHXFCSA-N	0	3	305.422	2.110	10	0		DEAEHN
CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@H]1CCCOC1	ZINC000171613306	402601389	/nfs/dbraw/zinc/60/13/89/402601389.db2.gz	BVCREKNDFWFDES-INIZCTEOSA-N	0	3	323.412	2.078	10	0		DEAEHN
CSCCN(C)C[C@H](c1cccs1)N1CCOCC1	ZINC000171632661	402603879	/nfs/dbraw/zinc/60/38/79/402603879.db2.gz	CHIUNBJJACUHAM-CYBMUJFWSA-N	0	3	300.493	2.416	10	0		DEAEHN
COCCCCC(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190578884	402610891	/nfs/dbraw/zinc/61/08/91/402610891.db2.gz	QNNKGCTXPKUQEY-KRWDZBQOSA-N	0	3	319.449	2.179	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CCOC[C@@H]1C	ZINC000248867535	402612416	/nfs/dbraw/zinc/61/24/16/402612416.db2.gz	NQUFVBNRHQSOBF-FZCLSBEQSA-N	0	3	316.445	2.296	10	0		DEAEHN
CC[C@@H](C)OCC(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190620843	402614130	/nfs/dbraw/zinc/61/41/30/402614130.db2.gz	DRBKPWKLSLFEEB-NVXWUHKLSA-N	0	3	319.449	2.177	10	0		DEAEHN
C[C@H](OCc1ccccc1)C(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000249056365	402619150	/nfs/dbraw/zinc/61/91/50/402619150.db2.gz	XRMVYFMNERKIHI-ZOBUZTSGSA-N	0	3	302.418	2.287	10	0		DEAEHN
Cc1nc(-c2cccc(NC(=O)N3CCCN(C)CC3)c2)no1	ZINC000180659584	402622458	/nfs/dbraw/zinc/62/24/58/402622458.db2.gz	CPVBEYBTAPTCNB-UHFFFAOYSA-N	0	3	315.377	2.214	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1F	ZINC000249219573	402623564	/nfs/dbraw/zinc/62/35/64/402623564.db2.gz	UGMWBGUJTLVFEV-QWHCGFSZSA-N	0	3	321.396	2.014	10	0		DEAEHN
CCc1cccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000249218342	402623634	/nfs/dbraw/zinc/62/36/34/402623634.db2.gz	UBCMZBQFAKSPMN-XJKSGUPXSA-N	0	3	317.433	2.129	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(C)c1	ZINC000249266198	402624278	/nfs/dbraw/zinc/62/42/78/402624278.db2.gz	ZMOAZKBNUSMWSC-LSDHHAIUSA-N	0	3	317.433	2.183	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)N(C)C	ZINC000247855783	402576906	/nfs/dbraw/zinc/57/69/06/402576906.db2.gz	XZKPBOPYTUYKHC-BBWFWOEESA-N	0	3	303.450	2.278	10	0		DEAEHN
CCc1ccccc1S(=O)(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000249489243	402631246	/nfs/dbraw/zinc/63/12/46/402631246.db2.gz	XYCIQFDAZNWPCX-HIFRSBDPSA-N	0	3	310.463	2.256	10	0		DEAEHN
CC(C)N(C)C(=O)[C@@H](C)N1C[C@@H](c2ccsc2)[C@H](CO)C1	ZINC000249587617	402635531	/nfs/dbraw/zinc/63/55/31/402635531.db2.gz	UJFLQKKOOHDEGL-SNPRPXQTSA-N	0	3	310.463	2.011	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@H](c2cccs2)N(C)C)C1	ZINC000249611342	402636861	/nfs/dbraw/zinc/63/68/61/402636861.db2.gz	LAWVYGARWPNGLL-ZIAGYGMSSA-N	0	3	324.494	2.134	10	0		DEAEHN
C(c1nnc(C2CC2)n1C1CC1)N1CCCN(C2CC2)CC1	ZINC000181187855	402637648	/nfs/dbraw/zinc/63/76/48/402637648.db2.gz	UNBVXGARWWBMMO-UHFFFAOYSA-N	0	3	301.438	2.161	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(C)c1ccc(F)cc1	ZINC000171908354	402633361	/nfs/dbraw/zinc/63/33/61/402633361.db2.gz	RVVGQZMYPKYYGT-HNNXBMFYSA-N	0	3	309.385	2.082	10	0		DEAEHN
C[C@H](Cc1ccc(O)cc1)NC(=O)NCCN1CCCC[C@@H]1C	ZINC000249789654	402641868	/nfs/dbraw/zinc/64/18/68/402641868.db2.gz	UCTZZJWVQTYUSB-CABCVRRESA-N	0	3	319.449	2.497	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@@H](OC)c2ccccc2)C1	ZINC000249773343	402641933	/nfs/dbraw/zinc/64/19/33/402641933.db2.gz	UXMUHMBIUWLBOW-HZPDHXFCSA-N	0	3	305.422	2.158	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)C1CCN(CCc2cccnc2)CC1	ZINC000172158558	402642810	/nfs/dbraw/zinc/64/28/10/402642810.db2.gz	TYWRZAVGFWTVNL-OAHLLOKOSA-N	0	3	303.450	2.497	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NC[C@H](c2ccco2)N(C)C)CCN1C	ZINC000252537987	402658453	/nfs/dbraw/zinc/65/84/53/402658453.db2.gz	BWXKWESOHQCYLS-QLFBSQMISA-N	0	3	322.453	2.006	10	0		DEAEHN
O=C(CN1C[C@@H]2CCCC[C@@H]2C1)N1CCO[C@H]2CCCC[C@H]21	ZINC000252643223	402659742	/nfs/dbraw/zinc/65/97/42/402659742.db2.gz	JNVRRYVTVVYKAP-TWMKSMIVSA-N	0	3	306.450	2.278	10	0		DEAEHN
Cc1c(-c2cc(CN3[C@@H](C)CC(O)C[C@@H]3C)on2)cnn1C	ZINC000191170042	402647479	/nfs/dbraw/zinc/64/74/79/402647479.db2.gz	KKWNGLDFLIKSTO-QWRGUYRKSA-N	0	3	304.394	2.117	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NC[C@H](O)CC(C)(C)C	ZINC000172326694	402650318	/nfs/dbraw/zinc/65/03/18/402650318.db2.gz	FFFGZHHRPJKYQN-ZIAGYGMSSA-N	0	3	301.475	2.059	10	0		DEAEHN
COc1ccc(NC(=O)[C@H](C)N2CCCN(C3CC3)CC2)cc1	ZINC000172345965	402651240	/nfs/dbraw/zinc/65/12/40/402651240.db2.gz	BOWAGLYQBVJSFZ-AWEZNQCLSA-N	0	3	317.433	2.192	10	0		DEAEHN
Cc1nc(NC(=O)[C@@H](C)N2CCCN(C3CC3)CC2)sc1C	ZINC000172348059	402651693	/nfs/dbraw/zinc/65/16/93/402651693.db2.gz	KMXXPOQWDNEAGI-GFCCVEGCSA-N	0	3	322.478	2.257	10	0		DEAEHN
CC[C@]1(CO)CCCN1CC(=O)N1CCC[C@@H](C(F)(F)F)C1	ZINC000252003235	402652142	/nfs/dbraw/zinc/65/21/42/402652142.db2.gz	WTUJWTALHAQUKV-TZMCWYRMSA-N	0	3	322.371	2.024	10	0		DEAEHN
Cc1cccc(C)c1OCCCN1CC[C@@H](N2CCOCC2)C1	ZINC000173950963	402721085	/nfs/dbraw/zinc/72/10/85/402721085.db2.gz	DSFZUCUDRSCZQW-GOSISDBHSA-N	0	3	318.461	2.479	10	0		DEAEHN
Cc1ccc(OCCCN2CC[C@@H](N3CCOCC3)C2)cc1C	ZINC000173949147	402721357	/nfs/dbraw/zinc/72/13/57/402721357.db2.gz	PWTCWEAQKXDBDY-GOSISDBHSA-N	0	3	318.461	2.479	10	0		DEAEHN
CCOc1ncccc1CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000173779867	402712571	/nfs/dbraw/zinc/71/25/71/402712571.db2.gz	AGNWKLBWFRILHJ-UKRRQHHQSA-N	0	3	320.437	2.104	10	0		DEAEHN
C[C@@H](C(=O)NCC1CCCCC1)N1CCCN(C2CC2)CC1	ZINC000172541835	402661399	/nfs/dbraw/zinc/66/13/99/402661399.db2.gz	KEVYPTRYNIEBFL-HNNXBMFYSA-N	0	3	307.482	2.242	10	0		DEAEHN
CN(C)CCN(CC1CCCCC1)C(=O)N[C@@H]1CCCOC1	ZINC000172584711	402664552	/nfs/dbraw/zinc/66/45/52/402664552.db2.gz	OMBUYLIETDDJSB-MRXNPFEDSA-N	0	3	311.470	2.319	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cc3ccccc3[nH]c2=O)CCN1C	ZINC000172995225	402681936	/nfs/dbraw/zinc/68/19/36/402681936.db2.gz	YHQUGBQSEGAYIW-OCCSQVGLSA-N	0	3	313.401	2.083	10	0		DEAEHN
C[C@@H]1COCC[C@H]1N[C@@H]1CCCN(c2ccccc2F)C1=O	ZINC000191691982	402686517	/nfs/dbraw/zinc/68/65/17/402686517.db2.gz	DZHKDXXZUXURLW-BPLDGKMQSA-N	0	3	306.381	2.336	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(C(=O)C3CCCCC3)C2)CC1	ZINC000173275963	402690567	/nfs/dbraw/zinc/69/05/67/402690567.db2.gz	WTZGPRAZLJYUBH-QGZVFWFLSA-N	0	3	307.482	2.195	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)S(=O)(=O)CC2CCCCC2)CCN1C	ZINC000173276827	402690903	/nfs/dbraw/zinc/69/09/03/402690903.db2.gz	KTICVGNZJXQAOL-ZFWWWQNUSA-N	0	3	302.484	2.311	10	0		DEAEHN
COc1ccc(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1O	ZINC000174072242	402725851	/nfs/dbraw/zinc/72/58/51/402725851.db2.gz	KYBGYKBBGMPANU-OCCSQVGLSA-N	0	3	321.421	2.025	10	0		DEAEHN
CC[C@@H](O)CN1CCN(CCCOc2cc(C)cc(C)c2)CC1	ZINC000174089305	402726316	/nfs/dbraw/zinc/72/63/16/402726316.db2.gz	OTFVFYATIUFOQZ-GOSISDBHSA-N	0	3	320.477	2.461	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](C)CCc2cccn2C)C1	ZINC000174238038	402733240	/nfs/dbraw/zinc/73/32/40/402733240.db2.gz	QYRGXKCITCBTKR-GJZGRUSLSA-N	0	3	306.454	2.130	10	0		DEAEHN
Cc1c([O-])ccc2c(C[NH2+][C@@H](C)[C@@H]3CCCO3)cc(=O)oc12	ZINC000183140563	402742539	/nfs/dbraw/zinc/74/25/39/402742539.db2.gz	KJDJGOWVZWKGDK-NHYWBVRUSA-N	0	3	303.358	2.464	10	0		DEAEHN
C[C@@H](N[C@@H](C)C(=O)NC(=O)Nc1ccccc1F)[C@@H]1CCCO1	ZINC000183142807	402742609	/nfs/dbraw/zinc/74/26/09/402742609.db2.gz	RUIPODJCICPMRU-SUNKGSAMSA-N	0	3	323.368	2.019	10	0		DEAEHN
COc1ccc(Cl)cc1NC(=O)CN[C@H](C)[C@@H]1CCCO1	ZINC000183152642	402743562	/nfs/dbraw/zinc/74/35/62/402743562.db2.gz	KAFZJCUNAKNXIT-MFKMUULPSA-N	0	3	312.797	2.444	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(/C=C/c2ccccc2Cl)n1	ZINC000263250222	402750068	/nfs/dbraw/zinc/75/00/68/402750068.db2.gz	PVALGNQTYXHJCO-YBJDMEARSA-N	0	3	304.781	2.470	10	0		DEAEHN
C[C@@H](c1nc([C@@H]2CNCCN2C)no1)c1cccc(Cl)c1	ZINC000263303494	402756489	/nfs/dbraw/zinc/75/64/89/402756489.db2.gz	XLNLRHZZWFEXQJ-MFKMUULPSA-N	0	3	306.797	2.451	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(Cc2ccc3ccccc3c2)n1	ZINC000263305535	402756759	/nfs/dbraw/zinc/75/67/59/402756759.db2.gz	XUIFSHNVRFXQLO-INIZCTEOSA-N	0	3	308.385	2.390	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(/C=C/Sc2ccccc2)n1	ZINC000263306150	402756962	/nfs/dbraw/zinc/75/69/62/402756962.db2.gz	XXEFDEIQNPLBGN-UTSBKAFOSA-N	0	3	302.403	2.409	10	0		DEAEHN
CN1CCNC[C@H]1c1noc([C@]2(C)CCc3ccccc3C2)n1	ZINC000263316725	402757814	/nfs/dbraw/zinc/75/78/14/402757814.db2.gz	ZNQQNEMVVPYUSU-MAUKXSAKSA-N	0	3	312.417	2.092	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@]2(C)CCc3ccccc3C2)n1	ZINC000263316726	402757829	/nfs/dbraw/zinc/75/78/29/402757829.db2.gz	ZNQQNEMVVPYUSU-QAPCUYQASA-N	0	3	312.417	2.092	10	0		DEAEHN
CC[C@@H]1C[C@H](C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CCO1	ZINC000183336488	402758039	/nfs/dbraw/zinc/75/80/39/402758039.db2.gz	NQMLFSCCIGCSNR-FGTMMUONSA-N	0	3	318.461	2.481	10	0		DEAEHN
CCCC[C@@H](CC)CN1CCN(c2ccc3nncn3n2)CC1	ZINC000183613024	402781802	/nfs/dbraw/zinc/78/18/02/402781802.db2.gz	HLWDLZPWQOZGDO-OAHLLOKOSA-N	0	3	316.453	2.463	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CCC(C(C)C)CC1	ZINC000174824235	402759194	/nfs/dbraw/zinc/75/91/94/402759194.db2.gz	SPILPQAPJWCLMC-INIZCTEOSA-N	0	3	311.470	2.175	10	0		DEAEHN
C[C@@H]1CN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)[C@@H](C)CO1	ZINC000183395712	402763360	/nfs/dbraw/zinc/76/33/60/402763360.db2.gz	XUCRRNSRTIHMJS-XOSAIJSUSA-N	0	3	317.433	2.251	10	0		DEAEHN
COC(=O)c1cccc(NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000175012263	402771274	/nfs/dbraw/zinc/77/12/74/402771274.db2.gz	GLEQNUSPFDQZLF-SWLSCSKDSA-N	0	3	319.405	2.420	10	0		DEAEHN
C[C@H](C(=O)N1CCC(c2cc[nH]n2)CC1)N1CCCCCC1	ZINC000174031252	402724420	/nfs/dbraw/zinc/72/44/20/402724420.db2.gz	RAISMBYBXKHLCZ-CQSZACIVSA-N	0	3	304.438	2.380	10	0		DEAEHN
CCN(CC)[C@@H](C)CNC(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000194247954	402789004	/nfs/dbraw/zinc/78/90/04/402789004.db2.gz	FYLUZRKPNFMIIS-ZDUSSCGKSA-N	0	3	302.418	2.205	10	0		DEAEHN
COC[C@H](NC(=O)NCCN1CCCC[C@@H]1C)c1ccc(C)o1	ZINC000175278152	402793568	/nfs/dbraw/zinc/79/35/68/402793568.db2.gz	CZQIUUZIVFYAHZ-ZFWWWQNUSA-N	0	3	323.437	2.449	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)N(C)Cc1ccccc1F	ZINC000175341300	402798472	/nfs/dbraw/zinc/79/84/72/402798472.db2.gz	WAFBJJFTZBMOLG-INIZCTEOSA-N	0	3	321.440	2.200	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCC(OCC(C)C)CC1	ZINC000175372532	402800794	/nfs/dbraw/zinc/80/07/94/402800794.db2.gz	ITSATUBVPVSCRN-HNNXBMFYSA-N	0	3	311.470	2.317	10	0		DEAEHN
Cc1c(C(=O)N2CCN3CCC[C@H]3C2)cnn1Cc1ccccc1	ZINC000195332521	402842586	/nfs/dbraw/zinc/84/25/86/402842586.db2.gz	AUQYZOSJZQTCGS-KRWDZBQOSA-N	0	3	324.428	2.160	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)S(=O)(=O)Cc1cccc(C)c1	ZINC000175393419	402802502	/nfs/dbraw/zinc/80/25/02/402802502.db2.gz	YADVIXQLNKTBSM-MRXNPFEDSA-N	0	3	310.463	2.241	10	0		DEAEHN
O=C(NCCc1cc(F)cc(F)c1)N1CCCN(C2CC2)CC1	ZINC000194557041	402802803	/nfs/dbraw/zinc/80/28/03/402802803.db2.gz	XUPVNNHZHGYQFO-UHFFFAOYSA-N	0	3	323.387	2.387	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Cc2cnn(-c3ccccc3)c2)C1	ZINC000194648552	402808102	/nfs/dbraw/zinc/80/81/02/402808102.db2.gz	MKYHOXDIEZDRCW-INIZCTEOSA-N	0	3	312.417	2.015	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)NC[C@@H]2CCCN2C)cc1	ZINC000194702230	402811325	/nfs/dbraw/zinc/81/13/25/402811325.db2.gz	IVDGPBVMQZXLJM-UHOFOFEASA-N	0	3	315.417	2.105	10	0		DEAEHN
CCOc1cccnc1C(=O)NCc1ccccc1CN(C)C	ZINC000175928263	402843168	/nfs/dbraw/zinc/84/31/68/402843168.db2.gz	OMPIIPOGDFTIET-UHFFFAOYSA-N	0	3	313.401	2.472	10	0		DEAEHN
C[C@H](CNC(=O)[C@@H]1C[C@@H](C)CC(C)(C)C1)CN1CCN(C)CC1	ZINC000184067288	402815698	/nfs/dbraw/zinc/81/56/98/402815698.db2.gz	BEGKYCHOYGBQAV-BRWVUGGUSA-N	0	3	323.525	2.449	10	0		DEAEHN
CN1CCC(NC(=O)N(C[C@@H]2CCCO2)C2CCCC2)CC1	ZINC000175556380	402817218	/nfs/dbraw/zinc/81/72/18/402817218.db2.gz	NYAWKGYAJRWGPR-INIZCTEOSA-N	0	3	309.454	2.214	10	0		DEAEHN
COc1ccc(C)nc1NC(=O)N1CCC[C@H]1CN1CCCC1	ZINC000184252961	402830850	/nfs/dbraw/zinc/83/08/50/402830850.db2.gz	YTXIICNGZVUYBE-AWEZNQCLSA-N	0	3	318.421	2.491	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@@H](c2cccs2)N(C)C)C1	ZINC000194137045	402785681	/nfs/dbraw/zinc/78/56/81/402785681.db2.gz	LAWVYGARWPNGLL-KGLIPLIRSA-N	0	3	324.494	2.134	10	0		DEAEHN
CC1CCC(NC(=O)CN2CCC(c3ccn[nH]3)CC2)CC1	ZINC000195506392	402848076	/nfs/dbraw/zinc/84/80/76/402848076.db2.gz	LSNWFYQMDIIUBK-UHFFFAOYSA-N	0	3	304.438	2.284	10	0		DEAEHN
C[C@H]1CCCC[C@H]1NC(=O)CN1CCC(c2ccn[nH]2)CC1	ZINC000195506647	402848357	/nfs/dbraw/zinc/84/83/57/402848357.db2.gz	QBIJTPLEIUJUJX-DZGCQCFKSA-N	0	3	304.438	2.284	10	0		DEAEHN
c1cc(CN2CCC[C@@H](C3OCCO3)C2)n(-c2ccccc2)n1	ZINC000279859093	402965244	/nfs/dbraw/zinc/96/52/44/402965244.db2.gz	PUCHGUMTGYTCFD-OAHLLOKOSA-N	0	3	313.401	2.457	10	0		DEAEHN
Cc1nocc1CNC1CCN(c2cc(C)nc(C)n2)CC1	ZINC000293644977	403528124	/nfs/dbraw/zinc/52/81/24/403528124.db2.gz	RXGDIRIOMOLXLW-UHFFFAOYSA-N	0	3	301.394	2.148	10	0		DEAEHN
C[C@H]1OCC[C@H]1NC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000293664227	403531611	/nfs/dbraw/zinc/53/16/11/403531611.db2.gz	CMHVBOPIBQPZNY-RHSMWYFYSA-N	0	3	302.418	2.192	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)N[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000343512707	403618291	/nfs/dbraw/zinc/61/82/91/403618291.db2.gz	NEASBKMTLVPJDE-SWLSCSKDSA-N	0	3	318.421	2.274	10	0		DEAEHN
C[C@H](C(=O)N(C)C1CCCCC1)N1CCC[C@H](c2nc[nH]n2)C1	ZINC000333116544	403668881	/nfs/dbraw/zinc/66/88/81/403668881.db2.gz	YVKHXOOUHCCTNR-KGLIPLIRSA-N	0	3	319.453	2.164	10	0		DEAEHN
CO[C@H]1C[C@@H](CO)N(Cc2cccc(OC(F)(F)F)c2)C1	ZINC000343953996	403806615	/nfs/dbraw/zinc/80/66/15/403806615.db2.gz	LLRIUEFPBLHVPK-AAEUAGOBSA-N	0	3	305.296	2.167	10	0		DEAEHN
Oc1ccc(Br)c(CNC[C@@H]2CCC[C@H]2O)c1	ZINC000305133063	403845424	/nfs/dbraw/zinc/84/54/24/403845424.db2.gz	RXHXDJHXLORMIG-TVQRCGJNSA-N	0	3	300.196	2.405	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2c(C)nn(C)c2C)C12CCOCC2	ZINC000186304311	286391813	/nfs/dbraw/zinc/39/18/13/286391813.db2.gz	CHVKAVJLPQOXLZ-JKSUJKDBSA-N	0	3	307.438	2.101	10	0		DEAEHN
CC(C)n1cc2c(n1)C[C@H](NC(=O)CC1CCN(C)CC1)CC2	ZINC000362928269	404009317	/nfs/dbraw/zinc/00/93/17/404009317.db2.gz	QFZGBLXAUJFDRN-MRXNPFEDSA-N	0	3	318.465	2.169	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)CCN(C[C@@H](O)C(F)(F)F)C1	ZINC000323892152	404096830	/nfs/dbraw/zinc/09/68/30/404096830.db2.gz	GALHLXGFMIILOJ-UKRRQHHQSA-N	0	3	316.367	2.364	10	0		DEAEHN
Cc1nnc([C@@H]2CCCCN2C(=O)[C@@H](C)[NH+]2CCCCCC2)[n-]1	ZINC000328674720	404128140	/nfs/dbraw/zinc/12/81/40/404128140.db2.gz	KCBCKOLXNNMNGN-HIFRSBDPSA-N	0	3	319.453	2.431	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@@H](C(=O)N(C)C1CCN(C)CC1)CC2	ZINC000364556259	404447803	/nfs/dbraw/zinc/44/78/03/404447803.db2.gz	XLQVZYXNOJMZBU-ZDUSSCGKSA-N	0	3	318.465	2.191	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@H](C(=O)N(C)C1CCN(C)CC1)C2	ZINC000364556259	404447805	/nfs/dbraw/zinc/44/78/05/404447805.db2.gz	XLQVZYXNOJMZBU-ZDUSSCGKSA-N	0	3	318.465	2.191	10	0		DEAEHN
Cc1nc(C)n(C[C@@H]2CCCN2Cc2ccc3c(c2)CCO3)n1	ZINC000365253122	404587279	/nfs/dbraw/zinc/58/72/79/404587279.db2.gz	KWDGNSZQYUYSGQ-KRWDZBQOSA-N	0	3	312.417	2.494	10	0		DEAEHN
CC(C)[C@@H](O)C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1	ZINC000375841349	404757954	/nfs/dbraw/zinc/75/79/54/404757954.db2.gz	RSDLYCPZJAWQOU-NWANDNLSSA-N	0	3	310.463	2.264	10	0		DEAEHN
CC(=O)c1ccc(N2CC[C@H](OCCN3CCCCC3)C2)nc1	ZINC000356860181	404709987	/nfs/dbraw/zinc/70/99/87/404709987.db2.gz	NRROBZOQOHQABM-KRWDZBQOSA-N	0	3	317.433	2.365	10	0		DEAEHN
CN(CCOc1ccc(F)cc1)CCN1CCOC(C)(C)C1	ZINC000434696856	404925542	/nfs/dbraw/zinc/92/55/42/404925542.db2.gz	ISYZDMMSRPRASA-UHFFFAOYSA-N	0	3	310.413	2.247	10	0		DEAEHN
CC(=O)NC[C@@H]1CCCN(Cc2ccc(-c3cc[nH]n3)o2)C1	ZINC000434834178	404938382	/nfs/dbraw/zinc/93/83/82/404938382.db2.gz	OIYUDBKBVUDUKI-ZDUSSCGKSA-N	0	3	302.378	2.018	10	0		DEAEHN
CC(=O)c1cccc(CN2C[C@H](O)C[C@H]2[C@H]2CCCOC2)c1	ZINC000451304282	404948520	/nfs/dbraw/zinc/94/85/20/404948520.db2.gz	ODWNJHKNECWAIX-KSZLIROESA-N	0	3	303.402	2.251	10	0		DEAEHN
CC1CCC(O)(CN2CCOC[C@@H]2[C@H]2CCCC[C@H]2O)CC1	ZINC000408040857	405096811	/nfs/dbraw/zinc/09/68/11/405096811.db2.gz	AFTIDHSPQYCUNW-YZMJHREJSA-N	0	3	311.466	2.180	10	0		DEAEHN
C[C@H](NC1CC(O)(Cc2cccc(F)c2)C1)c1ccc(=O)[nH]n1	ZINC000367611268	405102424	/nfs/dbraw/zinc/10/24/24/405102424.db2.gz	BJCFTJPRCJXULL-HUZSNBGSSA-N	0	3	317.364	2.108	10	0		DEAEHN
C/C=C/C[C@H](NC(=O)[C@H](C)N1CCCCCC1)C(=O)OCC	ZINC000361548187	405126626	/nfs/dbraw/zinc/12/66/26/405126626.db2.gz	GWLWBSWVRWQDEU-PGXISHIXSA-N	0	3	310.438	2.265	10	0		DEAEHN
CCOC(=O)CCCCCN1C[C@]2(CCOC2)OC(C)(C)C1	ZINC000361528756	405116420	/nfs/dbraw/zinc/11/64/20/405116420.db2.gz	WGRIUXWKSVKXDM-KRWDZBQOSA-N	0	3	313.438	2.380	10	0		DEAEHN
Cc1cc(F)ccc1S(=O)(=O)NC(C)(C)CN1CCCC1	ZINC000452094226	405162878	/nfs/dbraw/zinc/16/28/78/405162878.db2.gz	YWYPOAXWZQNXOX-UHFFFAOYSA-N	0	3	314.426	2.287	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)[C@H](C)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000420349536	405328606	/nfs/dbraw/zinc/32/86/06/405328606.db2.gz	PMEKOAKXEAJYTH-AEGPPILISA-N	0	3	315.417	2.043	10	0		DEAEHN
CN(C)CCn1nccc1NC(=O)N1C[C@H]2CCCC[C@@H]2C1	ZINC000455653813	405440577	/nfs/dbraw/zinc/44/05/77/405440577.db2.gz	FKQBFEJHYHFGJE-ZIAGYGMSSA-N	0	3	305.426	2.099	10	0		DEAEHN
CO[C@@](C)(CNC(=O)CC1CCN(C)CC1)c1ccccc1	ZINC000456139767	405513236	/nfs/dbraw/zinc/51/32/36/405513236.db2.gz	ZRDOCGJFUJKGHK-SFHVURJKSA-N	0	3	304.434	2.396	10	0		DEAEHN
CN(C)[C@@]1(CNC(=O)N[C@@H]2CCCC(F)(F)C2)CCSC1	ZINC000494422287	405694711	/nfs/dbraw/zinc/69/47/11/405694711.db2.gz	BQTVPKOIVMMWOB-DGCLKSJQSA-N	0	3	321.437	2.301	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NC[C@H](C)N1CCCC1)CC2	ZINC000530473584	405808966	/nfs/dbraw/zinc/80/89/66/405808966.db2.gz	AXBHURISBZQFAC-KBPBESRZSA-N	0	3	318.465	2.239	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NC[C@H](C)N1CCCC1)C2	ZINC000530473584	405808972	/nfs/dbraw/zinc/80/89/72/405808972.db2.gz	AXBHURISBZQFAC-KBPBESRZSA-N	0	3	318.465	2.239	10	0		DEAEHN
CC(=O)CC(C)(C)CC(=O)Nc1cnn(C2CCN(C)CC2)c1	ZINC000634094456	406001307	/nfs/dbraw/zinc/00/13/07/406001307.db2.gz	ABRFVVGPSZGMCW-UHFFFAOYSA-N	0	3	320.437	2.484	10	0		DEAEHN
CC(C)N(Cc1ccccc1)C(=O)NCCOCCN(C)C	ZINC000471661760	406106794	/nfs/dbraw/zinc/10/67/94/406106794.db2.gz	GVYRXWJVHSEFJQ-UHFFFAOYSA-N	0	3	307.438	2.185	10	0		DEAEHN
CC(C)C[C@@H](CCO)CNCc1c(Br)cnn1C	ZINC000487312188	406222246	/nfs/dbraw/zinc/22/22/46/406222246.db2.gz	RKMSVQOPCWBQKE-LLVKDONJSA-N	0	3	318.259	2.317	10	0		DEAEHN
COc1ccccc1-n1nccc1CN(C)C1CCOCC1	ZINC000570116491	406349307	/nfs/dbraw/zinc/34/93/07/406349307.db2.gz	ASPCJULODBHUIE-UHFFFAOYSA-N	0	3	301.390	2.492	10	0		DEAEHN
Cc1nc2ccccc2n1CCC(=O)NC[C@H]1CCCN(C)C1	ZINC000547473835	406414729	/nfs/dbraw/zinc/41/47/29/406414729.db2.gz	QQLCFZZNUKSZHB-OAHLLOKOSA-N	0	3	314.433	2.193	10	0		DEAEHN
c1cncc(-c2nc3c(c(N4C[C@H]5CCC[C@@H](C4)N5)n2)CCC3)c1	ZINC000570619667	406416202	/nfs/dbraw/zinc/41/62/02/406416202.db2.gz	ZDCBVAFOSFVYFQ-GASCZTMLSA-N	0	3	321.428	2.358	10	0		DEAEHN
C[C@@H]1CCC[C@H](NC(=O)[C@@H](N)CN(C)Cc2ccccc2)C1	ZINC000637919264	406476821	/nfs/dbraw/zinc/47/68/21/406476821.db2.gz	RIFCFJOWDJYYJH-PVAVHDDUSA-N	0	3	303.450	2.141	10	0		DEAEHN
C[C@@H](N(C)C(=O)[C@@H](N)CN(C)Cc1ccccc1)C(C)(C)C	ZINC000637930087	406482478	/nfs/dbraw/zinc/48/24/78/406482478.db2.gz	SMPKFAVUQMMTBJ-ZBFHGGJFSA-N	0	3	305.466	2.339	10	0		DEAEHN
CC[C@H]1CCCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)C1	ZINC000637935771	406484987	/nfs/dbraw/zinc/48/49/87/406484987.db2.gz	UVNRTTDTKVLZRU-RDJZCZTQSA-N	0	3	303.450	2.094	10	0		DEAEHN
c1ccc(N2CCO[C@H](CN3CCOCC4(CC4)C3)C2)cc1	ZINC000571176403	406488182	/nfs/dbraw/zinc/48/81/82/406488182.db2.gz	VWENHMPFFRJBLN-QGZVFWFLSA-N	0	3	302.418	2.004	10	0		DEAEHN
CC(C)[C@H](NC(=O)N1CC[C@@H](N2CCCC2)C1)C(F)(F)F	ZINC000526068183	406541741	/nfs/dbraw/zinc/54/17/41/406541741.db2.gz	WMHZMXWJWXCDHM-NEPJUHHUSA-N	0	3	307.360	2.453	10	0		DEAEHN
N[C@@H]1CCO[C@@H]1C(=O)Nc1ccc(Cl)c(Br)c1	ZINC000637988235	406511547	/nfs/dbraw/zinc/51/15/47/406511547.db2.gz	VVUBYXGIJMMUCD-ZJUUUORDSA-N	0	3	319.586	2.157	10	0		DEAEHN
c1ccc(N2CC[C@@H](CN3CCN(c4cccnn4)CC3)C2)cc1	ZINC000638000318	406516356	/nfs/dbraw/zinc/51/63/56/406516356.db2.gz	QQGRZZCNSPULFN-KRWDZBQOSA-N	0	3	323.444	2.125	10	0		DEAEHN
CN(CCC[NH+](C)C)C(=O)c1cc([O-])ccc1C(F)(F)F	ZINC000527251566	406604783	/nfs/dbraw/zinc/60/47/83/406604783.db2.gz	OVBYDALADCLBNW-UHFFFAOYSA-N	0	3	304.312	2.435	10	0		DEAEHN
Cc1occc1CN(C)C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638382469	406738099	/nfs/dbraw/zinc/73/80/99/406738099.db2.gz	WTKBLFUJJQKCRK-QGZVFWFLSA-N	0	3	315.417	2.006	10	0		DEAEHN
C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)[C@@H]1CNCCOC1	ZINC000643617669	407017717	/nfs/dbraw/zinc/01/77/17/407017717.db2.gz	LXLLJQIRVFKGMW-WMLDXEAASA-N	0	3	302.418	2.050	10	0		DEAEHN
Cc1nsc([N-]C(=O)c2cc(NN)[nH+]c(C(C)(C)C)c2)n1	ZINC000128741905	195988217	/nfs/dbraw/zinc/98/82/17/195988217.db2.gz	FWMMXUSIXCQEID-UHFFFAOYSA-N	0	3	306.395	2.077	10	0		DEAEHN
Cc1nsc(NC(=O)c2cc(NN)nc(C(C)(C)C)c2)n1	ZINC000128741905	195988219	/nfs/dbraw/zinc/98/82/19/195988219.db2.gz	FWMMXUSIXCQEID-UHFFFAOYSA-N	0	3	306.395	2.077	10	0		DEAEHN
COCCOc1ccccc1C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000128960418	196007086	/nfs/dbraw/zinc/00/70/86/196007086.db2.gz	FLQUGAKMKZTCNE-HNNXBMFYSA-N	0	3	322.449	2.418	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)CCC(C)(C)C	ZINC000246272135	287230463	/nfs/dbraw/zinc/23/04/63/287230463.db2.gz	VAJVETNWLZYNIX-KGLIPLIRSA-N	0	3	302.484	2.311	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1cccc2ncccc21	ZINC000129310172	196038377	/nfs/dbraw/zinc/03/83/77/196038377.db2.gz	TZAKXCCJRHKDJS-ZDUSSCGKSA-N	0	3	321.446	2.243	10	0		DEAEHN
OCCOC1CCN(C[C@@H]2Cc3cc(Cl)ccc3O2)CC1	ZINC000129327538	196039811	/nfs/dbraw/zinc/03/98/11/196039811.db2.gz	DLJIAKOVNJMXSH-HNNXBMFYSA-N	0	3	311.809	2.117	10	0		DEAEHN
O=S1(=O)CC[C@@H](CN[C@@H]2CCc3sc(Cl)cc32)C1	ZINC000129594837	196060488	/nfs/dbraw/zinc/06/04/88/196060488.db2.gz	SQPNIPBJEZZGPX-WCBMZHEXSA-N	0	3	305.852	2.413	10	0		DEAEHN
COc1ccc([O-])c(C(=O)NC2CCC(C[NH+](C)C)CC2)c1	ZINC000129819578	196078306	/nfs/dbraw/zinc/07/83/06/196078306.db2.gz	FHYFWEHBDRJXNI-UHFFFAOYSA-N	0	3	306.406	2.251	10	0		DEAEHN
C[C@H](Cc1ccsc1)Nc1nc(N)nc(N2CCCC2)n1	ZINC000130987936	196129673	/nfs/dbraw/zinc/12/96/73/196129673.db2.gz	TUQKLIITSWJRKI-SNVBAGLBSA-N	0	3	304.423	2.159	10	0		DEAEHN
CCc1nn([C@H]2CCS(=O)(=O)C2)c(CC)c1[C@@H](CC)NC	ZINC000131084657	196138883	/nfs/dbraw/zinc/13/88/83/196138883.db2.gz	WOANRUYZTDRROE-NWDGAFQWSA-N	0	3	313.467	2.038	10	0		DEAEHN
C[C@]1(NC2=NCC3(CCCCC3)CS2)CCS(=O)(=O)C1	ZINC000131137868	196143291	/nfs/dbraw/zinc/14/32/91/196143291.db2.gz	GIAJFLNLSUWRDG-ZDUSSCGKSA-N	0	3	316.492	2.207	10	0		DEAEHN
Cc1cc(C)c(S(=O)(=O)NCCCC(F)(F)F)cc1CN	ZINC000131212826	196150139	/nfs/dbraw/zinc/15/01/39/196150139.db2.gz	RPOSOGXPIVNXRE-UHFFFAOYSA-N	0	3	324.368	2.383	10	0		DEAEHN
CCOC(=O)[C@@H](NCCN(C)C)c1ccc(C(F)F)cc1	ZINC000131507456	196175014	/nfs/dbraw/zinc/17/50/14/196175014.db2.gz	BXJVDSNBLUYMDJ-ZDUSSCGKSA-N	0	3	300.349	2.380	10	0		DEAEHN
C[C@@H](CN(C)C)N1C(=O)C2(CCCC2)N[C@@H]1c1cccs1	ZINC000131649254	196187589	/nfs/dbraw/zinc/18/75/89/196187589.db2.gz	YPBRUAAYBFEXKP-JSGCOSHPSA-N	0	3	307.463	2.441	10	0		DEAEHN
CC[C@H](C)[C@H](O)c1c(Br)cnn1CCN(C)C	ZINC000132029307	196220265	/nfs/dbraw/zinc/22/02/65/196220265.db2.gz	LBBWFHATFRCFCG-CABZTGNLSA-N	0	3	304.232	2.287	10	0		DEAEHN
CCCNc1ncc(Br)c(NC[C@H](C)N(C)C)n1	ZINC000132225429	196236866	/nfs/dbraw/zinc/23/68/66/196236866.db2.gz	GRPYMGZHUOJTHB-VIFPVBQESA-N	0	3	316.247	2.423	10	0		DEAEHN
CC(C)[C@@H]1CN(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)CCS1	ZINC000132438325	196256388	/nfs/dbraw/zinc/25/63/88/196256388.db2.gz	DDTAEIJBEMPIPY-ILXRZTDVSA-N	0	3	313.511	2.498	10	0		DEAEHN
C[C@H]1CNC[C@H](COCc2cccc(F)c2Br)O1	ZINC000132495411	196259265	/nfs/dbraw/zinc/25/92/65/196259265.db2.gz	OXTFFPOEXQSJRV-GXSJLCMTSA-N	0	3	318.186	2.482	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2	ZINC000179241956	287270141	/nfs/dbraw/zinc/27/01/41/287270141.db2.gz	WEGOXVASBRBSHQ-QXSJWSMHSA-N	0	3	321.465	2.118	10	0		DEAEHN
Cc1cnn(CCN[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)c1	ZINC000132973935	196301323	/nfs/dbraw/zinc/30/13/23/196301323.db2.gz	SVEDWAUIMYZCHS-OAHLLOKOSA-N	0	3	318.808	2.240	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@H](CC)CSC)o1	ZINC000134258178	196374469	/nfs/dbraw/zinc/37/44/69/196374469.db2.gz	SZMPUSHILMQRRA-LLVKDONJSA-N	0	3	320.480	2.199	10	0		DEAEHN
Cc1ccccc1S(=O)(=O)N[C@@](C)(CN)c1ccccc1	ZINC000134472269	196393615	/nfs/dbraw/zinc/39/36/15/196393615.db2.gz	CFTRCGJBLXIJHJ-INIZCTEOSA-N	0	3	304.415	2.147	10	0		DEAEHN
CNCc1cnc(Oc2cncc(Br)c2)nc1C	ZINC000134539014	196399854	/nfs/dbraw/zinc/39/98/54/196399854.db2.gz	YFWYBOJARWJXTG-UHFFFAOYSA-N	0	3	309.167	2.454	10	0		DEAEHN
Cc1sc(CNC(C)C)cc1S(=O)(=O)NCC(F)F	ZINC000136661531	196546110	/nfs/dbraw/zinc/54/61/10/196546110.db2.gz	SLBVHAINLHSZBB-UHFFFAOYSA-N	0	3	312.407	2.098	10	0		DEAEHN
Cc1ccccc1CCNC(=O)CN(C)[C@@]1(CO)CC[C@H](C)C1	ZINC000188031013	225006456	/nfs/dbraw/zinc/00/64/56/225006456.db2.gz	AQSAPHNTAXXWJR-KXBFYZLASA-N	0	3	318.461	2.137	10	0		DEAEHN
CN(C)CCOc1ccc(NC(=O)NCc2cccnc2)cc1	ZINC000047606734	424827044	/nfs/dbraw/zinc/82/70/44/424827044.db2.gz	MZKVVSRBIHCNEJ-UHFFFAOYSA-N	0	3	314.389	2.344	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)c1nscc1Br	ZINC000404785167	424929381	/nfs/dbraw/zinc/92/93/81/424929381.db2.gz	DYPNRTAPCAPRBH-QMMMGPOBSA-N	0	3	318.240	2.120	10	0		DEAEHN
CC[C@H](C)n1nc(NC(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1C	ZINC000408113240	424933506	/nfs/dbraw/zinc/93/35/06/424933506.db2.gz	UKMHVDGNEANNAF-CFVMTHIKSA-N	0	3	319.453	2.863	10	0		DEAEHN
C[C@@H](O)CN(Cc1ccc(C(=O)OC(C)(C)C)cc1)[C@H](C)CO	ZINC000248998238	424886665	/nfs/dbraw/zinc/88/66/65/424886665.db2.gz	YFZYMFJFEXQIJW-ZIAGYGMSSA-N	0	3	323.433	2.206	10	0		DEAEHN
Clc1cc(OC[C@@H]2CNCCO2)ccc1Br	ZINC000313516214	424894894	/nfs/dbraw/zinc/89/48/94/424894894.db2.gz	HPPMEECYLYUAIS-VIFPVBQESA-N	0	3	306.587	2.470	10	0		DEAEHN
COCCN(C)CCNC(=O)N[C@@H](C)c1ccc(C)c(F)c1	ZINC000087087022	267391096	/nfs/dbraw/zinc/39/10/96/267391096.db2.gz	DVYDXSCSKKEHLD-ZDUSSCGKSA-N	0	3	311.401	2.073	10	0		DEAEHN
CCn1ccnc1[C@@H]1OCC[C@H]1CN[C@H](C)c1nccnc1C	ZINC000658201546	425453954	/nfs/dbraw/zinc/45/39/54/425453954.db2.gz	OEJRVVKXPDUNMH-IJEWVQPXSA-N	0	3	315.421	2.430	10	0		DEAEHN
CCOc1ccc(C(=O)NC[C@@H]2CCCN2C)cc1OCC	ZINC000194732971	268557821	/nfs/dbraw/zinc/55/78/21/268557821.db2.gz	MAKGDUUGRVBDCB-AWEZNQCLSA-N	0	3	306.406	2.308	10	0		DEAEHN
C[C@H](N[C@@H]1CCc2nnnn2CC1)c1nc2c(s1)CCCC2	ZINC000333681692	268976376	/nfs/dbraw/zinc/97/63/76/268976376.db2.gz	FGNZGXYUKUVHEV-WDEREUQCSA-N	0	3	318.450	2.064	10	0		DEAEHN
CCc1nnc(CNC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)[nH]1	ZINC000392375866	269099297	/nfs/dbraw/zinc/09/92/97/269099297.db2.gz	OTLHTMQDXWOHQH-LBPRGKRZSA-N	0	3	323.441	2.104	10	0		DEAEHN
CCc1nnc(C[NH2+]C[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)[n-]1	ZINC000392375866	269099298	/nfs/dbraw/zinc/09/92/98/269099298.db2.gz	OTLHTMQDXWOHQH-LBPRGKRZSA-N	0	3	323.441	2.104	10	0		DEAEHN
CNC(=O)[C@@H]1CCN(Cc2cc(Br)ccc2C)C1	ZINC000398478354	269108884	/nfs/dbraw/zinc/10/88/84/269108884.db2.gz	KJIRRZPZDADWNI-LLVKDONJSA-N	0	3	311.223	2.325	10	0		DEAEHN
COC[C@@H](CN[C@H](C)c1ccc(Br)cn1)OC	ZINC000516829975	269369495	/nfs/dbraw/zinc/36/94/95/269369495.db2.gz	JVNQPJDSDMAUAB-MWLCHTKSSA-N	0	3	303.200	2.156	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@H](C)N1CCC[C@H]1Cn1ccnc1C	ZINC000247223727	276040872	/nfs/dbraw/zinc/04/08/72/276040872.db2.gz	YTUHVZFATBMZEQ-DZKIICNBSA-N	0	3	306.454	2.349	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000261940037	276161704	/nfs/dbraw/zinc/16/17/04/276161704.db2.gz	UQDLGVYBTCTAEJ-INJPQVFBSA-N	0	3	314.429	2.191	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)Nc1ccc(F)cc1F	ZINC000177707522	276182886	/nfs/dbraw/zinc/18/28/86/276182886.db2.gz	QDACNUYNBWVJNF-ZDUSSCGKSA-N	0	3	311.376	2.319	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@@H]1OCCc2ccccc21	ZINC000246344873	276376846	/nfs/dbraw/zinc/37/68/46/276376846.db2.gz	VECAGOCHGDJJLR-DOTOQJQBSA-N	0	3	302.418	2.243	10	0		DEAEHN
CN(C)C(=O)Cc1ccc(NC(=O)[C@@H]2NCCCC2(C)C)cc1	ZINC000261959558	276743694	/nfs/dbraw/zinc/74/36/94/276743694.db2.gz	XMJDLYLPYFSNFL-INIZCTEOSA-N	0	3	317.433	2.034	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)CC23CC4CC(CC(C4)C2)C3)CCO1	ZINC000116790299	276765608	/nfs/dbraw/zinc/76/56/08/276765608.db2.gz	YJLIQLBTHLNQCX-YMVOSSCXSA-N	0	3	320.477	2.382	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(Br)c(F)c2)C1	ZINC000071140011	276783153	/nfs/dbraw/zinc/78/31/53/276783153.db2.gz	LNPCDEPASOABNI-SNVBAGLBSA-N	0	3	315.186	2.364	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2C[C@]23CCc2ccccc23)n1	ZINC000263221643	277116544	/nfs/dbraw/zinc/11/65/44/277116544.db2.gz	LXSXRUDPQYCDAJ-RKVPGOIHSA-N	0	3	310.401	2.017	10	0		DEAEHN
C[C@@H](O)CCCN[C@@H](Cn1ccccc1=O)c1ccccc1	ZINC000450921700	277636306	/nfs/dbraw/zinc/63/63/06/277636306.db2.gz	JPIIWGXYMXPNGU-WBVHZDCISA-N	0	3	300.402	2.340	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(Cl)nn1	ZINC000294824074	278241710	/nfs/dbraw/zinc/24/17/10/278241710.db2.gz	ABWDRPIFTHISEH-LBPRGKRZSA-N	0	3	318.808	2.380	10	0		DEAEHN
C[C@H]1c2ccccc2O[C@H]1C(=O)NC1CCN(C2CC2)CC1	ZINC000117748517	278547692	/nfs/dbraw/zinc/54/76/92/278547692.db2.gz	DRKHUOHUTAFTIJ-YVEFUNNKSA-N	0	3	300.402	2.294	10	0		DEAEHN
C[C@@](C[NH3+])([N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1)C1CC1	ZINC000130361124	279148874	/nfs/dbraw/zinc/14/88/74/279148874.db2.gz	OABBUYQZOCKDJL-LBPRGKRZSA-N	0	3	323.245	2.399	10	0		DEAEHN
O=C(C[C@H]1CSCCN1)N1CCCC[C@H]1c1nccs1	ZINC000133672882	279796248	/nfs/dbraw/zinc/79/62/48/279796248.db2.gz	SFKCUYCZRFWSEA-RYUDHWBXSA-N	0	3	311.476	2.292	10	0		DEAEHN
Cc1cc(F)cc(C)c1S(=O)(=O)NC[C@@H](N)c1ccccc1	ZINC000262395760	280516825	/nfs/dbraw/zinc/51/68/25/280516825.db2.gz	BVNYBEIDATTWBK-OAHLLOKOSA-N	0	3	322.405	2.421	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN(C[C@@H](O)CC(F)(F)F)C2)n1	ZINC000249291212	281245401	/nfs/dbraw/zinc/24/54/01/281245401.db2.gz	MKTBBXLYOJNYQH-STQMWFEESA-N	0	3	317.355	2.437	10	0		DEAEHN
C[C@H](CCNCc1cc(Cl)c2c(c1)OCCO2)[S@@](C)=O	ZINC000129384892	281910787	/nfs/dbraw/zinc/91/07/87/281910787.db2.gz	AEPYPICSRUVAPJ-SBKAZYGRSA-N	0	3	317.838	2.358	10	0		DEAEHN
COC[C@@H](NC(=O)N[C@H](CN(C)C)c1ccccc1)C1CC1	ZINC000157208727	292827914	/nfs/dbraw/zinc/82/79/14/292827914.db2.gz	JZNMFHJOMWLISF-HZPDHXFCSA-N	0	3	305.422	2.014	10	0		DEAEHN
C[C@H](C(=O)N[C@H]1CCC[C@@H](C)[C@H]1C)N1CCCN(C2CC2)CC1	ZINC000172345941	289373525	/nfs/dbraw/zinc/37/35/25/289373525.db2.gz	DGELBGVHSYFXOK-KONPQCLYSA-N	0	3	321.509	2.486	10	0		DEAEHN
C[C@H](CC(F)(F)F)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000231791495	289435813	/nfs/dbraw/zinc/43/58/13/289435813.db2.gz	IYBVUUSOUGSVSP-RKDXNWHRSA-N	0	3	310.341	2.326	10	0		DEAEHN
CO[C@@H](C(=O)N1CCCC12CCN(C)CC2)c1ccc(O)cc1	ZINC000408153423	293382490	/nfs/dbraw/zinc/38/24/90/293382490.db2.gz	CAYQSBMZWGGKEU-MRXNPFEDSA-N	0	3	318.417	2.167	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cccnc1C(F)(F)F	ZINC000137076832	300314909	/nfs/dbraw/zinc/31/49/09/300314909.db2.gz	VOFKMGOYHGFVSF-WDEREUQCSA-N	0	3	313.323	2.409	10	0		DEAEHN
NC(=O)CCCCC(=O)NC[C@H](c1cccs1)N1CCCC1	ZINC000187179339	303242655	/nfs/dbraw/zinc/24/26/55/303242655.db2.gz	DRPUMILDROYGHI-CYBMUJFWSA-N	0	3	323.462	2.047	10	0		DEAEHN
Brc1ccc(CN[C@@H]2CCc3nc[nH]c3C2)nc1	ZINC000574005611	326113279	/nfs/dbraw/zinc/11/32/79/326113279.db2.gz	VIWDMRYBHGCEIJ-SNVBAGLBSA-N	0	3	307.195	2.214	10	0		DEAEHN
Brc1ccc(CN[C@@H]2CCc3[nH]cnc3C2)nc1	ZINC000574005611	326113282	/nfs/dbraw/zinc/11/32/82/326113282.db2.gz	VIWDMRYBHGCEIJ-SNVBAGLBSA-N	0	3	307.195	2.214	10	0		DEAEHN
C[C@H](CNC(=O)NCCOCC1CCC1)N1CCCC[C@H]1C	ZINC000575037637	326211946	/nfs/dbraw/zinc/21/19/46/326211946.db2.gz	RHTKMBAEHSUQEO-HUUCEWRRSA-N	0	3	311.470	2.365	10	0		DEAEHN
CC[C@@H]1CN(c2nc3c(cccc3F)o2)CCN1C[C@@H](C)O	ZINC000577445703	326366049	/nfs/dbraw/zinc/36/60/49/326366049.db2.gz	HEJNXLRFERBCLP-VXGBXAGGSA-N	0	3	307.369	2.248	10	0		DEAEHN
C[C@H](N[C@@H]1CCC(=O)N[C@H]1C)c1ccc(Br)cn1	ZINC000584270788	332178310	/nfs/dbraw/zinc/17/83/10/332178310.db2.gz	BBZGZABVOXMDPL-HOTUBEGUSA-N	0	3	312.211	2.162	10	0		DEAEHN
C[C@H](N[C@@H]1CCC(=O)N[C@@H]1C)c1ccc(Br)cn1	ZINC000584270790	332178355	/nfs/dbraw/zinc/17/83/55/332178355.db2.gz	BBZGZABVOXMDPL-YGOYTEALSA-N	0	3	312.211	2.162	10	0		DEAEHN
C[C@H](NCc1c(Br)cnn1C)[C@H]1CCCOC1	ZINC000388948004	335660913	/nfs/dbraw/zinc/66/09/13/335660913.db2.gz	HLCPIVOHUCLCEA-UWVGGRQHSA-N	0	3	302.216	2.087	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N(C)[C@@H]1CCN(C)C[C@@H]1C	ZINC000246173711	519523392	/nfs/dbraw/zinc/52/33/92/519523392.db2.gz	GIFGDSNGSOYUPV-LSDHHAIUSA-N	0	3	321.469	2.021	10	0		DEAEHN
CCCC[C@H](COC)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000157119931	521200717	/nfs/dbraw/zinc/20/07/17/521200717.db2.gz	GLJDHEYNJPWDFH-ZBFHGGJFSA-N	0	3	305.422	2.372	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)C1CCC(C)CC1	ZINC000111865833	523823913	/nfs/dbraw/zinc/82/39/13/523823913.db2.gz	NMTCFVFXPSNUFQ-UYSNPLJNSA-N	0	3	311.470	2.317	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)[C@H](C)c1ccco1	ZINC000111865128	523824835	/nfs/dbraw/zinc/82/48/35/523824835.db2.gz	PILSVHDJANFBJZ-ZIAGYGMSSA-N	0	3	309.410	2.093	10	0		DEAEHN
CN(C(=O)[C@]1(F)CCN(C(C)(C)C)C1)C1CCC(CO)CC1	ZINC000365961891	523914278	/nfs/dbraw/zinc/91/42/78/523914278.db2.gz	NIPQJHVEVPEJLX-KVULBXGLSA-N	0	3	314.445	2.208	10	0		DEAEHN
COc1ccccc1NCC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000127557337	524633724	/nfs/dbraw/zinc/63/37/24/524633724.db2.gz	IYFWGXPYUGFDKU-KGLIPLIRSA-N	0	3	305.422	2.048	10	0		DEAEHN
C[C@@H](Cc1ccccc1F)N[C@@H]1CCN(C2CCOCC2)C1=O	ZINC000364848275	524924773	/nfs/dbraw/zinc/92/47/73/524924773.db2.gz	PTUGJECDRXSLBV-SUMWQHHRSA-N	0	3	320.408	2.126	10	0		DEAEHN
CC(=O)N1CC[C@@H](CN(C)Cc2ccnn2-c2ccccc2)C1	ZINC000448330053	526646912	/nfs/dbraw/zinc/64/69/12/526646912.db2.gz	BYLJWQWRJXQZPY-INIZCTEOSA-N	0	3	312.417	2.173	10	0		DEAEHN
Cc1nc(CN2CCN(C[C@@H](C)Cc3ccccc3)CC2)no1	ZINC000132333818	526865067	/nfs/dbraw/zinc/86/50/67/526865067.db2.gz	OOULFTBMDIGMJN-HNNXBMFYSA-N	0	3	314.433	2.374	10	0		DEAEHN
CCO[C@H](C)c1noc(CN2C[C@H]3CCCCN3C[C@@H]2C)n1	ZINC000328681224	528022644	/nfs/dbraw/zinc/02/26/44/528022644.db2.gz	VBEUZEMJAHQDII-BFHYXJOUSA-N	0	3	308.426	2.226	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)c1cnc(C2CC2)nc1	ZINC000294973597	529201213	/nfs/dbraw/zinc/20/12/13/529201213.db2.gz	QVYYNJHNJOJRGO-HNNXBMFYSA-N	0	3	302.422	2.348	10	0		DEAEHN
CCn1nnc(C)c1CN[C@@H](C)Cc1ccc(OC)c(OC)c1	ZINC000449132029	535917488	/nfs/dbraw/zinc/91/74/88/535917488.db2.gz	RGDYCGTYZBEFDU-LBPRGKRZSA-N	0	3	318.421	2.344	10	0		DEAEHN
CN1CCC(CC(=O)N2CCC[C@H]2C(=O)OC(C)(C)C)CC1	ZINC000362890484	536335969	/nfs/dbraw/zinc/33/59/69/536335969.db2.gz	GEKGWIGSFVRRST-AWEZNQCLSA-N	0	3	310.438	2.051	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)C2(C)COC2)[C@@H]1c1cccs1	ZINC000372932064	536386227	/nfs/dbraw/zinc/38/62/27/536386227.db2.gz	VVFQZPZGTMWRFL-TZMCWYRMSA-N	0	3	308.447	2.284	10	0		DEAEHN
COc1ccc(Cl)cc1NC(=O)CN1CCN2CCC[C@H]2C1	ZINC000247105967	536576011	/nfs/dbraw/zinc/57/60/11/536576011.db2.gz	IQVQQQWDDMPIQZ-ZDUSSCGKSA-N	0	3	323.824	2.067	10	0		DEAEHN
COCCN(C)CCCNC(=O)Nc1cccc2c1OCCC2	ZINC000374560967	536789870	/nfs/dbraw/zinc/78/98/70/536789870.db2.gz	FTIBYANPJMQNAU-UHFFFAOYSA-N	0	3	321.421	2.101	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)NCCN2CCCC2(C)C)c1	ZINC000457850481	536880762	/nfs/dbraw/zinc/88/07/62/536880762.db2.gz	SUMOGRQXGPYFCM-UHFFFAOYSA-N	0	3	318.417	2.386	10	0		DEAEHN
COCCOCCC(=O)O[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000183175139	625294966	/nfs/dbraw/zinc/29/49/66/625294966.db2.gz	ZMCTVTPIRNPETR-QGZVFWFLSA-N	0	3	321.417	2.247	10	0		DEAEHN
CC(C)(C)OC(=O)N(CC(C)(C)CO)c1ccc(CN)nc1	ZINC000757135474	623084355	/nfs/dbraw/zinc/08/43/55/623084355.db2.gz	UALMSBOIEFOLFH-UHFFFAOYSA-N	0	3	309.410	2.300	10	0		DEAEHN
CCOC(=O)[C@@H](CC1CC1)NC(=O)[C@@H](C)N1CCCCCC1	ZINC000752385048	639178702	/nfs/dbraw/zinc/17/87/02/639178702.db2.gz	DWKZCBYOIFOBEW-UKRRQHHQSA-N	0	3	310.438	2.099	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NC[C@H](O)c1ccc(CC)cc1	ZINC000804156948	645733483	/nfs/dbraw/zinc/73/34/83/645733483.db2.gz	XPSPLCUOCBNLAH-IRXDYDNUSA-N	0	3	304.434	2.273	10	0		DEAEHN
CCOCCO[C@H]1CCN(C[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000157729661	646558473	/nfs/dbraw/zinc/55/84/73/646558473.db2.gz	LFJCLHSUCDYCSX-ZWKOTPCHSA-N	0	3	307.434	2.464	10	0		DEAEHN
CCc1cc(CNC(=O)c2cccc(CN3CCCC3)c2)[nH]n1	ZINC000732790147	647661346	/nfs/dbraw/zinc/66/13/46/647661346.db2.gz	ASHAXXDVPOALHH-UHFFFAOYSA-N	0	3	312.417	2.498	10	0		DEAEHN
CCNC(=O)NC(=O)CN[C@@H](C)c1ccc(C(C)(C)C)cc1	ZINC000154374329	647993637	/nfs/dbraw/zinc/99/36/37/647993637.db2.gz	ULAVFYBDQGPDBT-LBPRGKRZSA-N	0	3	305.422	2.480	10	0		DEAEHN
Cc1cc(N2CCN(c3ccc(Cl)cc3)CC2)nc(N)n1	ZINC000069001645	648520835	/nfs/dbraw/zinc/52/08/35/648520835.db2.gz	DEVAXUIHHONADC-UHFFFAOYSA-N	0	3	303.797	2.347	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)/C=C/c1cncc(O)c1)c1ccccc1	ZINC000181836545	648761527	/nfs/dbraw/zinc/76/15/27/648761527.db2.gz	VJEMPFQQXLDYGQ-KBOKABMXSA-N	0	3	311.385	2.220	10	0		DEAEHN
CC#CCCCCOC(=O)C1CC[C@H](C(F)(F)F)NC1=O	ZINC000183956648	649209415	/nfs/dbraw/zinc/20/94/15/649209415.db2.gz	LKTCMSMPDHBGNJ-WDEREUQCSA-N	0	3	305.296	2.180	10	0		DEAEHN
O=C(NCCN1CCCCC1)N[C@@H]1CCO[C@@H]1c1ccccc1	ZINC000083018757	683996502	/nfs/dbraw/zinc/99/65/02/683996502.db2.gz	OPSPMPPIGYUQDL-IAGOWNOFSA-N	0	3	317.433	2.302	10	0		DEAEHN
NC1(C(=O)Nc2ccc(SC(F)F)cc2)CCOCC1	ZINC000135289605	684234338	/nfs/dbraw/zinc/23/43/38/684234338.db2.gz	FILNOZYVWHBARZ-UHFFFAOYSA-N	0	3	302.346	2.448	10	0		DEAEHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2ccnc(C#N)c2)cc1	ZINC000193530882	685042716	/nfs/dbraw/zinc/04/27/16/685042716.db2.gz	WKJLCNSMCPUBCR-MRXNPFEDSA-N	0	3	318.336	2.477	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)O[C@H]1CCN(Cc2ccccc2)C1	ZINC000248749683	685166824	/nfs/dbraw/zinc/16/68/24/685166824.db2.gz	BUYJAORCVWUDOS-HYVNUMGLSA-N	0	3	303.402	2.477	10	0		DEAEHN
C[C@](O)(CN1CCC[C@@H](CO)CC1)C(F)(F)C(F)(F)F	ZINC000724041297	777229022	/nfs/dbraw/zinc/22/90/22/777229022.db2.gz	NGCWVMDLZJTNAO-ZJUUUORDSA-N	0	3	305.287	2.029	10	0		DEAEHN
C[C@@](O)(CNC[C@@H](O)c1ccsc1)C(F)(F)C(F)(F)F	ZINC000724056612	777232371	/nfs/dbraw/zinc/23/23/71/777232371.db2.gz	FPOAHKOQCXYSER-RKDXNWHRSA-N	0	3	319.295	2.320	10	0		DEAEHN
CC[C@@]1(O)CCCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724060304	777233570	/nfs/dbraw/zinc/23/35/70/777233570.db2.gz	UMAXAHWFCWJCMQ-NXEZZACHSA-N	0	3	305.287	2.172	10	0		DEAEHN
CCOC[C@H]1CCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724113660	777243885	/nfs/dbraw/zinc/24/38/85/777243885.db2.gz	GAAOOZWSTJBOBC-VHSXEESVSA-N	0	3	305.287	2.293	10	0		DEAEHN
Cc1n[nH]cc1CN[C@@H]1CN(C(=O)OC(C)(C)C)CC1(C)C	ZINC000721850088	780347503	/nfs/dbraw/zinc/34/75/03/780347503.db2.gz	QOCKVZJQHACTNM-CYBMUJFWSA-N	0	3	308.426	2.453	10	0		DEAEHN
Cn1cc(CNC2Cc3ccccc3C2)c(Br)n1	ZINC000712429387	792187663	/nfs/dbraw/zinc/18/76/63/792187663.db2.gz	AUHUKACQQGLUAQ-UHFFFAOYSA-N	0	3	306.207	2.440	10	0		DEAEHN
COCCC(C)(C)CNCc1cn(C)nc1Br	ZINC000712495838	792191048	/nfs/dbraw/zinc/19/10/48/792191048.db2.gz	JVWRBAKJINCTKN-UHFFFAOYSA-N	0	3	304.232	2.335	10	0		DEAEHN
Cc1nc(C)c([C@H](C)NCC[C@@H]2CCCS2(=O)=O)s1	ZINC000714335094	792308803	/nfs/dbraw/zinc/30/88/03/792308803.db2.gz	OXMXQZYXOQFAMD-CABZTGNLSA-N	0	3	302.465	2.378	10	0		DEAEHN
COc1ccc([C@H](C)NC2CC(S(C)(=O)=O)C2)cc1F	ZINC000716141087	792556556	/nfs/dbraw/zinc/55/65/56/792556556.db2.gz	ZPEMFJXONRROHV-GCVQQVDUSA-N	0	3	301.383	2.061	10	0		DEAEHN
CCOC(CC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)OCC	ZINC000407421150	802215731	/nfs/dbraw/zinc/21/57/31/802215731.db2.gz	LLPCYWZHDQLGNC-MRXNPFEDSA-N	0	3	320.433	2.166	10	0		DEAEHN
O=Cc1cnc(N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)nc1	ZINC000310187854	802252151	/nfs/dbraw/zinc/25/21/51/802252151.db2.gz	YZCHYQPPPCYISD-MSOLQXFVSA-N	0	3	322.412	2.247	10	0		DEAEHN
C#CCN1CCC(C(=O)N[C@@H](C)Cc2ccccc2OC)CC1	ZINC000057177369	1078730932	/nfs/dbraw/zinc/73/09/32/1078730932.db2.gz	PUMLEXUBKZMSLB-HNNXBMFYSA-N	0	3	314.429	2.088	10	0		DEAEHN
Cn1cc(CN[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c(Br)n1	ZINC000720657863	1085818903	/nfs/dbraw/zinc/81/89/03/1085818903.db2.gz	VMRXBLNYRQGENH-HBNTYKKESA-N	0	3	314.227	2.086	10	0		DEAEHN
CC(C)[C@H]1C[C@H](NCc2cn(C)nc2Br)CCO1	ZINC000720661162	1085821477	/nfs/dbraw/zinc/82/14/77/1085821477.db2.gz	QZIZVPUMQPWEQO-VXGBXAGGSA-N	0	3	316.243	2.476	10	0		DEAEHN
C[C@@H]1CN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)C(C)(C)C1	ZINC000702337960	1086424836	/nfs/dbraw/zinc/42/48/36/1086424836.db2.gz	KWIGOOINYIPWAG-HOCLYGCPSA-N	0	3	303.450	2.093	10	0		DEAEHN
COC[C@H](C)OC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1	ZINC000704424505	1086580627	/nfs/dbraw/zinc/58/06/27/1086580627.db2.gz	LXSKSDKQEQSBCM-YCPHGPKFSA-N	0	3	306.406	2.411	10	0		DEAEHN
COC[C@@H](C)OC(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000704469439	1086581089	/nfs/dbraw/zinc/58/10/89/1086581089.db2.gz	AOYUBXKMOXISDQ-PBHICJAKSA-N	0	3	306.406	2.412	10	0		DEAEHN
CC(C)(C)OC(=O)NCC1(NCc2ccoc2)CCOCC1	ZINC000705610048	1086619283	/nfs/dbraw/zinc/61/92/83/1086619283.db2.gz	WGPGDHRQDVWDRK-UHFFFAOYSA-N	0	3	310.394	2.443	10	0		DEAEHN
COC1(OC)CC[C@H]1NC[C@H](NC(=O)OC(C)(C)C)C1CC1	ZINC000710948452	1086691739	/nfs/dbraw/zinc/69/17/39/1086691739.db2.gz	RZVPWCYBENGNQU-QWHCGFSZSA-N	0	3	314.426	2.031	10	0		DEAEHN
C[C@H](CNCc1nccn1C1CC1)CNC(=O)OC(C)(C)C	ZINC000711753146	1087195232	/nfs/dbraw/zinc/19/52/32/1087195232.db2.gz	UIZREXHJTUWNLJ-GFCCVEGCSA-N	0	3	308.426	2.468	10	0		DEAEHN
CCn1cc(Br)cc1C(=O)N[C@H]1CCN(C)[C@@H]1C	ZINC000719383946	1089078201	/nfs/dbraw/zinc/07/82/01/1089078201.db2.gz	AMSBSUANHLGKIO-KOLCDFICSA-N	0	3	314.227	2.093	10	0		DEAEHN
CCCN[C@H]1c2ccccc2OC[C@@H]1Sc1nncn1C	ZINC000081866886	192332786	/nfs/dbraw/zinc/33/27/86/192332786.db2.gz	PVFZBLKJYUOFKE-KBPBESRZSA-N	0	3	304.419	2.409	10	0		DEAEHN
N[C@@H]1CCCC[C@H]1S(=O)(=O)c1ccccc1Br	ZINC000081932002	192340600	/nfs/dbraw/zinc/34/06/00/192340600.db2.gz	MBIBISLNBXKBIZ-ZYHUDNBSSA-N	0	3	318.236	2.493	10	0		DEAEHN
Cc1cnc(CN(C)C[C@@H]2CCCN(C)[C@H]2c2cnn(C)c2)o1	ZINC000328626673	231258947	/nfs/dbraw/zinc/25/89/47/231258947.db2.gz	FIPOSHJBGDWDOG-WMLDXEAASA-N	0	3	317.437	2.231	10	0		DEAEHN
COc1ccc(CS(=O)(=O)c2ccc(F)cc2)cc1CN	ZINC000087833044	185232833	/nfs/dbraw/zinc/23/28/33/185232833.db2.gz	MCDJNSFFZVUFGF-UHFFFAOYSA-N	0	3	309.362	2.267	10	0		DEAEHN
COc1ccc(CS(=O)(=O)c2cccc(C)c2)cc1CN	ZINC000087833068	185232856	/nfs/dbraw/zinc/23/28/56/185232856.db2.gz	KUZGUBVJLSVOOJ-UHFFFAOYSA-N	0	3	305.399	2.436	10	0		DEAEHN
COCC[C@@H](N)C(=O)Nc1c(F)cc(Br)cc1F	ZINC000088168573	185240894	/nfs/dbraw/zinc/24/08/94/185240894.db2.gz	MYCITJBNERNPHC-SECBINFHSA-N	0	3	323.137	2.030	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(OC[C@@H]2CCCCN2C)n1	ZINC000088165593	185240918	/nfs/dbraw/zinc/24/09/18/185240918.db2.gz	QLEBNKZXFMTAAI-NSHDSACASA-N	0	3	313.833	2.234	10	0		DEAEHN
CCN[C@@H]1CCN(c2c(F)cc(Br)cc2F)C1=O	ZINC000088171598	185241023	/nfs/dbraw/zinc/24/10/23/185241023.db2.gz	NQYKQIGWQJMQNH-SNVBAGLBSA-N	0	3	319.149	2.442	10	0		DEAEHN
CN(C)C[C@H](O)CNc1c(F)cc(Br)cc1F	ZINC000088170823	185241061	/nfs/dbraw/zinc/24/10/61/185241061.db2.gz	GWTVWVPVYWYCDT-MRVPVSSYSA-N	0	3	309.154	2.062	10	0		DEAEHN
CC[C@@H](C)Oc1cccc(NS(=O)(=O)[C@H](CC)CN)c1	ZINC000088473797	185252127	/nfs/dbraw/zinc/25/21/27/185252127.db2.gz	NMJPYDVJVFBFSN-BXUZGUMPSA-N	0	3	300.424	2.343	10	0		DEAEHN
CC[C@H](CN)S(=O)(=O)Nc1ccc(N2CCCCC2)cc1	ZINC000088474047	185252367	/nfs/dbraw/zinc/25/23/67/185252367.db2.gz	GIEWKYNGAVAZDI-OAHLLOKOSA-N	0	3	311.451	2.156	10	0		DEAEHN
NCc1cccc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)c1	ZINC000088419168	185249538	/nfs/dbraw/zinc/24/95/38/185249538.db2.gz	XEQVXTCTBREAHL-NSHDSACASA-N	0	3	322.352	2.108	10	0		DEAEHN
COC(=O)[C@](C)(N)CCCCN1CCC(C(F)(F)F)CC1	ZINC000088435490	185250228	/nfs/dbraw/zinc/25/02/28/185250228.db2.gz	OCBZHGJEMLGKEE-CYBMUJFWSA-N	0	3	310.360	2.321	10	0		DEAEHN
CCOC(=O)[C@](C)(N)C[C@@H](C)N1CCC(C(F)(F)F)CC1	ZINC000088435421	185250242	/nfs/dbraw/zinc/25/02/42/185250242.db2.gz	PZGGVLMNQIUUBC-ZWNOBZJWSA-N	0	3	310.360	2.320	10	0		DEAEHN
CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(S(=O)(=O)[N-]C)o1	ZINC000088540205	185255682	/nfs/dbraw/zinc/25/56/82/185255682.db2.gz	NJCSLEOPHBJAAP-DGCLKSJQSA-N	0	3	300.424	2.246	10	0		DEAEHN
C[C@@H]1CC[C@H](NCc2ccc(S(=O)(=O)N(C)C)o2)[C@@H]1C	ZINC000088540947	185255940	/nfs/dbraw/zinc/25/59/40/185255940.db2.gz	YGJUIRQACPYPKM-WZRBSPASSA-N	0	3	300.424	2.054	10	0		DEAEHN
C[N-]S(=O)(=O)c1ccc(C[NH2+][C@@H]2CCCCC[C@@H]2C)o1	ZINC000088541012	185255942	/nfs/dbraw/zinc/25/59/42/185255942.db2.gz	DOTPCDUUJKIKJJ-WCQYABFASA-N	0	3	300.424	2.246	10	0		DEAEHN
CCCN[C@@H](c1ccc(COC)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000088567524	185258348	/nfs/dbraw/zinc/25/83/48/185258348.db2.gz	RGSYOTKTDPYZEN-CVEARBPZSA-N	0	3	311.447	2.308	10	0		DEAEHN
CCOC(=O)[C@@H]1CNCCN1[C@@H](C)c1ccc(F)c(Cl)c1	ZINC000088657782	185261789	/nfs/dbraw/zinc/26/17/89/185261789.db2.gz	QYSSRLZBZBFRSD-HZMBPMFUSA-N	0	3	314.788	2.377	10	0		DEAEHN
CN[C@@H](CS(=O)(=O)c1cccc(Br)c1)C1CC1	ZINC000081982626	192349189	/nfs/dbraw/zinc/34/91/89/192349189.db2.gz	NOHRRODNMAQSAN-LBPRGKRZSA-N	0	3	318.236	2.221	10	0		DEAEHN
COc1ccc(CN)cc1CS(=O)(=O)c1cccc(C)c1	ZINC000081986641	192349822	/nfs/dbraw/zinc/34/98/22/192349822.db2.gz	QEVOMHWBEXVCFT-UHFFFAOYSA-N	0	3	305.399	2.436	10	0		DEAEHN
CN[C@H](CS(=O)(=O)c1cccc(Br)c1)C1CC1	ZINC000081982628	192349985	/nfs/dbraw/zinc/34/99/85/192349985.db2.gz	NOHRRODNMAQSAN-GFCCVEGCSA-N	0	3	318.236	2.221	10	0		DEAEHN
CCOC(=O)CC[C@H](C)NC(=O)c1cccc(CN(C)C)c1	ZINC000090002951	185276357	/nfs/dbraw/zinc/27/63/57/185276357.db2.gz	ZNCBZIINRMEKCP-ZDUSSCGKSA-N	0	3	306.406	2.210	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@@H]1CCCN(C(C)C)C1=O	ZINC000178288969	282217734	/nfs/dbraw/zinc/21/77/34/282217734.db2.gz	WQSGLMIORYSFER-HZPDHXFCSA-N	0	3	304.438	2.055	10	0		DEAEHN
N[C@@H]1COC[C@@H]1C(=O)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000090378789	185293483	/nfs/dbraw/zinc/29/34/83/185293483.db2.gz	NWRLQVUZIALKKI-IONNQARKSA-N	0	3	308.687	2.271	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1c1nc(-c2ccccc2Br)no1	ZINC000090423581	185295465	/nfs/dbraw/zinc/29/54/65/185295465.db2.gz	YPNHTPBCOZIYFH-GXSJLCMTSA-N	0	3	324.178	2.201	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1ccc(OC(F)F)c(Cl)c1	ZINC000090436572	185296219	/nfs/dbraw/zinc/29/62/19/185296219.db2.gz	SPRCFJLCMGKOEU-WPRPVWTQSA-N	0	3	320.723	2.114	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)N(C)Cc1cccc(Cl)c1Cl	ZINC000090434500	185296290	/nfs/dbraw/zinc/29/62/90/185296290.db2.gz	BDNIFCNOJVDLAZ-ZYHUDNBSSA-N	0	3	317.216	2.186	10	0		DEAEHN
C[C@@]1(C(=O)Nc2nc3ccc(Cl)cc3s2)COC[C@@H]1N	ZINC000090580319	185304928	/nfs/dbraw/zinc/30/49/28/185304928.db2.gz	LFBCPXSGCSWRBI-GXFFZTMASA-N	0	3	311.794	2.252	10	0		DEAEHN
CN(Cc1cccc(Cl)c1Cl)C(=O)[C@@]1(C)COC[C@H]1N	ZINC000090590398	185305520	/nfs/dbraw/zinc/30/55/20/185305520.db2.gz	PZBWAJLGHVLQKU-RISCZKNCSA-N	0	3	317.216	2.316	10	0		DEAEHN
CCC(C)(C)NC(=O)CN1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1	ZINC000179511296	282227593	/nfs/dbraw/zinc/22/75/93/282227593.db2.gz	FVJUKMTZZGASKQ-CYBMUJFWSA-N	0	3	319.453	2.166	10	0		DEAEHN
CCC(C)(C)NC(=O)CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1	ZINC000179511296	282227597	/nfs/dbraw/zinc/22/75/97/282227597.db2.gz	FVJUKMTZZGASKQ-CYBMUJFWSA-N	0	3	319.453	2.166	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(Cl)ccc1NN	ZINC000092675442	185333112	/nfs/dbraw/zinc/33/31/12/185333112.db2.gz	PLUKTRBCHGUYQP-GFCCVEGCSA-N	0	3	310.829	2.182	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Cc2ccccc2C(F)(F)F)C1	ZINC000171508543	282261108	/nfs/dbraw/zinc/26/11/08/282261108.db2.gz	XQOFQSBLGVFTED-LBPRGKRZSA-N	0	3	300.324	2.410	10	0		DEAEHN
Cc1oc(C)c(S(=O)(=O)NC2C(C)(C)C2(C)C)c1CN	ZINC000092833195	185344850	/nfs/dbraw/zinc/34/48/50/185344850.db2.gz	UAWZQOZMDMSUEK-UHFFFAOYSA-N	0	3	300.424	2.068	10	0		DEAEHN
C[C@@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccncc1	ZINC000036954910	539335034	/nfs/dbraw/zinc/33/50/34/539335034.db2.gz	DYKRVXSUSZVVNO-NWDGAFQWSA-N	0	3	305.403	2.141	10	0		DEAEHN
CN(CC(=O)OC(C)(C)C)C1CCN(Cc2cccnc2)CC1	ZINC000187667945	282288141	/nfs/dbraw/zinc/28/81/41/282288141.db2.gz	SMAJEDLZLIVBRR-UHFFFAOYSA-N	0	3	319.449	2.320	10	0		DEAEHN
C[C@H]1CC[C@@](CO)(N(C)CC(=O)NCc2cccc(Cl)c2)C1	ZINC000187903868	282294444	/nfs/dbraw/zinc/29/44/44/282294444.db2.gz	GRHUFKMHJSWFHI-SUMWQHHRSA-N	0	3	324.852	2.439	10	0		DEAEHN
C[C@H]1CCCC[C@H]1CN1CCN(c2ccc3nncn3n2)CC1	ZINC000183054611	199528688	/nfs/dbraw/zinc/52/86/88/199528688.db2.gz	UIQXKNZYPZUDAV-GJZGRUSLSA-N	0	3	314.437	2.073	10	0		DEAEHN
C[C@H](c1ccccc1)N1CC[C@H](NCc2cc(C(N)=O)co2)C1	ZINC000189414806	282309221	/nfs/dbraw/zinc/30/92/21/282309221.db2.gz	IACABQHFYRYDID-CJNGLKHVSA-N	0	3	313.401	2.304	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccccc2CCOC)C1	ZINC000189469199	282310810	/nfs/dbraw/zinc/31/08/10/282310810.db2.gz	NOOIYTINBCVOSV-HNNXBMFYSA-N	0	3	305.422	2.481	10	0		DEAEHN
CN(C)C(=O)COc1ccccc1CNC[C@H]1CCC(C)(C)O1	ZINC000189723611	282316801	/nfs/dbraw/zinc/31/68/01/282316801.db2.gz	NONADWSDUZXGRI-OAHLLOKOSA-N	0	3	320.433	2.201	10	0		DEAEHN
COc1cc(Br)ccc1[C@H](C)NCCOCCO	ZINC000190440453	282320922	/nfs/dbraw/zinc/32/09/22/282320922.db2.gz	HHHLJPQDMPGFTO-JTQLQIEISA-N	0	3	318.211	2.117	10	0		DEAEHN
CC[C@H]1CN(C)CCCN1C(=O)c1cc(-c2ccoc2)n[nH]1	ZINC000614335505	362353658	/nfs/dbraw/zinc/35/36/58/362353658.db2.gz	PSWMGAWYZPSAEY-ZDUSSCGKSA-N	0	3	302.378	2.226	10	0		DEAEHN
Cc1ccc2occ(/C=C/C(=O)NCCCN(C)C)c(=O)c2c1	ZINC000170565100	197779069	/nfs/dbraw/zinc/77/90/69/197779069.db2.gz	VIGFWGLCZGUGGU-SOFGYWHQSA-N	0	3	314.385	2.183	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1cc(C2CC2)on1	ZINC000193402470	282349785	/nfs/dbraw/zinc/34/97/85/282349785.db2.gz	VVAHVKJOBHFWNC-OAHLLOKOSA-N	0	3	313.401	2.455	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)c1cc(C2CC2)on1	ZINC000193402485	282349869	/nfs/dbraw/zinc/34/98/69/282349869.db2.gz	VVAHVKJOBHFWNC-HNNXBMFYSA-N	0	3	313.401	2.455	10	0		DEAEHN
COC[C@@H](NC[C@@]1(CCO)CCOC1)c1ccc(Cl)cc1	ZINC000194083413	282362412	/nfs/dbraw/zinc/36/24/12/282362412.db2.gz	SAMSBBVHBSQBAC-HZPDHXFCSA-N	0	3	313.825	2.406	10	0		DEAEHN
C[C@@H](NCc1nccn1C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000279659951	215040407	/nfs/dbraw/zinc/04/04/07/215040407.db2.gz	DBGYAVRWKHUZAG-CHWSQXEVSA-N	0	3	308.426	2.155	10	0		DEAEHN
CSC[C@H]1CCCN1C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000121395297	185792739	/nfs/dbraw/zinc/79/27/39/185792739.db2.gz	FSYJKXJHGLNWND-ZIAGYGMSSA-N	0	3	301.500	2.500	10	0		DEAEHN
Cc1nn(C)c(C)c1CCCNC(=O)[C@H](C)N1CCCCCC1	ZINC000180372831	539645198	/nfs/dbraw/zinc/64/51/98/539645198.db2.gz	QJCZKJQTGQTVLP-INIZCTEOSA-N	0	3	320.481	2.350	10	0		DEAEHN
OCC[C@]1(CN[C@H]2CCCOc3cc(F)ccc32)CCOC1	ZINC000182122666	539655418	/nfs/dbraw/zinc/65/54/18/539655418.db2.gz	KTSGUZIPCCLMJK-DOTOQJQBSA-N	0	3	309.381	2.418	10	0		DEAEHN
CNC(=O)[C@H](NCCOc1ccc(F)cc1Cl)C(C)C	ZINC000183638342	539663867	/nfs/dbraw/zinc/66/38/67/539663867.db2.gz	JZMXQAFIZMQAOW-CYBMUJFWSA-N	0	3	302.777	2.218	10	0		DEAEHN
CN(CCN1CCN(CC2CC2)CC1)Cc1ccc(F)cc1	ZINC000185192740	539671145	/nfs/dbraw/zinc/67/11/45/539671145.db2.gz	LEKOJLKNVZWYSH-UHFFFAOYSA-N	0	3	305.441	2.285	10	0		DEAEHN
CN[C@@H](c1sc(C)cc1Br)[C@H]1COCCO1	ZINC000083678378	192377401	/nfs/dbraw/zinc/37/74/01/192377401.db2.gz	ZRCSAXKMQLGOEB-NXEZZACHSA-N	0	3	306.225	2.495	10	0		DEAEHN
CC(=O)Nc1cccc([C@H](C)NC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000170828588	197831316	/nfs/dbraw/zinc/83/13/16/197831316.db2.gz	SZODTJVXMFHNGM-LRDDRELGSA-N	0	3	318.421	2.052	10	0		DEAEHN
Cc1nn(C)c(C)c1CCN1Cc2cc(F)cc(F)c2[C@H]1CN	ZINC000071683261	191007401	/nfs/dbraw/zinc/00/74/01/191007401.db2.gz	RWKRWWOLPZVIPM-MRXNPFEDSA-N	0	3	320.387	2.373	10	0		DEAEHN
NC[C@@H]1c2cc(OCc3ccccc3)ccc2CN1CCCO	ZINC000071684835	191008190	/nfs/dbraw/zinc/00/81/90/191008190.db2.gz	YEWWIQDPFKIVKQ-LJQANCHMSA-N	0	3	312.413	2.463	10	0		DEAEHN
C[C@@H]1CCC[C@H](C)N1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138363198	186016124	/nfs/dbraw/zinc/01/61/24/186016124.db2.gz	BIYHFQPEQKKNTL-AOOOYVTPSA-N	0	3	318.389	2.375	10	0		DEAEHN
CCCN(C(C)C)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138450554	186016967	/nfs/dbraw/zinc/01/69/67/186016967.db2.gz	LSIALVXRVURHPR-UHFFFAOYSA-N	0	3	320.405	2.493	10	0		DEAEHN
C[C@H]1CCC[C@@](N)(c2nc3c(cccc3S(C)(=O)=O)[nH]2)C1	ZINC000138157007	186014413	/nfs/dbraw/zinc/01/44/13/186014413.db2.gz	QMZYXUVYRIGUIP-BONVTDFDSA-N	0	3	307.419	2.331	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@@H](CC(C)C)C(=O)N2CCN(C)C)s1	ZINC000140032975	186025196	/nfs/dbraw/zinc/02/51/96/186025196.db2.gz	QOBTUIVOHDKCPI-DZGCQCFKSA-N	0	3	309.479	2.463	10	0		DEAEHN
Cc1ccc([C@@H](O)c2c(Cl)cnn2CCN(C)C)c(C)n1	ZINC000140167391	186025946	/nfs/dbraw/zinc/02/59/46/186025946.db2.gz	RCAXQVQILZGYPR-OAHLLOKOSA-N	0	3	308.813	2.192	10	0		DEAEHN
COc1ccc(OC)c([C@@H]2CCCN2CCCNC(C)=O)c1	ZINC000142791821	186032311	/nfs/dbraw/zinc/03/23/11/186032311.db2.gz	IUOIPTWCFODNPD-INIZCTEOSA-N	0	3	306.406	2.367	10	0		DEAEHN
CCCCCN(C)[C@]1(CN)CCS(=O)(=O)c2ccccc21	ZINC000147643568	186040703	/nfs/dbraw/zinc/04/07/03/186040703.db2.gz	HTOSLCGXNJWFIM-INIZCTEOSA-N	0	3	310.463	2.140	10	0		DEAEHN
Cc1c(CNC2CC2)cccc1S(=O)(=O)N(C)C1CCC1	ZINC000144624261	186035838	/nfs/dbraw/zinc/03/58/38/186035838.db2.gz	NERTYZVQKJLNQT-UHFFFAOYSA-N	0	3	308.447	2.420	10	0		DEAEHN
N[C@H](Cc1nc(-c2ccccc2)cs1)[C@@H]1CCS(=O)(=O)C1	ZINC000150001612	186054286	/nfs/dbraw/zinc/05/42/86/186054286.db2.gz	SSVZVNYXZSRYLS-CHWSQXEVSA-N	0	3	322.455	2.115	10	0		DEAEHN
CCCN[C@@H]1CCCc2nc([C@@H]3CCS(=O)(=O)C3)sc21	ZINC000150257782	186055902	/nfs/dbraw/zinc/05/59/02/186055902.db2.gz	CYDLNXBLKFDMJS-GHMZBOCLSA-N	0	3	314.476	2.422	10	0		DEAEHN
CCCN[C@H]1CCCc2nc([C@@H]3CCS(=O)(=O)C3)sc21	ZINC000150257988	186056386	/nfs/dbraw/zinc/05/63/86/186056386.db2.gz	CYDLNXBLKFDMJS-MNOVXSKESA-N	0	3	314.476	2.422	10	0		DEAEHN
CC(C(=O)Nc1cccc(Cl)c1-n1cccn1)=C1CNC1	ZINC000164122014	186149217	/nfs/dbraw/zinc/14/92/17/186149217.db2.gz	WZCBQBYWADBQJM-UHFFFAOYSA-N	0	3	302.765	2.384	10	0		DEAEHN
COc1cc(CNC[C@H](C)[S@@](C)=O)cc(Cl)c1OC	ZINC000159692618	186135998	/nfs/dbraw/zinc/13/59/98/186135998.db2.gz	SLNMNGBDUSLLQT-UGZDLDLSSA-N	0	3	305.827	2.214	10	0		DEAEHN
CN[C@@H](c1cccc2cnccc21)[C@@H]1CCCCS1(=O)=O	ZINC000164322451	186155723	/nfs/dbraw/zinc/15/57/23/186155723.db2.gz	PXVTUQPLQLNBHK-HOTGVXAUSA-N	0	3	304.415	2.463	10	0		DEAEHN
O=C(C(=O)N1CCCC[C@H](N2CCCC2)C1)c1ccccc1	ZINC000194279305	186276224	/nfs/dbraw/zinc/27/62/24/186276224.db2.gz	VRLKZJSKSIHDHT-INIZCTEOSA-N	0	3	300.402	2.346	10	0		DEAEHN
COc1ccc(C)cc1CCNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171899153	198003916	/nfs/dbraw/zinc/00/39/16/198003916.db2.gz	GCYZWDPAMRDIBH-MRXNPFEDSA-N	0	3	317.433	2.036	10	0		DEAEHN
CC[C@H](NC(=O)N1CCN2CCC[C@@H]2C1)c1nc(C)cs1	ZINC000171907509	198006448	/nfs/dbraw/zinc/00/64/48/198006448.db2.gz	WFJJNDOUPUTPRQ-OLZOCXBDSA-N	0	3	308.451	2.392	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2cc3cc(F)ccc3s2)CCO1	ZINC000172306468	198076380	/nfs/dbraw/zinc/07/63/80/198076380.db2.gz	YYTLNIXPHJEBLI-CYBMUJFWSA-N	0	3	322.405	2.443	10	0		DEAEHN
C[C@H](c1nc2ccccc2c(=O)[nH]1)N1CCN2CCCC[C@@H]2C1	ZINC000172805670	198151983	/nfs/dbraw/zinc/15/19/83/198151983.db2.gz	TYWZSOSMGNAFBV-ZIAGYGMSSA-N	0	3	312.417	2.154	10	0		DEAEHN
CCOC(=O)CCN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000173214259	198196342	/nfs/dbraw/zinc/19/63/42/198196342.db2.gz	RVUSEMNFFFAMJY-UHFFFAOYSA-N	0	3	318.417	2.142	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(F)cc2)[C@H](C)C1	ZINC000173261325	198202794	/nfs/dbraw/zinc/20/27/94/198202794.db2.gz	GJXUXZICTHXNEU-DOMZBBRYSA-N	0	3	314.426	2.177	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)S(=O)(=O)Cc2ccc(F)cc2)CCN1C	ZINC000173269694	198204998	/nfs/dbraw/zinc/20/49/98/198204998.db2.gz	ARYZUZAKNGLRSD-IUODEOHRSA-N	0	3	314.426	2.070	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCCc2ccccc2F)CCN1C	ZINC000173441456	198215669	/nfs/dbraw/zinc/21/56/69/198215669.db2.gz	NFCHJFZKIJOORC-UKRRQHHQSA-N	0	3	307.413	2.492	10	0		DEAEHN
C[C@H](CCc1ccccc1F)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000173522606	198223870	/nfs/dbraw/zinc/22/38/70/198223870.db2.gz	LDTMNMKMXACDEL-ZBFHGGJFSA-N	0	3	322.424	2.183	10	0		DEAEHN
c1c[nH]c([C@H](N[C@@H]2CCc3nnnn3CC2)C2CCCCC2)n1	ZINC000333707449	539969763	/nfs/dbraw/zinc/96/97/63/539969763.db2.gz	HXNROJMACJLFRH-UKRRQHHQSA-N	0	3	315.425	2.012	10	0		DEAEHN
CCn1nc(C)c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1Cl	ZINC000173744208	198247905	/nfs/dbraw/zinc/24/79/05/198247905.db2.gz	SGDWTZWXWYUQDG-JQWIXIFHSA-N	0	3	310.829	2.174	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCc2cccc3c2OCO3)CCN1C	ZINC000174225014	198308504	/nfs/dbraw/zinc/30/85/04/198308504.db2.gz	VGZKJXRNGBTJDB-JSGCOSHPSA-N	0	3	319.405	2.039	10	0		DEAEHN
CSc1nc(C2CC2)nc(C)c1C(=O)N1CC[C@@H](N(C)C)C1	ZINC000174583959	198355804	/nfs/dbraw/zinc/35/58/04/198355804.db2.gz	SJNXBIWRKYNAFA-GFCCVEGCSA-N	0	3	320.462	2.160	10	0		DEAEHN
COc1cc2c(cc1OC)[C@H](CC(=O)NCC(C)C)NCC2	ZINC000041536466	354175172	/nfs/dbraw/zinc/17/51/72/354175172.db2.gz	KRHHHZOJKIVSRB-AWEZNQCLSA-N	0	3	306.406	2.053	10	0		DEAEHN
CCOc1ccccc1NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000043332387	354219744	/nfs/dbraw/zinc/21/97/44/354219744.db2.gz	ABUUTOOHNDAWEB-CQSZACIVSA-N	0	3	321.421	2.054	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cn(C)nc2C(C)(C)C)CCN1C	ZINC000092814750	291059940	/nfs/dbraw/zinc/05/99/40/291059940.db2.gz	MEUGAMFJJKKYQF-STQMWFEESA-N	0	3	306.454	2.272	10	0		DEAEHN
c1ccc(N2CCC(NCc3nnc4ccccn43)CC2)cc1	ZINC000378895350	540121424	/nfs/dbraw/zinc/12/14/24/540121424.db2.gz	VXPGBPHQYHWJGH-UHFFFAOYSA-N	0	3	307.401	2.488	10	0		DEAEHN
C[C@H](N[C@H]1CCC(F)(F)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000380307162	540122312	/nfs/dbraw/zinc/12/23/12/540122312.db2.gz	JGVGZAXCGDBZLU-ONGXEEELSA-N	0	3	304.362	2.172	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCC[C@H]([C@@H](C)O)C1	ZINC000089930754	355548552	/nfs/dbraw/zinc/54/85/52/355548552.db2.gz	ZYHGCCHTMRFKSZ-WBVHZDCISA-N	0	3	304.434	2.128	10	0		DEAEHN
O=C1[C@H](N[C@@H]2CCCc3sccc32)CCN1C1CCOCC1	ZINC000367412116	283113809	/nfs/dbraw/zinc/11/38/09/283113809.db2.gz	GJNWUIYIKVSTKM-HUUCEWRRSA-N	0	3	320.458	2.495	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)Nc1cnc(C2CC2)nc1	ZINC000103240221	355715549	/nfs/dbraw/zinc/71/55/49/355715549.db2.gz	MMHURZOJTHZXFT-GFCCVEGCSA-N	0	3	303.410	2.350	10	0		DEAEHN
CCN1CCO[C@H](CNCc2ccc(Br)cc2)C1	ZINC000113266980	355758273	/nfs/dbraw/zinc/75/82/73/355758273.db2.gz	IPJPICUKAFHZRE-CQSZACIVSA-N	0	3	313.239	2.259	10	0		DEAEHN
C[C@@]1(CN(Cc2ccccc2)Cc2ccccc2)NC(=O)NC1=O	ZINC000149755685	355919614	/nfs/dbraw/zinc/91/96/14/355919614.db2.gz	WNEOEWOGCKRZSL-IBGZPJMESA-N	0	3	323.396	2.287	10	0		DEAEHN
Cc1noc(C)c1C[C@@H](C)NC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000156762523	355953920	/nfs/dbraw/zinc/95/39/20/355953920.db2.gz	UWZXDRYJKDQFKL-DOMZBBRYSA-N	0	3	324.469	2.498	10	0		DEAEHN
CC(C)(C)OC(=O)CCCCN1CC[C@](O)(C(F)(F)F)C1	ZINC000181965498	356102976	/nfs/dbraw/zinc/10/29/76/356102976.db2.gz	WZENSDAWXCLNKK-CYBMUJFWSA-N	0	3	311.344	2.498	10	0		DEAEHN
C[C@@H](NCc1cc(=O)n2ccccc2n1)[C@@H]1COc2ccccc21	ZINC000185620470	356208574	/nfs/dbraw/zinc/20/85/74/356208574.db2.gz	YGCGPOSJZZTGCU-CJNGLKHVSA-N	0	3	321.380	2.349	10	0		DEAEHN
CCn1c(C)nnc1CN1CCN(CC2CCCCC2)CC1	ZINC000195114383	356249697	/nfs/dbraw/zinc/24/96/97/356249697.db2.gz	ZNUQGEFRUBPRSD-UHFFFAOYSA-N	0	3	305.470	2.304	10	0		DEAEHN
Cc1ccc2ncnc(N3CCN(CC(C)(C)O)C[C@H]3C)c2c1	ZINC000249064725	356327002	/nfs/dbraw/zinc/32/70/02/356327002.db2.gz	IEDUGODNHBJSMX-CQSZACIVSA-N	0	3	314.433	2.220	10	0		DEAEHN
CN(C[C@H]1CCCN(C)C1)C(=O)c1coc(Br)c1	ZINC000265215884	356346612	/nfs/dbraw/zinc/34/66/12/356346612.db2.gz	CARYGALSOXTBAB-JTQLQIEISA-N	0	3	315.211	2.456	10	0		DEAEHN
CCn1cnnc1CN[C@@H](C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000400469323	283157211	/nfs/dbraw/zinc/15/72/11/283157211.db2.gz	XEVPYIZFGXOIQA-QWHCGFSZSA-N	0	3	323.441	2.033	10	0		DEAEHN
Brc1cc(CN2CC[C@H]3OCCN[C@@H]3C2)cs1	ZINC000404261627	283164770	/nfs/dbraw/zinc/16/47/70/283164770.db2.gz	OLCPBIJSFNUCAK-GHMZBOCLSA-N	0	3	317.252	2.073	10	0		DEAEHN
C[C@@H](CNc1nnc(Br)s1)CN1CCCC1	ZINC000081664929	192308779	/nfs/dbraw/zinc/30/87/79/192308779.db2.gz	HVZIUPLVIIQASR-QMMMGPOBSA-N	0	3	305.245	2.444	10	0		DEAEHN
CC(C)(C)c1ccc(CN[C@H]2CCN(S(C)(=O)=O)C2)s1	ZINC000400325233	356723196	/nfs/dbraw/zinc/72/31/96/356723196.db2.gz	ZOEPJBAVGCGCKF-NSHDSACASA-N	0	3	316.492	2.169	10	0		DEAEHN
NC[C@@H]1c2ccccc2CCN1C(=O)COCc1ccccc1	ZINC000404411581	356733217	/nfs/dbraw/zinc/73/32/17/356733217.db2.gz	PALJGAHBGTVGGG-GOSISDBHSA-N	0	3	310.397	2.288	10	0		DEAEHN
O=C1CCCN1CCNCc1ccc(Br)c(F)c1	ZINC000405355035	356734794	/nfs/dbraw/zinc/73/47/94/356734794.db2.gz	HVBPWKKTFVHMIO-UHFFFAOYSA-N	0	3	315.186	2.300	10	0		DEAEHN
c1cnn(-c2cccc(CN3CC[C@@H](Nc4ncccn4)C3)c2)c1	ZINC000578771039	356870923	/nfs/dbraw/zinc/87/09/23/356870923.db2.gz	HRYMXCOMVNJELY-MRXNPFEDSA-N	0	3	320.400	2.349	10	0		DEAEHN
NCc1csc(S(=O)(=O)N2CCCc3ccccc32)c1	ZINC000088925016	192657867	/nfs/dbraw/zinc/65/78/67/192657867.db2.gz	NEPBCWZKFBOEKT-UHFFFAOYSA-N	0	3	308.428	2.348	10	0		DEAEHN
CC(C)n1cc(CN(C)[C@@H]2CCCN(c3cccnn3)C2)cn1	ZINC000179496534	199045014	/nfs/dbraw/zinc/04/50/14/199045014.db2.gz	APIPGKKIZDKMMP-MRXNPFEDSA-N	0	3	314.437	2.355	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1ccc(Cl)cn1	ZINC000181026885	199242693	/nfs/dbraw/zinc/24/26/93/199242693.db2.gz	VREFHFAFZSRDOM-AWEZNQCLSA-N	0	3	310.829	2.361	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)N(C)C[C@H]1CCCN(C)C1	ZINC000187484297	200118011	/nfs/dbraw/zinc/11/80/11/200118011.db2.gz	CGWOBPILTOMMPQ-KGLIPLIRSA-N	0	3	320.437	2.134	10	0		DEAEHN
CN(C[C@@H](O)COc1cccc2[nH]ccc21)C[C@@H]1CCCO1	ZINC000187816820	200160619	/nfs/dbraw/zinc/16/06/19/200160619.db2.gz	PVMMTQGREUXNML-KGLIPLIRSA-N	0	3	304.390	2.018	10	0		DEAEHN
C[C@H]1CC[C@@](CO)(N(C)CC(=O)N(C)Cc2ccc(F)cc2)C1	ZINC000187923893	200177401	/nfs/dbraw/zinc/17/74/01/200177401.db2.gz	FRTGOALJEYEQDQ-KBXCAEBGSA-N	0	3	322.424	2.267	10	0		DEAEHN
CCOc1cccc2[nH]cc(CC(=O)NC[C@@H]3CCCN3C)c21	ZINC000187938342	200180197	/nfs/dbraw/zinc/18/01/97/200180197.db2.gz	ZZTPTRBAEXCURO-AWEZNQCLSA-N	0	3	315.417	2.320	10	0		DEAEHN
CCC[C@@H](C(=O)NCC1(CC(=O)OC)CCCCC1)N(C)C	ZINC000186558528	283472183	/nfs/dbraw/zinc/47/21/83/283472183.db2.gz	SQGJHFKGWRLTTF-AWEZNQCLSA-N	0	3	312.454	2.347	10	0		DEAEHN
C[C@@H](NC(=O)N[C@@H]1CCN(C2CC2)C1)c1ccc2c(c1)OCO2	ZINC000604165058	360887499	/nfs/dbraw/zinc/88/74/99/360887499.db2.gz	YPKJDZTTZDNROZ-DGCLKSJQSA-N	0	3	317.389	2.012	10	0		DEAEHN
Cc1cnn(CCN2CCC[C@H](c3nnc4ccccn43)C2)c1	ZINC000606435585	361006425	/nfs/dbraw/zinc/00/64/25/361006425.db2.gz	TYPASOMHZTYERR-HNNXBMFYSA-N	0	3	310.405	2.114	10	0		DEAEHN
Cc1cnc(CN(C)C[C@@H]2CCCN(C)[C@H]2c2cncn2C)o1	ZINC000671563222	540988413	/nfs/dbraw/zinc/98/84/13/540988413.db2.gz	CNNAYICRCRXETL-WMLDXEAASA-N	0	3	317.437	2.231	10	0		DEAEHN
c1cc(CNCCNc2cnccn2)n(CCc2ccccc2)n1	ZINC000621340577	364360200	/nfs/dbraw/zinc/36/02/00/364360200.db2.gz	JWUKMAUBSCBTOP-UHFFFAOYSA-N	0	3	322.416	2.118	10	0		DEAEHN
C/C(=C\c1cccc(C(F)(F)F)c1)CN(CCO)CCO	ZINC000628370192	366833997	/nfs/dbraw/zinc/83/39/97/366833997.db2.gz	CPAYGSCUXZTEDR-FMIVXFBMSA-N	0	3	303.324	2.395	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2ccc(C)c(OC)c2)CC12COC2	ZINC000449356933	240390747	/nfs/dbraw/zinc/39/07/47/240390747.db2.gz	CVTXRAVPDYQHOU-OAHLLOKOSA-N	0	3	319.401	2.015	10	0		DEAEHN
Cc1cc(CNC[C@@H]2CN(C)CCN2Cc2ccccc2)ccn1	ZINC000623574664	365085871	/nfs/dbraw/zinc/08/58/71/365085871.db2.gz	TVLSCQMEANGYFL-HXUWFJFHSA-N	0	3	324.472	2.296	10	0		DEAEHN
c1nnn(-c2ccccc2)c1CNC[C@H]1CCN1C1CCCC1	ZINC000623729202	365152150	/nfs/dbraw/zinc/15/21/50/365152150.db2.gz	SDVAMOJVCNVEQI-QGZVFWFLSA-N	0	3	311.433	2.374	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)N1CC=C(c2ccccc2)CC1	ZINC000091135873	193001078	/nfs/dbraw/zinc/00/10/78/193001078.db2.gz	KIAGGNJQHQDEGB-MRXNPFEDSA-N	0	3	302.443	2.397	10	0		DEAEHN
O[C@@H]1COCC[C@@H]1NCc1ccc(Cl)c(Br)c1	ZINC000623767608	365168475	/nfs/dbraw/zinc/16/84/75/365168475.db2.gz	YPZVDADFYSRYRJ-NWDGAFQWSA-N	0	3	320.614	2.342	10	0		DEAEHN
C[C@@H](NC[C@@H]1COCCN1C)c1ccc(Br)s1	ZINC000623713380	365141111	/nfs/dbraw/zinc/14/11/11/365141111.db2.gz	ZNTYHROHAZZTRH-NXEZZACHSA-N	0	3	319.268	2.492	10	0		DEAEHN
C[C@@H](NC[C@@H]1COCCN1C)c1ccccc1Br	ZINC000624172815	365318761	/nfs/dbraw/zinc/31/87/61/365318761.db2.gz	VBDPQNODYWZXBV-VXGBXAGGSA-N	0	3	313.239	2.430	10	0		DEAEHN
O[C@@H]1COCC[C@@H]1N[C@H]1CCc2ccc(Br)cc21	ZINC000624238334	365347214	/nfs/dbraw/zinc/34/72/14/365347214.db2.gz	PJKVOKKNYKGPLN-MELADBBJSA-N	0	3	312.207	2.176	10	0		DEAEHN
C[C@H](NC[C@@H]1CN(C)CCO1)c1cccc(Br)c1	ZINC000091666881	193088533	/nfs/dbraw/zinc/08/85/33/193088533.db2.gz	YBZFUXJCOJLHOY-SMDDNHRTSA-N	0	3	313.239	2.430	10	0		DEAEHN
CCc1nc(C(C)C)ccc1C(=O)NCCNc1ccncc1	ZINC000449815631	241115805	/nfs/dbraw/zinc/11/58/05/241115805.db2.gz	RNRACEYAJBZVCY-UHFFFAOYSA-N	0	3	312.417	2.426	10	0		DEAEHN
COC(=O)[C@H]1CCCN(C(=O)[C@H]2CCCCN2C2CCCC2)C1	ZINC000449841381	241152477	/nfs/dbraw/zinc/15/24/77/241152477.db2.gz	VCSAYBVPNFUYAV-GOEBONIOSA-N	0	3	322.449	2.195	10	0		DEAEHN
CS[C@H]1CN(Cc2nnc(C(C)C)s2)C[C@@H]1N(C)C	ZINC000450636354	242047615	/nfs/dbraw/zinc/04/76/15/242047615.db2.gz	MPKQHKBNTIKDGH-QWRGUYRKSA-N	0	3	300.497	2.139	10	0		DEAEHN
Cc1nn(C)cc1CC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450701073	242116932	/nfs/dbraw/zinc/11/69/32/242116932.db2.gz	VMHMITPLNZAFMF-KDOFPFPSSA-N	0	3	314.433	2.079	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccc(C(N)=S)cc1)N1C[C@H](C)[C@H](C)C1	ZINC000092085424	193154725	/nfs/dbraw/zinc/15/47/25/193154725.db2.gz	YVVPSMUDDZPREQ-TUAOUCFPSA-N	0	3	305.447	2.236	10	0		DEAEHN
O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H]1CCCOC1	ZINC000171589930	283988669	/nfs/dbraw/zinc/98/86/69/283988669.db2.gz	AUORJIKNWPUDEC-IAGOWNOFSA-N	0	3	317.433	2.302	10	0		DEAEHN
c1c(CNC2CCCC2)nnn1C[C@@H]1COc2ccccc2O1	ZINC000630604376	367753198	/nfs/dbraw/zinc/75/31/98/367753198.db2.gz	VYGIXZFYGQDQNQ-OAHLLOKOSA-N	0	3	314.389	2.150	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)c(C)cc1C	ZINC000092113386	193161740	/nfs/dbraw/zinc/16/17/40/193161740.db2.gz	IYMDTPLVFLRMTM-ZIAGYGMSSA-N	0	3	310.463	2.299	10	0		DEAEHN
C[C@H]1CCC[C@H](N(C)S(=O)(=O)c2ccc(CN)cc2F)C1	ZINC000092115913	193163870	/nfs/dbraw/zinc/16/38/70/193163870.db2.gz	CXZHYXCBNDTAMZ-AAEUAGOBSA-N	0	3	314.426	2.484	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N(S(=O)(=O)c2ccc(CN)cc2F)C1	ZINC000092116279	193164097	/nfs/dbraw/zinc/16/40/97/193164097.db2.gz	NKEBNOBKMIXTIR-MNOVXSKESA-N	0	3	300.399	2.094	10	0		DEAEHN
c1cncc([C@H]2CNCCN2Cc2cccc3c2CCOC3)c1	ZINC000631825198	368405140	/nfs/dbraw/zinc/40/51/40/368405140.db2.gz	BWQPOFMTCMOOIG-LJQANCHMSA-N	0	3	309.413	2.301	10	0		DEAEHN
CC[C@@H](C)CN(CC)S(=O)(=O)c1cc(CN)ccc1F	ZINC000093265743	193222698	/nfs/dbraw/zinc/22/26/98/193222698.db2.gz	HLIMGXDIJTXCLG-LLVKDONJSA-N	0	3	302.415	2.341	10	0		DEAEHN
CC(C)(CNC1=NC2(CS1)CCCCC2)S(C)(=O)=O	ZINC000093524726	193263933	/nfs/dbraw/zinc/26/39/33/193263933.db2.gz	ZXCLYDPPVBGWHX-UHFFFAOYSA-N	0	3	304.481	2.205	10	0		DEAEHN
NC(=O)[C@@]1(N)CCC[C@H]1CCSc1nc2ccccc2[nH]1	ZINC000093629104	193276245	/nfs/dbraw/zinc/27/62/45/193276245.db2.gz	OIQQIDYNYNVXHO-ZUZCIYMTSA-N	0	3	304.419	2.028	10	0		DEAEHN
CN[C@@H](Cc1cc(F)cc(Br)c1)C(OC)OC	ZINC000094000795	193337881	/nfs/dbraw/zinc/33/78/81/193337881.db2.gz	OKNGBJKYAGOXJT-NSHDSACASA-N	0	3	306.175	2.338	10	0		DEAEHN
NC(=O)[C@@]1(N)CC[C@@H](Sc2ccccc2Br)C1	ZINC000093849005	193317456	/nfs/dbraw/zinc/31/74/56/193317456.db2.gz	MYDLRLCXMAGURA-PRHODGIISA-N	0	3	315.236	2.277	10	0		DEAEHN
NC(=O)[C@]1(NC2CC2)CC[C@H](Sc2ncccc2Cl)C1	ZINC000093854120	193319727	/nfs/dbraw/zinc/31/97/27/193319727.db2.gz	JTUGHOBCIDXPEF-HZMBPMFUSA-N	0	3	311.838	2.356	10	0		DEAEHN
CN1CCN(C)[C@H](c2nc(CN)c(-c3ccccc3)s2)C1	ZINC000093896516	193324873	/nfs/dbraw/zinc/32/48/73/193324873.db2.gz	RVGPYETYZSOQRZ-AWEZNQCLSA-N	0	3	302.447	2.187	10	0		DEAEHN
COc1ccc(Cl)cc1C[C@@H](N)[C@H]1CN(C(C)C)CCO1	ZINC000093925748	193328721	/nfs/dbraw/zinc/32/87/21/193328721.db2.gz	SUKROIKBYYFKFX-GDBMZVCRSA-N	0	3	312.841	2.328	10	0		DEAEHN
CC(C)(C)c1csc(C[C@H](N)C(C)(C)N2CCOCC2)n1	ZINC000094256854	193355118	/nfs/dbraw/zinc/35/51/18/193355118.db2.gz	AWJKGXAFIRJIGL-LBPRGKRZSA-N	0	3	311.495	2.421	10	0		DEAEHN
CCCN[C@@H](C)c1cc(F)ccc1OCCS(C)(=O)=O	ZINC000094620275	193385407	/nfs/dbraw/zinc/38/54/07/193385407.db2.gz	ROOCWVQCSZFMMN-NSHDSACASA-N	0	3	303.399	2.310	10	0		DEAEHN
CC(C)(C)NCc1cnn([C@@H]2CCC[C@H](S(C)(=O)=O)C2)c1	ZINC000094644009	193389673	/nfs/dbraw/zinc/38/96/73/193389673.db2.gz	ILHXQKOQNVHOER-KGLIPLIRSA-N	0	3	313.467	2.300	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2N)C1	ZINC000094596191	193382228	/nfs/dbraw/zinc/38/22/28/193382228.db2.gz	NJSLWFYVSDBLEF-JTQLQIEISA-N	0	3	301.312	2.064	10	0		DEAEHN
C[C@@H](CN1CCCC1)Nc1nc2ccc(Br)cn2n1	ZINC000094604217	193383865	/nfs/dbraw/zinc/38/38/65/193383865.db2.gz	BZBDOAZHHVRTSE-JTQLQIEISA-N	0	3	324.226	2.388	10	0		DEAEHN
CCN[C@@H](C)c1cc(F)ccc1OCCS(=O)(=O)CC	ZINC000094618983	193385010	/nfs/dbraw/zinc/38/50/10/193385010.db2.gz	XIKYRNLWYIYPMA-NSHDSACASA-N	0	3	303.399	2.310	10	0		DEAEHN
CN[C@@H](C)c1cc(F)c(C)cc1N(C)[C@@H]1CCS(=O)(=O)C1	ZINC000094765851	193396194	/nfs/dbraw/zinc/39/61/94/193396194.db2.gz	OHNDBKLYYAWOGJ-NWDGAFQWSA-N	0	3	314.426	2.038	10	0		DEAEHN
CCN[C@H](C)c1cc(F)c(C)cc1N1CCS(=O)(=O)CC1	ZINC000094765783	193396389	/nfs/dbraw/zinc/39/63/89/193396389.db2.gz	VTUPJONLUZMTRQ-GFCCVEGCSA-N	0	3	314.426	2.039	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@@H]1NCc1ccc(Br)s1	ZINC000282449639	217002738	/nfs/dbraw/zinc/00/27/38/217002738.db2.gz	SJBURQKYJKTCJD-CBAPKCEASA-N	0	3	303.225	2.267	10	0		DEAEHN
O=C(Nc1cccc(-n2cccn2)c1)N1CCN2CCC[C@H]2C1	ZINC000264744456	204121517	/nfs/dbraw/zinc/12/15/17/204121517.db2.gz	PZTVNPJXNYIDAU-INIZCTEOSA-N	0	3	311.389	2.184	10	0		DEAEHN
COC(=O)[C@H](c1ccccc1C)N1CCCN(C2CC2)CC1	ZINC000184487473	284303104	/nfs/dbraw/zinc/30/31/04/284303104.db2.gz	OKRQGKQCXTXXIC-KRWDZBQOSA-N	0	3	302.418	2.379	10	0		DEAEHN
CN(C)C[C@@H]1C[C@H](O)CN1Cc1c(Cl)cccc1Cl	ZINC000097265150	193702007	/nfs/dbraw/zinc/70/20/07/193702007.db2.gz	DAWAFSFETPIAEP-QWRGUYRKSA-N	0	3	303.233	2.490	10	0		DEAEHN
c1c2c(cc3c1OCCC[C@@H]3NC[C@H]1COCCN1)CCCC2	ZINC000530220131	284376758	/nfs/dbraw/zinc/37/67/58/284376758.db2.gz	IZXVZSKHXNYCNQ-WMZOPIPTSA-N	0	3	316.445	2.357	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)N1CCN(C)[C@H](C)[C@H]1C)CC2	ZINC000530289638	284396508	/nfs/dbraw/zinc/39/65/08/284396508.db2.gz	FKVROCGMKNQUAX-MGPQQGTHSA-N	0	3	318.465	2.189	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N1CCN(C)[C@H](C)[C@H]1C)C2	ZINC000530289638	284396510	/nfs/dbraw/zinc/39/65/10/284396510.db2.gz	FKVROCGMKNQUAX-MGPQQGTHSA-N	0	3	318.465	2.189	10	0		DEAEHN
O=C(Nc1c(Cl)cc(Cl)cc1Cl)[C@@H]1C[C@@H](O)CN1	ZINC000020505407	182226091	/nfs/dbraw/zinc/22/60/91/182226091.db2.gz	DYHXQBLYUDCING-MUWHJKNJSA-N	0	3	309.580	2.308	10	0		DEAEHN
C[C@H]1CCc2nn(CC(=O)NCCN3CCCCCC3)cc2C1	ZINC000020865888	182250928	/nfs/dbraw/zinc/25/09/28/182250928.db2.gz	ZAMHMFZUVSTOTL-HNNXBMFYSA-N	0	3	318.465	2.000	10	0		DEAEHN
Cc1ccccc1[C@H](CN)N1CCN(c2nccs2)CC1	ZINC000021806762	182291385	/nfs/dbraw/zinc/29/13/85/182291385.db2.gz	OGGRWCPFKBCHCZ-HNNXBMFYSA-N	0	3	302.447	2.274	10	0		DEAEHN
CCc1noc(C)c1NC(=O)N(CCN(C)C)C[C@H]1CCCO1	ZINC000155481368	291606106	/nfs/dbraw/zinc/60/61/06/291606106.db2.gz	NHBDQAMTAZCYEP-CYBMUJFWSA-N	0	3	324.425	2.120	10	0		DEAEHN
CN1CCC[C@H](NCc2ccc(I)o2)C1	ZINC000040672955	183116389	/nfs/dbraw/zinc/11/63/89/183116389.db2.gz	KKMIKQDDLDNUKU-VIFPVBQESA-N	0	3	320.174	2.068	10	0		DEAEHN
CCC[C@H](N)C(=O)NCc1cc(Br)ccc1F	ZINC000041069549	183162256	/nfs/dbraw/zinc/16/22/56/183162256.db2.gz	MNTCRGNOSHGMJX-NSHDSACASA-N	0	3	303.175	2.332	10	0		DEAEHN
COCCN(C)[C@@H](CN)c1ccc(F)c(Br)c1	ZINC000042458660	183272746	/nfs/dbraw/zinc/27/27/46/183272746.db2.gz	CQMAWCLENGAWTH-LBPRGKRZSA-N	0	3	305.191	2.166	10	0		DEAEHN
CNC(=O)[C@@H]1CCCN1c1cccc(Cl)c1CNC1CC1	ZINC000042395665	183263608	/nfs/dbraw/zinc/26/36/08/183263608.db2.gz	FNEOJSNBJIBMDB-HNNXBMFYSA-N	0	3	307.825	2.307	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1N(C)S(=O)(=O)Cc1ccccc1CN	ZINC000042609410	183290737	/nfs/dbraw/zinc/29/07/37/183290737.db2.gz	RXQDASQPQYSKKO-CZUORRHYSA-N	0	3	310.463	2.486	10	0		DEAEHN
COc1ccc(OC)c([C@H](CN)N(C)Cc2cscn2)c1	ZINC000042864447	183315293	/nfs/dbraw/zinc/31/52/93/183315293.db2.gz	ACNRPAWMDDQWIL-AWEZNQCLSA-N	0	3	307.419	2.292	10	0		DEAEHN
NC[C@@H](c1cccc(Br)c1)N1CCC[C@H](CO)C1	ZINC000043020892	183330094	/nfs/dbraw/zinc/33/00/94/183330094.db2.gz	QGRPHEKWOWAQHO-FZMZJTMJSA-N	0	3	313.239	2.153	10	0		DEAEHN
CC(C)N(CC(F)(F)F)S(=O)(=O)Cc1ccccc1CN	ZINC000042768696	183307111	/nfs/dbraw/zinc/30/71/11/183307111.db2.gz	UEJBOVFGJPKHJM-UHFFFAOYSA-N	0	3	324.368	2.248	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(C)s1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043240631	183345738	/nfs/dbraw/zinc/34/57/38/183345738.db2.gz	NTLGGNCZQGRULR-UMVBOHGHSA-N	0	3	309.479	2.388	10	0		DEAEHN
CC[C@H](N)[C@@H](c1sccc1C)N(C)CC(=O)N1CCCC1	ZINC000043248498	183347089	/nfs/dbraw/zinc/34/70/89/183347089.db2.gz	HWPLOMQDTDAMGR-ZFWWWQNUSA-N	0	3	309.479	2.389	10	0		DEAEHN
C[C@H](N)[C@H](c1ccc(Br)s1)N1CCN(C)CC1	ZINC000043258590	183348205	/nfs/dbraw/zinc/34/82/05/183348205.db2.gz	BQAMDGSPYVZYIT-JOYOIKCWSA-N	0	3	318.284	2.146	10	0		DEAEHN
COc1ccc2cc([C@H](N)[C@@H]3CCS(=O)(=O)C3)ccc2c1	ZINC000043299893	183351565	/nfs/dbraw/zinc/35/15/65/183351565.db2.gz	RSBUXWTYMDOQNO-ZBFHGGJFSA-N	0	3	305.399	2.283	10	0		DEAEHN
N[C@@H](c1ccccc1OC(F)(F)F)[C@@H]1CCS(=O)(=O)C1	ZINC000043300041	183352126	/nfs/dbraw/zinc/35/21/26/183352126.db2.gz	VCLCQEYSXYHCJV-LDYMZIIASA-N	0	3	309.309	2.020	10	0		DEAEHN
CC[C@H](N)[C@@H](Oc1cccc(S(C)(=O)=O)c1)C(F)(F)F	ZINC000043385225	183357891	/nfs/dbraw/zinc/35/78/91/183357891.db2.gz	DAHNVFGACRWVEC-WDEREUQCSA-N	0	3	311.325	2.137	10	0		DEAEHN
CN[C@@H](CN1CCN(C)CC1)c1cccc(C(F)(F)F)c1	ZINC000043810456	183386567	/nfs/dbraw/zinc/38/65/67/183386567.db2.gz	WGOHEXQGBYEUBH-AWEZNQCLSA-N	0	3	301.356	2.213	10	0		DEAEHN
CN[C@@H](CN(C)CC(F)(F)F)c1cc(OC)ccc1OC	ZINC000043900627	183389428	/nfs/dbraw/zinc/38/94/28/183389428.db2.gz	IPUSGJOUCOMIKY-LBPRGKRZSA-N	0	3	306.328	2.458	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1CCC[C@H](n2cc(C)cn2)C1	ZINC000105860108	194148546	/nfs/dbraw/zinc/14/85/46/194148546.db2.gz	DUXDQVLVGZNOHQ-JKSUJKDBSA-N	0	3	304.438	2.229	10	0		DEAEHN
Cc1nc(C)n(C[C@H]2CCCN(C[C@H](O)c3ccccc3)C2)n1	ZINC000105885079	194157460	/nfs/dbraw/zinc/15/74/60/194157460.db2.gz	XZHWRJYVZGSIBB-WMZOPIPTSA-N	0	3	314.433	2.341	10	0		DEAEHN
CCCOc1cccc(CNC[C@@H]2CN(C3CC3)CCO2)c1	ZINC000106379765	194204054	/nfs/dbraw/zinc/20/40/54/194204054.db2.gz	BZOLZYOOKSDPOA-GOSISDBHSA-N	0	3	304.434	2.428	10	0		DEAEHN
O=S(=O)(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCNC1	ZINC000049640681	183749959	/nfs/dbraw/zinc/74/99/59/183749959.db2.gz	GMYJBTQOEDBQRE-SECBINFHSA-N	0	3	309.218	2.487	10	0		DEAEHN
CO[C@H]1C[C@@H](CN(C)C(=O)c2c(C)[nH]c3ccccc32)N(C)C1	ZINC000285283488	218365836	/nfs/dbraw/zinc/36/58/36/218365836.db2.gz	QSYZRMFGQXJKPR-KBPBESRZSA-N	0	3	315.417	2.267	10	0		DEAEHN
c1nc2cnccn2c1CNCC[C@H]1COc2ccccc2O1	ZINC000553581105	291746310	/nfs/dbraw/zinc/74/63/10/291746310.db2.gz	RWNPQXXHBZAXFK-AWEZNQCLSA-N	0	3	310.357	2.049	10	0		DEAEHN
Cc1ccc(-n2nnnc2CNCC(C)C)cc1Br	ZINC000109437350	194263516	/nfs/dbraw/zinc/26/35/16/194263516.db2.gz	ICITXUVCOKVOKE-UHFFFAOYSA-N	0	3	324.226	2.479	10	0		DEAEHN
CCC[C@H](C(N)=S)N1CCN(CCOCCC(C)C)CC1	ZINC000109469959	194267442	/nfs/dbraw/zinc/26/74/42/194267442.db2.gz	CUEPYJSXTXOXGQ-OAHLLOKOSA-N	0	3	315.527	2.122	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccccc1Cl)N1CCNC(=O)C1(C)C	ZINC000110653915	194347411	/nfs/dbraw/zinc/34/74/11/194347411.db2.gz	APOAYFQFOOCHMP-ZIAGYGMSSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)s1)N1CCNC(=O)[C@@H]1CC	ZINC000110677361	194348975	/nfs/dbraw/zinc/34/89/75/194348975.db2.gz	WCRMPNSZTHHEHH-GBIKHYSHSA-N	0	3	315.870	2.390	10	0		DEAEHN
CCCc1nc(N(CCCOC)CCOC)sc1CN	ZINC000055000405	183957132	/nfs/dbraw/zinc/95/71/32/183957132.db2.gz	GUCQTNURWLQEOC-UHFFFAOYSA-N	0	3	301.456	2.044	10	0		DEAEHN
CCOCCN(CC)c1nc(CC)c(CNCCOC)s1	ZINC000111124652	194393350	/nfs/dbraw/zinc/39/33/50/194393350.db2.gz	JFNXBSSXYKDTQV-UHFFFAOYSA-N	0	3	315.483	2.304	10	0		DEAEHN
Cc1cc(NC(=O)N[C@H](Cc2ccccc2)CN(C)C)no1	ZINC000056347303	184011147	/nfs/dbraw/zinc/01/11/47/184011147.db2.gz	JHFQDEQRDMJBLY-CQSZACIVSA-N	0	3	302.378	2.277	10	0		DEAEHN
Cc1cccc(C)c1OC[C@H](O)CN1CCCN(C2CC2)CC1	ZINC000061041184	184160861	/nfs/dbraw/zinc/16/08/61/184160861.db2.gz	NCDMKDYAWVIQMF-GOSISDBHSA-N	0	3	318.461	2.213	10	0		DEAEHN
CC[C@@H](Oc1ccc(Br)cc1[C@@H](C)N)C(N)=O	ZINC000061676069	184181900	/nfs/dbraw/zinc/18/19/00/184181900.db2.gz	QQELFQFMCWRCSC-GMSGAONNSA-N	0	3	301.184	2.112	10	0		DEAEHN
COc1ccccc1CCNC(=O)N1CCCN(C2CC2)CC1	ZINC000061795843	184187782	/nfs/dbraw/zinc/18/77/82/184187782.db2.gz	WDMMPTXLKLKTNL-UHFFFAOYSA-N	0	3	317.433	2.117	10	0		DEAEHN
COc1cc(Cl)c([C@H](N)C[C@@H](C)CC(N)=O)cc1OC	ZINC000061830334	184188868	/nfs/dbraw/zinc/18/88/68/184188868.db2.gz	JHZKEFQVHJHABF-LDYMZIIASA-N	0	3	300.786	2.259	10	0		DEAEHN
COc1cc(Cl)c([C@@H](N)C[C@@H](C)CC(N)=O)cc1OC	ZINC000061830332	184188947	/nfs/dbraw/zinc/18/89/47/184188947.db2.gz	JHZKEFQVHJHABF-KCJUWKMLSA-N	0	3	300.786	2.259	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2cc3c(c(Cl)c2)OCO3)CCCO1	ZINC000061915074	184195302	/nfs/dbraw/zinc/19/53/02/184195302.db2.gz	DZKQQCDWSFPJDW-MFKMUULPSA-N	0	3	312.797	2.179	10	0		DEAEHN
COCCN1C(=O)C[C@H](N)[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000062210260	184220625	/nfs/dbraw/zinc/22/06/25/184220625.db2.gz	RIBLIBKEOYYMCA-AAEUAGOBSA-N	0	3	303.189	2.241	10	0		DEAEHN
O=C(NC[C@@H]1CCCCN1Cc1ccccc1)N1CCOCC1	ZINC000062649469	184246437	/nfs/dbraw/zinc/24/64/37/184246437.db2.gz	ICIYIMLEBLRSRC-KRWDZBQOSA-N	0	3	317.433	2.083	10	0		DEAEHN
[NH3+][C@H]1CCCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1F	ZINC000063213790	184279089	/nfs/dbraw/zinc/27/90/89/184279089.db2.gz	SITMCBBSDCISDH-RYUDHWBXSA-N	0	3	320.817	2.417	10	0		DEAEHN
N[C@H]1CC(=O)N(c2ccccc2OCCOc2ccccc2)C1	ZINC000066055711	184385949	/nfs/dbraw/zinc/38/59/49/184385949.db2.gz	CKIVXBPAPCDVCJ-AWEZNQCLSA-N	0	3	312.369	2.208	10	0		DEAEHN
CN(C)CCNC(=O)c1cccc(NC(=O)c2ccccc2)c1	ZINC000065755822	184378908	/nfs/dbraw/zinc/37/89/08/184378908.db2.gz	SFZIRTPAUGAWLB-UHFFFAOYSA-N	0	3	311.385	2.230	10	0		DEAEHN
CCC(CC)C(=O)Nc1cccc(C(=O)NCCN(C)C)c1	ZINC000065755780	184379373	/nfs/dbraw/zinc/37/93/73/184379373.db2.gz	OQIBLWULWFGLQO-UHFFFAOYSA-N	0	3	305.422	2.353	10	0		DEAEHN
CNc1snc(C)c1C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000185427151	207365249	/nfs/dbraw/zinc/36/52/49/207365249.db2.gz	PEPBJOZSFBRHKS-NSHDSACASA-N	0	3	310.467	2.488	10	0		DEAEHN
Cc1cc(N[C@H]2CCN(C)[C@@H]2c2ccccc2)n2ncnc2n1	ZINC000270269175	208334916	/nfs/dbraw/zinc/33/49/16/208334916.db2.gz	JZOWANFTBBMXOU-GOEBONIOSA-N	0	3	308.389	2.290	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1ccc(OC(F)F)c(F)c1	ZINC000159270085	197341438	/nfs/dbraw/zinc/34/14/38/197341438.db2.gz	MYMWGQFIXNVOET-JTQLQIEISA-N	0	3	306.284	2.120	10	0		DEAEHN
COCCC[C@H](N)C(=O)N[C@H]1CCSc2ccc(F)cc21	ZINC000159173088	197333191	/nfs/dbraw/zinc/33/31/91/197333191.db2.gz	ZUEHSMOTPZJDLN-STQMWFEESA-N	0	3	312.410	2.233	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)[C@H](C)C(C)C)cc(CN)c1F	ZINC000159071930	197324484	/nfs/dbraw/zinc/32/44/84/197324484.db2.gz	BPZIKCXTJXUMCB-LLVKDONJSA-N	0	3	302.415	2.258	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCCC[C@H]2C)cc(CN)c1F	ZINC000159050666	197321694	/nfs/dbraw/zinc/32/16/94/197321694.db2.gz	BOUSBXYFFXKBRJ-LLVKDONJSA-N	0	3	300.399	2.156	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)c1ncsc1Br	ZINC000288670182	220337256	/nfs/dbraw/zinc/33/72/56/220337256.db2.gz	PNPYPFSHSNQQRY-MRVPVSSYSA-N	0	3	318.240	2.120	10	0		DEAEHN
C[C@@H]1OCC[C@@H]1N(C)[C@@H](CN)c1cc2c(c(Cl)c1)OCO2	ZINC000158613701	197288054	/nfs/dbraw/zinc/28/80/54/197288054.db2.gz	PMAXPDKCEJRWTN-XDTLVQLUSA-N	0	3	312.797	2.178	10	0		DEAEHN
CCN(Cc1cccs1)[C@H](CN)c1c(C)nn(C)c1OC	ZINC000158383075	197267609	/nfs/dbraw/zinc/26/76/09/197267609.db2.gz	IEZUDULYDVBXSC-CYBMUJFWSA-N	0	3	308.451	2.321	10	0		DEAEHN
C[C@@H](NC1CCS(=O)CC1)c1ccc2c(c1)OCCCO2	ZINC000158011271	197235254	/nfs/dbraw/zinc/23/52/54/197235254.db2.gz	PRXYCAIESYDBOM-AVHPMIGVSA-N	0	3	309.431	2.410	10	0		DEAEHN
COc1cc(CNC2CCS(=O)CC2)cc(Cl)c1OC	ZINC000157970795	197232135	/nfs/dbraw/zinc/23/21/35/197232135.db2.gz	FORCOPHKHXBWKV-UHFFFAOYSA-N	0	3	317.838	2.358	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2ccccc2O[C@H]2CCOC2)C1	ZINC000120300619	195138660	/nfs/dbraw/zinc/13/86/60/195138660.db2.gz	NUPYAMOTQOQFTL-KBPBESRZSA-N	0	3	319.405	2.022	10	0		DEAEHN
C[C@@](F)(Cc1ccc(Br)cn1)C[C@@H]1COCCN1	ZINC000157601527	197201083	/nfs/dbraw/zinc/20/10/83/197201083.db2.gz	JNTLVLWCHUDFRX-CHWSQXEVSA-N	0	3	317.202	2.493	10	0		DEAEHN
CCc1csc([C@H]2CCCN(CCN3C(=O)CCC3=O)C2)n1	ZINC000157047285	197157948	/nfs/dbraw/zinc/15/79/48/197157948.db2.gz	RKJYGEMUSWOHFJ-LBPRGKRZSA-N	0	3	321.446	2.034	10	0		DEAEHN
NCc1ccccc1CC(=O)Nc1ccc(Br)cn1	ZINC000157031975	197156501	/nfs/dbraw/zinc/15/65/01/197156501.db2.gz	YYTGWZDSUCDUBG-UHFFFAOYSA-N	0	3	320.190	2.484	10	0		DEAEHN
CCO[C@H]1C[C@@](N)(C(=O)N(CC(F)(F)F)C(C)C)C1(C)C	ZINC000156953033	197152316	/nfs/dbraw/zinc/15/23/16/197152316.db2.gz	VHQOOYWREBVNMS-GXFFZTMASA-N	0	3	310.360	2.318	10	0		DEAEHN
COc1ccccc1CCN(C)C(=O)C1(N)Cc2ccccc2C1	ZINC000156332134	197105480	/nfs/dbraw/zinc/10/54/80/197105480.db2.gz	SJPCXXHEPUXWMR-UHFFFAOYSA-N	0	3	324.424	2.192	10	0		DEAEHN
O=C(NC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)N1CC[C@H](N2CC=CC2)C1	ZINC000155636168	197074984	/nfs/dbraw/zinc/07/49/84/197074984.db2.gz	JJHSVJJJHATQKZ-KANFNMMFSA-N	0	3	323.440	2.228	10	0		DEAEHN
C[C@@H]1CCC[C@]2(CSC(NC[C@@H]3CCCS3(=O)=O)=N2)C1	ZINC000155416655	197052834	/nfs/dbraw/zinc/05/28/34/197052834.db2.gz	DGVPEWQYSCBBCN-MBNYWOFBSA-N	0	3	316.492	2.205	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)CCCSC(C)(C)C)CCO1	ZINC000155120324	197024096	/nfs/dbraw/zinc/02/40/96/197024096.db2.gz	BCHPCPUTPMFJGH-CYBMUJFWSA-N	0	3	302.484	2.087	10	0		DEAEHN
CCc1cccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000120452107	195168678	/nfs/dbraw/zinc/16/86/78/195168678.db2.gz	UBCMZBQFAKSPMN-CZUORRHYSA-N	0	3	317.433	2.129	10	0		DEAEHN
Cc1cc(F)cc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000120662673	195210457	/nfs/dbraw/zinc/21/04/57/195210457.db2.gz	PWGHNLVGHVQMKV-DOMZBBRYSA-N	0	3	321.396	2.014	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2ccc(F)c(Cl)c2)C[C@H]1C	ZINC000120598285	195198534	/nfs/dbraw/zinc/19/85/34/195198534.db2.gz	FVAMBEZDMZNQCX-VXGBXAGGSA-N	0	3	300.805	2.366	10	0		DEAEHN
CC[C@@H]1CN(CC2=Cc3ccccc3OC2)CCN1C[C@@H](C)O	ZINC000120726334	195225374	/nfs/dbraw/zinc/22/53/74/195225374.db2.gz	DFJYOXLCMQDABV-CRAIPNDOSA-N	0	3	316.445	2.239	10	0		DEAEHN
Cc1ccc(CN[C@@H]2CCC(=O)N(C)C2)cc1Br	ZINC000120838296	195248153	/nfs/dbraw/zinc/24/81/53/195248153.db2.gz	LXAFUZLSAIKFML-GFCCVEGCSA-N	0	3	311.223	2.468	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1F	ZINC000120786284	195237756	/nfs/dbraw/zinc/23/77/56/195237756.db2.gz	UGMWBGUJTLVFEV-CHWSQXEVSA-N	0	3	321.396	2.014	10	0		DEAEHN
Cc1noc(CCCN2CCC[C@H](c3nncn3C3CC3)C2)n1	ZINC000271601785	209048637	/nfs/dbraw/zinc/04/86/37/209048637.db2.gz	AWLNJJBSWNUYNH-ZDUSSCGKSA-N	0	3	316.409	2.117	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc(NC(C)=O)cc2)CCN1CCOC	ZINC000120935163	195267472	/nfs/dbraw/zinc/26/74/72/195267472.db2.gz	ZFNJTMIWAKVMFE-SFHVURJKSA-N	0	3	319.449	2.188	10	0		DEAEHN
O=C(NCc1cccs1)[C@@H]1C[C@H]2CCN(C3CCC3)C[C@@H]2O1	ZINC000247487814	257119369	/nfs/dbraw/zinc/11/93/69/257119369.db2.gz	LFWVHVDRZOCGHM-KCXAZCMYSA-N	0	3	320.458	2.396	10	0		DEAEHN
Cc1cccc(CN2CCN3C[C@@H](OCC4CC4)C[C@@H]3C2)n1	ZINC000503720652	257206978	/nfs/dbraw/zinc/20/69/78/257206978.db2.gz	UQEOYSQOQUWWGW-MSOLQXFVSA-N	0	3	301.434	2.075	10	0		DEAEHN
CC[C@@H]1CN(Cc2cnc3c(C)cccn23)CCN1CCOC	ZINC000120950267	195269658	/nfs/dbraw/zinc/26/96/58/195269658.db2.gz	VORGCJGCSSFQRS-MRXNPFEDSA-N	0	3	316.449	2.185	10	0		DEAEHN
COc1ccc2c(c1Br)CCN(CCN(C)C)C2	ZINC000074450873	184986864	/nfs/dbraw/zinc/98/68/64/184986864.db2.gz	LALOMDWQPLJAEQ-UHFFFAOYSA-N	0	3	313.239	2.377	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C)c1C	ZINC000121813768	195352755	/nfs/dbraw/zinc/35/27/55/195352755.db2.gz	OEQGGPGWUBNWEY-HNNXBMFYSA-N	0	3	319.449	2.334	10	0		DEAEHN
Cc1ccc(F)cc1NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000121820917	195355915	/nfs/dbraw/zinc/35/59/15/195355915.db2.gz	MEOWFCQXBUGFTC-AWEZNQCLSA-N	0	3	323.412	2.165	10	0		DEAEHN
C[C@H](NC(=O)C1CCN(C)CC1)c1ccccc1-n1cccn1	ZINC000121611270	195315987	/nfs/dbraw/zinc/31/59/87/195315987.db2.gz	DTERSSXRZOUIBN-AWEZNQCLSA-N	0	3	312.417	2.391	10	0		DEAEHN
Cc1ccc([C@H]2N[C@@H](C)C(=O)N2CC2CCN(C)CC2)s1	ZINC000121981282	195385883	/nfs/dbraw/zinc/38/58/83/195385883.db2.gz	RCBGJNIICKPJJM-WFASDCNBSA-N	0	3	307.463	2.217	10	0		DEAEHN
CC(C)CNCc1nnnn1-c1c(F)cc(F)cc1Cl	ZINC000124601961	195659055	/nfs/dbraw/zinc/65/90/55/195659055.db2.gz	MLQOBFYQKFPVQZ-UHFFFAOYSA-N	0	3	301.728	2.340	10	0		DEAEHN
CCCn1cc(S(=O)(=O)NC[C@@H](C)C(C)(C)C)cc1CN	ZINC000126125683	195812957	/nfs/dbraw/zinc/81/29/57/195812957.db2.gz	RMGVNYPPJHTCDV-GFCCVEGCSA-N	0	3	315.483	2.317	10	0		DEAEHN
COc1cc(C)c(CN(C)C[C@H](O)COC(C)C)cc1OC	ZINC000194893167	533568899	/nfs/dbraw/zinc/56/88/99/533568899.db2.gz	DWFQWUWGOKRSIM-HNNXBMFYSA-N	0	3	311.422	2.230	10	0		DEAEHN
COC(=O)COc1ccccc1[C@@H](C)NCC1(CCO)CC1	ZINC000188056982	533570810	/nfs/dbraw/zinc/57/08/10/533570810.db2.gz	URKGJOQGDODOOV-CYBMUJFWSA-N	0	3	307.390	2.052	10	0		DEAEHN
COc1ccc([C@@H](C)Cc2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263295428	132580715	/nfs/dbraw/zinc/58/07/15/132580715.db2.gz	WEVIMTQTYOYURA-WFASDCNBSA-N	0	3	316.405	2.001	10	0		DEAEHN
CC(C)[C@H](NC(=O)OC(C)(C)C)[C@]1(C)NCCc2ncn(C)c21	ZINC000725242734	542770238	/nfs/dbraw/zinc/77/02/38/542770238.db2.gz	NYPJEEIYIPBFDI-GUYCJALGSA-N	0	3	322.453	2.330	10	0		DEAEHN
C[C@H]1CCCN(CCNC(=O)NCc2ccc3cc[nH]c3n2)C1	ZINC000357607589	133087986	/nfs/dbraw/zinc/08/79/86/133087986.db2.gz	KQOODYHSTGLSTC-ZDUSSCGKSA-N	0	3	315.421	2.094	10	0		DEAEHN
C[C@@H](C(=O)N1C[C@]2(CCOC2)OC(C)(C)C1)N1CCCCCC1	ZINC000358228832	133130073	/nfs/dbraw/zinc/13/00/73/133130073.db2.gz	SZPPYKBPZFRRNA-YJBOKZPZSA-N	0	3	324.465	2.047	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC[C@@H](c2noc(C3CC3)n2)C1)N(C)C	ZINC000360692454	133195018	/nfs/dbraw/zinc/19/50/18/133195018.db2.gz	PQJZSFRZMVXYIS-ZIAGYGMSSA-N	0	3	320.437	2.383	10	0		DEAEHN
Cc1ccc([C@@H]2CCCN2C[C@H](O)COC2CCOCC2)o1	ZINC000368549489	133277717	/nfs/dbraw/zinc/27/77/17/133277717.db2.gz	QCRYAFWYURYLBX-HOCLYGCPSA-N	0	3	309.406	2.281	10	0		DEAEHN
Cc1ccncc1CN[C@@H]1CCCN(c2ccccc2C(N)=O)C1	ZINC000373005322	133373982	/nfs/dbraw/zinc/37/39/82/133373982.db2.gz	YDQXBFJBPZBHMA-MRXNPFEDSA-N	0	3	324.428	2.248	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@H]2CCCC[C@@H]2O)C1	ZINC000373019543	133374335	/nfs/dbraw/zinc/37/43/35/133374335.db2.gz	HWBGUXPUVMDBTF-HZMVEIRTSA-N	0	3	323.481	2.196	10	0		DEAEHN
C[C@@H](C(=O)N[C@@H](Cc1ccccc1)CN(C)C)C1CCOCC1	ZINC000121585949	144684997	/nfs/dbraw/zinc/68/49/97/144684997.db2.gz	MCTQQRDTMOEXNW-QAPCUYQASA-N	0	3	318.461	2.338	10	0		DEAEHN
O=C([C@H]1C[C@H]1c1c(F)cccc1F)N1CCN2CCC1CC2	ZINC000188667475	145015604	/nfs/dbraw/zinc/01/56/04/145015604.db2.gz	OXDHRKULWMIIKV-OLZOCXBDSA-N	0	3	306.356	2.375	10	0		DEAEHN
O=C(COc1ccccc1F)NCc1ccc2c(c1)CNC2	ZINC000188735906	145016809	/nfs/dbraw/zinc/01/68/09/145016809.db2.gz	SEJAJKGFJCWDFM-UHFFFAOYSA-N	0	3	300.333	2.124	10	0		DEAEHN
C[C@H](CNC(=O)c1csc(C(F)(F)F)n1)N(C)C1CC1	ZINC000188889293	145019124	/nfs/dbraw/zinc/01/91/24/145019124.db2.gz	HFFNTXILMZUQQB-SSDOTTSWSA-N	0	3	307.341	2.374	10	0		DEAEHN
CN(Cc1ccc(F)nc1)[C@@H]1CCCN(c2cccnn2)C1	ZINC000189336261	145026110	/nfs/dbraw/zinc/02/61/10/145026110.db2.gz	VRAZCKLULMIPIN-CQSZACIVSA-N	0	3	301.369	2.112	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CCCCCS(=O)(=O)CC	ZINC000190624813	145044690	/nfs/dbraw/zinc/04/46/90/145044690.db2.gz	IGMIMKWIQZYTAL-OAHLLOKOSA-N	0	3	304.500	2.008	10	0		DEAEHN
CCN(CC(=O)OC(C)(C)C)C1CCN(Cc2c[nH]cn2)CC1	ZINC000190831243	145048833	/nfs/dbraw/zinc/04/88/33/145048833.db2.gz	PDGBKKFSEGQASD-UHFFFAOYSA-N	0	3	322.453	2.038	10	0		DEAEHN
CCN(CC(=O)OC(C)(C)C)C1CCN(Cc2cnc[nH]2)CC1	ZINC000190831243	145048834	/nfs/dbraw/zinc/04/88/34/145048834.db2.gz	PDGBKKFSEGQASD-UHFFFAOYSA-N	0	3	322.453	2.038	10	0		DEAEHN
COCCN1CCC[C@@H]1CNCc1ccc(Br)o1	ZINC000190944224	145050325	/nfs/dbraw/zinc/05/03/25/145050325.db2.gz	YUEHDUZSBJMWFO-LLVKDONJSA-N	0	3	317.227	2.243	10	0		DEAEHN
Cc1cc(NC(=O)C2CCN(C[C@@H]3CCC=CO3)CC2)no1	ZINC000191068827	145052336	/nfs/dbraw/zinc/05/23/36/145052336.db2.gz	QNIHATRZJDHLJW-AWEZNQCLSA-N	0	3	305.378	2.326	10	0		DEAEHN
CSC1(C(=O)N2CC[C@H](CN(C)Cc3cccnc3)C2)CC1	ZINC000191055245	145052541	/nfs/dbraw/zinc/05/25/41/145052541.db2.gz	LEQJYNRFJSSOGK-OAHLLOKOSA-N	0	3	319.474	2.258	10	0		DEAEHN
COC(=O)CCCN1C[C@H](C(=O)OC)C[C@@H](c2ccccc2)C1	ZINC000246227648	145095530	/nfs/dbraw/zinc/09/55/30/145095530.db2.gz	FNTQTZPQYNQYAQ-HZPDHXFCSA-N	0	3	319.401	2.218	10	0		DEAEHN
Cc1cc(NC(=O)CCN2CC[C@@H](C)[C@@H](n3ccnc3)C2)no1	ZINC000246345038	145099604	/nfs/dbraw/zinc/09/96/04/145099604.db2.gz	VEYHOUNCJAYRDI-OCCSQVGLSA-N	0	3	317.393	2.091	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)cc1	ZINC000246331922	145099632	/nfs/dbraw/zinc/09/96/32/145099632.db2.gz	GHTNVNBTGWJNEE-CZUORRHYSA-N	0	3	317.433	2.032	10	0		DEAEHN
Cc1ccc(C)c(OCCN2C[C@@H](C)[C@@H](N3CCOCC3)C2)c1	ZINC000246428922	145102830	/nfs/dbraw/zinc/10/28/30/145102830.db2.gz	LCYRHPFHUYGMFI-MSOLQXFVSA-N	0	3	318.461	2.335	10	0		DEAEHN
C[C@H](C(=O)NCc1ccccc1F)N1CC[C@@H]2OCCC[C@@H]2C1	ZINC000246445727	145102950	/nfs/dbraw/zinc/10/29/50/145102950.db2.gz	BOZHSDIPLNHNGB-UNEWFSDZSA-N	0	3	320.408	2.331	10	0		DEAEHN
O=C(CN1CC[C@@H]2OCCC[C@H]2C1)N1CCc2ccccc2C1	ZINC000246731997	145111786	/nfs/dbraw/zinc/11/17/86/145111786.db2.gz	ORVJMUAIBZZLPH-ROUUACIJSA-N	0	3	314.429	2.072	10	0		DEAEHN
C[C@H](Sc1ccccn1)C(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000246728590	145111912	/nfs/dbraw/zinc/11/19/12/145111912.db2.gz	XHRSJIPTNSYHRS-RDBSUJKOSA-N	0	3	305.447	2.257	10	0		DEAEHN
O=C(C[C@@H]1CCOc2ccccc21)N1CCN2CCC[C@H]2C1	ZINC000246776128	145113475	/nfs/dbraw/zinc/11/34/75/145113475.db2.gz	VOYAFBZAROBMOK-GJZGRUSLSA-N	0	3	300.402	2.249	10	0		DEAEHN
O[C@H](COc1ccccc1F)CN1CC[C@H]2OCCC[C@H]2C1	ZINC000246808191	145114959	/nfs/dbraw/zinc/11/49/59/145114959.db2.gz	RVAZPVAWPLOHKK-OFQRWUPVSA-N	0	3	309.381	2.066	10	0		DEAEHN
CC(C)N(CC(=O)N1CCO[C@@H]2CCCC[C@H]21)C1CCOCC1	ZINC000246881016	145118044	/nfs/dbraw/zinc/11/80/44/145118044.db2.gz	FXLNCGSRWBMUKN-IAGOWNOFSA-N	0	3	324.465	2.046	10	0		DEAEHN
C[C@H](O)CN1CCN(CCCOCCc2ccccc2)C[C@H]1C	ZINC000247050457	145125097	/nfs/dbraw/zinc/12/50/97/145125097.db2.gz	FGSJYOCPKLIZSB-MSOLQXFVSA-N	0	3	320.477	2.023	10	0		DEAEHN
C[C@H](NC(=O)N1CCN2CCC[C@H]2C1)c1nc2ccccc2[nH]1	ZINC000247185150	145128303	/nfs/dbraw/zinc/12/83/03/145128303.db2.gz	NUHJSSIDTDMWHH-STQMWFEESA-N	0	3	313.405	2.114	10	0		DEAEHN
Cc1csc([C@@H](NC(=O)N2CCN3CCC[C@H]3C2)C2CC2)n1	ZINC000247230805	145129390	/nfs/dbraw/zinc/12/93/90/145129390.db2.gz	WYPNCUUZALVOQQ-KBPBESRZSA-N	0	3	320.462	2.392	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](C)c1ccc(F)cc1)N1CCN2CCC[C@H]2C1	ZINC000247392868	145135960	/nfs/dbraw/zinc/13/59/60/145135960.db2.gz	XJZUBZQCNGFKLU-VBQJREDUSA-N	0	3	319.424	2.171	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(CC(=O)N2CCC[C@@H](C)C2)C1	ZINC000247394207	145136101	/nfs/dbraw/zinc/13/61/01/145136101.db2.gz	XOBWFMNUWIAWJA-CVEARBPZSA-N	0	3	318.465	2.341	10	0		DEAEHN
C[C@H](c1cn(-c2ccccc2)nn1)N1CCN2CCCC[C@H]2C1	ZINC000247455370	145137660	/nfs/dbraw/zinc/13/76/60/145137660.db2.gz	PFABSWDINZPMTR-WBVHZDCISA-N	0	3	311.433	2.498	10	0		DEAEHN
C[C@@H]1C[C@H](c2cccc(F)c2)N(C[C@@H](O)CN2CCCC2=O)C1	ZINC000247485292	145138613	/nfs/dbraw/zinc/13/86/13/145138613.db2.gz	KMQWBQINGQRXLK-XOKHGSTOSA-N	0	3	320.408	2.192	10	0		DEAEHN
C[C@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N1CC[C@@H](c2cnn(C)c2)C1	ZINC000247571323	145141426	/nfs/dbraw/zinc/14/14/26/145141426.db2.gz	WSUAWUBTVJEETG-QKPAOTATSA-N	0	3	318.465	2.387	10	0		DEAEHN
C[C@@H]1CCC[C@H](C)N1C(=O)CN1CC[C@]2(O)CCCC[C@H]2C1	ZINC000248025730	145146123	/nfs/dbraw/zinc/14/61/23/145146123.db2.gz	OXELYCZDTSZMAT-UIBIWLFHSA-N	0	3	308.466	2.403	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccncn1	ZINC000248759200	145167453	/nfs/dbraw/zinc/16/74/53/145167453.db2.gz	JDPGMZCNXDANJA-UKRRQHHQSA-N	0	3	311.389	2.119	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@H]2c3ccccc3C[C@@H]2O)C12CCOCC2	ZINC000249048149	145176816	/nfs/dbraw/zinc/17/68/16/145176816.db2.gz	WJOJPPJKOUTQRI-FJIDUMEYSA-N	0	3	317.429	2.209	10	0		DEAEHN
C[C@H](CCc1ccccc1)NC(=O)N1CCN2CCC[C@H]2C1	ZINC000252442120	145199272	/nfs/dbraw/zinc/19/92/72/145199272.db2.gz	QKCIZOKMARHXRS-WBVHZDCISA-N	0	3	301.434	2.497	10	0		DEAEHN
CCC(C)(C)NC(=O)CN1CCNC[C@H]1c1cccc(F)c1	ZINC000261601300	145209297	/nfs/dbraw/zinc/20/92/97/145209297.db2.gz	AGJPRYKNMCVPAK-HNNXBMFYSA-N	0	3	307.413	2.077	10	0		DEAEHN
C[C@@H](NC(=O)[C@H]1NCCCC1(C)C)c1ccc2c(c1)OCCO2	ZINC000261626227	145211948	/nfs/dbraw/zinc/21/19/48/145211948.db2.gz	CQRWYPVFYXIYFV-MLGOLLRUSA-N	0	3	318.417	2.413	10	0		DEAEHN
Cn1c(CCN2CCNC[C@H]2c2cccnc2)nc2ccccc21	ZINC000261640686	145212818	/nfs/dbraw/zinc/21/28/18/145212818.db2.gz	FQQHNRKBRATSJD-SFHVURJKSA-N	0	3	321.428	2.157	10	0		DEAEHN
C[C@]1(CCc2ccccc2)CCN(C(=O)C2(N)CCOCC2)C1	ZINC000261668464	145215107	/nfs/dbraw/zinc/21/51/07/145215107.db2.gz	BSUXOAPNBVFEHP-SFHVURJKSA-N	0	3	316.445	2.366	10	0		DEAEHN
Cc1nc(-c2cccc(NC(=O)C3(N)CCOCC3)c2)oc1C	ZINC000261692579	145217369	/nfs/dbraw/zinc/21/73/69/145217369.db2.gz	DHLNABQZHKJGGY-UHFFFAOYSA-N	0	3	315.373	2.405	10	0		DEAEHN
COc1c(C)cc(CN(C)C(=O)[C@@H](N)C2CCOCC2)cc1C	ZINC000261827220	145231144	/nfs/dbraw/zinc/23/11/44/145231144.db2.gz	PTRHXGHIBAQYIV-INIZCTEOSA-N	0	3	320.433	2.024	10	0		DEAEHN
CC(=O)Nc1cccc(N[C@@H]2CCC[C@H]2[C@H]2COCCN2)c1	ZINC000261952217	145246561	/nfs/dbraw/zinc/24/65/61/145246561.db2.gz	OLOHDWZWYPDLIA-BRWVUGGUSA-N	0	3	303.406	2.214	10	0		DEAEHN
NC1(C(=O)NCC2(c3ccc(F)cc3)CCCC2)CCOCC1	ZINC000261952514	145246634	/nfs/dbraw/zinc/24/66/34/145246634.db2.gz	ZEHSCHQZOKLAFH-UHFFFAOYSA-N	0	3	320.408	2.262	10	0		DEAEHN
COCCNCC(=O)N[C@H](C)c1cc(Cl)ccc1Cl	ZINC000262145665	145266106	/nfs/dbraw/zinc/26/61/06/145266106.db2.gz	YJTUGUJGBFADEL-SECBINFHSA-N	0	3	305.205	2.407	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)Nc1ccc(F)c(F)c1	ZINC000262402147	145281191	/nfs/dbraw/zinc/28/11/91/145281191.db2.gz	CKSCIXWNPRZYDK-OWRWGESLSA-N	0	3	310.344	2.436	10	0		DEAEHN
COc1cc(CN(C)C(=O)[C@H]2NCCCC2(C)C)ccc1O	ZINC000262395608	145281477	/nfs/dbraw/zinc/28/14/77/145281477.db2.gz	BTYLFNLTPPLZGC-OAHLLOKOSA-N	0	3	306.406	2.137	10	0		DEAEHN
Cc1ccc(O)c(NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)c1	ZINC000262425982	145283700	/nfs/dbraw/zinc/28/37/00/145283700.db2.gz	FKGQVQCCVOYFQP-JDSLSITLSA-N	0	3	304.390	2.172	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)Nc1cc(F)cc(F)c1	ZINC000262460149	145284754	/nfs/dbraw/zinc/28/47/54/145284754.db2.gz	ILCKKAIJFZAFCQ-ZENOOKHLSA-N	0	3	310.344	2.436	10	0		DEAEHN
COc1ccc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)cc1	ZINC000262486955	145287385	/nfs/dbraw/zinc/28/73/85/145287385.db2.gz	KNNOQPOFKBTEGX-JKIFEVAISA-N	0	3	304.390	2.166	10	0		DEAEHN
COc1ccc(NC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)cc1	ZINC000262486954	145287437	/nfs/dbraw/zinc/28/74/37/145287437.db2.gz	KNNOQPOFKBTEGX-JJRVBVJISA-N	0	3	304.390	2.166	10	0		DEAEHN
Cc1ccc(CNC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)cc1	ZINC000262553502	145292136	/nfs/dbraw/zinc/29/21/36/145292136.db2.gz	SWEWQFFAPASAJS-RVKKMQEKSA-N	0	3	302.418	2.144	10	0		DEAEHN
CSc1cccc(NC(=O)c2n[nH]c3c2CNCC3)c1C	ZINC000262770740	145303994	/nfs/dbraw/zinc/30/39/94/145303994.db2.gz	ISWSRZSIHXHESC-UHFFFAOYSA-N	0	3	302.403	2.338	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2cc3c(s2)CCCC3)n1	ZINC000263150702	145330329	/nfs/dbraw/zinc/33/03/29/145330329.db2.gz	DBECTJWKPOQXEX-NSHDSACASA-N	0	3	304.419	2.253	10	0		DEAEHN
CC(C)[C@H](C(=O)N1CCC[C@@H](c2noc(C3CC3)n2)C1)N(C)C	ZINC000349570630	146386960	/nfs/dbraw/zinc/38/69/60/146386960.db2.gz	SWOVKRZNVOQIME-ZIAGYGMSSA-N	0	3	320.437	2.239	10	0		DEAEHN
CC(C)(C)c1n[nH]cc1CNC[C@@H]1CCC2(CCOCC2)[C@H]1O	ZINC000374707775	148280541	/nfs/dbraw/zinc/28/05/41/148280541.db2.gz	RHPWQBGQGIVZTD-BBRMVZONSA-N	0	3	321.465	2.365	10	0		DEAEHN
CCc1cnc(CCNC(=O)N[C@@H](C)CN2CCCCC2)s1	ZINC000073664319	401720055	/nfs/dbraw/zinc/72/00/55/401720055.db2.gz	SXFKERCHTUXGSW-ZDUSSCGKSA-N	0	3	324.494	2.422	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)N1C[C@@H]2[C@H](C1)C2(C)C	ZINC000073793658	401721983	/nfs/dbraw/zinc/72/19/83/401721983.db2.gz	HRCZDFHUGQVHGV-YESZJQIVSA-N	0	3	315.461	2.457	10	0		DEAEHN
Cc1ccccc1[C@@H](C)NC(=O)NCC1CCN(CCO)CC1	ZINC000111789310	401723903	/nfs/dbraw/zinc/72/39/03/401723903.db2.gz	IXMJFLBVJFNRPF-OAHLLOKOSA-N	0	3	319.449	2.060	10	0		DEAEHN
CCN(CCNC(=O)N1CCC[C@H](n2cc(C)cn2)C1)C1CC1	ZINC000111849960	401726050	/nfs/dbraw/zinc/72/60/50/401726050.db2.gz	VSFXUGVOYKHNBY-INIZCTEOSA-N	0	3	319.453	2.022	10	0		DEAEHN
CN(C)CCN(C(=O)c1cnn2c1CCCC2)c1ccccc1	ZINC000126487443	401696718	/nfs/dbraw/zinc/69/67/18/401696718.db2.gz	AVJNIUITEAQPCO-UHFFFAOYSA-N	0	3	312.417	2.428	10	0		DEAEHN
CN(CCn1cccn1)C[C@@H](O)COCc1ccc(Cl)cc1	ZINC000111278954	401707654	/nfs/dbraw/zinc/70/76/54/401707654.db2.gz	MMWVGVSLBHJDAU-MRXNPFEDSA-N	0	3	323.824	2.046	10	0		DEAEHN
CCC(CC)C(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000114415537	401798507	/nfs/dbraw/zinc/79/85/07/401798507.db2.gz	NYOMKABDOACEKG-UHFFFAOYSA-N	0	3	318.465	2.228	10	0		DEAEHN
Cc1cccc(C)c1OCCCN1CCO[C@@H](CN(C)C)C1	ZINC000112697946	401754652	/nfs/dbraw/zinc/75/46/52/401754652.db2.gz	ZZMXHAPUQAFHEU-KRWDZBQOSA-N	0	3	306.450	2.335	10	0		DEAEHN
Fc1ccc(OC2CCN(CCCN3CCOCC3)CC2)cc1	ZINC000075746158	401768047	/nfs/dbraw/zinc/76/80/47/401768047.db2.gz	ONRNUDKRYIWQCI-UHFFFAOYSA-N	0	3	322.424	2.391	10	0		DEAEHN
CCOc1ccc(OCC(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1	ZINC000113226724	401770782	/nfs/dbraw/zinc/77/07/82/401770782.db2.gz	LQXBLINQKUDDMU-LSDHHAIUSA-N	0	3	318.417	2.159	10	0		DEAEHN
OCCN(C[C@@H](O)COc1c(Cl)cccc1Cl)C1CC1	ZINC000077761418	401829687	/nfs/dbraw/zinc/82/96/87/401829687.db2.gz	FIRSQUIXWPWYFJ-LLVKDONJSA-N	0	3	320.216	2.190	10	0		DEAEHN
C[C@H](NC[C@H]1CN(C)CCO1)c1ccc(Br)cc1	ZINC000078469447	401852261	/nfs/dbraw/zinc/85/22/61/401852261.db2.gz	ORTZTRPHUBFWBC-FZMZJTMJSA-N	0	3	313.239	2.430	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)C2(c3ccc(Cl)cc3)CC2)CCO1	ZINC000116795826	401859280	/nfs/dbraw/zinc/85/92/80/401859280.db2.gz	ILRIZEXLAMMGRW-OAHLLOKOSA-N	0	3	322.836	2.161	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2cc3c(s2)CCCC3)CCO1	ZINC000116796255	401859758	/nfs/dbraw/zinc/85/97/58/401859758.db2.gz	WNUURAHSLSHQTO-ZDUSSCGKSA-N	0	3	308.447	2.030	10	0		DEAEHN
COc1cc(CN(C[C@H]2CCOC2)C2CC2)cc2c1OCCO2	ZINC000129945023	401812366	/nfs/dbraw/zinc/81/23/66/401812366.db2.gz	WWJFVBWMBNJULA-CYBMUJFWSA-N	0	3	319.401	2.467	10	0		DEAEHN
CC(C)CCn1cccc1CNC[C@@H]1CN(C2CC2)CCO1	ZINC000119131064	401927640	/nfs/dbraw/zinc/92/76/40/401927640.db2.gz	SKHLDAOSMQTJFS-GOSISDBHSA-N	0	3	305.466	2.487	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc(C(=O)OC(C)C)cc1	ZINC000135140665	401927722	/nfs/dbraw/zinc/92/77/22/401927722.db2.gz	QRCZHLFKIXHUKF-QGZVFWFLSA-N	0	3	309.406	2.129	10	0		DEAEHN
CNc1cc(N2CCC[C@H]2CNCc2nc(C)cs2)ncn1	ZINC000117385433	401875944	/nfs/dbraw/zinc/87/59/44/401875944.db2.gz	BAAPVCZTACJVKD-LBPRGKRZSA-N	0	3	318.450	2.042	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1ccc(N(C)C)nc1)c1ccccc1	ZINC000032273401	401877454	/nfs/dbraw/zinc/87/74/54/401877454.db2.gz	ORRJFXUNUHRDDJ-INIZCTEOSA-N	0	3	312.417	2.180	10	0		DEAEHN
CC[C@H]1CCCN(C(=O)NC[C@@H]2CCCN2CCOC)CC1	ZINC000117495181	401878412	/nfs/dbraw/zinc/87/84/12/401878412.db2.gz	HXZQHVMJZZTNKN-HOTGVXAUSA-N	0	3	311.470	2.319	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)Cc1ccc(O)cc1	ZINC000133364080	401882899	/nfs/dbraw/zinc/88/28/99/401882899.db2.gz	HEQQENRRQWRSEU-KRWDZBQOSA-N	0	3	312.413	2.224	10	0		DEAEHN
C[C@@H]1CCC[C@H](CN2CCN(c3ccc4nncn4n3)CC2)C1	ZINC000133383988	401884052	/nfs/dbraw/zinc/88/40/52/401884052.db2.gz	FKCYVEBJYXLNHB-CABCVRRESA-N	0	3	314.437	2.073	10	0		DEAEHN
Cc1ccccc1CN[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000035230388	401897104	/nfs/dbraw/zinc/89/71/04/401897104.db2.gz	MRVYSPFMHDIQLK-CYBMUJFWSA-N	0	3	304.415	2.493	10	0		DEAEHN
C[C@@H](NC(=O)CC1(N2CCOCC2)CCCC1)c1ccncc1	ZINC000118754834	401906674	/nfs/dbraw/zinc/90/66/74/401906674.db2.gz	QYKQQXRSGODOCZ-OAHLLOKOSA-N	0	3	317.433	2.294	10	0		DEAEHN
CC[C@H](C(=O)N1CCO[C@@H](c2ccc(F)c(C)c2)C1)N(C)C	ZINC000134798579	401915034	/nfs/dbraw/zinc/91/50/34/401915034.db2.gz	OMGTUYVNUBIPHF-HZPDHXFCSA-N	0	3	308.397	2.374	10	0		DEAEHN
COC(=O)C[C@@H](N)c1cc(OC)c(OC)cc1Br	ZINC000037754942	401917080	/nfs/dbraw/zinc/91/70/80/401917080.db2.gz	NVHNTVBCNLKQPD-SECBINFHSA-N	0	3	318.167	2.029	10	0		DEAEHN
COCCC1(CNC(=O)N[C@@H](CC(C)C)CN(C)C)CCC1	ZINC000119845236	401968974	/nfs/dbraw/zinc/96/89/74/401968974.db2.gz	LKGKCBKYKBDYSP-HNNXBMFYSA-N	0	3	313.486	2.469	10	0		DEAEHN
CN(CCCN1CCN(C)CC1)C(=O)[C@@H]1C[C@@H]1C1CCCCC1	ZINC000119899964	401971014	/nfs/dbraw/zinc/97/10/14/401971014.db2.gz	YJDZKTNGSVZAFI-QZTJIDSGSA-N	0	3	321.509	2.299	10	0		DEAEHN
CC(C)CCNC(=O)[C@H](C)N1CCC[C@H](Cc2nccn2C)C1	ZINC000090003947	401978221	/nfs/dbraw/zinc/97/82/21/401978221.db2.gz	KOUPXTWVSDHLJM-JKSUJKDBSA-N	0	3	320.481	2.225	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000120136143	401979480	/nfs/dbraw/zinc/97/94/80/401979480.db2.gz	CSSDRXKNVHYXKH-KBPBESRZSA-N	0	3	324.494	2.446	10	0		DEAEHN
CCNC(=O)N1CC[C@@H](N[C@@H](C)c2ccc(F)c(OC)c2)C1	ZINC000090410227	401982164	/nfs/dbraw/zinc/98/21/64/401982164.db2.gz	LXPNATOZXSBEBN-WCQYABFASA-N	0	3	309.385	2.289	10	0		DEAEHN
COc1cccc(C(C)(C)CNC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000120203233	401982631	/nfs/dbraw/zinc/98/26/31/401982631.db2.gz	IUFKIDZUBOUQEJ-OAHLLOKOSA-N	0	3	319.449	2.318	10	0		DEAEHN
Brc1cncnc1NCCCNCc1cccnc1	ZINC000090781710	401986919	/nfs/dbraw/zinc/98/69/19/401986919.db2.gz	FADUUOGLTKXQDS-UHFFFAOYSA-N	0	3	322.210	2.226	10	0		DEAEHN
COc1ccc(CNC2(CO)CC2)cc1OCc1cccnc1	ZINC000120391832	401988830	/nfs/dbraw/zinc/98/88/30/401988830.db2.gz	WERJVPJELNDBHS-UHFFFAOYSA-N	0	3	314.385	2.284	10	0		DEAEHN
CCCC(=O)N[C@@H]1CCCN(CCCCn2ccnc2C)C1	ZINC000120404858	401989494	/nfs/dbraw/zinc/98/94/94/401989494.db2.gz	FUZRPZHGULVKQK-MRXNPFEDSA-N	0	3	306.454	2.352	10	0		DEAEHN
CN(C)CCOc1cc(CNc2ccnc(C3CC3)n2)ccn1	ZINC000135375970	401937842	/nfs/dbraw/zinc/93/78/42/401937842.db2.gz	RYJLCEAKBFAEHI-UHFFFAOYSA-N	0	3	313.405	2.302	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cccc(Oc3cnccn3)c2)C1	ZINC000135449347	401939968	/nfs/dbraw/zinc/93/99/68/401939968.db2.gz	WCZSWYYBKHSBOS-CQSZACIVSA-N	0	3	312.373	2.045	10	0		DEAEHN
COc1ccc2c(c1)[C@H](NCCc1nc(C)no1)CCCO2	ZINC000089518748	401950482	/nfs/dbraw/zinc/95/04/82/401950482.db2.gz	OSRPHNMLPNLICH-CQSZACIVSA-N	0	3	303.362	2.433	10	0		DEAEHN
COCCOc1ccccc1CN1C[C@H]2CCC[C@@H](C1)C2O	ZINC000093479852	402015447	/nfs/dbraw/zinc/01/54/47/402015447.db2.gz	VIIHIYQZZRZCEZ-BYICEURKSA-N	0	3	305.418	2.305	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H](C)Oc1cccc(OC)c1)N(C)C	ZINC000121194177	402019879	/nfs/dbraw/zinc/01/98/79/402019879.db2.gz	MEYKZTWDOJDOCB-XJKSGUPXSA-N	0	3	308.422	2.309	10	0		DEAEHN
CCOc1ccc(NC(=O)N2CC[C@H](N3CCCC3)C2)cn1	ZINC000151521184	402041702	/nfs/dbraw/zinc/04/17/02/402041702.db2.gz	RXZTZEJUKCZQDZ-AWEZNQCLSA-N	0	3	304.394	2.182	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)Cc2ccc(OC)cc2)C1	ZINC000052593505	402044371	/nfs/dbraw/zinc/04/43/71/402044371.db2.gz	SOLPSVMFDZHHDT-HNNXBMFYSA-N	0	3	305.422	2.321	10	0		DEAEHN
CN(CC1=CCCOC1)C[C@@H](c1cccs1)N1CCOCC1	ZINC000121740925	402051058	/nfs/dbraw/zinc/05/10/58/402051058.db2.gz	JOBUHTFEIWZCSZ-INIZCTEOSA-N	0	3	322.474	2.400	10	0		DEAEHN
COc1ccc(C(F)(F)C(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1	ZINC000151819034	402058647	/nfs/dbraw/zinc/05/86/47/402058647.db2.gz	QKJMRCPBVZVWIB-TZMCWYRMSA-N	0	3	324.371	2.482	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cn(C)nc2C(C)(C)C)CCN1C	ZINC000092814749	402009695	/nfs/dbraw/zinc/00/96/95/402009695.db2.gz	MEUGAMFJJKKYQF-OLZOCXBDSA-N	0	3	306.454	2.272	10	0		DEAEHN
CN(C)CCN(C)C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000122576891	402084675	/nfs/dbraw/zinc/08/46/75/402084675.db2.gz	YBCLEXQQEQUFME-ZDUSSCGKSA-N	0	3	317.355	2.363	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cc(F)cc3nccnc32)CCN1C	ZINC000122754227	402092792	/nfs/dbraw/zinc/09/27/92/402092792.db2.gz	SARKSJBCRGFBHO-DGCLKSJQSA-N	0	3	316.380	2.324	10	0		DEAEHN
C[C@H](C(=O)N1CCc2ccccc21)N1CC[C@H]2OCCC[C@@H]2C1	ZINC000152901204	402115758	/nfs/dbraw/zinc/11/57/58/402115758.db2.gz	WWCNXIOCGXQZOV-QGPMSJSTSA-N	0	3	314.429	2.465	10	0		DEAEHN
Cc1ccccc1CCNC(=O)CN1CC[C@@H]2OCCC[C@@H]2C1	ZINC000153153108	402130384	/nfs/dbraw/zinc/13/03/84/402130384.db2.gz	FPINEMFUQFCQGT-MSOLQXFVSA-N	0	3	316.445	2.155	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)C(=O)c2ccc(Cl)cc2)CCN1C	ZINC000123761319	402144517	/nfs/dbraw/zinc/14/45/17/402144517.db2.gz	VMPCUPSGPCQDKP-BXUZGUMPSA-N	0	3	308.809	2.464	10	0		DEAEHN
COc1ccccc1OCC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000123710359	402142411	/nfs/dbraw/zinc/14/24/11/402142411.db2.gz	CLDDLDHZBDBSDA-KGLIPLIRSA-N	0	3	306.406	2.015	10	0		DEAEHN
COc1cc([C@@H](C)N[C@@H]2CCc3nc(C)nn3C2)ccc1F	ZINC000153529057	402151214	/nfs/dbraw/zinc/15/12/14/402151214.db2.gz	HGORAFGGDJLJBG-ZWNOBZJWSA-N	0	3	304.369	2.400	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1ccc2c(c1)nnn2C)c1ccccc1	ZINC000103739211	402193787	/nfs/dbraw/zinc/19/37/87/402193787.db2.gz	URBDWXAOEUVDOQ-MRXNPFEDSA-N	0	3	323.400	2.001	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)N1CCC(c2ccnn2C)CC1	ZINC000124799052	402198090	/nfs/dbraw/zinc/19/80/90/402198090.db2.gz	ZCPNWXWMMZAFBV-INIZCTEOSA-N	0	3	304.438	2.001	10	0		DEAEHN
COc1cccc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1OC	ZINC000124819007	402198490	/nfs/dbraw/zinc/19/84/90/402198490.db2.gz	ACKVZFUPFCFRQV-CHWSQXEVSA-N	0	3	306.406	2.259	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)CN[C@]2(CO)C[C@H](C)CC(C)(C)C2)C1	ZINC000124075045	402162525	/nfs/dbraw/zinc/16/25/25/402162525.db2.gz	PESMDPSCTNQYMY-IIDMSEBBSA-N	0	3	310.482	2.412	10	0		DEAEHN
CCC1(NC(=O)NCc2ccnc(OCCN(C)C)c2)CCC1	ZINC000153680840	402162555	/nfs/dbraw/zinc/16/25/55/402162555.db2.gz	VZRCUKIWHPHRHF-UHFFFAOYSA-N	0	3	320.437	2.154	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N(C)CCC2CCOCC2)C1	ZINC000153838046	402173713	/nfs/dbraw/zinc/17/37/13/402173713.db2.gz	LWPTYRSUHDAUMH-ZBFHGGJFSA-N	0	3	311.470	2.173	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N(C)CCC1CCOCC1	ZINC000125214697	402219675	/nfs/dbraw/zinc/21/96/75/402219675.db2.gz	CZURVYWKCZBVSO-INIZCTEOSA-N	0	3	313.486	2.421	10	0		DEAEHN
Cc1ccn2ncc(C(=O)NCC(C)(C)N3CCCCC3)c2n1	ZINC000069365536	402219921	/nfs/dbraw/zinc/21/99/21/402219921.db2.gz	JCHKGAHKOIHUSX-UHFFFAOYSA-N	0	3	315.421	2.032	10	0		DEAEHN
COc1ccc([C@@H](C)NC[C@H]2CCCN2C)cc1NC(C)=O	ZINC000154609383	402221438	/nfs/dbraw/zinc/22/14/38/402221438.db2.gz	AFBONLIWTZTVDP-IUODEOHRSA-N	0	3	305.422	2.398	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)c2cc3c(s2)CCOC3)[C@@H](C)C1	ZINC000155647900	402264096	/nfs/dbraw/zinc/26/40/96/402264096.db2.gz	YQODEPWLXLYBGQ-AAEUAGOBSA-N	0	3	308.447	2.279	10	0		DEAEHN
Cc1cc(C)n2c(CNC[C@@H](c3ccco3)N(C)C)cnc2n1	ZINC000155645870	402264202	/nfs/dbraw/zinc/26/42/02/402264202.db2.gz	NDKSCEKIJUKQLO-HNNXBMFYSA-N	0	3	313.405	2.332	10	0		DEAEHN
Cc1csc([C@H](C)NC(=O)N2CCCN(C3CC3)CC2)n1	ZINC000069828849	402246648	/nfs/dbraw/zinc/24/66/48/402246648.db2.gz	ZJPXCOGSMIEBOJ-LBPRGKRZSA-N	0	3	308.451	2.392	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2coc(-c3cccc(F)c3)n2)CCO1	ZINC000069969666	402252884	/nfs/dbraw/zinc/25/28/84/402252884.db2.gz	MBACVYBESRUKMJ-INIZCTEOSA-N	0	3	319.380	2.243	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)Cc1ccccc1C(F)(F)F	ZINC000104867295	402205312	/nfs/dbraw/zinc/20/53/12/402205312.db2.gz	YHACFUWSICIOKN-LBPRGKRZSA-N	0	3	300.324	2.458	10	0		DEAEHN
CC[C@H](C(=O)NC[C@@H]1CCCCN1Cc1ccccc1)N(C)C	ZINC000124994859	402207604	/nfs/dbraw/zinc/20/76/04/402207604.db2.gz	IUGJUZPVNPXGEZ-ZWKOTPCHSA-N	0	3	317.477	2.498	10	0		DEAEHN
COc1ccc(CNC(=O)N2CC[C@H](N(C)C)C2)cc1Cl	ZINC000125083017	402212144	/nfs/dbraw/zinc/21/21/44/402212144.db2.gz	LNLFYLVIMBYTCO-LBPRGKRZSA-N	0	3	311.813	2.194	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)N(C)C1CCN(CCn2cccn2)CC1	ZINC000109391464	402271910	/nfs/dbraw/zinc/27/19/10/402271910.db2.gz	FKTRZPWCOXALFZ-HNNXBMFYSA-N	0	3	321.469	2.033	10	0		DEAEHN
Cn1cc(-c2cc(CN3CC[C@@H]4OCCC[C@@H]4C3)on2)cn1	ZINC000185027890	402318031	/nfs/dbraw/zinc/31/80/31/402318031.db2.gz	BHDNDNNIHATEFV-WBMJQRKESA-N	0	3	302.378	2.076	10	0		DEAEHN
C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1ncncc1Cl	ZINC000176551061	402318709	/nfs/dbraw/zinc/31/87/09/402318709.db2.gz	ZTYYCLGWUXUVBU-GRYCIOLGSA-N	0	3	310.829	2.226	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)/C=C/c2ccc(OC)c(O)c2)C1	ZINC000185323691	402343238	/nfs/dbraw/zinc/34/32/38/402343238.db2.gz	KDVUHNRZYAESCR-KGXGESDWSA-N	0	3	304.390	2.015	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1cccc(F)c1C	ZINC000176892126	402347111	/nfs/dbraw/zinc/34/71/11/402347111.db2.gz	BPJZGYYRGZHUON-CYBMUJFWSA-N	0	3	321.396	2.015	10	0		DEAEHN
COCCN1CCN(c2c(C)cnc3c(C)cccc32)CC1=O	ZINC000185366411	402347542	/nfs/dbraw/zinc/34/75/42/402347542.db2.gz	VNHPQPVXORENLB-UHFFFAOYSA-N	0	3	313.401	2.147	10	0		DEAEHN
C[C@@H](NC(=O)NC(C)(C)CCN1CCN(C)CC1)C1CCCC1	ZINC000185393282	402349252	/nfs/dbraw/zinc/34/92/52/402349252.db2.gz	ZUJHVYUPPJOTBN-OAHLLOKOSA-N	0	3	324.513	2.280	10	0		DEAEHN
COC(=O)c1ccc(C(=O)N[C@H](C)CN2CCCCCC2)o1	ZINC000185443267	402352364	/nfs/dbraw/zinc/35/23/64/402352364.db2.gz	OAJKUQWCYGDRHP-GFCCVEGCSA-N	0	3	308.378	2.061	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccc(F)c(Br)c1	ZINC000231297173	402353696	/nfs/dbraw/zinc/35/36/96/402353696.db2.gz	NMVRJJSVVSGAEQ-JTQLQIEISA-N	0	3	315.186	2.412	10	0		DEAEHN
COc1ccc([C@H](NC[C@@H](C)CS(C)(=O)=O)C2CC2)cc1	ZINC000176956385	402354087	/nfs/dbraw/zinc/35/40/87/402354087.db2.gz	HJCWROMCBMPLMX-MLGOLLRUSA-N	0	3	311.447	2.417	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cccc(C[S@](C)=O)c1	ZINC000176966427	402355192	/nfs/dbraw/zinc/35/51/92/402355192.db2.gz	FVQAANUDBFQCQY-ZHRRBRCNSA-N	0	3	322.474	2.121	10	0		DEAEHN
COc1ccc(CNCC[C@@H](C)NC(=O)OC(C)(C)C)cn1	ZINC000232149275	402356668	/nfs/dbraw/zinc/35/66/68/402356668.db2.gz	FSDGWGQVKMGEEV-GFCCVEGCSA-N	0	3	309.410	2.483	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CCOc1ccc(OC)cc1	ZINC000177017108	402359632	/nfs/dbraw/zinc/35/96/32/402359632.db2.gz	APZOOWMJDRHDCO-OAHLLOKOSA-N	0	3	320.433	2.407	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Cc1noc2ccccc21	ZINC000177019526	402360192	/nfs/dbraw/zinc/36/01/92/402360192.db2.gz	ARFAPQCINQFPJV-ZDUSSCGKSA-N	0	3	301.390	2.313	10	0		DEAEHN
Brc1ccc2ncc(CN[C@@H]3CCCOC3)n2c1	ZINC000236765051	402381516	/nfs/dbraw/zinc/38/15/16/402381516.db2.gz	DGQXHQSPLMCIQB-LLVKDONJSA-N	0	3	310.195	2.365	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1C(=O)[C@@H](C)N1CCCCCC1	ZINC000177222529	402383068	/nfs/dbraw/zinc/38/30/68/402383068.db2.gz	LTOSSVRDPHXDHS-WBVHZDCISA-N	0	3	318.465	2.447	10	0		DEAEHN
CC(C)(C)c1ccc(OCCCN2C[C@H](O)C[C@@H]2CO)cc1	ZINC000185179336	402331324	/nfs/dbraw/zinc/33/13/24/402331324.db2.gz	SAAQNHUOZBTDCL-HZPDHXFCSA-N	0	3	307.434	2.181	10	0		DEAEHN
COCCOCCN1CC[C@@H](c2cc(OC)cc(OC)c2)C1	ZINC000177411962	402399888	/nfs/dbraw/zinc/39/98/88/402399888.db2.gz	BIERZUUYETXLTF-CQSZACIVSA-N	0	3	309.406	2.156	10	0		DEAEHN
COCCNCC(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1	ZINC000237211252	402400124	/nfs/dbraw/zinc/40/01/24/402400124.db2.gz	RVOHDOOUHBAPOJ-AWEZNQCLSA-N	0	3	313.401	2.162	10	0		DEAEHN
C[C@@H](c1cn(-c2ccccc2)nn1)N1CCCN(C2CC2)CC1	ZINC000177515944	402411639	/nfs/dbraw/zinc/41/16/39/402411639.db2.gz	BRSVLGSTKQMFIO-HNNXBMFYSA-N	0	3	311.433	2.498	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H](C)Cc1c(C)noc1C	ZINC000177535825	402413949	/nfs/dbraw/zinc/41/39/49/402413949.db2.gz	OMUOEYJFHPFNOT-SWLSCSKDSA-N	0	3	322.453	2.348	10	0		DEAEHN
CC(C)c1ccccc1OC[C@H](O)CN1CCC(C)(O)CC1	ZINC000177543565	402414208	/nfs/dbraw/zinc/41/42/08/402414208.db2.gz	JMEDCGFUACXTAF-OAHLLOKOSA-N	0	3	307.434	2.397	10	0		DEAEHN
CC(C)c1ccccc1OC[C@@H](O)CN1CCC(C)(O)CC1	ZINC000177543580	402414427	/nfs/dbraw/zinc/41/44/27/402414427.db2.gz	JMEDCGFUACXTAF-HNNXBMFYSA-N	0	3	307.434	2.397	10	0		DEAEHN
COCCC1(CNC(=O)N2CC[C@@H](N(C)C)C2)CCCCC1	ZINC000186291197	402418229	/nfs/dbraw/zinc/41/82/29/402418229.db2.gz	DKUXSJRDVFYRPL-OAHLLOKOSA-N	0	3	311.470	2.319	10	0		DEAEHN
Cc1cccc2[nH]c(CCC(=O)N3CCNC(C)(C)C3)nc21	ZINC000177703718	402428501	/nfs/dbraw/zinc/42/85/01/402428501.db2.gz	GAWBHFONPUPVHQ-UHFFFAOYSA-N	0	3	300.406	2.014	10	0		DEAEHN
Cc1cccc2nc(CCC(=O)N3CCNC(C)(C)C3)[nH]c21	ZINC000177703718	402428503	/nfs/dbraw/zinc/42/85/03/402428503.db2.gz	GAWBHFONPUPVHQ-UHFFFAOYSA-N	0	3	300.406	2.014	10	0		DEAEHN
OCC[C@@H](NC1CCN(Cc2cccnc2)CC1)c1ccco1	ZINC000186536580	402440399	/nfs/dbraw/zinc/44/03/99/402440399.db2.gz	BOBSFABHIZUEAF-QGZVFWFLSA-N	0	3	315.417	2.352	10	0		DEAEHN
CC(C)CNC(=O)CN[C@@H](C)c1ccccc1-n1cccn1	ZINC000177324936	402391334	/nfs/dbraw/zinc/39/13/34/402391334.db2.gz	HCYGUBJDCPGULC-AWEZNQCLSA-N	0	3	300.406	2.295	10	0		DEAEHN
CCn1c2ccccc2c2cc(NC(=O)[C@@H]3C[C@@H](O)CN3)ccc21	ZINC000237012982	402391536	/nfs/dbraw/zinc/39/15/36/402391536.db2.gz	YZSJCYKHORQVJY-CJNGLKHVSA-N	0	3	323.396	2.476	10	0		DEAEHN
Cc1cccc(C)c1OCCN1C[C@@H](C)[C@@H](N2CCOCC2)C1	ZINC000246116882	402511274	/nfs/dbraw/zinc/51/12/74/402511274.db2.gz	KSZVYKQGEMDTEO-MSOLQXFVSA-N	0	3	318.461	2.335	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C)C(=O)Nc1ccc(OC)cc1	ZINC000245457408	402462466	/nfs/dbraw/zinc/46/24/66/402462466.db2.gz	CCNZZQJYFRPGCG-ZBFHGGJFSA-N	0	3	319.449	2.438	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C)C(=O)NCCc1cccs1	ZINC000245474646	402464443	/nfs/dbraw/zinc/46/44/43/402464443.db2.gz	RDGHAHJIZHTKDA-CABCVRRESA-N	0	3	323.506	2.211	10	0		DEAEHN
CCCn1cc(CN2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)cn1	ZINC000245569187	402471606	/nfs/dbraw/zinc/47/16/06/402471606.db2.gz	VYUBBKUTYFNHMX-XYJFISCASA-N	0	3	320.481	2.367	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1	ZINC000178260860	402477117	/nfs/dbraw/zinc/47/71/17/402477117.db2.gz	UJXPYOHURFQYGG-PNBKFKSVSA-N	0	3	308.466	2.380	10	0		DEAEHN
C[C@H](Cc1ccc(O)cc1)NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000245660236	402477362	/nfs/dbraw/zinc/47/73/62/402477362.db2.gz	DAKUDFPRCLMYSK-IIAWOOMASA-N	0	3	319.449	2.447	10	0		DEAEHN
CC(C)[C@@](C)(O)CN1CCc2c(cccc2N2CCOC2=O)C1	ZINC000187088185	402482411	/nfs/dbraw/zinc/48/24/11/402482411.db2.gz	BKOFOZUOCFECMJ-SFHVURJKSA-N	0	3	318.417	2.408	10	0		DEAEHN
Cn1cc(CN2CC[C@@H]3OCCC[C@H]3C2)c(-c2cccnc2)n1	ZINC000245730884	402483560	/nfs/dbraw/zinc/48/35/60/402483560.db2.gz	JTUFDYLXCROURQ-RDJZCZTQSA-N	0	3	312.417	2.483	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H](C[C@H](C)O)c1ccccc1)N(C)C	ZINC000245754601	402485671	/nfs/dbraw/zinc/48/56/71/402485671.db2.gz	HJOVRVSQCPHGIA-USXIJHARSA-N	0	3	306.450	2.388	10	0		DEAEHN
C[C@@H]1CN(CC2=Cc3ccccc3OC2)C[C@H]1N1CCOCC1	ZINC000245767342	402486305	/nfs/dbraw/zinc/48/63/05/402486305.db2.gz	RBLDZNUEKZXJEF-CRAIPNDOSA-N	0	3	314.429	2.115	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cnc([C@H]2CCCO2)s1	ZINC000245846882	402491476	/nfs/dbraw/zinc/49/14/76/402491476.db2.gz	IOJUZRLZEBCQJS-FRRDWIJNSA-N	0	3	321.446	2.303	10	0		DEAEHN
CCN(C)[C@H](C(=O)N1CCN2CCCC[C@H]2C1)c1ccccc1	ZINC000245869455	402492616	/nfs/dbraw/zinc/49/26/16/402492616.db2.gz	VQTAGBCKMBXNFC-ROUUACIJSA-N	0	3	315.461	2.376	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)NCc2ccc(Cl)nc2)C1	ZINC000245923853	402497875	/nfs/dbraw/zinc/49/78/75/402497875.db2.gz	HJGWUZLMYJPNPF-KBPBESRZSA-N	0	3	322.840	2.361	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N(CCN(C)C)C(C)C	ZINC000187496715	402502595	/nfs/dbraw/zinc/50/25/95/402502595.db2.gz	WINCJRKGJVIXJS-ZDUSSCGKSA-N	0	3	308.426	2.133	10	0		DEAEHN
COc1cccc(C[C@H](NCc2cc(C(N)=O)co2)C2CC2)c1	ZINC000187713317	402509501	/nfs/dbraw/zinc/50/95/01/402509501.db2.gz	DFJKVBVBEDUZCX-KRWDZBQOSA-N	0	3	314.385	2.498	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)NCCCc1ccccn1	ZINC000178808761	402542293	/nfs/dbraw/zinc/54/22/93/402542293.db2.gz	RGSBWJYRUCJCPI-OAHLLOKOSA-N	0	3	304.438	2.188	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)N1CC[C@@H]2OCCC[C@@H]2C1	ZINC000246780553	402544420	/nfs/dbraw/zinc/54/44/20/402544420.db2.gz	QTWMJXCJZGSUGK-OAGGEKHMSA-N	0	3	309.454	2.071	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)N1CC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000246971285	402551850	/nfs/dbraw/zinc/55/18/50/402551850.db2.gz	JCVUYYBCDNCWEC-KGLIPLIRSA-N	0	3	310.438	2.051	10	0		DEAEHN
Cc1oc(-c2ccsc2)nc1CC(=O)NC[C@@H]1CCCN1C	ZINC000171116064	402559371	/nfs/dbraw/zinc/55/93/71/402559371.db2.gz	PVPVJHAYQWCMAW-ZDUSSCGKSA-N	0	3	319.430	2.464	10	0		DEAEHN
COC(=O)CCNC(=O)CN[C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000171127940	402559823	/nfs/dbraw/zinc/55/98/23/402559823.db2.gz	YDAWNBMDSRTUON-MRXNPFEDSA-N	0	3	324.808	2.060	10	0		DEAEHN
CCOc1ccc(OCC(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1	ZINC000247201224	402560099	/nfs/dbraw/zinc/56/00/99/402560099.db2.gz	LQXBLINQKUDDMU-CABCVRRESA-N	0	3	318.417	2.159	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@@H]2Oc3ccccc3[C@H]2C)C1	ZINC000247366495	402564931	/nfs/dbraw/zinc/56/49/31/402564931.db2.gz	OWIRHZDBLYOESL-LNCBFAARSA-N	0	3	302.418	2.396	10	0		DEAEHN
Cc1cccc(C)c1OC[C@@H](C)NC(=O)NC[C@@H]1CCCN1C	ZINC000171192874	402565462	/nfs/dbraw/zinc/56/54/62/402565462.db2.gz	OPWBLUPSIZIFOC-CVEARBPZSA-N	0	3	319.449	2.464	10	0		DEAEHN
CCN(CCC(=O)Nc1cc(C)on1)CCc1nccs1	ZINC000179037667	402566976	/nfs/dbraw/zinc/56/69/76/402566976.db2.gz	ASOPSWSGGYHQDV-UHFFFAOYSA-N	0	3	308.407	2.333	10	0		DEAEHN
CN(C)C(=O)CN1CCCCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000246177208	402515406	/nfs/dbraw/zinc/51/54/06/402515406.db2.gz	GLHQSGMQPKKSTP-IAGOWNOFSA-N	0	3	304.434	2.443	10	0		DEAEHN
CCc1noc(CC)c1CC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000246226738	402519072	/nfs/dbraw/zinc/51/90/72/402519072.db2.gz	WMHMQVWEUIKXJE-STQMWFEESA-N	0	3	307.438	2.283	10	0		DEAEHN
Cc1ccc([C@@H](C)NC(=O)CN2CCN3CCC[C@@H]3C2)cc1C	ZINC000178631297	402519423	/nfs/dbraw/zinc/51/94/23/402519423.db2.gz	RQECHNGINRRBQG-SJLPKXTDSA-N	0	3	315.461	2.261	10	0		DEAEHN
CCC[C@H](C(=O)NCCCc1nc2ccccc2[nH]1)N(C)C	ZINC000178653864	402521749	/nfs/dbraw/zinc/52/17/49/402521749.db2.gz	GQAGLSMBYKKCJT-OAHLLOKOSA-N	0	3	302.422	2.342	10	0		DEAEHN
CCOC(=O)N1CCCN(C[C@@](C)(O)c2ccccc2)CC1	ZINC000170777463	402524447	/nfs/dbraw/zinc/52/44/47/402524447.db2.gz	BIOAMIPVHOQCOW-QGZVFWFLSA-N	0	3	306.406	2.058	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](C)CCc2cccn2C)C1	ZINC000246389073	402528756	/nfs/dbraw/zinc/52/87/56/402528756.db2.gz	QYRGXKCITCBTKR-CABCVRRESA-N	0	3	306.454	2.130	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)C1CCN(C[C@H](O)CC(F)(F)F)CC1	ZINC000188964206	402529312	/nfs/dbraw/zinc/52/93/12/402529312.db2.gz	FVLBGTDRBHWQJR-DGCLKSJQSA-N	0	3	324.387	2.172	10	0		DEAEHN
COc1ccc([C@H](NC(=O)N2CC[C@@H](N(C)C)C2)C2CC2)cc1	ZINC000170827490	402529731	/nfs/dbraw/zinc/52/97/31/402529731.db2.gz	HIIWSQQHYPUSJR-NVXWUHKLSA-N	0	3	317.433	2.492	10	0		DEAEHN
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170827720	402529969	/nfs/dbraw/zinc/52/99/69/402529969.db2.gz	GKZLHZBKGBUCRO-DZGCQCFKSA-N	0	3	305.422	2.059	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCCCCN(C)c2ccccc2)C1	ZINC000170833340	402530758	/nfs/dbraw/zinc/53/07/58/402530758.db2.gz	LOSZYZBEGIXJDS-KRWDZBQOSA-N	0	3	318.465	2.249	10	0		DEAEHN
CC[C@H](Oc1cccc(C)c1)C(=O)N1CCN2CCC[C@H]2C1	ZINC000246442753	402531518	/nfs/dbraw/zinc/53/15/18/402531518.db2.gz	KWXNMLIFJFPGIP-RDJZCZTQSA-N	0	3	302.418	2.459	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cccc(OC[C@H]3CCCO3)c2)C1	ZINC000170856261	402533246	/nfs/dbraw/zinc/53/32/46/402533246.db2.gz	VFQJGQYLPHSPJA-DOTOQJQBSA-N	0	3	318.417	2.021	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Cc2ccc(Br)cc2)C1	ZINC000170863120	402534333	/nfs/dbraw/zinc/53/43/33/402534333.db2.gz	WCSQXVDLSJPWDP-ZDUSSCGKSA-N	0	3	311.223	2.154	10	0		DEAEHN
CC[C@H](C(=O)NCCN1CCc2c(Cl)cccc2C1)N(C)C	ZINC000189416535	402536274	/nfs/dbraw/zinc/53/62/74/402536274.db2.gz	ASSVKAPOMMNFGI-MRXNPFEDSA-N	0	3	323.868	2.155	10	0		DEAEHN
COC(=O)c1cc(F)ccc1CN1CCCN(C2CC2)CC1	ZINC000170908250	402540683	/nfs/dbraw/zinc/54/06/83/402540683.db2.gz	WCLFYIFLOLLVBO-UHFFFAOYSA-N	0	3	306.381	2.282	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2[C@H]3CCO[C@H]3C23CCC3)CCN1C	ZINC000246691847	402540934	/nfs/dbraw/zinc/54/09/34/402540934.db2.gz	MXGXKRHEUPLWHK-OXGONZEZSA-N	0	3	321.465	2.068	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCC(C)(C)c1ccc(F)cc1	ZINC000171356351	402580307	/nfs/dbraw/zinc/58/03/07/402580307.db2.gz	URAKPWJQJWAQQM-HNNXBMFYSA-N	0	3	307.413	2.497	10	0		DEAEHN
CO[C@@H](C)CNC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000190407726	402598490	/nfs/dbraw/zinc/59/84/90/402598490.db2.gz	XXXVGZXLSCWGHE-DOTOQJQBSA-N	0	3	319.449	2.375	10	0		DEAEHN
C[C@H](Nc1ccc(OC2CCN(C)CC2)nc1)c1nccn1C	ZINC000179741983	402599643	/nfs/dbraw/zinc/59/96/43/402599643.db2.gz	SJBWSTFHBSBOTR-ZDUSSCGKSA-N	0	3	315.421	2.461	10	0		DEAEHN
Cc1nc(C)n(C[C@H]2CCCN(Cc3cccc4nccn43)C2)n1	ZINC000180120582	402607885	/nfs/dbraw/zinc/60/78/85/402607885.db2.gz	ACSSTYYHFKEZJD-INIZCTEOSA-N	0	3	324.432	2.455	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1[C@@H]1CCCN(C(C)C)C1=O	ZINC000248770256	402608395	/nfs/dbraw/zinc/60/83/95/402608395.db2.gz	SNOXGZGFXOLFEW-JONQDZQNSA-N	0	3	322.449	2.192	10	0		DEAEHN
CN(C[C@@H]1CCCC[C@H]1O)[C@@H]1CCc2ccccc2NC1=O	ZINC000248845988	402611195	/nfs/dbraw/zinc/61/11/95/402611195.db2.gz	NDVKGIGIBPTYCH-USXIJHARSA-N	0	3	302.418	2.423	10	0		DEAEHN
COc1ccc(C[C@@H](C)NCC2(C)OCCCO2)cc1OC	ZINC000190649192	402615856	/nfs/dbraw/zinc/61/58/56/402615856.db2.gz	WLXNKAJLWZHTGB-CYBMUJFWSA-N	0	3	309.406	2.378	10	0		DEAEHN
C[C@H](NCC(=O)NCc1ccco1)c1cccc(-n2ccnc2)c1	ZINC000180659306	402622374	/nfs/dbraw/zinc/62/23/74/402622374.db2.gz	ULRXETIXQLSRJI-AWEZNQCLSA-N	0	3	324.384	2.432	10	0		DEAEHN
COC(=O)c1ccc(C)c(NC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000171807254	402624089	/nfs/dbraw/zinc/62/40/89/402624089.db2.gz	XSVJSLQHBOBGMH-AWEZNQCLSA-N	0	3	317.389	2.094	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)N[C@H](C)c1ccncc1OC	ZINC000249281717	402624791	/nfs/dbraw/zinc/62/47/91/402624791.db2.gz	NRDVTDWZCYHWEL-ZIAGYGMSSA-N	0	3	320.437	2.325	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)NCCN1CCCC[C@@H]1C	ZINC000249281920	402625069	/nfs/dbraw/zinc/62/50/69/402625069.db2.gz	NUGAGYZWHXFKDV-UONOGXRCSA-N	0	3	320.437	2.325	10	0		DEAEHN
Cc1cc2cc(NC(=O)N3CCO[C@@H](CN(C)C)C3)ccc2[nH]1	ZINC000181203824	402637980	/nfs/dbraw/zinc/63/79/80/402637980.db2.gz	VXMZHLRKDWTVFW-HNNXBMFYSA-N	0	3	316.405	2.271	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)N[C@@H](c2ccccc2)C2CC2)CCO1	ZINC000172118654	402641584	/nfs/dbraw/zinc/64/15/84/402641584.db2.gz	FHMAXBSIQQNWRW-IRXDYDNUSA-N	0	3	317.433	2.110	10	0		DEAEHN
Cc1c([C@H](C)NC[C@H](C)N2CCOCC2)cnn1C(C)(C)C	ZINC000191145274	402645313	/nfs/dbraw/zinc/64/53/13/402645313.db2.gz	XFTBMIROGLKBQX-KBPBESRZSA-N	0	3	308.470	2.318	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@@H](C)Oc2ccccc2)C1	ZINC000172224084	402645676	/nfs/dbraw/zinc/64/56/76/402645676.db2.gz	IINSANSEVXQTOC-HUUCEWRRSA-N	0	3	305.422	2.237	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H](C)N1CCCN(C2CC2)CC1)c1ccccc1	ZINC000172347179	402651880	/nfs/dbraw/zinc/65/18/80/402651880.db2.gz	SLBYRUJKYZOTBH-HZPDHXFCSA-N	0	3	315.461	2.422	10	0		DEAEHN
Oc1cccc(N2CCN(C[C@@H](O)CC3CCCC3)CC2)c1	ZINC000191270934	402656108	/nfs/dbraw/zinc/65/61/08/402656108.db2.gz	MNGRJLYITUWWEU-SFHVURJKSA-N	0	3	304.434	2.455	10	0		DEAEHN
CN(C)CCn1ccc(NC(=O)N2CCC[C@H]2c2ccco2)n1	ZINC000173945474	402721416	/nfs/dbraw/zinc/72/14/16/402721416.db2.gz	FANDYZCETSCOGJ-ZDUSSCGKSA-N	0	3	317.393	2.407	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cccc(C)c1	ZINC000173827331	402714658	/nfs/dbraw/zinc/71/46/58/402714658.db2.gz	SDFIIZGZZWAKPF-HUUCEWRRSA-N	0	3	308.447	2.242	10	0		DEAEHN
C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)C1(N)CCOCC1	ZINC000261849490	402718285	/nfs/dbraw/zinc/71/82/85/402718285.db2.gz	MEYBBIOTEFMYAX-OCCSQVGLSA-N	0	3	306.381	2.038	10	0		DEAEHN
Cc1c(Cl)cccc1OCC(=O)N1CCN2CCC[C@@H]2C1	ZINC000172515767	402660557	/nfs/dbraw/zinc/66/05/57/402660557.db2.gz	KAAIQKIGRAOBDP-CYBMUJFWSA-N	0	3	308.809	2.334	10	0		DEAEHN
Cc1ccsc1CNC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C	ZINC000253226888	402661878	/nfs/dbraw/zinc/66/18/78/402661878.db2.gz	JOFYEUQCIAGWQD-NORZTCDRSA-N	0	3	308.447	2.205	10	0		DEAEHN
Cc1c([C@@H](C)N[C@@H]2CCc3ncnn3C2)cnn1C(C)(C)C	ZINC000191357389	402663737	/nfs/dbraw/zinc/66/37/37/402663737.db2.gz	UPFGKPBMESKABJ-DGCLKSJQSA-N	0	3	302.426	2.204	10	0		DEAEHN
CN(C)C1(CN(C)C(=O)c2snnc2C(C)(C)C)CCC1	ZINC000191485874	402673703	/nfs/dbraw/zinc/67/37/03/402673703.db2.gz	LLWSVIIGPCFODU-UHFFFAOYSA-N	0	3	310.467	2.392	10	0		DEAEHN
COc1ccc(/C=C\C(=O)N2CCN3CCC[C@@H]3C2)cc1OC	ZINC000254984994	402674181	/nfs/dbraw/zinc/67/41/81/402674181.db2.gz	INNYAUSKAARTAZ-DDJMYBDESA-N	0	3	316.401	2.024	10	0		DEAEHN
O=C1O[C@H](CN2CCCN(C3CC3)CC2)CN1c1ccccc1	ZINC000172810833	402677399	/nfs/dbraw/zinc/67/73/99/402677399.db2.gz	DLZKFBDFXFAKQT-QGZVFWFLSA-N	0	3	315.417	2.182	10	0		DEAEHN
O=C(CC/C=C\c1ccccc1)NC[C@H](O)CN1CCCCC1	ZINC000255378851	402686248	/nfs/dbraw/zinc/68/62/48/402686248.db2.gz	DFKVDPXYPRPRBK-YYLWEKDPSA-N	0	3	316.445	2.443	10	0		DEAEHN
C/C=C\c1ccc(OCC(=O)N2CC[C@@H](N(C)C)C2)c(OC)c1	ZINC000255625371	402692988	/nfs/dbraw/zinc/69/29/88/402692988.db2.gz	WPISYVFWEHUHFL-IYKSTZQJSA-N	0	3	318.417	2.270	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ncc(F)cc1F	ZINC000191957552	402700986	/nfs/dbraw/zinc/70/09/86/402700986.db2.gz	WZIDLBCNRSYYQW-CQSZACIVSA-N	0	3	319.355	2.263	10	0		DEAEHN
COCCO[C@H]1CCC12CCN(Cc1c(C)n[nH]c1C)CC2	ZINC000257192490	402701751	/nfs/dbraw/zinc/70/17/51/402701751.db2.gz	UOOGZLLWZKZBRW-INIZCTEOSA-N	0	3	307.438	2.434	10	0		DEAEHN
COC(=O)c1ccsc1N1CC[C@@H](N[C@@H](C)C(C)C)C1=O	ZINC000174054903	402725342	/nfs/dbraw/zinc/72/53/42/402725342.db2.gz	WOJDHWVMZFALAP-CMPLNLGQSA-N	0	3	310.419	2.274	10	0		DEAEHN
C[C@H](NCC(=O)N1CCSc2ccccc21)[C@H]1CCCO1	ZINC000183087048	402737708	/nfs/dbraw/zinc/73/77/08/402737708.db2.gz	WGLGVOSXLWHIEN-GXTWGEPZSA-N	0	3	306.431	2.282	10	0		DEAEHN
CCN(Cc1cccc(F)c1)C(=O)CN[C@H](C)[C@@H]1CCCO1	ZINC000183119177	402740409	/nfs/dbraw/zinc/74/04/09/402740409.db2.gz	RQERBJKFJVHETE-CJNGLKHVSA-N	0	3	308.397	2.331	10	0		DEAEHN
CCN(Cc1cccc(F)c1)C(=O)CN[C@@H](C)[C@H]1CCCO1	ZINC000183119190	402740463	/nfs/dbraw/zinc/74/04/63/402740463.db2.gz	RQERBJKFJVHETE-XJKSGUPXSA-N	0	3	308.397	2.331	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCCCOC2CCCC2)CCN1C	ZINC000174454844	402741615	/nfs/dbraw/zinc/74/16/15/402741615.db2.gz	UXQLQRWTRHDEBH-LSDHHAIUSA-N	0	3	311.470	2.460	10	0		DEAEHN
Cc1c([O-])ccc2c(C[NH2+][C@@H](C)[C@H]3CCCO3)cc(=O)oc12	ZINC000183140601	402742092	/nfs/dbraw/zinc/74/20/92/402742092.db2.gz	KJDJGOWVZWKGDK-XHDPSFHLSA-N	0	3	303.358	2.464	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2cnc(-c3ccco3)s2)n1	ZINC000263248445	402750163	/nfs/dbraw/zinc/75/01/63/402750163.db2.gz	POTNMBQEZBEYMH-SECBINFHSA-N	0	3	317.374	2.029	10	0		DEAEHN
C[C@@H](Oc1ccccc1Cl)c1nc([C@H]2CNCCN2C)no1	ZINC000263257055	402751190	/nfs/dbraw/zinc/75/11/90/402751190.db2.gz	QOZIDOCOGHEQOV-ZYHUDNBSSA-N	0	3	322.796	2.439	10	0		DEAEHN
O[C@@H](CNc1ncnc2ccc(F)cc21)CN1CCCCC1	ZINC000174685694	402751571	/nfs/dbraw/zinc/75/15/71/402751571.db2.gz	BIUXIUKTSLJIQI-ZDUSSCGKSA-N	0	3	304.369	2.028	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@H]2c2cc(F)ccc2F)n1	ZINC000263276741	402753115	/nfs/dbraw/zinc/75/31/15/402753115.db2.gz	SWMUZWFIFOSBFZ-ZKYQVNSYSA-N	0	3	320.343	2.195	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(Cc3ccc(F)cc3)C2)CC1	ZINC000174878152	402761140	/nfs/dbraw/zinc/76/11/40/402761140.db2.gz	WSFULJGVHKHPGM-SFHVURJKSA-N	0	3	305.441	2.428	10	0		DEAEHN
C[C@H](NCCO[C@@H]1CCCCO1)c1ccc(-n2cncn2)cc1	ZINC000193083804	402764203	/nfs/dbraw/zinc/76/42/03/402764203.db2.gz	WWEUASYUGWJOBP-WMLDXEAASA-N	0	3	316.405	2.461	10	0		DEAEHN
CCO[C@H](CNC(=O)NC[C@@H]1CCCN1C)c1ccccc1	ZINC000193499872	402771679	/nfs/dbraw/zinc/77/16/79/402771679.db2.gz	PUOWWVVSPUUNIT-JKSUJKDBSA-N	0	3	305.422	2.158	10	0		DEAEHN
CCOC(=O)c1ccc(NC(=O)N[C@@H]2CCCN(CC)C2)cc1	ZINC000194310906	402791492	/nfs/dbraw/zinc/79/14/92/402791492.db2.gz	OEJRXZWDNSLREY-OAHLLOKOSA-N	0	3	319.405	2.469	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)N(CCN(C)C)Cc1cccc(F)c1	ZINC000194354781	402793278	/nfs/dbraw/zinc/79/32/78/402793278.db2.gz	XRXYUFVWDDFEMB-RHSMWYFYSA-N	0	3	322.424	2.389	10	0		DEAEHN
C[C@H]1COCC[C@H]1C(=O)N(CCN(C)C)Cc1ccc(F)cc1	ZINC000194353668	402793743	/nfs/dbraw/zinc/79/37/43/402793743.db2.gz	KIRTZJLIIVNYJU-WMLDXEAASA-N	0	3	322.424	2.389	10	0		DEAEHN
CCN(C(=O)CN(C)C[C@H]1CCCN1CC)c1ccccc1	ZINC000175349725	402798986	/nfs/dbraw/zinc/79/89/86/402798986.db2.gz	WSEHVGUMVBDVPC-QGZVFWFLSA-N	0	3	303.450	2.456	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)NCc1ccc(C)cc1	ZINC000175344293	402799136	/nfs/dbraw/zinc/79/91/36/402799136.db2.gz	LMVKOWWXDFWUDY-QGZVFWFLSA-N	0	3	303.450	2.027	10	0		DEAEHN
COc1cccc([C@@H](C)CC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000175385290	402801918	/nfs/dbraw/zinc/80/19/18/402801918.db2.gz	SGFUXVNEYHYBBO-GOEBONIOSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)S(=O)(=O)Cc1ccc(F)cc1	ZINC000175399676	402802975	/nfs/dbraw/zinc/80/29/75/402802975.db2.gz	YCWQUWYCLCAEKF-OAHLLOKOSA-N	0	3	314.426	2.072	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)S(=O)(=O)Cc1ccccc1C	ZINC000175395863	402803078	/nfs/dbraw/zinc/80/30/78/402803078.db2.gz	LUFWBQTWRUNPJJ-INIZCTEOSA-N	0	3	310.463	2.241	10	0		DEAEHN
C/C=C/c1ccc(OCC(=O)N2CCNC(C)(C)C2)c(OC)c1	ZINC000175395338	402803118	/nfs/dbraw/zinc/80/31/18/402803118.db2.gz	LLYHSSZFPVCLQF-AATRIKPKSA-N	0	3	318.417	2.318	10	0		DEAEHN
CC(C)Oc1cccc(CC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000195338751	402842760	/nfs/dbraw/zinc/84/27/60/402842760.db2.gz	XXIGTMKEKYSYCB-INIZCTEOSA-N	0	3	302.418	2.323	10	0		DEAEHN
Cc1noc(C)c1C[C@H](C)NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000175155236	402783960	/nfs/dbraw/zinc/78/39/60/402783960.db2.gz	RTLMGXQKMNTGHL-YWPYICTPSA-N	0	3	322.453	2.347	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H](c2ccccc2)N(C)C)C1	ZINC000194128954	402785160	/nfs/dbraw/zinc/78/51/60/402785160.db2.gz	YVMNIDIUDCOISR-IRXDYDNUSA-N	0	3	318.465	2.073	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2ccccc2COC)C1	ZINC000194144694	402785438	/nfs/dbraw/zinc/78/54/38/402785438.db2.gz	PCOBJJARMCUTOA-INIZCTEOSA-N	0	3	305.422	2.117	10	0		DEAEHN
CNC(=O)[C@H](NCc1ccc2oc(C(=O)OC)cc2c1)C(C)C	ZINC000183671634	402787430	/nfs/dbraw/zinc/78/74/30/402787430.db2.gz	VOIQRKBKBDWAIJ-OAHLLOKOSA-N	0	3	318.373	2.080	10	0		DEAEHN
CCCC[C@@H](CCC)NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000175988655	402846331	/nfs/dbraw/zinc/84/63/31/402846331.db2.gz	YVGBOFGHORFNBC-CVEARBPZSA-N	0	3	313.486	2.491	10	0		DEAEHN
Cc1nc(C[C@H]2CCCN(C[C@H](O)c3ccccc3)C2)no1	ZINC000195518029	402849240	/nfs/dbraw/zinc/84/92/40/402849240.db2.gz	LBBZJJGHHZJKPL-ZBFHGGJFSA-N	0	3	301.390	2.366	10	0		DEAEHN
C[C@H](O)CN1CCN(c2ncnc3cc(Cl)ccc32)C[C@@H]1C	ZINC000264353952	402870523	/nfs/dbraw/zinc/87/05/23/402870523.db2.gz	STGBAFBBYNQXQY-RYUDHWBXSA-N	0	3	320.824	2.175	10	0		DEAEHN
c1cn(Cc2ccccc2)c(CN[C@@H]2CCc3nc[nH]c3C2)n1	ZINC000566590957	292254001	/nfs/dbraw/zinc/25/40/01/292254001.db2.gz	NSVDJOFGPJBZKB-OAHLLOKOSA-N	0	3	307.401	2.302	10	0		DEAEHN
c1cn(Cc2ccccc2)c(CN[C@@H]2CCc3[nH]cnc3C2)n1	ZINC000566590957	292254002	/nfs/dbraw/zinc/25/40/02/292254002.db2.gz	NSVDJOFGPJBZKB-OAHLLOKOSA-N	0	3	307.401	2.302	10	0		DEAEHN
O=C([C@@H]1CSCCS1)N1CCCC[C@H](N2CCCC2)C1	ZINC000107531315	304377153	/nfs/dbraw/zinc/37/71/53/304377153.db2.gz	FBMPDXFDVQMOBE-KBPBESRZSA-N	0	3	314.520	2.312	10	0		DEAEHN
Cc1c[nH]nc1CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000289464034	403975407	/nfs/dbraw/zinc/97/54/07/403975407.db2.gz	IJMBBDBVNJTCJZ-CHWSQXEVSA-N	0	3	308.426	2.453	10	0		DEAEHN
CN(C)Cc1ccccc1C(=O)N[C@H](CO)CC1CCCC1	ZINC000362996173	404038183	/nfs/dbraw/zinc/03/81/83/404038183.db2.gz	ICLJQICILYNBMB-INIZCTEOSA-N	0	3	304.434	2.419	10	0		DEAEHN
C[C@H](NC(=O)C1CCCCC1)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000337949337	404328920	/nfs/dbraw/zinc/32/89/20/404328920.db2.gz	IHIRISOZKKPQCS-YCPHGPKFSA-N	0	3	323.481	2.013	10	0		DEAEHN
CO[C@@H]1COC[C@H]1n1cc(CN[C@@H]2C[C@H](C)CC(C)(C)C2)nn1	ZINC000329544930	404371550	/nfs/dbraw/zinc/37/15/50/404371550.db2.gz	ZCJLXCQDRRSIEJ-SJXGUFTOSA-N	0	3	322.453	2.169	10	0		DEAEHN
CC[C@H](C)Oc1cc(-c2nc([C@H]3CC(=O)N(C)C3)no2)ccn1	ZINC000329744119	404439281	/nfs/dbraw/zinc/43/92/81/404439281.db2.gz	XPZHFSFRTKQZLD-JQWIXIFHSA-N	0	3	316.361	2.255	10	0		DEAEHN
Cc1nnc([C@H](C)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)o1	ZINC000371523219	404464886	/nfs/dbraw/zinc/46/48/86/404464886.db2.gz	HFPSEYRFWDXUQG-IHRRRGAJSA-N	0	3	322.453	2.260	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1[C@H](NC2CC(C)(C)C2)CC(=O)N1C	ZINC000330328969	404627561	/nfs/dbraw/zinc/62/75/61/404627561.db2.gz	MCPACKFUFLRFBA-CZUORRHYSA-N	0	3	304.438	2.087	10	0		DEAEHN
COCCCCN(C)C[C@@H](c1cccs1)N1CCOCC1	ZINC000117880441	292319673	/nfs/dbraw/zinc/31/96/73/292319673.db2.gz	LLOWEIHGWWLSOF-HNNXBMFYSA-N	0	3	312.479	2.480	10	0		DEAEHN
c1ccc(-c2ccc(N3CCCN([C@H]4CCOC4)CC3)nn2)cc1	ZINC000375724299	404734474	/nfs/dbraw/zinc/73/44/74/404734474.db2.gz	VGLXZLAEDRVKDL-KRWDZBQOSA-N	0	3	324.428	2.445	10	0		DEAEHN
CC(=O)c1ccc(N2CC[C@@H](OCCN3CCCCC3)C2)nc1	ZINC000356860183	404709979	/nfs/dbraw/zinc/70/99/79/404709979.db2.gz	NRROBZOQOHQABM-QGZVFWFLSA-N	0	3	317.433	2.365	10	0		DEAEHN
COc1cccc(N2CC[C@H](CNCc3c(C)cnn3C)C2)c1	ZINC000375683872	404727738	/nfs/dbraw/zinc/72/77/38/404727738.db2.gz	AYTIWZXOZVXOQW-OAHLLOKOSA-N	0	3	314.433	2.353	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)N(C)CCCO)CCN1Cc1ccccc1	ZINC000367009407	404896736	/nfs/dbraw/zinc/89/67/36/404896736.db2.gz	GMKOPSNTZTWFGZ-WBVHZDCISA-N	0	3	319.449	2.063	10	0		DEAEHN
C[C@@](O)(CN1CCC(C(=O)N2CCCCC2)CC1)C(F)(F)F	ZINC000366847502	404857725	/nfs/dbraw/zinc/85/77/25/404857725.db2.gz	SQMATSDSLJEBDZ-CQSZACIVSA-N	0	3	322.371	2.024	10	0		DEAEHN
CC(C)(C)OC(=O)c1ccc(CN[C@@H]2CCC(=O)NC2)cc1	ZINC000360952661	404860531	/nfs/dbraw/zinc/86/05/31/404860531.db2.gz	ASDPTTGCHFDPNY-CQSZACIVSA-N	0	3	304.390	2.010	10	0		DEAEHN
Cc1cccnc1NC(=O)[C@@H]1CCCN(CC2=CCCOC2)C1	ZINC000378335734	404932553	/nfs/dbraw/zinc/93/25/53/404932553.db2.gz	SKVQNTBTEVMUTD-MRXNPFEDSA-N	0	3	315.417	2.387	10	0		DEAEHN
C[C@H]1OCC[C@]1(O)CNCc1ccsc1Br	ZINC000388965554	405036488	/nfs/dbraw/zinc/03/64/88/405036488.db2.gz	HMPTUXSSCSHHNH-KCJUWKMLSA-N	0	3	306.225	2.140	10	0		DEAEHN
Cn1c2ccc(CN3CC[C@@]4(O)CCCC[C@@H]4C3)cc2oc1=O	ZINC000408066786	405102995	/nfs/dbraw/zinc/10/29/95/405102995.db2.gz	CRZWQEHNZXPKRU-KDOFPFPSSA-N	0	3	316.401	2.259	10	0		DEAEHN
COCCCN(C)CCNC(=O)NC[C@@H]1C[C@H]1c1ccccc1	ZINC000247400495	292336751	/nfs/dbraw/zinc/33/67/51/292336751.db2.gz	HSGPJZWUPNRTET-IRXDYDNUSA-N	0	3	319.449	2.058	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@@H]2CN1Cc1nc(-c2ccoc2)no1	ZINC000408183449	405133102	/nfs/dbraw/zinc/13/31/02/405133102.db2.gz	RTOAQGGBSXEMEB-TZMCWYRMSA-N	0	3	302.378	2.388	10	0		DEAEHN
CO[C@@H](C)[C@@H](C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000577790830	405514099	/nfs/dbraw/zinc/51/40/99/405514099.db2.gz	SRNSHNBTYMQRQL-HLLBOEOZSA-N	0	3	319.449	2.374	10	0		DEAEHN
CC(C)(C)[C@H](NC(=O)NCCNc1ccncc1)C(F)(F)F	ZINC000556723550	405515217	/nfs/dbraw/zinc/51/52/17/405515217.db2.gz	VVYKNTLDZJSFFW-NSHDSACASA-N	0	3	318.343	2.192	10	0		DEAEHN
Cc1nc(CNC2CCN(C)CC2)sc1Br	ZINC000449399922	405547777	/nfs/dbraw/zinc/54/77/77/405547777.db2.gz	FOXBXHXAXRKYKH-UHFFFAOYSA-N	0	3	304.257	2.398	10	0		DEAEHN
CC[C@H](CCO)CNCc1snc(OC)c1Br	ZINC000638764833	405657048	/nfs/dbraw/zinc/65/70/48/405657048.db2.gz	BMEMCRHQXUWZSA-MRVPVSSYSA-N	0	3	323.256	2.412	10	0		DEAEHN
CCC1(CNCc2ccnn2-c2ccccc2OC)COC1	ZINC000449606083	405637574	/nfs/dbraw/zinc/63/75/74/405637574.db2.gz	PMZFRYBCQASDQC-UHFFFAOYSA-N	0	3	301.390	2.397	10	0		DEAEHN
COc1nsc(CNCCC[C@@H](C)CO)c1Br	ZINC000638820310	405692823	/nfs/dbraw/zinc/69/28/23/405692823.db2.gz	AWYMQYBEFJNCFZ-MRVPVSSYSA-N	0	3	323.256	2.412	10	0		DEAEHN
c1ccc(-n2nnc(CNCCN3CCCC3)c2C2CC2)cc1	ZINC000638866640	405728736	/nfs/dbraw/zinc/72/87/36/405728736.db2.gz	ZPHZJJYVZCAOQH-UHFFFAOYSA-N	0	3	311.433	2.330	10	0		DEAEHN
COc1ccc([C@](C)(O)[C@@H]2CCCN2Cc2cncn2C)cc1	ZINC000583615578	405774893	/nfs/dbraw/zinc/77/48/93/405774893.db2.gz	MGQURCSLMMMTBD-ROUUACIJSA-N	0	3	315.417	2.301	10	0		DEAEHN
Cn1cccc1[C@@H]1CCCCN1C[C@@H](O)COC[C@H]1CCCO1	ZINC000530867734	405874201	/nfs/dbraw/zinc/87/42/01/405874201.db2.gz	KUCAECKXJFZBPP-NUJGCVRESA-N	0	3	322.449	2.109	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N(CCN(C)C)CC(C)C)c1	ZINC000457536960	405887932	/nfs/dbraw/zinc/88/79/32/405887932.db2.gz	KSWJLGWYZMOLMX-UHFFFAOYSA-N	0	3	320.433	2.441	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000530813706	405864396	/nfs/dbraw/zinc/86/43/96/405864396.db2.gz	AXRXJCONRZYNBS-VQIMIIECSA-N	0	3	316.445	2.272	10	0		DEAEHN
C[C@H]1CC[C@H](C)N1CC(=O)NCc1cccc2c1CCOC2	ZINC000634315590	406094743	/nfs/dbraw/zinc/09/47/43/406094743.db2.gz	OQTOTPQUJLCGEK-KBPBESRZSA-N	0	3	302.418	2.248	10	0		DEAEHN
CC1(C)CN(C[C@@H](O)Cc2ccccc2C(F)(F)F)C[C@@H]1O	ZINC000562618001	406045425	/nfs/dbraw/zinc/04/54/25/406045425.db2.gz	ZDHOZNHVDSFHAP-JSGCOSHPSA-N	0	3	317.351	2.312	10	0		DEAEHN
O=C(NCCNc1ccncc1)c1cc(C2CCCCC2)n[nH]1	ZINC000534064499	406168408	/nfs/dbraw/zinc/16/84/08/406168408.db2.gz	QRDGHQWXMHLMHV-UHFFFAOYSA-N	0	3	313.405	2.116	10	0		DEAEHN
c1cnc(-c2ccnc(NC3CCN(C4CCC4)CC3)n2)cn1	ZINC000518310591	406133962	/nfs/dbraw/zinc/13/39/62/406133962.db2.gz	CANZFJLHALKDDY-UHFFFAOYSA-N	0	3	310.405	2.362	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@H]1CCSc2ccccc21	ZINC000536017767	406247844	/nfs/dbraw/zinc/24/78/44/406247844.db2.gz	PRFWFFHBUYHOGC-HNNXBMFYSA-N	0	3	313.426	2.311	10	0		DEAEHN
CC(C)OC(=O)[C@@H]1CCCN1C(=O)[C@@H](C(C)C)N1CCCCC1	ZINC000522934893	406414247	/nfs/dbraw/zinc/41/42/47/406414247.db2.gz	LVDPZEPICWYTBE-JKSUJKDBSA-N	0	3	324.465	2.440	10	0		DEAEHN
C[C@@H]1CCC[C@@H](C)N1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637871473	406455489	/nfs/dbraw/zinc/45/54/89/406455489.db2.gz	QSBZWMGNDPZTEA-BFYDXBDKSA-N	0	3	303.450	2.235	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NCC1CCCCC1	ZINC000637870683	406455504	/nfs/dbraw/zinc/45/55/04/406455504.db2.gz	VEQGOPBYFUBVOL-KRWDZBQOSA-N	0	3	303.450	2.142	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N1CC(=O)Nc1cccc(N2CCOCC2)c1	ZINC000524797248	406462408	/nfs/dbraw/zinc/46/24/08/406462408.db2.gz	XYVSVGQDVOLDDZ-HUUCEWRRSA-N	0	3	317.433	2.335	10	0		DEAEHN
CC(C)C1CCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)CC1	ZINC000638023549	406527872	/nfs/dbraw/zinc/52/78/72/406527872.db2.gz	OJEDRUGXQILOAZ-GOSISDBHSA-N	0	3	317.477	2.340	10	0		DEAEHN
C[C@H](NCCOCC1CCC1)c1ccc2c(c1)OCC(=O)N2	ZINC000552280672	406699088	/nfs/dbraw/zinc/69/90/88/406699088.db2.gz	PHVQBEAPLOSGJD-LBPRGKRZSA-N	0	3	304.390	2.485	10	0		DEAEHN
COc1nsc(CNC[C@H]2CCCOC2)c1Br	ZINC000638398844	406747860	/nfs/dbraw/zinc/74/78/60/406747860.db2.gz	FRGNTPGKICXVPQ-MRVPVSSYSA-N	0	3	321.240	2.430	10	0		DEAEHN
CCC(C)(C)[C@H](C)NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638408510	406755120	/nfs/dbraw/zinc/75/51/20/406755120.db2.gz	ZJSNRFFSIDMTOV-GOEBONIOSA-N	0	3	305.466	2.387	10	0		DEAEHN
c1nc2nc(-c3ccccc3)cc(N3C[C@H]4CCC[C@@H](C3)N4)n2n1	ZINC000569461836	292416360	/nfs/dbraw/zinc/41/63/60/292416360.db2.gz	GKVGGWRVCVOKJX-GASCZTMLSA-N	0	3	320.400	2.122	10	0		DEAEHN
C[C@@H](O)[C@@H](C)NCc1cc(Br)cc2c1OCC2	ZINC000129175071	196025697	/nfs/dbraw/zinc/02/56/97/196025697.db2.gz	BPFQFZKUZBTRSW-RKDXNWHRSA-N	0	3	300.196	2.243	10	0		DEAEHN
CN(CC[C@@H]1COCCN1)Cc1cccc(Br)c1	ZINC000129402235	196045111	/nfs/dbraw/zinc/04/51/11/196045111.db2.gz	JVVXCUHLBKHVSJ-CQSZACIVSA-N	0	3	313.239	2.259	10	0		DEAEHN
Cc1ccc([C@@H](C)N(C)C(=O)C(C)(C)N2CCNCC2)s1	ZINC000129663279	196065504	/nfs/dbraw/zinc/06/55/04/196065504.db2.gz	YOBIMVIEDVVJPH-CYBMUJFWSA-N	0	3	309.479	2.260	10	0		DEAEHN
O=c1c2ccnn2ccn1CCNCc1ccc(Cl)s1	ZINC000130727287	196104323	/nfs/dbraw/zinc/10/43/23/196104323.db2.gz	UTUPWJAETARZLR-UHFFFAOYSA-N	0	3	308.794	2.001	10	0		DEAEHN
CCN[C@H](c1ncccc1F)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000131662699	196189420	/nfs/dbraw/zinc/18/94/20/196189420.db2.gz	WDINFXUSUMSTHA-OBJOEFQTSA-N	0	3	314.426	2.475	10	0		DEAEHN
CCCN[C@@H](Cc1ccc(F)cc1C)[C@@H](C)S(C)(=O)=O	ZINC000131921654	196209963	/nfs/dbraw/zinc/20/99/63/196209963.db2.gz	PCJHAVGKZLZCSE-DOMZBBRYSA-N	0	3	301.427	2.478	10	0		DEAEHN
NC1(C(=O)Nc2c3ncsc3ccc2Cl)CCOCC1	ZINC000132086281	196225149	/nfs/dbraw/zinc/22/51/49/196225149.db2.gz	ULIJLTMPVSDMOY-UHFFFAOYSA-N	0	3	311.794	2.396	10	0		DEAEHN
C[C@@H]1[C@H](C)SCCN1[C@@H](CN)c1ccc2c(c1)OCCO2	ZINC000132401440	196253102	/nfs/dbraw/zinc/25/31/02/196253102.db2.gz	RNJNHBPCDKEBCE-DYEKYZERSA-N	0	3	308.447	2.283	10	0		DEAEHN
CC(C)(CNC(=O)N1CC[C@H]2OCCC[C@@H]2C1)N1CCCCC1	ZINC000132807592	196285752	/nfs/dbraw/zinc/28/57/52/196285752.db2.gz	RVHVAIIUTSRLRR-HZPDHXFCSA-N	0	3	323.481	2.461	10	0		DEAEHN
CC(=O)NC1CCN([C@H](c2ccc(Cl)s2)[C@H](C)N)CC1	ZINC000133741155	196332790	/nfs/dbraw/zinc/33/27/90/196332790.db2.gz	GRCLYWMNXIZZMV-XPTSAGLGSA-N	0	3	315.870	2.390	10	0		DEAEHN
C[C@H]1CNC[C@H](COc2ncc(Cl)cc2Br)O1	ZINC000133852850	196340465	/nfs/dbraw/zinc/34/04/65/196340465.db2.gz	NZYKSGPZYXQVJF-IONNQARKSA-N	0	3	321.602	2.253	10	0		DEAEHN
O=C1CC[C@@H](CNCc2ccc(Cl)c(Br)c2)N1	ZINC000137127582	196566468	/nfs/dbraw/zinc/56/64/68/196566468.db2.gz	ZAUKGDKZHHMCMI-VIFPVBQESA-N	0	3	317.614	2.471	10	0		DEAEHN
COc1ccc(C[C@@H](N)c2ccnn2C)cc1Br	ZINC000137175459	196567753	/nfs/dbraw/zinc/56/77/53/196567753.db2.gz	IKHHOGNYKYPDTM-LLVKDONJSA-N	0	3	310.195	2.434	10	0		DEAEHN
Cn1cncc1CNCCN1CCc2c(Cl)cccc2C1	ZINC000191107253	225104951	/nfs/dbraw/zinc/10/49/51/225104951.db2.gz	NRWCERCUEMFJJA-UHFFFAOYSA-N	0	3	304.825	2.221	10	0		DEAEHN
COCC1CCN(Cc2ccc3c(c2)sc(=O)n3C)CC1	ZINC000192623264	225138672	/nfs/dbraw/zinc/13/86/72/225138672.db2.gz	JINQPCZKLGEEQB-UHFFFAOYSA-N	0	3	306.431	2.458	10	0		DEAEHN
Cc1cc(NC(=O)N[C@@H](CN(C)C)c2ccccc2)n(C)n1	ZINC000043434518	424812049	/nfs/dbraw/zinc/81/20/49/424812049.db2.gz	DGQDALQCBBDIGH-AWEZNQCLSA-N	0	3	301.394	2.153	10	0		DEAEHN
C1C(Nc2nnc(C3CCOCC3)s2)CC1N1CCCCC1	ZINC000549563569	424874475	/nfs/dbraw/zinc/87/44/75/424874475.db2.gz	XJURNOSXLBNHAB-UHFFFAOYSA-N	0	3	322.478	2.861	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@H]2COc3ccc(Cl)cc3C2)C1	ZINC000194641929	424877944	/nfs/dbraw/zinc/87/79/44/424877944.db2.gz	MGPZWGRDSJOJSQ-HIFRSBDPSA-N	0	3	322.836	2.492	10	0		DEAEHN
Cc1ccccc1OCCCC(=O)N1CCN2CCC[C@@H]2C1	ZINC000195327686	424882538	/nfs/dbraw/zinc/88/25/38/424882538.db2.gz	NFFSRQJLGZVYNK-MRXNPFEDSA-N	0	3	302.418	2.461	10	0		DEAEHN
O=C(CCCOc1ccc(F)cc1)N1CCN2CCC[C@@H]2C1	ZINC000195327668	424882748	/nfs/dbraw/zinc/88/27/48/424882748.db2.gz	ONZICLVWWICVPW-OAHLLOKOSA-N	0	3	306.381	2.291	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H](C[C@@H](C)O)c1ccccc1)N(C)C	ZINC000154488453	424861626	/nfs/dbraw/zinc/86/16/26/424861626.db2.gz	HJOVRVSQCPHGIA-HYVNUMGLSA-N	0	3	306.450	2.388	10	0		DEAEHN
Brc1cccc2c1CC[C@@H]2NC1COCCOC1	ZINC000381280097	424908511	/nfs/dbraw/zinc/90/85/11/424908511.db2.gz	UQRRQCNHHDJRQP-AWEZNQCLSA-N	0	3	312.207	2.441	10	0		DEAEHN
O[C@@]1(CCNCc2ccc(Br)s2)CCOC1	ZINC000404189318	424926205	/nfs/dbraw/zinc/92/62/05/424926205.db2.gz	IDSGKMAAYSVBBX-NSHDSACASA-N	0	3	306.225	2.142	10	0		DEAEHN
c1ncn2cc(CNc3ccnc(N4CCCCC4)n3)ccc12	ZINC000574500236	424943580	/nfs/dbraw/zinc/94/35/80/424943580.db2.gz	GOZPGMDPULJARD-UHFFFAOYSA-N	0	3	308.389	2.727	10	0		DEAEHN
OC[C@]1(NCc2ccc(-n3cncn3)cc2)CCc2ccccc21	ZINC000370803881	269083906	/nfs/dbraw/zinc/08/39/06/269083906.db2.gz	UTPLNTVBUIIWJU-LJQANCHMSA-N	0	3	320.396	2.191	10	0		DEAEHN
O=C(NCCOCC1CCC1)NC[C@@H]1CCCCN1C1CC1	ZINC000515345555	269349981	/nfs/dbraw/zinc/34/99/81/269349981.db2.gz	XMVCGWPRWYENAU-INIZCTEOSA-N	0	3	309.454	2.119	10	0		DEAEHN
C[C@H]1C[C@H](C(=O)NCC2CCN(CCO)CC2)CC(C)(C)C1	ZINC000184233621	274618569	/nfs/dbraw/zinc/61/85/69/274618569.db2.gz	VIWINJXNVRZKLS-HOCLYGCPSA-N	0	3	310.482	2.269	10	0		DEAEHN
O[C@@H](CN1CCC[C@@H](n2cncn2)C1)c1ccc(Cl)cc1	ZINC000247034644	275051310	/nfs/dbraw/zinc/05/13/10/275051310.db2.gz	DIUJGIYUAMKCIT-CABCVRRESA-N	0	3	306.797	2.302	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1ccc(OC)nc1C	ZINC000123813297	276168840	/nfs/dbraw/zinc/16/88/40/276168840.db2.gz	QGUDJJAUOQEQQF-CYBMUJFWSA-N	0	3	306.410	2.347	10	0		DEAEHN
CCN1CCc2nc(NC(=O)CC3CCN(C)CC3)sc2C1	ZINC000371813925	276236535	/nfs/dbraw/zinc/23/65/35/276236535.db2.gz	BWVCMLOZVXSERX-UHFFFAOYSA-N	0	3	322.478	2.192	10	0		DEAEHN
CCN(CCNC(=O)N[C@@H]1CCOc2ccccc21)C1CC1	ZINC000171154063	276347108	/nfs/dbraw/zinc/34/71/08/276347108.db2.gz	PCOIRCDFDYWSBB-OAHLLOKOSA-N	0	3	303.406	2.294	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(C(=O)c3ccc(F)cc3)C2)CC1	ZINC000173292008	277110651	/nfs/dbraw/zinc/11/06/51/277110651.db2.gz	SQALXNPANKQNBI-QGZVFWFLSA-N	0	3	319.424	2.068	10	0		DEAEHN
CC(=O)c1ncc(C(=O)NC2CC(N3CCCCC3)C2)s1	ZINC000412307685	277118507	/nfs/dbraw/zinc/11/85/07/277118507.db2.gz	MJARJMHCGJJGGV-UHFFFAOYSA-N	0	3	307.419	2.092	10	0		DEAEHN
CN1CC[C@H](NC(=O)NC[C@H]2CCCOC2)[C@@H]1c1ccccc1	ZINC000245680232	277166941	/nfs/dbraw/zinc/16/69/41/277166941.db2.gz	VCGXVHBHVCZELA-PVAVHDDUSA-N	0	3	317.433	2.158	10	0		DEAEHN
C[C@@H]1C[C@@H](C(=O)NC[C@@H](O)CN2CCCCC2)CC(C)(C)C1	ZINC000248409749	277960810	/nfs/dbraw/zinc/96/08/10/277960810.db2.gz	GFQMFTQJKJKHEG-BZUAXINKSA-N	0	3	310.482	2.412	10	0		DEAEHN
C[C@@H](C(=O)N1C[C@H](C)C[C@H](C)C1)N1CC[C@@H]2OCCC[C@@H]2C1	ZINC000246762302	278200000	/nfs/dbraw/zinc/20/00/00/278200000.db2.gz	QCSVAFAALGVPDZ-NNXHMXCWSA-N	0	3	308.466	2.380	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)Nc1ccc(N2CCCC2)nc1	ZINC000262509468	278221253	/nfs/dbraw/zinc/22/12/53/278221253.db2.gz	MVHMGIFWZPLINE-OAHLLOKOSA-N	0	3	302.422	2.399	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1nc2ccccc2s1)[C@@H]1CCCO1	ZINC000183130451	278339359	/nfs/dbraw/zinc/33/93/59/278339359.db2.gz	IDQIBHXGGSPKMB-PWSUYJOCSA-N	0	3	305.403	2.392	10	0		DEAEHN
CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)N1CCCN(C2CC2)CC1	ZINC000186216267	279063615	/nfs/dbraw/zinc/06/36/15/279063615.db2.gz	YJSGTXLBTPDQAU-IRXDYDNUSA-N	0	3	323.481	2.460	10	0		DEAEHN
CC(C)C[C@H](C)S(=O)(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000247511433	279117142	/nfs/dbraw/zinc/11/71/42/279117142.db2.gz	NEIVGWWJBARJSH-ZNMIVQPWSA-N	0	3	302.484	2.167	10	0		DEAEHN
CC(C)C[C@H](C)S(=O)(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000152872639	279117525	/nfs/dbraw/zinc/11/75/25/279117525.db2.gz	NEIVGWWJBARJSH-KKUMJFAQSA-N	0	3	302.484	2.167	10	0		DEAEHN
C[C@H](N[C@@H]1CCc2ncnn2C1)c1ccc2c(c1)OCCCO2	ZINC000180583295	279522105	/nfs/dbraw/zinc/52/21/05/279522105.db2.gz	QEQHXISWNVZERC-GXTWGEPZSA-N	0	3	314.389	2.105	10	0		DEAEHN
C[C@H]1NCCN(C(=O)C2=Cc3cc(Cl)ccc3OC2)[C@@H]1C	ZINC000262899365	280049444	/nfs/dbraw/zinc/04/94/44/280049444.db2.gz	XMVBMYSYJZEQLN-GHMZBOCLSA-N	0	3	306.793	2.325	10	0		DEAEHN
CC[C@@H](NC(=O)N1CCO[C@H](CN(C)C)C1)c1ccc(C)cc1	ZINC000172115769	280172959	/nfs/dbraw/zinc/17/29/59/280172959.db2.gz	FWWBXHDPYHQMQB-IAGOWNOFSA-N	0	3	319.449	2.418	10	0		DEAEHN
Cc1cccc(C(=O)N2CCCC[C@H](N3CCN(C)CC3)C2)c1	ZINC000173288863	281189849	/nfs/dbraw/zinc/18/98/49/281189849.db2.gz	HKWZQGTUXNXYAL-SFHVURJKSA-N	0	3	315.461	2.237	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cc(C)oc1C	ZINC000183250793	281195247	/nfs/dbraw/zinc/19/52/47/281195247.db2.gz	GJEXGOOFYCHSHW-UONOGXRCSA-N	0	3	312.435	2.144	10	0		DEAEHN
Cc1cccc(CNC(=O)N(CCN(C)C)C2CCCC2)n1	ZINC000119229727	281715459	/nfs/dbraw/zinc/71/54/59/281715459.db2.gz	HCXLYBIQTUOYML-UHFFFAOYSA-N	0	3	304.438	2.406	10	0		DEAEHN
COC[C@@H](C)CN[C@@H](CCSC)c1nnc2ccccn21	ZINC000187629156	332979544	/nfs/dbraw/zinc/97/95/44/332979544.db2.gz	JPKCBJMXZWJZRZ-STQMWFEESA-N	0	3	308.451	2.396	10	0		DEAEHN
COC[C@@H](C)CN[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O	ZINC000188198264	333039077	/nfs/dbraw/zinc/03/90/77/333039077.db2.gz	PTEKHCRIKQWLJE-HZMBPMFUSA-N	0	3	314.788	2.457	10	0		DEAEHN
O=C(NC[C@H]1CCCCN1C1CC1)c1cccc2nccnc21	ZINC000584564038	337362996	/nfs/dbraw/zinc/36/29/96/337362996.db2.gz	LIVXXXYVDCCSIL-CQSZACIVSA-N	0	3	310.401	2.377	10	0		DEAEHN
COc1ccccc1OCCNC[C@@H](O)COC1CCCCC1	ZINC000584627911	337376151	/nfs/dbraw/zinc/37/61/51/337376151.db2.gz	QUDMZEGKJLBQBP-OAHLLOKOSA-N	0	3	323.433	2.374	10	0		DEAEHN
Cc1c(F)cc(CNC2CC2)cc1S(=O)(=O)N[C@@H]1C[C@H]1C	ZINC000089023728	518185998	/nfs/dbraw/zinc/18/59/98/518185998.db2.gz	WRMUGDFRWDKHJA-YMTOWFKASA-N	0	3	312.410	2.073	10	0		DEAEHN
CCOc1ccccc1CN1CCN(C[C@@H](C)O)[C@H](CC)C1	ZINC000106104630	521483144	/nfs/dbraw/zinc/48/31/44/521483144.db2.gz	DEYLVEJEMGSQSN-NVXWUHKLSA-N	0	3	306.450	2.362	10	0		DEAEHN
COCc1ccc(C(=O)N(CCN(C)C)Cc2ccccn2)o1	ZINC000107261224	522945709	/nfs/dbraw/zinc/94/57/09/522945709.db2.gz	FBRXAOMSCFERER-UHFFFAOYSA-N	0	3	317.389	2.025	10	0		DEAEHN
CC[C@@H]1CN(CCN(C)c2ccccc2)CCN1CCOC	ZINC000131461927	523440980	/nfs/dbraw/zinc/44/09/80/523440980.db2.gz	JXXONJXYHSYHIH-QGZVFWFLSA-N	0	3	305.466	2.165	10	0		DEAEHN
COCCN(C)CCNCc1ccc(Br)c(F)c1	ZINC000127433828	523604744	/nfs/dbraw/zinc/60/47/44/523604744.db2.gz	AUKZJXSDTWZETL-UHFFFAOYSA-N	0	3	319.218	2.256	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)Cc1ccc(C)cc1	ZINC000111866032	523824248	/nfs/dbraw/zinc/82/42/48/523824248.db2.gz	RDFDARYKIKVPOH-QGZVFWFLSA-N	0	3	319.449	2.247	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)Cc1ccc(F)cc1	ZINC000111866306	523825373	/nfs/dbraw/zinc/82/53/73/523825373.db2.gz	DKQJULVGZGTLHD-MRXNPFEDSA-N	0	3	323.412	2.078	10	0		DEAEHN
Cc1cc(C)n2c(CN[C@@H](CO)Cc3ccccc3)cnc2n1	ZINC000152700683	524563179	/nfs/dbraw/zinc/56/31/79/524563179.db2.gz	QMECRICEFMZXGM-MRXNPFEDSA-N	0	3	310.401	2.039	10	0		DEAEHN
Cc1cc(NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)ccc1C(N)=O	ZINC000246821000	525169596	/nfs/dbraw/zinc/16/95/96/525169596.db2.gz	XEXVHGQLWOIKRL-GXTWGEPZSA-N	0	3	318.421	2.040	10	0		DEAEHN
c1ncn(Cc2ccccc2CN[C@H]2CCCc3n[nH]cc32)n1	ZINC000367613974	526617825	/nfs/dbraw/zinc/61/78/25/526617825.db2.gz	GVJPMATZXFQLFB-INIZCTEOSA-N	0	3	308.389	2.217	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)C[C@@H](N)c1ccccc1	ZINC000119274778	527640907	/nfs/dbraw/zinc/64/09/07/527640907.db2.gz	CSQILHOZAOSYBT-SJKOYZFVSA-N	0	3	314.433	2.174	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)N1CCc2sccc2C1	ZINC000262572453	535043320	/nfs/dbraw/zinc/04/33/20/535043320.db2.gz	XQCOPBZJAOVVRO-DXCKQFNASA-N	0	3	320.458	2.165	10	0		DEAEHN
CC(C)Oc1ccccc1-c1nc([C@H]2CNCCN2C)no1	ZINC000263166186	535053089	/nfs/dbraw/zinc/05/30/89/535053089.db2.gz	FGFPMUZPFVCELD-CYBMUJFWSA-N	0	3	302.378	2.100	10	0		DEAEHN
CC(C)(CNC(=O)C1(N)CCOCC1)c1cccc(Cl)c1	ZINC000261927166	535092903	/nfs/dbraw/zinc/09/29/03/535092903.db2.gz	VVUOYSBCDDBOOG-UHFFFAOYSA-N	0	3	310.825	2.242	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CC[C@@H](OCc2ccncc2)C1	ZINC000360186000	535364290	/nfs/dbraw/zinc/36/42/90/535364290.db2.gz	YGSUJENHOMSRBV-SJORKVTESA-N	0	3	317.433	2.074	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N(C)[C@@H]1CCCN(C)C1)C2	ZINC000375264365	535381566	/nfs/dbraw/zinc/38/15/66/535381566.db2.gz	YUBIGSIMESJPDJ-ZIAGYGMSSA-N	0	3	318.465	2.191	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)N(C)[C@@H]1CCCN(C)C1)CC2	ZINC000375264365	535381567	/nfs/dbraw/zinc/38/15/67/535381567.db2.gz	YUBIGSIMESJPDJ-ZIAGYGMSSA-N	0	3	318.465	2.191	10	0		DEAEHN
CN(C)Cc1ccnc(NCc2c(Br)cnn2C)c1	ZINC000362632931	536050775	/nfs/dbraw/zinc/05/07/75/536050775.db2.gz	HCLRDVAAJYDGHU-UHFFFAOYSA-N	0	3	324.226	2.251	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc(OC)c(F)c2)CCN1C[C@H](C)O	ZINC000246925954	536155559	/nfs/dbraw/zinc/15/55/59/536155559.db2.gz	AOZAPRVCUUATBY-ZFWWWQNUSA-N	0	3	310.413	2.111	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)c2cnc[nH]2)[C@H]1c1cccs1	ZINC000357219377	536386629	/nfs/dbraw/zinc/38/66/29/536386629.db2.gz	KXDBYVNUSVDRMS-RISCZKNCSA-N	0	3	304.419	2.284	10	0		DEAEHN
CNC(=O)c1ccc(CN2CC[C@@H](C)[C@H](n3ccnc3)C2)cc1	ZINC000247794809	536423882	/nfs/dbraw/zinc/42/38/82/536423882.db2.gz	ZLXQTFDDLIQUDF-RHSMWYFYSA-N	0	3	312.417	2.326	10	0		DEAEHN
CN1CC[C@@H](NC(=O)Cc2cncs2)[C@H]1c1ccccc1	ZINC000249969520	536454419	/nfs/dbraw/zinc/45/44/19/536454419.db2.gz	XKYNDNWKDVUKKU-GDBMZVCRSA-N	0	3	301.415	2.247	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)C(=O)c2ccc(Cl)cc2)C1	ZINC000252656599	536470303	/nfs/dbraw/zinc/47/03/03/536470303.db2.gz	KJFXLIKBRMMPCE-DZGCQCFKSA-N	0	3	320.820	2.465	10	0		DEAEHN
CC(C)(C)OC(=O)NC[C@H]1CC[C@]2(C1)NCCc1nc[nH]c12	ZINC000724109156	563496093	/nfs/dbraw/zinc/49/60/93/563496093.db2.gz	FNAOGCHUOUCNIP-MEDUHNTESA-N	0	3	306.410	2.076	10	0		DEAEHN
O=S(=O)(/C=C\c1ccccc1)NC1CCN(CC2CC2)CC1	ZINC000255143448	623607620	/nfs/dbraw/zinc/60/76/20/623607620.db2.gz	MYAHRJQNJGDVDD-RAXLEYEMSA-N	0	3	320.458	2.451	10	0		DEAEHN
CCC[C@H](C(=O)N1CCn2c(C(C)C)nnc2[C@H]1C)N(C)C	ZINC000188800616	624168851	/nfs/dbraw/zinc/16/88/51/624168851.db2.gz	FMLZCWRRYQJAEN-CHWSQXEVSA-N	0	3	307.442	2.035	10	0		DEAEHN
c1nnc(C2CCN(CCOCCOc3ccccc3)CC2)[nH]1	ZINC000083444814	633098229	/nfs/dbraw/zinc/09/82/29/633098229.db2.gz	UKDCMPIIOAGUQT-UHFFFAOYSA-N	0	3	316.405	2.080	10	0		DEAEHN
C[C@@H](NC(=O)[C@H](N)C1CCOCC1)C12CC3CC(CC(C3)C1)C2	ZINC000261720374	636259287	/nfs/dbraw/zinc/25/92/87/636259287.db2.gz	JFUJRLSRAYWQQS-XHRNPLNVSA-N	0	3	320.477	2.461	10	0		DEAEHN
C[C@H](N[C@@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C)c1nncn1C	ZINC000229084580	646665895	/nfs/dbraw/zinc/66/58/95/646665895.db2.gz	CVNBMZUVGMBAPK-YNEHKIRRSA-N	0	3	323.441	2.159	10	0		DEAEHN
C[C@H]1[C@H](NCc2cncnc2)CCCN1C(=O)OC(C)(C)C	ZINC000189531075	649415571	/nfs/dbraw/zinc/41/55/71/649415571.db2.gz	CBLWVEFYGDKFIC-GXTWGEPZSA-N	0	3	306.410	2.354	10	0		DEAEHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)CN1CCCC1	ZINC000005602534	651279696	/nfs/dbraw/zinc/27/96/96/651279696.db2.gz	RVSRDNZLKOKNCE-SJLPKXTDSA-N	0	3	313.445	2.225	10	0		DEAEHN
Brc1ccc2c(c1)[C@@H](NCCn1cncn1)CCO2	ZINC000381649413	685400888	/nfs/dbraw/zinc/40/08/88/685400888.db2.gz	AQLRYOQDXQOMCQ-LBPRGKRZSA-N	0	3	323.194	2.154	10	0		DEAEHN
COC(=O)CCN[C@@H]1CCOc2ccc(Br)cc21	ZINC000037252242	683881892	/nfs/dbraw/zinc/88/18/92/683881892.db2.gz	BVSUXHASNKVWNM-LLVKDONJSA-N	0	3	314.179	2.425	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NS(=O)(=O)/C=C/c2ccccc2)C1	ZINC000246239114	685126340	/nfs/dbraw/zinc/12/63/40/685126340.db2.gz	RLXDRJFAKYKGCQ-UFXRLHEYSA-N	0	3	308.447	2.305	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)O[C@H]1CCN(Cc2ccccc2)C1	ZINC000248749688	685167104	/nfs/dbraw/zinc/16/71/04/685167104.db2.gz	BUYJAORCVWUDOS-PVAVHDDUSA-N	0	3	303.402	2.477	10	0		DEAEHN
Cc1cn(C)nc1CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C	ZINC000723502000	777113613	/nfs/dbraw/zinc/11/36/13/777113613.db2.gz	XTDNIIJSTWCLPX-UONOGXRCSA-N	0	3	322.453	2.464	10	0		DEAEHN
C[C@@](O)(CN1CCC[C@@](C)(O)CC1)C(F)(F)C(F)(F)F	ZINC000724041748	777228681	/nfs/dbraw/zinc/22/86/81/777228681.db2.gz	OVVRXXACHZSVGY-NXEZZACHSA-N	0	3	305.287	2.172	10	0		DEAEHN
COC1(C)CCN(C[C@](C)(O)C(F)(F)C(F)(F)F)CC1	ZINC000724111041	777242990	/nfs/dbraw/zinc/24/29/90/777242990.db2.gz	LBFOPVUJAJBBEE-JTQLQIEISA-N	0	3	305.287	2.436	10	0		DEAEHN
C[C@@H](N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C)c1cnn(C)c1	ZINC000721863107	780405772	/nfs/dbraw/zinc/40/57/72/780405772.db2.gz	HXPMLMIPCNAVQY-YRGRVCCFSA-N	0	3	308.426	2.326	10	0		DEAEHN
CCc1ccc([C@@H](C)NC[C@]2(OC)CCS(=O)(=O)C2)s1	ZINC000721262332	781074783	/nfs/dbraw/zinc/07/47/83/781074783.db2.gz	TUKCETQQPZUGRQ-BXUZGUMPSA-N	0	3	317.476	2.165	10	0		DEAEHN
COc1cccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)n1	ZINC000721885007	781532022	/nfs/dbraw/zinc/53/20/22/781532022.db2.gz	WOFJXFUXLDSSGI-TZMCWYRMSA-N	0	3	321.421	2.435	10	0		DEAEHN
Cc1cc(Cl)ccc1S(=O)(=O)N1CCNCCC1(C)C	ZINC000712516529	792192551	/nfs/dbraw/zinc/19/25/51/792192551.db2.gz	ZYHQOLRRYBDTQF-UHFFFAOYSA-N	0	3	316.854	2.411	10	0		DEAEHN
O=S(=O)(c1ccc(Cl)cc1)N1CCNCCC12CCC2	ZINC000713218420	792217045	/nfs/dbraw/zinc/21/70/45/792217045.db2.gz	VKNJNHFRHTZCJA-UHFFFAOYSA-N	0	3	314.838	2.247	10	0		DEAEHN
Cc1c(CN)c(NC(=O)c2cscc2C(F)F)nn1C	ZINC000717243793	799276736	/nfs/dbraw/zinc/27/67/36/799276736.db2.gz	ZRVGCBCNCUCCBD-UHFFFAOYSA-N	0	3	300.334	2.439	10	0		DEAEHN
Cn1cc(CNCC[C@@H]2CC(C)(C)CO2)c(Br)n1	ZINC000717350441	799381292	/nfs/dbraw/zinc/38/12/92/799381292.db2.gz	ZTJYETSSYWDMGO-LLVKDONJSA-N	0	3	316.243	2.477	10	0		DEAEHN
Cc1cc(CN[C@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)n(C)n1	ZINC000401810912	801852085	/nfs/dbraw/zinc/85/20/85/801852085.db2.gz	UEYUAYUIBXVSSQ-JSGCOSHPSA-N	0	3	322.453	2.464	10	0		DEAEHN
CCn1cc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)nn1	ZINC000404432357	802020036	/nfs/dbraw/zinc/02/00/36/802020036.db2.gz	OECXKLZYSASEBW-GXTWGEPZSA-N	0	3	323.441	2.033	10	0		DEAEHN
C[C@@H](C[C@@H]1CCOC1)NCc1cn(C)nc1Br	ZINC000720668136	1085836574	/nfs/dbraw/zinc/83/65/74/1085836574.db2.gz	AGRNURYHRWGNPL-UWVGGRQHSA-N	0	3	302.216	2.087	10	0		DEAEHN
CN1CCC[C@H]2[C@H]1CCN2C(=O)c1ccncc1Br	ZINC000720830672	1086186862	/nfs/dbraw/zinc/18/68/62/1086186862.db2.gz	SBQWAQIFNXHVIA-OLZOCXBDSA-N	0	3	324.222	2.153	10	0		DEAEHN
CN(C)C[C@H](N)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000702415602	1086431961	/nfs/dbraw/zinc/43/19/61/1086431961.db2.gz	WAUKSZMQFYDRCC-KRWDZBQOSA-N	0	3	313.401	2.093	10	0		DEAEHN
COC[C@H](C)OC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C	ZINC000704490099	1086583425	/nfs/dbraw/zinc/58/34/25/1086583425.db2.gz	QBYSEAFXEYRBCO-OFQRWUPVSA-N	0	3	306.406	2.411	10	0		DEAEHN
CCn1cc(CNCC23CC(C2)CN3C(=O)OC(C)(C)C)cn1	ZINC000706424812	1086638633	/nfs/dbraw/zinc/63/86/33/1086638633.db2.gz	LELAWZGOCCCOEV-UHFFFAOYSA-N	0	3	320.437	2.392	10	0		DEAEHN
COC1(OC)CC[C@@H]1N[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000710957195	1086691576	/nfs/dbraw/zinc/69/15/76/1086691576.db2.gz	CRMNFEOCFQDTLN-UTUOFQBUSA-N	0	3	302.415	2.029	10	0		DEAEHN
COCC(C)(C)CCNCc1cn(C)nc1Br	ZINC000718724414	1088634983	/nfs/dbraw/zinc/63/49/83/1088634983.db2.gz	AZEHIEAKEHJGFA-UHFFFAOYSA-N	0	3	304.232	2.335	10	0		DEAEHN
C[C@@H]1[C@@H](NC(=O)c2ccc(F)c(Br)c2)CCN1C	ZINC000719384319	1089076739	/nfs/dbraw/zinc/07/67/39/1089076739.db2.gz	CUCAITFCPATXBO-PELKAZGASA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@H]1[C@H](NC(=O)c2ccsc2Br)CCN1C	ZINC000719399081	1089086028	/nfs/dbraw/zinc/08/60/28/1089086028.db2.gz	YXJBYFNBIUOVFU-IONNQARKSA-N	0	3	303.225	2.333	10	0		DEAEHN
CN[C@@H]1c2ccccc2OC[C@H]1Sc1nnc(N(C)C)s1	ZINC000081769400	192323176	/nfs/dbraw/zinc/32/31/76/192323176.db2.gz	VQKDAHAGDUIFMJ-VXGBXAGGSA-N	0	3	322.459	2.418	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(CCOC)Cc2ccc(C)o2)C1	ZINC000151451472	282117155	/nfs/dbraw/zinc/11/71/55/282117155.db2.gz	CFXGMUNWFRKRSD-OAHLLOKOSA-N	0	3	323.437	2.230	10	0		DEAEHN
CC[C@H](N)[C@H](C)S(=O)(=O)c1ccc(Br)cc1	ZINC000081933360	192341332	/nfs/dbraw/zinc/34/13/32/192341332.db2.gz	MOVUGOIGTAQIDA-KWQFWETISA-N	0	3	306.225	2.349	10	0		DEAEHN
CN[C@@H]1CCC[C@H]1S(=O)(=O)c1ccc(Br)cc1	ZINC000081933396	192341485	/nfs/dbraw/zinc/34/14/85/192341485.db2.gz	CERPDEJWLOIVLO-VXGBXAGGSA-N	0	3	318.236	2.363	10	0		DEAEHN
CS[C@H]1CN(C(=O)CCOCC(C)C)C[C@@H]1N1CCCC1	ZINC000361632694	295670584	/nfs/dbraw/zinc/67/05/84/295670584.db2.gz	UJVIGRPSEGOOAG-GJZGRUSLSA-N	0	3	314.495	2.087	10	0		DEAEHN
CCCN[C@@H](C)[C@H](C)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000081935180	192343173	/nfs/dbraw/zinc/34/31/73/192343173.db2.gz	UUXGNSZTZYKAKC-RYUDHWBXSA-N	0	3	313.419	2.008	10	0		DEAEHN
CC(=O)c1ccc(N2CCN(CCN(C)C)CC2)cc1Cl	ZINC000078941784	185132606	/nfs/dbraw/zinc/13/26/06/185132606.db2.gz	WBEULPPNPAILMP-UHFFFAOYSA-N	0	3	309.841	2.226	10	0		DEAEHN
C[C@H](O)c1ccc(N2CCN(CCN(C)C)CC2)cc1Cl	ZINC000078944579	185133422	/nfs/dbraw/zinc/13/34/22/185133422.db2.gz	WWHORFDMWKGBHZ-ZDUSSCGKSA-N	0	3	311.857	2.077	10	0		DEAEHN
CC[C@]1(CO)CCCN(C(=O)N[C@H](CC(C)C)CN(C)C)C1	ZINC000190286468	529420971	/nfs/dbraw/zinc/42/09/71/529420971.db2.gz	IFNWKXOQZWJHCG-WBVHZDCISA-N	0	3	313.486	2.157	10	0		DEAEHN
Cn1cc([C@@H]2NC(=O)CC[C@H]2NC/C=C/c2ccco2)cn1	ZINC000328656933	231293162	/nfs/dbraw/zinc/29/31/62/231293162.db2.gz	ZVFDBEAXWXLPBU-FKFXUJFPSA-N	0	3	300.362	2.476	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(CCN3CCCC3=O)C2)c1	ZINC000083252239	185221655	/nfs/dbraw/zinc/22/16/55/185221655.db2.gz	IDTKENKVUARWAH-CQSZACIVSA-N	0	3	318.417	2.116	10	0		DEAEHN
CC(C)[C@@H](C[NH3+])[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000087404594	185223727	/nfs/dbraw/zinc/22/37/27/185223727.db2.gz	LGKFKJCJRRUXTD-LLVKDONJSA-N	0	3	311.234	2.255	10	0		DEAEHN
CCC[C@H](C[NH3+])[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000087403886	185223753	/nfs/dbraw/zinc/22/37/53/185223753.db2.gz	IMZOTWRSGCZYCM-MRVPVSSYSA-N	0	3	311.234	2.399	10	0		DEAEHN
CN[C@@H](Cc1cc(Br)ccc1OC)c1nc[nH]n1	ZINC000087879188	185234551	/nfs/dbraw/zinc/23/45/51/185234551.db2.gz	UMEGRHPSUIDUDT-JTQLQIEISA-N	0	3	311.183	2.079	10	0		DEAEHN
C[NH2+][C@@H](Cc1cc(Br)ccc1OC)c1nnc[n-]1	ZINC000087879188	185234552	/nfs/dbraw/zinc/23/45/52/185234552.db2.gz	UMEGRHPSUIDUDT-JTQLQIEISA-N	0	3	311.183	2.079	10	0		DEAEHN
CN[C@@H](Cc1cc(Br)ccc1OC)c1nnc[nH]1	ZINC000087879188	185234553	/nfs/dbraw/zinc/23/45/53/185234553.db2.gz	UMEGRHPSUIDUDT-JTQLQIEISA-N	0	3	311.183	2.079	10	0		DEAEHN
NC[C@@H](NC[C@H]1CCCO1)c1cc(Br)ccc1F	ZINC000087928556	185237512	/nfs/dbraw/zinc/23/75/12/185237512.db2.gz	UVPYHUGRURNESN-ZWNOBZJWSA-N	0	3	317.202	2.357	10	0		DEAEHN
COc1cc(C)c(Br)cc1[C@H](N)CCC(N)=O	ZINC000088078818	185238791	/nfs/dbraw/zinc/23/87/91/185238791.db2.gz	UETLYMWEWOKOFB-SNVBAGLBSA-N	0	3	301.184	2.031	10	0		DEAEHN
COc1cc(C)c(Br)cc1[C@H](N)[C@@H]1COCCO1	ZINC000088078060	185238971	/nfs/dbraw/zinc/23/89/71/185238971.db2.gz	XYGGRDMZEWWWLS-STQMWFEESA-N	0	3	316.195	2.181	10	0		DEAEHN
COc1ccc(Br)c(Cn2ncc(CN)c2C)c1	ZINC000087799454	185232598	/nfs/dbraw/zinc/23/25/98/185232598.db2.gz	OCZRQSOEEXSKSU-UHFFFAOYSA-N	0	3	310.195	2.470	10	0		DEAEHN
C[C@H](CNC(=O)N1CC[C@@H](N(C)C)C1)c1ccc(F)cc1F	ZINC000173509858	282190886	/nfs/dbraw/zinc/19/08/86/282190886.db2.gz	CBNAZHHAXRIXBD-DGCLKSJQSA-N	0	3	311.376	2.414	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1ccc2nc(N)sc2c1	ZINC000087847659	185233409	/nfs/dbraw/zinc/23/34/09/185233409.db2.gz	QNVFJSNJZIREQE-NSHDSACASA-N	0	3	304.419	2.045	10	0		DEAEHN
CN[C@H](Cc1cc(OC)ccc1Br)c1nc[nH]n1	ZINC000087879016	185234282	/nfs/dbraw/zinc/23/42/82/185234282.db2.gz	HLXPAKZEIAPYPG-LLVKDONJSA-N	0	3	311.183	2.079	10	0		DEAEHN
C[NH2+][C@H](Cc1cc(OC)ccc1Br)c1nnc[n-]1	ZINC000087879016	185234283	/nfs/dbraw/zinc/23/42/83/185234283.db2.gz	HLXPAKZEIAPYPG-LLVKDONJSA-N	0	3	311.183	2.079	10	0		DEAEHN
CN[C@H](Cc1cc(OC)ccc1Br)c1nnc[nH]1	ZINC000087879016	185234284	/nfs/dbraw/zinc/23/42/84/185234284.db2.gz	HLXPAKZEIAPYPG-LLVKDONJSA-N	0	3	311.183	2.079	10	0		DEAEHN
CN(CCc1ccccc1)S(=O)(=O)c1cccc(CN)c1	ZINC000088196222	185241432	/nfs/dbraw/zinc/24/14/32/185241432.db2.gz	AMFNGOISSCMPEJ-UHFFFAOYSA-N	0	3	304.415	2.009	10	0		DEAEHN
COc1ccccc1C[C@@H](C)N(C)C(=O)[C@@H](N)CCSC	ZINC000088200092	185241707	/nfs/dbraw/zinc/24/17/07/185241707.db2.gz	MJFDGZBSFOINHH-OCCSQVGLSA-N	0	3	310.463	2.165	10	0		DEAEHN
CCCN[C@@H](Cc1ccc2ccccc2n1)CS(C)(=O)=O	ZINC000088519504	185254712	/nfs/dbraw/zinc/25/47/12/185254712.db2.gz	OFDTXPQRYZLHTQ-HNNXBMFYSA-N	0	3	306.431	2.190	10	0		DEAEHN
CCN(C(C)C)S(=O)(=O)c1ccc(CNCC(C)C)o1	ZINC000088543640	185256715	/nfs/dbraw/zinc/25/67/15/185256715.db2.gz	WJBJJDVUHJBRJE-UHFFFAOYSA-N	0	3	302.440	2.444	10	0		DEAEHN
CCOC(=O)[C@H]1CNCCN1[C@@H]1CCSc2ccccc21	ZINC000088658293	185261676	/nfs/dbraw/zinc/26/16/76/185261676.db2.gz	OCTVGCYMEIEBNV-ZIAGYGMSSA-N	0	3	306.431	2.060	10	0		DEAEHN
CCCN[C@H](CS(=O)(=O)CCCOC)c1ccccc1C	ZINC000081985839	192349448	/nfs/dbraw/zinc/34/94/48/192349448.db2.gz	IJONQJGUSSGQPJ-MRXNPFEDSA-N	0	3	313.463	2.487	10	0		DEAEHN
C[C@H](N[C@H]1CCCS(=O)(=O)C1)c1ccccc1-n1cccn1	ZINC000090016378	185278182	/nfs/dbraw/zinc/27/81/82/185278182.db2.gz	MHVQAAQSVPAWPQ-KBPBESRZSA-N	0	3	319.430	2.100	10	0		DEAEHN
N[C@H]1COC[C@H]1c1nc(-c2ccc(Br)s2)no1	ZINC000090364811	185292893	/nfs/dbraw/zinc/29/28/93/185292893.db2.gz	GASXRQZMWHFCFF-RITPCOANSA-N	0	3	316.180	2.002	10	0		DEAEHN
N[C@@H]1COC[C@H]1C(=O)Nc1ccc(Cl)cc1C(F)(F)F	ZINC000090378666	185293436	/nfs/dbraw/zinc/29/34/36/185293436.db2.gz	CINDIXODOLJRCD-VXNVDRBHSA-N	0	3	308.687	2.271	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1c(Cl)ccc(C)c1Cl	ZINC000090431444	185295993	/nfs/dbraw/zinc/29/59/93/185295993.db2.gz	GATUYKIZHZQVSK-SCZZXKLOSA-N	0	3	303.189	2.475	10	0		DEAEHN
CC(C)Oc1ccc(NC(=O)[C@]2(C)COC[C@@H]2N)cc1Cl	ZINC000090588719	185305382	/nfs/dbraw/zinc/30/53/82/185305382.db2.gz	RGKOLTABLDODMJ-DZGCQCFKSA-N	0	3	312.797	2.430	10	0		DEAEHN
C[C@]1(C(=O)Nc2ccc(Cl)c3ncccc23)COC[C@@H]1N	ZINC000090588951	185305556	/nfs/dbraw/zinc/30/55/56/185305556.db2.gz	FMFDPSNHDSRVHH-WFASDCNBSA-N	0	3	305.765	2.191	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)[C@]1(C)COC[C@@H]1N	ZINC000090589944	185305596	/nfs/dbraw/zinc/30/55/96/185305596.db2.gz	DSARACRUQUVKLX-DZGCQCFKSA-N	0	3	312.797	2.431	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@]2(C)COC[C@H]2N)cc1C(F)(F)F	ZINC000090601246	185306037	/nfs/dbraw/zinc/30/60/37/185306037.db2.gz	IKOCEQNUWKHGEL-YPMHNXCESA-N	0	3	302.296	2.316	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)C1CCC(C(=O)OC)CC1	ZINC000179502522	282227337	/nfs/dbraw/zinc/22/73/37/282227337.db2.gz	KCNWJRDAOXJHPI-GPANFISMSA-N	0	3	324.465	2.347	10	0		DEAEHN
CCC(CC)[C@@H](O)CNC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000111826635	282240680	/nfs/dbraw/zinc/24/06/80/282240680.db2.gz	WUHVVOFGORXEPP-CABCVRRESA-N	0	3	301.475	2.059	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1nc(NC)ccc1Cl	ZINC000092674443	185333118	/nfs/dbraw/zinc/33/31/18/185333118.db2.gz	RXUKQSJWXZOGIT-NSHDSACASA-N	0	3	310.829	2.333	10	0		DEAEHN
CCN(CC)CC(=O)NCc1nc2ccccc2n1C1CC1	ZINC000185105218	282260023	/nfs/dbraw/zinc/26/00/23/282260023.db2.gz	DEQXYLRBXRVFNV-UHFFFAOYSA-N	0	3	300.406	2.329	10	0		DEAEHN
CNCc1cc(S(=O)(=O)NC2C(C)(C)C2(C)C)ccc1C	ZINC000092833225	185344820	/nfs/dbraw/zinc/34/48/20/185344820.db2.gz	DPPLLEGLGXQBDG-UHFFFAOYSA-N	0	3	310.463	2.427	10	0		DEAEHN
C[C@@H]1OCC[C@H]1N[C@@H](CO)c1cccc(Br)c1	ZINC000181399738	199290713	/nfs/dbraw/zinc/29/07/13/199290713.db2.gz	YGIZUKBSADCLEB-BIMULSAOSA-N	0	3	300.196	2.250	10	0		DEAEHN
COCC[C@H](C)N[C@H](CO)c1cccc(Br)c1	ZINC000181390557	199288756	/nfs/dbraw/zinc/28/87/56/199288756.db2.gz	WJZITYMBTYEFID-GXFFZTMASA-N	0	3	302.212	2.497	10	0		DEAEHN
C[C@H](NCCN1C(=O)NC(C)(C)C1=O)c1cccc(Cl)c1	ZINC000181410296	199292576	/nfs/dbraw/zinc/29/25/76/199292576.db2.gz	JAQOBGXXIKQZSH-JTQLQIEISA-N	0	3	309.797	2.321	10	0		DEAEHN
COC1(CNC(=O)N[C@@H](CN(C)C)c2ccccc2)CCC1	ZINC000181414547	199293852	/nfs/dbraw/zinc/29/38/52/199293852.db2.gz	XMXJOUQKUFBIDM-HNNXBMFYSA-N	0	3	305.422	2.158	10	0		DEAEHN
CN1C[C@@H](C(=O)Nc2cccc3nccn32)[C@H](C(F)(F)F)C1	ZINC000299745609	529816745	/nfs/dbraw/zinc/81/67/45/529816745.db2.gz	RJHZLCWORARJFD-NXEZZACHSA-N	0	3	312.295	2.013	10	0		DEAEHN
COC(=O)CC1(CC(=O)NCCN2CCCC[C@H]2C)CCCC1	ZINC000189093901	282307818	/nfs/dbraw/zinc/30/78/18/282307818.db2.gz	KSEGFRZDVNYFMI-OAHLLOKOSA-N	0	3	324.465	2.491	10	0		DEAEHN
C[C@@H]1CSCCN(CC(=O)N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000190438270	282320908	/nfs/dbraw/zinc/32/09/08/282320908.db2.gz	KSYOQGNPICJQFY-RYUDHWBXSA-N	0	3	324.412	2.472	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCC(C)(C)c2ccncc2)CCN1C	ZINC000092362425	539425425	/nfs/dbraw/zinc/42/54/25/539425425.db2.gz	YJFFYYZXIORQFD-GDBMZVCRSA-N	0	3	318.465	2.483	10	0		DEAEHN
COC(=O)N[C@@H](C(=O)Nc1cccc(CN(C)C)c1)C(C)C	ZINC000108157606	185503746	/nfs/dbraw/zinc/50/37/46/185503746.db2.gz	CFMJMXYIHZKKLR-CQSZACIVSA-N	0	3	307.394	2.067	10	0		DEAEHN
Cc1cc(C)n2c(CN3CCC[C@H]3Cn3ccnc3)cnc2n1	ZINC000097103948	539434859	/nfs/dbraw/zinc/43/48/59/539434859.db2.gz	VTDFSMPZYMXOGE-HNNXBMFYSA-N	0	3	310.405	2.207	10	0		DEAEHN
CCc1nc(CN2CC[C@H](CNc3cccc(C)n3)C2)n[nH]1	ZINC000181713007	199342660	/nfs/dbraw/zinc/34/26/60/199342660.db2.gz	UTULSFXUANQNTR-CYBMUJFWSA-N	0	3	300.410	2.005	10	0		DEAEHN
COC1(CNCc2cc(-c3ccccc3)n[nH]2)CCOCC1	ZINC000123181427	539464958	/nfs/dbraw/zinc/46/49/58/539464958.db2.gz	NDQUHQDMPAXBJR-UHFFFAOYSA-N	0	3	301.390	2.362	10	0		DEAEHN
CCc1nc(CNC(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)cs1	ZINC000125405578	539472636	/nfs/dbraw/zinc/47/26/36/539472636.db2.gz	CXPMJHAFKAEJBS-MNOVXSKESA-N	0	3	308.451	2.130	10	0		DEAEHN
Cc1ccsc1CN1CCCN(Cc2noc(C)n2)CC1	ZINC000127919539	539484793	/nfs/dbraw/zinc/48/47/93/539484793.db2.gz	SOFPDCNPBCXFIW-UHFFFAOYSA-N	0	3	306.435	2.456	10	0		DEAEHN
O=S(=O)(c1cccc(F)c1)N1CCCC[C@@H]1CNC1CC1	ZINC000111720827	185631558	/nfs/dbraw/zinc/63/15/58/185631558.db2.gz	BPVVQOJHOYBAJA-CQSZACIVSA-N	0	3	312.410	2.121	10	0		DEAEHN
CC(C)OC1CCC(NC(=O)N2CC[C@H](N3CC=CC3)C2)CC1	ZINC000151984750	539533793	/nfs/dbraw/zinc/53/37/93/539533793.db2.gz	AKGJZWXIEVMVPC-CGZBRXJRSA-N	0	3	321.465	2.378	10	0		DEAEHN
COC(=O)C(C)(C)[C@@H]1CCCN(C[C@@H](O)CC(F)(F)F)C1	ZINC000615794710	362703961	/nfs/dbraw/zinc/70/39/61/362703961.db2.gz	PCOMMJZSQACRJX-MNOVXSKESA-N	0	3	311.344	2.211	10	0		DEAEHN
CS[C@@H]1CN(C(=O)Nc2ccc(C)nc2)C[C@@H]1N1CCCC1	ZINC000615932977	362735191	/nfs/dbraw/zinc/73/51/91/362735191.db2.gz	XKDHRBJJEYVZDH-LSDHHAIUSA-N	0	3	320.462	2.434	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(Br)c[nH]1	ZINC000083550446	192372093	/nfs/dbraw/zinc/37/20/93/192372093.db2.gz	RNMMSMJOTSEJAI-MWLCHTKSSA-N	0	3	312.211	2.086	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(C23CC4CC(CC(C4)C2)C3)n1	ZINC000263179817	282974348	/nfs/dbraw/zinc/97/43/48/282974348.db2.gz	GPFYDQHJRFGZRE-DLUQRMLASA-N	0	3	302.422	2.114	10	0		DEAEHN
CSc1nnc(CCCNCc2cncnc2)n1CC(C)C	ZINC000177559283	539630950	/nfs/dbraw/zinc/63/09/50/539630950.db2.gz	VLBFFQZOQRAXGQ-UHFFFAOYSA-N	0	3	320.466	2.168	10	0		DEAEHN
CCN1C(=O)CC[C@H](N)[C@@H]1c1ccc(OC)c(OC)c1Cl	ZINC000070985995	190928662	/nfs/dbraw/zinc/92/86/62/190928662.db2.gz	RBNAGRIXJPLYJU-HZMBPMFUSA-N	0	3	312.797	2.368	10	0		DEAEHN
CN[C@@H](Cc1ncnn1C)c1cc(Br)cs1	ZINC000083974305	192393454	/nfs/dbraw/zinc/39/34/54/192393454.db2.gz	RVFVZHWQCASWED-QMMMGPOBSA-N	0	3	301.213	2.142	10	0		DEAEHN
CC(=O)N(CCN)c1ccc(CNC(=O)OC(C)(C)C)cc1	ZINC000071701098	191009894	/nfs/dbraw/zinc/00/98/94/191009894.db2.gz	KNRNOQKSKOEXIW-UHFFFAOYSA-N	0	3	307.394	2.023	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N2CCCC[C@@H]2C)c1	ZINC000138257715	186015572	/nfs/dbraw/zinc/01/55/72/186015572.db2.gz	XKJPNRGEPSFRMP-JTQLQIEISA-N	0	3	318.389	2.247	10	0		DEAEHN
CN[C@@H](Cc1cc(OC)ncn1)c1ccc(Br)o1	ZINC000138719060	186018182	/nfs/dbraw/zinc/01/81/82/186018182.db2.gz	OZIALQVYQJBSOM-VIFPVBQESA-N	0	3	312.167	2.344	10	0		DEAEHN
CCCCN(C1CC1)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138739162	186018404	/nfs/dbraw/zinc/01/84/04/186018404.db2.gz	QPMVRXZBPHNEAV-UHFFFAOYSA-N	0	3	318.389	2.377	10	0		DEAEHN
CC(C)[C@@H]1CCN(S(=O)(=O)c2cc(CN)cc(F)c2F)C1	ZINC000139292747	186021082	/nfs/dbraw/zinc/02/10/82/186021082.db2.gz	SQSXTDVKWPGZIN-LLVKDONJSA-N	0	3	318.389	2.090	10	0		DEAEHN
CCC[C@H]1N[C@H](c2ccsc2)N(C2CCN(C)CC2)C1=O	ZINC000141186633	186029115	/nfs/dbraw/zinc/02/91/15/186029115.db2.gz	OAFJHUQGLUQZHS-CABCVRRESA-N	0	3	307.463	2.441	10	0		DEAEHN
CC(C)[C@H]1N[C@@H](c2ccsc2)N(C2CCN(C)CC2)C1=O	ZINC000141241292	186029131	/nfs/dbraw/zinc/02/91/31/186029131.db2.gz	JBSTYQJZXGEZHH-HUUCEWRRSA-N	0	3	307.463	2.297	10	0		DEAEHN
Cc1c(NN)ncnc1OCc1ccc(Br)cc1	ZINC000147819325	186042010	/nfs/dbraw/zinc/04/20/10/186042010.db2.gz	INYXSWQXSXVFHH-UHFFFAOYSA-N	0	3	309.167	2.412	10	0		DEAEHN
CNCc1ccc(Oc2cccc(S(C)(=O)=O)c2)nc1C	ZINC000148249308	186043907	/nfs/dbraw/zinc/04/39/07/186043907.db2.gz	KKVLFDVFVYCQEC-UHFFFAOYSA-N	0	3	306.387	2.305	10	0		DEAEHN
CCNCc1sc(CS(C)(=O)=O)nc1-c1ccccc1	ZINC000149475094	186050233	/nfs/dbraw/zinc/05/02/33/186050233.db2.gz	GWKMWBKTWCUYCO-UHFFFAOYSA-N	0	3	310.444	2.464	10	0		DEAEHN
CCN[C@@H](c1cnc2ccccc2c1)[C@H]1CCS(=O)(=O)C1	ZINC000150100603	186055056	/nfs/dbraw/zinc/05/50/56/186055056.db2.gz	JNBCBNDLQRAHTI-XJKSGUPXSA-N	0	3	304.415	2.320	10	0		DEAEHN
NCc1ccccc1NC(=O)CC[S@](=O)c1ccccc1	ZINC000155906172	186121798	/nfs/dbraw/zinc/12/17/98/186121798.db2.gz	DBWLQLDDKNQAFM-OAQYLSRUSA-N	0	3	302.399	2.282	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccccc1CN)[S@@](=O)c1ccccc1	ZINC000155907837	186122541	/nfs/dbraw/zinc/12/25/41/186122541.db2.gz	QCAWBIDARBZNTF-QKVFXAPYSA-N	0	3	302.399	2.280	10	0		DEAEHN
Cc1ccc([S@](=O)CC(=O)Nc2ccccc2CN)cc1	ZINC000155914192	186123013	/nfs/dbraw/zinc/12/30/13/186123013.db2.gz	AQHLMPGOJITCIH-NRFANRHFSA-N	0	3	302.399	2.200	10	0		DEAEHN
COc1ccc(Br)cc1CNC[C@H](C)[S@](C)=O	ZINC000159653401	186132874	/nfs/dbraw/zinc/13/28/74/186132874.db2.gz	JUNMBZMVIRUHGF-HUTHGQBESA-N	0	3	320.252	2.314	10	0		DEAEHN
COCC[C@H](N)C(=O)Nc1c(C)cc(C)cc1Br	ZINC000159673698	186134823	/nfs/dbraw/zinc/13/48/23/186134823.db2.gz	CDEDHLDUEPFKKG-NSHDSACASA-N	0	3	315.211	2.368	10	0		DEAEHN
C[C@H](CNCc1cc(Cl)c2c(c1)OCCCO2)[S@@](C)=O	ZINC000159684411	186135164	/nfs/dbraw/zinc/13/51/64/186135164.db2.gz	WYYNIYOEMFWOHT-SBKAZYGRSA-N	0	3	317.838	2.358	10	0		DEAEHN
Cc1ccc([C@H](N)[C@@H]2CCS(=O)(=O)C2)c(Br)c1	ZINC000164264424	186154118	/nfs/dbraw/zinc/15/41/18/186154118.db2.gz	FGRTUWVHYSDVJD-BXKDBHETSA-N	0	3	318.236	2.192	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NC(=O)N1CCC[C@H](N(C)C)C1	ZINC000173344448	186179050	/nfs/dbraw/zinc/17/90/50/186179050.db2.gz	HPIBMPXOJMCGPG-RDJZCZTQSA-N	0	3	319.449	2.327	10	0		DEAEHN
CN(C)C(=O)C1CCN(CC2=Cc3ccccc3OC2)CC1	ZINC000179685782	186205303	/nfs/dbraw/zinc/20/53/03/186205303.db2.gz	DNXUMMCTTPYGOW-UHFFFAOYSA-N	0	3	300.402	2.263	10	0		DEAEHN
CCn1nccc1CCN1C[C@@H](O)C[C@H]1c1cccc(F)c1	ZINC000253396356	186305216	/nfs/dbraw/zinc/30/52/16/186305216.db2.gz	NWPKKTRWXIBBBQ-IRXDYDNUSA-N	0	3	303.381	2.393	10	0		DEAEHN
Cc1nc2ccc(NC(=O)N3CCN4CCC[C@H]4C3)cc2o1	ZINC000171888281	198002543	/nfs/dbraw/zinc/00/25/43/198002543.db2.gz	FHZXGNRWOVRMEN-ZDUSSCGKSA-N	0	3	300.362	2.448	10	0		DEAEHN
CNCC(=O)N1CCC[C@@H]1c1n[nH]cc1-c1ccccc1F	ZINC000072367531	191136583	/nfs/dbraw/zinc/13/65/83/191136583.db2.gz	HGPYZOOPSFNCNW-CQSZACIVSA-N	0	3	302.353	2.099	10	0		DEAEHN
CN1CC[C@@H](N[C@@H]2CCc3c2cccc3Br)C1=O	ZINC000172087571	198037676	/nfs/dbraw/zinc/03/76/76/198037676.db2.gz	BJJPUHXRDYITGS-CHWSQXEVSA-N	0	3	309.207	2.257	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2ccc3c(c2)OCCCO3)CCN1C	ZINC000172621993	198126617	/nfs/dbraw/zinc/12/66/17/198126617.db2.gz	OIQAAYGFKLSIMB-UKRRQHHQSA-N	0	3	318.417	2.403	10	0		DEAEHN
COc1ccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000173189925	198193948	/nfs/dbraw/zinc/19/39/48/198193948.db2.gz	POTFUWOQRXJPBM-DZGCQCFKSA-N	0	3	305.422	2.319	10	0		DEAEHN
COCCCOc1cccc(C(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000173574505	198229124	/nfs/dbraw/zinc/22/91/24/198229124.db2.gz	WUJDZHCTBAEMTR-MRXNPFEDSA-N	0	3	318.417	2.022	10	0		DEAEHN
CCN(CC)CC(=O)N1C[C@H](C)O[C@@H](c2ccc(F)cc2)C1	ZINC000173523275	198224099	/nfs/dbraw/zinc/22/40/99/198224099.db2.gz	OIOMBGIPIXGXJD-XJKSGUPXSA-N	0	3	308.397	2.456	10	0		DEAEHN
CO[C@@H](CNC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccccc1	ZINC000173701344	198242069	/nfs/dbraw/zinc/24/20/69/198242069.db2.gz	ZTTJCUSCFJKMOS-IRXDYDNUSA-N	0	3	315.417	2.030	10	0		DEAEHN
CC(C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000174018402	198281257	/nfs/dbraw/zinc/28/12/57/198281257.db2.gz	MAEURIOJRYPCJE-QGZVFWFLSA-N	0	3	319.449	2.140	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NC(=O)NCCN1CCCCC1	ZINC000173983703	198276000	/nfs/dbraw/zinc/27/60/00/198276000.db2.gz	HBQDXZNQZYUHLO-INIZCTEOSA-N	0	3	319.449	2.377	10	0		DEAEHN
Cc1cnn(CCN[C@H]2CCCN(c3ccc(C)cc3)C2=O)c1	ZINC000174086580	198289968	/nfs/dbraw/zinc/28/99/68/198289968.db2.gz	RRLJYSUYGWUEAQ-KRWDZBQOSA-N	0	3	312.417	2.285	10	0		DEAEHN
CC[C@H](O)CN1CCN(CCCOCCc2ccccc2)CC1	ZINC000174094722	198291103	/nfs/dbraw/zinc/29/11/03/198291103.db2.gz	QVXKVJISCQSBOP-IBGZPJMESA-N	0	3	320.477	2.024	10	0		DEAEHN
C[C@H](Cc1ccccc1F)NC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000174252956	198310661	/nfs/dbraw/zinc/31/06/61/198310661.db2.gz	YVTUVGBKORIGOL-ZBFHGGJFSA-N	0	3	317.408	2.412	10	0		DEAEHN
NC[C@H](NCCCO)c1cc(Cl)ccc1Br	ZINC000085220879	192482476	/nfs/dbraw/zinc/48/24/76/192482476.db2.gz	GRHRAXVRVGNYOA-NSHDSACASA-N	0	3	307.619	2.074	10	0		DEAEHN
C[C@H](CC(=O)N1CCN2CCC[C@@H]2C1)C(=O)c1cccc(F)c1	ZINC000174663977	198367630	/nfs/dbraw/zinc/36/76/30/198367630.db2.gz	MRQQRRAUCAXLJD-CZUORRHYSA-N	0	3	318.392	2.341	10	0		DEAEHN
O[C@H](CN1CCC[C@H](Cn2cncn2)C1)c1cccc(Cl)c1	ZINC000174788148	198385404	/nfs/dbraw/zinc/38/54/04/198385404.db2.gz	OKPZJCNAAJDYBS-XJKSGUPXSA-N	0	3	320.824	2.377	10	0		DEAEHN
CN(C)C(=O)[C@H]1CCCN1CCC(=O)Nc1cccc(Cl)c1	ZINC000028903181	354104253	/nfs/dbraw/zinc/10/42/53/354104253.db2.gz	FDAPYWMECNSRDY-CQSZACIVSA-N	0	3	323.824	2.221	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCCCC[C@H]1CO	ZINC000379469951	540121588	/nfs/dbraw/zinc/12/15/88/540121588.db2.gz	GQTIRCAUDNQFMZ-KRWDZBQOSA-N	0	3	304.434	2.272	10	0		DEAEHN
O=C(CNC1(c2ccc(Cl)cc2)CCOCC1)NC1CC1	ZINC000107898418	355729617	/nfs/dbraw/zinc/72/96/17/355729617.db2.gz	JNNSMCTVIBXFJQ-UHFFFAOYSA-N	0	3	308.809	2.214	10	0		DEAEHN
COc1ccc(OC)c([C@@H](C)NC(=O)NC[C@@H]2CCCN2C)c1	ZINC000139416180	355876954	/nfs/dbraw/zinc/87/69/54/355876954.db2.gz	OZBYDHYZSYCXGO-OLZOCXBDSA-N	0	3	321.421	2.158	10	0		DEAEHN
O=C(CN[C@H]1CCCC[C@H]1n1cccn1)NC1CCCCC1	ZINC000128166510	355827238	/nfs/dbraw/zinc/82/72/38/355827238.db2.gz	LPYHHBZIZFBWFU-JKSUJKDBSA-N	0	3	304.438	2.405	10	0		DEAEHN
Cc1cc(CNC(=O)N[C@H](CN(C)C)c2ccccc2)on1	ZINC000140238584	355883911	/nfs/dbraw/zinc/88/39/11/355883911.db2.gz	OERQHROBQKLKNW-OAHLLOKOSA-N	0	3	302.378	2.085	10	0		DEAEHN
Cc1noc(C)c1C[C@H](C)NC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000156762682	355953309	/nfs/dbraw/zinc/95/33/09/355953309.db2.gz	UWZXDRYJKDQFKL-WFASDCNBSA-N	0	3	324.469	2.498	10	0		DEAEHN
C[C@H](CN[C@H](C)c1ccc(-n2cccn2)cc1)CS(C)(=O)=O	ZINC000180843989	356063300	/nfs/dbraw/zinc/06/33/00/356063300.db2.gz	NQOCZQJEYULOFD-ZIAGYGMSSA-N	0	3	321.446	2.204	10	0		DEAEHN
CN(C)C[C@](C)(O)CNC(=O)CC1CCC(C(F)(F)F)CC1	ZINC000180751310	356058967	/nfs/dbraw/zinc/05/89/67/356058967.db2.gz	XFLYGFGSSLNTIG-ORHYLEIMSA-N	0	3	324.387	2.174	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1cnn(Cc2ccccc2)c1	ZINC000179420495	356025657	/nfs/dbraw/zinc/02/56/57/356025657.db2.gz	QCOLLIXYVFGQEK-RHSMWYFYSA-N	0	3	312.417	2.017	10	0		DEAEHN
CCN(CC)C(=O)[C@H]1CCCN1C[C@H](O)CCc1ccccc1	ZINC000182272966	356118225	/nfs/dbraw/zinc/11/82/25/356118225.db2.gz	LREGEHHJKJZUGF-QZTJIDSGSA-N	0	3	318.461	2.313	10	0		DEAEHN
CCS(=O)(=O)C[C@H](C)NC[C@H](C)c1ccc(F)cc1F	ZINC000183051829	356157862	/nfs/dbraw/zinc/15/78/62/356157862.db2.gz	UTRHDWZEZFNOGW-QWRGUYRKSA-N	0	3	305.390	2.481	10	0		DEAEHN
C[C@@H](C(=O)N1CCCCCC1)N(CC(N)=S)C1CCCC1	ZINC000080222354	192013441	/nfs/dbraw/zinc/01/34/41/192013441.db2.gz	YADYQHGQMGVOFU-ZDUSSCGKSA-N	0	3	311.495	2.308	10	0		DEAEHN
CCOC(=O)C[C@H](N)c1cc(OC)ccc1Br	ZINC000228763409	356281405	/nfs/dbraw/zinc/28/14/05/356281405.db2.gz	BNSNSRKHJRJHRT-NSHDSACASA-N	0	3	302.168	2.411	10	0		DEAEHN
NCc1ccnc(I)c1OC(F)(F)F	ZINC000238690407	356305127	/nfs/dbraw/zinc/30/51/27/356305127.db2.gz	SNOHCZLIXIXMRY-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
COC[C@H]1CCN([C@@H](CN)c2ccccc2Br)C1	ZINC000081041530	192218389	/nfs/dbraw/zinc/21/83/89/192218389.db2.gz	MQCLEPOLKDISTE-FZMZJTMJSA-N	0	3	313.239	2.417	10	0		DEAEHN
NCc1ccc(I)nc1C(F)(F)F	ZINC000306777347	356405176	/nfs/dbraw/zinc/40/51/76/356405176.db2.gz	NCZYPEKIGCAMPQ-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
NCc1nc(I)ccc1C(F)(F)F	ZINC000306909299	356406529	/nfs/dbraw/zinc/40/65/29/356406529.db2.gz	HEQDBTGYHCEIAE-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
NC[C@@H](c1ccc(Cl)cc1Cl)N1CCn2cnnc2C1	ZINC000081533197	192285037	/nfs/dbraw/zinc/28/50/37/192285037.db2.gz	OYYMHSPWVSDZDO-LBPRGKRZSA-N	0	3	312.204	2.101	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)NCCNc1nc2ccccc2s1	ZINC000236971895	202101394	/nfs/dbraw/zinc/10/13/94/202101394.db2.gz	URDRIGXUHUGQGU-ZWNOBZJWSA-N	0	3	306.435	2.198	10	0		DEAEHN
CC[C@@]1(O)CCOC2(CCN(Cc3cnn(C)c3C)CC2)C1	ZINC000409419916	356736103	/nfs/dbraw/zinc/73/61/03/356736103.db2.gz	PXLUWGWFLBBYIA-MRXNPFEDSA-N	0	3	307.438	2.015	10	0		DEAEHN
CCc1nc(C)c(NC(=O)NCCNc2ccncc2)s1	ZINC000578252577	356787650	/nfs/dbraw/zinc/78/76/50/356787650.db2.gz	NERFAPDOCUIWPL-UHFFFAOYSA-N	0	3	305.407	2.064	10	0		DEAEHN
c1[nH]nc(-c2ccc3c(c2)OCO3)c1CNCC1=CCOCC1	ZINC000578843910	356879315	/nfs/dbraw/zinc/87/93/15/356879315.db2.gz	PBRSHWQIPSNIAG-UHFFFAOYSA-N	0	3	313.357	2.242	10	0		DEAEHN
Cc1cc(C(=O)N2CCCNCC2)sc1Br	ZINC000087017891	192611974	/nfs/dbraw/zinc/61/19/74/192611974.db2.gz	DVYWOONJXBHMIL-UHFFFAOYSA-N	0	3	303.225	2.255	10	0		DEAEHN
CC(=O)N1C[C@@H]2CCC[C@H](N[C@H](C)c3nccnc3C)[C@H]2C1	ZINC000579400821	356968792	/nfs/dbraw/zinc/96/87/92/356968792.db2.gz	ALDFCKCIURPGDH-OEAJRASXSA-N	0	3	302.422	2.083	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1cc(F)cc(OC)c1	ZINC000179474763	199041965	/nfs/dbraw/zinc/04/19/65/199041965.db2.gz	PRECXAIWULSOHL-OAHLLOKOSA-N	0	3	323.412	2.460	10	0		DEAEHN
Cc1cc(F)ccc1-n1ccc(C(=O)NC[C@@H]2CCCN2C)n1	ZINC000180684644	199196120	/nfs/dbraw/zinc/19/61/20/199196120.db2.gz	DSGSIDCZWZPYIY-AWEZNQCLSA-N	0	3	316.380	2.144	10	0		DEAEHN
CCn1cc([C@@H](C)N[C@H]2CCCN(c3cccnn3)C2)cn1	ZINC000180934982	199230139	/nfs/dbraw/zinc/23/01/39/199230139.db2.gz	KSCIFZCHRKYPNC-HIFRSBDPSA-N	0	3	300.410	2.013	10	0		DEAEHN
COCCN(C)CCNC(=O)N[C@@H]1c2cc(C)ccc2C[C@@H]1C	ZINC000181201235	199264599	/nfs/dbraw/zinc/26/45/99/199264599.db2.gz	IVNJDUSLNVCHKM-YOEHRIQHSA-N	0	3	319.449	2.106	10	0		DEAEHN
Cn1cc([C@H]2CCN(Cc3ccc4c(c3)CCC(=O)N4C)C2)cn1	ZINC000187005014	200046487	/nfs/dbraw/zinc/04/64/87/200046487.db2.gz	FMOYBYJMUHWAIX-INIZCTEOSA-N	0	3	324.428	2.319	10	0		DEAEHN
CCN(CCO)CCNC(=O)N[C@@H](C)c1cccc(Cl)c1	ZINC000187080392	200058506	/nfs/dbraw/zinc/05/85/06/200058506.db2.gz	KCPDSFUFUZMCKT-LBPRGKRZSA-N	0	3	313.829	2.014	10	0		DEAEHN
CCOc1cccc2[nH]cc(CC(=O)N3CC[C@H](N(C)C)C3)c21	ZINC000187448488	200113286	/nfs/dbraw/zinc/11/32/86/200113286.db2.gz	YLDDUBVSUXEQML-AWEZNQCLSA-N	0	3	315.417	2.272	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1cc(F)ccc1OC	ZINC000187744254	200152050	/nfs/dbraw/zinc/15/20/50/200152050.db2.gz	FUNSGFBZQVPFNU-OAHLLOKOSA-N	0	3	323.412	2.460	10	0		DEAEHN
C[C@H]1CC[C@](CO)(N(C)CC(=O)N(C)Cc2ccccc2F)C1	ZINC000187944594	200181019	/nfs/dbraw/zinc/18/10/19/200181019.db2.gz	ZHLOKLIWMJAHFJ-KSSFIOAISA-N	0	3	322.424	2.267	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1cc(COC(C)(C)C)on1)N(C)C	ZINC000188572492	200268683	/nfs/dbraw/zinc/26/86/83/200268683.db2.gz	MFAWNJHKVLXRQA-AWEZNQCLSA-N	0	3	311.426	2.336	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1cncc(Cl)n1	ZINC000189196241	200362662	/nfs/dbraw/zinc/36/26/62/200362662.db2.gz	KZFOGGFKBFIOLM-CYBMUJFWSA-N	0	3	318.808	2.033	10	0		DEAEHN
COc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(C3CC3)C2)cc1F	ZINC000604161810	360888025	/nfs/dbraw/zinc/88/80/25/360888025.db2.gz	NFCNOKQFVHKMJL-WCQYABFASA-N	0	3	321.396	2.431	10	0		DEAEHN
Cc1cccnc1C(F)(F)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000192596656	200907002	/nfs/dbraw/zinc/90/70/02/200907002.db2.gz	DTOLSCSBANRCHC-OLZOCXBDSA-N	0	3	311.376	2.423	10	0		DEAEHN
COCCN1CCN(CCCc2ccc3c(c2)CCO3)C[C@@H]1C	ZINC000193248386	201012796	/nfs/dbraw/zinc/01/27/96/201012796.db2.gz	PVORJVYESXGONO-INIZCTEOSA-N	0	3	318.461	2.207	10	0		DEAEHN
CC(C)Cc1ccc(S(=O)(=O)N[C@@H]2CNCC[C@H]2C)cc1	ZINC000193400673	201046717	/nfs/dbraw/zinc/04/67/17/201046717.db2.gz	AMIADQFTSHZNGA-CZUORRHYSA-N	0	3	310.463	2.161	10	0		DEAEHN
COC[C@H](NC[C@@H](C)N1CCOCC1)c1ccc(Cl)cc1	ZINC000193957485	201153127	/nfs/dbraw/zinc/15/31/27/201153127.db2.gz	INGMWVPMQDUHKV-CJNGLKHVSA-N	0	3	312.841	2.338	10	0		DEAEHN
CCn1cc([C@@H](C)N[C@H]2CCCN(c3ncccn3)C2)cn1	ZINC000194983997	201321423	/nfs/dbraw/zinc/32/14/23/201321423.db2.gz	AEKJFPTWCLXBFL-HIFRSBDPSA-N	0	3	300.410	2.013	10	0		DEAEHN
Cc1nn(C)c(C)c1NC(=O)NC[C@@H]1N(C)CCCC1(C)C	ZINC000448005274	239215697	/nfs/dbraw/zinc/21/56/97/239215697.db2.gz	UFSLQAJSCYJWKI-ZDUSSCGKSA-N	0	3	307.442	2.279	10	0		DEAEHN
CCCCOC(=O)CN1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000195296927	201375871	/nfs/dbraw/zinc/37/58/71/201375871.db2.gz	PDBKXJCTVYNMPE-QGZVFWFLSA-N	0	3	319.449	2.179	10	0		DEAEHN
CC(=O)[C@H](C)CCCCC(=O)NC1CCN([C@H]2CCOC2)CC1	ZINC000620012283	363932180	/nfs/dbraw/zinc/93/21/80/363932180.db2.gz	YIZYDMLQVXTBDG-PBHICJAKSA-N	0	3	324.465	2.141	10	0		DEAEHN
O[C@@]1(CNCc2ccsc2Br)CCSC1	ZINC000623438655	365030641	/nfs/dbraw/zinc/03/06/41/365030641.db2.gz	GYECGPNERZVOFX-SNVBAGLBSA-N	0	3	308.266	2.468	10	0		DEAEHN
c1cc(CNC[C@H]2CCN2C2CCCC2)n(-c2ccccn2)n1	ZINC000623728847	365151932	/nfs/dbraw/zinc/15/19/32/365151932.db2.gz	BYBVOTPNYWALAV-MRXNPFEDSA-N	0	3	311.433	2.374	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)N[C@@H]1CCCC[C@H]1C(F)(F)F	ZINC000091135269	193001606	/nfs/dbraw/zinc/00/16/06/193001606.db2.gz	WCDISYWZMPAVQG-GMTAPVOTSA-N	0	3	310.385	2.319	10	0		DEAEHN
C[C@H](Cc1c(F)cccc1F)NC(=O)C[C@@H]1CSCCN1	ZINC000091135445	193002006	/nfs/dbraw/zinc/00/20/06/193002006.db2.gz	RYOALWOWDLPLPI-GHMZBOCLSA-N	0	3	314.401	2.107	10	0		DEAEHN
CC[C@H](C)NCC(=O)Nc1ccc(Br)c(C)n1	ZINC000091507216	193067499	/nfs/dbraw/zinc/06/74/99/193067499.db2.gz	APAWJSUZJMZIIA-QMMMGPOBSA-N	0	3	300.200	2.479	10	0		DEAEHN
CN(C[C@H]1CCN(C)C1)c1nc(Cl)ncc1Br	ZINC000091659108	193085651	/nfs/dbraw/zinc/08/56/51/193085651.db2.gz	BFRKAIQALJKNPT-QMMMGPOBSA-N	0	3	319.634	2.280	10	0		DEAEHN
C[C@@H](NC[C@H]1CN(C)CCO1)c1cccc(OC(F)F)c1	ZINC000091667721	193087739	/nfs/dbraw/zinc/08/77/39/193087739.db2.gz	HCWLWBCBGTVJJH-RISCZKNCSA-N	0	3	300.349	2.269	10	0		DEAEHN
CCc1nc(C)sc1CN1CCC2(CC1)[C@H](O)C[C@@H]2OC	ZINC000091736942	193099405	/nfs/dbraw/zinc/09/94/05/193099405.db2.gz	VHUQCPDPPJNBGA-CABCVRRESA-N	0	3	310.463	2.376	10	0		DEAEHN
COc1cc(F)cc(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000091928387	193127988	/nfs/dbraw/zinc/12/79/88/193127988.db2.gz	FVKFDBPSLPHCHZ-IUODEOHRSA-N	0	3	323.412	2.458	10	0		DEAEHN
CCCNCc1nc(C)ccc1OCCCS(=O)(=O)CC	ZINC000091995222	193138753	/nfs/dbraw/zinc/13/87/53/193138753.db2.gz	DIXSQMXLRDKQJD-UHFFFAOYSA-N	0	3	314.451	2.093	10	0		DEAEHN
C=C/C(C)=C/CC(=O)Nc1ccc(C(=O)NCCN(C)C)cc1	ZINC000628640562	366910982	/nfs/dbraw/zinc/91/09/82/366910982.db2.gz	GHJIXTGLPMRNAD-MKMNVTDBSA-N	0	3	315.417	2.439	10	0		DEAEHN
COCC1(CNCc2c(Br)cnn2C)CCCC1	ZINC000449743541	241020296	/nfs/dbraw/zinc/02/02/96/241020296.db2.gz	YUAUMHPZWRGVEI-UHFFFAOYSA-N	0	3	316.243	2.479	10	0		DEAEHN
C[C@@H](NC(=O)[C@H]1NCCCC1(C)C)c1ccc(NC(N)=O)cc1	ZINC000261940096	296102704	/nfs/dbraw/zinc/10/27/04/296102704.db2.gz	UQRYFRZENVLDJM-BXUZGUMPSA-N	0	3	318.421	2.133	10	0		DEAEHN
CCNCc1ccc(C)c(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)c1	ZINC000092113570	193161804	/nfs/dbraw/zinc/16/18/04/193161804.db2.gz	ZJUKSJXEJSDAHX-ZIAGYGMSSA-N	0	3	310.463	2.381	10	0		DEAEHN
CC1([N-]S(=O)(=O)c2ccc(C[NH3+])cc2F)CCCCC1	ZINC000092116014	193163857	/nfs/dbraw/zinc/16/38/57/193163857.db2.gz	NJCOIZZQZJKJNG-UHFFFAOYSA-N	0	3	300.399	2.286	10	0		DEAEHN
c1c(CNC[C@H]2CCc3ccccc32)nnn1C[C@@H]1CCOC1	ZINC000631069103	368000050	/nfs/dbraw/zinc/00/00/50/368000050.db2.gz	MGIWYHWHOPHMJM-GOEBONIOSA-N	0	3	312.417	2.134	10	0		DEAEHN
c1c(CNCCCCc2ccccc2)nnn1C[C@@H]1CCOC1	ZINC000631036370	367981241	/nfs/dbraw/zinc/98/12/41/367981241.db2.gz	MHSZSHMKJHGFIC-KRWDZBQOSA-N	0	3	314.433	2.427	10	0		DEAEHN
c1cc(CNCCCOC2CCOCC2)n(CC2CCC2)n1	ZINC000631079917	368006508	/nfs/dbraw/zinc/00/65/08/368006508.db2.gz	LUKAQICGLJTOGA-UHFFFAOYSA-N	0	3	307.438	2.359	10	0		DEAEHN
O[C@@H]1CCOC[C@H]1N[C@@H]1CCc2sc(Br)cc21	ZINC000631750785	368369474	/nfs/dbraw/zinc/36/94/74/368369474.db2.gz	MIQBJLUPXBUZBP-OPRDCNLKSA-N	0	3	318.236	2.237	10	0		DEAEHN
c1ccc(-n2nnnc2CCN2CCSC[C@H]2C2CC2)cc1	ZINC000451645296	243262108	/nfs/dbraw/zinc/26/21/08/243262108.db2.gz	CJVHHITYGLRPTQ-HNNXBMFYSA-N	0	3	315.446	2.032	10	0		DEAEHN
COCCNCc1ccnn1C[C@@H]1Cc2ccccc2S1	ZINC000092271935	193183963	/nfs/dbraw/zinc/18/39/63/193183963.db2.gz	STVZRMWDHUOTMC-HNNXBMFYSA-N	0	3	303.431	2.336	10	0		DEAEHN
COc1ccc(CN2CCCC[C@@H]2CN2CCOCC2)cc1O	ZINC000093011530	193193993	/nfs/dbraw/zinc/19/39/93/193193993.db2.gz	IZXZPDGCONEJES-MRXNPFEDSA-N	0	3	320.433	2.088	10	0		DEAEHN
CN1CCC2(CC1)CC(=O)NC(=O)[C@@H]2c1ccc(Cl)cc1	ZINC000093161614	193209999	/nfs/dbraw/zinc/20/99/99/193209999.db2.gz	IOLDMYPQZAKVTE-AWEZNQCLSA-N	0	3	306.793	2.182	10	0		DEAEHN
CN1CCC2(CC1)CC(=O)NC(=O)[C@@H]2c1ccccc1Cl	ZINC000093183611	193212376	/nfs/dbraw/zinc/21/23/76/193212376.db2.gz	RREGWNBIBWLFHS-AWEZNQCLSA-N	0	3	306.793	2.182	10	0		DEAEHN
COC[C@@H]1CCCN(Cc2cc(OC)c3c(c2)OCCO3)C1	ZINC000093337583	193234366	/nfs/dbraw/zinc/23/43/66/193234366.db2.gz	RCFGVHAAEJKSIU-CYBMUJFWSA-N	0	3	307.390	2.325	10	0		DEAEHN
CS(=O)(=O)c1cccc(Oc2cccc(F)c2C(=N)N)c1	ZINC000093409129	193245314	/nfs/dbraw/zinc/24/53/14/193245314.db2.gz	KEDBHWYRYVEISO-UHFFFAOYSA-N	0	3	308.334	2.306	10	0		DEAEHN
CCN[C@]1(C(=O)OC)CCC[C@H](N(C)CCC(F)(F)F)C1	ZINC000093756621	193302125	/nfs/dbraw/zinc/30/21/25/193302125.db2.gz	CTWYVPBSOZPPBL-WCQYABFASA-N	0	3	310.360	2.335	10	0		DEAEHN
CC(C)(N)c1cn(Cc2cc(F)cc(Br)c2)nn1	ZINC000094002042	193337973	/nfs/dbraw/zinc/33/79/73/193337973.db2.gz	CQJQSCZPZZEOEA-UHFFFAOYSA-N	0	3	313.174	2.422	10	0		DEAEHN
CC(C)(C)c1csc(C[C@H](N)[C@H]2CN3CCC[C@@H]3CO2)n1	ZINC000094256928	193355313	/nfs/dbraw/zinc/35/53/13/193355313.db2.gz	SFEZDEXUHQRZQA-FRRDWIJNSA-N	0	3	309.479	2.174	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccccc1Cl)N(C)CCS(C)(=O)=O	ZINC000094297396	193356690	/nfs/dbraw/zinc/35/66/90/193356690.db2.gz	VOILHYLVCXBHMJ-KGLIPLIRSA-N	0	3	318.870	2.095	10	0		DEAEHN
CC(C)NCc1cc(F)c(OCC(=O)NC(C)C)c(F)c1	ZINC000094347438	193363326	/nfs/dbraw/zinc/36/33/26/193363326.db2.gz	FYQXNPJMFSFLBF-UHFFFAOYSA-N	0	3	300.349	2.366	10	0		DEAEHN
CNCc1cc(F)c(O[C@H](C)C(=O)NCC(C)C)c(F)c1	ZINC000094346562	193363723	/nfs/dbraw/zinc/36/37/23/193363723.db2.gz	LKADBIKETWGPDZ-SNVBAGLBSA-N	0	3	300.349	2.224	10	0		DEAEHN
Cc1ccccc1CCNC(=O)c1c[nH]c(=NN)c(Cl)c1	ZINC000094186762	193347637	/nfs/dbraw/zinc/34/76/37/193347637.db2.gz	QHNPIDRWTDHQQB-UHFFFAOYSA-N	0	3	304.781	2.302	10	0		DEAEHN
CCC(N)(CC)C(=O)N(C[C@@H]1CCCO1)[C@H]1CCSC1	ZINC000094244632	193354597	/nfs/dbraw/zinc/35/45/97/193354597.db2.gz	JYBWZTCGJBHGPZ-STQMWFEESA-N	0	3	300.468	2.017	10	0		DEAEHN
CN[C@H]1CCCc2sc(N3CCN4CCCC[C@@H]4C3)nc21	ZINC000094444125	193369809	/nfs/dbraw/zinc/36/98/09/193369809.db2.gz	CNVJAGCOBRBETR-OLZOCXBDSA-N	0	3	306.479	2.414	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1c1nc(Br)cn2ccnc12	ZINC000094490621	193373352	/nfs/dbraw/zinc/37/33/52/193373352.db2.gz	KYBHDDOQYLNAAM-JTQLQIEISA-N	0	3	324.226	2.022	10	0		DEAEHN
Nc1c(C(=O)NCCN2CCCC2)cccc1C(F)(F)F	ZINC000094599012	193382979	/nfs/dbraw/zinc/38/29/79/193382979.db2.gz	WHMQOTGIINNYKI-UHFFFAOYSA-N	0	3	301.312	2.113	10	0		DEAEHN
COc1ccc(Cc2nc3sc(C)cc3c(NN)n2)cn1	ZINC000094633589	193385339	/nfs/dbraw/zinc/38/53/39/193385339.db2.gz	YLGFEYYOBVKCPA-UHFFFAOYSA-N	0	3	301.375	2.280	10	0		DEAEHN
CCN[C@@H](C)c1cc(F)c(C)cc1N1CCS(=O)(=O)CC1	ZINC000094765782	193396618	/nfs/dbraw/zinc/39/66/18/193396618.db2.gz	VTUPJONLUZMTRQ-LBPRGKRZSA-N	0	3	314.426	2.039	10	0		DEAEHN
CCC1(CC)CCN(S(=O)(=O)c2ccc(F)c(CN)c2)C1	ZINC000094801011	193398954	/nfs/dbraw/zinc/39/89/54/193398954.db2.gz	KFIXMDHOWUFOPM-UHFFFAOYSA-N	0	3	314.426	2.485	10	0		DEAEHN
Cc1c(F)cc(CN)cc1S(=O)(=O)N1CCC(C)(C)C1	ZINC000094814885	193399880	/nfs/dbraw/zinc/39/98/80/193399880.db2.gz	QZIDVIULPKEHCA-UHFFFAOYSA-N	0	3	300.399	2.013	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@H]1NCc1ccc(Br)s1	ZINC000282449641	217003030	/nfs/dbraw/zinc/00/30/30/217003030.db2.gz	SJBURQKYJKTCJD-IONNQARKSA-N	0	3	303.225	2.267	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@H]1NCc1cc(Br)ccc1F	ZINC000282457146	217010417	/nfs/dbraw/zinc/01/04/17/217010417.db2.gz	STWUUPZVRRSFQH-QPUJVOFHSA-N	0	3	315.186	2.345	10	0		DEAEHN
O=C(Nc1cccc(-n2cccn2)c1)N1CCN2CCC[C@@H]2C1	ZINC000264744458	204123071	/nfs/dbraw/zinc/12/30/71/204123071.db2.gz	PZTVNPJXNYIDAU-MRXNPFEDSA-N	0	3	311.389	2.184	10	0		DEAEHN
COC(=O)[C@H](N[C@@H](CN1CCCC1)c1ccccc1)C1CC1	ZINC000358810512	284287329	/nfs/dbraw/zinc/28/73/29/284287329.db2.gz	FZVCWNRIDFRULD-DLBZAZTESA-N	0	3	302.418	2.365	10	0		DEAEHN
Cc1nn(C)c(C)c1CNC[C@@H](C)N(C)C(=O)OC(C)(C)C	ZINC000282629467	217136406	/nfs/dbraw/zinc/13/64/06/217136406.db2.gz	GEGUEDXDYYERBJ-LLVKDONJSA-N	0	3	310.442	2.382	10	0		DEAEHN
C[C@H]1CN([C@@H](CN)c2ccccc2OC(F)(F)F)CCO1	ZINC000019230433	182109259	/nfs/dbraw/zinc/10/92/59/182109259.db2.gz	DAUMYULOVILZIK-JQWIXIFHSA-N	0	3	304.312	2.306	10	0		DEAEHN
CCCSC[C@H](N)c1c(Br)cnn1CCOC	ZINC000160061219	197382662	/nfs/dbraw/zinc/38/26/62/197382662.db2.gz	YATHUIXNJHEAOH-JTQLQIEISA-N	0	3	322.272	2.435	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1ccc(NC(=O)C2CC2)cc1	ZINC000267452358	206078677	/nfs/dbraw/zinc/07/86/77/206078677.db2.gz	FQCNBHORNPELGU-MRXNPFEDSA-N	0	3	315.417	2.201	10	0		DEAEHN
CNCc1nc2cc(Cl)ccc2n1CCCN1CCOCC1	ZINC000040406187	183062107	/nfs/dbraw/zinc/06/21/07/183062107.db2.gz	JRAKSJXXEDWOJO-UHFFFAOYSA-N	0	3	322.840	2.131	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2cc(Cl)cc3cccnc32)C1	ZINC000040632683	183111388	/nfs/dbraw/zinc/11/13/88/183111388.db2.gz	WLPWKEAWFCZMEH-YPMHNXCESA-N	0	3	305.765	2.204	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2cc(Cl)cc3cccnc32)C1	ZINC000040632684	183111417	/nfs/dbraw/zinc/11/14/17/183111417.db2.gz	WLPWKEAWFCZMEH-AAEUAGOBSA-N	0	3	305.765	2.204	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2ccc(OC(C)C)c(Cl)c2)C1	ZINC000040633565	183111495	/nfs/dbraw/zinc/11/14/95/183111495.db2.gz	WWQJLHJJCVTDRK-DGCLKSJQSA-N	0	3	312.797	2.443	10	0		DEAEHN
CN1CCC(OC(=O)c2ccc(Br)c(N)c2)CC1	ZINC000041086565	183164214	/nfs/dbraw/zinc/16/42/14/183164214.db2.gz	BBAGCVMVDQBFIV-UHFFFAOYSA-N	0	3	313.195	2.282	10	0		DEAEHN
Cc1cc(NCCN2CCN(C)CC2)ccc1Br	ZINC000041563169	183203091	/nfs/dbraw/zinc/20/30/91/183203091.db2.gz	CATUKUBIOVXCTE-UHFFFAOYSA-N	0	3	312.255	2.417	10	0		DEAEHN
O=S1(=O)CC[C@H](Nc2c3c(nc4ccccc42)CCC3)C1	ZINC000041473011	183193278	/nfs/dbraw/zinc/19/32/78/183193278.db2.gz	AMAIFCSVKHHGRZ-NSHDSACASA-N	0	3	302.399	2.323	10	0		DEAEHN
CCN(CC)C(=O)COc1c(Br)cccc1CN	ZINC000042411356	183264982	/nfs/dbraw/zinc/26/49/82/183264982.db2.gz	CNKRFTJIYJKKDR-UHFFFAOYSA-N	0	3	315.211	2.155	10	0		DEAEHN
COC[C@@H](C)N(C)[C@@H](CN)c1cccc(Br)c1	ZINC000042517780	183279420	/nfs/dbraw/zinc/27/94/20/183279420.db2.gz	FOHWYGVBRPFPAF-MFKMUULPSA-N	0	3	301.228	2.416	10	0		DEAEHN
CCN(CCC(=O)Nc1cccc(CN)c1)CC(F)(F)F	ZINC000042739583	183304016	/nfs/dbraw/zinc/30/40/16/183304016.db2.gz	NJHDHIUTJDNDKI-UHFFFAOYSA-N	0	3	303.328	2.358	10	0		DEAEHN
COc1cccc([C@H](CN)N(C)Cc2cscn2)c1OC	ZINC000042863796	183315321	/nfs/dbraw/zinc/31/53/21/183315321.db2.gz	RFTHMLMSJIDHJC-ZDUSSCGKSA-N	0	3	307.419	2.292	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccc(Cl)s1)N(C)CC(=O)NC1CC1	ZINC000043252659	183346478	/nfs/dbraw/zinc/34/64/78/183346478.db2.gz	DTTMHWWENHWEGM-OQPBUACISA-N	0	3	301.843	2.000	10	0		DEAEHN
CCC(C)(C)NC(=O)[C@H](C)N(CCC(N)=S)CC(C)C	ZINC000043418474	183360789	/nfs/dbraw/zinc/36/07/89/183360789.db2.gz	NVOIFZSLOHSBQK-LBPRGKRZSA-N	0	3	301.500	2.314	10	0		DEAEHN
N[C@H]1C[C@H]1NC(=O)c1cc(C(F)(F)F)ccc1Br	ZINC000159797757	197365204	/nfs/dbraw/zinc/36/52/04/197365204.db2.gz	QXVOUSCJPBAULR-DTWKUNHWSA-N	0	3	323.112	2.297	10	0		DEAEHN
CC(C)c1cc(C(=O)NC[C@H]2CCN(C)C2)nn1C(C)(C)C	ZINC000105566240	194110144	/nfs/dbraw/zinc/11/01/44/194110144.db2.gz	RFNNYCOGIYZBFG-CYBMUJFWSA-N	0	3	306.454	2.443	10	0		DEAEHN
CCCCCNC(=O)[C@H](C)N[C@H]1CCc2nc(C(C)C)nn2C1	ZINC000105874078	194153720	/nfs/dbraw/zinc/15/37/20/194153720.db2.gz	HSMDZXWWQVRMAQ-KBPBESRZSA-N	0	3	321.469	2.001	10	0		DEAEHN
CCNCCS(=O)(=O)Nc1ccc(F)c(C(F)(F)F)c1	ZINC000049644356	183751273	/nfs/dbraw/zinc/75/12/73/183751273.db2.gz	JEXHKAHYJAKXNI-UHFFFAOYSA-N	0	3	314.304	2.196	10	0		DEAEHN
COCCCNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[C@H](C)N	ZINC000050209220	183777711	/nfs/dbraw/zinc/77/77/11/183777711.db2.gz	JSRDSIVIOFOMIT-WDEREUQCSA-N	0	3	314.813	2.280	10	0		DEAEHN
CCC[C@@H](C(N)=S)N1CCN(c2nc(CC)cs2)CC1	ZINC000109471762	194267575	/nfs/dbraw/zinc/26/75/75/194267575.db2.gz	BITIPHUBHCDDQI-LBPRGKRZSA-N	0	3	312.508	2.282	10	0		DEAEHN
CCOC(=O)COc1ccc(Br)cc1[C@@H](C)N	ZINC000052066586	183849152	/nfs/dbraw/zinc/84/91/52/183849152.db2.gz	KCBRKKDKSHIQBM-MRVPVSSYSA-N	0	3	302.168	2.411	10	0		DEAEHN
CCCN([C@H]1CCCNC1)S(=O)(=O)c1ccc(C)c(F)c1	ZINC000110942461	194372282	/nfs/dbraw/zinc/37/22/82/194372282.db2.gz	ZKEGMAPEYNDLPK-ZDUSSCGKSA-N	0	3	314.426	2.287	10	0		DEAEHN
CCCn1cc(Br)cc1C(=O)N(C)CCN(C)C	ZINC000111139130	194394672	/nfs/dbraw/zinc/39/46/72/194394672.db2.gz	VSNHWZHFNDEPGS-UHFFFAOYSA-N	0	3	316.243	2.294	10	0		DEAEHN
CN1CCC(NC(=O)NC[C@H]2CCN(C)c3ccccc32)CC1	ZINC000057336327	184033735	/nfs/dbraw/zinc/03/37/35/184033735.db2.gz	GRTVJHCJZWQKGF-CQSZACIVSA-N	0	3	316.449	2.004	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccc(C(F)(F)F)[nH]c2=O)C1	ZINC000060416571	184149250	/nfs/dbraw/zinc/14/92/50/184149250.db2.gz	UYXSNONHVCCPLV-VIFPVBQESA-N	0	3	317.311	2.020	10	0		DEAEHN
CCNC(C)(C)C(=O)Nc1ccc(OCC(F)(F)F)nc1	ZINC000061290612	184167833	/nfs/dbraw/zinc/16/78/33/184167833.db2.gz	FSTNIQGKXNTQMP-UHFFFAOYSA-N	0	3	305.300	2.349	10	0		DEAEHN
COCCN(C)CCNc1ccc(N)cc1Br	ZINC000061377998	184169502	/nfs/dbraw/zinc/16/95/02/184169502.db2.gz	BKTMLFDZKVHBRB-UHFFFAOYSA-N	0	3	302.216	2.021	10	0		DEAEHN
CC(C)(CC(N)=O)C[C@@H](N)c1cc2c(cc1Cl)OCCO2	ZINC000061825433	184188938	/nfs/dbraw/zinc/18/89/38/184188938.db2.gz	VDDKLNGKTPKHIQ-LLVKDONJSA-N	0	3	312.797	2.403	10	0		DEAEHN
NCc1ccccc1CNS(=O)(=O)c1ccccc1Cl	ZINC000061841266	184189279	/nfs/dbraw/zinc/18/92/79/184189279.db2.gz	BIGINVNAZXLLJV-UHFFFAOYSA-N	0	3	310.806	2.277	10	0		DEAEHN
C[C@@H](CCNS(=O)(=O)C[C@H]1CCCCN1)c1ccccc1	ZINC000061911528	184195003	/nfs/dbraw/zinc/19/50/03/184195003.db2.gz	IIQZNNVKIAPSQF-GOEBONIOSA-N	0	3	310.463	2.242	10	0		DEAEHN
NC[C@H](c1ccc(Br)cc1)N1CCn2ccnc2C1	ZINC000062246181	184225223	/nfs/dbraw/zinc/22/52/23/184225223.db2.gz	SSRVZYUCKXUIMC-CYBMUJFWSA-N	0	3	321.222	2.161	10	0		DEAEHN
CCCN[C@H](C)c1ccc(F)cc1O[C@@H]1CCS(=O)(=O)C1	ZINC000062747183	184251884	/nfs/dbraw/zinc/25/18/84/184251884.db2.gz	RNGIEUGCSZOANU-DGCLKSJQSA-N	0	3	315.410	2.452	10	0		DEAEHN
N[C@H](CNC(=O)c1cncc(Br)c1)c1ccccc1	ZINC000062837963	184255769	/nfs/dbraw/zinc/25/57/69/184255769.db2.gz	FLXAVEFJDMUDRA-CYBMUJFWSA-N	0	3	320.190	2.274	10	0		DEAEHN
CCN[C@H](CCSc1cccc(Br)c1)C(N)=O	ZINC000062604196	184244917	/nfs/dbraw/zinc/24/49/17/184244917.db2.gz	MEPTUTAGMYLBGB-LLVKDONJSA-N	0	3	317.252	2.395	10	0		DEAEHN
CCN[C@@H](CCSc1ccc(C(F)(F)F)cn1)C(N)=O	ZINC000062599036	184244951	/nfs/dbraw/zinc/24/49/51/184244951.db2.gz	ACKKDKFGUWLZHM-VIFPVBQESA-N	0	3	307.341	2.046	10	0		DEAEHN
[NH3+][C@H]1CCCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)s1	ZINC000063213901	184279082	/nfs/dbraw/zinc/27/90/82/184279082.db2.gz	MPWRYTIUHHGSFF-IUCAKERBSA-N	0	3	308.856	2.340	10	0		DEAEHN
COc1cccc(CNC(C)C)c1OCCCS(C)(=O)=O	ZINC000063014387	184266330	/nfs/dbraw/zinc/26/63/30/184266330.db2.gz	DRYNVDXTUBKDSN-UHFFFAOYSA-N	0	3	315.435	2.007	10	0		DEAEHN
CC[C@@H](N)c1cccc(S(=O)(=O)NCCC(F)(F)F)c1	ZINC000063101548	184271114	/nfs/dbraw/zinc/27/11/14/184271114.db2.gz	HPKPRNGQNIBBON-LLVKDONJSA-N	0	3	310.341	2.327	10	0		DEAEHN
CNc1ncc(C(=O)N(C)CC2CCN(C)CC2)cc1Cl	ZINC000063125778	184271502	/nfs/dbraw/zinc/27/15/02/184271502.db2.gz	LMFCUGHLFSPWQY-UHFFFAOYSA-N	0	3	310.829	2.191	10	0		DEAEHN
Cn1cc(Br)cc1C(=O)Nc1cccc(CN)c1	ZINC000063190937	184277237	/nfs/dbraw/zinc/27/72/37/184277237.db2.gz	KWFDYVQRPFVGIW-UHFFFAOYSA-N	0	3	308.179	2.499	10	0		DEAEHN
CC[C@H](NC[C@@H]1Cc2ccccc2O1)C(=O)Nc1cc(C)on1	ZINC000065401540	184336912	/nfs/dbraw/zinc/33/69/12/184336912.db2.gz	GMBWRPRDYKEZLV-KBPBESRZSA-N	0	3	315.373	2.293	10	0		DEAEHN
CC[C@@H](C)NCC(=O)Nc1ccc(C(=O)N(CC)CC)cc1	ZINC000066068132	184386369	/nfs/dbraw/zinc/38/63/69/184386369.db2.gz	KDIIIBMGQAVJRH-CYBMUJFWSA-N	0	3	305.422	2.495	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)Nc3ccncc3)cc2)CC1	ZINC000114162391	194636496	/nfs/dbraw/zinc/63/64/96/194636496.db2.gz	CJAVZHXIRYKUCY-UHFFFAOYSA-N	0	3	310.401	2.476	10	0		DEAEHN
CCC1(CNC(=O)NC[C@@H](O)CN2CCCCC2)CCCC1	ZINC000119906299	195059039	/nfs/dbraw/zinc/05/90/39/195059039.db2.gz	HXLPVBHQKKPXCW-OAHLLOKOSA-N	0	3	311.470	2.103	10	0		DEAEHN
CCOc1ccc(NC(=O)[C@@H](N)CCCOC)cc1Cl	ZINC000159266350	197341497	/nfs/dbraw/zinc/34/14/97/197341497.db2.gz	GCBXDQKYTCWMSS-LBPRGKRZSA-N	0	3	300.786	2.431	10	0		DEAEHN
CC[C@H]1CN[C@@H](c2ccccc2)CN1C1CCS(=O)CC1	ZINC000159195684	197335004	/nfs/dbraw/zinc/33/50/04/197335004.db2.gz	RWFRRTJKZAFQBW-DILDSAGESA-N	0	3	306.475	2.323	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC2(C)CCCC2)cc(CN)c1F	ZINC000159122563	197329740	/nfs/dbraw/zinc/32/97/40/197329740.db2.gz	WNCNPPAOTHJEFO-UHFFFAOYSA-N	0	3	300.399	2.204	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCCCCC2)cc(CN)c1F	ZINC000159052464	197322950	/nfs/dbraw/zinc/32/29/50/197322950.db2.gz	WCYXVJKMOQNBQQ-UHFFFAOYSA-N	0	3	300.399	2.158	10	0		DEAEHN
Cc1cc(CN)cnc1Sc1ccc(S(C)(=O)=O)cc1	ZINC000158927639	197312379	/nfs/dbraw/zinc/31/23/79/197312379.db2.gz	XGUGXYQIWCABAC-UHFFFAOYSA-N	0	3	308.428	2.403	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)s1	ZINC000158745298	197298221	/nfs/dbraw/zinc/29/82/21/197298221.db2.gz	QLJMWCIXFZOIIO-RYUDHWBXSA-N	0	3	314.476	2.278	10	0		DEAEHN
CNc1nc(NC[C@H]2CCCCS2)nc(N2CCCC2)n1	ZINC000157660885	197206221	/nfs/dbraw/zinc/20/62/21/197206221.db2.gz	RLZMFXZBJASCQR-LLVKDONJSA-N	0	3	308.455	2.211	10	0		DEAEHN
Cc1nn(C)c(C)c1CN1CCC(C(=O)N[C@H](C)C(C)C)CC1	ZINC000157612136	197201720	/nfs/dbraw/zinc/20/17/20/197201720.db2.gz	WQLYHCWCYQBRGR-CYBMUJFWSA-N	0	3	320.481	2.410	10	0		DEAEHN
Cc1cc(Br)cn(CCNCc2ccoc2)c1=O	ZINC000156978142	197153604	/nfs/dbraw/zinc/15/36/04/197153604.db2.gz	XFBPJMMDOKAHLN-UHFFFAOYSA-N	0	3	311.179	2.302	10	0		DEAEHN
CC(C)(C)OC[C@H](O)CN1CCC[C@@H]1C[C@H](O)c1ccco1	ZINC000156910024	197149292	/nfs/dbraw/zinc/14/92/92/197149292.db2.gz	DGFAWDMQHLCCNJ-KFWWJZLASA-N	0	3	311.422	2.344	10	0		DEAEHN
COCCN[C@]1(c2nc3c(s2)CCC3)CCN(C)[C@@H](C)C1	ZINC000156689128	197134235	/nfs/dbraw/zinc/13/42/35/197134235.db2.gz	QAVILSAGNKVFII-BLLLJJGKSA-N	0	3	309.479	2.177	10	0		DEAEHN
C[C@](O)(Cc1ccc(C(F)(F)F)cc1)C[C@H]1COCCN1	ZINC000156779979	197140582	/nfs/dbraw/zinc/14/05/82/197140582.db2.gz	ZUEVQSJMCLKBJH-KBPBESRZSA-N	0	3	303.324	2.377	10	0		DEAEHN
O=C1[C@@H](N[C@H]2CCC23CCOCC3)CCN1c1ccccc1	ZINC000558622326	291896515	/nfs/dbraw/zinc/89/65/15/291896515.db2.gz	XJBHCQJUNHVIOI-HOTGVXAUSA-N	0	3	300.402	2.341	10	0		DEAEHN
O=C1[C@H](N[C@@H]2CCC23CCOCC3)CCN1c1ccccc1	ZINC000558622327	291896529	/nfs/dbraw/zinc/89/65/29/291896529.db2.gz	XJBHCQJUNHVIOI-HZPDHXFCSA-N	0	3	300.402	2.341	10	0		DEAEHN
CCc1nn(C)c(C[C@H](N)c2ccnc(C)n2)c1Br	ZINC000156519823	197120354	/nfs/dbraw/zinc/12/03/54/197120354.db2.gz	RDPSRJUWDTYPAF-VIFPVBQESA-N	0	3	324.226	2.086	10	0		DEAEHN
O=C1C[C@H](NC[C@@H]2CCCCS2)C(=O)N1c1ccccc1	ZINC000156412619	197111169	/nfs/dbraw/zinc/11/11/69/197111169.db2.gz	JJAFUSXANNMFAB-KBPBESRZSA-N	0	3	304.415	2.194	10	0		DEAEHN
C[C@H](C(=O)Nc1ccccc1CN)[S@](=O)c1cccs1	ZINC000155971190	197078304	/nfs/dbraw/zinc/07/83/04/197078304.db2.gz	WWWZUHBMIRATLO-CFMSYZGJSA-N	0	3	308.428	2.342	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC[C@H]1c1c(C)nn(C)c1C)N(C)C	ZINC000155631812	197074063	/nfs/dbraw/zinc/07/40/63/197074063.db2.gz	MVKGTKKKGHSFCX-GJZGRUSLSA-N	0	3	306.454	2.431	10	0		DEAEHN
CC[C@@H]1CN(Cc2cc(OC)cc(OC)c2)CCN1CCOC	ZINC000120938497	195267634	/nfs/dbraw/zinc/26/76/34/195267634.db2.gz	AOSRUAQZXXEEKJ-MRXNPFEDSA-N	0	3	322.449	2.246	10	0		DEAEHN
COCCN1CCO[C@@H]2CCN(Cc3cccc(F)c3C)C[C@H]21	ZINC000253598307	257105410	/nfs/dbraw/zinc/10/54/10/257105410.db2.gz	HLFTXMIOZSFDQA-QZTJIDSGSA-N	0	3	322.424	2.056	10	0		DEAEHN
CCOCCN1CCN(Cc2ccc(OC)c(O)c2)C[C@H]1CC	ZINC000120995644	195277284	/nfs/dbraw/zinc/27/72/84/195277284.db2.gz	OFJLMGXIEXNCIC-MRXNPFEDSA-N	0	3	322.449	2.334	10	0		DEAEHN
CC1(C)Cc2cc(CN3CC[C@@H](N4CCOCC4)C3)ccc2O1	ZINC000121002978	195278512	/nfs/dbraw/zinc/27/85/12/195278512.db2.gz	LKKGJQSVYUBYJI-QGZVFWFLSA-N	0	3	316.445	2.307	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCN(C2CCCC2)CC1	ZINC000121628915	195319980	/nfs/dbraw/zinc/31/99/80/195319980.db2.gz	ZNTBTEGBEREYJP-MRXNPFEDSA-N	0	3	324.513	2.233	10	0		DEAEHN
C[C@@H](NC(=O)c1cccc2ncnn21)[C@@H](c1ccccc1)N(C)C	ZINC000545317734	285422372	/nfs/dbraw/zinc/42/23/72/285422372.db2.gz	UZZCRAATBLICTP-DYVFJYSZSA-N	0	3	323.400	2.151	10	0		DEAEHN
C[C@@H](NCCc1cn(C)cn1)c1ccc(Br)cn1	ZINC000562738390	292007518	/nfs/dbraw/zinc/00/75/18/292007518.db2.gz	VVSUYDGPWZQYLI-SNVBAGLBSA-N	0	3	309.211	2.471	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)NCc1ccc2cc[nH]c2n1	ZINC000357985116	133113509	/nfs/dbraw/zinc/11/35/09/133113509.db2.gz	JDGALORGAJRBMS-ZDUSSCGKSA-N	0	3	315.421	2.237	10	0		DEAEHN
CC1=CCN(CCNCc2ccccc2N2CCOCC2)CC1	ZINC000358165240	133125378	/nfs/dbraw/zinc/12/53/78/133125378.db2.gz	LAZBHQQXFPRNQC-UHFFFAOYSA-N	0	3	315.461	2.265	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@H](CC(C)C)C(=O)OC(C)C	ZINC000358268244	133132000	/nfs/dbraw/zinc/13/20/00/133132000.db2.gz	XHRGRHYUJROJDP-HUUCEWRRSA-N	0	3	312.454	2.343	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NC[C@H](C)Oc1ccc(OC)cc1	ZINC000361937741	133200391	/nfs/dbraw/zinc/20/03/91/133200391.db2.gz	IVKRFMCUGHPQRP-WMLDXEAASA-N	0	3	320.433	2.453	10	0		DEAEHN
Cc1ccccc1-n1cc(CN2CCC[C@H](c3nc[nH]n3)C2)nn1	ZINC000377623712	133337943	/nfs/dbraw/zinc/33/79/43/133337943.db2.gz	KEBQUVRPSKQAIK-AWEZNQCLSA-N	0	3	323.404	2.073	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)C2(C)COC2)[C@H]1c1cccs1	ZINC000372932057	133371101	/nfs/dbraw/zinc/37/11/01/133371101.db2.gz	VVFQZPZGTMWRFL-JSGCOSHPSA-N	0	3	308.447	2.284	10	0		DEAEHN
CC(C)c1ccccc1NC(=O)CN1CCO[C@H](CN(C)C)C1	ZINC000105927257	144625093	/nfs/dbraw/zinc/62/50/93/144625093.db2.gz	FKZCFNVTQMFUGJ-OAHLLOKOSA-N	0	3	319.449	2.011	10	0		DEAEHN
C[C@@H]1CCC[C@@H]1C(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000344986525	404484864	/nfs/dbraw/zinc/48/48/64/404484864.db2.gz	DFNRXBFXIOPFSI-HHXXYDBFSA-N	0	3	316.445	2.176	10	0		DEAEHN
O=C(NCCc1ccc(Cl)cc1Cl)[C@H]1C[C@H](F)CN1	ZINC000188199181	145008221	/nfs/dbraw/zinc/00/82/21/145008221.db2.gz	AIISUQQEFUEGPP-CMPLNLGQSA-N	0	3	305.180	2.352	10	0		DEAEHN
O=S(=O)(/C=C/c1ccccc1)NCc1ccc2c(c1)CNC2	ZINC000189212647	145023849	/nfs/dbraw/zinc/02/38/49/145023849.db2.gz	XNVCLXVGAIYZJB-CMDGGOBGSA-N	0	3	314.410	2.380	10	0		DEAEHN
Cc1ccc(N2CCCN(C[C@H](O)CC3CCCC3)CC2)nn1	ZINC000191333772	145056527	/nfs/dbraw/zinc/05/65/27/145056527.db2.gz	LMXWBBIPIPJJOM-QGZVFWFLSA-N	0	3	318.465	2.238	10	0		DEAEHN
Cn1c2ccc(CN3CC[C@]4(CCOC4)C3)cc2sc1=O	ZINC000192626246	145076584	/nfs/dbraw/zinc/07/65/84/145076584.db2.gz	QJPNJWPVSZKAJL-INIZCTEOSA-N	0	3	304.415	2.212	10	0		DEAEHN
CCOC(=O)[C@H](C)[C@@H](C)NCc1ccc2c(c1)sc(=O)n2C	ZINC000192720537	145077639	/nfs/dbraw/zinc/07/76/39/145077639.db2.gz	AMKFGMAYSHIAAF-GHMZBOCLSA-N	0	3	322.430	2.277	10	0		DEAEHN
C[C@H](C(=O)Nc1ccc(Cl)cc1)N1CCN2CCC[C@H]2C1	ZINC000246389871	145101808	/nfs/dbraw/zinc/10/18/08/145101808.db2.gz	PGBCQMKWMZUGGJ-DOMZBBRYSA-N	0	3	307.825	2.447	10	0		DEAEHN
CCOCCN1CCN(Cc2cccc(COC)c2)C[C@H]1C	ZINC000246439681	145102600	/nfs/dbraw/zinc/10/26/00/145102600.db2.gz	DDMAQUTVACFFSG-MRXNPFEDSA-N	0	3	306.450	2.376	10	0		DEAEHN
Cc1ccc([C@H](O)CN2CCC[C@@H](Cn3cncn3)C2)cc1	ZINC000246633824	145109016	/nfs/dbraw/zinc/10/90/16/145109016.db2.gz	BGRIBPCMCBHGDC-NVXWUHKLSA-N	0	3	300.406	2.032	10	0		DEAEHN
C[C@H]1c2ccccc2O[C@@H]1C(=O)NCCN1CCC[C@@H](C)C1	ZINC000246640736	145109112	/nfs/dbraw/zinc/10/91/12/145109112.db2.gz	DUFYJAJRKFEBMF-KEYYUXOJSA-N	0	3	302.418	2.399	10	0		DEAEHN
Cc1ccccc1[C@H](C)NC(=O)[C@H](C)N1CCN2CCC[C@H]2C1	ZINC000246730521	145111884	/nfs/dbraw/zinc/11/18/84/145111884.db2.gz	VYFRHOHSGLGZIM-ULQDDVLXSA-N	0	3	315.461	2.341	10	0		DEAEHN
C[C@H](Sc1ccccn1)C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000246728540	145111955	/nfs/dbraw/zinc/11/19/55/145111955.db2.gz	XHRSJIPTNSYHRS-HZSPNIEDSA-N	0	3	305.447	2.257	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@@H]2COc3ccccc3C2)C1	ZINC000247331778	145134002	/nfs/dbraw/zinc/13/40/02/145134002.db2.gz	NAHTWISZCHQUTL-KBMXLJTQSA-N	0	3	302.418	2.083	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)[C@H](C)Oc2cccc(F)c2)C1	ZINC000247354451	145134379	/nfs/dbraw/zinc/13/43/79/145134379.db2.gz	OFDDEQXXQHRSPG-HEHGZKQESA-N	0	3	308.397	2.438	10	0		DEAEHN
COCCOc1ccccc1C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000247530698	145140217	/nfs/dbraw/zinc/14/02/17/145140217.db2.gz	ZUUKDZLHFIZVEF-GOEBONIOSA-N	0	3	320.433	2.170	10	0		DEAEHN
Cc1ccccc1C[C@H](C)NC(=O)N1CCN2CCC[C@H]2C1	ZINC000247655358	145142783	/nfs/dbraw/zinc/14/27/83/145142783.db2.gz	XZWLVSGQOFKKCI-RDJZCZTQSA-N	0	3	301.434	2.416	10	0		DEAEHN
C[C@H](c1nc(-c2cccnc2)no1)N1CCN2CCCC[C@H]2C1	ZINC000248369784	145151976	/nfs/dbraw/zinc/15/19/76/145151976.db2.gz	WRIDYCPGCHQRMV-HIFRSBDPSA-N	0	3	313.405	2.363	10	0		DEAEHN
Cc1csc([C@@H](C)CNC(=O)N2CCN3CCC[C@H]3C2)n1	ZINC000248637016	145162698	/nfs/dbraw/zinc/16/26/98/145162698.db2.gz	QNZJRGLHJUZICK-AAEUAGOBSA-N	0	3	308.451	2.045	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ncccc1Br	ZINC000248779082	145166892	/nfs/dbraw/zinc/16/68/92/145166892.db2.gz	UVLPXNXZUVDRTA-QWRGUYRKSA-N	0	3	324.222	2.153	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1[C@@H]1CCCN(C(C)C)C1=O	ZINC000248770250	145167462	/nfs/dbraw/zinc/16/74/62/145167462.db2.gz	SNOXGZGFXOLFEW-JJXSEGSLSA-N	0	3	322.449	2.192	10	0		DEAEHN
Cc1nsc(N2CCCN(C[C@@H](O)C3CCCCC3)CC2)n1	ZINC000248900989	145172684	/nfs/dbraw/zinc/17/26/84/145172684.db2.gz	KXHLARIJYUDGOS-OAHLLOKOSA-N	0	3	324.494	2.300	10	0		DEAEHN
CCC[C@@H]1CN(C[C@@H](O)CC2CCCC2)CCN1CCOC	ZINC000249029435	145176374	/nfs/dbraw/zinc/17/63/74/145176374.db2.gz	FCLFRYXIIUMALN-MSOLQXFVSA-N	0	3	312.498	2.360	10	0		DEAEHN
Cn1cnc2cc(CN3CCNC[C@H]3c3cccnc3)ccc21	ZINC000261841505	145232528	/nfs/dbraw/zinc/23/25/28/145232528.db2.gz	ZTQIMFHJUXZNSB-SFHVURJKSA-N	0	3	307.401	2.115	10	0		DEAEHN
CCNC(=O)c1ccc(C)c(NC(=O)[C@@H]2NCCCC2(C)C)c1	ZINC000261856173	145233977	/nfs/dbraw/zinc/23/39/77/145233977.db2.gz	JXNFPJPOOYJMNJ-HNNXBMFYSA-N	0	3	317.433	2.461	10	0		DEAEHN
Cc1ccc(CN(C)C(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)cc1	ZINC000261885624	145237557	/nfs/dbraw/zinc/23/75/57/145237557.db2.gz	NCMAADOLZHEIQV-FRQCXROJSA-N	0	3	316.445	2.486	10	0		DEAEHN
N[C@@H](C(=O)NCC12CC3CC(CC(C3)C1)C2)C1CCOCC1	ZINC000261887425	145238151	/nfs/dbraw/zinc/23/81/51/145238151.db2.gz	VDXOSBHOMLYCPO-JKJYUFNASA-N	0	3	306.450	2.073	10	0		DEAEHN
Cc1cccc(CN(C)C(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)c1	ZINC000261908720	145240528	/nfs/dbraw/zinc/24/05/28/145240528.db2.gz	PWJBEEYRGWKSOU-GPMSIDNRSA-N	0	3	316.445	2.486	10	0		DEAEHN
CC(C)(C)C(=O)c1ccc(NC(=O)C2(N)CCOCC2)cc1	ZINC000261925674	145242477	/nfs/dbraw/zinc/24/24/77/145242477.db2.gz	VRQPFSUGJMDKIR-UHFFFAOYSA-N	0	3	304.390	2.362	10	0		DEAEHN
Cc1ccccc1CCNC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C	ZINC000261923194	145242820	/nfs/dbraw/zinc/24/28/20/145242820.db2.gz	RXUMEMPZMYVMEZ-FRQCXROJSA-N	0	3	316.445	2.186	10	0		DEAEHN
NC1(C(=O)Nc2cccc(Oc3ccccn3)c2)CCOCC1	ZINC000261931314	145243437	/nfs/dbraw/zinc/24/34/37/145243437.db2.gz	WFXUGTXZRBTUSM-UHFFFAOYSA-N	0	3	313.357	2.320	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N1CCc2ccc(F)cc21	ZINC000261964706	145248138	/nfs/dbraw/zinc/24/81/38/145248138.db2.gz	YEVDXIJEDYLJIU-JOQOYGCGSA-N	0	3	318.392	2.247	10	0		DEAEHN
c1sc(CN[C@@H]2CCC[C@H]2[C@H]2COCCN2)nc1C1CC1	ZINC000261995508	145251439	/nfs/dbraw/zinc/25/14/39/145251439.db2.gz	TZCUMPKSJBHTDZ-MGPQQGTHSA-N	0	3	307.463	2.267	10	0		DEAEHN
C[C@@H](NC(=O)C[C@@H]1CNCCO1)c1ccc(C(F)(F)F)cc1	ZINC000262113591	145262884	/nfs/dbraw/zinc/26/28/84/145262884.db2.gz	JYIAJEDUIIBZRY-ZWNOBZJWSA-N	0	3	316.323	2.261	10	0		DEAEHN
COc1cccc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)c1	ZINC000262504447	145289138	/nfs/dbraw/zinc/28/91/38/145289138.db2.gz	MIGXXBWNARESKH-CKEIUWERSA-N	0	3	304.390	2.166	10	0		DEAEHN
Cc1ccccc1CNC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C	ZINC000262558324	145293114	/nfs/dbraw/zinc/29/31/14/145293114.db2.gz	USJKAXYOUUZJNS-RLFYNMQTSA-N	0	3	302.418	2.144	10	0		DEAEHN
C[C@H]1C[NH2+]CC[C@@H]1[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000262745941	145303142	/nfs/dbraw/zinc/30/31/42/145303142.db2.gz	DTXOVJOIKQDJPG-KWQFWETISA-N	0	3	323.245	2.270	10	0		DEAEHN
CSCc1ccc(-c2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263119625	145327006	/nfs/dbraw/zinc/32/70/06/145327006.db2.gz	AUAUYQHUXYYFQZ-CYBMUJFWSA-N	0	3	304.419	2.176	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(/C=C/c2cccc3cccnc23)n1	ZINC000263146625	145329532	/nfs/dbraw/zinc/32/95/32/145329532.db2.gz	CTPIWNOSUZDODJ-KIUWMYQTSA-N	0	3	321.384	2.364	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(C[C@H]2CCCc3ccccc32)n1	ZINC000263153302	145330352	/nfs/dbraw/zinc/33/03/52/145330352.db2.gz	DFBAEUBROJLRPL-ZBFHGGJFSA-N	0	3	312.417	2.308	10	0		DEAEHN
CCCOc1cccc(-c2nc([C@H]3CNCCN3C)no2)c1	ZINC000263206528	145335966	/nfs/dbraw/zinc/33/59/66/145335966.db2.gz	JTTARTYPBBXIEZ-CQSZACIVSA-N	0	3	302.378	2.102	10	0		DEAEHN
Cc1ccc2nc(C)c(-c3nc([C@H]4CNCCN4C)no3)cc2c1	ZINC000263221674	145337908	/nfs/dbraw/zinc/33/79/08/145337908.db2.gz	LYWFMIRSYSSWSD-MRXNPFEDSA-N	0	3	323.400	2.478	10	0		DEAEHN
O[C@@H](CCNCc1cncc(Br)c1)C(F)(F)F	ZINC000349333428	146370001	/nfs/dbraw/zinc/37/00/01/146370001.db2.gz	QHMSUOXASLQAQL-VIFPVBQESA-N	0	3	313.117	2.247	10	0		DEAEHN
COCCn1c(SC[C@@H](C)N(C)C)nnc1-c1ccncc1	ZINC000358853975	147219570	/nfs/dbraw/zinc/21/95/70/147219570.db2.gz	NNEWDGOSKPKMNR-GFCCVEGCSA-N	0	3	321.450	2.029	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCCOc1ccc(F)c(F)c1	ZINC000358864240	147221165	/nfs/dbraw/zinc/22/11/65/147221165.db2.gz	VGVJZWAERMONDF-HNNXBMFYSA-N	0	3	312.360	2.334	10	0		DEAEHN
C[C@H]1CN(C)CC[C@H]1N(C)C(=O)NCc1ccc2cc[nH]c2n1	ZINC000360712966	147372641	/nfs/dbraw/zinc/37/26/41/147372641.db2.gz	KUZYVWGBOARAIX-SWLSCSKDSA-N	0	3	315.421	2.045	10	0		DEAEHN
c1cc(-c2ccc(CN[C@@H]3CCN(c4ccccn4)C3)o2)n[nH]1	ZINC000370535839	148028622	/nfs/dbraw/zinc/02/86/22/148028622.db2.gz	MPSGDGXEWFKOEF-CYBMUJFWSA-N	0	3	309.373	2.433	10	0		DEAEHN
Cc1nccn1CCCCNC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000073722852	401720561	/nfs/dbraw/zinc/72/05/61/401720561.db2.gz	MKBSTIUJUBZMKC-INIZCTEOSA-N	0	3	323.485	2.247	10	0		DEAEHN
CC(C)CC[C@@H](NC(=O)NC[C@](C)(O)CN(C)C)C(C)(C)C	ZINC000127132459	401721762	/nfs/dbraw/zinc/72/17/62/401721762.db2.gz	YZVYENJQUSOWRT-PBHICJAKSA-N	0	3	315.502	2.449	10	0		DEAEHN
C[C@@H]1C[C@@H]1NC(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000112217101	401733461	/nfs/dbraw/zinc/73/34/61/401733461.db2.gz	CCZGEOXNFGLLIF-KGLIPLIRSA-N	0	3	311.495	2.446	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NCCc1cscn1	ZINC000110806598	401694343	/nfs/dbraw/zinc/69/43/43/401694343.db2.gz	LXPYXKTWNKLJAM-UHFFFAOYSA-N	0	3	319.430	2.056	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1ccc(N2CCCC2)nc1	ZINC000072089194	401702615	/nfs/dbraw/zinc/70/26/15/401702615.db2.gz	GVMHVSMWCZWCJY-MRXNPFEDSA-N	0	3	318.465	2.388	10	0		DEAEHN
CCC[C@@H](C)C(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000114414630	401798495	/nfs/dbraw/zinc/79/84/95/401798495.db2.gz	UFNVJLXLNZNBQP-OAHLLOKOSA-N	0	3	318.465	2.228	10	0		DEAEHN
O=C(CN[C@@H]1CCCC[C@@H]1n1cccn1)NC1CCCCC1	ZINC000128167167	401765842	/nfs/dbraw/zinc/76/58/42/401765842.db2.gz	LPYHHBZIZFBWFU-CVEARBPZSA-N	0	3	304.438	2.405	10	0		DEAEHN
C[C@@H]1C[C@@H](c2cccc(F)c2)N(C[C@H](O)CN2CCCC2=O)C1	ZINC000075842864	401770439	/nfs/dbraw/zinc/77/04/39/401770439.db2.gz	KMQWBQINGQRXLK-XYPHTWIQSA-N	0	3	320.408	2.192	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)ccc1F	ZINC000113222351	401770838	/nfs/dbraw/zinc/77/08/38/401770838.db2.gz	GUZUTMGWBAYIFB-SMDDNHRTSA-N	0	3	319.380	2.093	10	0		DEAEHN
CC[C@@H](CO)N1CCN(CCCOCCc2ccccc2)CC1	ZINC000075963345	401775148	/nfs/dbraw/zinc/77/51/48/401775148.db2.gz	PYSADASKMPXJND-IBGZPJMESA-N	0	3	320.477	2.024	10	0		DEAEHN
CC[C@H](CO)N1CCN(CCCOc2cc(C)cc(C)c2)CC1	ZINC000075961994	401775236	/nfs/dbraw/zinc/77/52/36/401775236.db2.gz	CPRKTNUKEMKYKP-GOSISDBHSA-N	0	3	320.477	2.461	10	0		DEAEHN
COc1ccc(CN2CC[C@H](c3cnn(C)c3)C2)cc1OC	ZINC000128489015	401779515	/nfs/dbraw/zinc/77/95/15/401779515.db2.gz	HPIHGIZOJUCAKG-AWEZNQCLSA-N	0	3	301.390	2.427	10	0		DEAEHN
COc1ccc(CNC(=O)CN(C(C)C)C2CCOCC2)cc1	ZINC000077323641	401810528	/nfs/dbraw/zinc/81/05/28/401810528.db2.gz	PDBGRJOYIBTOKM-UHFFFAOYSA-N	0	3	320.433	2.201	10	0		DEAEHN
CCOCCC1(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)CC1	ZINC000132618755	401870616	/nfs/dbraw/zinc/87/06/16/401870616.db2.gz	GDOZBXDKMZDREL-HUUCEWRRSA-N	0	3	311.470	2.317	10	0		DEAEHN
CN1C[C@@H](NCc2ccc(F)c(Br)c2)CCC1=O	ZINC000077899912	401835862	/nfs/dbraw/zinc/83/58/62/401835862.db2.gz	JVINKHKEXWKWHL-JTQLQIEISA-N	0	3	315.186	2.299	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)CSCc1cscn1	ZINC000131110560	401843766	/nfs/dbraw/zinc/84/37/66/401843766.db2.gz	QARKUCMVERVMKB-DGCLKSJQSA-N	0	3	311.476	2.071	10	0		DEAEHN
O=C(NCCN1CCCCC1)N[C@H]1CCN(c2ccccc2)C1	ZINC000078544849	401855085	/nfs/dbraw/zinc/85/50/85/401855085.db2.gz	HRKIOJNECHUFMZ-INIZCTEOSA-N	0	3	316.449	2.050	10	0		DEAEHN
Cc1cc2[nH]c(C(=O)N3CCO[C@H](CN(C)C)C3)cc2c(C)c1	ZINC000116784068	401858473	/nfs/dbraw/zinc/85/84/73/401858473.db2.gz	GQNABUQYKMVJCV-CQSZACIVSA-N	0	3	315.417	2.187	10	0		DEAEHN
Cc1ccc(CCCC(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000116793232	401859055	/nfs/dbraw/zinc/85/90/55/401859055.db2.gz	KBZSRBPACUSZSV-QGZVFWFLSA-N	0	3	304.434	2.107	10	0		DEAEHN
COCCOc1cccc(CNC(=O)CN2CCCC2(C)C)c1	ZINC000077382964	401813481	/nfs/dbraw/zinc/81/34/81/401813481.db2.gz	SGCSSUIBZNIVJZ-UHFFFAOYSA-N	0	3	320.433	2.202	10	0		DEAEHN
COC(=O)c1ccccc1N1CCN[C@H](Cc2ccccc2)C1	ZINC000039952504	401924572	/nfs/dbraw/zinc/92/45/72/401924572.db2.gz	XUNNCBOLCYRKRN-MRXNPFEDSA-N	0	3	310.397	2.494	10	0		DEAEHN
COCCN1CCN(CCCc2cccc(OC)c2)C[C@H]1C	ZINC000119157823	401929956	/nfs/dbraw/zinc/92/99/56/401929956.db2.gz	PVSKEAJLAYWHOM-MRXNPFEDSA-N	0	3	306.450	2.280	10	0		DEAEHN
CCc1ncc(NC(=O)N[C@@H](CN(C)C)c2ccccc2)cn1	ZINC000119168691	401930557	/nfs/dbraw/zinc/93/05/57/401930557.db2.gz	QFDWUVMBNIUKTG-HNNXBMFYSA-N	0	3	313.405	2.463	10	0		DEAEHN
COC(=O)c1ccc(CN2CC[C@H](c3cnn(C)c3)C2)s1	ZINC000119242073	401935318	/nfs/dbraw/zinc/93/53/18/401935318.db2.gz	NEUMHQTWWXTRNU-NSHDSACASA-N	0	3	305.403	2.258	10	0		DEAEHN
Cc1cc(N2CCC[C@H](NCc3ccc(C)cc3)C2=O)n(C)n1	ZINC000080526306	401890145	/nfs/dbraw/zinc/89/01/45/401890145.db2.gz	RNTUXNVNZKQUKN-INIZCTEOSA-N	0	3	312.417	2.322	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCc2ccccc2OC2CCC2)C1	ZINC000118586787	401901228	/nfs/dbraw/zinc/90/12/28/401901228.db2.gz	VZGFMBIQKJPMMR-OAHLLOKOSA-N	0	3	317.433	2.463	10	0		DEAEHN
CC[C@H](O)CN(Cc1ccccc1)C[C@H](O)COC(C)(C)C	ZINC000134508688	401904946	/nfs/dbraw/zinc/90/49/46/401904946.db2.gz	HBOUQSJBGGFZSY-IRXDYDNUSA-N	0	3	309.450	2.436	10	0		DEAEHN
Cc1ccc(NC(=O)N2CCO[C@@H](CN(C)C)C2)c(Cl)c1	ZINC000118789090	401908153	/nfs/dbraw/zinc/90/81/53/401908153.db2.gz	LJUCUTIMQIINAM-LBPRGKRZSA-N	0	3	311.813	2.443	10	0		DEAEHN
CCOC(=O)C[C@H](N)c1cc(Br)ccc1OC	ZINC000036894210	401908780	/nfs/dbraw/zinc/90/87/80/401908780.db2.gz	INRFAXICCYJMTN-JTQLQIEISA-N	0	3	302.168	2.411	10	0		DEAEHN
COC(=O)c1ccc(CN2CCCN(C3CC3)CC2)cc1F	ZINC000089127814	401936426	/nfs/dbraw/zinc/93/64/26/401936426.db2.gz	LCRBOEBZNVKTAX-UHFFFAOYSA-N	0	3	306.381	2.282	10	0		DEAEHN
CCN(CC)CC(=O)N1CCO[C@H](c2ccc(F)c(C)c2)C1	ZINC000134777975	401913693	/nfs/dbraw/zinc/91/36/93/401913693.db2.gz	FFWKSZQOMWHAFX-INIZCTEOSA-N	0	3	308.397	2.376	10	0		DEAEHN
CCc1ccc(CC(=O)NC[C@H]2CCCN2CCOC)cc1	ZINC000118970390	401915968	/nfs/dbraw/zinc/91/59/68/401915968.db2.gz	JJMBUZFJHSAOHX-QGZVFWFLSA-N	0	3	304.434	2.019	10	0		DEAEHN
C[C@@](CO)(NC[C@H]1CCCO1)c1ccc(Br)cc1	ZINC000038114611	401922887	/nfs/dbraw/zinc/92/28/87/401922887.db2.gz	ORHDUHOOOVTKFM-KGLIPLIRSA-N	0	3	314.223	2.425	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccnc(OC2CCC2)c1	ZINC000089571947	401952185	/nfs/dbraw/zinc/95/21/85/401952185.db2.gz	RXIIDKWWGSBZOB-UKRRQHHQSA-N	0	3	315.417	2.322	10	0		DEAEHN
COCCC1(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)CCC1	ZINC000119497354	401954502	/nfs/dbraw/zinc/95/45/02/401954502.db2.gz	LCUSZIJHRZMVOW-LSDHHAIUSA-N	0	3	311.470	2.317	10	0		DEAEHN
CCc1cc(C(=O)Nc2ccn(CCN(C)C)n2)oc1CC	ZINC000136307340	401965304	/nfs/dbraw/zinc/96/53/04/401965304.db2.gz	XAHLJIVOVPJUAB-UHFFFAOYSA-N	0	3	304.394	2.415	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2)N(C)C	ZINC000119810827	401967403	/nfs/dbraw/zinc/96/74/03/401967403.db2.gz	NSCJWOXPAURUMH-NHYWBVRUSA-N	0	3	303.406	2.089	10	0		DEAEHN
C[C@H]1CCCN(C(=O)c2ccnc(OCCN(C)C)c2)CC1	ZINC000136718785	401972724	/nfs/dbraw/zinc/97/27/24/401972724.db2.gz	AJDVXSITOZKDAH-AWEZNQCLSA-N	0	3	305.422	2.284	10	0		DEAEHN
CN(CC(=O)Nc1cc(F)cc(F)c1)C1CCC(CO)CC1	ZINC000089924453	401973818	/nfs/dbraw/zinc/97/38/18/401973818.db2.gz	DSTZBKBTLWLVJV-UHFFFAOYSA-N	0	3	312.360	2.386	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)c1cccnc1N1CCCC1	ZINC000046859833	401974113	/nfs/dbraw/zinc/97/41/13/401974113.db2.gz	NYFAOBZSECKMBF-HNNXBMFYSA-N	0	3	316.449	2.286	10	0		DEAEHN
COc1cccc(C(=O)N(CCN(C)C)C[C@H]2CCCO2)c1F	ZINC000090552980	401984721	/nfs/dbraw/zinc/98/47/21/401984721.db2.gz	XQQYAOZBRSWNIR-CYBMUJFWSA-N	0	3	324.396	2.017	10	0		DEAEHN
C[C@H](NC(=O)[C@@]1(F)CCNC1)c1ccccc1Br	ZINC000150721722	401993863	/nfs/dbraw/zinc/99/38/63/401993863.db2.gz	AHLLNNYFQWRKOW-TVQRCGJNSA-N	0	3	315.186	2.328	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2ccc3c(c2)CC(C)(C)O3)C[C@@H]1C	ZINC000120607700	401995437	/nfs/dbraw/zinc/99/54/37/401995437.db2.gz	YOCMBFMCGPIZJV-LSDHHAIUSA-N	0	3	318.461	2.287	10	0		DEAEHN
CC(C)(C)OC(=O)N1C[C@@H](N)[C@@H](c2nccc3[nH]ccc32)C1	ZINC000089220763	401938902	/nfs/dbraw/zinc/93/89/02/401938902.db2.gz	VCNPCIVVKYWICT-NWDGAFQWSA-N	0	3	302.378	2.225	10	0		DEAEHN
C[C@@H](CN1CC[C@H](Cc2ccc(F)cc2)C1)CS(C)(=O)=O	ZINC000119292860	401938978	/nfs/dbraw/zinc/93/89/78/401938978.db2.gz	OJDQNQVCWYIOIO-DZGCQCFKSA-N	0	3	313.438	2.371	10	0		DEAEHN
COc1ccc(CCNC(=O)N(C)CCN(C)C)c(Cl)c1	ZINC000119365188	401944586	/nfs/dbraw/zinc/94/45/86/401944586.db2.gz	NJPXNKIYNFWCNW-UHFFFAOYSA-N	0	3	313.829	2.094	10	0		DEAEHN
Cc1nc2ccccc2n1CC(=O)NCCN1CCCC[C@H]1C	ZINC000044532992	401944832	/nfs/dbraw/zinc/94/48/32/401944832.db2.gz	HXHORVUIDNWTKT-CQSZACIVSA-N	0	3	314.433	2.335	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(Br)nc1	ZINC000093097523	402011753	/nfs/dbraw/zinc/01/17/53/402011753.db2.gz	CELSSEOHXBFGIR-CMPLNLGQSA-N	0	3	324.222	2.153	10	0		DEAEHN
COCCCNC(=O)CN1C[C@@H](c2ccc(OC)cc2)C[C@@H]1C	ZINC000151046721	402012645	/nfs/dbraw/zinc/01/26/45/402012645.db2.gz	VFHAGDNUCTUJFZ-HOCLYGCPSA-N	0	3	320.433	2.026	10	0		DEAEHN
CC(C)CNC(=O)[C@H](C)N[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000121103565	402015086	/nfs/dbraw/zinc/01/50/86/402015086.db2.gz	XJGWTROBYBEBBG-KBPBESRZSA-N	0	3	315.421	2.079	10	0		DEAEHN
CCCOc1cccc(CN2CCN([C@H](CC)CO)CC2)c1	ZINC000093740214	402019078	/nfs/dbraw/zinc/01/90/78/402019078.db2.gz	QOOVUUCDDDFHED-QGZVFWFLSA-N	0	3	306.450	2.364	10	0		DEAEHN
O=C(CN[C@@H](c1ccc(Cl)cc1)C1CC1)NC(=O)NC1CC1	ZINC000050273798	402026358	/nfs/dbraw/zinc/02/63/58/402026358.db2.gz	MMWXONRTHWRTHR-OAHLLOKOSA-N	0	3	321.808	2.369	10	0		DEAEHN
Cc1ccc([C@H]2CN(C(=O)NC[C@@H](C)N(C)C3CC3)CCO2)o1	ZINC000121313407	402027607	/nfs/dbraw/zinc/02/76/07/402027607.db2.gz	ZTXNNRIVCYWSRI-MLGOLLRUSA-N	0	3	321.421	2.154	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCc2ccccc2OCC2CC2)C1	ZINC000121312547	402027648	/nfs/dbraw/zinc/02/76/48/402027648.db2.gz	UEPXAMBXALSACT-MRXNPFEDSA-N	0	3	317.433	2.321	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](C)c2ccc3c(c2)OCO3)C1	ZINC000052521720	402043904	/nfs/dbraw/zinc/04/39/04/402043904.db2.gz	WHOVFRXSXIZRSD-JSGCOSHPSA-N	0	3	319.405	2.260	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)CCOc2cccc(C)c2)C1	ZINC000052593452	402044381	/nfs/dbraw/zinc/04/43/81/402044381.db2.gz	NEPNOTFKNHMFCG-INIZCTEOSA-N	0	3	319.449	2.500	10	0		DEAEHN
CCN(CC)[C@@H](C)C[N-]S(=O)(=O)c1cc(F)c(C)cc1F	ZINC000121913545	402056708	/nfs/dbraw/zinc/05/67/08/402056708.db2.gz	ZGYQSRSWUJMVAS-NSHDSACASA-N	0	3	320.405	2.282	10	0		DEAEHN
CC[NH+](CC)[C@@H](C)C[N-]S(=O)(=O)c1cc(F)c(C)cc1F	ZINC000121913545	402056710	/nfs/dbraw/zinc/05/67/10/402056710.db2.gz	ZGYQSRSWUJMVAS-NSHDSACASA-N	0	3	320.405	2.282	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)N1CC[C@H]2OCCC[C@@H]2C1	ZINC000150989320	402009469	/nfs/dbraw/zinc/00/94/69/402009469.db2.gz	KHXFRERIJPUGPQ-BRWVUGGUSA-N	0	3	323.481	2.461	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2cnn(-c3ccccc3F)c2)C1	ZINC000152128905	402077224	/nfs/dbraw/zinc/07/72/24/402077224.db2.gz	YCCBSXILVQMBRT-CYBMUJFWSA-N	0	3	317.368	2.179	10	0		DEAEHN
COc1ccc(O[C@@H](C)C(=O)NC[C@H](N)c2ccccc2)cc1	ZINC000152167067	402079595	/nfs/dbraw/zinc/07/95/95/402079595.db2.gz	IFHXQBCHQPTNAB-GUYCJALGSA-N	0	3	314.385	2.279	10	0		DEAEHN
COc1cccc(CNC(=O)N(CCN(C)C)C2CCCC2)n1	ZINC000122753227	402093138	/nfs/dbraw/zinc/09/31/38/402093138.db2.gz	LMPDOWJGQDUFMV-UHFFFAOYSA-N	0	3	320.437	2.106	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cccnc2N2CCCC2)CCN1C	ZINC000123025003	402106666	/nfs/dbraw/zinc/10/66/66/402106666.db2.gz	GLQZYJWXLHHSDR-LSDHHAIUSA-N	0	3	316.449	2.237	10	0		DEAEHN
C[C@@H](CO)[C@@H](C)NCc1cc2c(cc1Br)OCO2	ZINC000123241580	402117339	/nfs/dbraw/zinc/11/73/39/402117339.db2.gz	BGBSYQYMZVYBKP-DTWKUNHWSA-N	0	3	316.195	2.284	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)Nc2cccc(N(C)C)n2)CCN1C	ZINC000152961476	402119317	/nfs/dbraw/zinc/11/93/17/402119317.db2.gz	WXEWYOMYPVDOFZ-STQMWFEESA-N	0	3	305.426	2.094	10	0		DEAEHN
CCOC(=O)c1cnc2ccc(Cl)cc2c1N1CCNCC1	ZINC000053994911	402061268	/nfs/dbraw/zinc/06/12/68/402061268.db2.gz	CMUXPPNKRJFBIG-UHFFFAOYSA-N	0	3	319.792	2.475	10	0		DEAEHN
COc1cc(C[NH2+]C[C@H](C)CCO)cc(Br)c1[O-]	ZINC000097440095	402125012	/nfs/dbraw/zinc/12/50/12/402125012.db2.gz	AEDGETXPCUTTGR-SECBINFHSA-N	0	3	318.211	2.271	10	0		DEAEHN
CC[C@@H](C(=O)N1CCO[C@H](CN(C)C)C1)c1ccc(F)cc1	ZINC000123594460	402137005	/nfs/dbraw/zinc/13/70/05/402137005.db2.gz	LHVRFEALVYHFOY-HZPDHXFCSA-N	0	3	308.397	2.108	10	0		DEAEHN
C[C@H](CN[C@H](C)c1cc(F)c(F)c(F)c1)N1CCOCC1	ZINC000123360168	402123806	/nfs/dbraw/zinc/12/38/06/402123806.db2.gz	IAKAHRJMYDSNNC-GHMZBOCLSA-N	0	3	302.340	2.475	10	0		DEAEHN
COCCOc1cccc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000123776762	402145798	/nfs/dbraw/zinc/14/57/98/402145798.db2.gz	DMLKIAKZCFRMKA-HOCLYGCPSA-N	0	3	320.433	2.267	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)CSCC(F)(F)F	ZINC000153470852	402147761	/nfs/dbraw/zinc/14/77/61/402147761.db2.gz	XHLXYIOBSJRJQP-GHMZBOCLSA-N	0	3	310.385	2.367	10	0		DEAEHN
COc1ccc(OC)c(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000124481103	402181895	/nfs/dbraw/zinc/18/18/95/402181895.db2.gz	CICBPWHQAIYXHA-QWHCGFSZSA-N	0	3	306.406	2.259	10	0		DEAEHN
COc1cccc(CNC(=O)[C@@H](C(C)C)N2CCCCC2)n1	ZINC000104346598	402203437	/nfs/dbraw/zinc/20/34/37/402203437.db2.gz	QXFFYLYLNTWHRS-MRXNPFEDSA-N	0	3	305.422	2.217	10	0		DEAEHN
COC[C@@H](C)C(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000103388470	402186327	/nfs/dbraw/zinc/18/63/27/402186327.db2.gz	MGEXUCOHGRRUEH-CQSZACIVSA-N	0	3	322.474	2.499	10	0		DEAEHN
CC(C)CO[C@H]1CCN(C[C@@H](O)COCc2ccccc2)C1	ZINC000124648166	402189751	/nfs/dbraw/zinc/18/97/51/402189751.db2.gz	JKJVYNMXOVNTHL-MSOLQXFVSA-N	0	3	307.434	2.311	10	0		DEAEHN
COc1cccc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1OC	ZINC000124819225	402198673	/nfs/dbraw/zinc/19/86/73/402198673.db2.gz	ACKVZFUPFCFRQV-QWHCGFSZSA-N	0	3	306.406	2.259	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N2CCC(c3cc[nH]n3)CC2)cc1	ZINC000125207636	402218938	/nfs/dbraw/zinc/21/89/38/402218938.db2.gz	BJUQIMWVNNWCSC-UHFFFAOYSA-N	0	3	312.417	2.491	10	0		DEAEHN
O=C(c1ccc(-c2ncon2)cc1)N1CC[C@@H](N2CCCC2)C1	ZINC000107244710	402228475	/nfs/dbraw/zinc/22/84/75/402228475.db2.gz	NBADKTLCYOJKEC-OAHLLOKOSA-N	0	3	312.373	2.047	10	0		DEAEHN
CC(C)C[C@H](CNC(=O)c1ccc(-c2ncon2)cc1)N(C)C	ZINC000107357945	402230971	/nfs/dbraw/zinc/23/09/71/402230971.db2.gz	QDZZKFBIOSXOIU-OAHLLOKOSA-N	0	3	316.405	2.443	10	0		DEAEHN
CC[C@H](C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1)N(C)C	ZINC000154842189	402235304	/nfs/dbraw/zinc/23/53/04/402235304.db2.gz	KRGZTAWFVDPKHH-IEBWSBKVSA-N	0	3	317.477	2.498	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2cc(-c3cccs3)on2)CCO1	ZINC000070016294	402255094	/nfs/dbraw/zinc/25/50/94/402255094.db2.gz	VSOVPYPEUQOPDP-ZDUSSCGKSA-N	0	3	307.419	2.166	10	0		DEAEHN
CCCCOC(=O)CCN1CCC[C@@H](Cn2nc(C)nc2C)C1	ZINC000105919887	402211124	/nfs/dbraw/zinc/21/11/24/402211124.db2.gz	WLFJXCODWULHCE-MRXNPFEDSA-N	0	3	322.453	2.340	10	0		DEAEHN
CC[C@H](C)Oc1ccc(C(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000176608631	402323213	/nfs/dbraw/zinc/32/32/13/402323213.db2.gz	DCHKTQHQSKUVHE-YOEHRIQHSA-N	0	3	320.433	2.267	10	0		DEAEHN
C[C@H](NC(=O)N[C@H](CN(C)C)c1ccccc1)[C@@H]1CCCO1	ZINC000195603352	402273405	/nfs/dbraw/zinc/27/34/05/402273405.db2.gz	RULWYCXZOKAJQD-IMJJTQAJSA-N	0	3	305.422	2.156	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N1[C@H](C)CC[C@@H]1C)c1nnc2n1CCCC2	ZINC000156347327	402279919	/nfs/dbraw/zinc/27/99/19/402279919.db2.gz	LOMZIGUVYAUMKE-CRWXNKLISA-N	0	3	319.453	2.053	10	0		DEAEHN
CCOc1cccnc1C(=O)NCCN(C)Cc1ccccc1	ZINC000176160502	402285332	/nfs/dbraw/zinc/28/53/32/402285332.db2.gz	VWGPOBFCLSTJCV-UHFFFAOYSA-N	0	3	313.401	2.342	10	0		DEAEHN
COCCN1CCC(NC(=O)/C(C)=C/c2ccc(F)cc2)CC1	ZINC000176198169	402289657	/nfs/dbraw/zinc/28/96/57/402289657.db2.gz	VKCQWKZYHALIDU-BUHFOSPRSA-N	0	3	320.408	2.456	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1ccc(C(=O)OC)cc1	ZINC000176298062	402297692	/nfs/dbraw/zinc/29/76/92/402297692.db2.gz	RFLPAUUVWSIMST-HNNXBMFYSA-N	0	3	319.405	2.421	10	0		DEAEHN
CCN1CCN(c2cccc(NC(=O)N[C@H]3C[C@@H]3C)c2)CC1	ZINC000184919556	402309782	/nfs/dbraw/zinc/30/97/82/402309782.db2.gz	PJBCQBJNTUPMNC-BBRMVZONSA-N	0	3	302.422	2.358	10	0		DEAEHN
O=C(NCCOCc1ccccc1)N1CCCN(C2CC2)CC1	ZINC000176448725	402310699	/nfs/dbraw/zinc/31/06/99/402310699.db2.gz	ODQRUCGMCHEQKU-UHFFFAOYSA-N	0	3	317.433	2.083	10	0		DEAEHN
CC(C)[C@](C)(O)CN1CCCN(C(=O)c2ccccc2)CC1	ZINC000184955736	402312365	/nfs/dbraw/zinc/31/23/65/402312365.db2.gz	JFRJMSKSHYWSEB-GOSISDBHSA-N	0	3	304.434	2.242	10	0		DEAEHN
COC(=O)CCN(Cc1cc(-c2cnn(C)c2)no1)CC(C)C	ZINC000184990405	402315145	/nfs/dbraw/zinc/31/51/45/402315145.db2.gz	NHQLPEYVNZHDOY-UHFFFAOYSA-N	0	3	320.393	2.096	10	0		DEAEHN
CC[C@@H](Oc1cccc(C)c1)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000176519917	402316568	/nfs/dbraw/zinc/31/65/68/402316568.db2.gz	KWXNMLIFJFPGIP-NVXWUHKLSA-N	0	3	302.418	2.459	10	0		DEAEHN
CC(C)[C@H]1OCCC[C@H]1CNC(=O)N1CCCN(C2CC2)CC1	ZINC000176826240	402340966	/nfs/dbraw/zinc/34/09/66/402340966.db2.gz	KGDDPTIHJGWYQV-DOTOQJQBSA-N	0	3	323.481	2.317	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(OC)ccc1OC	ZINC000176964902	402354929	/nfs/dbraw/zinc/35/49/29/402354929.db2.gz	OBMALPBQLOXSSU-CYBMUJFWSA-N	0	3	306.406	2.260	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1ccc(OC)cc1	ZINC000177024681	402360618	/nfs/dbraw/zinc/36/06/18/402360618.db2.gz	DKJUYVUZNPHOFY-HNNXBMFYSA-N	0	3	305.422	2.321	10	0		DEAEHN
CN1CC[C@H](NC(=O)NO[C@@H]2CCCCO2)[C@@H]1c1ccccc1	ZINC000185733240	402372537	/nfs/dbraw/zinc/37/25/37/402372537.db2.gz	WXWKPQNWPFCZEB-XHSDSOJGSA-N	0	3	319.405	2.189	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCc1ccccc1OC	ZINC000177297286	402388587	/nfs/dbraw/zinc/38/85/87/402388587.db2.gz	ULCAAQKTZGVSOZ-INIZCTEOSA-N	0	3	319.449	2.363	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCc1ccccc1OC	ZINC000177297269	402388873	/nfs/dbraw/zinc/38/88/73/402388873.db2.gz	ULCAAQKTZGVSOZ-MRXNPFEDSA-N	0	3	319.449	2.363	10	0		DEAEHN
CCN(CC)C(=O)CN[C@H](C)c1ccccc1-n1cccn1	ZINC000177254784	402385907	/nfs/dbraw/zinc/38/59/07/402385907.db2.gz	FAOGBDUQVMACQJ-CQSZACIVSA-N	0	3	300.406	2.391	10	0		DEAEHN
Cc1ccc(C(=O)N2CCCC[C@H](N3CCN(C)CC3)C2)cc1	ZINC000176673125	402327491	/nfs/dbraw/zinc/32/74/91/402327491.db2.gz	LWFRFVFYDPUDAT-SFHVURJKSA-N	0	3	315.461	2.237	10	0		DEAEHN
Cc1ccc(NC(=O)N[C@H](C)CCN2CCN(C)CC2)s1	ZINC000186037468	402397393	/nfs/dbraw/zinc/39/73/93/402397393.db2.gz	XKJLUKLLQMSDIO-GFCCVEGCSA-N	0	3	310.467	2.204	10	0		DEAEHN
CN(C[C@H]1CCCN(C)C1)C(=O)Nc1ccc([S@](C)=O)cc1	ZINC000177454872	402404401	/nfs/dbraw/zinc/40/44/01/402404401.db2.gz	HRCGNBHXJOLXCU-XMHCIUCPSA-N	0	3	323.462	2.230	10	0		DEAEHN
C[C@H](c1ccccc1Cl)N1CCN(C(=O)C(C)(C)N)CC1	ZINC000237394220	402407067	/nfs/dbraw/zinc/40/70/67/402407067.db2.gz	VQCMCJRTIDZNDD-GFCCVEGCSA-N	0	3	309.841	2.283	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCc1sc(C)nc1C	ZINC000177498685	402409464	/nfs/dbraw/zinc/40/94/64/402409464.db2.gz	RHWHPZYWEFKMCV-AWEZNQCLSA-N	0	3	324.494	2.428	10	0		DEAEHN
O[C@H](COC[C@@H]1CCCO1)CN1Cc2ccccc2C2(CC2)C1	ZINC000186212037	402410997	/nfs/dbraw/zinc/41/09/97/402410997.db2.gz	JNKSPNSIJUXNAE-IRXDYDNUSA-N	0	3	317.429	2.090	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCCNc1ccccn1	ZINC000177524513	402412318	/nfs/dbraw/zinc/41/23/18/402412318.db2.gz	SLZDCSAEPCNGPJ-HNNXBMFYSA-N	0	3	319.453	2.009	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1nccn1CC(C)C	ZINC000177545454	402414453	/nfs/dbraw/zinc/41/44/53/402414453.db2.gz	VHZQDAHHVRQWIK-OAHLLOKOSA-N	0	3	321.469	2.165	10	0		DEAEHN
C[C@H]1CN(C(=O)C2(N)CCCC2)C[C@@H](c2ccc(F)cc2)O1	ZINC000237719812	402419185	/nfs/dbraw/zinc/41/91/85/402419185.db2.gz	LMZPAWHWNQNEIL-WFASDCNBSA-N	0	3	306.381	2.386	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)Nc1ccc(F)c(F)c1	ZINC000177699932	402428152	/nfs/dbraw/zinc/42/81/52/402428152.db2.gz	SWRMKKGGAMHCQN-ZDUSSCGKSA-N	0	3	311.376	2.319	10	0		DEAEHN
COc1ccc(F)cc1CC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000186497990	402436398	/nfs/dbraw/zinc/43/63/98/402436398.db2.gz	JJPWDPDXMFUOQA-DOMZBBRYSA-N	0	3	308.397	2.318	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N2CCC[C@H]2Cn2ccnc2)c1	ZINC000177804075	402437943	/nfs/dbraw/zinc/43/79/43/402437943.db2.gz	BBWBQEZJRQNPDV-KRWDZBQOSA-N	0	3	312.417	2.250	10	0		DEAEHN
Cc1nnc(CN2CCN(C3CCCCC3)CC2)n1C1CC1	ZINC000163037113	402439838	/nfs/dbraw/zinc/43/98/38/402439838.db2.gz	IHSWKWIFVHHCMQ-UHFFFAOYSA-N	0	3	303.454	2.372	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)[C@@H](O)c2cc(Cl)cc(Cl)c2)C1	ZINC000163127084	402442340	/nfs/dbraw/zinc/44/23/40/402442340.db2.gz	BOYVIRLOTCBGOW-OLZOCXBDSA-N	0	3	317.216	2.189	10	0		DEAEHN
CN(C)Cc1cc(CNC(=O)[C@@H](N)c2ccccc2)ccc1F	ZINC000237048172	402392962	/nfs/dbraw/zinc/39/29/62/402392962.db2.gz	SYMLQJPZOIVMSE-KRWDZBQOSA-N	0	3	315.392	2.204	10	0		DEAEHN
COc1ccc(OCCCN2CCCC[C@]2(C)C(N)=O)cc1	ZINC000185966368	402393677	/nfs/dbraw/zinc/39/36/77/402393677.db2.gz	SWQCNYKYMVYGIB-QGZVFWFLSA-N	0	3	306.406	2.194	10	0		DEAEHN
CCOCCC1(CNC(=O)N(C)C[C@H]2CCCN2CC)CC1	ZINC000161615399	402393849	/nfs/dbraw/zinc/39/38/49/402393849.db2.gz	VEVKEUKQQFAJFT-OAHLLOKOSA-N	0	3	311.470	2.319	10	0		DEAEHN
CSc1nsc(NC(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)n1	ZINC000246121306	402511509	/nfs/dbraw/zinc/51/15/09/402511509.db2.gz	YOWYYLISMNJBHV-RKDXNWHRSA-N	0	3	315.468	2.110	10	0		DEAEHN
C[C@@H](CNC(=O)NC[C@@H]1CCC(C)(C)O1)N1CCC[C@@H](C)C1	ZINC000186657246	402452368	/nfs/dbraw/zinc/45/23/68/402452368.db2.gz	PYNBIEFPDLDACD-ILXRZTDVSA-N	0	3	311.470	2.364	10	0		DEAEHN
Cc1ccc(CN2CCC[C@H](C(=O)NCC3CC3)C2)c(C)n1	ZINC000186674068	402454119	/nfs/dbraw/zinc/45/41/19/402454119.db2.gz	NCJVCKVOGSXBMS-KRWDZBQOSA-N	0	3	301.434	2.437	10	0		DEAEHN
C[C@H](c1ccccc1)[C@](C)(O)C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000245427372	402459773	/nfs/dbraw/zinc/45/97/73/402459773.db2.gz	VZTMZTUKOFYDFL-LFEHRJTNSA-N	0	3	316.445	2.236	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)c1c[nH]nc1-c1ccc(F)cc1	ZINC000186762516	402462802	/nfs/dbraw/zinc/46/28/02/402462802.db2.gz	QVKFEYPAYFZIKK-UHFFFAOYSA-N	0	3	316.380	2.382	10	0		DEAEHN
COC(=O)[C@H](C)Oc1ccc(CN(C)C[C@H]2CCCO2)cc1	ZINC000245501478	402466730	/nfs/dbraw/zinc/46/67/30/402466730.db2.gz	CVTBRJZVSRWBME-XJKSGUPXSA-N	0	3	307.390	2.238	10	0		DEAEHN
COCC[C@H](Cc1cccc(F)c1)N[C@@H]1CCCn2ncnc21	ZINC000164663406	402466900	/nfs/dbraw/zinc/46/69/00/402466900.db2.gz	JBATXHUNBWUTST-HZPDHXFCSA-N	0	3	318.396	2.490	10	0		DEAEHN
COCc1ccsc1C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000245526941	402468292	/nfs/dbraw/zinc/46/82/92/402468292.db2.gz	PPJOAXBEKLHMKG-GXTWGEPZSA-N	0	3	308.447	2.451	10	0		DEAEHN
CC[C@H](C)Oc1cc(C(=O)N2CCN3CCC[C@H]3C2)ccn1	ZINC000245566638	402471648	/nfs/dbraw/zinc/47/16/48/402471648.db2.gz	RCMGPYFQOCAAHQ-ZFWWWQNUSA-N	0	3	303.406	2.179	10	0		DEAEHN
CC[C@H](CSC)N(C)CC(=O)N1CCO[C@@H]2CCCC[C@H]21	ZINC000245601461	402473952	/nfs/dbraw/zinc/47/39/52/402473952.db2.gz	PEBZNTODGYMDRU-RBSFLKMASA-N	0	3	314.495	2.230	10	0		DEAEHN
CN(C[C@@H]1CCCO1)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000245626616	402475214	/nfs/dbraw/zinc/47/52/14/402475214.db2.gz	GRCOVSNOMGJPPH-YESZJQIVSA-N	0	3	317.433	2.252	10	0		DEAEHN
CCC[C@@H](CN1CC[C@@H](NS(C)(=O)=O)C1)c1ccccc1	ZINC000245634549	402476002	/nfs/dbraw/zinc/47/60/02/402476002.db2.gz	BNXJOHQOLBWNPG-JKSUJKDBSA-N	0	3	310.463	2.194	10	0		DEAEHN
Cc1nnc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)s1	ZINC000245649028	402476678	/nfs/dbraw/zinc/47/66/78/402476678.db2.gz	MIOZWWRYSWYJNG-OLZOCXBDSA-N	0	3	317.418	2.413	10	0		DEAEHN
C[C@@H]1CN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)C[C@H](C)O1	ZINC000245699779	402480902	/nfs/dbraw/zinc/48/09/02/402480902.db2.gz	ZANPUTGZHODSPZ-WTTBNOFXSA-N	0	3	317.433	2.251	10	0		DEAEHN
COCC[C@@](C)(O)CN[C@@H](C)c1ccc(OC)c(NC(C)=O)c1	ZINC000178380744	402491613	/nfs/dbraw/zinc/49/16/13/402491613.db2.gz	DMZBSGQCKHOCJB-YVEFUNNKSA-N	0	3	324.421	2.092	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)[C@H](O)C1CCCCC1	ZINC000187385244	402497418	/nfs/dbraw/zinc/49/74/18/402497418.db2.gz	IWAPLJOYNIGNDG-QZTJIDSGSA-N	0	3	318.461	2.217	10	0		DEAEHN
C[C@H]1CCCN(CCNC(=O)N2CCCC[C@H]2c2cn[nH]c2)C1	ZINC000245961684	402501022	/nfs/dbraw/zinc/50/10/22/402501022.db2.gz	MRBVBYLVGCDDQC-HOCLYGCPSA-N	0	3	319.453	2.378	10	0		DEAEHN
NC(=O)c1ccc(CN(C[C@@H]2CCCO2)[C@H]2CCSC2)cc1	ZINC000245987615	402501938	/nfs/dbraw/zinc/50/19/38/402501938.db2.gz	WIDXNGBZRRDRKQ-HOTGVXAUSA-N	0	3	320.458	2.272	10	0		DEAEHN
CN(Cc1cn(C)nc1-c1ccncc1)C[C@H]1CCCC[C@H]1O	ZINC000246055983	402506058	/nfs/dbraw/zinc/50/60/58/402506058.db2.gz	YSCMWXDLXAQQKW-NVXWUHKLSA-N	0	3	314.433	2.465	10	0		DEAEHN
CC1(C)CC[C@@H](CN[C@@H](Cc2ccc(Cl)cc2)C(N)=O)O1	ZINC000187648298	402507087	/nfs/dbraw/zinc/50/70/87/402507087.db2.gz	NBQKFJTXIFGQIN-KBPBESRZSA-N	0	3	310.825	2.284	10	0		DEAEHN
Cn1ccnc1CC1CCN(C(=O)c2cc(C3CC3)[nH]n2)CC1	ZINC000178539337	402509432	/nfs/dbraw/zinc/50/94/32/402509432.db2.gz	KOZRLOJYIDQETH-UHFFFAOYSA-N	0	3	313.405	2.116	10	0		DEAEHN
C[C@@H]1OCCC[C@H]1C(=O)N(CCN(C)C)Cc1cccc(O)c1	ZINC000189549035	402544606	/nfs/dbraw/zinc/54/46/06/402544606.db2.gz	VSYFQMAZOAMOGB-WMLDXEAASA-N	0	3	320.433	2.098	10	0		DEAEHN
CC[C@@H]1CN(CCc2ccc(F)c(F)c2)CCN1C[C@H](C)O	ZINC000246937573	402550513	/nfs/dbraw/zinc/55/05/13/402550513.db2.gz	WSRZAQCFVOWOJE-DZGCQCFKSA-N	0	3	312.404	2.284	10	0		DEAEHN
CCOc1cc(NC(=O)N2CC[C@H](N(C)C)C2)ccc1OC	ZINC000171078514	402555281	/nfs/dbraw/zinc/55/52/81/402555281.db2.gz	UIDPMYQLHVNSIJ-ZDUSSCGKSA-N	0	3	307.394	2.262	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCC[C@@H]2CCC[C@H]21	ZINC000247069250	402555726	/nfs/dbraw/zinc/55/57/26/402555726.db2.gz	YFNOKXGOEWPRAH-ARFHVFGLSA-N	0	3	309.454	2.071	10	0		DEAEHN
CC(C)Oc1cccc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)n1	ZINC000247155626	402558750	/nfs/dbraw/zinc/55/87/50/402558750.db2.gz	XMDKUOKXXWFTHS-KBPBESRZSA-N	0	3	303.406	2.178	10	0		DEAEHN
COc1ccc(CN2CCN(C[C@@H](C)O)[C@H](C)C2)cc1Cl	ZINC000178991405	402562918	/nfs/dbraw/zinc/56/29/18/402562918.db2.gz	CIGIRVVSYFZUOV-CHWSQXEVSA-N	0	3	312.841	2.236	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000247322333	402563546	/nfs/dbraw/zinc/56/35/46/402563546.db2.gz	OSGGYDRUBCVPIQ-FZMZJTMJSA-N	0	3	319.380	2.093	10	0		DEAEHN
C[C@@H](CNC(=O)NC[C@@H]1CCCN1C)COCc1ccccc1	ZINC000171191223	402565482	/nfs/dbraw/zinc/56/54/82/402565482.db2.gz	MQZFHAXUJGOVHY-RDJZCZTQSA-N	0	3	319.449	2.233	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)[C@@H]1CCC[C@@H](C)C1	ZINC000247480865	402568840	/nfs/dbraw/zinc/56/88/40/402568840.db2.gz	JKSRDJIFHCOFRR-BZUAXINKSA-N	0	3	311.470	2.317	10	0		DEAEHN
C[C@@H]1CN(C(=O)CN(C[C@H]2CCCO2)C2CCCC2)C[C@@H](C)O1	ZINC000247523041	402571385	/nfs/dbraw/zinc/57/13/85/402571385.db2.gz	NOJDMJIVNVAAQT-BFYDXBDKSA-N	0	3	324.465	2.046	10	0		DEAEHN
Cc1c([O-])ccc2c(CN3CC[N@@H+]4CCC[C@@H]4C3)cc(=O)oc12	ZINC000178627264	402519127	/nfs/dbraw/zinc/51/91/27/402519127.db2.gz	SUVCRSLRLLWOIH-CQSZACIVSA-N	0	3	314.385	2.087	10	0		DEAEHN
Cc1c([O-])ccc2c(CN3CC[N@H+]4CCC[C@@H]4C3)cc(=O)oc12	ZINC000178627264	402519129	/nfs/dbraw/zinc/51/91/29/402519129.db2.gz	SUVCRSLRLLWOIH-CQSZACIVSA-N	0	3	314.385	2.087	10	0		DEAEHN
O=C(CN1CCN2CCC[C@@H]2C1)N[C@H](c1ccccc1)C1CC1	ZINC000178641934	402520637	/nfs/dbraw/zinc/52/06/37/402520637.db2.gz	PCVNFSGQSUILJY-IEBWSBKVSA-N	0	3	313.445	2.034	10	0		DEAEHN
COC(C)(C)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1	ZINC000178676228	402525234	/nfs/dbraw/zinc/52/52/34/402525234.db2.gz	AZZZVXJVMVKPDD-CYBMUJFWSA-N	0	3	305.422	2.148	10	0		DEAEHN
COc1ccc([C@@H](NC(=O)N2CC[C@@H](N(C)C)C2)C2CC2)cc1	ZINC000170827497	402529642	/nfs/dbraw/zinc/52/96/42/402529642.db2.gz	HIIWSQQHYPUSJR-WBVHZDCISA-N	0	3	317.433	2.492	10	0		DEAEHN
Cc1cccc(C)c1OCCNC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170831492	402530542	/nfs/dbraw/zinc/53/05/42/402530542.db2.gz	KOJKDHVRIVHAQI-OAHLLOKOSA-N	0	3	305.422	2.028	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCC(C)(C)c2ccccc2F)C1	ZINC000170836049	402531680	/nfs/dbraw/zinc/53/16/80/402531680.db2.gz	IDBWMSHGVFTETJ-ZDUSSCGKSA-N	0	3	307.413	2.449	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)CC2(CC(=O)OC)CCCC2)C1	ZINC000189176959	402531889	/nfs/dbraw/zinc/53/18/89/402531889.db2.gz	GZFATOXMHWQIHN-AWEZNQCLSA-N	0	3	310.438	2.101	10	0		DEAEHN
CCCCc1ccc(NC(=O)C(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170845306	402532058	/nfs/dbraw/zinc/53/20/58/402532058.db2.gz	KLLOPUFUYTWXFI-MRXNPFEDSA-N	0	3	317.433	2.130	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NC[C@@H](O)C1CCCCC1	ZINC000170840182	402532191	/nfs/dbraw/zinc/53/21/91/402532191.db2.gz	YQUJCJSZPDCVBY-HZPDHXFCSA-N	0	3	313.486	2.203	10	0		DEAEHN
Cc1oc(-c2cccs2)nc1CC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170867886	402535834	/nfs/dbraw/zinc/53/58/34/402535834.db2.gz	WUBQPGABRVKJMM-GFCCVEGCSA-N	0	3	319.430	2.417	10	0		DEAEHN
Cc1cnn(CCC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c1	ZINC000248062436	402581445	/nfs/dbraw/zinc/58/14/45/402581445.db2.gz	PFXFXOWFZRSZGE-AEFFLSMTSA-N	0	3	312.417	2.143	10	0		DEAEHN
CCN(CC(C)(C)O)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248145710	402583302	/nfs/dbraw/zinc/58/33/02/402583302.db2.gz	ZOEFJBZHTBQPRM-CVEARBPZSA-N	0	3	319.449	2.234	10	0		DEAEHN
CCN(CC(=O)NC(C)(C)C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000179552901	402594688	/nfs/dbraw/zinc/59/46/88/402594688.db2.gz	GEHSUIUSKYNYHK-QGZVFWFLSA-N	0	3	317.477	2.498	10	0		DEAEHN
Cc1c(C(=O)N2CCN3CCC[C@@H]3C2)cnn1-c1ccccc1	ZINC000171585500	402597950	/nfs/dbraw/zinc/59/79/50/402597950.db2.gz	XYZXKQBJXFNQAP-MRXNPFEDSA-N	0	3	310.401	2.101	10	0		DEAEHN
CN1CCN(CCCNCc2cocn2)[C@@H](c2ccccc2)C1	ZINC000248683795	402603368	/nfs/dbraw/zinc/60/33/68/402603368.db2.gz	XWQLCKZFYOHMOG-GOSISDBHSA-N	0	3	314.433	2.143	10	0		DEAEHN
CCN(C(=O)[C@H](C)NCCn1cc(C)cn1)C1CCCCC1	ZINC000171632904	402603858	/nfs/dbraw/zinc/60/38/58/402603858.db2.gz	VZJUKSAESNNBPQ-HNNXBMFYSA-N	0	3	306.454	2.351	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCCc1ccccc1O	ZINC000171633499	402603902	/nfs/dbraw/zinc/60/39/02/402603902.db2.gz	DETXDYVVKGDENB-HNNXBMFYSA-N	0	3	307.438	2.210	10	0		DEAEHN
CN(C[C@H](O)COCc1ccccc1)C[C@@H](O)CC1CCCC1	ZINC000190542358	402608433	/nfs/dbraw/zinc/60/84/33/402608433.db2.gz	RNQVFVJLLHDTCK-OALUTQOASA-N	0	3	321.461	2.437	10	0		DEAEHN
CC[C@H](O)CN1CCN(C[C@H](C)c2ccc(OC)cc2)CC1	ZINC000180163574	402609186	/nfs/dbraw/zinc/60/91/86/402609186.db2.gz	GHJZZDSKBVDTOA-RDJZCZTQSA-N	0	3	306.450	2.187	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000248885248	402612919	/nfs/dbraw/zinc/61/29/19/402612919.db2.gz	UJDOOYRWSJCWFL-KBAYOESNSA-N	0	3	316.445	2.440	10	0		DEAEHN
C[C@H]1CN(C(=O)NCc2cccc(CN(C)C)c2)CCS1	ZINC000171734424	402616483	/nfs/dbraw/zinc/61/64/83/402616483.db2.gz	ZXACQUVJIIATHL-ZDUSSCGKSA-N	0	3	307.463	2.395	10	0		DEAEHN
CCC(CC)n1nc(C)cc1C(=O)N1CCN2CCC[C@H]2C1	ZINC000180472400	402617524	/nfs/dbraw/zinc/61/75/24/402617524.db2.gz	ZTQAOJHLDUYRCD-HNNXBMFYSA-N	0	3	304.438	2.473	10	0		DEAEHN
CCn1cc([C@@H](C)N[C@H]2CCc3nnc(C(C)C)n3C2)cn1	ZINC000180535866	402619707	/nfs/dbraw/zinc/61/97/07/402619707.db2.gz	KSRQWBZHUKEVRW-OCCSQVGLSA-N	0	3	302.426	2.284	10	0		DEAEHN
COCCN1CCC[C@@H]1CN[C@@H](c1ncc[nH]1)c1ccccc1	ZINC000249182773	402622864	/nfs/dbraw/zinc/62/28/64/402622864.db2.gz	JBROTAPHLLFFGL-IAGOWNOFSA-N	0	3	314.433	2.200	10	0		DEAEHN
O=C(Nc1cnc(-c2ccccc2)nc1)N1CCN2CCC[C@@H]2C1	ZINC000171807313	402624069	/nfs/dbraw/zinc/62/40/69/402624069.db2.gz	HDSKLLORAXGQKA-MRXNPFEDSA-N	0	3	323.400	2.456	10	0		DEAEHN
COc1cccc(CN2CCC(Cc3nccn3C)CC2)n1	ZINC000171828914	402626461	/nfs/dbraw/zinc/62/64/61/402626461.db2.gz	LMFSDMIROXXUOM-UHFFFAOYSA-N	0	3	300.406	2.278	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(C(=O)CN(CC)C2CC2)C1	ZINC000179168847	402577786	/nfs/dbraw/zinc/57/77/86/402577786.db2.gz	AHWSDBXHUYMUFT-HNNXBMFYSA-N	0	3	304.438	2.093	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)NC[C@H]1Cc2ccccc21	ZINC000249686425	402638257	/nfs/dbraw/zinc/63/82/57/402638257.db2.gz	IKBFJBSECKREKX-GOEBONIOSA-N	0	3	301.434	2.500	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc2c(c1)OCCCO2	ZINC000172060400	402638664	/nfs/dbraw/zinc/63/86/64/402638664.db2.gz	IWEPYBRWNZDQID-UKRRQHHQSA-N	0	3	316.401	2.157	10	0		DEAEHN
Cc1nc(C[C@H]2CCCN(C[C@@H](O)c3ccccc3)C2)no1	ZINC000249873937	402643090	/nfs/dbraw/zinc/64/30/90/402643090.db2.gz	LBBZJJGHHZJKPL-GDBMZVCRSA-N	0	3	301.390	2.366	10	0		DEAEHN
C[C@H]1OCCC[C@@H]1C(=O)NCc1cccc(OCCN(C)C)c1	ZINC000191140211	402644902	/nfs/dbraw/zinc/64/49/02/402644902.db2.gz	DZNYVETZJSEGQG-PBHICJAKSA-N	0	3	320.433	2.058	10	0		DEAEHN
Cc1ccc2c(n1)OCCN2C(=O)c1cccc(CN(C)C)c1	ZINC000181602332	402651388	/nfs/dbraw/zinc/65/13/88/402651388.db2.gz	LVDVXWLEXMKUTH-UHFFFAOYSA-N	0	3	311.385	2.491	10	0		DEAEHN
C[C@H]1CC[C@@H](C(N)=O)CN1CCOc1ccc(Cl)c(F)c1	ZINC000191993016	402703331	/nfs/dbraw/zinc/70/33/31/402703331.db2.gz	VSITUUYQNBIKEP-WDEREUQCSA-N	0	3	314.788	2.444	10	0		DEAEHN
C[C@@H](NCC(=O)N1CCNC1=O)c1ccc(C(C)(C)C)cc1	ZINC000182608696	402703543	/nfs/dbraw/zinc/70/35/43/402703543.db2.gz	YMLREEJWZOPWKX-GFCCVEGCSA-N	0	3	303.406	2.187	10	0		DEAEHN
CCOc1ncccc1CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000173779882	402712426	/nfs/dbraw/zinc/71/24/26/402712426.db2.gz	AGNWKLBWFRILHJ-HIFRSBDPSA-N	0	3	320.437	2.104	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC/C=C\c1ccccc1	ZINC000255005710	402675196	/nfs/dbraw/zinc/67/51/96/402675196.db2.gz	MPFCCUWGXPHMAH-VWTAQGJOSA-N	0	3	317.433	2.110	10	0		DEAEHN
Clc1ccc(OCCN2CC[C@@H](N3CCOCC3)C2)cc1	ZINC000173931988	402720218	/nfs/dbraw/zinc/72/02/18/402720218.db2.gz	AIYDJBNDIAHLOJ-OAHLLOKOSA-N	0	3	310.825	2.125	10	0		DEAEHN
CC[C@H]1CN(CCCc2ccccc2OC)CCN1C[C@@H](C)O	ZINC000182441094	402690126	/nfs/dbraw/zinc/69/01/26/402690126.db2.gz	RJNVQVSKRYUOEF-AEFFLSMTSA-N	0	3	320.477	2.405	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCOc2ccccc2)CCN1C	ZINC000173366471	402694419	/nfs/dbraw/zinc/69/44/19/402694419.db2.gz	PAEAGZFPTCVBOD-CABCVRRESA-N	0	3	305.422	2.190	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H](C)CN(C)Cc1ccccc1)N(C)C	ZINC000182533675	402697712	/nfs/dbraw/zinc/69/77/12/402697712.db2.gz	STMGEKXDADZKKP-WBVHZDCISA-N	0	3	305.466	2.353	10	0		DEAEHN
C[C@@H]1CC[C@H](C(N)=O)CN1CCOc1ccc(Cl)c(F)c1	ZINC000191992996	402703043	/nfs/dbraw/zinc/70/30/43/402703043.db2.gz	VSITUUYQNBIKEP-MNOVXSKESA-N	0	3	314.788	2.444	10	0		DEAEHN
CC(C)c1cnc(NC(=O)N2CCO[C@@H](CN(C)C)C2)s1	ZINC000192395225	402727028	/nfs/dbraw/zinc/72/70/28/402727028.db2.gz	PLXXRZRUVXSWPP-NSHDSACASA-N	0	3	312.439	2.061	10	0		DEAEHN
CC[C@@H](O)CN1CCN(CCSCc2ccccc2)CC1	ZINC000192604843	402739806	/nfs/dbraw/zinc/73/98/06/402739806.db2.gz	XKSVCAYUIQRKGD-QGZVFWFLSA-N	0	3	308.491	2.308	10	0		DEAEHN
CCCOc1ccc(CNC(=O)CN[C@H](C)[C@H]2CCCO2)cc1	ZINC000183138621	402742279	/nfs/dbraw/zinc/74/22/79/402742279.db2.gz	MDYGCSMXTCAVSD-RHSMWYFYSA-N	0	3	320.433	2.249	10	0		DEAEHN
Cc1ccc(SCc2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263265592	402751959	/nfs/dbraw/zinc/75/19/59/402751959.db2.gz	RLWMEASHINFMFV-ZDUSSCGKSA-N	0	3	304.419	2.246	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2ccc(OCC3CC3)cc2)n1	ZINC000263276844	402753194	/nfs/dbraw/zinc/75/31/94/402753194.db2.gz	SYHZFMJDWPKRBS-HNNXBMFYSA-N	0	3	314.389	2.102	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(Cc2ccc3ccccc3c2)n1	ZINC000263305536	402756882	/nfs/dbraw/zinc/75/68/82/402756882.db2.gz	XUIFSHNVRFXQLO-MRXNPFEDSA-N	0	3	308.385	2.390	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2c(C3CC3)nc3sccn23)CCO1	ZINC000183399217	402763266	/nfs/dbraw/zinc/76/32/66/402763266.db2.gz	AQUYQGPCNSPNNT-CYBMUJFWSA-N	0	3	320.462	2.036	10	0		DEAEHN
Cc1cnc([C@@H](C)NC(=O)N2CC[C@H](N3CC=CC3)C2)s1	ZINC000174922568	402763564	/nfs/dbraw/zinc/76/35/64/402763564.db2.gz	ZQXZPQOHKQCTLA-OLZOCXBDSA-N	0	3	306.435	2.168	10	0		DEAEHN
COC(=O)c1ccc(NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1	ZINC000175000366	402770206	/nfs/dbraw/zinc/77/02/06/402770206.db2.gz	GWXVOZNAQUFPQQ-IUODEOHRSA-N	0	3	319.405	2.420	10	0		DEAEHN
CC(C)Cc1nnc([N-]C(=O)c2c[nH+]ccc2N(C)C)s1	ZINC000183530350	402773950	/nfs/dbraw/zinc/77/39/50/402773950.db2.gz	QSOUXDAVZXRRSB-UHFFFAOYSA-N	0	3	305.407	2.450	10	0		DEAEHN
O=C(NCCOC1CCCCCC1)N1CC[C@H](N2CC=CC2)C1	ZINC000175056818	402775336	/nfs/dbraw/zinc/77/53/36/402775336.db2.gz	KYAKFUHIEIYCKI-INIZCTEOSA-N	0	3	321.465	2.382	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)/C=C/c2ccc(OC)c(OC)c2)C1	ZINC000193687645	402775346	/nfs/dbraw/zinc/77/53/46/402775346.db2.gz	IOOCDQOVUZDFOV-TUPIDYKKSA-N	0	3	318.417	2.318	10	0		DEAEHN
CCc1ccc([C@@H](CN2CCOCC2)N[C@H]2CCCOC2)cc1	ZINC000183563507	402776292	/nfs/dbraw/zinc/77/62/92/402776292.db2.gz	XNIFQARHTAVSFC-RBUKOAKNSA-N	0	3	318.461	2.391	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000194340739	402792754	/nfs/dbraw/zinc/79/27/54/402792754.db2.gz	UJQBUQAGVSMXHH-HNNXBMFYSA-N	0	3	317.437	2.288	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(C(=O)CCC3CCC3)C2)CC1	ZINC000175407105	402804348	/nfs/dbraw/zinc/80/43/48/402804348.db2.gz	LHAGNSSOWBTZBC-QGZVFWFLSA-N	0	3	307.482	2.195	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Cc2c(C)nn(CC(C)C)c2C)C1	ZINC000194641783	402807161	/nfs/dbraw/zinc/80/71/61/402807161.db2.gz	LYOCYBAEVDSNMM-INIZCTEOSA-N	0	3	320.481	2.299	10	0		DEAEHN
CCN1CCN(CCCCNC(=O)N2C[C@H](C)CC[C@@H]2C)CC1	ZINC000175531874	402815350	/nfs/dbraw/zinc/81/53/50/402815350.db2.gz	QUPZZQKSDXSOIF-SJORKVTESA-N	0	3	324.513	2.234	10	0		DEAEHN
COc1ccnc(NC2CCN(C[C@@H]3CCC=CO3)CC2)n1	ZINC000194841314	402818176	/nfs/dbraw/zinc/81/81/76/402818176.db2.gz	RBQFPRFNIPRIJT-AWEZNQCLSA-N	0	3	304.394	2.054	10	0		DEAEHN
CC(C)CN1CCN(Cc2ccc3c(c2)sc(=O)n3C)CC1	ZINC000194975316	402825163	/nfs/dbraw/zinc/82/51/63/402825163.db2.gz	MIXRORUWLSDYQB-UHFFFAOYSA-N	0	3	319.474	2.374	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)CC[N@@H+]1C	ZINC000175191557	402786544	/nfs/dbraw/zinc/78/65/44/402786544.db2.gz	YSWATNWQTYDCEG-WCQYABFASA-N	0	3	309.385	2.155	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)CC[N@H+]1C	ZINC000175191557	402786547	/nfs/dbraw/zinc/78/65/47/402786547.db2.gz	YSWATNWQTYDCEG-WCQYABFASA-N	0	3	309.385	2.155	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N[C@@H]1COc2ccccc2C1	ZINC000194191780	402787655	/nfs/dbraw/zinc/78/76/55/402787655.db2.gz	FDIYVHRYIHPQJP-HOTGVXAUSA-N	0	3	319.449	2.266	10	0		DEAEHN
C[C@@H](O)CN1CCN(c2ncnc3cc(Cl)ccc32)C[C@@H]1C	ZINC000264353951	402870741	/nfs/dbraw/zinc/87/07/41/402870741.db2.gz	STGBAFBBYNQXQY-NWDGAFQWSA-N	0	3	320.824	2.175	10	0		DEAEHN
O=C(CN1CCC[C@@H]1[C@H]1CCCC[C@H]1O)NCc1ccccc1	ZINC000281310468	403063412	/nfs/dbraw/zinc/06/34/12/403063412.db2.gz	HZQSIGBWJQPRFL-KZNAEPCWSA-N	0	3	316.445	2.318	10	0		DEAEHN
COc1ccc(NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c(C)n1	ZINC000268344807	403075289	/nfs/dbraw/zinc/07/52/89/403075289.db2.gz	HISTYSPYGCULTO-DGCLKSJQSA-N	0	3	306.410	2.345	10	0		DEAEHN
Cn1cccc1CN[C@H]1CCCC[C@H]1n1cc(C(C)(C)O)nn1	ZINC000276288009	403161014	/nfs/dbraw/zinc/16/10/14/403161014.db2.gz	HCETXFTWYCNZJL-LSDHHAIUSA-N	0	3	317.437	2.118	10	0		DEAEHN
c1c(CN[C@H]2CCCN(c3ccccc3)C2)nc2ncccn12	ZINC000298530139	403405797	/nfs/dbraw/zinc/40/57/97/403405797.db2.gz	SAHQOXCMLGMXBY-HNNXBMFYSA-N	0	3	307.401	2.488	10	0		DEAEHN
C/C(=C\c1ccc(Cl)cc1)CNCC(=O)N1CCOCC1	ZINC000345706809	403446235	/nfs/dbraw/zinc/44/62/35/403446235.db2.gz	MLOSRBXRNXUCQU-JLHYYAGUSA-N	0	3	308.809	2.192	10	0		DEAEHN
CCN1CCC[C@@H](Nc2nc(C(F)(F)F)nc3nc[nH]c32)C1	ZINC000301102754	403589873	/nfs/dbraw/zinc/58/98/73/403589873.db2.gz	SAKYNGVXPQTTHR-MRVPVSSYSA-N	0	3	314.315	2.268	10	0		DEAEHN
Cn1cncc1CN[C@H]1CCO[C@@H]1c1nccn1-c1ccccc1	ZINC000343398268	403570330	/nfs/dbraw/zinc/57/03/30/403570330.db2.gz	JLQZUPIDUHMRCD-IRXDYDNUSA-N	0	3	323.400	2.226	10	0		DEAEHN
CCCCc1nc(CN2CC[C@]3(OC)CC[C@H](O)C[C@H]23)c[nH]1	ZINC000299787551	403576172	/nfs/dbraw/zinc/57/61/72/403576172.db2.gz	OZLHZCBYWGIGEF-YQQAZPJKSA-N	0	3	307.438	2.257	10	0		DEAEHN
CCCCc1ncc(CN2CC[C@]3(OC)CC[C@H](O)C[C@H]23)[nH]1	ZINC000299787551	403576178	/nfs/dbraw/zinc/57/61/78/403576178.db2.gz	OZLHZCBYWGIGEF-YQQAZPJKSA-N	0	3	307.438	2.257	10	0		DEAEHN
CN1CCO[C@@H]2CN(c3ccnc4cc(Cl)ccc43)C[C@H]21	ZINC000301661246	403660762	/nfs/dbraw/zinc/66/07/62/403660762.db2.gz	MSAYLTYGPLSKAJ-HZPDHXFCSA-N	0	3	303.793	2.407	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2ccc3cc[nH]c(=O)c3c2)C1	ZINC000333359424	403733683	/nfs/dbraw/zinc/73/36/83/403733683.db2.gz	GXUUMPVEHQBSFY-ZDUSSCGKSA-N	0	3	300.362	2.108	10	0		DEAEHN
CC(=O)N[C@@H](C(=O)NCCN1[C@H](C)CCC[C@@H]1C)C1CCCC1	ZINC000341062672	403756407	/nfs/dbraw/zinc/75/64/07/403756407.db2.gz	CLBINWFCUSZENL-JKIFEVAISA-N	0	3	323.481	2.060	10	0		DEAEHN
C(CCN1CCO[C@H](C2CC2)C1)CCN1CCO[C@H](C2CC2)C1	ZINC000368793084	403861028	/nfs/dbraw/zinc/86/10/28/403861028.db2.gz	RUVBOJKTPNZLIZ-OALUTQOASA-N	0	3	322.493	2.378	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)N(C)[C@@H]2CN3CCC2CC3)cc1	ZINC000320489128	404067166	/nfs/dbraw/zinc/06/71/66/404067166.db2.gz	CHOOGMNDFWAXEM-MRXNPFEDSA-N	0	3	301.390	2.447	10	0		DEAEHN
C[C@@H]1CCN(CC(=O)N2CCC[C@@H](C(N)=O)C2)CC12CCC2	ZINC000329157357	404248784	/nfs/dbraw/zinc/24/87/84/404248784.db2.gz	WFSBXTRYFVUDGS-ZIAGYGMSSA-N	0	3	307.438	2.272	10	0		DEAEHN
Cn1nccc1[C@@H]1CCC[C@H](NCc2nnc3ccccn32)C1	ZINC000363923429	404253589	/nfs/dbraw/zinc/25/35/89/404253589.db2.gz	GUKAJKACEGJKLP-KGLIPLIRSA-N	0	3	310.405	2.279	10	0		DEAEHN
Cc1nc([C@@H]2CCCN2C(=O)[C@H](C)N2CCCCCC2)no1	ZINC000329416626	404331503	/nfs/dbraw/zinc/33/15/03/404331503.db2.gz	ZGRDBTCWEVIDKQ-JSGCOSHPSA-N	0	3	306.410	2.306	10	0		DEAEHN
Cn1cc(C[C@@H]2CCN(Cc3ccc4c(c3)OCCO4)C2)cn1	ZINC000370013040	404304920	/nfs/dbraw/zinc/30/49/20/404304920.db2.gz	VPHMIQXCVSHTMV-HNNXBMFYSA-N	0	3	313.401	2.256	10	0		DEAEHN
CC(C)[C@H](C(=O)N1CCC[C@@H](c2nnc[n-]2)C1)[NH+]1CCCCC1	ZINC000364090273	404315763	/nfs/dbraw/zinc/31/57/63/404315763.db2.gz	QXGRTPPQLAWZIW-HUUCEWRRSA-N	0	3	319.453	2.021	10	0		DEAEHN
C[C@H]1CCN(c2cncc3nncn32)CCN1Cc1ccccc1	ZINC000364683582	404500196	/nfs/dbraw/zinc/50/01/96/404500196.db2.gz	SWKFSRVAVGKXGW-HNNXBMFYSA-N	0	3	322.416	2.225	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNCCN1CCCCCC1	ZINC000291944446	404592232	/nfs/dbraw/zinc/59/22/32/404592232.db2.gz	NODXWAUPXJXJMB-UHFFFAOYSA-N	0	3	313.449	2.292	10	0		DEAEHN
c1ccc(CN2CC[C@H](N3CCO[C@@]4(CCCOC4)C3)C2)cc1	ZINC000297285852	404533857	/nfs/dbraw/zinc/53/38/57/404533857.db2.gz	ACTSGTHRVZVUGL-OALUTQOASA-N	0	3	316.445	2.142	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@@H]1CCC[C@@H]2OCC[C@@H]21	ZINC000291895442	404570017	/nfs/dbraw/zinc/57/00/17/404570017.db2.gz	IKQIDISSUOPOGG-KURKYZTESA-N	0	3	312.417	2.374	10	0		DEAEHN
CCn1cc(CCN2CC[C@H](c3nc(C4CC4)no3)C2)cn1	ZINC000375701871	404730655	/nfs/dbraw/zinc/73/06/55/404730655.db2.gz	PXXDODSBDGOTIV-AWEZNQCLSA-N	0	3	301.394	2.195	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)N[C@@H]2CNCCC2(F)F)cc1C	ZINC000415374977	404855111	/nfs/dbraw/zinc/85/51/11/404855111.db2.gz	KYRBDAFSJHJAMC-CYBMUJFWSA-N	0	3	311.332	2.316	10	0		DEAEHN
Cn1nccc1[C@H]1CCCCN1CCC(=O)NC1CCCC1	ZINC000366868445	404861187	/nfs/dbraw/zinc/86/11/87/404861187.db2.gz	MCFTVNMUCVHOOB-MRXNPFEDSA-N	0	3	304.438	2.396	10	0		DEAEHN
Cn1nccc1[C@@H]1CCCCN1CCC(=O)NC1CCCC1	ZINC000366868443	404861285	/nfs/dbraw/zinc/86/12/85/404861285.db2.gz	MCFTVNMUCVHOOB-INIZCTEOSA-N	0	3	304.438	2.396	10	0		DEAEHN
C[C@H](C[S@](C)=O)NCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000361270244	405001590	/nfs/dbraw/zinc/00/15/90/405001590.db2.gz	DKYKNLUIOMORJR-GTJPDFRWSA-N	0	3	311.447	2.499	10	0		DEAEHN
CC(C)C[C@@H](C)C(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000361209611	404974816	/nfs/dbraw/zinc/97/48/16/404974816.db2.gz	HFLCSJJNTAWFNY-APWZRJJASA-N	0	3	318.461	2.422	10	0		DEAEHN
Cc1cc(CNC[C@@H]2CN(Cc3ccccc3)CCCO2)on1	ZINC000390702589	405047741	/nfs/dbraw/zinc/04/77/41/405047741.db2.gz	FJJGQNSVBHFOSM-GOSISDBHSA-N	0	3	315.417	2.364	10	0		DEAEHN
C[NH+](C)C[C@@H]1CCN(C(=O)c2ccc3c(c2[O-])OC(C)(C)C3)C1	ZINC000408405274	405196926	/nfs/dbraw/zinc/19/69/26/405196926.db2.gz	CIRPBMBJIFLYIA-LBPRGKRZSA-N	0	3	318.417	2.129	10	0		DEAEHN
FC(F)(F)C1CCC(CN2CCN3CCOC[C@@H]3C2)CC1	ZINC000368399442	405239513	/nfs/dbraw/zinc/23/95/13/405239513.db2.gz	JSXNGSRGBWEJNN-RUXDESIVSA-N	0	3	306.372	2.372	10	0		DEAEHN
COc1cccc(C2=CCN(C(=O)NC[C@H](C)N(C)C)CC2)c1	ZINC000455443427	405410470	/nfs/dbraw/zinc/41/04/70/405410470.db2.gz	QBXGDPLCSCMPEF-AWEZNQCLSA-N	0	3	317.433	2.444	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)N(C)[C@@H]1CCN(C(C)C)C1	ZINC000458810917	405604144	/nfs/dbraw/zinc/60/41/44/405604144.db2.gz	AUNNYNGTUKSFOD-CYBMUJFWSA-N	0	3	308.426	2.170	10	0		DEAEHN
O=C(NCCNc1ccncc1)NCC1CCC(F)(F)CC1	ZINC000560931992	405879732	/nfs/dbraw/zinc/87/97/32/405879732.db2.gz	AIWMMGQMGDPEQN-UHFFFAOYSA-N	0	3	312.364	2.040	10	0		DEAEHN
CS(=O)(=O)NCC1CCN(Cc2ccc(C3CC3)cc2)CC1	ZINC000459543043	405949517	/nfs/dbraw/zinc/94/95/17/405949517.db2.gz	KQUFGYMOVVYMDT-UHFFFAOYSA-N	0	3	322.474	2.325	10	0		DEAEHN
CCOC(=O)[C@H]1CN(c2ccnc3ccccc32)CC12COC2	ZINC000450573516	405960793	/nfs/dbraw/zinc/96/07/93/405960793.db2.gz	XHIQOPFLVRZEBL-CQSZACIVSA-N	0	3	312.369	2.251	10	0		DEAEHN
COC(=O)C[C@H](NC(=O)CC1CCN(C)CC1)c1cccs1	ZINC000612423277	405917930	/nfs/dbraw/zinc/91/79/30/405917930.db2.gz	AQZHRPMZYSJPFP-ZDUSSCGKSA-N	0	3	324.446	2.200	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@@H](COC)Cc1ccccc1	ZINC000471696712	406109872	/nfs/dbraw/zinc/10/98/72/406109872.db2.gz	JJLYFOCVPICICW-IAGOWNOFSA-N	0	3	304.434	2.235	10	0		DEAEHN
CC1(C)CN(C[C@H](O)COC[C@@H]2CCCO2)Cc2ccccc21	ZINC000534668169	406194156	/nfs/dbraw/zinc/19/41/56/406194156.db2.gz	MLTDSDIZVCZMCX-IRXDYDNUSA-N	0	3	319.445	2.336	10	0		DEAEHN
C[C@@H]1CCC[C@@H](NC(=O)[C@H](N)CN(C)Cc2ccccc2)C1	ZINC000637919261	406477384	/nfs/dbraw/zinc/47/73/84/406477384.db2.gz	RIFCFJOWDJYYJH-DJIMGWMZSA-N	0	3	303.450	2.141	10	0		DEAEHN
CN(C)CCN(CC(=O)OC(C)(C)C)C(=O)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC000525312604	406485208	/nfs/dbraw/zinc/48/52/08/406485208.db2.gz	GFNADCAUYSGQBX-FOLVSLTJSA-N	0	3	324.465	2.155	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N1CCC[C@@H]1C1CCC1	ZINC000637968961	406500991	/nfs/dbraw/zinc/50/09/91/406500991.db2.gz	CUMCNYZDJKZNHD-QZTJIDSGSA-N	0	3	315.461	2.237	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N[C@@H]1CCCC1(C)C	ZINC000638004686	406518980	/nfs/dbraw/zinc/51/89/80/406518980.db2.gz	FBTJIQGOVODXMO-JKSUJKDBSA-N	0	3	303.450	2.141	10	0		DEAEHN
CC[C@H](NC[C@@H]1CCC2(CCOCC2)[C@H]1O)c1ccn(C)n1	ZINC000549625103	406589518	/nfs/dbraw/zinc/58/95/18/406589518.db2.gz	HKEFNZFSDBIYIZ-DZKIICNBSA-N	0	3	307.438	2.029	10	0		DEAEHN
C[C@@H]1C[C@H](c2cccnc2)N(C[C@H](O)COC[C@@H]2CCCO2)C1	ZINC000554264185	406790095	/nfs/dbraw/zinc/79/00/95/406790095.db2.gz	NGNAAIGUDLZANV-LAVFITLUSA-N	0	3	320.433	2.021	10	0		DEAEHN
OCc1sc(N2CC[C@@H](N3CCCCC3)C2)nc1Cl	ZINC000129121373	196021200	/nfs/dbraw/zinc/02/12/00/196021200.db2.gz	WGOIEAPILBJHBU-SNVBAGLBSA-N	0	3	301.843	2.353	10	0		DEAEHN
CN1CCO[C@@H](CNCc2cc(F)cc(C(F)(F)F)c2)C1	ZINC000129458166	196050392	/nfs/dbraw/zinc/05/03/92/196050392.db2.gz	VESVACWWVIOEGK-ZDUSSCGKSA-N	0	3	306.303	2.265	10	0		DEAEHN
COc1ccc(C(N)=S)c(N2CCN(C(C)(C)C)CC2)c1	ZINC000130559865	196090485	/nfs/dbraw/zinc/09/04/85/196090485.db2.gz	OAUADUJMWMGWTE-UHFFFAOYSA-N	0	3	307.463	2.250	10	0		DEAEHN
Cc1nc(-c2ccccc2)ncc1C(=O)NC[C@@H]1CCCN1C	ZINC000130704440	196102820	/nfs/dbraw/zinc/10/28/20/196102820.db2.gz	DKCIYVGZTBZHLG-HNNXBMFYSA-N	0	3	310.401	2.276	10	0		DEAEHN
CNc1ncc(Br)c(N[C@H](CN(C)C)C(C)C)n1	ZINC000130977357	196128301	/nfs/dbraw/zinc/12/83/01/196128301.db2.gz	VXJAUJIRLRTBDU-SNVBAGLBSA-N	0	3	316.247	2.279	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1C1(O)CCCCC1	ZINC000131179163	196147585	/nfs/dbraw/zinc/14/75/85/196147585.db2.gz	AKSPNABWRKHLQW-UHFFFAOYSA-N	0	3	316.243	2.359	10	0		DEAEHN
CNCc1cccc(S(=O)(=O)NCCCC(F)(F)F)c1C	ZINC000131228981	196150979	/nfs/dbraw/zinc/15/09/79/196150979.db2.gz	AXSXKOJMNNYVHI-UHFFFAOYSA-N	0	3	324.368	2.335	10	0		DEAEHN
CNCc1cccc(S(=O)(=O)NCCCCC(F)(F)F)c1	ZINC000131246524	196153601	/nfs/dbraw/zinc/15/36/01/196153601.db2.gz	PUTGLCWGJUHDLU-UHFFFAOYSA-N	0	3	324.368	2.417	10	0		DEAEHN
COc1cc(CN2CCC[C@H]2C[NH3+])cc(Br)c1[O-]	ZINC000131358607	196162285	/nfs/dbraw/zinc/16/22/85/196162285.db2.gz	HAAZMGUEXNAFNQ-JTQLQIEISA-N	0	3	315.211	2.086	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1cccc(C)c1Br	ZINC000131394634	196165350	/nfs/dbraw/zinc/16/53/50/196165350.db2.gz	LMKHVEOVMKHKEV-JTQLQIEISA-N	0	3	315.211	2.450	10	0		DEAEHN
Cc1cccc(NC(=O)[C@@]2(C)COC[C@@H]2N)c1Br	ZINC000131436252	196168850	/nfs/dbraw/zinc/16/88/50/196168850.db2.gz	NTVYSTSVBMNVSR-GWCFXTLKSA-N	0	3	313.195	2.060	10	0		DEAEHN
CCN[C@@H](Cc1ccc(F)cc1C)C(C)(C)S(C)(=O)=O	ZINC000131933741	196211724	/nfs/dbraw/zinc/21/17/24/196211724.db2.gz	PQGCFQVEQYAKEA-AWEZNQCLSA-N	0	3	301.427	2.478	10	0		DEAEHN
C[C@@H]1CNC[C@@H](COCc2ccccc2Br)O1	ZINC000132652169	196273550	/nfs/dbraw/zinc/27/35/50/196273550.db2.gz	ONRYMLJRROIMAD-PWSUYJOCSA-N	0	3	300.196	2.343	10	0		DEAEHN
N[C@H]1COC[C@@H]1c1nc(-c2ccc(Cl)c(Cl)c2)no1	ZINC000133030358	196306433	/nfs/dbraw/zinc/30/64/33/196306433.db2.gz	RUZUPNXYCANEDH-XVKPBYJWSA-N	0	3	300.145	2.485	10	0		DEAEHN
COc1cc(C[NH2+]C2(CO)CCC2)cc(Br)c1[O-]	ZINC000133150669	196316133	/nfs/dbraw/zinc/31/61/33/196316133.db2.gz	UUTQWTATZPFSKE-UHFFFAOYSA-N	0	3	316.195	2.168	10	0		DEAEHN
CN1CCC[C@]2(CC(=O)NC(=O)[C@@H]2c2ccccc2Cl)C1	ZINC000134372973	196383162	/nfs/dbraw/zinc/38/31/62/196383162.db2.gz	OZJQLPKTUKEVSJ-HOCLYGCPSA-N	0	3	306.793	2.182	10	0		DEAEHN
CN(C)CCN(Cc1ccco1)C(=O)NC[C@H]1CCC(C)(C)O1	ZINC000188179984	225011597	/nfs/dbraw/zinc/01/15/97/225011597.db2.gz	DGIQTGBXKJMWMX-CQSZACIVSA-N	0	3	323.437	2.310	10	0		DEAEHN
O=C(CN1CCN2CCC[C@H]2C1)N[C@@H](c1ccccc1)C1CC1	ZINC000246389071	225227107	/nfs/dbraw/zinc/22/71/07/225227107.db2.gz	PCVNFSGQSUILJY-HKUYNNGSSA-N	0	3	313.445	2.034	10	0		DEAEHN
CCOc1ccccc1CCC(=O)N1CCN2CCC[C@@H]2C1	ZINC000195318486	424882316	/nfs/dbraw/zinc/88/23/16/424882316.db2.gz	GRPXYHNWTSEXGM-MRXNPFEDSA-N	0	3	302.418	2.325	10	0		DEAEHN
C[C@@]1(CNC(=O)c2ccnnc2)CCCN1Cc1ccccc1	ZINC000153807521	424860563	/nfs/dbraw/zinc/86/05/63/424860563.db2.gz	XOCXIJMTFCHUMA-SFHVURJKSA-N	0	3	310.401	2.261	10	0		DEAEHN
CN(C[C@H]1CCCN1C)C(=O)c1coc(Br)c1	ZINC000383278648	424910457	/nfs/dbraw/zinc/91/04/57/424910457.db2.gz	ICHAUPSZLWWPPW-SNVBAGLBSA-N	0	3	301.184	2.208	10	0		DEAEHN
COC(=O)c1nc(NCCN(C)Cc2ccccc2)sc1C	ZINC000386847916	424912501	/nfs/dbraw/zinc/91/25/01/424912501.db2.gz	YWVKHHFGAZJRJW-UHFFFAOYSA-N	0	3	319.430	2.782	10	0		DEAEHN
CCCC(=O)N1CCO[C@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC000404139324	424925176	/nfs/dbraw/zinc/92/51/76/424925176.db2.gz	GMJGGIWWEMKKGY-SJORKVTESA-N	0	3	302.418	2.288	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1nscc1Br	ZINC000404789534	424929053	/nfs/dbraw/zinc/92/90/53/424929053.db2.gz	GSXSSSUELPZSLS-MRVPVSSYSA-N	0	3	318.240	2.072	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@H](C)c1ccncc1OC	ZINC000249000756	424886866	/nfs/dbraw/zinc/88/68/66/424886866.db2.gz	ONCRASLXUBMDLI-KGLIPLIRSA-N	0	3	320.437	2.277	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)N(CCN(C)C)Cc2ccco2)n1	ZINC000088229332	267398105	/nfs/dbraw/zinc/39/81/05/267398105.db2.gz	NVVVVSYAYNAQJH-OAHLLOKOSA-N	0	3	318.421	2.244	10	0		DEAEHN
CN1C[C@H](CNCc2sccc2Br)CC1=O	ZINC000657694329	425387390	/nfs/dbraw/zinc/38/73/90/425387390.db2.gz	CYIOPUINVRWGRH-QMMMGPOBSA-N	0	3	303.225	2.079	10	0		DEAEHN
Cc1cc([C@H](C)NC[C@@H]2CCCO[C@H]2c2ccnn2C)nn1C	ZINC000658268563	425463611	/nfs/dbraw/zinc/46/36/11/425463611.db2.gz	JHQANKOCLOFIPB-GRDNDAEWSA-N	0	3	317.437	2.281	10	0		DEAEHN
C[C@@H]1CCN[C@H](C(=O)NCCCCOCc2ccccc2)C1	ZINC000390703820	269098091	/nfs/dbraw/zinc/09/80/91/269098091.db2.gz	AUQYBAKASZAXLN-WBVHZDCISA-N	0	3	304.434	2.488	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000396403849	269103289	/nfs/dbraw/zinc/10/32/89/269103289.db2.gz	ZJJWKQMNPWWHQB-IEBWSBKVSA-N	0	3	320.477	2.370	10	0		DEAEHN
O=C(NCC1(O)CCN(Cc2ccccc2)CC1)c1ccco1	ZINC000397531404	269106912	/nfs/dbraw/zinc/10/69/12/269106912.db2.gz	HVDRLSBLXBMWBN-UHFFFAOYSA-N	0	3	314.385	2.037	10	0		DEAEHN
N[C@H](C(=O)NCc1ccccc1OC(F)(F)F)C1CCC1	ZINC000398988892	269110836	/nfs/dbraw/zinc/11/08/36/269110836.db2.gz	JDCTWHAAXXLQLJ-LBPRGKRZSA-N	0	3	302.296	2.329	10	0		DEAEHN
CC(=O)NCCCCCC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000052852881	273492263	/nfs/dbraw/zinc/49/22/63/273492263.db2.gz	GKCZYSLZOUDWHK-KRWDZBQOSA-N	0	3	319.449	2.102	10	0		DEAEHN
CC[C@](C)(O)CN[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1	ZINC000249076577	273765685	/nfs/dbraw/zinc/76/56/85/273765685.db2.gz	RCCGEVROHORUDB-KBMXLJTQSA-N	0	3	310.825	2.362	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cccc(Br)n1	ZINC000137077441	274374135	/nfs/dbraw/zinc/37/41/35/274374135.db2.gz	XEGWPBNZYPIHHV-GHMZBOCLSA-N	0	3	324.222	2.153	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC1C[C@H](C)C[C@@H](C)C1	ZINC000246827866	277220677	/nfs/dbraw/zinc/22/06/77/277220677.db2.gz	GNLNNZYVYQDFDW-IIAWOOMASA-N	0	3	311.470	2.221	10	0		DEAEHN
C[C@@H](C(=O)NC[C@@]1(O)CCc2ccccc21)N1[C@H](C)CC[C@@H]1C	ZINC000246518557	278208234	/nfs/dbraw/zinc/20/82/34/278208234.db2.gz	IURXOOJKROBWOE-YGTYGHESSA-N	0	3	316.445	2.198	10	0		DEAEHN
C[C@@H](CN)C(=O)/N=c1/sccn1Cc1ccccc1Cl	ZINC000262479230	278242906	/nfs/dbraw/zinc/24/29/06/278242906.db2.gz	ZINBEMOKDFQDME-KDSBZSBUSA-N	0	3	309.822	2.273	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N(CCN(C)C)C(C)C	ZINC000159166530	279259067	/nfs/dbraw/zinc/25/90/67/279259067.db2.gz	XAZDFZDYBAISJM-UHFFFAOYSA-N	0	3	309.458	2.021	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)Cc2cccc(N(C)C)c2)C1	ZINC000151451256	279293348	/nfs/dbraw/zinc/29/33/48/279293348.db2.gz	AVICVABQRDGQNC-MRXNPFEDSA-N	0	3	318.465	2.378	10	0		DEAEHN
C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1cn2ccnc2s1	ZINC000190992340	279323483	/nfs/dbraw/zinc/32/34/83/279323483.db2.gz	XAOAJFBTGGHHQC-FRRDWIJNSA-N	0	3	320.462	2.492	10	0		DEAEHN
C[C@H](NC(=O)c1ccccc1OCCN(C)C)C1CCOCC1	ZINC000152332795	279448640	/nfs/dbraw/zinc/44/86/40/279448640.db2.gz	YMUWWBQLMZMKOD-AWEZNQCLSA-N	0	3	320.433	2.172	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)CN1CCC[C@H]1Cn1ccnc1C	ZINC000247005711	280240937	/nfs/dbraw/zinc/24/09/37/280240937.db2.gz	LBAKERFAEJAZOF-SJORKVTESA-N	0	3	318.465	2.447	10	0		DEAEHN
C[C@H](CCNCc1cnn(Cc2ccccc2)c1)[S@](C)=O	ZINC000129507041	281913564	/nfs/dbraw/zinc/91/35/64/281913564.db2.gz	OMGVFGFCDDHBRV-SPLOXXLWSA-N	0	3	305.447	2.178	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)N(C)[C@H]1CCSC1	ZINC000123368161	289186996	/nfs/dbraw/zinc/18/69/96/289186996.db2.gz	JMPGMOCHNWCWQE-CVEARBPZSA-N	0	3	321.490	2.306	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NC2(CO)CCCC2)[C@H]1c1ccccc1	ZINC000248057051	290138814	/nfs/dbraw/zinc/13/88/14/290138814.db2.gz	ONQFJPXQUSTUTO-HZPDHXFCSA-N	0	3	317.433	2.036	10	0		DEAEHN
Cn1nc(C(=O)Nc2ccc3c(c2F)CCNC3)cc1C1CC1	ZINC000261796512	294511598	/nfs/dbraw/zinc/51/15/98/294511598.db2.gz	VFJQBXVLCLBEHC-UHFFFAOYSA-N	0	3	314.364	2.335	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)NCCOCC1CCC1	ZINC000575053038	326213994	/nfs/dbraw/zinc/21/39/94/326213994.db2.gz	DNQWVORLONAHJE-MRXNPFEDSA-N	0	3	311.470	2.367	10	0		DEAEHN
COC[C@H](C)CN[C@@H](CO)c1cccc(Br)c1	ZINC000188104689	333031753	/nfs/dbraw/zinc/03/17/53/333031753.db2.gz	UQDATDOPQPJJDJ-MFKMUULPSA-N	0	3	302.212	2.355	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)NC[C@H]3CCCN(C)C3)cc2c1	ZINC000189263946	333067632	/nfs/dbraw/zinc/06/76/32/333067632.db2.gz	IMODOZUOHGJAQT-GFCCVEGCSA-N	0	3	301.390	2.248	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1	ZINC000189977503	336256445	/nfs/dbraw/zinc/25/64/45/336256445.db2.gz	CJQHZYBDPIDBQZ-AGIUHOORSA-N	0	3	318.421	2.076	10	0		DEAEHN
C1CCC(N2CCN(c3nc(C4CCOCC4)no3)CC2)CC1	ZINC000582592721	337110970	/nfs/dbraw/zinc/11/09/70/337110970.db2.gz	LNAIVLAYSFOSKB-UHFFFAOYSA-N	0	3	320.437	2.418	10	0		DEAEHN
COc1ccc(C[C@H](C)CN2CCN(CCO)[C@@H](C)C2)cc1F	ZINC000190239076	533776310	/nfs/dbraw/zinc/77/63/10/533776310.db2.gz	HMSYMDINFHLHNB-GJZGRUSLSA-N	0	3	324.440	2.011	10	0		DEAEHN
COc1cc([C@@H](C)N[C@H](C)CCS(C)(=O)=O)ccc1F	ZINC000154271738	518140297	/nfs/dbraw/zinc/14/02/97/518140297.db2.gz	VEKDUUCUAZZDEF-GHMZBOCLSA-N	0	3	303.399	2.308	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@](C)(O)[C@H](C)c2ccccc2)C1	ZINC000245416734	521647395	/nfs/dbraw/zinc/64/73/95/521647395.db2.gz	IRTSBQYLCAWBGW-HFTRVMKXSA-N	0	3	304.434	2.142	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)Cc1cccc(F)c1	ZINC000111865407	523825732	/nfs/dbraw/zinc/82/57/32/523825732.db2.gz	OLCFRFYHJAQELA-MRXNPFEDSA-N	0	3	323.412	2.078	10	0		DEAEHN
C[C@@H](C(=O)NC1CCCC1)N1CCC(Cc2nccn2C)CC1	ZINC000105875570	524164723	/nfs/dbraw/zinc/16/47/23/524164723.db2.gz	GPRVCNBNQSCKTA-AWEZNQCLSA-N	0	3	318.465	2.122	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(C[C@H](O)COC(C)C)CC2	ZINC000374365054	534882355	/nfs/dbraw/zinc/88/23/55/534882355.db2.gz	JBFMWNYDQYKWCG-SFHVURJKSA-N	0	3	305.418	2.076	10	0		DEAEHN
c1ccc(CSCCCN2CCN3CCOC[C@H]3C2)cc1	ZINC000363807733	526474968	/nfs/dbraw/zinc/47/49/68/526474968.db2.gz	YVQVJONGOZAHNF-QGZVFWFLSA-N	0	3	306.475	2.326	10	0		DEAEHN
CC1=CCN(CCNC(=O)NC[C@@H]2N(C)CCCC2(C)C)CC1	ZINC000447990178	528117344	/nfs/dbraw/zinc/11/73/44/528117344.db2.gz	RAMZBQOJUJKFLD-INIZCTEOSA-N	0	3	322.497	2.058	10	0		DEAEHN
CCN(CC)c1ccc(CN[C@@H](COC)C2CCOCC2)cn1	ZINC000187804394	528307818	/nfs/dbraw/zinc/30/78/18/528307818.db2.gz	LCWIRDBCCVZAOG-KRWDZBQOSA-N	0	3	321.465	2.459	10	0		DEAEHN
CC(C)CN1CCN(c2ncc(Br)cc2N)CC1	ZINC000055085556	535107014	/nfs/dbraw/zinc/10/70/14/535107014.db2.gz	HZDDBEOHXHNKAT-UHFFFAOYSA-N	0	3	313.243	2.204	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N(C)[C@H]1CCCN(C)C1)C2	ZINC000375264358	535381696	/nfs/dbraw/zinc/38/16/96/535381696.db2.gz	YUBIGSIMESJPDJ-KGLIPLIRSA-N	0	3	318.465	2.191	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)N(C)[C@H]1CCCN(C)C1)CC2	ZINC000375264358	535381697	/nfs/dbraw/zinc/38/16/97/535381697.db2.gz	YUBIGSIMESJPDJ-KGLIPLIRSA-N	0	3	318.465	2.191	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2cncn2C)[C@H]1Oc1ccccc1	ZINC000249463076	535414657	/nfs/dbraw/zinc/41/46/57/535414657.db2.gz	ROHQRAHOVBYPBU-BRWVUGGUSA-N	0	3	301.390	2.135	10	0		DEAEHN
CCCc1nc(C)c(-c2nc([C@@H]3CNCCN3C)no2)s1	ZINC000263218319	535485398	/nfs/dbraw/zinc/48/53/98/535485398.db2.gz	LIGPWFOKGHXJSY-JTQLQIEISA-N	0	3	307.423	2.030	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)[C@@H]1CCc2nc(C(C)C)[nH]c2C1	ZINC000372392138	535564919	/nfs/dbraw/zinc/56/49/19/535564919.db2.gz	ACEUEJVKIHUMDQ-ZIAGYGMSSA-N	0	3	318.465	2.239	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)[C@@H]1CCc2[nH]c(C(C)C)nc2C1	ZINC000372392138	535564922	/nfs/dbraw/zinc/56/49/22/535564922.db2.gz	ACEUEJVKIHUMDQ-ZIAGYGMSSA-N	0	3	318.465	2.239	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)N[C@H](C)[C@H](C)CO)c1ccccc1	ZINC000246958468	535673342	/nfs/dbraw/zinc/67/33/42/535673342.db2.gz	FZJMACVFSMZZAC-BFYDXBDKSA-N	0	3	321.465	2.386	10	0		DEAEHN
CN(C)c1cc(C(=O)N2CCN3CCC2CC3)c2ccccc2n1	ZINC000188843357	536143506	/nfs/dbraw/zinc/14/35/06/536143506.db2.gz	OYFDGXLVSGHWGV-UHFFFAOYSA-N	0	3	324.428	2.221	10	0		DEAEHN
CN1CCC[C@@H](CCNC(=O)C(=O)c2ccc3c(c2)CCC3)C1	ZINC000458164625	536362595	/nfs/dbraw/zinc/36/25/95/536362595.db2.gz	KJGYVGBMZCRKRQ-AWEZNQCLSA-N	0	3	314.429	2.206	10	0		DEAEHN
COc1ccc(/C(C)=C/c2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263183209	536561221	/nfs/dbraw/zinc/56/12/21/536561221.db2.gz	GZCHNFSMTMBHIB-PABFRNLHSA-N	0	3	314.389	2.215	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc(OC[C@@H]2CCCO2)cc1	ZINC000175852601	536630278	/nfs/dbraw/zinc/63/02/78/536630278.db2.gz	NJGAKXHEZQGWSM-ROUUACIJSA-N	0	3	323.433	2.122	10	0		DEAEHN
COc1ccc(C(=O)NC[C@@H]2CCCN2C)c(OC(F)F)c1	ZINC000191413738	536743959	/nfs/dbraw/zinc/74/39/59/536743959.db2.gz	AOJNCJSIFDYEEF-JTQLQIEISA-N	0	3	314.332	2.121	10	0		DEAEHN
COCc1ccc(C(=O)Nc2ccc3c(c2F)CCNC3)o1	ZINC000261675170	536763901	/nfs/dbraw/zinc/76/39/01/536763901.db2.gz	GWNXAYSMMCJHLJ-UHFFFAOYSA-N	0	3	304.321	2.463	10	0		DEAEHN
COc1cccc([C@H]2C[C@H]2C(=O)N2CCN3CCC2CC3)c1	ZINC000188634482	536912216	/nfs/dbraw/zinc/91/22/16/536912216.db2.gz	CMFIFYTTZMSQDA-IAGOWNOFSA-N	0	3	300.402	2.105	10	0		DEAEHN
Cc1ccccc1[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)CN1CCCCC1	ZINC000288183199	625491079	/nfs/dbraw/zinc/49/10/79/625491079.db2.gz	FANINWZVQUEUHE-NJAFHUGGSA-N	0	3	316.445	2.062	10	0		DEAEHN
O=S(=O)(/C=C\c1ccccc1)NC[C@@H]1CCN(C2CC2)C1	ZINC000254949279	622788783	/nfs/dbraw/zinc/78/87/83/622788783.db2.gz	GEHXPGRPGJZZAA-KLQCNHIUSA-N	0	3	306.431	2.061	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)[C@H](N)CCOC	ZINC000052808128	625105343	/nfs/dbraw/zinc/10/53/43/625105343.db2.gz	GBBRHEWHMOSMBN-LLVKDONJSA-N	0	3	300.786	2.431	10	0		DEAEHN
COCC[C@@H](N)C(=O)Nc1cc(C)c(Br)c(C)c1	ZINC000232036829	635923789	/nfs/dbraw/zinc/92/37/89/635923789.db2.gz	KPIJABZTAGOGBJ-LLVKDONJSA-N	0	3	315.211	2.368	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)CCN(c2ncc(C=O)cn2)C1	ZINC000323304775	641355228	/nfs/dbraw/zinc/35/52/28/641355228.db2.gz	CVCGERYNAVXXIY-HNNXBMFYSA-N	0	3	310.401	2.247	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H](C)CC(=O)OCc1ccccc1)N(C)C	ZINC000121528404	650895261	/nfs/dbraw/zinc/89/52/61/650895261.db2.gz	GTKCIPUAUAQYRH-GDBMZVCRSA-N	0	3	320.433	2.355	10	0		DEAEHN
C[C@@H]1[C@H](OC(=O)c2cccc(CN3CCCC3)c2)CC(=O)N1C	ZINC000806080596	644650602	/nfs/dbraw/zinc/65/06/02/644650602.db2.gz	HSVIYJIRHROJBL-CZUORRHYSA-N	0	3	316.401	2.058	10	0		DEAEHN
CN1CCCN(C(=O)N[C@@H]2Cc3ccc(Cl)cc3C2)CC1	ZINC000800740164	645301772	/nfs/dbraw/zinc/30/17/72/645301772.db2.gz	YEAWRPRZZNRYQF-OAHLLOKOSA-N	0	3	307.825	2.154	10	0		DEAEHN
O=C(OCc1ccc2c(c1)OCCO2)C1CCN(C2CC2)CC1	ZINC000801872890	645455884	/nfs/dbraw/zinc/45/58/84/645455884.db2.gz	HREXZGFVKJTHPI-UHFFFAOYSA-N	0	3	317.385	2.375	10	0		DEAEHN
CCCN(CCN1CCCCC1)C(=O)Cc1ccc(F)cn1	ZINC000804566093	645791460	/nfs/dbraw/zinc/79/14/60/645791460.db2.gz	JLIHLVBLBSHUCY-UHFFFAOYSA-N	0	3	307.413	2.488	10	0		DEAEHN
Cn1c2ccccc2nc1C(C#N)C(=O)C=Cc1ccncn1	ZINC000156325634	646412193	/nfs/dbraw/zinc/41/21/93/646412193.db2.gz	RLZRBHWQFJHSBW-YBJDMEARSA-N	0	3	303.325	2.253	10	0		DEAEHN
Cn1ccc(CN[C@@H]2CCC[C@H]2CNC(=O)OC(C)(C)C)n1	ZINC000230685113	646743534	/nfs/dbraw/zinc/74/35/34/646743534.db2.gz	PMFIAXJMVPDVQC-GXTWGEPZSA-N	0	3	308.426	2.203	10	0		DEAEHN
CCN1CCN(c2ccc(CNCc3ccco3)cn2)CC1	ZINC000069708095	648739224	/nfs/dbraw/zinc/73/92/24/648739224.db2.gz	NFMIQBVYNDCRHD-UHFFFAOYSA-N	0	3	300.406	2.106	10	0		DEAEHN
Fc1ccc(SCc2noc(C[C@@H]3CNCCO3)n2)cc1	ZINC000091295215	684035958	/nfs/dbraw/zinc/03/59/58/684035958.db2.gz	JEKPFMOEHSYOHI-LLVKDONJSA-N	0	3	309.366	2.032	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2ccc(Cl)nc2)C1	ZINC000119959117	684089603	/nfs/dbraw/zinc/08/96/03/684089603.db2.gz	MKVMPRVWYJLYED-CYBMUJFWSA-N	0	3	310.829	2.061	10	0		DEAEHN
CN(CC1(O)CCCCC1)[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000191765410	684436053	/nfs/dbraw/zinc/43/60/53/684436053.db2.gz	XKVAOXDVXFJTSI-QGZVFWFLSA-N	0	3	316.445	2.415	10	0		DEAEHN
C[C@H]1COCC[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000192577971	684452914	/nfs/dbraw/zinc/45/29/14/684452914.db2.gz	BUYJAORCVWUDOS-UAGQMJEPSA-N	0	3	303.402	2.477	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)Cc2ccc(Cl)nc2)C1	ZINC000194171668	685059656	/nfs/dbraw/zinc/05/96/56/685059656.db2.gz	RIPCFKBJCVNKAM-ZDUSSCGKSA-N	0	3	310.829	2.361	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2ccc([C@H](C)O)cc2)C1	ZINC000249726980	685186581	/nfs/dbraw/zinc/18/65/81/685186581.db2.gz	QHLQSWOUEYNSJS-XJKSGUPXSA-N	0	3	305.422	2.023	10	0		DEAEHN
C[C@H](N[C@H]1C[C@@H](O)[C@@H]1n1cccn1)c1ccc(-n2cccn2)cc1	ZINC000886097048	692002879	/nfs/dbraw/zinc/00/28/79/692002879.db2.gz	KAPZRADOQODSOB-VIBAHUMZSA-N	0	3	323.400	2.094	10	0		DEAEHN
COc1ccc(/C=C(/C)C(=O)NCCN2CCCC2)cc1F	ZINC000588444902	777199954	/nfs/dbraw/zinc/19/99/54/777199954.db2.gz	ZBMRWIAHPZSCRP-QBFSEMIESA-N	0	3	306.381	2.450	10	0		DEAEHN
CO[C@@]1(CN[C@H](C)c2ccc(Cl)cc2)CCS(=O)(=O)C1	ZINC000721258567	781017705	/nfs/dbraw/zinc/01/77/05/781017705.db2.gz	IDZPMQYSCJXICF-BXUZGUMPSA-N	0	3	317.838	2.194	10	0		DEAEHN
Cn1cc(CNCC[C@@H]2CCCCO2)c(Br)n1	ZINC000712484085	792190278	/nfs/dbraw/zinc/19/02/78/792190278.db2.gz	ZKPOTJUVGZTNET-NSHDSACASA-N	0	3	302.216	2.231	10	0		DEAEHN
CN1CCN(C(=O)c2cc(Br)c[nH]2)CCC1(C)C	ZINC000712616481	792193631	/nfs/dbraw/zinc/19/36/31/792193631.db2.gz	IUFCZDCBNZGVJD-UHFFFAOYSA-N	0	3	314.227	2.334	10	0		DEAEHN
NC(=O)C1CC(NCc2cc(Br)ccc2Cl)C1	ZINC000716714570	793002650	/nfs/dbraw/zinc/00/26/50/793002650.db2.gz	BVLOFRZWVGNBLI-UHFFFAOYSA-N	0	3	317.614	2.456	10	0		DEAEHN
CC(C)(C)OC(=O)NC1CCN(CCNCc2ccco2)CC1	ZINC000721932244	1084504403	/nfs/dbraw/zinc/50/44/03/1084504403.db2.gz	SBCSMBULUAPDOH-UHFFFAOYSA-N	0	3	323.437	2.358	10	0		DEAEHN
COc1cncc(CNC(C)(C)CNC(=O)OC(C)(C)C)c1	ZINC000704219394	1086574478	/nfs/dbraw/zinc/57/44/78/1086574478.db2.gz	YNPIEIXOOWHDKF-UHFFFAOYSA-N	0	3	309.410	2.483	10	0		DEAEHN
COC[C@H](C)OC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C	ZINC000704490098	1086582622	/nfs/dbraw/zinc/58/26/22/1086582622.db2.gz	QBYSEAFXEYRBCO-LZWOXQAQSA-N	0	3	306.406	2.411	10	0		DEAEHN
CC(C)(C)c1ccc(CNC(C)(C)CNS(C)(=O)=O)s1	ZINC000708222347	1086677779	/nfs/dbraw/zinc/67/77/79/1086677779.db2.gz	FJBJCHZDDKEQKL-UHFFFAOYSA-N	0	3	318.508	2.463	10	0		DEAEHN
CC[C@@H](CN[C@H]1CCC1(OC)OC)NC(=O)OC(C)(C)C	ZINC000710959136	1086691129	/nfs/dbraw/zinc/69/11/29/1086691129.db2.gz	KXFVLOGWJKXYDQ-RYUDHWBXSA-N	0	3	302.415	2.031	10	0		DEAEHN
Cc1nc(CNCCN2CCCC2)sc1Br	ZINC000719304772	1088942637	/nfs/dbraw/zinc/94/26/37/1088942637.db2.gz	JIIPNLPRXDNCCK-UHFFFAOYSA-N	0	3	304.257	2.399	10	0		DEAEHN
Cc1nc(CNC[C@@H]2CC[C@@H](O)C2)sc1Br	ZINC000719303364	1088941349	/nfs/dbraw/zinc/94/13/49/1088941349.db2.gz	BFZHACQQJPVXNU-RKDXNWHRSA-N	0	3	305.241	2.465	10	0		DEAEHN
Cc1nc(CNC[C@@H]2CC[C@H](O)C2)sc1Br	ZINC000719303357	1088942721	/nfs/dbraw/zinc/94/27/21/1088942721.db2.gz	BFZHACQQJPVXNU-BDAKNGLRSA-N	0	3	305.241	2.465	10	0		DEAEHN
C[C@@H]1[C@@H](NC(=O)c2ccc(Br)c(F)c2)CCN1C	ZINC000719384701	1089053211	/nfs/dbraw/zinc/05/32/11/1089053211.db2.gz	DPOGMKSDGOXIRW-PELKAZGASA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@H]1[C@H](NC(=O)c2ccc(Br)cc2F)CCN1C	ZINC000719388972	1089080728	/nfs/dbraw/zinc/08/07/28/1089080728.db2.gz	UGDMUQIIMDNJAE-QPUJVOFHSA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@@H]1[C@H](NC(=O)c2cscc2Br)CCN1C	ZINC000719399046	1089086522	/nfs/dbraw/zinc/08/65/22/1089086522.db2.gz	YNWWZCRNISESIF-GMSGAONNSA-N	0	3	303.225	2.333	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)Nc1cccc([S@](C)=O)c1	ZINC000136824579	282091217	/nfs/dbraw/zinc/09/12/17/282091217.db2.gz	FBPHBXOCUJOMBQ-MZOGBMEOSA-N	0	3	321.446	2.124	10	0		DEAEHN
CCN(CCCNC(=O)NC[C@@H]1CCCN1C)c1ccccc1	ZINC000139425876	282101034	/nfs/dbraw/zinc/10/10/34/282101034.db2.gz	UPIURKHSIXOKRB-KRWDZBQOSA-N	0	3	318.465	2.296	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)NC[C@@H](CC(C)C)N(C)C)cc1	ZINC000278385922	214133640	/nfs/dbraw/zinc/13/36/40/214133640.db2.gz	BCATUIGZUXGUJD-QGZVFWFLSA-N	0	3	319.449	2.375	10	0		DEAEHN
CCN[C@@H]1c2ccccc2OC[C@@H]1Sc1nnc(C)n1C	ZINC000081886242	192334688	/nfs/dbraw/zinc/33/46/88/192334688.db2.gz	KQLGVTNEXYQEQY-UONOGXRCSA-N	0	3	304.419	2.327	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2cccc3c2OC(C)(C)C3)CCO1	ZINC000128157445	282127794	/nfs/dbraw/zinc/12/77/94/282127794.db2.gz	ACMPAYGTFAOSMZ-MRXNPFEDSA-N	0	3	304.434	2.163	10	0		DEAEHN
CCC[C@H](N)CS(=O)(=O)c1ccccc1Br	ZINC000081931333	192341620	/nfs/dbraw/zinc/34/16/20/192341620.db2.gz	LFWARCKRFACXOT-VIFPVBQESA-N	0	3	306.225	2.350	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)CCOC)c1ccc(C)cc1C	ZINC000081943822	192344673	/nfs/dbraw/zinc/34/46/73/192344673.db2.gz	WJWFAXUFYRDZFS-INIZCTEOSA-N	0	3	313.463	2.405	10	0		DEAEHN
Cc1cnc([C@H](C)NC(=O)N2CCCN(C3CC3)CC2)s1	ZINC000079086408	185155636	/nfs/dbraw/zinc/15/56/36/185155636.db2.gz	QKBJTHFORARQMW-LBPRGKRZSA-N	0	3	308.451	2.392	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NC[C@H](c1ccco1)N(C)C	ZINC000079192876	185161393	/nfs/dbraw/zinc/16/13/93/185161393.db2.gz	JDYJITTWPUNIRP-HUUCEWRRSA-N	0	3	324.469	2.158	10	0		DEAEHN
COc1ccc(Br)c(CN[C@H]2CN(C)C[C@H]2C)c1	ZINC000358086101	536628965	/nfs/dbraw/zinc/62/89/65/536628965.db2.gz	WLFDAGVAEUNFBM-YGRLFVJLSA-N	0	3	313.239	2.497	10	0		DEAEHN
N[C@@H](c1cc(Cl)sc1Cl)[C@@H]1CCS(=O)(=O)C1	ZINC000082998650	185210562	/nfs/dbraw/zinc/21/05/62/185210562.db2.gz	SGUFCVBSFXMDCE-SVGQVSJJSA-N	0	3	300.232	2.489	10	0		DEAEHN
N[C@H](c1cc(Cl)sc1Cl)[C@@H]1CCS(=O)(=O)C1	ZINC000082998652	185210626	/nfs/dbraw/zinc/21/06/26/185210626.db2.gz	SGUFCVBSFXMDCE-XRGYYRRGSA-N	0	3	300.232	2.489	10	0		DEAEHN
NC[C@@H](NCC(F)(F)F)c1cc(Cl)c2c(c1)OCCO2	ZINC000087929569	185237581	/nfs/dbraw/zinc/23/75/81/185237581.db2.gz	DPGKSTRTQHDJMZ-SECBINFHSA-N	0	3	310.703	2.263	10	0		DEAEHN
CCOCCN(C)[C@H](CN)c1ccc(Br)s1	ZINC000087975929	185237767	/nfs/dbraw/zinc/23/77/67/185237767.db2.gz	YNFTXXGQFCWZHY-SECBINFHSA-N	0	3	307.257	2.479	10	0		DEAEHN
CN1CCCC[C@H]1COc1ncc(Br)cc1N	ZINC000088165382	185240939	/nfs/dbraw/zinc/24/09/39/185240939.db2.gz	DLIDTXJDZVOKIZ-JTQLQIEISA-N	0	3	300.200	2.289	10	0		DEAEHN
CCn1ccnc(N2CCC(NCc3ccsc3)CC2)c1=O	ZINC000328643573	529548144	/nfs/dbraw/zinc/54/81/44/529548144.db2.gz	RKVMITOKRWCCNK-UHFFFAOYSA-N	0	3	318.446	2.083	10	0		DEAEHN
CN1CCN(CC2(CC(N)=S)CC2)[C@H](c2ccccc2)C1	ZINC000088256856	185244119	/nfs/dbraw/zinc/24/41/19/185244119.db2.gz	BAEBRYOTLQERJA-HNNXBMFYSA-N	0	3	303.475	2.432	10	0		DEAEHN
CC[C@H](C)C[C@@H](C)NS(=O)(=O)c1cccc(F)c1CN	ZINC000088299313	185245030	/nfs/dbraw/zinc/24/50/30/185245030.db2.gz	PVKGVPNXHCFMTN-WDEREUQCSA-N	0	3	302.415	2.387	10	0		DEAEHN
COc1ccc(Br)c(NC(=O)[C@@H](N)C(C)C)c1	ZINC000088321284	185245384	/nfs/dbraw/zinc/24/53/84/185245384.db2.gz	ASCNPEKZDVXVAD-NSHDSACASA-N	0	3	301.184	2.380	10	0		DEAEHN
C[C@H]1CCC[C@](N)(C(=O)Nc2cnc(Br)cn2)C1	ZINC000088446383	185251304	/nfs/dbraw/zinc/25/13/04/185251304.db2.gz	VAJOOEOHERGNSX-QPUJVOFHSA-N	0	3	313.199	2.085	10	0		DEAEHN
CC[C@@H]1CC[C@H]([NH2+]Cc2ccc(S(=O)(=O)[N-]C)o2)[C@@H]1C	ZINC000088540951	185255750	/nfs/dbraw/zinc/25/57/50/185255750.db2.gz	VUTVXQLRYLQYBY-WZRBSPASSA-N	0	3	300.424	2.102	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@@H](C)[C@@H](C)CC)o1	ZINC000088542908	185256088	/nfs/dbraw/zinc/25/60/88/185256088.db2.gz	RBHICWPDJULRCL-RYUDHWBXSA-N	0	3	302.440	2.492	10	0		DEAEHN
CCCCC[N-]S(=O)(=O)c1ccc(C[NH2+]CC(C)C)o1	ZINC000088542009	185256498	/nfs/dbraw/zinc/25/64/98/185256498.db2.gz	KLYKBZPFHORPOV-UHFFFAOYSA-N	0	3	302.440	2.494	10	0		DEAEHN
C[C@@H]1CC[C@H](C)CN1S(=O)(=O)c1ccc(F)c(CN)c1	ZINC000088704766	185262701	/nfs/dbraw/zinc/26/27/01/185262701.db2.gz	NVFOBKMUDIOJJC-WDEREUQCSA-N	0	3	300.399	2.094	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-]CCCC(C)C)o1	ZINC000088550704	185257675	/nfs/dbraw/zinc/25/76/75/185257675.db2.gz	WSNNZFUEZAAHIM-UHFFFAOYSA-N	0	3	302.440	2.494	10	0		DEAEHN
NCc1cccc(S(=O)(=O)Nc2c(F)cc(F)cc2F)c1	ZINC000088721050	185263259	/nfs/dbraw/zinc/26/32/59/185263259.db2.gz	NQJIZKWGSYEVRN-UHFFFAOYSA-N	0	3	316.304	2.363	10	0		DEAEHN
CN(C[C@@H]1CCOC1)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000179260702	282221557	/nfs/dbraw/zinc/22/15/57/282221557.db2.gz	KTZFTRYBLORYOD-XIRDDKMYSA-N	0	3	317.433	2.110	10	0		DEAEHN
CCCOc1ccc(NC(=O)[C@@H]2COC[C@@H]2NC)cc1Cl	ZINC000090434320	185296217	/nfs/dbraw/zinc/29/62/17/185296217.db2.gz	JUZQDJNOOUZHKJ-YPMHNXCESA-N	0	3	312.797	2.302	10	0		DEAEHN
C[C@@]1(c2nc(-c3ccc(Br)cc3)no2)COC[C@@H]1N	ZINC000090573319	185304458	/nfs/dbraw/zinc/30/44/58/185304458.db2.gz	GSDMEUJYBQNVKN-GXFFZTMASA-N	0	3	324.178	2.114	10	0		DEAEHN
Cc1ccc(OCC(=O)N2CCCSC[C@@H]2CN(C)C)cc1	ZINC000090699944	185310436	/nfs/dbraw/zinc/31/04/36/185310436.db2.gz	WHDMOZPBXSEQKF-HNNXBMFYSA-N	0	3	322.474	2.270	10	0		DEAEHN
CN(C)C[C@@H]1CSCCCN1C(=O)c1ccc(N(C)C)cc1	ZINC000090700132	185310642	/nfs/dbraw/zinc/31/06/42/185310642.db2.gz	KOBGYZMZUNODIG-MRXNPFEDSA-N	0	3	321.490	2.262	10	0		DEAEHN
CCCS(=O)(=O)N1CCCSC[C@@H]1CN1CCCCC1	ZINC000090701808	185310710	/nfs/dbraw/zinc/31/07/10/185310710.db2.gz	HKFOZFAXEDVOTF-AWEZNQCLSA-N	0	3	320.524	2.020	10	0		DEAEHN
COCCNCC(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000092495564	185322374	/nfs/dbraw/zinc/32/23/74/185322374.db2.gz	BLWKMPAMHLHXLH-SNVBAGLBSA-N	0	3	304.312	2.119	10	0		DEAEHN
Cc1ccc(CCC(=O)N[C@H](C)CCN2CCN(C)CC2)cc1	ZINC000184358675	282252844	/nfs/dbraw/zinc/25/28/44/282252844.db2.gz	YZMNLWQTFLJELV-QGZVFWFLSA-N	0	3	317.477	2.070	10	0		DEAEHN
CCO[C@H]1C[C@H](NCc2cnc3ccccn23)C12CCOCC2	ZINC000185663353	282264109	/nfs/dbraw/zinc/26/41/09/282264109.db2.gz	NKCGHIYWHBMHIR-HOTGVXAUSA-N	0	3	315.417	2.398	10	0		DEAEHN
CN(CC(=O)OC(C)(C)C)C1CCN(Cc2ccccn2)CC1	ZINC000187667473	282288143	/nfs/dbraw/zinc/28/81/43/282288143.db2.gz	BSLFFFOVYUTMGD-UHFFFAOYSA-N	0	3	319.449	2.320	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)CCC1CCN(C(C)=O)CC1	ZINC000080203260	539376724	/nfs/dbraw/zinc/37/67/24/539376724.db2.gz	BQGMSMNEZINOJJ-KRWDZBQOSA-N	0	3	323.481	2.016	10	0		DEAEHN
CSCCCCCNC(=O)Nc1cnn(CCN(C)C)c1	ZINC000614179344	362309496	/nfs/dbraw/zinc/30/94/96/362309496.db2.gz	PIACQTQNWRGZQI-UHFFFAOYSA-N	0	3	313.471	2.100	10	0		DEAEHN
O=C1CC[C@@H](CNCc2ccc(Br)cc2Cl)N1	ZINC000135189139	539514340	/nfs/dbraw/zinc/51/43/40/539514340.db2.gz	WIIIFPSWXCGZNH-JTQLQIEISA-N	0	3	317.614	2.471	10	0		DEAEHN
CCN[C@@](C)(C[C@H](C)Sc1nc2ccccc2[nH]1)C(N)=O	ZINC000068635409	190779898	/nfs/dbraw/zinc/77/98/98/190779898.db2.gz	ZVSQSQWQKMPCOF-BONVTDFDSA-N	0	3	306.435	2.287	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2ccc(Br)cc2)n1	ZINC000263266478	282973802	/nfs/dbraw/zinc/97/38/02/282973802.db2.gz	RQCIVPBTDIQFHE-LLVKDONJSA-N	0	3	323.194	2.075	10	0		DEAEHN
COC(=O)c1cnc(-c2cccc(F)c2)nc1[C@H]1CCCN1	ZINC000616579299	362894279	/nfs/dbraw/zinc/89/42/79/362894279.db2.gz	QBGQDEVIEXLYIK-CYBMUJFWSA-N	0	3	301.321	2.494	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCNC[C@H]1c1cccc(F)c1	ZINC000616636440	362902200	/nfs/dbraw/zinc/90/22/00/362902200.db2.gz	SLOUDSGFPFOVKY-HNNXBMFYSA-N	0	3	323.412	2.297	10	0		DEAEHN
O=C(C/C=C\c1cccc(F)c1)NC[C@H](O)CN1CCCCC1	ZINC000255017301	282608088	/nfs/dbraw/zinc/60/80/88/282608088.db2.gz	CKOOVHWEKAJQHX-WVRJYTFGSA-N	0	3	320.408	2.192	10	0		DEAEHN
COc1ccc([C@H](C)NC[C@H](C)CS(C)(=O)=O)cc1OC	ZINC000180881677	539647257	/nfs/dbraw/zinc/64/72/57/539647257.db2.gz	MSBAIZXMCKCYNW-RYUDHWBXSA-N	0	3	315.435	2.035	10	0		DEAEHN
CC(=O)NC[C@H]1CCCN(CCN(C)Cc2ccc(F)cc2)C1	ZINC000181662587	539652574	/nfs/dbraw/zinc/65/25/74/539652574.db2.gz	WNJDWCNHEYVUKA-QGZVFWFLSA-N	0	3	321.440	2.106	10	0		DEAEHN
COc1ccc(C)cc1NC(=O)[C@H](C)N[C@@H](C)[C@@H]1CCCO1	ZINC000183203822	539660515	/nfs/dbraw/zinc/66/05/15/539660515.db2.gz	GUTMNIMSNXDERB-YDHLFZDLSA-N	0	3	306.406	2.488	10	0		DEAEHN
CNC(=O)[C@H](NCCCc1nc(-c2ccccc2)no1)C(C)C	ZINC000183663532	539663842	/nfs/dbraw/zinc/66/38/42/539663842.db2.gz	AKBLWSQGNYKHJO-OAHLLOKOSA-N	0	3	316.405	2.029	10	0		DEAEHN
CNc1cc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)cc(Cl)n1	ZINC000083552803	192372674	/nfs/dbraw/zinc/37/26/74/192372674.db2.gz	CCLQVQBLYLHJGX-ZYHUDNBSSA-N	0	3	308.813	2.085	10	0		DEAEHN
CC[C@@H]1CN(Cc2cccc(OC)c2F)CCN1C[C@@H](C)O	ZINC000192950773	539710079	/nfs/dbraw/zinc/71/00/79/539710079.db2.gz	XQSIPOWJYXZJBV-UKRRQHHQSA-N	0	3	310.413	2.111	10	0		DEAEHN
CN[C@@H](C[S@](=O)C1CCOCC1)c1cc(C)ccc1OC	ZINC000084054747	192397469	/nfs/dbraw/zinc/39/74/69/192397469.db2.gz	IVBDMLGNCIRDSG-YCRPNKLZSA-N	0	3	311.447	2.192	10	0		DEAEHN
CCOc1ccc([C@H](C[S@@](=O)C2CCOCC2)NC)cc1	ZINC000084054948	192398057	/nfs/dbraw/zinc/39/80/57/192398057.db2.gz	DHKPGLDBMXVFOK-KKSFZXQISA-N	0	3	311.447	2.274	10	0		DEAEHN
O[C@@H]1CCC[C@@H]1CNCc1ccc(I)o1	ZINC000084223850	192414180	/nfs/dbraw/zinc/41/41/80/192414180.db2.gz	RCPATXNFMDIBFY-PSASIEDQSA-N	0	3	321.158	2.135	10	0		DEAEHN
COc1ccc(C(=O)N2CC[C@H](N(C)C)C2)cc1OC(F)F	ZINC000170865891	197841608	/nfs/dbraw/zinc/84/16/08/197841608.db2.gz	AWKLRDYREAUVFC-NSHDSACASA-N	0	3	314.332	2.073	10	0		DEAEHN
CC[C@@H](N)c1nc2cc(C)ccc2n1CCN1CCOCC1	ZINC000071666967	191001826	/nfs/dbraw/zinc/00/18/26/191001826.db2.gz	PINAJQXFHOWZHG-CQSZACIVSA-N	0	3	302.422	2.087	10	0		DEAEHN
COc1ccc(Cl)c2c1CN(Cc1nccn1C)[C@H]2CN	ZINC000071684012	191008410	/nfs/dbraw/zinc/00/84/10/191008410.db2.gz	WYPPPKLATAKBAI-LBPRGKRZSA-N	0	3	306.797	2.098	10	0		DEAEHN
NCc1ccccc1C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000071700084	191010294	/nfs/dbraw/zinc/01/02/94/191010294.db2.gz	OECKTOKKQVHLCJ-UHFFFAOYSA-N	0	3	311.385	2.234	10	0		DEAEHN
COC(=O)c1ccc(Cl)c(N[C@@H](C)C[C@H]2COCCN2)c1	ZINC000133649816	186003525	/nfs/dbraw/zinc/00/35/25/186003525.db2.gz	VJAOOIUTBKBXSB-JQWIXIFHSA-N	0	3	312.797	2.306	10	0		DEAEHN
CCNCc1cc(F)c(F)c(S(=O)(=O)N(C)C(C)C)c1	ZINC000138335353	186015498	/nfs/dbraw/zinc/01/54/98/186015498.db2.gz	CBCGELNRBJXXDP-UHFFFAOYSA-N	0	3	306.378	2.103	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000138271711	186015804	/nfs/dbraw/zinc/01/58/04/186015804.db2.gz	ZIJZNLQUVHEZHN-UHFFFAOYSA-N	0	3	318.389	2.249	10	0		DEAEHN
CCN(C(C)C)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138442829	186017003	/nfs/dbraw/zinc/01/70/03/186017003.db2.gz	PWZXVUHJUXPDEY-UHFFFAOYSA-N	0	3	306.378	2.103	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N(C)[C@H](C)C(C)C)c1	ZINC000138521653	186017700	/nfs/dbraw/zinc/01/77/00/186017700.db2.gz	BIHUCVPVQULCSE-SNVBAGLBSA-N	0	3	320.405	2.349	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N2C[C@@H](C)C[C@@H]2C)c1	ZINC000139345667	186021584	/nfs/dbraw/zinc/02/15/84/186021584.db2.gz	AURUGNYINFCDLS-UWVGGRQHSA-N	0	3	318.389	2.103	10	0		DEAEHN
CC(C)n1ncnc1C[C@H](N)c1ncccc1Br	ZINC000140341609	186026423	/nfs/dbraw/zinc/02/64/23/186026423.db2.gz	UUAAKTIQDNJQRB-JTQLQIEISA-N	0	3	310.199	2.259	10	0		DEAEHN
CCCCN(CC)[C@]1(CN)CCS(=O)(=O)c2ccccc21	ZINC000147637265	186040583	/nfs/dbraw/zinc/04/05/83/186040583.db2.gz	SEJCMAOWSAYNKL-INIZCTEOSA-N	0	3	310.463	2.140	10	0		DEAEHN
Cc1cc(S(=O)(=O)NCC(F)F)cc(CNC(C)C)c1F	ZINC000148187694	186043538	/nfs/dbraw/zinc/04/35/38/186043538.db2.gz	WXRXDYPJPVRROU-UHFFFAOYSA-N	0	3	324.368	2.176	10	0		DEAEHN
CC[C@@H]1N[C@H](c2cccs2)N([C@@H]2CCCN(CC)C2)C1=O	ZINC000144296766	186034771	/nfs/dbraw/zinc/03/47/71/186034771.db2.gz	LRFGYZGKJOUNPU-IPYPFGDCSA-N	0	3	307.463	2.441	10	0		DEAEHN
N[C@@H](Cc1cn2ccsc2n1)[C@H]1COc2ccccc2O1	ZINC000149186384	186048654	/nfs/dbraw/zinc/04/86/54/186048654.db2.gz	ZNYSWBQISIMJOM-SMDDNHRTSA-N	0	3	301.371	2.106	10	0		DEAEHN
CCO[C@@H]1C[C@](N)(C(=O)NC[C@H]2C[C@@H]2c2ccccc2)C1(C)C	ZINC000249087938	539778192	/nfs/dbraw/zinc/77/81/92/539778192.db2.gz	UILNGEWAHBEZDD-NNFUDEMPSA-N	0	3	316.445	2.439	10	0		DEAEHN
CN[C@@H]1CC(C)(C)Cc2nc([C@H]3CCS(=O)(=O)C3)sc21	ZINC000150258948	186056353	/nfs/dbraw/zinc/05/63/53/186056353.db2.gz	DOVWKPQUHNUXDT-VHSXEESVSA-N	0	3	314.476	2.278	10	0		DEAEHN
Cc1ccc(Br)c(NC(=O)C[C@H]2CNCCO2)c1	ZINC000163961961	186144159	/nfs/dbraw/zinc/14/41/59/186144159.db2.gz	ZBIOJRMICVXYOU-JTQLQIEISA-N	0	3	313.195	2.075	10	0		DEAEHN
CCN(CC)c1nc(NC)nc(N2C[C@@H](C)S[C@H](C)C2)n1	ZINC000155891597	186120922	/nfs/dbraw/zinc/12/09/22/186120922.db2.gz	HAKGULYPYGYFGL-GHMZBOCLSA-N	0	3	310.471	2.090	10	0		DEAEHN
COc1cccc(CNC[C@@H](C)[S@@](C)=O)c1OC(F)F	ZINC000159670642	186134030	/nfs/dbraw/zinc/13/40/30/186134030.db2.gz	WLTIDMRCPBQHMS-YBYGRFCBSA-N	0	3	307.362	2.153	10	0		DEAEHN
CN(C)C(=O)C1CCN(Cc2cnc(-c3ccccc3)[nH]2)CC1	ZINC000179685620	186205015	/nfs/dbraw/zinc/20/50/15/186205015.db2.gz	BNTQVKFMLSYLNH-UHFFFAOYSA-N	0	3	312.417	2.377	10	0		DEAEHN
CCn1cc(CNC2CCN(C(=O)c3ccccc3)CC2)cn1	ZINC000171835140	197992656	/nfs/dbraw/zinc/99/26/56/197992656.db2.gz	ONKQSWSCNWIBMW-UHFFFAOYSA-N	0	3	312.417	2.297	10	0		DEAEHN
CC(C)Cc1nnc(NC(=O)N2CCN3CCC[C@@H]3C2)s1	ZINC000171886638	198000567	/nfs/dbraw/zinc/00/05/67/198000567.db2.gz	BNXKPRABZRNOSI-LLVKDONJSA-N	0	3	309.439	2.049	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)Nc1nc2c(s1)COCC2	ZINC000172256797	198066446	/nfs/dbraw/zinc/06/64/46/198066446.db2.gz	KEMPLTWLNSDARS-LLVKDONJSA-N	0	3	324.450	2.212	10	0		DEAEHN
Cc1ncsc1CCN1CCCN(c2ccc(C)nn2)CC1	ZINC000172535415	198111510	/nfs/dbraw/zinc/11/15/10/198111510.db2.gz	IXFGZYLWJNUSSJ-UHFFFAOYSA-N	0	3	317.462	2.305	10	0		DEAEHN
Cc1nn(-c2nc(C)cc(C)n2)c(C)c1C(=O)CCN(C)C	ZINC000072416284	191155043	/nfs/dbraw/zinc/15/50/43/191155043.db2.gz	XSYIJFDGJPAFBQ-UHFFFAOYSA-N	0	3	301.394	2.030	10	0		DEAEHN
C[C@H](C1CC1)N(Cc1ccccc1)C(=O)COC1(C)CNC1	ZINC000309773936	539879100	/nfs/dbraw/zinc/87/91/00/539879100.db2.gz	WJCRUNKICKRMJU-CQSZACIVSA-N	0	3	302.418	2.192	10	0		DEAEHN
CN(C(=O)c1ncccc1N)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000309728850	539878093	/nfs/dbraw/zinc/87/80/93/539878093.db2.gz	QWAVZIWWZPLVGG-OAHLLOKOSA-N	0	3	310.401	2.010	10	0		DEAEHN
CCN(C(=O)c1cncc(Br)c1)[C@H]1CCN(C)C1	ZINC000617561082	363189779	/nfs/dbraw/zinc/18/97/79/363189779.db2.gz	DMSAEYWKRVIJRO-LBPRGKRZSA-N	0	3	312.211	2.010	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCc2ccc(F)cc2)CCN1C	ZINC000173189867	198193312	/nfs/dbraw/zinc/19/33/12/198193312.db2.gz	JBDOOZUYFSGHAT-CJNGLKHVSA-N	0	3	307.413	2.492	10	0		DEAEHN
C[C@H](CNC(=O)N1CCN2CCC[C@@H]2C1)Oc1ccc(F)cc1	ZINC000173275817	198206067	/nfs/dbraw/zinc/20/60/67/198206067.db2.gz	DSGKYNNMIXLUKD-UKRRQHHQSA-N	0	3	321.396	2.083	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2COc3ccccc3C2)CCN1C	ZINC000174062240	198286442	/nfs/dbraw/zinc/28/64/42/198286442.db2.gz	HABPMEKSBRBRSC-FVQBIDKESA-N	0	3	317.433	2.114	10	0		DEAEHN
CC[C@@H](O)CN1CCN(CCCc2cccc(OC)c2)CC1	ZINC000174081634	198289085	/nfs/dbraw/zinc/28/90/85/198289085.db2.gz	CDVWCIGHRDNKTD-QGZVFWFLSA-N	0	3	306.450	2.016	10	0		DEAEHN
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1CC[C@H](N2CC=CC2)C1	ZINC000174403070	198330785	/nfs/dbraw/zinc/33/07/85/198330785.db2.gz	HIDIXRCPBFNVPN-YESZJQIVSA-N	0	3	315.392	2.337	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)[C@H]2CCCCN2Cc2ccccc2)C1	ZINC000174583516	198355169	/nfs/dbraw/zinc/35/51/69/198355169.db2.gz	FCKXKICYNHJOEE-ZWKOTPCHSA-N	0	3	315.461	2.204	10	0		DEAEHN
O=C(CN1CCC[C@H]2CCCC[C@H]21)NC(=O)NCC(F)(F)F	ZINC000007588422	354004666	/nfs/dbraw/zinc/00/46/66/354004666.db2.gz	PLJKDJJXFLRQDB-GHMZBOCLSA-N	0	3	321.343	2.029	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NC[C@H]1CCCOC1)c1ccccc1	ZINC000057162126	354559083	/nfs/dbraw/zinc/55/90/83/354559083.db2.gz	DACZVJQWGRBFKM-GDBMZVCRSA-N	0	3	305.422	2.015	10	0		DEAEHN
COc1ccc(OCCCN2CCC(C(=O)N(C)C)CC2)cc1	ZINC000061761405	354631734	/nfs/dbraw/zinc/63/17/34/354631734.db2.gz	GNDWXFLDDUFDKO-UHFFFAOYSA-N	0	3	320.433	2.264	10	0		DEAEHN
C[C@H](N[C@@H]1CCC(F)(F)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000380307157	540122138	/nfs/dbraw/zinc/12/21/38/540122138.db2.gz	JGVGZAXCGDBZLU-GXSJLCMTSA-N	0	3	304.362	2.172	10	0		DEAEHN
COC(C)(C)C[C@H](C)NC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000073722361	191346238	/nfs/dbraw/zinc/34/62/38/191346238.db2.gz	ZIBUHHXAMDBZRA-KBPBESRZSA-N	0	3	301.475	2.466	10	0		DEAEHN
NC[C@H](NC(=O)c1cccc(Br)c1)C(F)(F)F	ZINC000401877889	540143022	/nfs/dbraw/zinc/14/30/22/540143022.db2.gz	ORAYOOGPUMVMCT-QMMMGPOBSA-N	0	3	311.101	2.069	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)N2CCO[C@H](c3cccs3)C2)C1	ZINC000120067620	355789768	/nfs/dbraw/zinc/78/97/68/355789768.db2.gz	KUVZJVIOQCEEQM-KGLIPLIRSA-N	0	3	323.462	2.173	10	0		DEAEHN
O=C(NCCN1CCCCC1)N[C@@H]1CCN(c2ccccc2)C1	ZINC000078544856	191881136	/nfs/dbraw/zinc/88/11/36/191881136.db2.gz	HRKIOJNECHUFMZ-MRXNPFEDSA-N	0	3	316.449	2.050	10	0		DEAEHN
CNC(=O)N1CCC([C@@H]2CCN(Cc3ccncc3F)C2)CC1	ZINC000169781623	355982917	/nfs/dbraw/zinc/98/29/17/355982917.db2.gz	PKMBVVUVQWFJFV-CQSZACIVSA-N	0	3	320.412	2.094	10	0		DEAEHN
NC(=O)C[C@H](NCc1cn2ccsc2n1)C1CCCCC1	ZINC000182062354	356108199	/nfs/dbraw/zinc/10/81/99/356108199.db2.gz	KEFSXHHRHXWIKQ-ZDUSSCGKSA-N	0	3	306.435	2.310	10	0		DEAEHN
C[C@@H](CN[C@@H](C)c1cccc(-n2cccn2)c1)CS(C)(=O)=O	ZINC000183594643	356176531	/nfs/dbraw/zinc/17/65/31/356176531.db2.gz	JMCKXVNBCFJCCL-KBPBESRZSA-N	0	3	321.446	2.204	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCCN([C@@H]2CN3CCC2CC3)CC1	ZINC000226093342	356278313	/nfs/dbraw/zinc/27/83/13/356278313.db2.gz	QORVYMUFFVFZEQ-OAHLLOKOSA-N	0	3	309.454	2.023	10	0		DEAEHN
NCc1c(I)nccc1OC(F)(F)F	ZINC000238615272	356304522	/nfs/dbraw/zinc/30/45/22/356304522.db2.gz	DFUYHZPILSFTRB-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
C[C@H]1CC[C@](N)(c2ncc(I)cn2)C1	ZINC000306647137	356404793	/nfs/dbraw/zinc/40/47/93/356404793.db2.gz	PFBKFJTXSFDKFT-OIBJUYFYSA-N	0	3	303.147	2.055	10	0		DEAEHN
NCc1cc(C(F)(F)F)cnc1I	ZINC000306923115	356406015	/nfs/dbraw/zinc/40/60/15/356406015.db2.gz	YQFVYMLPIYLVKN-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
Cc1cc(C)c(C(=O)N2CCO[C@@H](CN(C)CC3CC3)C2)o1	ZINC000328640357	356465368	/nfs/dbraw/zinc/46/53/68/356465368.db2.gz	QBHNMQHTPJIXCC-HNNXBMFYSA-N	0	3	306.406	2.079	10	0		DEAEHN
CC[C@@H](C)[C@@H]([NH3+])C(=O)NCc1ccc([O-])c(Br)c1	ZINC000236984151	202108429	/nfs/dbraw/zinc/10/84/29/202108429.db2.gz	PJFZMQXTAYHRIQ-PRHODGIISA-N	0	3	315.211	2.144	10	0		DEAEHN
CC[C@@H](C)[C@H]([NH3+])C(=O)Nc1n[n-]c(-c2ccccc2Cl)n1	ZINC000236994452	202113252	/nfs/dbraw/zinc/11/32/52/202113252.db2.gz	CUPMPPWETHWXPS-KCJUWKMLSA-N	0	3	307.785	2.437	10	0		DEAEHN
OCCN1CCC[C@@H](NCc2ccc(Br)s2)C1	ZINC000384294573	356682403	/nfs/dbraw/zinc/68/24/03/356682403.db2.gz	FDJVTEMXLRYKPP-SNVBAGLBSA-N	0	3	319.268	2.057	10	0		DEAEHN
C[C@@H](NCc1cc2c(cc1Br)OCO2)C(C)(C)O	ZINC000393962822	356713266	/nfs/dbraw/zinc/71/32/66/356713266.db2.gz	IDPRZRLYINTEDH-MRVPVSSYSA-N	0	3	316.195	2.427	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@H](c2cccc(F)c2)C1)N(C)C	ZINC000178656500	198904940	/nfs/dbraw/zinc/90/49/40/198904940.db2.gz	GKNTWTZXFFDZPK-HOTGVXAUSA-N	0	3	308.397	2.456	10	0		DEAEHN
O=C(NCCCCc1ccccc1)NCCNc1ccncc1	ZINC000591548504	357734416	/nfs/dbraw/zinc/73/44/16/357734416.db2.gz	XBPZROHBVPUAMO-UHFFFAOYSA-N	0	3	312.417	2.238	10	0		DEAEHN
COc1ccc([C@H](C)CN2CCN(c3cccnn3)CC2)cc1	ZINC000179972460	199101776	/nfs/dbraw/zinc/10/17/76/199101776.db2.gz	PEAAKUBUVKIDAF-OAHLLOKOSA-N	0	3	312.417	2.411	10	0		DEAEHN
CCOc1cccc(CN2C[C@@H](C)[C@H](N3CCOCC3)C2)c1	ZINC000180224211	199133324	/nfs/dbraw/zinc/13/33/24/199133324.db2.gz	JNHMWCJMKMMUBZ-CRAIPNDOSA-N	0	3	304.434	2.238	10	0		DEAEHN
c1cc(-c2noc(CN3CC[C@@H](N4CCCCC4)C3)n2)co1	ZINC000594024882	358191685	/nfs/dbraw/zinc/19/16/85/358191685.db2.gz	UCNLEBLUBTVHCA-CQSZACIVSA-N	0	3	302.378	2.390	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCC2(C)Cc3ccccc3C2)C1	ZINC000180580770	199179991	/nfs/dbraw/zinc/17/99/91/199179991.db2.gz	VCWVEZLZZVYVBQ-INIZCTEOSA-N	0	3	301.434	2.137	10	0		DEAEHN
CN1c2ccc(CN3CCN4CCCC[C@@H]4C3)cc2CCC1=O	ZINC000186919161	200031308	/nfs/dbraw/zinc/03/13/08/200031308.db2.gz	SLLBOCSMAICSGE-QGZVFWFLSA-N	0	3	313.445	2.266	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)c1c[nH]nc1C1CC1	ZINC000187307145	200092375	/nfs/dbraw/zinc/09/23/75/200092375.db2.gz	RFVYJMAPHLYWEE-HNNXBMFYSA-N	0	3	312.417	2.190	10	0		DEAEHN
CCN1CCN(c2cccc(NC(=O)C[C@@H](O)C(C)C)c2)CC1	ZINC000187401291	200107204	/nfs/dbraw/zinc/10/72/04/200107204.db2.gz	SJDXEAYZXDRFCG-QGZVFWFLSA-N	0	3	319.449	2.174	10	0		DEAEHN
O=C(NCc1ccc(Cl)cc1F)N1CCN2CCC[C@H]2C1	ZINC000187859001	200167301	/nfs/dbraw/zinc/16/73/01/200167301.db2.gz	MTGWOZAHGDACNO-ZDUSSCGKSA-N	0	3	311.788	2.469	10	0		DEAEHN
CCSc1cc(CNC(=O)N2CC[C@H](N(C)C)C2)ccn1	ZINC000188111188	200194942	/nfs/dbraw/zinc/19/49/42/200194942.db2.gz	JVJIYLVHSTWQOR-ZDUSSCGKSA-N	0	3	308.451	2.039	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)N3C[C@H]4CCCN4C[C@H]3C)cc2c1	ZINC000189285359	200376136	/nfs/dbraw/zinc/37/61/36/200376136.db2.gz	ABLYZWGTSOULGU-TZMCWYRMSA-N	0	3	313.401	2.485	10	0		DEAEHN
CNS(=O)(=O)c1cccc(CN[C@@H]2CC[C@@H]2C2CCC2)c1	ZINC000516787301	283523772	/nfs/dbraw/zinc/52/37/72/283523772.db2.gz	JOEMMTZILFNPOI-HZPDHXFCSA-N	0	3	308.447	2.263	10	0		DEAEHN
c1ccc2c(c1)[nH]c1c2C[C@@H](NCc2nnc3ccccn32)C1	ZINC000442849788	238086747	/nfs/dbraw/zinc/08/67/47/238086747.db2.gz	URQNZPFTRPXUPZ-GFCCVEGCSA-N	0	3	303.369	2.468	10	0		DEAEHN
C[C@H](NC(=O)N[C@@H]1CCN(C2CC2)C1)c1ccc2c(c1)OCO2	ZINC000604165060	360887491	/nfs/dbraw/zinc/88/74/91/360887491.db2.gz	YPKJDZTTZDNROZ-WCQYABFASA-N	0	3	317.389	2.012	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)C1CCN(Cc2ccnc(N)c2)CC1	ZINC000193323447	201029453	/nfs/dbraw/zinc/02/94/53/201029453.db2.gz	USBLOGCBAZFOBN-CYBMUJFWSA-N	0	3	304.438	2.037	10	0		DEAEHN
CCO[C@@H](CNC(=O)NC[C@@H]1CCCN1C)c1ccccc1	ZINC000193499857	201064926	/nfs/dbraw/zinc/06/49/26/201064926.db2.gz	PUOWWVVSPUUNIT-HOTGVXAUSA-N	0	3	305.422	2.158	10	0		DEAEHN
COC(=O)C(C)(C)[C@@H](NCCn1ccnc1)c1ccccc1	ZINC000611405438	361593080	/nfs/dbraw/zinc/59/30/80/361593080.db2.gz	DQWMUMULKYHUEJ-HNNXBMFYSA-N	0	3	301.390	2.413	10	0		DEAEHN
COC(=O)C(C)(C)[C@H](NC[C@@H](O)COC(C)C)c1ccccc1	ZINC000611406870	361593141	/nfs/dbraw/zinc/59/31/41/361593141.db2.gz	ZCRNODXUMDRGQQ-HZPDHXFCSA-N	0	3	323.433	2.302	10	0		DEAEHN
COC(=O)[C@@H]1CC12CCN(Cc1c(C)cc(OC)nc1C)CC2	ZINC000611621933	361646764	/nfs/dbraw/zinc/64/67/64/361646764.db2.gz	LAYOVOSASNVEQX-HNNXBMFYSA-N	0	3	318.417	2.482	10	0		DEAEHN
CSC1(CNC(=O)N[C@@H](CN(C)C)c2ccccc2)CC1	ZINC000194819211	201296049	/nfs/dbraw/zinc/29/60/49/201296049.db2.gz	OPKYUCJGLORLNL-AWEZNQCLSA-N	0	3	307.463	2.484	10	0		DEAEHN
Cc1ccc(C(=O)NCCNc2ccncc2)c(F)c1Cl	ZINC000448035299	239229351	/nfs/dbraw/zinc/22/93/51/239229351.db2.gz	OXKBWHBBIVZSLM-UHFFFAOYSA-N	0	3	307.756	2.446	10	0		DEAEHN
CC(=O)N(C[C@@H]1CCCN1Cc1cnn2ccccc12)C1CC1	ZINC000275535358	212399686	/nfs/dbraw/zinc/39/96/86/212399686.db2.gz	DZTALABBNNEJCJ-KRWDZBQOSA-N	0	3	312.417	2.310	10	0		DEAEHN
NC[C@H](NC(=O)c1cscc1C(F)(F)F)C(F)(F)F	ZINC000621668476	364497508	/nfs/dbraw/zinc/49/75/08/364497508.db2.gz	GHTVPCSQXYXGRZ-LURJTMIESA-N	0	3	306.231	2.386	10	0		DEAEHN
Cc1cc(N2CCC(NCc3ccncc3F)CC2)nc(C)n1	ZINC000449221930	240218611	/nfs/dbraw/zinc/21/86/11/240218611.db2.gz	HODSDEKFNKFSOY-UHFFFAOYSA-N	0	3	315.396	2.386	10	0		DEAEHN
CN1C[C@@H](CNCc2ccsc2Br)CC1=O	ZINC000623570725	365084557	/nfs/dbraw/zinc/08/45/57/365084557.db2.gz	BXVVTVOSDMCVLJ-MRVPVSSYSA-N	0	3	303.225	2.079	10	0		DEAEHN
C[S@@](=O)CCN[C@@H]1CCc2c1cccc2Br	ZINC000091341896	193043722	/nfs/dbraw/zinc/04/37/22/193043722.db2.gz	UUBRPKCUEHAMGI-WBMJQRKESA-N	0	3	302.237	2.405	10	0		DEAEHN
C[C@@H](NC[C@H]1COCCN1C)c1cc(Br)cs1	ZINC000624176890	365320303	/nfs/dbraw/zinc/32/03/03/365320303.db2.gz	UQPKPXMFEVIANR-KOLCDFICSA-N	0	3	319.268	2.492	10	0		DEAEHN
Cn1ccnc1[C@@H](NC[C@@H]1CCCO[C@H]1c1cn[nH]c1)C1CC1	ZINC000624241234	365348474	/nfs/dbraw/zinc/34/84/74/365348474.db2.gz	CKMPXTLIJUKZCF-CWRNSKLLSA-N	0	3	315.421	2.352	10	0		DEAEHN
C[C@H](NC[C@@H]1CN(C)CCO1)c1cccc(OC(F)F)c1	ZINC000091667718	193088095	/nfs/dbraw/zinc/08/80/95/193088095.db2.gz	HCWLWBCBGTVJJH-SMDDNHRTSA-N	0	3	300.349	2.269	10	0		DEAEHN
CC[C@@H]1[NH2+]CC[C@H]1[N-]S(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000624391691	365406658	/nfs/dbraw/zinc/40/66/58/365406658.db2.gz	BJTYQZWSLUXDCE-NWDGAFQWSA-N	0	3	323.245	2.412	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)s1	ZINC000092113936	193161056	/nfs/dbraw/zinc/16/10/56/193161056.db2.gz	GRIOHAXXWLTMNR-QWRGUYRKSA-N	0	3	302.465	2.134	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)ccc1C	ZINC000092113767	193161189	/nfs/dbraw/zinc/16/11/89/193161189.db2.gz	SKVCEGWETSCYBZ-ZIAGYGMSSA-N	0	3	310.463	2.381	10	0		DEAEHN
CC(C)[NH2+]Cc1ccc(S(=O)(=O)[N-]C(C)(C)C)c(F)c1	ZINC000092115772	193163692	/nfs/dbraw/zinc/16/36/92/193163692.db2.gz	IFGYIGYWDKUBBR-UHFFFAOYSA-N	0	3	302.415	2.401	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCCCC[C@@H]2C)c(F)c1	ZINC000092116228	193163805	/nfs/dbraw/zinc/16/38/05/193163805.db2.gz	ZYZBGTOAUWNRLV-LBPRGKRZSA-N	0	3	314.426	2.498	10	0		DEAEHN
CC(C)CN(C1CC1)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115959	193164131	/nfs/dbraw/zinc/16/41/31/193164131.db2.gz	CZJFISLCJCGPAA-UHFFFAOYSA-N	0	3	300.399	2.094	10	0		DEAEHN
CN(c1cccc(F)c1)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092116038	193164456	/nfs/dbraw/zinc/16/44/56/193164456.db2.gz	XBAARXIZHCFXME-UHFFFAOYSA-N	0	3	312.341	2.249	10	0		DEAEHN
CC(=O)N1CCC[C@@H](CNCc2ccnn2CC2CCC2)C1	ZINC000631124843	368031210	/nfs/dbraw/zinc/03/12/10/368031210.db2.gz	SXYQPGAAIVGXOG-INIZCTEOSA-N	0	3	304.438	2.031	10	0		DEAEHN
c1nc2sc3c(c2c(N2CC(N4CCCC4)C2)n1)CCC3	ZINC000631353977	368170759	/nfs/dbraw/zinc/17/07/59/368170759.db2.gz	VIEGZKSGLYZBPF-UHFFFAOYSA-N	0	3	300.431	2.464	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000262524246	203320663	/nfs/dbraw/zinc/32/06/63/203320663.db2.gz	FYCVIKQVJPGTQB-TZMCWYRMSA-N	0	3	302.777	2.146	10	0		DEAEHN
N=C(N)c1c(F)cccc1Sc1nnnn1C1CCCC1	ZINC000093409308	193245790	/nfs/dbraw/zinc/24/57/90/193245790.db2.gz	SVDJLAHOSDCVIG-UHFFFAOYSA-N	0	3	306.370	2.363	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)NCc1cc(OC)nc2ccccc12	ZINC000262708632	203389529	/nfs/dbraw/zinc/38/95/29/203389529.db2.gz	OEPHTRKCYGQBLK-ZBEGNZNMSA-N	0	3	301.390	2.233	10	0		DEAEHN
N[C@H](Cc1c[nH]cn1)c1nc2cc(F)c(Br)cc2[nH]1	ZINC000093728651	193297031	/nfs/dbraw/zinc/29/70/31/193297031.db2.gz	SUZQVXCMIIMEJJ-SECBINFHSA-N	0	3	324.157	2.430	10	0		DEAEHN
N[C@H](Cc1c[nH]cn1)c1nc2cc(Br)c(F)cc2[nH]1	ZINC000093728651	193297032	/nfs/dbraw/zinc/29/70/32/193297032.db2.gz	SUZQVXCMIIMEJJ-SECBINFHSA-N	0	3	324.157	2.430	10	0		DEAEHN
COC(=O)[C@]1(N)CCC[C@H](N2CCC(C(F)(F)F)CC2)C1	ZINC000093756675	193301483	/nfs/dbraw/zinc/30/14/83/193301483.db2.gz	IPISGOAFRIKOGT-AAEUAGOBSA-N	0	3	308.344	2.074	10	0		DEAEHN
Cc1csc(S[C@@H]2CCC[C@@](NC3CC3)(C(N)=O)C2)n1	ZINC000093778066	193304450	/nfs/dbraw/zinc/30/44/50/193304450.db2.gz	ZMGDBJDEGUPTAV-RISCZKNCSA-N	0	3	311.476	2.462	10	0		DEAEHN
COc1ccc(S[C@@H]2CC[C@](NC3CC3)(C(N)=O)C2)cc1	ZINC000093850425	193317735	/nfs/dbraw/zinc/31/77/35/193317735.db2.gz	WCPPGQJVGDICTO-GDBMZVCRSA-N	0	3	306.431	2.316	10	0		DEAEHN
CN[C@@H](c1ccc(C(F)(F)F)cc1)[C@@H]1CN(C)CCN1C	ZINC000093894767	193324598	/nfs/dbraw/zinc/32/45/98/193324598.db2.gz	QBKZXIIGKNUKKO-KBPBESRZSA-N	0	3	301.356	2.212	10	0		DEAEHN
CN[C@@H](c1ccc(C(F)(F)F)cc1)[C@H]1CN(C)CCN1C	ZINC000093894769	193325019	/nfs/dbraw/zinc/32/50/19/193325019.db2.gz	QBKZXIIGKNUKKO-KGLIPLIRSA-N	0	3	301.356	2.212	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)cc1)N(C)CCS(C)(=O)=O	ZINC000094297104	193356543	/nfs/dbraw/zinc/35/65/43/193356543.db2.gz	YHXCGAPWAQZICU-KBPBESRZSA-N	0	3	318.870	2.095	10	0		DEAEHN
CN1CCC(Nc2nc(C(F)(F)F)ccc2C(N)=S)CC1	ZINC000094335942	193360312	/nfs/dbraw/zinc/36/03/12/193360312.db2.gz	AWFQPXAUGYEQPW-UHFFFAOYSA-N	0	3	318.368	2.241	10	0		DEAEHN
CSCC[C@H](N)C(=O)Nc1cc(C)c(Br)cn1	ZINC000094063527	193342487	/nfs/dbraw/zinc/34/24/87/193342487.db2.gz	JBRDIJRZKULVPF-VIFPVBQESA-N	0	3	318.240	2.171	10	0		DEAEHN
CCN[C@H](c1cc(C)c(F)cc1F)[C@@H]1CCS(=O)(=O)C1	ZINC000094077964	193344051	/nfs/dbraw/zinc/34/40/51/193344051.db2.gz	ZFQRTMAGRWTXCM-YGRLFVJLSA-N	0	3	303.374	2.359	10	0		DEAEHN
CN[C@H]1COC[C@@H]1c1nc(-c2ncc(Cl)cc2Cl)no1	ZINC000094199324	193348567	/nfs/dbraw/zinc/34/85/67/193348567.db2.gz	LVJLRYQEIPGZKS-CBAPKCEASA-N	0	3	315.160	2.140	10	0		DEAEHN
CC(C)([C@H](O)[C@H]1CCC[C@H](S(C)(=O)=O)C1)N1CCCCC1	ZINC000094641332	193388775	/nfs/dbraw/zinc/38/87/75/193388775.db2.gz	KUAWRUZZGIWMDV-SOUVJXGZSA-N	0	3	317.495	2.215	10	0		DEAEHN
CC(C)(C)NCc1ccn([C@H]2CCC[C@H](S(C)(=O)=O)C2)n1	ZINC000094644460	193389689	/nfs/dbraw/zinc/38/96/89/193389689.db2.gz	XXFSVPSNEFSNSB-KBPBESRZSA-N	0	3	313.467	2.300	10	0		DEAEHN
COCCNCc1cc(Cl)c(O[C@H](C)[C@H](C)O)c(OC)c1	ZINC000094653295	193390985	/nfs/dbraw/zinc/39/09/85/193390985.db2.gz	AXZFTRKWMSQCKC-WDEREUQCSA-N	0	3	317.813	2.233	10	0		DEAEHN
CC(C)(C)NCc1cn([C@@H]2CCO[C@]3(CCSC3)C2)nn1	ZINC000094419106	193368550	/nfs/dbraw/zinc/36/85/50/193368550.db2.gz	AGVWYGBJNDHTLD-UKRRQHHQSA-N	0	3	310.467	2.393	10	0		DEAEHN
CC(C)(C)NCc1cn([C@H]2CCO[C@@]3(CCSC3)C2)nn1	ZINC000094419109	193368671	/nfs/dbraw/zinc/36/86/71/193368671.db2.gz	AGVWYGBJNDHTLD-ZFWWWQNUSA-N	0	3	310.467	2.393	10	0		DEAEHN
CNCc1ccc(Cl)c(S(=O)(=O)N2CCC(C)(C)C2)c1	ZINC000094815012	193399818	/nfs/dbraw/zinc/39/98/18/193399818.db2.gz	KQAMAUKGECEUOG-UHFFFAOYSA-N	0	3	316.854	2.480	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@H]1NCc1csc(Br)c1	ZINC000282536123	217069364	/nfs/dbraw/zinc/06/93/64/217069364.db2.gz	ZKUSNDVMRPYGCL-VXNVDRBHSA-N	0	3	303.225	2.267	10	0		DEAEHN
Cc1c(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)[nH]c2c1C(=O)CCC2	ZINC000266103256	205100698	/nfs/dbraw/zinc/10/06/98/205100698.db2.gz	SITOPOPQRDDRKT-DGCLKSJQSA-N	0	3	317.433	2.397	10	0		DEAEHN
CC(C)(C)NCc1ccnc(NC2CCS(=O)CC2)c1F	ZINC000097875446	193765184	/nfs/dbraw/zinc/76/51/84/193765184.db2.gz	JZQCOWHJGKHVEA-UHFFFAOYSA-N	0	3	313.442	2.432	10	0		DEAEHN
Cc1c(C(=O)N2CCC[C@H]2CN(C)C)oc2c1C(=O)CCC2	ZINC000267510966	206117237	/nfs/dbraw/zinc/11/72/37/206117237.db2.gz	IPFSNQXPYFPRMC-LBPRGKRZSA-N	0	3	304.390	2.273	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1ccc(OC)cc1C	ZINC000036076762	182795451	/nfs/dbraw/zinc/79/54/51/182795451.db2.gz	HFDHEWGQSJNUKP-CYBMUJFWSA-N	0	3	314.451	2.012	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)Nc1cc(C(=O)N(C)C)ccc1Cl	ZINC000037003300	182860219	/nfs/dbraw/zinc/86/02/19/182860219.db2.gz	MNOMHKHADAOXNH-ZANVPECISA-N	0	3	311.813	2.354	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2ccc(Cl)c3ncccc23)C1	ZINC000040633635	183111706	/nfs/dbraw/zinc/11/17/06/183111706.db2.gz	CLFBUXYQEIRTAH-TVQRCGJNSA-N	0	3	305.765	2.204	10	0		DEAEHN
COC(=O)c1c(NC(=O)[C@@H](N)CC(C)C)sc2c1CCC2	ZINC000040858844	183143327	/nfs/dbraw/zinc/14/33/27/183143327.db2.gz	NXUIPUUQLBKEGD-JTQLQIEISA-N	0	3	310.419	2.335	10	0		DEAEHN
COC(=O)[C@@H](C)CNCc1cc(Br)ccc1F	ZINC000041069410	183162591	/nfs/dbraw/zinc/16/25/91/183162591.db2.gz	QFDZDXNTBKLTQR-QMMMGPOBSA-N	0	3	304.159	2.487	10	0		DEAEHN
CC1(C)COCCN1[C@H](CN)c1ccc(Br)o1	ZINC000042461406	183272901	/nfs/dbraw/zinc/27/29/01/183272901.db2.gz	MEONEHXBAQIXBS-SECBINFHSA-N	0	3	303.200	2.153	10	0		DEAEHN
CCN(CCOC)[C@@H](CN)c1ccccc1Br	ZINC000042492640	183276227	/nfs/dbraw/zinc/27/62/27/183276227.db2.gz	CIWHYFNGVBATME-ZDUSSCGKSA-N	0	3	301.228	2.417	10	0		DEAEHN
CCN(CCOC)[C@@H](CN)c1cccc(Br)c1	ZINC000042492561	183276511	/nfs/dbraw/zinc/27/65/11/183276511.db2.gz	LIVMIDLAFGXJAI-ZDUSSCGKSA-N	0	3	301.228	2.417	10	0		DEAEHN
C[C@@H](N)[C@@H](c1cccc(Cl)c1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043014543	183327609	/nfs/dbraw/zinc/32/76/09/183327609.db2.gz	WCXGXLMDUHLYAQ-DFBGVHRSSA-N	0	3	309.841	2.281	10	0		DEAEHN
C[C@@H](N)[C@@H](c1cccc(Cl)c1)N(CC(N)=O)C1CCCC1	ZINC000043015967	183327719	/nfs/dbraw/zinc/32/77/19/183327719.db2.gz	ABQGUYAHVHPELO-BZNIZROVSA-N	0	3	309.841	2.458	10	0		DEAEHN
NC[C@H](c1cccc(Br)c1)N1CCC(CO)CC1	ZINC000043020261	183328564	/nfs/dbraw/zinc/32/85/64/183328564.db2.gz	LYUNMTGYWLEUJH-CQSZACIVSA-N	0	3	313.239	2.153	10	0		DEAEHN
COc1ccc2cc([C@H](N)[C@H]3CCS(=O)(=O)C3)ccc2c1	ZINC000043299895	183351433	/nfs/dbraw/zinc/35/14/33/183351433.db2.gz	RSBUXWTYMDOQNO-HOCLYGCPSA-N	0	3	305.399	2.283	10	0		DEAEHN
CCCN[C@@H](c1cc(F)ccc1F)[C@H]1CCS(=O)(=O)C1	ZINC000043301288	183352446	/nfs/dbraw/zinc/35/24/46/183352446.db2.gz	GWHAAWVRHCIKAB-IINYFYTJSA-N	0	3	303.374	2.440	10	0		DEAEHN
CN[C@H](c1ccc(C(F)(F)F)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000043300513	183352482	/nfs/dbraw/zinc/35/24/82/183352482.db2.gz	UHZAGXBXDXEPGJ-ZYHUDNBSSA-N	0	3	307.337	2.401	10	0		DEAEHN
Cc1ccc([C@@H]([C@@H](C)N)N2CCN(c3nccs3)CC2)o1	ZINC000043363894	183357483	/nfs/dbraw/zinc/35/74/83/183357483.db2.gz	WKBGOXIUHLARHJ-TZMCWYRMSA-N	0	3	306.435	2.255	10	0		DEAEHN
CNCc1cccc(Br)c1OCC(=O)OC(C)C	ZINC000043446067	183364558	/nfs/dbraw/zinc/36/45/58/183364558.db2.gz	BMNIAGYGRIHFJI-UHFFFAOYSA-N	0	3	316.195	2.499	10	0		DEAEHN
CC(C)N1CCC(N(C)C(=O)c2nnc(Cl)s2)CC1	ZINC000159759138	197361557	/nfs/dbraw/zinc/36/15/57/197361557.db2.gz	BAGZFHYYJFWFHO-UHFFFAOYSA-N	0	3	302.831	2.136	10	0		DEAEHN
CCOc1ccc(NC(=O)[C@H](C)NCCn2cc(C)cn2)cc1	ZINC000105881406	194155495	/nfs/dbraw/zinc/15/54/95/194155495.db2.gz	UEAYVHNSURRVJP-AWEZNQCLSA-N	0	3	316.405	2.207	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2ccc(OC(F)F)cc2)C[C@@H]1C	ZINC000106097768	194186344	/nfs/dbraw/zinc/18/63/44/194186344.db2.gz	SXIFDRNOQHVCRE-QWHCGFSZSA-N	0	3	314.376	2.175	10	0		DEAEHN
FC(F)Oc1ccccc1CNC[C@H]1CN(C2CC2)CCO1	ZINC000106380815	194204704	/nfs/dbraw/zinc/20/47/04/194204704.db2.gz	KTXSTSHKVGJEBJ-AWEZNQCLSA-N	0	3	312.360	2.241	10	0		DEAEHN
C[C@@H](Cc1cccs1)N[C@@H]1CC(=O)N(C2CCCC2)C1=O	ZINC000109379757	194260089	/nfs/dbraw/zinc/26/00/89/194260089.db2.gz	FCRPHUGLEVAUNX-SMDDNHRTSA-N	0	3	306.431	2.339	10	0		DEAEHN
CCc1ccc(CN2CCN([C@@H](CC)C(N)=S)CC2)s1	ZINC000109469657	194267473	/nfs/dbraw/zinc/26/74/73/194267473.db2.gz	CBEUYMDFOWVTSO-AWEZNQCLSA-N	0	3	311.520	2.493	10	0		DEAEHN
COC[C@@H](N)Cc1nc(-c2cccc(C(F)(F)F)c2)no1	ZINC000109496400	194268755	/nfs/dbraw/zinc/26/87/55/194268755.db2.gz	NLYPOADNMIFLSH-JTQLQIEISA-N	0	3	301.268	2.272	10	0		DEAEHN
c1ccc(OCCN2CCCC[C@H]2CN2CCOCC2)cc1	ZINC000109820997	194289250	/nfs/dbraw/zinc/28/92/50/194289250.db2.gz	WEBMDLTZYWPUEL-KRWDZBQOSA-N	0	3	304.434	2.252	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2ccccc2C(F)(F)F)CCN1C	ZINC000110708491	194353716	/nfs/dbraw/zinc/35/37/16/194353716.db2.gz	MWVIDJVQTGBFOT-RISCZKNCSA-N	0	3	301.356	2.341	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)s1)N1CCNC(=O)C1(C)C	ZINC000110653432	194347203	/nfs/dbraw/zinc/34/72/03/194347203.db2.gz	VOGLDRVZSSVPFY-CABZTGNLSA-N	0	3	315.870	2.390	10	0		DEAEHN
CC[C@@H]1C(=O)NCCN1[C@@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000110677580	194348872	/nfs/dbraw/zinc/34/88/72/194348872.db2.gz	AVLXWNJYSMPTAR-KBVBSXBZSA-N	0	3	301.843	2.000	10	0		DEAEHN
CC[C@H]1C(=O)NCCN1c1cccc(Cl)c1CNC1CC1	ZINC000110682704	194349111	/nfs/dbraw/zinc/34/91/11/194349111.db2.gz	LKENMEFJUMWAPF-AWEZNQCLSA-N	0	3	307.825	2.307	10	0		DEAEHN
C[C@](O)(Cc1ccc(C(F)(F)F)cc1)C[C@@H]1COCCN1	ZINC000156779706	197140729	/nfs/dbraw/zinc/14/07/29/197140729.db2.gz	ZUEVQSJMCLKBJH-KGLIPLIRSA-N	0	3	303.324	2.377	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)NC1CCCCCCC1	ZINC000061041553	184160939	/nfs/dbraw/zinc/16/09/39/184160939.db2.gz	RLQJPLWLSZIARL-UHFFFAOYSA-N	0	3	307.482	2.386	10	0		DEAEHN
COc1ccccc1CCC(=O)N1CCCN(C2CC2)CC1	ZINC000061605624	184177151	/nfs/dbraw/zinc/17/71/51/184177151.db2.gz	KUHTXYMQVRAODX-UHFFFAOYSA-N	0	3	302.418	2.325	10	0		DEAEHN
C[C@H](c1cccc(Cl)c1)N(C)C(=O)[C@H](C)N1CCNCC1	ZINC000062028188	184202095	/nfs/dbraw/zinc/20/20/95/184202095.db2.gz	KTIPMSKIGSSRFJ-OLZOCXBDSA-N	0	3	309.841	2.153	10	0		DEAEHN
COCCCN(C)[C@H](CN)c1cc2c(c(Cl)c1)OCO2	ZINC000062029709	184202112	/nfs/dbraw/zinc/20/21/12/184202112.db2.gz	IWQVAEFRSILOFQ-GFCCVEGCSA-N	0	3	300.786	2.037	10	0		DEAEHN
Brc1ccccc1-c1cc(N2CCNCC2)n[nH]1	ZINC000062669905	184247118	/nfs/dbraw/zinc/24/71/18/184247118.db2.gz	OAZRIRSQPBEMLU-UHFFFAOYSA-N	0	3	307.195	2.249	10	0		DEAEHN
C[C@@H](NCCc1nccs1)c1ccc2c(c1)NC(=O)CO2	ZINC000063133624	184272971	/nfs/dbraw/zinc/27/29/71/184272971.db2.gz	ZXSCNLWCCVGTRE-SNVBAGLBSA-N	0	3	303.387	2.367	10	0		DEAEHN
[NH3+][C@H]1CCC[C@@H]1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000063175787	184276572	/nfs/dbraw/zinc/27/65/72/184276572.db2.gz	KRUMIAREPSYOSA-IUCAKERBSA-N	0	3	309.218	2.152	10	0		DEAEHN
CN(C)C(=O)CCc1cccc(NC(=O)CNC(C)(C)C)c1	ZINC000066212442	184397272	/nfs/dbraw/zinc/39/72/72/184397272.db2.gz	JDDFEZIIGGWEGF-UHFFFAOYSA-N	0	3	305.422	2.034	10	0		DEAEHN
C[C@@H](NC[C@@H](O)COC[C@@H]1CCCO1)c1ccc(F)cc1F	ZINC000538187394	285027266	/nfs/dbraw/zinc/02/72/66/285027266.db2.gz	GEVBQHHQHHLHFH-BNOWGMLFSA-N	0	3	315.360	2.172	10	0		DEAEHN
CCc1cc(=O)[n-]c(CN2CCC(C[NH+]3CCCC3)CC2)n1	ZINC000119894247	195056975	/nfs/dbraw/zinc/05/69/75/195056975.db2.gz	DGUTVJWMKBOWCM-UHFFFAOYSA-N	0	3	304.438	2.052	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCC[C@H](C)CC2)cc(CN)c1F	ZINC000159116259	197328476	/nfs/dbraw/zinc/32/84/76/197328476.db2.gz	VQDCVTDIJLVBLP-NSHDSACASA-N	0	3	314.426	2.404	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)C2CC2)cc(CNC(C)C)c1F	ZINC000159061672	197323684	/nfs/dbraw/zinc/32/36/84/197323684.db2.gz	ZPWBBRAZGAMEFK-UHFFFAOYSA-N	0	3	314.426	2.415	10	0		DEAEHN
CCN[C@@H](CS(=O)(=O)c1ccccc1Cl)[C@H]1CCOC1	ZINC000158719055	197296267	/nfs/dbraw/zinc/29/62/67/197296267.db2.gz	RGULCPGHJQQHPM-AAEUAGOBSA-N	0	3	317.838	2.128	10	0		DEAEHN
CNCc1ccc(C)c(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)c1	ZINC000158746989	197298099	/nfs/dbraw/zinc/29/80/99/197298099.db2.gz	RKBBTXXGYCQIAF-GJZGRUSLSA-N	0	3	308.447	2.135	10	0		DEAEHN
Cc1cc(C)c(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)cc1CN	ZINC000158736418	197297900	/nfs/dbraw/zinc/29/79/00/197297900.db2.gz	FWDWYHDEWVQFNH-OKILXGFUSA-N	0	3	308.447	2.183	10	0		DEAEHN
CN[C@H](C)c1cccc(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)c1	ZINC000158211289	197253004	/nfs/dbraw/zinc/25/30/04/197253004.db2.gz	YVJPRQBKMJJHQF-YUELXQCFSA-N	0	3	308.447	2.388	10	0		DEAEHN
CN(C)C(=O)c1ccc(Cl)c(NC(=O)[C@H](N)C(C)(C)C)c1	ZINC000158236790	197255978	/nfs/dbraw/zinc/25/59/78/197255978.db2.gz	XQUPYHPBIMKUPZ-LBPRGKRZSA-N	0	3	311.813	2.354	10	0		DEAEHN
C[C@@H](NC1CCS(=O)CC1)c1cnn(-c2ccccc2)c1	ZINC000157944756	197229721	/nfs/dbraw/zinc/22/97/21/197229721.db2.gz	RAGVOLDOHBEYBO-TZHTUTLZSA-N	0	3	303.431	2.434	10	0		DEAEHN
C[C@H](NC1CCS(=O)CC1)c1cnn(-c2ccccc2)c1	ZINC000157944610	197229245	/nfs/dbraw/zinc/22/92/45/197229245.db2.gz	RAGVOLDOHBEYBO-PCODGMICSA-N	0	3	303.431	2.434	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC[C@@H](CCC(=O)OCC)C1)N(C)C	ZINC000120305048	195138439	/nfs/dbraw/zinc/13/84/39/195138439.db2.gz	OCVBSJPWQUKXHL-LSDHHAIUSA-N	0	3	312.454	2.299	10	0		DEAEHN
COc1ccc(CC2CCN([C@@H](C)C(=O)N(C)C)CC2)cc1	ZINC000157724240	197211283	/nfs/dbraw/zinc/21/12/83/197211283.db2.gz	PAHKXTQTRUPMNT-AWEZNQCLSA-N	0	3	304.434	2.426	10	0		DEAEHN
CC[C@@](C)([C@H](O)c1c(Br)cnn1C)N1CCCC1	ZINC000157631869	197203846	/nfs/dbraw/zinc/20/38/46/197203846.db2.gz	SDQYLOMSJZSENV-OLZOCXBDSA-N	0	3	316.243	2.481	10	0		DEAEHN
CC[C@H](N)c1cccc(S(=O)(=O)N(C)CCOC(C)C)c1	ZINC000157293515	197176903	/nfs/dbraw/zinc/17/69/03/197176903.db2.gz	GFIOMXGBHHNEHU-HNNXBMFYSA-N	0	3	314.451	2.142	10	0		DEAEHN
CN[C@@H](C)c1cccc(S(=O)(=O)NCC(C)(C)SC)c1	ZINC000156875050	197146528	/nfs/dbraw/zinc/14/65/28/197146528.db2.gz	FKNZISUPTBFIIS-NSHDSACASA-N	0	3	316.492	2.387	10	0		DEAEHN
C[C@@H]1C[C@H](Nc2ccc(F)c([N-]S(C)(=O)=O)c2)CC[N@@H+]1C	ZINC000155962812	197077268	/nfs/dbraw/zinc/07/72/68/197077268.db2.gz	YBCBYQRJWONPDP-ZYHUDNBSSA-N	0	3	315.414	2.092	10	0		DEAEHN
C[C@@H]1C[C@H](Nc2ccc(F)c([N-]S(C)(=O)=O)c2)CC[N@H+]1C	ZINC000155962812	197077271	/nfs/dbraw/zinc/07/72/71/197077271.db2.gz	YBCBYQRJWONPDP-ZYHUDNBSSA-N	0	3	315.414	2.092	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c(C)c1	ZINC000120534668	195185012	/nfs/dbraw/zinc/18/50/12/195185012.db2.gz	ZMOAZKBNUSMWSC-CABCVRRESA-N	0	3	317.433	2.183	10	0		DEAEHN
COCCN1CCN(Cc2c[nH]nc2-c2ccccc2)C[C@@H]1C	ZINC000120798223	195240046	/nfs/dbraw/zinc/24/00/46/195240046.db2.gz	OUSWMXJITNXQHK-HNNXBMFYSA-N	0	3	314.433	2.229	10	0		DEAEHN
Cc1ccc(CN2CC[C@H]3[C@H]2CCN3Cc2cnn(C)c2)o1	ZINC000248082645	257108973	/nfs/dbraw/zinc/10/89/73/257108973.db2.gz	ARCBPUAOWQEBBT-DLBZAZTESA-N	0	3	300.406	2.170	10	0		DEAEHN
Cc1cccc(CN2CCN3C[C@H](OCC4CC4)C[C@@H]3C2)n1	ZINC000503720653	257207533	/nfs/dbraw/zinc/20/75/33/257207533.db2.gz	UQEOYSQOQUWWGW-QZTJIDSGSA-N	0	3	301.434	2.075	10	0		DEAEHN
CN(C1CCCC1)S(=O)(=O)c1ccc(CN)cc1Cl	ZINC000126185824	195818299	/nfs/dbraw/zinc/81/82/99/195818299.db2.gz	IIZFSRRLAGALDW-UHFFFAOYSA-N	0	3	302.827	2.362	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@@H]1C[C@@]12CCCc1ccccc12	ZINC000562450595	291985835	/nfs/dbraw/zinc/98/58/35/291985835.db2.gz	RQTUZAQEYVUIRW-AZUAARDMSA-N	0	3	321.424	2.326	10	0		DEAEHN
CC(C)c1nc([C@H]2CCCN2C(=O)NC2CCN(C)CC2)no1	ZINC000177350414	132526864	/nfs/dbraw/zinc/52/68/64/132526864.db2.gz	WWFMXJRMJNHMHU-CYBMUJFWSA-N	0	3	321.425	2.134	10	0		DEAEHN
CC1=CCN(CCNCc2nccn2CC(F)(F)F)CC1	ZINC000358146136	133124298	/nfs/dbraw/zinc/12/42/98/133124298.db2.gz	WOZGWHMVPUUMET-UHFFFAOYSA-N	0	3	302.344	2.187	10	0		DEAEHN
O=C1[C@@H](NC2CC(c3ccccn3)C2)CCN1CC(F)(F)F	ZINC000377624349	133337864	/nfs/dbraw/zinc/33/78/64/133337864.db2.gz	LBPIOBKFIWAMQB-XIVSLSHWSA-N	0	3	313.323	2.080	10	0		DEAEHN
c1ccc(-n2nnnc2CCN2CC[C@@H](c3cccnc3)C2)cc1	ZINC000564080997	292085269	/nfs/dbraw/zinc/08/52/69/292085269.db2.gz	VQFHWPJKOPRCGD-MRXNPFEDSA-N	0	3	320.400	2.089	10	0		DEAEHN
CC(C)n1cc(CN[C@H]2CCCN(c3cccnn3)C2)cn1	ZINC000171841726	144813015	/nfs/dbraw/zinc/81/30/15/144813015.db2.gz	IVUSETKULXPOJC-HNNXBMFYSA-N	0	3	300.410	2.013	10	0		DEAEHN
O=C([C@@H]1C[C@@H]1c1c(F)cccc1F)N1CCN2CCC1CC2	ZINC000188667545	145015829	/nfs/dbraw/zinc/01/58/29/145015829.db2.gz	OXDHRKULWMIIKV-QWHCGFSZSA-N	0	3	306.356	2.375	10	0		DEAEHN
COc1cccc(/C(C)=C/C(=O)N2CCN3CCC2CC3)c1	ZINC000188658045	145015970	/nfs/dbraw/zinc/01/59/70/145015970.db2.gz	QBUQRFBDDJTECP-WYMLVPIESA-N	0	3	300.402	2.405	10	0		DEAEHN
COC(=O)CC1(CC(=O)N2CCCN(C3CC3)CC2)CCCC1	ZINC000189199338	145023882	/nfs/dbraw/zinc/02/38/82/145023882.db2.gz	LAEWJYAIPFMMGF-UHFFFAOYSA-N	0	3	322.449	2.197	10	0		DEAEHN
CCN(C)c1ccc(CN2CCC[C@H](Cn3cncn3)C2)cn1	ZINC000191155073	145053478	/nfs/dbraw/zinc/05/34/78/145053478.db2.gz	LYPOJXYZRPDLQT-INIZCTEOSA-N	0	3	314.437	2.041	10	0		DEAEHN
COCCN(CCOC)Cc1ccc(-n2ccnc2)cc1C	ZINC000191887563	145067099	/nfs/dbraw/zinc/06/70/99/145067099.db2.gz	QYXLOYPGDCDALY-UHFFFAOYSA-N	0	3	303.406	2.276	10	0		DEAEHN
C[C@H](NC(=O)N1CCC(CN2CCN(C)CC2)CC1)C(C)(C)C	ZINC000192182273	145071788	/nfs/dbraw/zinc/07/17/88/145071788.db2.gz	GXXXBGBHAFWZJH-HNNXBMFYSA-N	0	3	324.513	2.090	10	0		DEAEHN
CCOC[C@H]1CCN(CC(=O)N2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000246132090	145093426	/nfs/dbraw/zinc/09/34/26/145093426.db2.gz	FIPLUHWCNWXFBB-QWHCGFSZSA-N	0	3	322.371	2.146	10	0		DEAEHN
CCOc1ccc(CN2CCN(C[C@H](C)O)[C@H](CC)C2)cc1	ZINC000246350632	145099731	/nfs/dbraw/zinc/09/97/31/145099731.db2.gz	MMZAVUVIBXSHLP-DOTOQJQBSA-N	0	3	306.450	2.362	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccc(Cl)cc1)N1CCN2CCC[C@H]2C1	ZINC000246389884	145101522	/nfs/dbraw/zinc/10/15/22/145101522.db2.gz	PGBCQMKWMZUGGJ-WFASDCNBSA-N	0	3	307.825	2.447	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)[C@@H](C)N2CCN3CCC[C@H]3C2)c1	ZINC000246588307	145107870	/nfs/dbraw/zinc/10/78/70/145107870.db2.gz	SRZXZJPBWZPPHB-WBVHZDCISA-N	0	3	301.434	2.410	10	0		DEAEHN
O=C(CN1CC[C@H]2OCCC[C@H]2C1)N1CCc2ccccc2C1	ZINC000246732007	145111949	/nfs/dbraw/zinc/11/19/49/145111949.db2.gz	ORVJMUAIBZZLPH-ZWKOTPCHSA-N	0	3	314.429	2.072	10	0		DEAEHN
Cc1ccc(F)c(OCC(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000246836588	145116154	/nfs/dbraw/zinc/11/61/54/145116154.db2.gz	ARFIYMCVJARJBM-HIFRSBDPSA-N	0	3	308.397	2.358	10	0		DEAEHN
CSc1cc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)ccn1	ZINC000246853189	145116775	/nfs/dbraw/zinc/11/67/75/145116775.db2.gz	UARCCBJBENRCNX-KBPBESRZSA-N	0	3	305.447	2.360	10	0		DEAEHN
CC(C)(C)OC(=O)[C@H]1CCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000247016083	145123302	/nfs/dbraw/zinc/12/33/02/145123302.db2.gz	LPBYKWGZWYOLID-HOTGVXAUSA-N	0	3	305.418	2.254	10	0		DEAEHN
Cc1ccc(NC(=O)[C@H](C)N2CCN3CCC[C@H]3C2)c(F)c1	ZINC000247064158	145125302	/nfs/dbraw/zinc/12/53/02/145125302.db2.gz	GBJVUHJTBMQMSG-KBPBESRZSA-N	0	3	305.397	2.241	10	0		DEAEHN
Cc1sc(NC(=O)CN2CCN3CCC[C@H]3C2)c(C)c1C	ZINC000247260098	145130500	/nfs/dbraw/zinc/13/05/00/145130500.db2.gz	ZUVJRLURHNIFAJ-AWEZNQCLSA-N	0	3	307.463	2.392	10	0		DEAEHN
Cc1cc(C)nc(SCC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)n1	ZINC000247371159	145135361	/nfs/dbraw/zinc/13/53/61/145135361.db2.gz	KUPMYDKCWFFASV-UONOGXRCSA-N	0	3	322.478	2.127	10	0		DEAEHN
O=C(NC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)N1CCN2CCC[C@H]2C1	ZINC000247631469	145142174	/nfs/dbraw/zinc/14/21/74/145142174.db2.gz	SVUJMPIOTDYWTQ-OWLYRPNTSA-N	0	3	311.429	2.062	10	0		DEAEHN
CN(Cc1cc(-c2cnn(C)c2)no1)C[C@@H]1CCCC[C@H]1O	ZINC000248976475	145174238	/nfs/dbraw/zinc/17/42/38/145174238.db2.gz	HRQHLZBNLKCQCX-BLLLJJGKSA-N	0	3	304.394	2.058	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)C(=O)Nc1cccc(C)c1	ZINC000249123260	145179599	/nfs/dbraw/zinc/17/95/99/145179599.db2.gz	CCKBGFAQAFNFNV-CVEARBPZSA-N	0	3	315.417	2.019	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)C(=O)Nc1ccccc1C	ZINC000249155636	145180405	/nfs/dbraw/zinc/18/04/05/145180405.db2.gz	IGVIQGWWWYWDGP-CABCVRRESA-N	0	3	315.417	2.019	10	0		DEAEHN
Cc1ccc(S(=O)(=O)C[C@H](C)N[C@H]2CCOC[C@H]2C)cc1	ZINC000249320884	145182088	/nfs/dbraw/zinc/18/20/88/145182088.db2.gz	QQPCNQPARFYVHI-YCPHGPKFSA-N	0	3	311.447	2.172	10	0		DEAEHN
CCN(CC)C(=O)[C@H](C)N1C[C@@H](CO)[C@@H](c2ccsc2)C1	ZINC000249581990	145187483	/nfs/dbraw/zinc/18/74/83/145187483.db2.gz	RLWONCAAJOFAEV-AEGPPILISA-N	0	3	310.463	2.013	10	0		DEAEHN
Cc1cccc(CS(=O)(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000252466273	145198866	/nfs/dbraw/zinc/19/88/66/145198866.db2.gz	WCMLPSAXYRMIRG-ZBFHGGJFSA-N	0	3	310.463	2.143	10	0		DEAEHN
CCCC[C@H](C(=O)OC)N1CCC[C@@H](Cc2nccn2C)C1	ZINC000252744182	145201175	/nfs/dbraw/zinc/20/11/75/145201175.db2.gz	VXSAECIQRJLYNZ-LSDHHAIUSA-N	0	3	307.438	2.406	10	0		DEAEHN
CN(Cc1ccccc1)C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C	ZINC000261539076	145206514	/nfs/dbraw/zinc/20/65/14/145206514.db2.gz	BMKGOUINTDQBQJ-HDMKZQKVSA-N	0	3	302.418	2.178	10	0		DEAEHN
COc1ccc(OC)c(CN2CCNC[C@@H]2c2cccnc2)c1	ZINC000261654057	145213508	/nfs/dbraw/zinc/21/35/08/145213508.db2.gz	HPEPDXNEDFXSDC-QGZVFWFLSA-N	0	3	313.401	2.245	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)NCc1cc(F)ccc1F	ZINC000261649246	145213982	/nfs/dbraw/zinc/21/39/82/145213982.db2.gz	FPZRADJOHIRLQE-SUYBPPKGSA-N	0	3	324.371	2.114	10	0		DEAEHN
COc1ccccc1NC(=O)CN1CCNCc2ccccc21	ZINC000261713319	145219032	/nfs/dbraw/zinc/21/90/32/145219032.db2.gz	LFLPYNSNDICOCS-UHFFFAOYSA-N	0	3	311.385	2.244	10	0		DEAEHN
C[C@H](NC(=O)[C@H](N)C1CCOCC1)C12CC3CC(CC(C3)C1)C2	ZINC000261720365	145219566	/nfs/dbraw/zinc/21/95/66/145219566.db2.gz	JFUJRLSRAYWQQS-GMTINNKDSA-N	0	3	320.477	2.461	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)N[C@@H](C)C[C@@H]2COCCN2)c1	ZINC000261822041	145230800	/nfs/dbraw/zinc/23/08/00/145230800.db2.gz	ASAQAJBUKBMMNN-MELADBBJSA-N	0	3	308.422	2.121	10	0		DEAEHN
Cc1cccc(CN(C)C(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000261908722	145240514	/nfs/dbraw/zinc/24/05/14/145240514.db2.gz	PWJBEEYRGWKSOU-JTDSTZFVSA-N	0	3	316.445	2.486	10	0		DEAEHN
NC1(C(=O)Nc2ccc3[nH]c(C4CCC4)nc3c2)CCOCC1	ZINC000261911945	145241221	/nfs/dbraw/zinc/24/12/21/145241221.db2.gz	TVQFSJGFCYBYBC-UHFFFAOYSA-N	0	3	314.389	2.277	10	0		DEAEHN
C[C@@H](NC(=O)C1(N)CCOCC1)c1ncc(-c2ccccc2)o1	ZINC000261929972	145243244	/nfs/dbraw/zinc/24/32/44/145243244.db2.gz	WDDBEKRGNKDGRF-GFCCVEGCSA-N	0	3	315.373	2.027	10	0		DEAEHN
CCN(C)c1ccc(CN2CCNC[C@@H]2c2cccnc2)cn1	ZINC000262039426	145256133	/nfs/dbraw/zinc/25/61/33/145256133.db2.gz	YEJQAIYFLZOZTN-QGZVFWFLSA-N	0	3	311.433	2.079	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)Nc1ccc(F)c(F)c1	ZINC000262402138	145281540	/nfs/dbraw/zinc/28/15/40/145281540.db2.gz	CKSCIXWNPRZYDK-CKUKBARFSA-N	0	3	310.344	2.436	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)NCc1ccccc1Cl	ZINC000262495933	145288401	/nfs/dbraw/zinc/28/84/01/145288401.db2.gz	LJAUXGYBGFPTKF-DXCKQFNASA-N	0	3	322.836	2.489	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)Nc1cccc(F)c1F	ZINC000262505710	145289151	/nfs/dbraw/zinc/28/91/51/145289151.db2.gz	MKMUOXCVWOPJPC-VAHXTSCQSA-N	0	3	310.344	2.436	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(C[C@H]2CCCc3ccccc32)n1	ZINC000263153299	145330576	/nfs/dbraw/zinc/33/05/76/145330576.db2.gz	DFBAEUBROJLRPL-GDBMZVCRSA-N	0	3	312.417	2.308	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2C[C@@H]2c2ccc(F)cc2F)n1	ZINC000263210829	145336955	/nfs/dbraw/zinc/33/69/55/145336955.db2.gz	KFYAPPXUZXXHQQ-MBNYWOFBSA-N	0	3	320.343	2.195	10	0		DEAEHN
Cc1noc(C)c1[C@H](C)CNC(=O)N1CC[C@H]2CCN(C)C[C@@H]21	ZINC000332829380	145389194	/nfs/dbraw/zinc/38/91/94/145389194.db2.gz	CSFYWXAFCONIEZ-DFBGVHRSSA-N	0	3	320.437	2.131	10	0		DEAEHN
c1nc(-c2ccncc2)sc1CN1CCN2CCC1CC2	ZINC000349301373	146366805	/nfs/dbraw/zinc/36/68/05/146366805.db2.gz	UQPXVSUCKMGLKF-UHFFFAOYSA-N	0	3	300.431	2.485	10	0		DEAEHN
O[C@@H](CCNCc1ccc(Br)cn1)C(F)(F)F	ZINC000349300404	146367043	/nfs/dbraw/zinc/36/70/43/146367043.db2.gz	SSLCUQUTCWRTDH-VIFPVBQESA-N	0	3	313.117	2.247	10	0		DEAEHN
O=C(c1cccc(CN2CCCC2)c1)N1CC(OCC(F)F)C1	ZINC000358365027	147120608	/nfs/dbraw/zinc/12/06/08/147120608.db2.gz	CIQKGXLGIZLDIQ-UHFFFAOYSA-N	0	3	324.371	2.389	10	0		DEAEHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)NC[C@](C)(O)C1CCCCC1	ZINC000359208650	147282422	/nfs/dbraw/zinc/28/24/22/147282422.db2.gz	KAVPHVYDWNRLQL-QBIMZIAESA-N	0	3	323.481	2.100	10	0		DEAEHN
CCOCc1nc([C@H](C)NC(=O)[C@H](C)N2CCCCCC2)no1	ZINC000359490975	147336510	/nfs/dbraw/zinc/33/65/10/147336510.db2.gz	BYPBCICYEKRKBS-STQMWFEESA-N	0	3	324.425	2.048	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N[C@H](C)CN1CCCCC1	ZINC000073665450	401720050	/nfs/dbraw/zinc/72/00/50/401720050.db2.gz	GAXRFQSEPZZTQL-OAHLLOKOSA-N	0	3	321.469	2.213	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H](C)c1ccccc1C	ZINC000111789309	401723773	/nfs/dbraw/zinc/72/37/73/401723773.db2.gz	CLKCJFVWCABAAE-JKSUJKDBSA-N	0	3	319.449	2.466	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NCCCc1ccccc1	ZINC000111792657	401723954	/nfs/dbraw/zinc/72/39/54/401723954.db2.gz	UDIUZCOLPPXEGT-QGZVFWFLSA-N	0	3	319.449	2.029	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@H](C)c1ccc(C)o1	ZINC000111804101	401724375	/nfs/dbraw/zinc/72/43/75/401724375.db2.gz	VGTQOOZKAFPRIM-ZIAGYGMSSA-N	0	3	309.410	2.059	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CC[C@H](CC(C)C)C1	ZINC000074167516	401731945	/nfs/dbraw/zinc/73/19/45/401731945.db2.gz	FCJFADNQCOKPOX-HZPDHXFCSA-N	0	3	311.470	2.175	10	0		DEAEHN
CC[C@@H]1CCCCCN1C(=O)NC[C@H](C)CN1CCN(C)CC1	ZINC000074657117	401743110	/nfs/dbraw/zinc/74/31/10/401743110.db2.gz	IPKZKQVGLKNXKM-DLBZAZTESA-N	0	3	324.513	2.234	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(C)C[C@H]2CCCN(C)C2)s1	ZINC000074841677	401744961	/nfs/dbraw/zinc/74/49/61/401744961.db2.gz	RNLXPARNWPBVMG-ZDUSSCGKSA-N	0	3	324.494	2.231	10	0		DEAEHN
COCCN(C)CCNC(=O)CCc1c[nH]c2ccc(C)cc12	ZINC000073288325	401717275	/nfs/dbraw/zinc/71/72/75/401717275.db2.gz	OHWLNTLDKIMLLF-UHFFFAOYSA-N	0	3	317.433	2.103	10	0		DEAEHN
COc1cc(CNCCc2cscn2)cc2c1OCCO2	ZINC000111626600	401718941	/nfs/dbraw/zinc/71/89/41/401718941.db2.gz	SFGYRFACNDSZRT-UHFFFAOYSA-N	0	3	306.387	2.255	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cc(Cl)nc(N3CCCC3)c2)C1	ZINC000112635049	401751958	/nfs/dbraw/zinc/75/19/58/401751958.db2.gz	NGRYLCCYQZCFDW-CYBMUJFWSA-N	0	3	322.840	2.111	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2cccc(-c3ccoc3)c2)CCO1	ZINC000127955543	401757091	/nfs/dbraw/zinc/75/70/91/401757091.db2.gz	DYSYXTCHDSKIGY-QGZVFWFLSA-N	0	3	314.385	2.349	10	0		DEAEHN
C[C@@H]1C[C@H]1NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000075977735	401776082	/nfs/dbraw/zinc/77/60/82/401776082.db2.gz	JCZGTTGCONOIKO-RHSMWYFYSA-N	0	3	301.434	2.401	10	0		DEAEHN
CC(C)(CNC(=O)NC[C@@H]1CCCC[C@@H]1O)N1CCCCC1	ZINC000077753379	401828812	/nfs/dbraw/zinc/82/88/12/401828812.db2.gz	HEECTJHOLOODLY-GJZGRUSLSA-N	0	3	311.470	2.101	10	0		DEAEHN
CN(C)[C@H](CNC(=O)[C@@H]1CCCc2n[nH]cc21)c1ccccc1	ZINC000131690874	401854687	/nfs/dbraw/zinc/85/46/87/401854687.db2.gz	BDJRRHLVIHWFHK-RHSMWYFYSA-N	0	3	312.417	2.249	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NC[C@@H]1CCCS1	ZINC000131715631	401855700	/nfs/dbraw/zinc/85/57/00/401855700.db2.gz	LQLTYZWZDMEVKP-ZDUSSCGKSA-N	0	3	308.447	2.252	10	0		DEAEHN
CCOC(=O)CCCCN1CCC[C@@H](Cc2noc(C)n2)C1	ZINC000132711727	401872533	/nfs/dbraw/zinc/87/25/33/401872533.db2.gz	PBLYHWZUJGOWAZ-AWEZNQCLSA-N	0	3	309.410	2.366	10	0		DEAEHN
Cc1cc(C(=O)N2CCO[C@H](CN(C)C)C2)c(C)n1C(C)C	ZINC000116792577	401859100	/nfs/dbraw/zinc/85/91/00/401859100.db2.gz	SOUFFZHUHZMOOC-OAHLLOKOSA-N	0	3	307.438	2.088	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@H](CN(C)C)C1)c1ccccc1	ZINC000116786489	401859236	/nfs/dbraw/zinc/85/92/36/401859236.db2.gz	YTHBFBSBSXNGAC-SJORKVTESA-N	0	3	304.434	2.359	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)N2CCc3ccccc3C2)[C@@H](C)C1	ZINC000132472191	401867871	/nfs/dbraw/zinc/86/78/71/401867871.db2.gz	PXJDAQNNWVUWTP-YOEHRIQHSA-N	0	3	301.434	2.483	10	0		DEAEHN
Cc1cc(C)cc(CCC(=O)N2CCO[C@H](CN(C)C)C2)c1	ZINC000134038413	401898196	/nfs/dbraw/zinc/89/81/96/401898196.db2.gz	XBOGQBUSQAXCTH-QGZVFWFLSA-N	0	3	304.434	2.025	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@@H]2CN1c1ncc(Br)cn1	ZINC000083704203	401901089	/nfs/dbraw/zinc/90/10/89/401901089.db2.gz	YPNJLVNWJJUXOG-ZYHUDNBSSA-N	0	3	311.227	2.302	10	0		DEAEHN
COc1ccc([C@@H](C)NC2CCS(=O)(=O)CC2)cc1F	ZINC000036331444	401904355	/nfs/dbraw/zinc/90/43/55/401904355.db2.gz	WMTODLXNPMMNOX-SNVBAGLBSA-N	0	3	301.383	2.062	10	0		DEAEHN
O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)[C@@H]1C[C@H](O)CN1	ZINC000036720533	401907124	/nfs/dbraw/zinc/90/71/24/401907124.db2.gz	UENRKFXTROXAJT-XVKPBYJWSA-N	0	3	308.687	2.020	10	0		DEAEHN
CCOC(=O)C[C@@H](N)c1cc(Br)ccc1OC	ZINC000036894211	401908878	/nfs/dbraw/zinc/90/88/78/401908878.db2.gz	INRFAXICCYJMTN-SNVBAGLBSA-N	0	3	302.168	2.411	10	0		DEAEHN
COc1cc(C[NH2+]C[C@@H]2CCOC2)cc(Br)c1[O-]	ZINC000037738272	401916735	/nfs/dbraw/zinc/91/67/35/401916735.db2.gz	XGKVBUOMJXRGGZ-VIFPVBQESA-N	0	3	316.195	2.289	10	0		DEAEHN
Cc1noc(CCN[C@H](C)c2ccc(N3CCOC3=O)cc2)n1	ZINC000089518031	401950964	/nfs/dbraw/zinc/95/09/64/401950964.db2.gz	KRJXSOSQZGAMBK-LLVKDONJSA-N	0	3	316.361	2.228	10	0		DEAEHN
CCN(CC)C(=O)[C@@H](C)N[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000119491944	401954519	/nfs/dbraw/zinc/95/45/19/401954519.db2.gz	HBJMQIVMOPMCBA-UONOGXRCSA-N	0	3	315.421	2.175	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)NC[C@H]1CCCN(C)C1	ZINC000119828881	401968341	/nfs/dbraw/zinc/96/83/41/401968341.db2.gz	YXAZLJSWPKQOMP-CYBMUJFWSA-N	0	3	310.467	2.059	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)C[C@H](O)c2ccccc2)C1	ZINC000089330059	401942595	/nfs/dbraw/zinc/94/25/95/401942595.db2.gz	UYMRFSFPIRDUNI-ZACQAIPSSA-N	0	3	302.418	2.053	10	0		DEAEHN
NC[C@H](N)c1cc(Br)c(Br)s1	ZINC000044470150	401943341	/nfs/dbraw/zinc/94/33/41/401943341.db2.gz	HLKUIHXLGJILOK-BYPYZUCNSA-N	0	3	300.019	2.232	10	0		DEAEHN
C(CCN1CCOCC12CCC2)CN1CCOCC12CCC2	ZINC000135540808	401944248	/nfs/dbraw/zinc/94/42/48/401944248.db2.gz	WEOCYJFBBHQPRQ-UHFFFAOYSA-N	0	3	308.466	2.276	10	0		DEAEHN
c1ccc(OCCOCCN2CCS[C@@H]3COCC[C@@H]32)cc1	ZINC000135547994	401944301	/nfs/dbraw/zinc/94/43/01/401944301.db2.gz	BUPOMMCRTNYVFS-DLBZAZTESA-N	0	3	323.458	2.288	10	0		DEAEHN
CCC[C@H](C)NC(=O)C(C)S(=O)(=O)Cc1ccccc1F	ZINC000044640641	401947160	/nfs/dbraw/zinc/94/71/60/401947160.db2.gz	DPNYTWCPFBTFSY-NWDGAFQWSA-N	0	3	315.410	2.434	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H](C)N1CCc2ccccc21)N(C)C	ZINC000135650013	401949448	/nfs/dbraw/zinc/94/94/48/401949448.db2.gz	UIUVYLJMDUHCMU-RHSMWYFYSA-N	0	3	303.450	2.284	10	0		DEAEHN
COc1ccc([C@@H](C)NCCc2nc(C)no2)cc1NC(C)=O	ZINC000089518393	401950463	/nfs/dbraw/zinc/95/04/63/401950463.db2.gz	ZGBWZHDZOLVGCY-SNVBAGLBSA-N	0	3	318.377	2.238	10	0		DEAEHN
Cc1ccn(-c2ccccc2NC(=O)NC2CCN(C)CC2)n1	ZINC000151046582	402012513	/nfs/dbraw/zinc/01/25/13/402012513.db2.gz	HFNGRDKZUCUZKF-UHFFFAOYSA-N	0	3	313.405	2.396	10	0		DEAEHN
CCC(CC)CN1CCN(C[C@H]2CN(C(C)C)CCO2)CC1	ZINC000121070621	402013047	/nfs/dbraw/zinc/01/30/47/402013047.db2.gz	PCTMDCTUNWSIBI-SFHVURJKSA-N	0	3	311.514	2.149	10	0		DEAEHN
CC[C@H]1CCCCCN1Cc1cnc(N2CCN(C)CC2)nc1	ZINC000093530203	402016397	/nfs/dbraw/zinc/01/63/97/402016397.db2.gz	VLLPPSCDUNGJAM-KRWDZBQOSA-N	0	3	317.481	2.383	10	0		DEAEHN
CC[C@@H](CO)N1CCN(Cc2cccn2CCC(C)C)CC1	ZINC000093740491	402019657	/nfs/dbraw/zinc/01/96/57/402019657.db2.gz	JJDGLERURPWGEK-KRWDZBQOSA-N	0	3	307.482	2.423	10	0		DEAEHN
Cc1cc(C)n2c(CN3CCC[C@H](c4cc[nH]n4)C3)cnc2n1	ZINC000121227805	402021711	/nfs/dbraw/zinc/02/17/11/402021711.db2.gz	UTVZJTBVCSYLDH-AWEZNQCLSA-N	0	3	310.405	2.449	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCC[C@H](CNCC(=O)c2ccc[nH]2)C1	ZINC000095085324	402024805	/nfs/dbraw/zinc/02/48/05/402024805.db2.gz	RSRPECULASGANL-CYBMUJFWSA-N	0	3	321.421	2.434	10	0		DEAEHN
CN(C)CCN1CCN(C(=O)c2cccc3ccccc32)CC1	ZINC000052633466	402045099	/nfs/dbraw/zinc/04/50/99/402045099.db2.gz	YWXFKRFCHKEKPD-UHFFFAOYSA-N	0	3	311.429	2.159	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2nc(C3CC3)cs2)C1	ZINC000151641443	402047922	/nfs/dbraw/zinc/04/79/22/402047922.db2.gz	FEBQYWBKXIJUIV-GFCCVEGCSA-N	0	3	308.451	2.304	10	0		DEAEHN
C[C@H](N[C@@H]1CCC(=O)N(C)C1)c1cnn(Cc2ccccc2)c1	ZINC000152464892	402096422	/nfs/dbraw/zinc/09/64/22/402096422.db2.gz	LGZFTFVWHVRBKL-WMLDXEAASA-N	0	3	312.417	2.203	10	0		DEAEHN
O=C(c1cc(-c2ccc(F)cc2)[nH]n1)N1CCN2CCC1CC2	ZINC000059282165	402104287	/nfs/dbraw/zinc/10/42/87/402104287.db2.gz	OEMOUAXKAPAWRS-UHFFFAOYSA-N	0	3	314.364	2.136	10	0		DEAEHN
CC(=O)c1cccc(OCC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000123131924	402111824	/nfs/dbraw/zinc/11/18/24/402111824.db2.gz	ZUGDTIGDQPWBFP-BBRMVZONSA-N	0	3	318.417	2.209	10	0		DEAEHN
COc1cc(C(=O)N[C@@H](CC(C)C)C[NH+](C)C)cc(OC)c1[O-]	ZINC000152909195	402116211	/nfs/dbraw/zinc/11/62/11/402116211.db2.gz	HWZPTBIJLAWCNR-ZDUSSCGKSA-N	0	3	324.421	2.116	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000123257206	402118170	/nfs/dbraw/zinc/11/81/70/402118170.db2.gz	JLJPNLOBWWPCSJ-BXUZGUMPSA-N	0	3	321.396	2.339	10	0		DEAEHN
C[C@@H](CS(C)(=O)=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000152952421	402118981	/nfs/dbraw/zinc/11/89/81/402118981.db2.gz	KLXSUXMXNMNXMX-RDJZCZTQSA-N	0	3	324.490	2.064	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2ccc(-n3cccn3)cc2)CCN1C	ZINC000123377272	402124665	/nfs/dbraw/zinc/12/46/65/402124665.db2.gz	BXWZQBCIMPADEH-WMLDXEAASA-N	0	3	312.417	2.427	10	0		DEAEHN
CC(C)=C(F)C(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000123393494	402125456	/nfs/dbraw/zinc/12/54/56/402125456.db2.gz	CJVNINUKWDGABP-UHFFFAOYSA-N	0	3	320.412	2.055	10	0		DEAEHN
CCCOc1cccc(CN2CCN(C[C@H](O)CC)CC2)c1	ZINC000123574282	402135809	/nfs/dbraw/zinc/13/58/09/402135809.db2.gz	VKKNCALNVXCJMI-QGZVFWFLSA-N	0	3	306.450	2.364	10	0		DEAEHN
C[C@H](C(=O)N(C)CC(=O)NC1CC1)N(C)CCC1CCCCC1	ZINC000101565727	402149064	/nfs/dbraw/zinc/14/90/64/402149064.db2.gz	FVRFCSOZZAVAQN-CQSZACIVSA-N	0	3	323.481	2.014	10	0		DEAEHN
CC(C)CO[C@@H]1CCN(C[C@@H](O)COCc2ccccc2)C1	ZINC000124647958	402189851	/nfs/dbraw/zinc/18/98/51/402189851.db2.gz	JKJVYNMXOVNTHL-QZTJIDSGSA-N	0	3	307.434	2.311	10	0		DEAEHN
Cc1nn(C)c2sc(C(=O)N(C)[C@@H]3CCN(C)[C@H](C)C3)cc12	ZINC000124708544	402192952	/nfs/dbraw/zinc/19/29/52/402192952.db2.gz	DYIRFKMRBLOPJQ-ZYHUDNBSSA-N	0	3	320.462	2.498	10	0		DEAEHN
COc1ccc(CN2CCC(N3CCO[C@H](C)C3)CC2)cc1	ZINC000124123194	402165112	/nfs/dbraw/zinc/16/51/12/402165112.db2.gz	LZZIYKIOYNAVIA-OAHLLOKOSA-N	0	3	304.434	2.380	10	0		DEAEHN
CC[C@H](CO)NC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000067734225	402170420	/nfs/dbraw/zinc/17/04/20/402170420.db2.gz	ZAUSCCODUSYPLG-SJORKVTESA-N	0	3	319.449	2.111	10	0		DEAEHN
Cn1cc(CN2CC[C@@H](CNC(=O)CC3=CCCCC3)C2)cn1	ZINC000067878611	402177662	/nfs/dbraw/zinc/17/76/62/402177662.db2.gz	AVEPDXHOWCATRW-INIZCTEOSA-N	0	3	316.449	2.249	10	0		DEAEHN
FC(F)Oc1ccc(CNC[C@H]2CN(C3CC3)CCO2)cc1	ZINC000106380095	402213522	/nfs/dbraw/zinc/21/35/22/402213522.db2.gz	BUSUEZSAKPZAKX-HNNXBMFYSA-N	0	3	312.360	2.241	10	0		DEAEHN
COc1ccccc1C[C@@H](C)CC(=O)N1CC[C@@H](N(C)C)C1	ZINC000107246905	402228686	/nfs/dbraw/zinc/22/86/86/402228686.db2.gz	MOESILUBBVKFAJ-GDBMZVCRSA-N	0	3	304.434	2.426	10	0		DEAEHN
CN(C)C[C@H]1CCCCN1C(=O)c1ccc(-c2ncon2)cc1	ZINC000107248352	402228897	/nfs/dbraw/zinc/22/88/97/402228897.db2.gz	DPTGAVCMYIADAQ-OAHLLOKOSA-N	0	3	314.389	2.293	10	0		DEAEHN
CCc1nn(C)c(Cl)c1C(=O)N(C)C[C@H]1CCCN1CC	ZINC000154933752	402238763	/nfs/dbraw/zinc/23/87/63/402238763.db2.gz	NZSOQOQIXOKOCB-LLVKDONJSA-N	0	3	312.845	2.192	10	0		DEAEHN
COc1ccc([C@@H](C)NC[C@]2(CCO)CCOC2)c(OC)c1	ZINC000125744414	402248418	/nfs/dbraw/zinc/24/84/18/402248418.db2.gz	QZWWYKYEMFTUQK-DYVFJYSZSA-N	0	3	309.406	2.144	10	0		DEAEHN
CCc1noc(CC)c1CNC(=O)N(C)C[C@@H]1CCCN1CC	ZINC000125905696	402256146	/nfs/dbraw/zinc/25/61/46/402256146.db2.gz	QWELHSGKBHLZGX-ZDUSSCGKSA-N	0	3	322.453	2.425	10	0		DEAEHN
CCc1noc(CC)c1CC(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000155497957	402258985	/nfs/dbraw/zinc/25/89/85/402258985.db2.gz	HJVKQAKHPMNNBM-WFASDCNBSA-N	0	3	307.438	2.187	10	0		DEAEHN
COCc1csc(NC(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)n1	ZINC000125087449	402212524	/nfs/dbraw/zinc/21/25/24/402212524.db2.gz	LPPDFRBEGVSJDY-JQWIXIFHSA-N	0	3	312.439	2.140	10	0		DEAEHN
CNC(=O)c1ccc(CN2CCC[C@@H](n3cc(C)cn3)C2)cc1	ZINC000109005809	402266523	/nfs/dbraw/zinc/26/65/23/402266523.db2.gz	IIDDVRNSSJQHLB-QGZVFWFLSA-N	0	3	312.417	2.388	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(Br)s2)C1	ZINC000070916206	402267024	/nfs/dbraw/zinc/26/70/24/402267024.db2.gz	ZDEYCVLPYWUUCM-MRVPVSSYSA-N	0	3	303.225	2.287	10	0		DEAEHN
C[C@H](N[C@H]1CCN(Cc2ccccn2)C[C@@H]1C)c1cnccn1	ZINC000126198945	402268911	/nfs/dbraw/zinc/26/89/11/402268911.db2.gz	YSNRKOGUUCXRPV-ZOBUZTSGSA-N	0	3	311.433	2.433	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)CCn1cnc2ccccc21	ZINC000126284725	402273164	/nfs/dbraw/zinc/27/31/64/402273164.db2.gz	WFJYNORMKDRLSS-HNNXBMFYSA-N	0	3	314.433	2.417	10	0		DEAEHN
Cc1ccc(CCCC(=O)N2CCO[C@H](CN(C)C)C2)s1	ZINC000176059627	402274813	/nfs/dbraw/zinc/27/48/13/402274813.db2.gz	RWQFZBGAJYWWGT-CQSZACIVSA-N	0	3	310.463	2.168	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1cc(F)cc(F)c1	ZINC000110087644	402281033	/nfs/dbraw/zinc/28/10/33/402281033.db2.gz	FNTMXDUCLJZBOL-CQSZACIVSA-N	0	3	313.348	2.197	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NC2Cc3ccccc3C2)CCN1C	ZINC000184918471	402308981	/nfs/dbraw/zinc/30/89/81/402308981.db2.gz	FSVUCCZJTJKBQR-SUMWQHHRSA-N	0	3	301.434	2.278	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H](COC)c1ccco1	ZINC000176437752	402309610	/nfs/dbraw/zinc/30/96/10/402309610.db2.gz	HEAIIMPCXZJNKM-KGLIPLIRSA-N	0	3	309.410	2.093	10	0		DEAEHN
COCCCN(C)CCNC(=O)NC[C@H]1C[C@@H]1c1ccccc1	ZINC000176644920	402326118	/nfs/dbraw/zinc/32/61/18/402326118.db2.gz	HSGPJZWUPNRTET-IAGOWNOFSA-N	0	3	319.449	2.058	10	0		DEAEHN
Cc1c(CNCC2=CCN(C(=O)OC(C)(C)C)CC2)cnn1C	ZINC000230943230	402353155	/nfs/dbraw/zinc/35/31/55/402353155.db2.gz	SBJCHSNGCVZTFN-UHFFFAOYSA-N	0	3	320.437	2.385	10	0		DEAEHN
Cc1ccc(S(=O)(=O)C[C@H](C)N[C@@H]2CCCC[C@@H]2O)cc1	ZINC000185445163	402353467	/nfs/dbraw/zinc/35/34/67/402353467.db2.gz	UXKATJIYLZCUME-IMJJTQAJSA-N	0	3	311.447	2.050	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(OC)ccc1OC	ZINC000176964918	402354776	/nfs/dbraw/zinc/35/47/76/402354776.db2.gz	OBMALPBQLOXSSU-ZDUSSCGKSA-N	0	3	306.406	2.260	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CSCc1ccccn1	ZINC000176990164	402357636	/nfs/dbraw/zinc/35/76/36/402357636.db2.gz	ITEASEQWUKFSBA-HNNXBMFYSA-N	0	3	307.463	2.258	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)[C@H]1CSCCS1	ZINC000177009694	402359355	/nfs/dbraw/zinc/35/93/55/402359355.db2.gz	RABRVZAASNOWPP-HUUCEWRRSA-N	0	3	324.515	2.124	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CSCc1cccnc1	ZINC000177011134	402359392	/nfs/dbraw/zinc/35/93/92/402359392.db2.gz	YHWZRAKTWQLDDB-OAHLLOKOSA-N	0	3	307.463	2.258	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NC(=O)N2CC[C@H](N(C)C)C2)C1(CC)CC	ZINC000176676959	402327479	/nfs/dbraw/zinc/32/74/79/402327479.db2.gz	PGJGJVWSSYBFJQ-RRFJBIMHSA-N	0	3	311.470	2.316	10	0		DEAEHN
CC(C)[C@@H](C)CC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000176674865	402327977	/nfs/dbraw/zinc/32/79/77/402327977.db2.gz	SEWWSQUYAUVKTR-IRXDYDNUSA-N	0	3	309.498	2.297	10	0		DEAEHN
COCCCNC(=O)CN(C)c1c(C)cnc2c(C)cccc21	ZINC000185258449	402339254	/nfs/dbraw/zinc/33/92/54/402339254.db2.gz	DRRVIKNZVGSDCO-UHFFFAOYSA-N	0	3	315.417	2.441	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(CCCNC(C)=O)C2)c1	ZINC000177409544	402399376	/nfs/dbraw/zinc/39/93/76/402399376.db2.gz	SRYYFSPEXITCQJ-AWEZNQCLSA-N	0	3	306.406	2.019	10	0		DEAEHN
CCC[C@@H](N)C(=O)NC[C@@H](O)c1c(Cl)cccc1Cl	ZINC000161796426	402399748	/nfs/dbraw/zinc/39/97/48/402399748.db2.gz	JUJHLHSCVFZSKD-GHMZBOCLSA-N	0	3	305.205	2.270	10	0		DEAEHN
COCCN1CCC(NC(=O)[C@@H]2C[C@H]2C2CCCCC2)CC1	ZINC000161793519	402399872	/nfs/dbraw/zinc/39/98/72/402399872.db2.gz	TZKSBYNOXYSWHV-DLBZAZTESA-N	0	3	308.466	2.430	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NC[C@H](OC)c1ccccc1	ZINC000177422608	402400953	/nfs/dbraw/zinc/40/09/53/402400953.db2.gz	ZPKYARBVLAAQPS-IRXDYDNUSA-N	0	3	319.449	2.500	10	0		DEAEHN
COc1cccc(N2CCC[C@H](NC(=O)[C@@H](N)CC(C)C)C2)c1	ZINC000237253702	402401184	/nfs/dbraw/zinc/40/11/84/402401184.db2.gz	IUVFYVBTCIOBTM-YOEHRIQHSA-N	0	3	319.449	2.154	10	0		DEAEHN
C[C@]1(C(=O)NCc2cnn(Cc3ccccc3)c2)CCCCN1	ZINC000237581090	402413703	/nfs/dbraw/zinc/41/37/03/402413703.db2.gz	DFECYZJTYUIUCG-GOSISDBHSA-N	0	3	312.417	2.080	10	0		DEAEHN
CCc1cnc(CNC(=O)N(C)C[C@H]2CCCN2CC)s1	ZINC000177556722	402415397	/nfs/dbraw/zinc/41/53/97/402415397.db2.gz	CJORLFBGZNTNHX-GFCCVEGCSA-N	0	3	310.467	2.331	10	0		DEAEHN
Cc1ccn(-c2ccccc2NC(=O)C[C@@H]2CSCCN2)n1	ZINC000237860582	402424009	/nfs/dbraw/zinc/42/40/09/402424009.db2.gz	RYXVROOTPVPJHI-CYBMUJFWSA-N	0	3	316.430	2.214	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)N([C@@H](C)C1CC1)C1CC1	ZINC000177697582	402428013	/nfs/dbraw/zinc/42/80/13/402428013.db2.gz	ROODHZIUXKTSGE-WMLDXEAASA-N	0	3	307.482	2.192	10	0		DEAEHN
Cc1cc(=O)[nH]cc1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000186472847	402433872	/nfs/dbraw/zinc/43/38/72/402433872.db2.gz	PVWHDSWTTDSTEL-CXAGYDPISA-N	0	3	313.401	2.105	10	0		DEAEHN
O=C1O[C@@H](CN2CCN3CCCC[C@@H]3C2)CN1c1ccccc1	ZINC000177775375	402435432	/nfs/dbraw/zinc/43/54/32/402435432.db2.gz	WIBMHZSSINHHDO-SJORKVTESA-N	0	3	315.417	2.182	10	0		DEAEHN
CC[C@H]1CN(CC(=O)N2CCNC2=O)CC[C@H]1c1ccccc1	ZINC000245411337	402457689	/nfs/dbraw/zinc/45/76/89/402457689.db2.gz	WKMZJFCYNQDUEL-GOEBONIOSA-N	0	3	315.417	2.054	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H]1CCN(c2ccccc2F)C1=O	ZINC000245480668	402464866	/nfs/dbraw/zinc/46/48/66/402464866.db2.gz	XMXXABFTCUFXGN-YOEHRIQHSA-N	0	3	319.424	2.347	10	0		DEAEHN
Cc1cc(N2CC[C@H](N3CC[C@@H](CC(C)C)C3)C2=O)n(C)n1	ZINC000245484037	402465284	/nfs/dbraw/zinc/46/52/84/402465284.db2.gz	GQCYNGBPMCCPCP-GJZGRUSLSA-N	0	3	304.438	2.202	10	0		DEAEHN
COCc1ccsc1C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000245526945	402468797	/nfs/dbraw/zinc/46/87/97/402468797.db2.gz	PPJOAXBEKLHMKG-JSGCOSHPSA-N	0	3	308.447	2.451	10	0		DEAEHN
COC(=O)c1ccccc1CCN1CCCN(C2CC2)CC1	ZINC000186890127	402469880	/nfs/dbraw/zinc/46/98/80/402469880.db2.gz	AYXWULMBCUCGDB-UHFFFAOYSA-N	0	3	302.418	2.186	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2ccc(Cl)c(F)c2)C[C@@H]1C	ZINC000245686001	402479086	/nfs/dbraw/zinc/47/90/86/402479086.db2.gz	ANWFWOUESWAPAI-RYUDHWBXSA-N	0	3	300.805	2.366	10	0		DEAEHN
CC[C@H](N)C(=O)N1CCC(CN2CCc3ccccc32)CC1	ZINC000165860028	402479430	/nfs/dbraw/zinc/47/94/30/402479430.db2.gz	VACMNPJMFXPOGD-INIZCTEOSA-N	0	3	301.434	2.025	10	0		DEAEHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)NC[C@@H]1CCC(C)(C)O1	ZINC000187069912	402480824	/nfs/dbraw/zinc/48/08/24/402480824.db2.gz	DQWPMCVCUGXHMI-KFWWJZLASA-N	0	3	311.470	2.364	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N[C@@H]2Cc3ccccc3[C@@H]2O)c1	ZINC000178326343	402485252	/nfs/dbraw/zinc/48/52/52/402485252.db2.gz	IUQAXRSPSKXKJU-MSOLQXFVSA-N	0	3	310.397	2.136	10	0		DEAEHN
CC[C@H](N[C@@H](C)C1CCS(=O)(=O)CC1)c1nccs1	ZINC000187228136	402488916	/nfs/dbraw/zinc/48/89/16/402488916.db2.gz	LJORHNJYCVMYRD-JQWIXIFHSA-N	0	3	302.465	2.397	10	0		DEAEHN
CCCCCCNC(=O)[C@H]1CCCN([C@H]2CCCCNC2=O)C1	ZINC000245907982	402496385	/nfs/dbraw/zinc/49/63/85/402496385.db2.gz	QYLOFGOBTIVPMU-HOTGVXAUSA-N	0	3	323.481	2.064	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCO[C@@H](c3cccs3)C2)C1	ZINC000245974984	402501527	/nfs/dbraw/zinc/50/15/27/402501527.db2.gz	BMPNIOUUHAHZMO-UONOGXRCSA-N	0	3	323.462	2.315	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(C)c1	ZINC000246040090	402504614	/nfs/dbraw/zinc/50/46/14/402504614.db2.gz	BDKHDFPSAZOYCO-LSDHHAIUSA-N	0	3	310.463	2.407	10	0		DEAEHN
C[C@H]1CN(CCCOc2cccc(Cl)c2)CCN1CCO	ZINC000187718170	402509474	/nfs/dbraw/zinc/50/94/74/402509474.db2.gz	HICSLHJEPVXGJQ-AWEZNQCLSA-N	0	3	312.841	2.107	10	0		DEAEHN
CC(=O)Nc1ccc(C)c(NC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000171077437	402555383	/nfs/dbraw/zinc/55/53/83/402555383.db2.gz	LEGZENYLUBMEDV-AWEZNQCLSA-N	0	3	304.394	2.121	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N2CCc3ccccc3C2)C1	ZINC000247383399	402565540	/nfs/dbraw/zinc/56/55/40/402565540.db2.gz	PXJDAQNNWVUWTP-RHSMWYFYSA-N	0	3	301.434	2.483	10	0		DEAEHN
Cc1nc(C)n(C[C@@H]2CCCN(C[C@@H](O)c3ccccc3)C2)n1	ZINC000247397492	402566109	/nfs/dbraw/zinc/56/61/09/402566109.db2.gz	XZHWRJYVZGSIBB-SJLPKXTDSA-N	0	3	314.433	2.341	10	0		DEAEHN
Cc1cnc(CCN(C)C(=O)NCCN2CCC[C@H](C)C2)s1	ZINC000179141878	402575648	/nfs/dbraw/zinc/57/56/48/402575648.db2.gz	NROCADMFOYFXAE-ZDUSSCGKSA-N	0	3	324.494	2.367	10	0		DEAEHN
CCN(CCNC(=O)N1CCc2cc(OC)ccc21)C1CC1	ZINC000171250709	402570887	/nfs/dbraw/zinc/57/08/87/402570887.db2.gz	KPCFTOJHAPUKKT-UHFFFAOYSA-N	0	3	303.406	2.252	10	0		DEAEHN
CCOCCN1CCN(CCN(C)c2ccccc2)C[C@H]1C	ZINC000246184831	402516731	/nfs/dbraw/zinc/51/67/31/402516731.db2.gz	HQZPOQLTQDMPCF-QGZVFWFLSA-N	0	3	305.466	2.165	10	0		DEAEHN
COCc1cccc(CC(=O)NCCN2CCCC[C@H]2C)c1	ZINC000188264095	402518007	/nfs/dbraw/zinc/51/80/07/402518007.db2.gz	XUPSYWCYXYUZHV-OAHLLOKOSA-N	0	3	304.434	2.366	10	0		DEAEHN
COCc1cccc(CC(=O)NCCN2CCCC[C@@H]2C)c1	ZINC000188264120	402518200	/nfs/dbraw/zinc/51/82/00/402518200.db2.gz	XUPSYWCYXYUZHV-HNNXBMFYSA-N	0	3	304.434	2.366	10	0		DEAEHN
C[C@@H](CNC(=O)c1cn2ccnc2s1)N1CCC[C@@H](C)C1	ZINC000188306815	402519893	/nfs/dbraw/zinc/51/98/93/402519893.db2.gz	RKASKDVCXIHCQQ-NEPJUHHUSA-N	0	3	306.435	2.246	10	0		DEAEHN
Cc1coc(-c2cccc(NC(=O)c3n[nH]c4c3CNCC4)c2)n1	ZINC000188637747	402522390	/nfs/dbraw/zinc/52/23/90/402522390.db2.gz	OMXQNXYZJOIHPT-UHFFFAOYSA-N	0	3	323.356	2.271	10	0		DEAEHN
CCCC(=O)N[C@H]1CCCN(C[C@](C)(O)c2ccccc2)C1	ZINC000170779509	402524064	/nfs/dbraw/zinc/52/40/64/402524064.db2.gz	KECWBQXMCRHLFX-WMZOPIPTSA-N	0	3	304.434	2.275	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(C)[C@H]2CCN(C)C[C@H]2C)s1	ZINC000246311407	402525033	/nfs/dbraw/zinc/52/50/33/402525033.db2.gz	MGOYTNFZTQGSOL-OCCSQVGLSA-N	0	3	324.494	2.230	10	0		DEAEHN
Cc1cc(C)cc(OCCNC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000170833719	402530765	/nfs/dbraw/zinc/53/07/65/402530765.db2.gz	TUQGXRSEXRTNPU-HNNXBMFYSA-N	0	3	305.422	2.028	10	0		DEAEHN
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170834787	402530975	/nfs/dbraw/zinc/53/09/75/402530975.db2.gz	FHCONRCONAHSDG-HOCLYGCPSA-N	0	3	319.449	2.362	10	0		DEAEHN
COc1ccc(C(C)(C)CNC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170835211	402531682	/nfs/dbraw/zinc/53/16/82/402531682.db2.gz	PKYRAMISQLLFNB-OAHLLOKOSA-N	0	3	319.449	2.318	10	0		DEAEHN
O=C(Cc1c[nH]c2cc(F)ccc12)N1CCN2CCC[C@@H]2C1	ZINC000171278957	402574040	/nfs/dbraw/zinc/57/40/40/402574040.db2.gz	KWDHYUGXIBFOGB-CQSZACIVSA-N	0	3	301.365	2.156	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000170859452	402533619	/nfs/dbraw/zinc/53/36/19/402533619.db2.gz	SXLPRBPDWRPVPN-SFHVURJKSA-N	0	3	324.424	2.085	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COc2cc(C)cc(C)c2)CC[C@@H]1C	ZINC000189314110	402534028	/nfs/dbraw/zinc/53/40/28/402534028.db2.gz	HMEGIMIENHEYHW-XYJFISCASA-N	0	3	307.434	2.400	10	0		DEAEHN
COc1cc(C(=O)N2CC[C@H](N(C)C)C2)ccc1OC(C)C	ZINC000170862212	402534440	/nfs/dbraw/zinc/53/44/40/402534440.db2.gz	GZFLCRGBCFRXEZ-AWEZNQCLSA-N	0	3	306.406	2.259	10	0		DEAEHN
Cc1c(C(=O)N2CC[C@@H](N(C)C)C2)cnn1-c1ccc(F)cc1	ZINC000170867384	402535869	/nfs/dbraw/zinc/53/58/69/402535869.db2.gz	UXBJCYWEYZJFIO-OAHLLOKOSA-N	0	3	316.380	2.096	10	0		DEAEHN
CCc1cccc(S(=O)(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000246572171	402537062	/nfs/dbraw/zinc/53/70/62/402537062.db2.gz	SQUYKJDZJQQMFG-HIFRSBDPSA-N	0	3	308.447	2.106	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccc(C(=O)NC(C)C)cc2)C1	ZINC000179475856	402591430	/nfs/dbraw/zinc/59/14/30/402591430.db2.gz	ITXMCLBDGFVRFS-MRXNPFEDSA-N	0	3	317.433	2.039	10	0		DEAEHN
c1nnc([C@@H]2CCCCN2CC2CCC3(CC2)OCCO3)[nH]1	ZINC000190315915	402592522	/nfs/dbraw/zinc/59/25/22/402592522.db2.gz	BHLBASJGKUZCRI-AWEZNQCLSA-N	0	3	306.410	2.265	10	0		DEAEHN
Cc1c(C(=O)N2CCN3CCC[C@H]3C2)cnn1-c1ccccc1	ZINC000171585506	402597896	/nfs/dbraw/zinc/59/78/96/402597896.db2.gz	XYZXKQBJXFNQAP-INIZCTEOSA-N	0	3	310.401	2.101	10	0		DEAEHN
COCCOc1ccc(CN2CCCN(C3CC3)CC2)cc1	ZINC000179732906	402598895	/nfs/dbraw/zinc/59/88/95/402598895.db2.gz	XHDSJJPBNNYLRC-UHFFFAOYSA-N	0	3	304.434	2.382	10	0		DEAEHN
CCc1ccccc1NC(=O)[C@@H](C)NCCn1cc(C)cn1	ZINC000171600716	402599600	/nfs/dbraw/zinc/59/96/00/402599600.db2.gz	YJMPUNGOYWYGOC-CQSZACIVSA-N	0	3	300.406	2.371	10	0		DEAEHN
FC(F)Oc1cccc(CNC[C@H]2CN(C3CC3)CCO2)c1	ZINC000171646150	402605943	/nfs/dbraw/zinc/60/59/43/402605943.db2.gz	XRNLYGVKPYVETB-HNNXBMFYSA-N	0	3	312.360	2.241	10	0		DEAEHN
CN1CC[C@H](NC(=O)CC2(O)CCCC2)[C@@H]1c1ccccc1	ZINC000180136118	402608601	/nfs/dbraw/zinc/60/86/01/402608601.db2.gz	HOXYCRAIWHTRLL-RDJZCZTQSA-N	0	3	302.418	2.243	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@](C)(O)C2CCCCC2)C1	ZINC000248812934	402609282	/nfs/dbraw/zinc/60/92/82/402609282.db2.gz	CNMMMZQTSSCFHH-DOTOQJQBSA-N	0	3	311.470	2.101	10	0		DEAEHN
O=C(NCc1ccc(Cl)cn1)N1CCCN(C2CC2)CC1	ZINC000180852338	402628163	/nfs/dbraw/zinc/62/81/63/402628163.db2.gz	RCEMYHKQQFIGSI-UHFFFAOYSA-N	0	3	308.813	2.115	10	0		DEAEHN
COc1ccc(C[C@H](C)NCC2(C)OCCCO2)cc1OC	ZINC000190649177	402616036	/nfs/dbraw/zinc/61/60/36/402616036.db2.gz	WLXNKAJLWZHTGB-ZDUSSCGKSA-N	0	3	309.406	2.378	10	0		DEAEHN
Cc1cc2c(cc1C)[C@@H](NC[C@@H]1CN(C)CCO1)CCCO2	ZINC000180490014	402618069	/nfs/dbraw/zinc/61/80/69/402618069.db2.gz	YJFPPYAMQNYUMF-WBVHZDCISA-N	0	3	304.434	2.437	10	0		DEAEHN
CCc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc3c(c1)OCO3)CC2	ZINC000180631119	402622172	/nfs/dbraw/zinc/62/21/72/402622172.db2.gz	HHTZGNZWDLINLF-YPMHNXCESA-N	0	3	314.389	2.235	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2cc(F)cc3cccnc32)[C@H](C)C1	ZINC000249307742	402625925	/nfs/dbraw/zinc/62/59/25/402625925.db2.gz	UKQCRGIQJBLAOG-KGLIPLIRSA-N	0	3	317.408	2.261	10	0		DEAEHN
O=C(NCCCOC1CCCCC1)N1CCN2CCC[C@@H]2C1	ZINC000171899179	402632393	/nfs/dbraw/zinc/63/23/93/402632393.db2.gz	MMNIZXIXXBZKRR-OAHLLOKOSA-N	0	3	309.454	2.215	10	0		DEAEHN
Cc1ccc([C@@H](C)NCCN2C(=O)NC(C)(C)C2=O)cc1F	ZINC000181342179	402642411	/nfs/dbraw/zinc/64/24/11/402642411.db2.gz	TZJNDUUKBRNDCX-LLVKDONJSA-N	0	3	307.369	2.115	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)n1	ZINC000249944861	402643749	/nfs/dbraw/zinc/64/37/49/402643749.db2.gz	YGESPAHMCHODJY-DAXOMENPSA-N	0	3	306.454	2.298	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@@H]1CC(C)(C)OC1(C)C	ZINC000181873831	402659450	/nfs/dbraw/zinc/65/94/50/402659450.db2.gz	APAJOGMQEUQRFR-UONOGXRCSA-N	0	3	311.470	2.458	10	0		DEAEHN
C[C@H](C(=O)Nc1cc(F)ccc1F)N1CCCN(C2CC2)CC1	ZINC000172345999	402651255	/nfs/dbraw/zinc/65/12/55/402651255.db2.gz	SQHFQBMYKMIEMO-GFCCVEGCSA-N	0	3	323.387	2.462	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)Cc1ccc(C)cc1F	ZINC000192013969	402705108	/nfs/dbraw/zinc/70/51/08/402705108.db2.gz	JDCOMDKDNMPEDI-CYBMUJFWSA-N	0	3	316.442	2.284	10	0		DEAEHN
C[C@H](NC1CCN(C(=O)c2ccccc2)CC1)c1nccn1C	ZINC000182639505	402705354	/nfs/dbraw/zinc/70/53/54/402705354.db2.gz	XUNOKVUROIYNII-AWEZNQCLSA-N	0	3	312.417	2.376	10	0		DEAEHN
COC(=O)CCCN[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1	ZINC000192150648	402714551	/nfs/dbraw/zinc/71/45/51/402714551.db2.gz	KCYAHDYQFODTIZ-CZUORRHYSA-N	0	3	324.808	2.155	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1OCCNC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000173903821	402718198	/nfs/dbraw/zinc/71/81/98/402718198.db2.gz	JONUNPZVCDKNJE-IXDOHACOSA-N	0	3	321.465	2.237	10	0		DEAEHN
C[C@@H](CN[C@H]1CCCOc2cc(F)ccc21)N1CCOCC1	ZINC000181929834	402660906	/nfs/dbraw/zinc/66/09/06/402660906.db2.gz	HHRSXRMVUMYOTK-BBRMVZONSA-N	0	3	308.397	2.350	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@H](C)Oc2ccc(F)c(F)c2)C1	ZINC000253359528	402662901	/nfs/dbraw/zinc/66/29/01/402662901.db2.gz	XPFYLDRFHHVWDF-RYUDHWBXSA-N	0	3	312.360	2.333	10	0		DEAEHN
C[C@H]1CN(C2CCN(CCC(=O)c3ccccc3)CC2)CCO1	ZINC000182073128	402666026	/nfs/dbraw/zinc/66/60/26/402666026.db2.gz	FLYXBBVIHWOLRS-INIZCTEOSA-N	0	3	316.445	2.445	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)c2cnc(-c3ccncc3)s2)C1	ZINC000172912999	402679510	/nfs/dbraw/zinc/67/95/10/402679510.db2.gz	VTVIDAIGXSUUTP-GFCCVEGCSA-N	0	3	316.430	2.277	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)/C=C\c2ccc(OC)c(OC)c2)C1	ZINC000255129804	402679936	/nfs/dbraw/zinc/67/99/36/402679936.db2.gz	IOOCDQOVUZDFOV-WKTRQSJXSA-N	0	3	318.417	2.318	10	0		DEAEHN
Cc1cc(N2CC[C@@H](N(C)CC3CCCCC3)C2=O)n(C)n1	ZINC000173183486	402687610	/nfs/dbraw/zinc/68/76/10/402687610.db2.gz	WCZOUUZFGZCSFU-OAHLLOKOSA-N	0	3	304.438	2.346	10	0		DEAEHN
CCCc1cc(NC(=O)[C@H](NC2CCOCC2)C(C)C)n[nH]1	ZINC000173267694	402690036	/nfs/dbraw/zinc/69/00/36/402690036.db2.gz	UHZLFBOIBFFKOO-OAHLLOKOSA-N	0	3	308.426	2.094	10	0		DEAEHN
CC[C@@H]1CN(CCCc2ccccc2OC)CCN1C[C@@H](C)O	ZINC000182441072	402690232	/nfs/dbraw/zinc/69/02/32/402690232.db2.gz	RJNVQVSKRYUOEF-SJLPKXTDSA-N	0	3	320.477	2.405	10	0		DEAEHN
CNCC(=O)N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1	ZINC000262762187	402730593	/nfs/dbraw/zinc/73/05/93/402730593.db2.gz	JPMJOHRPPWUDTH-HNNXBMFYSA-N	0	3	303.793	2.354	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@H](C)N[C@H](C)[C@H]2CCCO2)c1	ZINC000183094072	402738181	/nfs/dbraw/zinc/73/81/81/402738181.db2.gz	GDOQQRRRTYCPKU-BFQNTYOBSA-N	0	3	304.390	2.373	10	0		DEAEHN
O=C(c1cccs1)N1CCCN(CCCn2ccnc2)CC1	ZINC000183177909	402745230	/nfs/dbraw/zinc/74/52/30/402745230.db2.gz	SZMXNNUFIKMJBJ-UHFFFAOYSA-N	0	3	318.446	2.183	10	0		DEAEHN
C[C@H](Cc1nc([C@H]2CNCCN2C)no1)c1cccc(F)c1	ZINC000263174519	402746545	/nfs/dbraw/zinc/74/65/45/402746545.db2.gz	GBQZGMCXKSRGAW-BXUZGUMPSA-N	0	3	304.369	2.131	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N(C(=O)c2ccnc(OCCN(C)C)c2)C1	ZINC000183221144	402748326	/nfs/dbraw/zinc/74/83/26/402748326.db2.gz	VFRYCNVPKXUIQV-KGLIPLIRSA-N	0	3	305.422	2.283	10	0		DEAEHN
Cc1ccc(-c2cc(-c3nc([C@@H]4CNCCN4C)no3)n[nH]2)cc1	ZINC000263269747	402752897	/nfs/dbraw/zinc/75/28/97/402752897.db2.gz	SBXGIPWBFIFBQZ-HNNXBMFYSA-N	0	3	324.388	2.011	10	0		DEAEHN
CC(C)COc1ccc(-c2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263306175	402756717	/nfs/dbraw/zinc/75/67/17/402756717.db2.gz	XYNOFKAVNWWHEH-HNNXBMFYSA-N	0	3	316.405	2.348	10	0		DEAEHN
CN(C)c1ccncc1C(=O)NC[C@H](c1cccs1)N(C)C	ZINC000183471135	402770416	/nfs/dbraw/zinc/77/04/16/402770416.db2.gz	IOXRFWPPBASHBH-CQSZACIVSA-N	0	3	318.446	2.242	10	0		DEAEHN
CN(C(=O)c1ccc2c(c1O)CCCC2)[C@H]1CCCN(C)C1	ZINC000182862769	402722781	/nfs/dbraw/zinc/72/27/81/402722781.db2.gz	RQXOWLCQBSTWHM-AWEZNQCLSA-N	0	3	302.418	2.437	10	0		DEAEHN
O=C(c1cncc(Cl)n1)N1CCCC[C@@H](N2CCCC2)C1	ZINC000192348149	402723440	/nfs/dbraw/zinc/72/34/40/402723440.db2.gz	GBYXBRYJDCHUDR-GFCCVEGCSA-N	0	3	308.813	2.221	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H](C)c2nc(C)cs2)C1	ZINC000183688454	402789031	/nfs/dbraw/zinc/78/90/31/402789031.db2.gz	OPJBIQFZHYDFQX-YPMHNXCESA-N	0	3	310.467	2.339	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cc(C(=O)OC)ccc2F)C1	ZINC000194340977	402793095	/nfs/dbraw/zinc/79/30/95/402793095.db2.gz	CMNXTSYDQFQRLZ-LBPRGKRZSA-N	0	3	323.368	2.218	10	0		DEAEHN
COC(=O)COc1ccccc1[C@@H](C)NCCn1cc(C)cn1	ZINC000183738098	402793271	/nfs/dbraw/zinc/79/32/71/402793271.db2.gz	QBZFVOPQRCUOIG-CQSZACIVSA-N	0	3	317.389	2.094	10	0		DEAEHN
CC(C)NC(=O)CCN(C)[C@@H](C)c1ccc([S@](C)=O)cc1	ZINC000175410944	402804198	/nfs/dbraw/zinc/80/41/98/402804198.db2.gz	WOQZPMLYUNKHTM-ZSEKCTLFSA-N	0	3	310.463	2.332	10	0		DEAEHN
C[C@H](CNc1ncnc2cc(Cl)ccc21)N1CCN(C)CC1	ZINC000263911467	402819322	/nfs/dbraw/zinc/81/93/22/402819322.db2.gz	JYXMHPIHCKVWLK-GFCCVEGCSA-N	0	3	319.840	2.331	10	0		DEAEHN
CCCCN1CCOC[C@@H]1C(=O)Nc1cccc(CN(C)C)c1	ZINC000184251723	402830717	/nfs/dbraw/zinc/83/07/17/402830717.db2.gz	PBGAHFBFPXEMCY-QGZVFWFLSA-N	0	3	319.449	2.188	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)Nc1ccc([S@@](C)=O)cc1	ZINC000175787758	402833000	/nfs/dbraw/zinc/83/30/00/402833000.db2.gz	PJLAWZLDQUJMTB-WHEQGISXSA-N	0	3	323.462	2.420	10	0		DEAEHN
Cc1oc(-c2ccco2)nc1CC(=O)N1CCN2CCC[C@H]2C1	ZINC000195190463	402835973	/nfs/dbraw/zinc/83/59/73/402835973.db2.gz	MLAMCUQZSYGBHH-ZDUSSCGKSA-N	0	3	315.373	2.092	10	0		DEAEHN
CN(C(=O)[C@@H]1CCCN(Cc2ccccc2)C1)c1nncs1	ZINC000184349320	402837259	/nfs/dbraw/zinc/83/72/59/402837259.db2.gz	BARXIRYZXUFGHN-CQSZACIVSA-N	0	3	316.430	2.413	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN([C@@H](C)C(=O)N(C)C(C)C)C1	ZINC000175202833	402787488	/nfs/dbraw/zinc/78/74/88/402787488.db2.gz	YFIZHTVPGOXAKW-GJZGRUSLSA-N	0	3	306.454	2.338	10	0		DEAEHN
O=C(c1[nH]nc2ccc(Cl)cc21)N1CCN(C2CC2)CC1	ZINC000278840873	402877069	/nfs/dbraw/zinc/87/70/69/402877069.db2.gz	KMJLWVQQMUUPFU-UHFFFAOYSA-N	0	3	304.781	2.137	10	0		DEAEHN
O=C(Nc1ccn(-c2ccccc2)n1)N1CCN2CCC[C@@H]2C1	ZINC000264735141	402892223	/nfs/dbraw/zinc/89/22/23/402892223.db2.gz	OJORRAVUFAALPG-OAHLLOKOSA-N	0	3	311.389	2.184	10	0		DEAEHN
Cn1cc([C@H]2OCCC[C@@H]2NCc2cccc3nccn32)cn1	ZINC000275648411	403112203	/nfs/dbraw/zinc/11/22/03/403112203.db2.gz	UEMZLXOGDNEPFB-DOTOQJQBSA-N	0	3	311.389	2.078	10	0		DEAEHN
Cn1ccnc(N2CCC[C@@H](NC/C=C/c3ccccc3)C2)c1=O	ZINC000275728623	403119199	/nfs/dbraw/zinc/11/91/99/403119199.db2.gz	ZPLZLTIRSLDLOI-HFTQHKIXSA-N	0	3	324.428	2.052	10	0		DEAEHN
O=C([C@@H]1CSCCS1)N1CCCC[C@@H](N2CCCC2)C1	ZINC000107531313	304377047	/nfs/dbraw/zinc/37/70/47/304377047.db2.gz	FBMPDXFDVQMOBE-KGLIPLIRSA-N	0	3	314.520	2.312	10	0		DEAEHN
COc1ccc(F)c(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1OC	ZINC000188451343	286318361	/nfs/dbraw/zinc/31/83/61/286318361.db2.gz	GYSDIVRZPHAUIU-NWDGAFQWSA-N	0	3	322.380	2.152	10	0		DEAEHN
C/C(=C\c1ccccc1)CN1CCC[C@@H](CS(N)(=O)=O)C1	ZINC000271179215	403274252	/nfs/dbraw/zinc/27/42/52/403274252.db2.gz	LKQVYULHEWPTTQ-HFQYIWAZSA-N	0	3	308.447	2.090	10	0		DEAEHN
CC(=O)CSCC(=O)N(CCN1CCCCCC1)C(C)C	ZINC000345947964	403544894	/nfs/dbraw/zinc/54/48/94/403544894.db2.gz	GMAIVWMFKBFKLI-UHFFFAOYSA-N	0	3	314.495	2.422	10	0		DEAEHN
CC(=O)CCc1ccc(OC[C@H](O)CN2C[C@H](C)[C@H]2C)cc1	ZINC000293532191	403497652	/nfs/dbraw/zinc/49/76/52/403497652.db2.gz	XEIWVAPEKSOPSX-YSVLISHTSA-N	0	3	305.418	2.288	10	0		DEAEHN
Cc1cc(NC[C@@H]2CN3CCN2CC3)c2cc(F)ccc2n1	ZINC000301762528	403675379	/nfs/dbraw/zinc/67/53/79/403675379.db2.gz	GOKZEUXMCRONKX-CQSZACIVSA-N	0	3	300.381	2.094	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@H]2CN1C[C@@H](O)COCc1ccccc1	ZINC000303080316	403746731	/nfs/dbraw/zinc/74/67/31/403746731.db2.gz	MKNIMTXDOGQCET-NZSAHSFTSA-N	0	3	318.461	2.123	10	0		DEAEHN
Cc1cn[nH]c1CN[C@H]1CC(=O)N(c2ccccc2Cl)C1	ZINC000368674659	403818959	/nfs/dbraw/zinc/81/89/59/403818959.db2.gz	BNSZOIZJGALUAW-NSHDSACASA-N	0	3	304.781	2.267	10	0		DEAEHN
CN(CCOc1c(Cl)cccc1Cl)CC(C)(CO)CO	ZINC000305254046	403894019	/nfs/dbraw/zinc/89/40/19/403894019.db2.gz	MSQVIBCOOJOZHF-UHFFFAOYSA-N	0	3	322.232	2.295	10	0		DEAEHN
Nc1cccnc1C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000310101070	403965906	/nfs/dbraw/zinc/96/59/06/403965906.db2.gz	XUDZJMJHJSKQCF-MRXNPFEDSA-N	0	3	324.428	2.306	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCC[C@H]1C(C)(C)O	ZINC000305747916	403928023	/nfs/dbraw/zinc/92/80/23/403928023.db2.gz	QCAZVOVYUPFOIQ-INIZCTEOSA-N	0	3	304.434	2.270	10	0		DEAEHN
CN(C(=O)c1ncccc1N)C1CCN(Cc2ccccc2)CC1	ZINC000310525437	403967291	/nfs/dbraw/zinc/96/72/91/403967291.db2.gz	OOSOZYWYQVQKNK-UHFFFAOYSA-N	0	3	324.428	2.400	10	0		DEAEHN
c1cnn(CCCCCN2CCC(Oc3cnccn3)CC2)c1	ZINC000369683301	404190957	/nfs/dbraw/zinc/19/09/57/404190957.db2.gz	WDMVVOTWFVXGTJ-UHFFFAOYSA-N	0	3	315.421	2.387	10	0		DEAEHN
c1nn2ccccc2c1CN1CCC(OC[C@@H]2CCOC2)CC1	ZINC000369963408	404285262	/nfs/dbraw/zinc/28/52/62/404285262.db2.gz	FIUSUSLTAACUCU-OAHLLOKOSA-N	0	3	315.417	2.352	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)nc1	ZINC000297122269	404460970	/nfs/dbraw/zinc/46/09/70/404460970.db2.gz	IGIQFMVHQVLQAS-BXUZGUMPSA-N	0	3	304.394	2.231	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(CCSc2ccccc2)CC12COC2	ZINC000451138210	404877380	/nfs/dbraw/zinc/87/73/80/404877380.db2.gz	QFEBVIZCOGZTGD-HNNXBMFYSA-N	0	3	321.442	2.290	10	0		DEAEHN
CCCNC(=O)C1CCN(Cc2ccc(-c3cc[nH]n3)o2)CC1	ZINC000435127672	404957997	/nfs/dbraw/zinc/95/79/97/404957997.db2.gz	XUWRGBIHKMKMDM-UHFFFAOYSA-N	0	3	316.405	2.408	10	0		DEAEHN
CC(C)(O)C1CN(C[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000435901005	405024494	/nfs/dbraw/zinc/02/44/94/405024494.db2.gz	DYRWWZRBRYAJQL-ZDUSSCGKSA-N	0	3	317.351	2.312	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)c2ncccc2N)CCN1Cc1ccccc1	ZINC000379661924	405027894	/nfs/dbraw/zinc/02/78/94/405027894.db2.gz	GTWMMXJMZUKTCP-GOEBONIOSA-N	0	3	324.428	2.447	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CC[C@@H](CN3CCCCC3)C2)o1	ZINC000408097807	405110997	/nfs/dbraw/zinc/11/09/97/405110997.db2.gz	NVMTVGLBXWKDHL-AWEZNQCLSA-N	0	3	312.435	2.085	10	0		DEAEHN
COc1ccc(OC)c(CN[C@@H](C)C2(OC)CCOCC2)c1	ZINC000453072048	405281406	/nfs/dbraw/zinc/28/14/06/405281406.db2.gz	NBKFXUIQOHLPKT-ZDUSSCGKSA-N	0	3	309.406	2.378	10	0		DEAEHN
COc1ccc(NC(=O)CNC2(CCO)CCCCC2)cc1	ZINC000440889861	405330210	/nfs/dbraw/zinc/33/02/10/405330210.db2.gz	PSPQFPDWGJOQTH-UHFFFAOYSA-N	0	3	306.406	2.309	10	0		DEAEHN
Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CN(C)CCCO	ZINC000440957367	405332697	/nfs/dbraw/zinc/33/26/97/405332697.db2.gz	LRWMOSVOZKZBHR-INIZCTEOSA-N	0	3	309.450	2.346	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCc2c(Cl)cc(F)cc2C1)N(C)C	ZINC000455443490	405410453	/nfs/dbraw/zinc/41/04/53/405410453.db2.gz	HSGVFGOIBNTQJC-JTQLQIEISA-N	0	3	313.804	2.497	10	0		DEAEHN
c1ccc(CN2CCCO[C@@H](CN3CC[C@]34CCOC4)C2)cc1	ZINC000421016996	405430881	/nfs/dbraw/zinc/43/08/81/405430881.db2.gz	JPVFPBBLGWESEE-RTBURBONSA-N	0	3	316.445	2.142	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@@H](c1ccccc1)C(F)F	ZINC000455598683	405432229	/nfs/dbraw/zinc/43/22/29/405432229.db2.gz	NWYHQNOAZFRUNX-AWEZNQCLSA-N	0	3	320.343	2.221	10	0		DEAEHN
c1ccc(-n2nnc(CN[C@@H]3CCN(C4CC4)C3)c2C2CC2)cc1	ZINC000638563695	405547725	/nfs/dbraw/zinc/54/77/25/405547725.db2.gz	BDCHHLOHEBMGLM-OAHLLOKOSA-N	0	3	323.444	2.471	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)N(CCN(C)C)CC(C)C	ZINC000458835938	405619453	/nfs/dbraw/zinc/61/94/53/405619453.db2.gz	FHNAKOXYDPILAS-UHFFFAOYSA-N	0	3	310.442	2.275	10	0		DEAEHN
COc1nsc(CN[C@@H](C)[C@@H]2CCOC2)c1Br	ZINC000638692269	405620028	/nfs/dbraw/zinc/62/00/28/405620028.db2.gz	FVJKMZQFXNCYAU-JGVFFNPUSA-N	0	3	321.240	2.429	10	0		DEAEHN
CC(C)N1CC[C@@H](N(C)C(=O)NCc2ccc3cc[nH]c3n2)C1	ZINC000458777622	405586142	/nfs/dbraw/zinc/58/61/42/405586142.db2.gz	AONMZHGSFPQRIN-OAHLLOKOSA-N	0	3	315.421	2.187	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@H]1CCO[C@]2(CCSC2)C1	ZINC000495135830	405822868	/nfs/dbraw/zinc/82/28/68/405822868.db2.gz	BSOYWKLNAMEAFK-SQWLQELKSA-N	0	3	312.479	2.032	10	0		DEAEHN
COc1nsc(CN[C@H]2CCOC[C@@H]2C)c1Br	ZINC000639121202	405898735	/nfs/dbraw/zinc/89/87/35/405898735.db2.gz	NFSPATDFIZBBLV-YUMQZZPRSA-N	0	3	321.240	2.429	10	0		DEAEHN
CCn1nncc1CN(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000459372913	405876725	/nfs/dbraw/zinc/87/67/25/405876725.db2.gz	ZYQJFJNKJDWHJP-QGZVFWFLSA-N	0	3	313.449	2.394	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N(C)CC2CCN(C)CC2)c1	ZINC000457524633	405881657	/nfs/dbraw/zinc/88/16/57/405881657.db2.gz	IRBFUQSGDLTZAV-UHFFFAOYSA-N	0	3	318.417	2.195	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)c1cc(C)cc(C(=O)OC)c1	ZINC000457557871	405896269	/nfs/dbraw/zinc/89/62/69/405896269.db2.gz	NVSPKMSFBDOMOO-INIZCTEOSA-N	0	3	318.417	2.386	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)NCCN2CCC(C)CC2)c1	ZINC000457448059	405844627	/nfs/dbraw/zinc/84/46/27/405844627.db2.gz	HDDDRFIFSFDUNT-UHFFFAOYSA-N	0	3	318.417	2.243	10	0		DEAEHN
c1ccc(N2CC[C@@H](CN3CCO[C@@]4(CCOC4)C3)C2)cc1	ZINC000639052056	405847598	/nfs/dbraw/zinc/84/75/98/405847598.db2.gz	HTWMELBXTQPPOY-WMZOPIPTSA-N	0	3	302.418	2.004	10	0		DEAEHN
c1c(CN2CCN(C3CCCCC3)CC2)nnn1CC1CC1	ZINC000450501269	405932309	/nfs/dbraw/zinc/93/23/09/405932309.db2.gz	MWNNLKLYQUDEKR-UHFFFAOYSA-N	0	3	303.454	2.138	10	0		DEAEHN
COCCC1(C)CN(Cc2ccc(-n3cncn3)c(C)c2)C1	ZINC000459628199	405988516	/nfs/dbraw/zinc/98/85/16/405988516.db2.gz	DLOXPSLKHQNSQI-UHFFFAOYSA-N	0	3	300.406	2.434	10	0		DEAEHN
COc1cc(CN[C@H]2CN(Cc3ccccc3)C[C@@H]2C)on1	ZINC000639325380	406045431	/nfs/dbraw/zinc/04/54/31/406045431.db2.gz	WVEVVQGJWQIBBG-BBRMVZONSA-N	0	3	301.390	2.293	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2ccccc2CC)CC12COC2	ZINC000451127687	406058879	/nfs/dbraw/zinc/05/88/79/406058879.db2.gz	AODUIFSUMXGPJS-MRXNPFEDSA-N	0	3	303.402	2.261	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1	ZINC000533816345	406163501	/nfs/dbraw/zinc/16/35/01/406163501.db2.gz	SHBBHUYRWBLJMR-SQWLQELKSA-N	0	3	302.422	2.183	10	0		DEAEHN
CC(C)(C)c1nc(C(=O)NCCNc2ccncc2)cs1	ZINC000535257879	406217641	/nfs/dbraw/zinc/21/76/41/406217641.db2.gz	LHFKECSYXPNQCN-UHFFFAOYSA-N	0	3	304.419	2.099	10	0		DEAEHN
C[C@H](Cc1ccncc1)NCc1c(Br)cnn1C	ZINC000487275736	406219927	/nfs/dbraw/zinc/21/99/27/406219927.db2.gz	PWYKFRGAZOOHIQ-SNVBAGLBSA-N	0	3	309.211	2.298	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@@H]1[C@H]2CCO[C@@H]2C1(C)C	ZINC000487280108	406221560	/nfs/dbraw/zinc/22/15/60/406221560.db2.gz	QULSNFIDJDJTOK-FXAINCCUSA-N	0	3	314.227	2.086	10	0		DEAEHN
Cn1ncc(Br)c1CNCC1(CCO)CCCC1	ZINC000487316991	406223681	/nfs/dbraw/zinc/22/36/81/406223681.db2.gz	DAIUWQNKSZGKKH-UHFFFAOYSA-N	0	3	316.243	2.215	10	0		DEAEHN
c1ccc(CN2CC[C@@H](N3CCO[C@]4(CCSC4)C3)C2)cc1	ZINC000569238718	406225880	/nfs/dbraw/zinc/22/58/80/406225880.db2.gz	PUMWHBWYWBGTOE-QZTJIDSGSA-N	0	3	318.486	2.469	10	0		DEAEHN
CC(C)[C@@H]1C[C@H](NCc2c(Br)cnn2C)CCO1	ZINC000487579352	406249168	/nfs/dbraw/zinc/24/91/68/406249168.db2.gz	VMOFSYDREUDFKM-MFKMUULPSA-N	0	3	316.243	2.476	10	0		DEAEHN
Cc1cc(C[C@H](C)NC(=O)NC[C@@H](C)N2CCCC[C@H]2C)[nH]n1	ZINC000487549254	406244647	/nfs/dbraw/zinc/24/46/47/406244647.db2.gz	HJAXNIBVERYZHM-NWANDNLSSA-N	0	3	321.469	2.211	10	0		DEAEHN
CC(C)c1ccc(CCNC(=O)CN2CC[C@H](CO)[C@H]2C)cc1	ZINC000488716540	406340379	/nfs/dbraw/zinc/34/03/79/406340379.db2.gz	JQOUTKQGCUFJJF-CRAIPNDOSA-N	0	3	318.461	2.171	10	0		DEAEHN
Cc1ccc([C@H](C)NC(=O)CN2CC[C@@H](CO)[C@H]2C)cc1C	ZINC000488732263	406342567	/nfs/dbraw/zinc/34/25/67/406342567.db2.gz	MMKDVOFCYDKEKD-UXLLHSPISA-N	0	3	304.434	2.183	10	0		DEAEHN
C[C@@H](c1ccc(F)cc1)N(C)C(=O)CN1CC[C@@H](CO)[C@H]1C	ZINC000488808742	406350304	/nfs/dbraw/zinc/35/03/04/406350304.db2.gz	ROLSYBNTZPGCBF-GUTXKFCHSA-N	0	3	308.397	2.048	10	0		DEAEHN
CN(C)CCCN(C)C(=O)CCC(=O)c1ccc(Cl)cn1	ZINC000547429236	406409567	/nfs/dbraw/zinc/40/95/67/406409567.db2.gz	PWWDXPRPRWWOTM-UHFFFAOYSA-N	0	3	311.813	2.108	10	0		DEAEHN
CC(C)OC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)N1CCCCC1	ZINC000522934892	406414052	/nfs/dbraw/zinc/41/40/52/406414052.db2.gz	LVDPZEPICWYTBE-HOTGVXAUSA-N	0	3	324.465	2.440	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CCC[C@H]2CCC[C@@H]21	ZINC000637954259	406494408	/nfs/dbraw/zinc/49/44/08/406494408.db2.gz	UZQKAZKHHCXHPE-SQNIBIBYSA-N	0	3	315.461	2.237	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637869914	406455057	/nfs/dbraw/zinc/45/50/57/406455057.db2.gz	ZWBNTWZGCLPNDC-IAGOWNOFSA-N	0	3	303.450	2.237	10	0		DEAEHN
CCCC1(CNC(=O)[C@@H](N)CN(C)Cc2ccccc2)CC1	ZINC000638045738	406541119	/nfs/dbraw/zinc/54/11/19/406541119.db2.gz	VYNIARMWOKQDTB-INIZCTEOSA-N	0	3	303.450	2.142	10	0		DEAEHN
Cc1cc(NC(=O)[C@@H]2OCC[C@@H]2N)cc(C)c1Br	ZINC000638297833	406680826	/nfs/dbraw/zinc/68/08/26/406680826.db2.gz	BBZZPFLEMDWPIM-CMPLNLGQSA-N	0	3	313.195	2.121	10	0		DEAEHN
OCCN1CCC[C@H](NCc2ccsc2C(F)(F)F)C1	ZINC000527655608	406705158	/nfs/dbraw/zinc/70/51/58/406705158.db2.gz	KKXPVPGTYQYQFI-NSHDSACASA-N	0	3	308.369	2.313	10	0		DEAEHN
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CSC2(C)C)cc1	ZINC000572596134	406699194	/nfs/dbraw/zinc/69/91/94/406699194.db2.gz	JTOJBRFROKKOMF-UKRRQHHQSA-N	0	3	309.431	2.113	10	0		DEAEHN
c1ccc(-n2nnnc2CCN2CCC[C@H]2c2cccnc2)cc1	ZINC000554241638	406787701	/nfs/dbraw/zinc/78/77/01/406787701.db2.gz	OLYIPCLDOXCJJA-KRWDZBQOSA-N	0	3	320.400	2.437	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H]1CNCCOC1)c1ccc(Cl)c(Cl)c1	ZINC000643619840	407018438	/nfs/dbraw/zinc/01/84/38/407018438.db2.gz	HRXVOBKNXBSCSB-MWLCHTKSSA-N	0	3	317.216	2.407	10	0		DEAEHN
CC[C@@H](C)NCC(=O)Nc1ncc(Br)cc1C	ZINC000129630990	196063382	/nfs/dbraw/zinc/06/33/82/196063382.db2.gz	IBDVCEZALHAGCF-SECBINFHSA-N	0	3	300.200	2.479	10	0		DEAEHN
CC(C)(C(=O)N1CCC[C@H]1c1ccsc1)N1CCNCC1	ZINC000129655951	196064998	/nfs/dbraw/zinc/06/49/98/196064998.db2.gz	ODLIMIMVCMZHMU-AWEZNQCLSA-N	0	3	307.463	2.095	10	0		DEAEHN
Cc1cc(Br)cnc1NC(=O)c1cc[nH]c(=NN)c1	ZINC000129793686	196076554	/nfs/dbraw/zinc/07/65/54/196076554.db2.gz	PHCIUWWBIAHHNW-UHFFFAOYSA-N	0	3	322.166	2.085	10	0		DEAEHN
CCN[C@@H](C)c1cccc(S(=O)(=O)NC[C@H](C)OCC)c1	ZINC000131230020	196152602	/nfs/dbraw/zinc/15/26/02/196152602.db2.gz	CMAVAVVKOGXHNJ-STQMWFEESA-N	0	3	314.451	2.060	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ccncc1F	ZINC000131795717	196200521	/nfs/dbraw/zinc/20/05/21/196200521.db2.gz	OKUCQXOAELBGHQ-CQSZACIVSA-N	0	3	301.365	2.123	10	0		DEAEHN
CCN[C@@H](CC)c1ccc(SCCS(C)(=O)=O)cn1	ZINC000131899033	196207987	/nfs/dbraw/zinc/20/79/87/196207987.db2.gz	HBQLNZQQLHJVKA-LBPRGKRZSA-N	0	3	302.465	2.279	10	0		DEAEHN
CNc1nc(N(C)C)nc(N2CCc3sccc3[C@H]2C)n1	ZINC000132567234	196266015	/nfs/dbraw/zinc/26/60/15/196266015.db2.gz	SWSWOCOHNWRDGK-SECBINFHSA-N	0	3	304.423	2.165	10	0		DEAEHN
COc1cc(C)cc(CNC(=O)N2CC[C@@H](N3CC=CC3)C2)c1	ZINC000132965042	196300422	/nfs/dbraw/zinc/30/04/22/196300422.db2.gz	DNRAVWFBAXPPHA-MRXNPFEDSA-N	0	3	315.417	2.159	10	0		DEAEHN
COCc1nnc2sc([C@@H]3CC[C@@H]4CCCC[C@@H]4N3)nn12	ZINC000133942031	196347965	/nfs/dbraw/zinc/34/79/65/196347965.db2.gz	VVFQKYBQAQXQHF-DCAQKATOSA-N	0	3	307.423	2.316	10	0		DEAEHN
CC[C@@H]([NH3+])CC[N-]S(=O)(=O)c1ccccc1C(F)(F)F	ZINC000135189848	196451245	/nfs/dbraw/zinc/45/12/45/196451245.db2.gz	YTJLUATXFCPZBZ-SECBINFHSA-N	0	3	310.341	2.111	10	0		DEAEHN
CN[C@H](c1ccncc1F)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000135862136	196505603	/nfs/dbraw/zinc/50/56/03/196505603.db2.gz	BKEXXFIKDVWONG-SUNKGSAMSA-N	0	3	300.399	2.085	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)Nc1ccc(OCCN(C)C)cc1	ZINC000194069005	225173568	/nfs/dbraw/zinc/17/35/68/225173568.db2.gz	RNTMACNLDIFSID-CZUORRHYSA-N	0	3	306.406	2.238	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)Nc2cc(F)ccc2F)c1	ZINC000105881467	424849643	/nfs/dbraw/zinc/84/96/43/424849643.db2.gz	HBWKZRRGLNRNAW-LLVKDONJSA-N	0	3	308.332	2.087	10	0		DEAEHN
CN1CC[C@@H]2CN(c3ncc(Br)cc3F)C[C@@H]2C1	ZINC000386455762	424911876	/nfs/dbraw/zinc/91/18/76/424911876.db2.gz	FFWYYRNTKMDDSR-ZJUUUORDSA-N	0	3	314.202	2.371	10	0		DEAEHN
Brc1ccsc1CN1CC[C@@H]2OCCN[C@H]2C1	ZINC000404248876	424926049	/nfs/dbraw/zinc/92/60/49/424926049.db2.gz	IAAQEXKYBAOGIW-QWRGUYRKSA-N	0	3	317.252	2.073	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-]CCC2(C[NH3+])CC2)sc1Cl	ZINC000404701872	424928039	/nfs/dbraw/zinc/92/80/39/424928039.db2.gz	ZFSRPDZZGFAFHA-UHFFFAOYSA-N	0	3	308.856	2.117	10	0		DEAEHN
CN(C[C@@H]1CCCN1C)C(=O)c1nscc1Br	ZINC000404776536	424929023	/nfs/dbraw/zinc/92/90/23/424929023.db2.gz	AJSZYWKVDPLADO-QMMMGPOBSA-N	0	3	318.240	2.072	10	0		DEAEHN
O[C@@H]1C[C@H](NCc2cccc(-c3ccccn3)c2)[C@H]1n1cccn1	ZINC000657514844	425355574	/nfs/dbraw/zinc/35/55/74/425355574.db2.gz	BEKYRYJGRMDZFQ-IPMKNSEASA-N	0	3	320.396	2.409	10	0		DEAEHN
CN(C(=O)c1ccc2ncsc2c1)[C@H](CN)C(F)(F)F	ZINC000662980981	425771471	/nfs/dbraw/zinc/77/14/71/425771471.db2.gz	LIGCQJGITKPEQN-SNVBAGLBSA-N	0	3	303.309	2.258	10	0		DEAEHN
CC(C)CC(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000397626682	269106471	/nfs/dbraw/zinc/10/64/71/269106471.db2.gz	KZOWHLKDFPTDKT-UHFFFAOYSA-N	0	3	304.434	2.176	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1)N(C)C	ZINC000119171439	276021303	/nfs/dbraw/zinc/02/13/03/276021303.db2.gz	QXNJLLKCGOOPQN-PBHICJAKSA-N	0	3	321.440	2.499	10	0		DEAEHN
CC1(C)NC(=O)N(CCN2CCC[C@@]3(CC=CCC3)C2)C1=O	ZINC000114493928	276154423	/nfs/dbraw/zinc/15/44/23/276154423.db2.gz	ZFCOXFGIDWLRFE-KRWDZBQOSA-N	0	3	305.422	2.139	10	0		DEAEHN
CNC(=O)[C@H](C)CN(C)C[C@@H]1CC(c2ccc(Cl)cc2)=NO1	ZINC000091675529	277247804	/nfs/dbraw/zinc/24/78/04/277247804.db2.gz	GPHRSMSKMZWGQH-RISCZKNCSA-N	0	3	323.824	2.147	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H](c1ccc(F)cc1)N(C)C)N(C)C	ZINC000137056133	278855786	/nfs/dbraw/zinc/85/57/86/278855786.db2.gz	FEMQWDFHZIAPPO-JKSUJKDBSA-N	0	3	309.429	2.275	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCSC(C)(C)C1	ZINC000083710852	279124835	/nfs/dbraw/zinc/12/48/35/279124835.db2.gz	AKGQHIKDNRZVEC-CYBMUJFWSA-N	0	3	301.500	2.500	10	0		DEAEHN
O=C1[C@H](N2CCN3CCC[C@@H]3C2)CCN1c1ccc(Cl)cc1	ZINC000172624702	280323493	/nfs/dbraw/zinc/32/34/93/280323493.db2.gz	DGXSIQRGOXQRIR-HZPDHXFCSA-N	0	3	319.836	2.225	10	0		DEAEHN
Cc1ccc([C@H]2OCCC[C@@H]2C(=O)N2CCCNCC2)cc1	ZINC000262484157	281006268	/nfs/dbraw/zinc/00/62/68/281006268.db2.gz	WGIJBHIWRUQAID-DLBZAZTESA-N	0	3	302.418	2.285	10	0		DEAEHN
Cc1ccc2nccc(N3CCc4nn(C)c(=O)cc4C3)c2c1	ZINC000185740272	281170957	/nfs/dbraw/zinc/17/09/57/281170957.db2.gz	KMFVIRDNIXEWMM-UHFFFAOYSA-N	0	3	306.369	2.200	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN(CC(=O)N[C@@H](C)C(C)C)C2)n1	ZINC000195516157	281245266	/nfs/dbraw/zinc/24/52/66/281245266.db2.gz	OKPHYCQVBYOKCX-HOTGVXAUSA-N	0	3	318.465	2.285	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)NC[C@@]1(C)CCCO1	ZINC000119989094	281732482	/nfs/dbraw/zinc/73/24/82/281732482.db2.gz	MRQYVPKMWAIRHY-SJLPKXTDSA-N	0	3	319.449	2.028	10	0		DEAEHN
CN1C[C@@H](C(=O)Nc2ccnn2C(C)(C)C)[C@H](C(F)(F)F)C1	ZINC000299744505	290266980	/nfs/dbraw/zinc/26/69/80/290266980.db2.gz	OZANWTBPRNWLTG-NXEZZACHSA-N	0	3	318.343	2.317	10	0		DEAEHN
COc1ccccc1/C=C\CN1CCN(CC(C)(C)O)[C@@H](C)C1	ZINC000438328775	295347914	/nfs/dbraw/zinc/34/79/14/295347914.db2.gz	OHKHDECTMDJAAP-GQSKFBFOSA-N	0	3	318.461	2.485	10	0		DEAEHN
O=C(CN[C@H]1CCCC[C@@H]1n1cccn1)Nc1nccs1	ZINC000128040905	295523112	/nfs/dbraw/zinc/52/31/12/295523112.db2.gz	IEUVRKQSUAYHAK-RYUDHWBXSA-N	0	3	305.407	2.052	10	0		DEAEHN
C[S@](=O)C[C@H](N[C@H]1Cc2ccccc2[C@H]1O)c1ccccc1	ZINC000248564260	300886786	/nfs/dbraw/zinc/88/67/86/300886786.db2.gz	KJLUNMJVBQTYQV-AYMMHLMVSA-N	0	3	315.438	2.354	10	0		DEAEHN
C[C@H](CNC(=O)NCCOCC1CCC1)N1CCCC[C@@H]1C	ZINC000575037638	326211997	/nfs/dbraw/zinc/21/19/97/326211997.db2.gz	RHTKMBAEHSUQEO-LSDHHAIUSA-N	0	3	311.470	2.365	10	0		DEAEHN
CN(C)Cc1cccc(CNC(=O)NCCOCC2CCC2)c1	ZINC000576041829	326264968	/nfs/dbraw/zinc/26/49/68/326264968.db2.gz	MPXARMJYHJERAN-UHFFFAOYSA-N	0	3	319.449	2.364	10	0		DEAEHN
CN1CCN(CCCCNC(=O)[C@H]2CCCCC2(C)C)CC1	ZINC000576799939	326319561	/nfs/dbraw/zinc/31/95/61/326319561.db2.gz	XINVFMPMEHTSSD-MRXNPFEDSA-N	0	3	309.498	2.347	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N[C@@H](C)CN1CCCCC1	ZINC000189955808	335693999	/nfs/dbraw/zinc/69/39/99/335693999.db2.gz	OLTCHFJNTVHJSS-KBPBESRZSA-N	0	3	320.437	2.325	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000189977565	336257186	/nfs/dbraw/zinc/25/71/86/336257186.db2.gz	CJQHZYBDPIDBQZ-RWMBFGLXSA-N	0	3	318.421	2.076	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1c[nH]c(=O)c2ccccc12	ZINC000190380774	336263735	/nfs/dbraw/zinc/26/37/35/336263735.db2.gz	VHUZHXPYMGOJDQ-CYBMUJFWSA-N	0	3	315.417	2.234	10	0		DEAEHN
c1c(CNCC[C@@H]2COc3ccccc3O2)nc2ncccn12	ZINC000584396425	337317548	/nfs/dbraw/zinc/31/75/48/337317548.db2.gz	PLXRSWZQGMFBBJ-CQSZACIVSA-N	0	3	310.357	2.049	10	0		DEAEHN
CCCCCOC[C@H](O)CNCCOc1ccccc1OC	ZINC000584627855	337376211	/nfs/dbraw/zinc/37/62/11/337376211.db2.gz	LURGLDUMVOGMKH-OAHLLOKOSA-N	0	3	311.422	2.231	10	0		DEAEHN
CCC(CC)[C@@H](O)CNCc1ccc2c(c1)sc(=O)n2C	ZINC000192583827	341876282	/nfs/dbraw/zinc/87/62/82/341876282.db2.gz	WERAABXAONREQK-AWEZNQCLSA-N	0	3	308.447	2.487	10	0		DEAEHN
C[C@@H]1CCC[C@@H](NC(=O)NC[C@H](O)CN2CCCCC2)CC1	ZINC000190957342	533771139	/nfs/dbraw/zinc/77/11/39/533771139.db2.gz	ANJIPJOSQHDHJO-OAGGEKHMSA-N	0	3	311.470	2.101	10	0		DEAEHN
C[S@](=O)c1ccc(NC(=O)NCCN2CCCCC2)cc1	ZINC000175785819	518185638	/nfs/dbraw/zinc/18/56/38/518185638.db2.gz	XVXVONGQOITMAL-NRFANRHFSA-N	0	3	309.435	2.031	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@H]1CCCN1c1nccs1	ZINC000156685522	519775577	/nfs/dbraw/zinc/77/55/77/519775577.db2.gz	WGXHWOAFBQFIMN-UONOGXRCSA-N	0	3	324.494	2.204	10	0		DEAEHN
CCN(CC)c1ncc(CN2C[C@@H](C(N)=O)CC[C@H]2C)s1	ZINC000245542478	520931349	/nfs/dbraw/zinc/93/13/49/520931349.db2.gz	PVLHSIHOLNYJPV-NEPJUHHUSA-N	0	3	310.467	2.075	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@@H](c2cccc(OC)c2)C1)N(C)C	ZINC000158072084	520975485	/nfs/dbraw/zinc/97/54/85/520975485.db2.gz	UPXIEPRTLRXMOS-IAGOWNOFSA-N	0	3	320.433	2.325	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)NCCN1CCC[C@@H](C)C1	ZINC000162084873	521176168	/nfs/dbraw/zinc/17/61/68/521176168.db2.gz	DWNWQIVPVUATAJ-CQSZACIVSA-N	0	3	324.494	2.449	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H]2CCO[C@H]2c2ccccc2)C1	ZINC000245477809	521646118	/nfs/dbraw/zinc/64/61/18/521646118.db2.gz	URPSINBXLBNYPQ-BBWFWOEESA-N	0	3	317.433	2.300	10	0		DEAEHN
COc1cc(CN2CCC[C@H](Cn3cncn3)C2)cc(OC)c1	ZINC000128518166	522377840	/nfs/dbraw/zinc/37/78/40/522377840.db2.gz	YGRRBDACCGZDDE-AWEZNQCLSA-N	0	3	316.405	2.208	10	0		DEAEHN
COCc1csc(NC(=O)N2CCC(N3CC=CC3)CC2)n1	ZINC000156097174	523155903	/nfs/dbraw/zinc/15/59/03/523155903.db2.gz	XUSWSAZBYPEQMG-UHFFFAOYSA-N	0	3	322.434	2.158	10	0		DEAEHN
Cc1cc(C)nc(SCC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)n1	ZINC000127486775	524593792	/nfs/dbraw/zinc/59/37/92/524593792.db2.gz	KUPMYDKCWFFASV-KGLIPLIRSA-N	0	3	322.478	2.127	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1C	ZINC000247277195	534799316	/nfs/dbraw/zinc/79/93/16/534799316.db2.gz	FSNDEOQXYLAUMP-HZMBPMFUSA-N	0	3	305.422	2.389	10	0		DEAEHN
COc1ccc(OC)c(CC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000124169718	524812561	/nfs/dbraw/zinc/81/25/61/524812561.db2.gz	RJGPYWXXSBUABG-ZFWWWQNUSA-N	0	3	320.433	2.187	10	0		DEAEHN
C[C@@H]1CN([C@@H](CNCC2=CCCOC2)c2cccs2)CCO1	ZINC000127121428	525060055	/nfs/dbraw/zinc/06/00/55/525060055.db2.gz	JFYNOZHSMFBJKC-ZBFHGGJFSA-N	0	3	322.474	2.446	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(CCC(=O)NC(C)C)CC2	ZINC000374328676	534881724	/nfs/dbraw/zinc/88/17/24/534881724.db2.gz	JYRODHOXSVHSLW-UHFFFAOYSA-N	0	3	302.418	2.205	10	0		DEAEHN
O=C(C1CCCCC1)N1CC[C@@H](NCc2ccc(F)nc2)C1	ZINC000189146750	526300425	/nfs/dbraw/zinc/30/04/25/526300425.db2.gz	MWJQUSKPYVVQSF-OAHLLOKOSA-N	0	3	305.397	2.492	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)C[C@@H](O)c2ccccc2)C1	ZINC000246524960	536473342	/nfs/dbraw/zinc/47/33/42/536473342.db2.gz	UYMRFSFPIRDUNI-BRWVUGGUSA-N	0	3	302.418	2.053	10	0		DEAEHN
COCCOCCN1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1	ZINC000246420295	536499772	/nfs/dbraw/zinc/49/97/72/536499772.db2.gz	BZPONMPEZZTJDT-IAGOWNOFSA-N	0	3	311.397	2.377	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)C1	ZINC000194917122	529089450	/nfs/dbraw/zinc/08/94/50/529089450.db2.gz	LICJLUIAKMDEEZ-HRCADAONSA-N	0	3	305.397	2.465	10	0		DEAEHN
CCC[C@@H](C)NC(=O)[C@@H](C)N1CCC(c2n[nH]c(CC)n2)CC1	ZINC000190662717	535331062	/nfs/dbraw/zinc/33/10/62/535331062.db2.gz	PFJJJIRFRJEPHF-CHWSQXEVSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCC[C@@H](C)NC(=O)[C@@H](C)N1CCC(c2nc(CC)n[nH]2)CC1	ZINC000190662717	535331067	/nfs/dbraw/zinc/33/10/67/535331067.db2.gz	PFJJJIRFRJEPHF-CHWSQXEVSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCC[C@@H](C)NC(=O)[C@@H](C)N1CCC(c2nnc(CC)[nH]2)CC1	ZINC000190662717	535331069	/nfs/dbraw/zinc/33/10/69/535331069.db2.gz	PFJJJIRFRJEPHF-CHWSQXEVSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)N[C@@H](C)CN1CCC[C@@H](C)C1	ZINC000454651515	535881924	/nfs/dbraw/zinc/88/19/24/535881924.db2.gz	VKQKSPJHIIYJBS-OLZOCXBDSA-N	0	3	322.453	2.465	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)CCO1	ZINC000246914599	535947291	/nfs/dbraw/zinc/94/72/91/535947291.db2.gz	HONIGCODNCXWFP-OWCLPIDISA-N	0	3	322.836	2.233	10	0		DEAEHN
CC[C@H]1CN(CCOc2cc(C)ccc2C)CCN1C[C@H](C)O	ZINC000246991592	536151485	/nfs/dbraw/zinc/15/14/85/536151485.db2.gz	BANJITCMRSCZSM-ROUUACIJSA-N	0	3	320.477	2.459	10	0		DEAEHN
CO[C@H](C)c1nc(CN2CCNC[C@@H]2c2cccnc2)cs1	ZINC000261868313	536507624	/nfs/dbraw/zinc/50/76/24/536507624.db2.gz	XBDLHQMQAKXSRD-IUODEOHRSA-N	0	3	318.446	2.392	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1Cn1c2ccccc2oc1=O	ZINC000176072095	624612910	/nfs/dbraw/zinc/61/29/10/624612910.db2.gz	LYOSHAOGCVVJSR-AWEZNQCLSA-N	0	3	312.373	2.222	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@H]1CCCc2nc(C)ncc21	ZINC000734823798	633430032	/nfs/dbraw/zinc/43/00/32/633430032.db2.gz	DXKMBCFIZVINAR-JKSUJKDBSA-N	0	3	302.422	2.153	10	0		DEAEHN
CC(=O)CCN(C)[C@@H](C)c1cccc(N2CCCS2(=O)=O)c1	ZINC000186281948	634079903	/nfs/dbraw/zinc/07/99/03/634079903.db2.gz	LAQWUWGMXYCAPX-AWEZNQCLSA-N	0	3	324.446	2.198	10	0		DEAEHN
COc1cc(C[NH2+][C@@H](C)C(C)(C)O)cc(Br)c1[O-]	ZINC000393964182	635758999	/nfs/dbraw/zinc/75/89/99/635758999.db2.gz	KYIDNLPWZVCVAD-QMMMGPOBSA-N	0	3	318.211	2.412	10	0		DEAEHN
Fc1cc(Br)cc(OC[C@@H]2CNCCO2)c1F	ZINC000219987847	636843119	/nfs/dbraw/zinc/84/31/19/636843119.db2.gz	ZDYMXFHAWBGQLG-QMMMGPOBSA-N	0	3	308.122	2.095	10	0		DEAEHN
COC(=O)/C(C)=C\CN(C)[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000746500342	638349641	/nfs/dbraw/zinc/34/96/41/638349641.db2.gz	SCDDIOJXNLVEBG-XXYUJHKVSA-N	0	3	314.389	2.379	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NC[C@@H](O)c1ccc(CC)cc1	ZINC000804156947	645733541	/nfs/dbraw/zinc/73/35/41/645733541.db2.gz	XPSPLCUOCBNLAH-IAGOWNOFSA-N	0	3	304.434	2.273	10	0		DEAEHN
Cc1nc([C@H](C)NC[C@H]2CCCN2C(=O)OC(C)(C)C)n[nH]1	ZINC000392387788	685449734	/nfs/dbraw/zinc/44/97/34/685449734.db2.gz	YUUUYMGOLZKBPX-CMPLNLGQSA-N	0	3	309.414	2.163	10	0		DEAEHN
CN1CC[C@H](NC(=O)C[C@H]2CCCOC2)[C@@H]1c1ccccc1	ZINC000249093204	685174266	/nfs/dbraw/zinc/17/42/66/685174266.db2.gz	LAJXNPDEQRCPGU-HFTRVMKXSA-N	0	3	302.418	2.365	10	0		DEAEHN
CN1C[C@@H](CNCc2cscc2Br)CC1=O	ZINC000723563172	777124963	/nfs/dbraw/zinc/12/49/63/777124963.db2.gz	QLUHJPZSODDZDZ-MRVPVSSYSA-N	0	3	303.225	2.079	10	0		DEAEHN
Cc1cc(CNCC(C)(C)CS(C)(=O)=O)cc(Cl)n1	ZINC000723881791	777200824	/nfs/dbraw/zinc/20/08/24/777200824.db2.gz	FNDAGVPOQVJDSK-UHFFFAOYSA-N	0	3	304.843	2.204	10	0		DEAEHN
C[C@H](O)[C@@H]1CCCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724061014	777233180	/nfs/dbraw/zinc/23/31/80/777233180.db2.gz	ICVYFHYHDVAJOS-IVZWLZJFSA-N	0	3	305.287	2.028	10	0		DEAEHN
CCn1cncc1CN[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000721847151	780294399	/nfs/dbraw/zinc/29/43/99/780294399.db2.gz	KIRQWGXTSCNNNY-TZMCWYRMSA-N	0	3	308.426	2.248	10	0		DEAEHN
CO[C@@]1(CN[C@@H](C)c2cc(C)sc2C)CCS(=O)(=O)C1	ZINC000721258031	781016517	/nfs/dbraw/zinc/01/65/17/781016517.db2.gz	GGGSCMBVTQUCQV-SMDDNHRTSA-N	0	3	317.476	2.219	10	0		DEAEHN
Cc1nn(C)cc1CN[C@@H]1CN(C(=O)OC(C)(C)C)CC1(C)C	ZINC000721905674	781600147	/nfs/dbraw/zinc/60/01/47/781600147.db2.gz	SGUPFQZJMXVDKG-CQSZACIVSA-N	0	3	322.453	2.464	10	0		DEAEHN
C[C@@H](C(=O)NC12CC3CC(CC(C3)C1)C2)N(C)CC1CC(O)C1	ZINC000190112613	786065359	/nfs/dbraw/zinc/06/53/59/786065359.db2.gz	JNVNAFVULJQPMK-CLAPNMPZSA-N	0	3	320.477	2.163	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCNCCC23CCC3)c(C)s1	ZINC000713209560	792216464	/nfs/dbraw/zinc/21/64/64/792216464.db2.gz	CTMXJEOUMCOIIS-UHFFFAOYSA-N	0	3	314.476	2.272	10	0		DEAEHN
CS(=O)(=O)[C@H]1C[C@H](NCc2cccc(C(F)(F)F)c2)C1	ZINC000714253115	792306707	/nfs/dbraw/zinc/30/67/07/792306707.db2.gz	UJDPAILPDGCVKD-HAQNSBGRSA-N	0	3	307.337	2.371	10	0		DEAEHN
CC(C)CC[C@H](N)C(=O)NCc1ncc(Br)s1	ZINC000714944579	792361195	/nfs/dbraw/zinc/36/11/95/792361195.db2.gz	RVBYLGRSINSHHG-QMMMGPOBSA-N	0	3	320.256	2.285	10	0		DEAEHN
Cc1ccc([O-])c(C[NH2+]C[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2)n1	ZINC000715103478	792383048	/nfs/dbraw/zinc/38/30/48/792383048.db2.gz	LQJQBNLJXLIIIM-JOCQHMNTSA-N	0	3	321.421	2.489	10	0		DEAEHN
C[C@@H]([N-]S(=O)(=O)c1cc(F)ccc1Cl)C1CC[NH2+]CC1	ZINC000716564622	792974811	/nfs/dbraw/zinc/97/48/11/792974811.db2.gz	HNNUXFOTXHSXPS-SECBINFHSA-N	0	3	320.817	2.146	10	0		DEAEHN
Cn1cc(Br)c(CN[C@H]2CCCc3[nH]ncc32)n1	ZINC000401954734	801858942	/nfs/dbraw/zinc/85/89/42/801858942.db2.gz	SOGBRNXHNSDNIL-JTQLQIEISA-N	0	3	310.199	2.073	10	0		DEAEHN
C=CCOc1ccc(CN[C@@H]2CCCCNC2=O)cc1OC	ZINC000054174237	1078604793	/nfs/dbraw/zinc/60/47/93/1078604793.db2.gz	FPBNLWMLYTXVPM-CQSZACIVSA-N	0	3	304.390	2.018	10	0		DEAEHN
Cc1nn(C)c(CN[C@H]2CCCN3CCSC[C@@H]23)c1Cl	ZINC000720510350	1085266920	/nfs/dbraw/zinc/26/69/20/1085266920.db2.gz	KGLZVZNSZIWCMA-AAEUAGOBSA-N	0	3	314.886	2.051	10	0		DEAEHN
C=Cn1cc(CNCC23CC(C2)CN3C(=O)OC(C)(C)C)cn1	ZINC000701865193	1086388226	/nfs/dbraw/zinc/38/82/26/1086388226.db2.gz	QMLJMHMXHNKZAN-UHFFFAOYSA-N	0	3	318.421	2.473	10	0		DEAEHN
COC[C@@H](C)OC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000704448185	1086580339	/nfs/dbraw/zinc/58/03/39/1086580339.db2.gz	BVYKLBDYINBCJF-GDBMZVCRSA-N	0	3	306.406	2.412	10	0		DEAEHN
COC[C@H](C)OC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1	ZINC000704424500	1086580854	/nfs/dbraw/zinc/58/08/54/1086580854.db2.gz	LXSKSDKQEQSBCM-IJEWVQPXSA-N	0	3	306.406	2.411	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@@]2(NCc3c[nH]cn3)CCC[C@H]12	ZINC000711623327	1087177378	/nfs/dbraw/zinc/17/73/78/1087177378.db2.gz	LFPQGIXHSPHABV-BBRMVZONSA-N	0	3	306.410	2.431	10	0		DEAEHN
CCn1cc(Br)cc1C(=O)N[C@H]1CCN(C)[C@H]1C	ZINC000719383953	1089076930	/nfs/dbraw/zinc/07/69/30/1089076930.db2.gz	AMSBSUANHLGKIO-ONGXEEELSA-N	0	3	314.227	2.093	10	0		DEAEHN
COC[C@H](CO)NCc1ccc(C)c(Br)c1C	ZINC000719541224	1089288582	/nfs/dbraw/zinc/28/85/82/1089288582.db2.gz	XKNRBNFYBDVDJH-LBPRGKRZSA-N	0	3	302.212	2.163	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1ccc(C(=O)N(C)C)cc1	ZINC000076856329	185047234	/nfs/dbraw/zinc/04/72/34/185047234.db2.gz	FDZMYKSGOQJCDK-MRXNPFEDSA-N	0	3	319.449	2.095	10	0		DEAEHN
CN[C@@H]1c2ccc(OC)cc2CC[C@H]1Sc1nncn1C	ZINC000081867078	192332698	/nfs/dbraw/zinc/33/26/98/192332698.db2.gz	LGPYSURRWQUSSQ-ZIAGYGMSSA-N	0	3	304.419	2.191	10	0		DEAEHN
Cc1nccn1CCN1CCN(Cc2ccccc2F)CC1	ZINC000077121686	185110368	/nfs/dbraw/zinc/11/03/68/185110368.db2.gz	GTEYWRJBSOAQNT-UHFFFAOYSA-N	0	3	302.397	2.148	10	0		DEAEHN
CCN[C@H]1CCOC[C@H]1S(=O)(=O)c1ccc(F)c(Cl)c1	ZINC000081946437	192345679	/nfs/dbraw/zinc/34/56/79/192345679.db2.gz	YIJANIVFGXWEOL-QWHCGFSZSA-N	0	3	321.801	2.020	10	0		DEAEHN
CCc1noc(CC)c1CC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000153038945	282160354	/nfs/dbraw/zinc/16/03/54/282160354.db2.gz	WMHMQVWEUIKXJE-CHWSQXEVSA-N	0	3	307.438	2.283	10	0		DEAEHN
C[C@H](CNC[C@H](O)c1cc(Cl)ccc1Cl)[S@](C)=O	ZINC000165235186	197673066	/nfs/dbraw/zinc/67/30/66/197673066.db2.gz	JLHQNHCDSTWILU-XFGRJSRNSA-N	0	3	310.246	2.383	10	0		DEAEHN
CCn1cc([C@@H]2NC(=O)CC[C@H]2NCc2cccn2C)cn1	ZINC000328651124	231286733	/nfs/dbraw/zinc/28/67/33/231286733.db2.gz	VWBPXTCDFADNIG-ZBFHGGJFSA-N	0	3	301.394	2.191	10	0		DEAEHN
COC(=O)CCCN1CC[C@H](c2cc(OC)cc(OC)c2)C1	ZINC000083402870	185222008	/nfs/dbraw/zinc/22/20/08/185222008.db2.gz	AEZPVVBQFXTHAV-ZDUSSCGKSA-N	0	3	307.390	2.446	10	0		DEAEHN
O=C(C[C@H]1CCCCC(=O)N1)N1CC[C@H](N2CCCCC2)C1	ZINC000328681153	231305228	/nfs/dbraw/zinc/30/52/28/231305228.db2.gz	UYIDTHSYOOMTHX-CABCVRRESA-N	0	3	307.438	2.362	10	0		DEAEHN
CC(C)[C@H](C[NH3+])[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000087404596	185223720	/nfs/dbraw/zinc/22/37/20/185223720.db2.gz	LGKFKJCJRRUXTD-NSHDSACASA-N	0	3	311.234	2.255	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1ccc2nc(N)sc2c1	ZINC000087847660	185233355	/nfs/dbraw/zinc/23/33/55/185233355.db2.gz	QNVFJSNJZIREQE-LLVKDONJSA-N	0	3	304.419	2.045	10	0		DEAEHN
C[C@@H](CN1CCCC1)NC(=O)c1ccc2nc(N)sc2c1	ZINC000087847491	185233478	/nfs/dbraw/zinc/23/34/78/185233478.db2.gz	PZNFJNCJTMKCHW-JTQLQIEISA-N	0	3	304.419	2.093	10	0		DEAEHN
CCC(CC)c1cc(CNC(=O)NC[C@@H]2CCCN2C)on1	ZINC000174354757	282193531	/nfs/dbraw/zinc/19/35/31/282193531.db2.gz	MKZHYQWOJCDISX-ZDUSSCGKSA-N	0	3	308.426	2.472	10	0		DEAEHN
C[C@H](CN)S(=O)(=O)NC(c1ccccc1)c1ccccc1	ZINC000088472429	185252158	/nfs/dbraw/zinc/25/21/58/185252158.db2.gz	HEQGFRLPRZRJQZ-CYBMUJFWSA-N	0	3	304.415	2.043	10	0		DEAEHN
CC[C@H](C[NH3+])S(=O)(=O)[N-]c1cc(C(F)(F)F)ccc1F	ZINC000088474009	185252399	/nfs/dbraw/zinc/25/23/99/185252399.db2.gz	XIHWXOFIOOYNED-MRVPVSSYSA-N	0	3	314.304	2.324	10	0		DEAEHN
CCN[C@@](CO)(CN(C)CCC(F)(F)F)c1ccccc1	ZINC000088439527	185250769	/nfs/dbraw/zinc/25/07/69/185250769.db2.gz	VIBAWSFVNIEDJP-CQSZACIVSA-N	0	3	304.356	2.368	10	0		DEAEHN
CSC[C@H](C)CNS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000088551153	185257503	/nfs/dbraw/zinc/25/75/03/185257503.db2.gz	NJASQZFPCJTXFU-LLVKDONJSA-N	0	3	320.480	2.055	10	0		DEAEHN
CSC[C@H](C)C[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000088551153	185257504	/nfs/dbraw/zinc/25/75/04/185257504.db2.gz	NJASQZFPCJTXFU-LLVKDONJSA-N	0	3	320.480	2.055	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2sc3ccc(F)cc3c2N)C1	ZINC000088643365	185261233	/nfs/dbraw/zinc/26/12/33/185261233.db2.gz	IEIWVRKVLOVGMI-JTQLQIEISA-N	0	3	307.394	2.399	10	0		DEAEHN
CCC[C@H](C(=O)NCC[C@H](C)NC(=O)OC(C)(C)C)N(C)C	ZINC000179148314	282216183	/nfs/dbraw/zinc/21/61/83/282216183.db2.gz	WSPRYLBDFAPRLW-QWHCGFSZSA-N	0	3	315.458	2.136	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)/C=C/c1ccc(Cl)cc1	ZINC000090293262	185289797	/nfs/dbraw/zinc/28/97/97/185289797.db2.gz	YQUNFTODOQDOSU-VQHVLOKHSA-N	0	3	314.838	2.324	10	0		DEAEHN
N[C@@H]1COC[C@H]1c1nc(Cc2ccc(Cl)c(Cl)c2)no1	ZINC000090364623	185292748	/nfs/dbraw/zinc/29/27/48/185292748.db2.gz	OXVMHKTZXOFAGF-LDYMZIIASA-N	0	3	314.172	2.408	10	0		DEAEHN
C[C@H](NC(=O)[C@H]1COC[C@@H]1N)c1ccc(Cl)cc1Cl	ZINC000090379050	185293497	/nfs/dbraw/zinc/29/34/97/185293497.db2.gz	WEQLBFFFCJLTBF-JWYUURKGSA-N	0	3	303.189	2.144	10	0		DEAEHN
N[C@@H]1COC[C@@H]1C(=O)Nc1ccc(Br)cc1Cl	ZINC000090379215	185293569	/nfs/dbraw/zinc/29/35/69/185293569.db2.gz	IKFPSKSMKGYSNV-IONNQARKSA-N	0	3	319.586	2.015	10	0		DEAEHN
N[C@@H]1COC[C@@H]1C(=O)Nc1ccc(SC(F)(F)F)cc1	ZINC000090380643	185293740	/nfs/dbraw/zinc/29/37/40/185293740.db2.gz	DRWJISGHBCHLDN-VHSXEESVSA-N	0	3	306.309	2.211	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1ccc(OC(C)C)c(Cl)c1	ZINC000090433703	185296274	/nfs/dbraw/zinc/29/62/74/185296274.db2.gz	XIMDZKXHXLGCAQ-WCQYABFASA-N	0	3	312.797	2.300	10	0		DEAEHN
C[C@@]1(C(=O)Nc2cc(C(F)(F)F)ccc2F)COC[C@@H]1N	ZINC000090603846	185306140	/nfs/dbraw/zinc/30/61/40/185306140.db2.gz	CCIWZXJILSMFFM-CMPLNLGQSA-N	0	3	306.259	2.147	10	0		DEAEHN
C[C@@]1(c2nc(-c3cccc(Br)c3)no2)COC[C@H]1N	ZINC000090573278	185304329	/nfs/dbraw/zinc/30/43/29/185304329.db2.gz	ASBOYPHYQXASTQ-ZWNOBZJWSA-N	0	3	324.178	2.114	10	0		DEAEHN
CN(C)C[C@H]1CSCCCN1C(=O)c1ccc(N(C)C)cc1	ZINC000090700133	185310505	/nfs/dbraw/zinc/31/05/05/185310505.db2.gz	KOBGYZMZUNODIG-INIZCTEOSA-N	0	3	321.490	2.262	10	0		DEAEHN
CN(C)C[C@H]1CSCCCN1C(=O)NCc1cccs1	ZINC000090700239	185310522	/nfs/dbraw/zinc/31/05/22/185310522.db2.gz	WYJCUFJUIOMLPJ-LBPRGKRZSA-N	0	3	313.492	2.327	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N)[C@@H](Sc1nnc(C)n1C)CC2	ZINC000092389959	185315529	/nfs/dbraw/zinc/31/55/29/185315529.db2.gz	MNMVNYMVEUWXGV-KBPBESRZSA-N	0	3	304.419	2.239	10	0		DEAEHN
Cc1ccc(F)c(CN2CCC[C@H](C(=O)N3CCOCC3)C2)c1	ZINC000179890532	282233746	/nfs/dbraw/zinc/23/37/46/282233746.db2.gz	XNSKURQADJKCIX-HNNXBMFYSA-N	0	3	320.408	2.205	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)Nc1nnc(C(F)F)s1	ZINC000092598960	185328536	/nfs/dbraw/zinc/32/85/36/185328536.db2.gz	INNBNZTXHOBOJN-HTQZYQBOSA-N	0	3	317.365	2.176	10	0		DEAEHN
CCN[C@@H](Cc1cncc(Br)c1)c1cnn(C)c1	ZINC000167748134	197713219	/nfs/dbraw/zinc/71/32/19/197713219.db2.gz	QOEIHIQPYIWMRL-ZDUSSCGKSA-N	0	3	309.211	2.471	10	0		DEAEHN
Cn1cc([C@H]2CCN(CCC(=O)OCc3ccccc3)C2)cn1	ZINC000181460472	199299630	/nfs/dbraw/zinc/29/96/30/199299630.db2.gz	HZIMCUFEYUCJFI-INIZCTEOSA-N	0	3	313.401	2.343	10	0		DEAEHN
O=C1CC[C@@H](CNCc2cc(Cl)ccc2OC(F)F)N1	ZINC000079927439	539376215	/nfs/dbraw/zinc/37/62/15/539376215.db2.gz	NXIHIGZWDGKLRZ-JTQLQIEISA-N	0	3	304.724	2.310	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@H]1Cc2cc(F)ccc2O1	ZINC000245433269	282387594	/nfs/dbraw/zinc/38/75/94/282387594.db2.gz	PPYAEDQETQAKKR-GDBMZVCRSA-N	0	3	306.381	2.072	10	0		DEAEHN
CN(Cc1ccc(F)cc1Br)C[C@@H]1CNCCO1	ZINC000126874135	539479529	/nfs/dbraw/zinc/47/95/29/539479529.db2.gz	QGLBKAUAAGTUKJ-LBPRGKRZSA-N	0	3	317.202	2.008	10	0		DEAEHN
CC(C)(C)c1ccc(CNCC(C)(C)NS(C)(=O)=O)s1	ZINC000127183218	539481009	/nfs/dbraw/zinc/48/10/09/539481009.db2.gz	JJTFSGSLQSFDBH-UHFFFAOYSA-N	0	3	318.508	2.463	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@@H](C)NCCN1CCO[C@@H](C)C1	ZINC000247075872	282476700	/nfs/dbraw/zinc/47/67/00/282476700.db2.gz	QMFLXJPXGXEYLN-UONOGXRCSA-N	0	3	308.470	2.318	10	0		DEAEHN
CC(=O)[C@H](C)CCCCC(=O)Nc1cnn(CCN(C)C)c1	ZINC000155079989	539556623	/nfs/dbraw/zinc/55/66/23/539556623.db2.gz	DBMITFBAFWUFMQ-CYBMUJFWSA-N	0	3	308.426	2.169	10	0		DEAEHN
N[C@@H]1CC(=O)N(C2CC2)[C@H]1c1ccc(Br)s1	ZINC000069798386	190818884	/nfs/dbraw/zinc/81/88/84/190818884.db2.gz	RHWWWRAGILJLKN-RDDDGLTNSA-N	0	3	301.209	2.274	10	0		DEAEHN
c1ccc(-n2nnnc2CCN2CC[C@H]3CC[C@@H](C2)S3)cc1	ZINC000625775873	365896901	/nfs/dbraw/zinc/89/69/01/365896901.db2.gz	WVNASHWNLGTYBY-CABCVRRESA-N	0	3	315.446	2.175	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)Nc2cnn(C(C)(C)C)c2)[C@@H](C)C1	ZINC000180955952	539648356	/nfs/dbraw/zinc/64/83/56/539648356.db2.gz	QTMKZHRKHJWDNW-JSGCOSHPSA-N	0	3	307.442	2.488	10	0		DEAEHN
OCC[C@]1(CN[C@@H]2CCCOc3cc(F)ccc32)CCOC1	ZINC000182122685	539654976	/nfs/dbraw/zinc/65/49/76/539654976.db2.gz	KTSGUZIPCCLMJK-NVXWUHKLSA-N	0	3	309.381	2.418	10	0		DEAEHN
C[C@H](CCN(C)C)NCc1c(Cl)cccc1S(C)(=O)=O	ZINC000129952074	185924176	/nfs/dbraw/zinc/92/41/76/185924176.db2.gz	IOLGJSDVTZPKSL-LLVKDONJSA-N	0	3	318.870	2.173	10	0		DEAEHN
Nc1cnc2ccc(Br)cc2c1NCc1nnc[nH]1	ZINC000080570020	192168775	/nfs/dbraw/zinc/16/87/75/192168775.db2.gz	NETXOVGWMNMQRR-UHFFFAOYSA-N	0	3	319.166	2.310	10	0		DEAEHN
CCCCNC(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190676779	539696266	/nfs/dbraw/zinc/69/62/66/539696266.db2.gz	UUJKIUMETXYYCB-INIZCTEOSA-N	0	3	304.438	2.345	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)c2ccn(C)c2C)o1	ZINC000195149937	539720556	/nfs/dbraw/zinc/72/05/56/539720556.db2.gz	VRVNXHIKNAGCTP-UHFFFAOYSA-N	0	3	303.406	2.439	10	0		DEAEHN
Cc1cccc(N2CCN(C(=O)c3ccccc3CN)CC2)c1	ZINC000071700027	191009917	/nfs/dbraw/zinc/00/99/17/191009917.db2.gz	APRZIMFTGVGLDP-UHFFFAOYSA-N	0	3	309.413	2.416	10	0		DEAEHN
Nc1ncccc1C(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000071700403	191010279	/nfs/dbraw/zinc/01/02/79/191010279.db2.gz	CTAMYFILQQMWLP-MRXNPFEDSA-N	0	3	310.401	2.231	10	0		DEAEHN
CCC[C@H]1CCN(S(=O)(=O)c2cc(CN)cc(F)c2F)C1	ZINC000139296568	186021594	/nfs/dbraw/zinc/02/15/94/186021594.db2.gz	JJGIXHCYHVIXRJ-JTQLQIEISA-N	0	3	318.389	2.234	10	0		DEAEHN
CC(C)[C@@H]1N[C@H](c2cccs2)N(C2CCN(C)CC2)C1=O	ZINC000141216603	186029058	/nfs/dbraw/zinc/02/90/58/186029058.db2.gz	MVJSHPJQUVDKGF-GJZGRUSLSA-N	0	3	307.463	2.297	10	0		DEAEHN
CCN[C@@H](c1cncs1)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000147685031	186041183	/nfs/dbraw/zinc/04/11/83/186041183.db2.gz	FUTORUNVHWNQSQ-GMXVVIOVSA-N	0	3	302.465	2.397	10	0		DEAEHN
COc1ccc(C)cc1NC(=O)[C@H](C)N[C@H](C)[C@H]1CCCO1	ZINC000248574104	539774583	/nfs/dbraw/zinc/77/45/83/539774583.db2.gz	GUTMNIMSNXDERB-VNHYZAJKSA-N	0	3	306.406	2.488	10	0		DEAEHN
CCc1cc(Br)ccc1NC[C@@H](O)CN(C)C	ZINC000148293203	186043868	/nfs/dbraw/zinc/04/38/68/186043868.db2.gz	JQUXWDDUUVMXHP-GFCCVEGCSA-N	0	3	301.228	2.346	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)N1CCC[C@H]2CCCC[C@H]21	ZINC000145767948	186038053	/nfs/dbraw/zinc/03/80/53/186038053.db2.gz	BWFHYGSOBUCUDR-SJLPKXTDSA-N	0	3	319.493	2.338	10	0		DEAEHN
NCc1cc(NS(=O)(=O)CCc2ccccc2)ccc1F	ZINC000149278351	186049331	/nfs/dbraw/zinc/04/93/31/186049331.db2.gz	FEAAULJIIAEQCN-UHFFFAOYSA-N	0	3	308.378	2.269	10	0		DEAEHN
CC[C@H](NC)c1cccc(S(=O)(=O)NN2CCCCC2)c1	ZINC000148540487	186045259	/nfs/dbraw/zinc/04/52/59/186045259.db2.gz	SSZVQHIFTFOFQZ-HNNXBMFYSA-N	0	3	311.451	2.036	10	0		DEAEHN
CCCN[C@H]1CCCc2sc([C@H]3CCS(=O)(=O)C3)nc21	ZINC000150265907	186056221	/nfs/dbraw/zinc/05/62/21/186056221.db2.gz	XHTCTECJDOLXBK-QWRGUYRKSA-N	0	3	314.476	2.422	10	0		DEAEHN
CCOC(=O)c1cccc(NC(=O)C2(N)Cc3ccccc3C2)c1	ZINC000150760743	186065000	/nfs/dbraw/zinc/06/50/00/186065000.db2.gz	JHLUNPWHKGWPRL-UHFFFAOYSA-N	0	3	324.380	2.298	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)NC2CC(C)C2)c(C)s1	ZINC000164014890	186145991	/nfs/dbraw/zinc/14/59/91/186145991.db2.gz	IEVABNKPWHKLQU-UHFFFAOYSA-N	0	3	302.465	2.243	10	0		DEAEHN
Cn1ncc(Br)c1C(=O)C[C@H](N)c1ccccc1	ZINC000164114441	186149462	/nfs/dbraw/zinc/14/94/62/186149462.db2.gz	BFAZTPVURNEVEE-NSHDSACASA-N	0	3	308.179	2.455	10	0		DEAEHN
COc1cc(CNC2(CO)CC2)cc(Br)c1OC	ZINC000159549912	186126213	/nfs/dbraw/zinc/12/62/13/186126213.db2.gz	SHYMVPVSNCTAOC-UHFFFAOYSA-N	0	3	316.195	2.081	10	0		DEAEHN
Cc1nn(-c2ccccc2)c(C)c1CNC[C@@H](C)[S@@](C)=O	ZINC000159647549	186132818	/nfs/dbraw/zinc/13/28/18/186132818.db2.gz	ZPAQLNIESKNYDZ-GTJPDFRWSA-N	0	3	305.447	2.346	10	0		DEAEHN
CSc1cc2c(cc1CNC[C@H](C)[S@](C)=O)OCCO2	ZINC000159651156	186132962	/nfs/dbraw/zinc/13/29/62/186132962.db2.gz	QNRHMCURVQSFLG-WVDJIFEKSA-N	0	3	315.460	2.036	10	0		DEAEHN
CCOC(=O)NCCNCc1ccc(Br)s1	ZINC000163929191	186143054	/nfs/dbraw/zinc/14/30/54/186143054.db2.gz	IXQZJCQLPPZSHE-UHFFFAOYSA-N	0	3	307.213	2.346	10	0		DEAEHN
CC[C@@H](CNC(=O)N1CC[C@@H](N(C)C)C1)Oc1cccc(F)c1	ZINC000175641586	186184320	/nfs/dbraw/zinc/18/43/20/186184320.db2.gz	NAZBFIWMFWWBHT-CABCVRRESA-N	0	3	323.412	2.329	10	0		DEAEHN
COc1ccc(CN2CCC(C(=O)N(C)C)CC2)cc1OC	ZINC000179686010	186205395	/nfs/dbraw/zinc/20/53/95/186205395.db2.gz	KWBYGSUDPUUOEO-UHFFFAOYSA-N	0	3	306.406	2.004	10	0		DEAEHN
OC[C@@H](NCCCn1ccnc1)c1cccc(Br)c1	ZINC000183898368	186229097	/nfs/dbraw/zinc/22/90/97/186229097.db2.gz	LNETXNBNMULSFY-CQSZACIVSA-N	0	3	324.222	2.359	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)CN(C)[C@]1(CO)CC[C@H](C)C1	ZINC000187987322	186240088	/nfs/dbraw/zinc/24/00/88/186240088.db2.gz	OTZWXAGASLCMRX-HNAYVOBHSA-N	0	3	318.461	2.436	10	0		DEAEHN
C[C@H](NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)[C@@H]1CCCO1	ZINC000179101206	299175607	/nfs/dbraw/zinc/17/56/07/299175607.db2.gz	QJLDXNWFMCGZPZ-PQEBFOHHSA-N	0	3	317.433	2.299	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)[C@H]1Cc2ccccc2O1)c1ccccc1	ZINC000171888326	198002460	/nfs/dbraw/zinc/00/24/60/198002460.db2.gz	RXYJCCOGCNKCQN-SJLPKXTDSA-N	0	3	310.397	2.409	10	0		DEAEHN
COc1ccc([C@@H](C)NC(=O)N2CCN3CCC[C@@H]3C2)cc1F	ZINC000171899048	198003702	/nfs/dbraw/zinc/00/37/02/198003702.db2.gz	HSCLJJJCEPYQBM-TZMCWYRMSA-N	0	3	321.396	2.385	10	0		DEAEHN
CN1CC[C@@H](N[C@H]2CCc3c2cccc3Br)C1=O	ZINC000172087580	198037881	/nfs/dbraw/zinc/03/78/81/198037881.db2.gz	BJJPUHXRDYITGS-QWHCGFSZSA-N	0	3	309.207	2.257	10	0		DEAEHN
CCn1nc(C)c(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1Cl	ZINC000173216817	198197338	/nfs/dbraw/zinc/19/73/38/198197338.db2.gz	CESPHMKLKXSGNY-PWSUYJOCSA-N	0	3	312.845	2.420	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2nc3c(s2)COCC3)CCN1C	ZINC000173241796	198199742	/nfs/dbraw/zinc/19/97/42/198199742.db2.gz	AIFWJLKJJIQWKO-MNOVXSKESA-N	0	3	324.450	2.162	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)c2cccs2)[C@H](C)C1	ZINC000173256399	198202809	/nfs/dbraw/zinc/20/28/09/198202809.db2.gz	JDDLEHWVQYDUIR-NEPJUHHUSA-N	0	3	302.465	2.099	10	0		DEAEHN
C[C@@H](C(=O)N1CCO[C@H](c2nccs2)C1)N1CCCCCC1	ZINC000173271702	198204505	/nfs/dbraw/zinc/20/45/05/198204505.db2.gz	VWIUVSLIZUPZPT-KBPBESRZSA-N	0	3	323.462	2.308	10	0		DEAEHN
C[C@H]1C[C@H](N(C)S(=O)(=O)Cc2ccc(F)cc2)CCN1C	ZINC000173269705	198204897	/nfs/dbraw/zinc/20/48/97/198204897.db2.gz	ARYZUZAKNGLRSD-SWLSCSKDSA-N	0	3	314.426	2.070	10	0		DEAEHN
O=C(NCCc1ccccc1F)N1CC[C@@H](N2CC=CC2)C1	ZINC000173441123	198215369	/nfs/dbraw/zinc/21/53/69/198215369.db2.gz	URGBTOGDTIZQKH-OAHLLOKOSA-N	0	3	303.381	2.024	10	0		DEAEHN
O=C(NCCc1cccc(F)c1)N1CC[C@H](N2CC=CC2)C1	ZINC000173541208	198225129	/nfs/dbraw/zinc/22/51/29/198225129.db2.gz	UHRHCSQNIILSOK-INIZCTEOSA-N	0	3	303.381	2.024	10	0		DEAEHN
CC(=O)O[C@@H]1CC=C2CCN3Cc4cc5c(cc4[C@H]1[C@@H]23)OCO5	ZINC000004097634	181072600	/nfs/dbraw/zinc/07/26/00/181072600.db2.gz	SEWQEQSXDGJDGG-ZTFGCOKTSA-N	0	3	313.353	2.349	10	0	biogenic,in-vitro	DEAEHN
CCCOc1ccc(C(=O)CCC(=O)N2CCC[C@H]2CN)cc1	ZINC000236786901	202007130	/nfs/dbraw/zinc/00/71/30/202007130.db2.gz	QWMMQTBMDCBKCU-HNNXBMFYSA-N	0	3	318.417	2.388	10	0		DEAEHN
CN(CC(=O)NC1CCN(C2CC2)CC1)Cc1ccccc1F	ZINC000042327618	354192975	/nfs/dbraw/zinc/19/29/75/354192975.db2.gz	CNAFCWDTVAPWRP-UHFFFAOYSA-N	0	3	319.424	2.001	10	0		DEAEHN
CCC(=O)OC[C@@H]1CN(Cc2ccccc2)C[C@@H]1OC(=O)CC	ZINC000048533462	354353657	/nfs/dbraw/zinc/35/36/57/354353657.db2.gz	IAILZLXBCDRKGE-HOTGVXAUSA-N	0	3	319.401	2.393	10	0		DEAEHN
CC(=O)c1c(F)cccc1NC1CCN(CCN(C)C)CC1	ZINC000075669317	355100980	/nfs/dbraw/zinc/10/09/80/355100980.db2.gz	XTFWKZVZIMSGMA-UHFFFAOYSA-N	0	3	307.413	2.466	10	0		DEAEHN
CNC(=O)c1c2ncccc2nc([C@@H](C)N)c1-c1ccccn1	ZINC000141589074	355891088	/nfs/dbraw/zinc/89/10/88/355891088.db2.gz	JAOBPUAAGFBZGR-SNVBAGLBSA-N	0	3	307.357	2.071	10	0		DEAEHN
C[C@@H](NC[C@H](C)CS(C)(=O)=O)c1ccc(-n2cccn2)cc1	ZINC000180843974	356063782	/nfs/dbraw/zinc/06/37/82/356063782.db2.gz	NQOCZQJEYULOFD-UONOGXRCSA-N	0	3	321.446	2.204	10	0		DEAEHN
C[C@H]1CC[C@@H](C(N)=O)CN1Cc1cnn(Cc2ccccc2)c1	ZINC000179420506	356025603	/nfs/dbraw/zinc/02/56/03/356025603.db2.gz	QCOLLIXYVFGQEK-WMLDXEAASA-N	0	3	312.417	2.017	10	0		DEAEHN
CN(C)C(=O)C1CCN(Cc2cn(C)nc2C(C)(C)C)CC1	ZINC000179590483	356027977	/nfs/dbraw/zinc/02/79/77/356027977.db2.gz	UVDYQEMYULCBKT-UHFFFAOYSA-N	0	3	306.454	2.018	10	0		DEAEHN
C[C@H](NC[C@H](O)COC(C)(C)C)c1ccc(-n2ccnn2)cc1	ZINC000182051034	356106489	/nfs/dbraw/zinc/10/64/89/356106489.db2.gz	KWNDHCFXFFSNQL-BBRMVZONSA-N	0	3	318.421	2.094	10	0		DEAEHN
CC[C@H](C)N1CCN(C[C@@H](C(N)=S)c2ccccc2)CC1	ZINC000080797692	192191657	/nfs/dbraw/zinc/19/16/57/192191657.db2.gz	FTZHULBHXQHDCN-GOEBONIOSA-N	0	3	305.491	2.472	10	0		DEAEHN
CC(C)CN1CCN(C[C@H](C(N)=S)c2ccccc2)CC1	ZINC000080797696	192191700	/nfs/dbraw/zinc/19/17/00/192191700.db2.gz	XGUIQMGPSNNLHL-INIZCTEOSA-N	0	3	305.491	2.330	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cccc3c2OCCO3)C1	ZINC000194354141	356237858	/nfs/dbraw/zinc/23/78/58/356237858.db2.gz	CUHHJFJGVGCHRF-LBPRGKRZSA-N	0	3	305.378	2.064	10	0		DEAEHN
Ic1cnc([C@@H]2NC[C@@H]2C2CC2)s1	ZINC000306898454	356406025	/nfs/dbraw/zinc/40/60/25/356406025.db2.gz	XHFWMAOOCMLTFN-HTRCEHHLSA-N	0	3	306.172	2.418	10	0		DEAEHN
C[C@H](c1nc(C2CC2)no1)N(C)C[C@H]1CCc2nccn2C1	ZINC000328655572	356466352	/nfs/dbraw/zinc/46/63/52/356466352.db2.gz	YMCDIKDSUWZHIH-VXGBXAGGSA-N	0	3	301.394	2.399	10	0		DEAEHN
CC[C@@H](C)[C@H](N)C(=O)Nc1nc2cc3c(cc2s1)OCCO3	ZINC000236996370	202115325	/nfs/dbraw/zinc/11/53/25/202115325.db2.gz	UTKJVBGQTNGOJC-OQPBUACISA-N	0	3	321.402	2.379	10	0		DEAEHN
NC[C@H]1c2ccccc2CCN1C(=O)COCc1ccccc1	ZINC000404411583	356733605	/nfs/dbraw/zinc/73/36/05/356733605.db2.gz	PALJGAHBGTVGGG-SFHVURJKSA-N	0	3	310.397	2.288	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)NCCN2CCCC[C@@H]2C)c1F	ZINC000180408454	199155571	/nfs/dbraw/zinc/15/55/71/199155571.db2.gz	YKQVPLIZBLFRSJ-ZDUSSCGKSA-N	0	3	321.396	2.063	10	0		DEAEHN
CCOc1ccc([C@H](C)NC[C@H]2CN(C)CCO2)cc1OCC	ZINC000180493813	199166431	/nfs/dbraw/zinc/16/64/31/199166431.db2.gz	RIFUFQQIICTPPL-HOCLYGCPSA-N	0	3	322.449	2.465	10	0		DEAEHN
C[C@H](N[C@H]1CCc2ncnn2C1)c1ccc2c(c1)OCCCO2	ZINC000180583326	199179829	/nfs/dbraw/zinc/17/98/29/199179829.db2.gz	QEQHXISWNVZERC-JSGCOSHPSA-N	0	3	314.389	2.105	10	0		DEAEHN
c1nc2n(n1)C[C@H](N[C@@H]1CSCCc3ccccc31)CC2	ZINC000180604524	199183545	/nfs/dbraw/zinc/18/35/45/199183545.db2.gz	FFODRLSVRDRCNM-UKRRQHHQSA-N	0	3	300.431	2.213	10	0		DEAEHN
C[C@H](NCC(=O)NC(C)(C)C)c1cccc(-n2ccnc2)c1	ZINC000180677256	199195063	/nfs/dbraw/zinc/19/50/63/199195063.db2.gz	UEUDPYUMFCXOLJ-ZDUSSCGKSA-N	0	3	300.406	2.438	10	0		DEAEHN
COc1ccc(C[C@@H](C)C(=O)N2CC[C@H](N(C)C)C2)cc1OC	ZINC000180703731	199198885	/nfs/dbraw/zinc/19/88/85/199198885.db2.gz	JTTGQGZAPDCNMF-HIFRSBDPSA-N	0	3	320.433	2.045	10	0		DEAEHN
CNCc1cccc(S(=O)(=O)N2Cc3ccccc3C2)c1	ZINC000089022932	192703935	/nfs/dbraw/zinc/70/39/35/192703935.db2.gz	SCQFBRNGNRKELY-UHFFFAOYSA-N	0	3	302.399	2.111	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)Nc1ccc2nccn2c1	ZINC000606581419	361022678	/nfs/dbraw/zinc/02/26/78/361022678.db2.gz	CFUSVGQFHQPPGX-CYBMUJFWSA-N	0	3	301.394	2.330	10	0		DEAEHN
CC(=O)Nc1cccc([C@@H](C)NC[C@H](O)COC(C)(C)C)c1	ZINC000193430522	201050287	/nfs/dbraw/zinc/05/02/87/201050287.db2.gz	SSBIEJXKKANGKA-WBMJQRKESA-N	0	3	308.422	2.472	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2ccc(C)cc2C)CC12COC2	ZINC000449357464	240396871	/nfs/dbraw/zinc/39/68/71/240396871.db2.gz	DKSKODXDUISFDS-INIZCTEOSA-N	0	3	303.402	2.315	10	0		DEAEHN
COc1cc(C[NH2+]C[C@H]2C[C@@H](O)C2)cc(Br)c1[O-]	ZINC000623751171	365161257	/nfs/dbraw/zinc/16/12/57/365161257.db2.gz	LNWKRSDXYILHMI-WAAGHKOSSA-N	0	3	316.195	2.024	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000091480041	193062140	/nfs/dbraw/zinc/06/21/40/193062140.db2.gz	JBXZCGVLMJQBPQ-CMPLNLGQSA-N	0	3	302.296	2.187	10	0		DEAEHN
C[C@@H]1CC[C@@H]([N-]S(=O)(=O)c2cc(Cl)cc(Cl)c2)C[NH2+]1	ZINC000624406899	365413608	/nfs/dbraw/zinc/41/36/08/365413608.db2.gz	OKDIPRYUFUMFBV-LDYMZIIASA-N	0	3	323.245	2.412	10	0		DEAEHN
CNC(=O)CCCN(C)C[C@H]1CC(c2ccc(Cl)cc2)=NO1	ZINC000091982482	193136359	/nfs/dbraw/zinc/13/63/59/193136359.db2.gz	KLDUAEKKIPJOPR-CQSZACIVSA-N	0	3	323.824	2.291	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2ccc(CNC3CC3)cc2)C[C@H]1C	ZINC000092091457	193155777	/nfs/dbraw/zinc/15/57/77/193155777.db2.gz	DRHNXUBHWAZTJK-BETUJISGSA-N	0	3	308.447	2.215	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)cn1C(C)C	ZINC000092113921	193161769	/nfs/dbraw/zinc/16/17/69/193161769.db2.gz	KWXAATXKECGGAJ-CHWSQXEVSA-N	0	3	313.467	2.065	10	0		DEAEHN
CC(C)NCc1ccc(S(=O)(=O)N2CCCCC2)c(F)c1	ZINC000092115538	193163604	/nfs/dbraw/zinc/16/36/04/193163604.db2.gz	ZPYCFWQRLMPUPE-UHFFFAOYSA-N	0	3	314.426	2.498	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCC(C)(C)CC2)c(F)c1	ZINC000092116128	193164170	/nfs/dbraw/zinc/16/41/70/193164170.db2.gz	RGQSFINHUQZARA-UHFFFAOYSA-N	0	3	314.426	2.356	10	0		DEAEHN
c1cc(CNCCCOC[C@@H]2CCOC2)n(CC2CCC2)n1	ZINC000631078612	368005810	/nfs/dbraw/zinc/00/58/10/368005810.db2.gz	VLUBBADZTYFDTJ-INIZCTEOSA-N	0	3	307.438	2.216	10	0		DEAEHN
c1nc2nc(-c3ccccc3)cc(N3CC(N4CCCC4)C3)n2n1	ZINC000631353169	368170671	/nfs/dbraw/zinc/17/06/71/368170671.db2.gz	JQTSAZWRNQNEGZ-UHFFFAOYSA-N	0	3	320.400	2.076	10	0		DEAEHN
c1nn(-c2ccccc2)c2ncnc(N3CC(N4CCCC4)C3)c12	ZINC000631353181	368170797	/nfs/dbraw/zinc/17/07/97/368170797.db2.gz	KCDCPKRCQOKRRN-UHFFFAOYSA-N	0	3	320.400	2.100	10	0		DEAEHN
CO[C@]1(C)C[C@@H](NCC(=O)Nc2ccc3c(c2)OCO3)C1(C)C	ZINC000451488786	243025101	/nfs/dbraw/zinc/02/51/01/243025101.db2.gz	NAUXMJBDRYHZPB-RHSMWYFYSA-N	0	3	320.389	2.147	10	0		DEAEHN
CC(C)(C(N)=S)N1CCN(CCSc2ccccc2)CC1	ZINC000092261142	193181886	/nfs/dbraw/zinc/18/18/86/193181886.db2.gz	PFMKGTUORUCYGV-UHFFFAOYSA-N	0	3	323.531	2.461	10	0		DEAEHN
c1ccc(-n2nnnc2CCN2CCSC[C@@H]2C2CC2)cc1	ZINC000451645297	243257488	/nfs/dbraw/zinc/25/74/88/243257488.db2.gz	CJVHHITYGLRPTQ-OAHLLOKOSA-N	0	3	315.446	2.032	10	0		DEAEHN
CCN(CC(C)(C)O)[C@@H](C)C(=O)Nc1cc(Cl)ccc1N	ZINC000092964988	193189701	/nfs/dbraw/zinc/18/97/01/193189701.db2.gz	BHRKEKWZTXRMOA-JTQLQIEISA-N	0	3	313.829	2.342	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)Nc1ncnc2c1ncn2C	ZINC000678832261	541772465	/nfs/dbraw/zinc/77/24/65/541772465.db2.gz	DSPDAXPESTZCME-ZDUSSCGKSA-N	0	3	310.405	2.296	10	0		DEAEHN
O=C(Nc1ccc(OCC2CCCCC2)cc1)[C@@H]1C[C@@H](O)CN1	ZINC000262526592	203320357	/nfs/dbraw/zinc/32/03/57/203320357.db2.gz	OTWZMXAUQMVZPF-WBVHZDCISA-N	0	3	318.417	2.307	10	0		DEAEHN
CC[C@@H](C)CN(CC)S(=O)(=O)c1ccc(F)c(CN)c1	ZINC000093252450	193220520	/nfs/dbraw/zinc/22/05/20/193220520.db2.gz	YBWPVCVFSVOYRG-LLVKDONJSA-N	0	3	302.415	2.341	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N(CC)C[C@H](C)CC)c[nH]1	ZINC000093265793	193222647	/nfs/dbraw/zinc/22/26/47/193222647.db2.gz	HGRHJELFEOPGMB-GFCCVEGCSA-N	0	3	301.456	2.181	10	0		DEAEHN
CCOC(OCC)[C@@H](Cc1c(Cl)c(C)nn1CC)NC	ZINC000093306918	193227749	/nfs/dbraw/zinc/22/77/49/193227749.db2.gz	IIDXPSKLKNKRCM-LLVKDONJSA-N	0	3	303.834	2.394	10	0		DEAEHN
[NH3+][C@]1(C(=O)[O-])CCC[C@H]1CCN1CCC[C@H](C(F)(F)F)C1	ZINC000093596130	193270580	/nfs/dbraw/zinc/27/05/80/193270580.db2.gz	YPEPREGFJDGMIH-GMXVVIOVSA-N	0	3	308.344	2.233	10	0		DEAEHN
[NH3+][C@]1(C(=O)[O-])CCC[C@@H]1CCN1CCC[C@H](C(F)(F)F)C1	ZINC000093596128	193270856	/nfs/dbraw/zinc/27/08/56/193270856.db2.gz	YPEPREGFJDGMIH-NTZNESFSSA-N	0	3	308.344	2.233	10	0		DEAEHN
CCOC(=O)[C@@]1(NC)CCC[C@@H](N(C)CCC(F)(F)F)C1	ZINC000093756581	193302140	/nfs/dbraw/zinc/30/21/40/193302140.db2.gz	RCSDVJSNLJLJBI-DGCLKSJQSA-N	0	3	310.360	2.335	10	0		DEAEHN
CN[C@@]1(C(N)=O)CC[C@@H](Sc2ccc(C(F)(F)F)cn2)C1	ZINC000093850376	193317446	/nfs/dbraw/zinc/31/74/46/193317446.db2.gz	LTPDUIHTWUPMQZ-SKDRFNHKSA-N	0	3	319.352	2.189	10	0		DEAEHN
CN[C@@H](c1ccc(Cl)c(Cl)c1)[C@@H]1CN(C)CCN1C	ZINC000093894635	193324638	/nfs/dbraw/zinc/32/46/38/193324638.db2.gz	ZSMHPYVTHVDKNE-KBPBESRZSA-N	0	3	302.249	2.500	10	0		DEAEHN
CCC(N)(CC)C(=O)Nc1ccc(OCC(F)(F)F)nc1	ZINC000094243849	193354288	/nfs/dbraw/zinc/35/42/88/193354288.db2.gz	HWZUAWGGEMIBAB-UHFFFAOYSA-N	0	3	305.300	2.479	10	0		DEAEHN
N[C@@H]1COC[C@H]1C(=O)Nc1ccc(Cl)c(Br)c1	ZINC000094670424	193390922	/nfs/dbraw/zinc/39/09/22/193390922.db2.gz	FGYDPMAZCUCEQA-GMSGAONNSA-N	0	3	319.586	2.015	10	0		DEAEHN
[NH3+]C[C@@H]1CCC[C@H]1C(=O)Nc1cc(Br)ccc1[O-]	ZINC000094573701	193381433	/nfs/dbraw/zinc/38/14/33/193381433.db2.gz	GJFNEJDPIJYBLH-WCBMZHEXSA-N	0	3	313.195	2.468	10	0		DEAEHN
CNCc1cc(S(=O)(=O)NCc2cscc2C)cs1	ZINC000094887055	193405164	/nfs/dbraw/zinc/40/51/64/193405164.db2.gz	RZLYLHPBDZXPSC-UHFFFAOYSA-N	0	3	316.473	2.316	10	0		DEAEHN
CCN[C@@H](Cc1cccc(F)c1F)C(C)(C)S(C)(=O)=O	ZINC000094713184	193393444	/nfs/dbraw/zinc/39/34/44/193393444.db2.gz	JFYNGZCJBUXFCH-LBPRGKRZSA-N	0	3	305.390	2.309	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2CCC(CC)(CC)C2)c[nH]1	ZINC000094815056	193399867	/nfs/dbraw/zinc/39/98/67/193399867.db2.gz	WGFJKUIUQRFVNJ-UHFFFAOYSA-N	0	3	313.467	2.325	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCC[C@@H](CNCC(=O)c2ccc[nH]2)C1	ZINC000095085325	193419441	/nfs/dbraw/zinc/41/94/41/193419441.db2.gz	RSRPECULASGANL-ZDUSSCGKSA-N	0	3	321.421	2.434	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@H]1NCc1cc(Br)ccc1F	ZINC000282457142	217010542	/nfs/dbraw/zinc/01/05/42/217010542.db2.gz	STWUUPZVRRSFQH-PRHODGIISA-N	0	3	315.186	2.345	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)c1ccc2nnc(C(C)(C)C)n2n1	ZINC000274877049	212002845	/nfs/dbraw/zinc/00/28/45/212002845.db2.gz	GSZXBFADOGPDML-ZDUSSCGKSA-N	0	3	316.453	2.342	10	0		DEAEHN
Cc1cc2cn[nH]c2c(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000266078184	205080655	/nfs/dbraw/zinc/08/06/55/205080655.db2.gz	MEGWBOWSHZIKEC-GXTWGEPZSA-N	0	3	300.406	2.426	10	0		DEAEHN
N[C@H](c1ccc(Br)c(F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000161813456	197521099	/nfs/dbraw/zinc/52/10/99/197521099.db2.gz	STKHZWFHZLFYLA-LDYMZIIASA-N	0	3	322.199	2.023	10	0		DEAEHN
CCCNCc1cc(Br)cc(C)c1OCC(N)=O	ZINC000160719824	197433975	/nfs/dbraw/zinc/43/39/75/197433975.db2.gz	WMJJIZQTCJSZID-UHFFFAOYSA-N	0	3	315.211	2.121	10	0		DEAEHN
CN(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(CN)c1	ZINC000020189134	182195331	/nfs/dbraw/zinc/19/53/31/182195331.db2.gz	OVQBGEPCEUUSNI-UHFFFAOYSA-N	0	3	308.378	2.105	10	0		DEAEHN
CCCN1CCN([C@H](CN)c2ccc(Br)o2)CC1	ZINC000022174362	182311832	/nfs/dbraw/zinc/31/18/32/182311832.db2.gz	BNEYGNAXUNOYPE-LLVKDONJSA-N	0	3	316.243	2.070	10	0		DEAEHN
C[C@H]1C(=O)[C@@]23C[C@@]14C=CCN1CC[C@@]2(c2ccccc2NC3=O)[C@@H]14	ZINC000038846721	183011394	/nfs/dbraw/zinc/01/13/94/183011394.db2.gz	RVVXEECWQBKQNP-DJKGFLTMSA-N	0	3	320.392	2.116	10	0	biogenic	DEAEHN
O=C(NCc1cc(Br)ccc1F)[C@H]1CCCCN1	ZINC000041069509	183162533	/nfs/dbraw/zinc/16/25/33/183162533.db2.gz	VXUOJKJJLCYFGL-GFCCVEGCSA-N	0	3	315.186	2.347	10	0		DEAEHN
CCN(C)C(=O)COc1c(Br)cccc1CNC	ZINC000042411529	183265535	/nfs/dbraw/zinc/26/55/35/183265535.db2.gz	IZPBASKVUHMSLB-UHFFFAOYSA-N	0	3	315.211	2.026	10	0		DEAEHN
COCCCN(CCOC)[C@H](CN)c1cc(C)sc1C	ZINC000042420834	183267711	/nfs/dbraw/zinc/26/77/11/183267711.db2.gz	BPHDXFPXHOWFDJ-OAHLLOKOSA-N	0	3	300.468	2.350	10	0		DEAEHN
CCN(CCOC)[C@H](CN)c1cc(Br)cs1	ZINC000042492682	183276173	/nfs/dbraw/zinc/27/61/73/183276173.db2.gz	LYHSTNRBOKFMPB-SNVBAGLBSA-N	0	3	307.257	2.479	10	0		DEAEHN
CN(Cc1cnn(C)c1)c1cc(Br)ccc1CN	ZINC000042489137	183276213	/nfs/dbraw/zinc/27/62/13/183276213.db2.gz	QIJRLUSSUOLCSS-UHFFFAOYSA-N	0	3	309.211	2.278	10	0		DEAEHN
CCCNCc1c(Cl)cccc1N(C)C[C@@H](O)COC	ZINC000042511610	183278835	/nfs/dbraw/zinc/27/88/35/183278835.db2.gz	KGCBKCIETUEFJZ-GFCCVEGCSA-N	0	3	300.830	2.283	10	0		DEAEHN
CC(C)C[C@H](C)N(C)S(=O)(=O)c1cccc2c1CCNC2	ZINC000042592571	183288433	/nfs/dbraw/zinc/28/84/33/183288433.db2.gz	NINPKRLOFYXGKY-ZDUSSCGKSA-N	0	3	310.463	2.387	10	0		DEAEHN
C[C@@H](N)[C@H](c1cccc(Cl)c1)N(CC(N)=O)C1CCCC1	ZINC000043015971	183327419	/nfs/dbraw/zinc/32/74/19/183327419.db2.gz	ABQGUYAHVHPELO-BDJLRTHQSA-N	0	3	309.841	2.458	10	0		DEAEHN
CCCN(CC(=O)N(C)C)[C@H](CN)c1ccc(Cl)s1	ZINC000043253752	183347807	/nfs/dbraw/zinc/34/78/07/183347807.db2.gz	JMNCMYQSWLXWPH-SNVBAGLBSA-N	0	3	303.859	2.202	10	0		DEAEHN
COCCN(CCOC)[C@H](c1ccc(Cl)s1)[C@H](C)N	ZINC000043252903	183347963	/nfs/dbraw/zinc/34/79/63/183347963.db2.gz	ZMBAHFNRUOKGAO-GWCFXTLKSA-N	0	3	306.859	2.385	10	0		DEAEHN
C[C@H](N)[C@H](c1cc(Br)cs1)N1CCC[C@@H]1CO	ZINC000043286384	183350868	/nfs/dbraw/zinc/35/08/68/183350868.db2.gz	UIPKCNWWYZFGEY-MKPLZMMCSA-N	0	3	319.268	2.356	10	0		DEAEHN
N[C@@H](c1cc(Br)ccc1F)[C@@H]1CCS(=O)(=O)C1	ZINC000043299753	183351195	/nfs/dbraw/zinc/35/11/95/183351195.db2.gz	XLFFUEWUIFDXEZ-RDDDGLTNSA-N	0	3	322.199	2.023	10	0		DEAEHN
CC(C)N(CCO)[C@H](CN)c1cc(Br)cs1	ZINC000043287365	183351635	/nfs/dbraw/zinc/35/16/35/183351635.db2.gz	PMEYMNWFYROONM-SNVBAGLBSA-N	0	3	307.257	2.213	10	0		DEAEHN
CN[C@@H](c1cccc(Br)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000043300584	183351975	/nfs/dbraw/zinc/35/19/75/183351975.db2.gz	SRQFIDCGFGIHCR-PWSUYJOCSA-N	0	3	318.236	2.144	10	0		DEAEHN
CCCN[C@H](c1ccc2c(c1)CCO2)[C@@H]1CCS(=O)(=O)C1	ZINC000043301494	183352457	/nfs/dbraw/zinc/35/24/57/183352457.db2.gz	YKBHTLVXNSYNCV-GDBMZVCRSA-N	0	3	309.431	2.097	10	0		DEAEHN
CC[C@@H](N)[C@H](Oc1ccc(S(C)(=O)=O)cc1)C(F)(F)F	ZINC000043385209	183357941	/nfs/dbraw/zinc/35/79/41/183357941.db2.gz	WJGSMWSWCUCONZ-MNOVXSKESA-N	0	3	311.325	2.137	10	0		DEAEHN
CN(C)C(=O)CCCOc1c(Br)cccc1CN	ZINC000043448086	183364122	/nfs/dbraw/zinc/36/41/22/183364122.db2.gz	GFUVFKSEIRYLCT-UHFFFAOYSA-N	0	3	315.211	2.155	10	0		DEAEHN
CN1CCC[C@@H](Nc2nc3c(cc2C(N)=S)CCCC3)C1	ZINC000043410901	183360094	/nfs/dbraw/zinc/36/00/94/183360094.db2.gz	NGVCWPAQYYBGKS-GFCCVEGCSA-N	0	3	304.463	2.101	10	0		DEAEHN
COC(=O)CCNC(=O)CN[C@H](C)c1ccc2ccccc2c1	ZINC000102686895	193917042	/nfs/dbraw/zinc/91/70/42/193917042.db2.gz	KQIQPMNQDRNLGA-CYBMUJFWSA-N	0	3	314.385	2.170	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccc(-n2cccc2)c(F)c1	ZINC000104866994	194048349	/nfs/dbraw/zinc/04/83/49/194048349.db2.gz	BYAHVDHCWSIDGG-AWEZNQCLSA-N	0	3	301.365	2.440	10	0		DEAEHN
CO[C@H]1C[C@@H](CN(C)Cc2ncc(-c3ccccc3)o2)N(C)C1	ZINC000284789370	218179182	/nfs/dbraw/zinc/17/91/82/218179182.db2.gz	JMGHCXUAKKNSJL-HOTGVXAUSA-N	0	3	315.417	2.493	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)c1ccc2nc(N)sc2c1	ZINC000105739050	194122960	/nfs/dbraw/zinc/12/29/60/194122960.db2.gz	FYPSAJNCUZUWBK-LLVKDONJSA-N	0	3	304.419	2.093	10	0		DEAEHN
FC(F)(F)COCCCN1CCC(Nc2cccnn2)CC1	ZINC000105805889	194133827	/nfs/dbraw/zinc/13/38/27/194133827.db2.gz	CWPKORYMVBZQCU-UHFFFAOYSA-N	0	3	318.343	2.322	10	0		DEAEHN
CC(=O)Nc1cccc(CN2CCC[C@H](Cn3cncn3)C2)c1	ZINC000105884561	194157770	/nfs/dbraw/zinc/15/77/70/194157770.db2.gz	NDGPRMZWICKVRE-INIZCTEOSA-N	0	3	313.405	2.149	10	0		DEAEHN
C[C@H](C(=O)N1CCCCC1)N1CCC(Cc2nccn2C)CC1	ZINC000105918458	194168959	/nfs/dbraw/zinc/16/89/59/194168959.db2.gz	MXSVPMVVDWDHIW-OAHLLOKOSA-N	0	3	318.465	2.076	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1cccc(Cl)c1)N1CCNC(=O)C1(C)C	ZINC000110653672	194346496	/nfs/dbraw/zinc/34/64/96/194346496.db2.gz	AYHPTHQIWDEKKI-ZIAGYGMSSA-N	0	3	309.841	2.329	10	0		DEAEHN
C[C@H]1CN(c2nc(-c3ccccc3)c(CN)s2)CCN1C	ZINC000110760105	194356732	/nfs/dbraw/zinc/35/67/32/194356732.db2.gz	MVMLXNKJKFHOTM-LBPRGKRZSA-N	0	3	302.447	2.409	10	0		DEAEHN
CC[C@H](N)[C@@H](c1cccc(Cl)c1)N1CCNC(=O)C1(C)C	ZINC000110653670	194347602	/nfs/dbraw/zinc/34/76/02/194347602.db2.gz	AYHPTHQIWDEKKI-UONOGXRCSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)s1)N1CCNC(=O)[C@@H]1C	ZINC000110655174	194347620	/nfs/dbraw/zinc/34/76/20/194347620.db2.gz	UVHKUFTZCGEXFG-YGOYTEALSA-N	0	3	301.843	2.000	10	0		DEAEHN
CN([C@@H]1CCCNC1)S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000110928426	194370647	/nfs/dbraw/zinc/37/06/47/194370647.db2.gz	JAAQVUKUXQBPPK-SNVBAGLBSA-N	0	3	323.245	2.366	10	0		DEAEHN
CCCN([C@@H]1CCCNC1)S(=O)(=O)c1c(F)cccc1F	ZINC000110942439	194372452	/nfs/dbraw/zinc/37/24/52/194372452.db2.gz	KTMRIKFXHMUNOW-LLVKDONJSA-N	0	3	318.389	2.118	10	0		DEAEHN
CN(CC(=O)Nc1ccc(Cl)c(N)c1)CC1CCOCC1	ZINC000111156554	194396664	/nfs/dbraw/zinc/39/66/64/194396664.db2.gz	XCEXEUFPHIZSEK-UHFFFAOYSA-N	0	3	311.813	2.219	10	0		DEAEHN
CN(CC1CCOCC1)[C@@H](CN)c1ccc(Br)o1	ZINC000111159503	194397842	/nfs/dbraw/zinc/39/78/42/194397842.db2.gz	CSORCRYAXLSHPF-NSHDSACASA-N	0	3	317.227	2.400	10	0		DEAEHN
COc1cccc(N2C(=O)C[C@H](NCCc3ccccc3)C2=O)c1	ZINC000059516356	184139386	/nfs/dbraw/zinc/13/93/86/184139386.db2.gz	AJKNFMNMBXZZAF-KRWDZBQOSA-N	0	3	324.380	2.159	10	0		DEAEHN
C[C@H]1CN(CCC(=O)Nc2ccc(N)cc2Cl)CCCO1	ZINC000061912799	184195411	/nfs/dbraw/zinc/19/54/11/184195411.db2.gz	UCFKQPKOUDKKDL-NSHDSACASA-N	0	3	311.813	2.362	10	0		DEAEHN
C[C@H]([C@H](N)c1ccccc1)N1CCN(CC(F)(F)F)CC1	ZINC000061941121	184197201	/nfs/dbraw/zinc/19/72/01/184197201.db2.gz	XZULCUSBCSEWFZ-OCCSQVGLSA-N	0	3	301.356	2.255	10	0		DEAEHN
C[C@@H](C(=O)N1CCNCC1)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC000062014487	184201830	/nfs/dbraw/zinc/20/18/30/184201830.db2.gz	ZDXQTAFCELBHNR-STQMWFEESA-N	0	3	309.841	2.153	10	0		DEAEHN
COCCN1C(=O)C[C@@H](N)[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000062210257	184220870	/nfs/dbraw/zinc/22/08/70/184220870.db2.gz	RIBLIBKEOYYMCA-DGCLKSJQSA-N	0	3	303.189	2.241	10	0		DEAEHN
COCCNCc1ccc(OCCOCC(F)(F)F)cc1	ZINC000062729163	184250677	/nfs/dbraw/zinc/25/06/77/184250677.db2.gz	WSLVOIUSVBQALW-UHFFFAOYSA-N	0	3	307.312	2.380	10	0		DEAEHN
CCN[C@H](CCSc1ccccc1Br)C(N)=O	ZINC000062597094	184244769	/nfs/dbraw/zinc/24/47/69/184244769.db2.gz	HBCFDDBSBMLKIR-SNVBAGLBSA-N	0	3	317.252	2.395	10	0		DEAEHN
CCN[C@@H](CCSc1ccc(Br)cc1)C(N)=O	ZINC000062596944	184244841	/nfs/dbraw/zinc/24/48/41/184244841.db2.gz	VXWZNFFIKUPYBI-NSHDSACASA-N	0	3	317.252	2.395	10	0		DEAEHN
CCN[C@H](C)c1ccc(F)cc1OCCCS(C)(=O)=O	ZINC000063014501	184266610	/nfs/dbraw/zinc/26/66/10/184266610.db2.gz	WKSYGICDLJVXKK-LLVKDONJSA-N	0	3	303.399	2.310	10	0		DEAEHN
CC(C)(C)NCC(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000066212391	184397242	/nfs/dbraw/zinc/39/72/42/184397242.db2.gz	SBHQRDFVTPFTIP-UHFFFAOYSA-N	0	3	303.406	2.249	10	0		DEAEHN
Cn1cc([C@H](CN)Oc2cc(F)ccc2Br)cn1	ZINC000160179036	197391232	/nfs/dbraw/zinc/39/12/32/197391232.db2.gz	VDWRMHKVNXTJGB-LBPRGKRZSA-N	0	3	314.158	2.401	10	0		DEAEHN
COc1ccccc1N1CC[C@H](N[C@H](C)c2cnn(C)c2)C1	ZINC000119665174	195013459	/nfs/dbraw/zinc/01/34/59/195013459.db2.gz	LJPTWPVWJAJBFV-HIFRSBDPSA-N	0	3	300.406	2.358	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000159102016	197327177	/nfs/dbraw/zinc/32/71/77/197327177.db2.gz	XTKXWUHCFCYOIP-LLVKDONJSA-N	0	3	306.284	2.278	10	0		DEAEHN
N[C@H](CS(=O)(=O)c1c(Cl)cccc1Cl)[C@H]1CCOC1	ZINC000158810076	197302728	/nfs/dbraw/zinc/30/27/28/197302728.db2.gz	ZPTPRYGDTUQWAO-GZMMTYOYSA-N	0	3	324.229	2.131	10	0		DEAEHN
CN(C)CCc1noc(-c2ccc(C(F)(F)F)cc2N)n1	ZINC000158684667	197293769	/nfs/dbraw/zinc/29/37/69/197293769.db2.gz	YYKPMTAZXZUEQI-UHFFFAOYSA-N	0	3	300.284	2.442	10	0		DEAEHN
CCNCc1csc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)c1	ZINC000158746443	197298285	/nfs/dbraw/zinc/29/82/85/197298285.db2.gz	RMGKYODMWKLMFG-CHWSQXEVSA-N	0	3	314.476	2.278	10	0		DEAEHN
Cc1cc(C)c(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)cc1CN	ZINC000158736545	197298357	/nfs/dbraw/zinc/29/83/57/197298357.db2.gz	FWDWYHDEWVQFNH-ZIAGYGMSSA-N	0	3	308.447	2.183	10	0		DEAEHN
CC(C)OCCN(C)c1ncc(Br)cc1CN	ZINC000158344055	197264134	/nfs/dbraw/zinc/26/41/34/197264134.db2.gz	BNSAVXXDLWSRPS-UHFFFAOYSA-N	0	3	302.216	2.164	10	0		DEAEHN
CC(C)([C@H](N)Cc1cccc(C(F)(F)F)c1)S(C)(=O)=O	ZINC000157675472	197206545	/nfs/dbraw/zinc/20/65/45/197206545.db2.gz	BZZDRPVQVLHTEX-LLVKDONJSA-N	0	3	309.353	2.398	10	0		DEAEHN
C[C@@](F)(Cc1cncc(Br)c1)C[C@H]1COCCN1	ZINC000157668842	197206431	/nfs/dbraw/zinc/20/64/31/197206431.db2.gz	BCKRHLCLXSHDOM-QWHCGFSZSA-N	0	3	317.202	2.493	10	0		DEAEHN
CCCc1nc(N(C)CCOCC)sc1CNCCOC	ZINC000157730221	197210723	/nfs/dbraw/zinc/21/07/23/197210723.db2.gz	ICLYXNUBNBDOBY-UHFFFAOYSA-N	0	3	315.483	2.304	10	0		DEAEHN
CCCNc1nnc(C(=O)N(CCN(C)C)CC(C)C)s1	ZINC000157324908	197180266	/nfs/dbraw/zinc/18/02/66/197180266.db2.gz	KLEGIWAESNVWHO-UHFFFAOYSA-N	0	3	313.471	2.020	10	0		DEAEHN
CCN[C@H](C)c1cccc(S(=O)(=O)N(C)CCOCC)c1	ZINC000157290978	197177265	/nfs/dbraw/zinc/17/72/65/197177265.db2.gz	GKVGJDCUPKUFMJ-CYBMUJFWSA-N	0	3	314.451	2.014	10	0		DEAEHN
COc1ccc2[nH]c(=S)n(C[C@H](C)CN3CCCC3)c2n1	ZINC000157050411	197158424	/nfs/dbraw/zinc/15/84/24/197158424.db2.gz	ASBGSEPIGOOGSA-LLVKDONJSA-N	0	3	306.435	2.461	10	0		DEAEHN
C[C@@](O)(Cc1ccc(C(F)(F)F)cc1)C[C@H]1COCCN1	ZINC000156779843	197140298	/nfs/dbraw/zinc/14/02/98/197140298.db2.gz	ZUEVQSJMCLKBJH-UONOGXRCSA-N	0	3	303.324	2.377	10	0		DEAEHN
O=C1[C@H](N[C@H]2CCC23CCOCC3)CCN1c1ccccc1	ZINC000558622325	291896521	/nfs/dbraw/zinc/89/65/21/291896521.db2.gz	XJBHCQJUNHVIOI-CVEARBPZSA-N	0	3	300.402	2.341	10	0		DEAEHN
O=C1C[C@H](NC[C@H]2CCCCS2)C(=O)N1c1ccccc1	ZINC000156412814	197111104	/nfs/dbraw/zinc/11/11/04/197111104.db2.gz	JJAFUSXANNMFAB-KGLIPLIRSA-N	0	3	304.415	2.194	10	0		DEAEHN
O=C(NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)C1CC(=O)C1	ZINC000156178497	197092698	/nfs/dbraw/zinc/09/26/98/197092698.db2.gz	ONOXPCHSXQKOQP-ALOPSCKCSA-N	0	3	312.413	2.277	10	0		DEAEHN
CNc1nc(N[C@H](C)c2nccs2)nc(N2CCCC2)n1	ZINC000156153706	197090397	/nfs/dbraw/zinc/09/03/97/197090397.db2.gz	UHJCYHQSBSNFGY-SECBINFHSA-N	0	3	305.411	2.143	10	0		DEAEHN
NCc1cccc(NC(=O)C[S@@](=O)c2cccc(F)c2)c1	ZINC000156085272	197085362	/nfs/dbraw/zinc/08/53/62/197085362.db2.gz	GYGOHVZNEYAHBB-NRFANRHFSA-N	0	3	306.362	2.031	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCc2nc(C(F)(F)F)cs2)C1	ZINC000155474878	197058784	/nfs/dbraw/zinc/05/87/84/197058784.db2.gz	IQNBVKSMMYTMLZ-MRVPVSSYSA-N	0	3	322.356	2.007	10	0		DEAEHN
CC(C)c1ccc(NC(=O)CN2CCO[C@@H](CN(C)C)C2)cc1	ZINC000155323714	197044695	/nfs/dbraw/zinc/04/46/95/197044695.db2.gz	UFYSTZCYWFEVOL-KRWDZBQOSA-N	0	3	319.449	2.011	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc(COC)cc2)CCN1C[C@@H](C)O	ZINC000120709345	195221515	/nfs/dbraw/zinc/22/15/15/195221515.db2.gz	XWMJDVBCBAHSRB-CRAIPNDOSA-N	0	3	306.450	2.110	10	0		DEAEHN
Cc1noc(C)c1CN1C[C@@H]2CN(c3ccsc3)C(=O)[C@@H]2C1	ZINC000251990197	257106877	/nfs/dbraw/zinc/10/68/77/257106877.db2.gz	IUKJFHVLMODRDO-IUODEOHRSA-N	0	3	317.414	2.448	10	0		DEAEHN
O=C(NCC1CC1)[C@@H]1CC[C@H]2[C@H](CCN2Cc2cccs2)O1	ZINC000247469063	257119302	/nfs/dbraw/zinc/11/93/02/257119302.db2.gz	DQXAIRXHUSQZRP-JYJNAYRXSA-N	0	3	320.458	2.396	10	0		DEAEHN
COCCN1CCO[C@@H]2CCN(Cc3ccc(F)cc3C)C[C@@H]21	ZINC000503717319	257209358	/nfs/dbraw/zinc/20/93/58/257209358.db2.gz	SRCWWBGJGSHORH-ZWKOTPCHSA-N	0	3	322.424	2.056	10	0		DEAEHN
CC[C@@H]1CN(Cc2cnn(C(C)(C)C)c2)CCN1CCOC	ZINC000120976428	195275403	/nfs/dbraw/zinc/27/54/03/195275403.db2.gz	IIBDHUIAWZPOFJ-MRXNPFEDSA-N	0	3	308.470	2.181	10	0		DEAEHN
O=C([C@@H](C1CC1)N1CCCC1)N1CCCC[C@@H]1c1cn[nH]c1	ZINC000124172699	304289400	/nfs/dbraw/zinc/28/94/00/304289400.db2.gz	VQXOOLYMPPIDMK-HZPDHXFCSA-N	0	3	302.422	2.338	10	0		DEAEHN
CNC(=O)c1ccc(NC(=O)CC2CCN(C)CC2)cc1Cl	ZINC000362650810	133243714	/nfs/dbraw/zinc/24/37/14/133243714.db2.gz	WEBUTWNMGGJCLZ-UHFFFAOYSA-N	0	3	323.824	2.370	10	0		DEAEHN
CN(CCNC(=O)CC1CCN(C)CC1)Cc1ccc(F)cc1	ZINC000362888354	133257520	/nfs/dbraw/zinc/25/75/20/133257520.db2.gz	BLKWKKIGJMHCQY-UHFFFAOYSA-N	0	3	321.440	2.106	10	0		DEAEHN
Cc1ccnc(C2CCN(C(=O)CN3CCC(C)CC3)CC2)n1	ZINC000368317179	133268701	/nfs/dbraw/zinc/26/87/01/133268701.db2.gz	WDPCLIPCBJAUIU-UHFFFAOYSA-N	0	3	316.449	2.223	10	0		DEAEHN
O=C(C1CCN(CCOCC(F)F)CC1)N1CCCCCC1	ZINC000188642653	145015101	/nfs/dbraw/zinc/01/51/01/145015101.db2.gz	SMXRLGQHISYYDT-UHFFFAOYSA-N	0	3	318.408	2.383	10	0		DEAEHN
COC[C@H](C)n1ccc(NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)n1	ZINC000189901849	145036163	/nfs/dbraw/zinc/03/61/63/145036163.db2.gz	IFEAAPPEOSTRRG-RDBSUJKOSA-N	0	3	323.441	2.037	10	0		DEAEHN
COC[C@H](C)n1ccc(NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)n1	ZINC000189901831	145036224	/nfs/dbraw/zinc/03/62/24/145036224.db2.gz	IFEAAPPEOSTRRG-MELADBBJSA-N	0	3	323.441	2.037	10	0		DEAEHN
Cn1ccnc1[C@H](O)C1CCN(C[C@@H](O)CC2CCCC2)CC1	ZINC000190915153	145050038	/nfs/dbraw/zinc/05/00/38/145050038.db2.gz	KVUKAYONXNAZGV-DLBZAZTESA-N	0	3	321.465	2.107	10	0		DEAEHN
COc1ncccc1CN1CCC[C@@H](Cc2nccn2C)C1	ZINC000193456626	145086340	/nfs/dbraw/zinc/08/63/40/145086340.db2.gz	FSYSGHDQMMAQKF-AWEZNQCLSA-N	0	3	300.406	2.278	10	0		DEAEHN
Cc1ccccc1CS(=O)(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000246272156	145096728	/nfs/dbraw/zinc/09/67/28/145096728.db2.gz	VALPADTZYZLVQD-GDBMZVCRSA-N	0	3	310.463	2.143	10	0		DEAEHN
COc1ncc(C)cc1NC(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000246284341	145097054	/nfs/dbraw/zinc/09/70/54/145097054.db2.gz	BUXLOERSONUQJP-OCCSQVGLSA-N	0	3	306.410	2.249	10	0		DEAEHN
C[C@H](CNC(=O)N1CCN2CCC[C@H]2C1)Cc1cccs1	ZINC000246893139	145118354	/nfs/dbraw/zinc/11/83/54/145118354.db2.gz	HGQSLFKSPBEKIY-KBPBESRZSA-N	0	3	307.463	2.416	10	0		DEAEHN
CC[C@@H]1CCC[C@@H](NC(=O)NC[C@@H](O)CN2CCCCC2)C1	ZINC000246913932	145119324	/nfs/dbraw/zinc/11/93/24/145119324.db2.gz	CXYMLZSXKPHZAN-BZUAXINKSA-N	0	3	311.470	2.101	10	0		DEAEHN
C[C@H](O)CN1CCN(CCCOCCc2ccccc2)C[C@@H]1C	ZINC000247050477	145125197	/nfs/dbraw/zinc/12/51/97/145125197.db2.gz	FGSJYOCPKLIZSB-ROUUACIJSA-N	0	3	320.477	2.023	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1N[C@H]1CCCn2ncnc21	ZINC000247153899	145127861	/nfs/dbraw/zinc/12/78/61/145127861.db2.gz	RROUWWHHGHNCRJ-PVAVHDDUSA-N	0	3	311.433	2.223	10	0		DEAEHN
CCOCCN1CCN(CCCCCn2cccn2)C[C@H]1C	ZINC000247253946	145130395	/nfs/dbraw/zinc/13/03/95/145130395.db2.gz	UENLGRPYRSLSOV-QGZVFWFLSA-N	0	3	308.470	2.096	10	0		DEAEHN
CC(C)OC[C@H](O)CN1CCC[C@@H]1C[C@@H](O)c1cccs1	ZINC000247281533	145131491	/nfs/dbraw/zinc/13/14/91/145131491.db2.gz	XKMUMBJRMKHNGA-RBSFLKMASA-N	0	3	313.463	2.422	10	0		DEAEHN
COc1ccc(F)cc1[C@@H](C)NC(=O)N1CCN2CCC[C@H]2C1	ZINC000247486347	145139187	/nfs/dbraw/zinc/13/91/87/145139187.db2.gz	KTQGKJOAIFYJED-OCCSQVGLSA-N	0	3	321.396	2.385	10	0		DEAEHN
Cc1ccc(C(=O)CCN2C[C@@H](C)[C@@H](N3CCOCC3)C2)cc1	ZINC000248548841	145158479	/nfs/dbraw/zinc/15/84/79/145158479.db2.gz	GZEFVOPJCJMSQF-AEFFLSMTSA-N	0	3	316.445	2.220	10	0		DEAEHN
Cc1ccccc1CCNC(=O)[C@H](C)N[C@H](C)[C@H]1CCCO1	ZINC000248587395	145159914	/nfs/dbraw/zinc/15/99/14/145159914.db2.gz	KCWCXBOYYVMXRZ-HLLBOEOZSA-N	0	3	304.434	2.199	10	0		DEAEHN
CN(Cc1ccc2c(c1)sc(=O)n2C)C[C@@H]1CCC[C@H]1O	ZINC000248720122	145165124	/nfs/dbraw/zinc/16/51/24/145165124.db2.gz	GKAVVVXHXXNKOV-GXTWGEPZSA-N	0	3	306.431	2.193	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1C[C@H]1CC2(CCC2)C(=O)O1	ZINC000248825651	145169477	/nfs/dbraw/zinc/16/94/77/145169477.db2.gz	GWTJAHIRULTFKD-HUUCEWRRSA-N	0	3	303.406	2.142	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)CCN1C	ZINC000248867915	145170564	/nfs/dbraw/zinc/17/05/64/145170564.db2.gz	QHOVEKRRWUUVIQ-DTZQCDIJSA-N	0	3	309.454	2.068	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CCOC[C@H]1C	ZINC000248881436	145171615	/nfs/dbraw/zinc/17/16/15/145171615.db2.gz	SKNYXJURVQGUAV-INMHGKMJSA-N	0	3	304.434	2.296	10	0		DEAEHN
CO[C@@H]1CN([C@@H](C)C(=O)N2CCc3ccccc3C2)CC[C@H]1C	ZINC000251525407	145194796	/nfs/dbraw/zinc/19/47/96/145194796.db2.gz	CXPRUWLDSXWYMT-RVKKMQEKSA-N	0	3	316.445	2.317	10	0		DEAEHN
c1ccc(-c2noc(CN3CCNC[C@H]3c3cccnc3)n2)cc1	ZINC000261614619	145210563	/nfs/dbraw/zinc/21/05/63/145210563.db2.gz	CHTWOMYEPXHGCY-INIZCTEOSA-N	0	3	321.384	2.278	10	0		DEAEHN
CC(C)(C)NC(=O)CN1CCNC[C@H]1c1cccc(Cl)c1	ZINC000261611265	145210713	/nfs/dbraw/zinc/21/07/13/145210713.db2.gz	CDANKCJZMSJPFO-AWEZNQCLSA-N	0	3	309.841	2.201	10	0		DEAEHN
COc1cccc(CN2CCNC[C@H]2c2cccnc2)c1OC	ZINC000261676222	145215444	/nfs/dbraw/zinc/21/54/44/145215444.db2.gz	JNOFFZVYRXKCPE-INIZCTEOSA-N	0	3	313.401	2.245	10	0		DEAEHN
Fc1cccc(OCCN2CCNC[C@@H]2c2cccnc2)c1	ZINC000261764202	145223975	/nfs/dbraw/zinc/22/39/75/145223975.db2.gz	OEPNATNIVNUUDW-QGZVFWFLSA-N	0	3	301.365	2.246	10	0		DEAEHN
Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)C2(N)CCOCC2)C1	ZINC000261868183	145235757	/nfs/dbraw/zinc/23/57/57/145235757.db2.gz	NWWKGXSABSCRSC-LSDHHAIUSA-N	0	3	302.418	2.207	10	0		DEAEHN
CN(C[C@H]1COc2ccccc2O1)C(=O)[C@@H]1NCCCC1(C)C	ZINC000261864335	145235784	/nfs/dbraw/zinc/23/57/84/145235784.db2.gz	KRQIHGCAELIESA-BBRMVZONSA-N	0	3	318.417	2.063	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)CN2CCNC[C@H]2c2cccnc2)c1	ZINC000261874647	145236507	/nfs/dbraw/zinc/23/65/07/145236507.db2.gz	XUDQRNVUYFXHIX-SFHVURJKSA-N	0	3	324.428	2.283	10	0		DEAEHN
CCN1CC[C@H](NC(=O)[C@@H](C)N)[C@H]1c1ccc(Cl)c(F)c1	ZINC000261880222	145237395	/nfs/dbraw/zinc/23/73/95/145237395.db2.gz	SZUYHMYZKJBIJM-BIGNPOOSSA-N	0	3	313.804	2.078	10	0		DEAEHN
NC1(C(=O)NCc2ccc(Cl)cc2Cl)CCOCC1	ZINC000261946129	145245740	/nfs/dbraw/zinc/24/57/40/145245740.db2.gz	YJIZBGBAJPJCJU-UHFFFAOYSA-N	0	3	303.189	2.118	10	0		DEAEHN
CN(CC12CC3CC(CC(C3)C1)C2)C(=O)C1(N)CCOCC1	ZINC000262066672	145258292	/nfs/dbraw/zinc/25/82/92/145258292.db2.gz	FNPOVWUUZMXDNW-UHFFFAOYSA-N	0	3	306.450	2.169	10	0		DEAEHN
CCc1ccc([C@H]2CNCCN2CC(=O)Nc2ccncc2)cc1	ZINC000262164321	145266763	/nfs/dbraw/zinc/26/67/63/145266763.db2.gz	HFJLDZAGLAXZIU-GOSISDBHSA-N	0	3	324.428	2.229	10	0		DEAEHN
COc1ccccc1[C@@H]1CNCCN1Cc1nc(C)c(C)o1	ZINC000262274964	145273106	/nfs/dbraw/zinc/27/31/06/145273106.db2.gz	SYQQXDDOEWDOGJ-HNNXBMFYSA-N	0	3	301.390	2.447	10	0		DEAEHN
CC(C)C[C@H](N)C(=O)N1CCC[C@H](c2noc(C3CC3)n2)C1	ZINC000262296446	145274592	/nfs/dbraw/zinc/27/45/92/145274592.db2.gz	JFALCHYEDRXWJX-STQMWFEESA-N	0	3	306.410	2.026	10	0		DEAEHN
C[C@@H](C(=O)NCc1ccc(CO)c(F)c1)[C@H](N)c1ccccc1	ZINC000262305626	145274900	/nfs/dbraw/zinc/27/49/00/145274900.db2.gz	OPMCOXCQVYIASF-PXAZEXFGSA-N	0	3	316.376	2.270	10	0		DEAEHN
O=c1[nH]c2ccccc2cc1CN1CCNC[C@H]1c1cccnc1	ZINC000262301117	145275302	/nfs/dbraw/zinc/27/53/02/145275302.db2.gz	XMVXGTVLXGGUPT-SFHVURJKSA-N	0	3	320.396	2.482	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)Nc1nc(C2CC2)cs1	ZINC000262530266	145290569	/nfs/dbraw/zinc/29/05/69/145290569.db2.gz	PLIFECKXOCSYGB-IETSOEAISA-N	0	3	321.446	2.492	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N1C[C@@H]2CCCC[C@@H]2C1	ZINC000262587022	145295761	/nfs/dbraw/zinc/29/57/61/145295761.db2.gz	ZVLUSPSITUUGJE-KCTHJMFYSA-N	0	3	306.450	2.168	10	0		DEAEHN
NC1(C(=O)N[C@H]2CCN(c3c(F)cccc3F)C2)CCCCC1	ZINC000262644724	145297910	/nfs/dbraw/zinc/29/79/10/145297910.db2.gz	MVFLEVGXDYCYRC-LBPRGKRZSA-N	0	3	323.387	2.321	10	0		DEAEHN
COc1ccccc1[C@H](C)Cc1nc([C@@H]2CNCCN2C)no1	ZINC000263134823	145328170	/nfs/dbraw/zinc/32/81/70/145328170.db2.gz	BYPHWRUWFIKEJZ-OCCSQVGLSA-N	0	3	316.405	2.001	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2ccccc2C(F)(F)F)n1	ZINC000263216151	145337121	/nfs/dbraw/zinc/33/71/21/145337121.db2.gz	KXHNQPLVNWUBRU-LLVKDONJSA-N	0	3	312.295	2.332	10	0		DEAEHN
C[C@@H](Oc1cccc(Cl)c1)c1nc([C@H]2CNCCN2C)no1	ZINC000263217863	145337476	/nfs/dbraw/zinc/33/74/76/145337476.db2.gz	LFRZWZZWQWRHKV-ZWNOBZJWSA-N	0	3	322.796	2.439	10	0		DEAEHN
CS(=O)(=O)C1(CN[C@@H](C[C@H]2CCOC2)c2ccccc2)CC1	ZINC000359029505	147249791	/nfs/dbraw/zinc/24/97/91/147249791.db2.gz	LHYUSQLGPRTLID-ZBFHGGJFSA-N	0	3	323.458	2.321	10	0		DEAEHN
CC(C)CN(CCN(C)C)C(=O)NCc1ccc2cc[nH]c2n1	ZINC000360714125	147373288	/nfs/dbraw/zinc/37/32/88/147373288.db2.gz	OIHWGBORXJHKDR-UHFFFAOYSA-N	0	3	317.437	2.292	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@H](C(=O)N(C)CCN(C)C1CC1)C2	ZINC000372385187	148201654	/nfs/dbraw/zinc/20/16/54/148201654.db2.gz	GXKYHHIYLYWPSV-ZDUSSCGKSA-N	0	3	318.465	2.191	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@@H](C(=O)N(C)CCN(C)C1CC1)CC2	ZINC000372385187	148201656	/nfs/dbraw/zinc/20/16/56/148201656.db2.gz	GXKYHHIYLYWPSV-ZDUSSCGKSA-N	0	3	318.465	2.191	10	0		DEAEHN
COC(=O)C(C)(C)CCN1CC[C@@H](c2nc(C3CC3)no2)C1	ZINC000375415130	148369607	/nfs/dbraw/zinc/36/96/07/148369607.db2.gz	OFSRQJFHVUOUTR-GFCCVEGCSA-N	0	3	307.394	2.326	10	0		DEAEHN
C[C@@H](NC[C@@H](O)COC1CCOCC1)c1ccc(F)c(F)c1	ZINC000127179504	401723422	/nfs/dbraw/zinc/72/34/22/401723422.db2.gz	JVEBYKQWUPZUAS-DGCLKSJQSA-N	0	3	315.360	2.172	10	0		DEAEHN
CN(C)CCOc1ccccc1CNC(=O)N(C)C1CCC1	ZINC000073915245	401724744	/nfs/dbraw/zinc/72/47/44/401724744.db2.gz	PKVOHXJLFZMZNT-UHFFFAOYSA-N	0	3	305.422	2.321	10	0		DEAEHN
COC[C@@H](C)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000112186870	401732545	/nfs/dbraw/zinc/73/25/45/401732545.db2.gz	OXYUFJSYXJLRFO-CQSZACIVSA-N	0	3	314.495	2.137	10	0		DEAEHN
CSc1ncc(C(=O)NCCN(C)C)c(-c2ccccc2)n1	ZINC000006938122	401734835	/nfs/dbraw/zinc/73/48/35/401734835.db2.gz	SXFPGUNALBLBDV-UHFFFAOYSA-N	0	3	316.430	2.157	10	0		DEAEHN
CCNC(=O)c1cccc(NC(=O)CN[C@H](C)C(C)(C)C)c1	ZINC000074317284	401735444	/nfs/dbraw/zinc/73/54/44/401735444.db2.gz	ZGPMJWAFWREISF-GFCCVEGCSA-N	0	3	305.422	2.399	10	0		DEAEHN
CCS(=O)(=O)NCCN[C@H](C)c1ccc2ccccc2c1	ZINC000112540681	401749047	/nfs/dbraw/zinc/74/90/47/401749047.db2.gz	QLCOOJIPFDRHKX-CYBMUJFWSA-N	0	3	306.431	2.430	10	0		DEAEHN
C[C@@H](CNC(=O)NC1CCC(C)(C)CC1)CN1CCN(C)CC1	ZINC000074524365	401741249	/nfs/dbraw/zinc/74/12/49/401741249.db2.gz	YFABXETZIRAVFA-HNNXBMFYSA-N	0	3	324.513	2.138	10	0		DEAEHN
Cc1cc(NC(=O)C2(N)CCOCC2)ccc1Br	ZINC000127703359	401746087	/nfs/dbraw/zinc/74/60/87/401746087.db2.gz	RSERLEQWNDOYRG-UHFFFAOYSA-N	0	3	313.195	2.204	10	0		DEAEHN
CC[C@H](C(N)=O)N1CCC(CN2CCc3ccccc32)CC1	ZINC000111307305	401710060	/nfs/dbraw/zinc/71/00/60/401710060.db2.gz	KGPDFCGTUIOPLY-MRXNPFEDSA-N	0	3	301.434	2.025	10	0		DEAEHN
COc1ccc2nc(C(=O)NC[C@H](C)N(C)C3CC3)ccc2c1	ZINC000075577845	401763008	/nfs/dbraw/zinc/76/30/08/401763008.db2.gz	RRTRQSVZGSQZNT-LBPRGKRZSA-N	0	3	313.401	2.456	10	0		DEAEHN
Cc1ccc(CN(C)C)cc1NC(=O)CCc1ccnn1C	ZINC000128270365	401769060	/nfs/dbraw/zinc/76/90/60/401769060.db2.gz	MAMOHZIGLNSKBH-UHFFFAOYSA-N	0	3	300.406	2.361	10	0		DEAEHN
Cc1noc2nc(C)cc(C(=O)N3C[C@H]4CCCN4C[C@@H]3C)c12	ZINC000113233198	401771421	/nfs/dbraw/zinc/77/14/21/401771421.db2.gz	PNVQYXJGSBRLDI-WCQYABFASA-N	0	3	314.389	2.148	10	0		DEAEHN
COc1cc(OC)cc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000113233578	401772532	/nfs/dbraw/zinc/77/25/32/401772532.db2.gz	FLFNQZRICADCDK-GXTWGEPZSA-N	0	3	304.390	2.013	10	0		DEAEHN
O=C(CN[C@H]1CCCC[C@H]1n1cccn1)NCc1cccs1	ZINC000128357498	401772890	/nfs/dbraw/zinc/77/28/90/401772890.db2.gz	FLVIBDCMXXELSA-LSDHHAIUSA-N	0	3	318.446	2.334	10	0		DEAEHN
CN(C(=O)CN1CC[C@@]2(O)CCCC[C@@H]2C1)C1CCCCC1	ZINC000128437384	401776662	/nfs/dbraw/zinc/77/66/62/401776662.db2.gz	UGIFMCUSAGUZFN-QAPCUYQASA-N	0	3	308.466	2.405	10	0		DEAEHN
CC(C)Cn1ncc(C(=O)N2CC[C@@H](N(C)C)C2)c1C(F)F	ZINC000128733346	401789739	/nfs/dbraw/zinc/78/97/39/401789739.db2.gz	IOTPAJITHQQRTH-LLVKDONJSA-N	0	3	314.380	2.253	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)CCc1nc(C(C)(C)C)no1	ZINC000077729475	401827598	/nfs/dbraw/zinc/82/75/98/401827598.db2.gz	OUVZGMHFCABSES-CYBMUJFWSA-N	0	3	324.469	2.392	10	0		DEAEHN
Cn1cncc1CN[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000132700602	401871491	/nfs/dbraw/zinc/87/14/91/401871491.db2.gz	FYNNSICBOAAJEE-JKSUJKDBSA-N	0	3	306.360	2.233	10	0		DEAEHN
Cc1cccnc1[C@H](NC(=O)NC[C@@H]1CCCN1C)C(C)C	ZINC000115810488	401837382	/nfs/dbraw/zinc/83/73/82/401837382.db2.gz	IPUVNOMWHQNGTJ-LSDHHAIUSA-N	0	3	304.438	2.481	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000115837861	401838268	/nfs/dbraw/zinc/83/82/68/401838268.db2.gz	UBXUSRFVGBSYLM-WBVHZDCISA-N	0	3	316.449	2.001	10	0		DEAEHN
C[C@@H]1CN(C2CCN(Cc3ccccc3N(C)C)CC2)CCO1	ZINC000078048196	401838672	/nfs/dbraw/zinc/83/86/72/401838672.db2.gz	PTINTTOQFMBBTQ-MRXNPFEDSA-N	0	3	317.477	2.438	10	0		DEAEHN
CN(C)[C@@H](CNC(=O)[C@H]1CCCc2n[nH]cc21)c1ccccc1	ZINC000131691099	401854725	/nfs/dbraw/zinc/85/47/25/401854725.db2.gz	BDJRRHLVIHWFHK-YOEHRIQHSA-N	0	3	312.417	2.249	10	0		DEAEHN
C[C@@H](SCc1ccccc1)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000116793514	401859144	/nfs/dbraw/zinc/85/91/44/401859144.db2.gz	OCWMVFVJVPQTNG-GDBMZVCRSA-N	0	3	322.474	2.097	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2cc3cc(Cl)ccc3o2)CCO1	ZINC000116792192	401859432	/nfs/dbraw/zinc/85/94/32/401859432.db2.gz	YGDGJLZAPBZBNM-CYBMUJFWSA-N	0	3	322.792	2.489	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)CCC(=O)c2ccc(F)c(F)c2)C1	ZINC000087330474	401931141	/nfs/dbraw/zinc/93/11/41/401931141.db2.gz	QWDVRJMBBWGTFT-LBPRGKRZSA-N	0	3	324.371	2.386	10	0		DEAEHN
C[C@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)[C@H]1CCCO1	ZINC000079619967	401877933	/nfs/dbraw/zinc/87/79/33/401877933.db2.gz	CTYAAGMOLNSYIZ-LSDHHAIUSA-N	0	3	311.470	2.317	10	0		DEAEHN
C[C@H](CCC(=O)N1CCO[C@@H](CN(C)C)C1)c1ccccc1	ZINC000133317253	401882165	/nfs/dbraw/zinc/88/21/65/401882165.db2.gz	JHKYUFGXXWPIJT-WBVHZDCISA-N	0	3	304.434	2.359	10	0		DEAEHN
CC(C)Cn1ncc(C(=O)NC[C@@H]2CCCN2C)c1C(F)F	ZINC000134625943	401908986	/nfs/dbraw/zinc/90/89/86/401908986.db2.gz	YZULSKOQMHKSHF-NSHDSACASA-N	0	3	314.380	2.301	10	0		DEAEHN
CCN(CC)c1ncc(CNC2CCC(C(N)=O)CC2)s1	ZINC000037319380	401912111	/nfs/dbraw/zinc/91/21/11/401912111.db2.gz	NCKDOYSCHRQBCK-UHFFFAOYSA-N	0	3	310.467	2.123	10	0		DEAEHN
CCc1cc(C(=O)NCCCN2CCN(CC)CC2)oc1CC	ZINC000134968628	401922363	/nfs/dbraw/zinc/92/23/63/401922363.db2.gz	DYPLFKIDPNOWGW-UHFFFAOYSA-N	0	3	321.465	2.162	10	0		DEAEHN
Cc1nccn1-c1ccc([C@@H](C)N[C@H](C)CS(C)(=O)=O)cc1	ZINC000089633104	401954631	/nfs/dbraw/zinc/95/46/31/401954631.db2.gz	RHTMOVXOFDGJAB-CHWSQXEVSA-N	0	3	321.446	2.264	10	0		DEAEHN
C[C@@H](O)CCNC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000119627005	401962111	/nfs/dbraw/zinc/96/21/11/401962111.db2.gz	STHKCUBNMCDROV-CRAIPNDOSA-N	0	3	319.449	2.111	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2cc3ccccc3[nH]2)C1	ZINC000136522552	401968889	/nfs/dbraw/zinc/96/88/89/401968889.db2.gz	FDHCXVXNRRSHGV-INIZCTEOSA-N	0	3	314.433	2.494	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1	ZINC000119955297	401972652	/nfs/dbraw/zinc/97/26/52/401972652.db2.gz	DFVWVZZRVYSAOJ-CHWSQXEVSA-N	0	3	322.478	2.342	10	0		DEAEHN
Cc1noc(CCCC(=O)N[C@@H](CN(C)C)c2ccccc2)n1	ZINC000046745633	401972623	/nfs/dbraw/zinc/97/26/23/401972623.db2.gz	AIUADCIFQJYDBI-HNNXBMFYSA-N	0	3	316.405	2.120	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cccc(Br)n1	ZINC000137077484	401978562	/nfs/dbraw/zinc/97/85/62/401978562.db2.gz	XEGWPBNZYPIHHV-WDEREUQCSA-N	0	3	324.222	2.153	10	0		DEAEHN
CCCCCCNC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000091843181	401998692	/nfs/dbraw/zinc/99/86/92/401998692.db2.gz	GQDPJZBCCAOLGX-KRWDZBQOSA-N	0	3	324.513	2.378	10	0		DEAEHN
C[C@@H](NC(=O)c1ccco1)C(=O)Nc1cccc(CN(C)C)c1	ZINC000047460131	401982139	/nfs/dbraw/zinc/98/21/39/401982139.db2.gz	FDXPYFXJRINOLF-GFCCVEGCSA-N	0	3	315.373	2.098	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)c1cccc(F)n1	ZINC000137400883	401982982	/nfs/dbraw/zinc/98/29/82/401982982.db2.gz	ZQMUOTDFLDWZGG-AWEZNQCLSA-N	0	3	301.365	2.123	10	0		DEAEHN
CCCc1cc(NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)n(C)n1	ZINC000091093892	401992853	/nfs/dbraw/zinc/99/28/53/401992853.db2.gz	KXAQISZNWICVFF-OCCSQVGLSA-N	0	3	307.442	2.319	10	0		DEAEHN
O=C(NC[C@H](O)CN1CCCCC1)Nc1ccc2c(c1)CCC2	ZINC000043389309	401938576	/nfs/dbraw/zinc/93/85/76/401938576.db2.gz	BXZSFXOYAUORHZ-KRWDZBQOSA-N	0	3	317.433	2.144	10	0		DEAEHN
COC(=O)[C@H]1C[C@H](c2ccccc2)CN(Cc2cnn(C)c2)C1	ZINC000135457770	401940455	/nfs/dbraw/zinc/94/04/55/401940455.db2.gz	RBBFZGSUGVVROE-IRXDYDNUSA-N	0	3	313.401	2.199	10	0		DEAEHN
COC[C@@](C)(CCO)NCCOc1ccc(F)cc1Cl	ZINC000091677367	401997021	/nfs/dbraw/zinc/99/70/21/401997021.db2.gz	BGTJCCDUQCUAGK-CQSZACIVSA-N	0	3	305.777	2.235	10	0		DEAEHN
CC(C)n1cnnc1[C@@H]1CCCN(C[C@H](O)COC(C)(C)C)C1	ZINC000093200971	402012845	/nfs/dbraw/zinc/01/28/45/402012845.db2.gz	QECRSEDGJMACFK-CABCVRRESA-N	0	3	324.469	2.214	10	0		DEAEHN
CC(C)CNC(=O)[C@@H](C)N[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000121103431	402015215	/nfs/dbraw/zinc/01/52/15/402015215.db2.gz	XJGWTROBYBEBBG-UONOGXRCSA-N	0	3	315.421	2.079	10	0		DEAEHN
CC(C)Cc1ncc(CN2CC[C@H](CN3CCOCC3)C2)s1	ZINC000093665549	402018836	/nfs/dbraw/zinc/01/88/36/402018836.db2.gz	QAECTSHGZAQCCA-OAHLLOKOSA-N	0	3	323.506	2.496	10	0		DEAEHN
COc1ccccc1/C=C/CN1CCN(C[C@H]2CCOC2)CC1	ZINC000093817732	402021229	/nfs/dbraw/zinc/02/12/29/402021229.db2.gz	VBZRDYKBDJPCEL-UKINESCASA-N	0	3	316.445	2.363	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCO[C@H](c3ccc(C)o3)C2)C1	ZINC000121261487	402024235	/nfs/dbraw/zinc/02/42/35/402024235.db2.gz	CNOPXZJWMCWFLH-ZBFHGGJFSA-N	0	3	321.421	2.155	10	0		DEAEHN
Cc1cnc(CCN(C)C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)s1	ZINC000121352519	402030196	/nfs/dbraw/zinc/03/01/96/402030196.db2.gz	ZREJXTLYHFTKNG-DGCLKSJQSA-N	0	3	322.478	2.261	10	0		DEAEHN
C[C@H](N[C@@H]1CCO[C@H]1C)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000121392182	402032614	/nfs/dbraw/zinc/03/26/14/402032614.db2.gz	QBLKTQAGYQEVMK-OUJBWJOFSA-N	0	3	301.383	2.057	10	0		DEAEHN
Cc1cc2ncn(C[C@@H](O)CN(C)C[C@@H]3CCCO3)c2cc1C	ZINC000052103364	402038877	/nfs/dbraw/zinc/03/88/77/402038877.db2.gz	LBVVVBIGAGAEFM-HOTGVXAUSA-N	0	3	317.433	2.125	10	0		DEAEHN
Cc1noc(C)c1CC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000052555986	402043925	/nfs/dbraw/zinc/04/39/25/402043925.db2.gz	JAFXCOWQTAURJL-MRXNPFEDSA-N	0	3	301.390	2.253	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2ccc(COC)cc2)C1	ZINC000052524401	402043982	/nfs/dbraw/zinc/04/39/82/402043982.db2.gz	YUWISJFRFNYLET-MRXNPFEDSA-N	0	3	305.422	2.117	10	0		DEAEHN
CSc1ccc(O[C@@H](C)C(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000151601629	402045989	/nfs/dbraw/zinc/04/59/89/402045989.db2.gz	CEZCGSIKLQPWIH-QWHCGFSZSA-N	0	3	308.447	2.338	10	0		DEAEHN
COc1cccc(OCCN2CCC(n3cncn3)CC2)c1	ZINC000151690859	402050819	/nfs/dbraw/zinc/05/08/19/402050819.db2.gz	IMBCGTNEDDHTED-UHFFFAOYSA-N	0	3	302.378	2.003	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cncc(OC(C)C)c1	ZINC000121761874	402051549	/nfs/dbraw/zinc/05/15/49/402051549.db2.gz	PRLUELGYSVZKBQ-OAHLLOKOSA-N	0	3	305.422	2.425	10	0		DEAEHN
C[C@H]1CN(C2CCN(Cc3c[nH]nc3C(C)(C)C)CC2)CCO1	ZINC000092079631	402001685	/nfs/dbraw/zinc/00/16/85/402001685.db2.gz	QRYKFNGGXIFQRH-AWEZNQCLSA-N	0	3	320.481	2.392	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NC[C@@H](CCO)CC(C)C	ZINC000120866436	402005348	/nfs/dbraw/zinc/00/53/48/402005348.db2.gz	XUGCIDRHJSLFME-JKSUJKDBSA-N	0	3	313.486	2.157	10	0		DEAEHN
COc1ccc(O[C@@H](C)C(=O)NC[C@@H](N)c2ccccc2)cc1	ZINC000152167210	402079369	/nfs/dbraw/zinc/07/93/69/402079369.db2.gz	IFHXQBCHQPTNAB-SUMWQHHRSA-N	0	3	314.385	2.279	10	0		DEAEHN
COc1ccc(O[C@H](C)C(=O)NC[C@H](N)c2ccccc2)cc1	ZINC000152167166	402079530	/nfs/dbraw/zinc/07/95/30/402079530.db2.gz	IFHXQBCHQPTNAB-DYVFJYSZSA-N	0	3	314.385	2.279	10	0		DEAEHN
COCCOc1ccccc1C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000122758930	402093627	/nfs/dbraw/zinc/09/36/27/402093627.db2.gz	IPNMYASCMFJZLA-GJZGRUSLSA-N	0	3	320.433	2.267	10	0		DEAEHN
CC(C)[C@H](O)CNC(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000152767765	402107954	/nfs/dbraw/zinc/10/79/54/402107954.db2.gz	BRXRBFNWLAHYAD-IAGOWNOFSA-N	0	3	319.449	2.140	10	0		DEAEHN
C[C@H](CO)[C@H](C)NC(=O)c1oc2ccccc2c1CN(C)C	ZINC000151903134	402064672	/nfs/dbraw/zinc/06/46/72/402064672.db2.gz	OYESNKMWNJKCAV-NEPJUHHUSA-N	0	3	304.390	2.241	10	0		DEAEHN
Cc1cc(C)n(CCCNC(=O)N[C@H](CC(C)C)CN(C)C)n1	ZINC000097394479	402124444	/nfs/dbraw/zinc/12/44/44/402124444.db2.gz	FXNSCGSUDXQPJS-MRXNPFEDSA-N	0	3	323.485	2.166	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)C[C@H]2OC(=O)c3ccccc32)CCN1C	ZINC000123401316	402126125	/nfs/dbraw/zinc/12/61/25/402126125.db2.gz	AMUATTFVQMBYFE-DVOMOZLQSA-N	0	3	316.401	2.229	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1cccc2c1OCO2)c1ccccc1	ZINC000097496914	402126231	/nfs/dbraw/zinc/12/62/31/402126231.db2.gz	YKLYFTGOIQLWHC-OAHLLOKOSA-N	0	3	312.369	2.448	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)C(=O)NCCC2=CCCC2)c1	ZINC000123682961	402141306	/nfs/dbraw/zinc/14/13/06/402141306.db2.gz	OPTZXPCMLXHNPR-UHFFFAOYSA-N	0	3	315.417	2.303	10	0		DEAEHN
CCCC(=O)N1CCCC[C@@H]1C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000123521044	402132429	/nfs/dbraw/zinc/13/24/29/402132429.db2.gz	ZFGWZLRMVAEONE-BZUAXINKSA-N	0	3	323.481	2.109	10	0		DEAEHN
Cc1cccc(CNC(=O)N[C@H](CN(C)C)c2ccccc2)n1	ZINC000123738596	402144087	/nfs/dbraw/zinc/14/40/87/402144087.db2.gz	VJLANFIAIKTBPT-QGZVFWFLSA-N	0	3	312.417	2.492	10	0		DEAEHN
CC(C(=O)N[C@@H](C)c1ccccc1)S(=O)(=O)c1nccs1	ZINC000068144714	402185207	/nfs/dbraw/zinc/18/52/07/402185207.db2.gz	XOCJXCCCPKPMIO-QWRGUYRKSA-N	0	3	324.427	2.183	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1cc(-c2cccnc2)on1	ZINC000068224089	402188190	/nfs/dbraw/zinc/18/81/90/402188190.db2.gz	UKERBOQSUNEIPK-CQSZACIVSA-N	0	3	316.405	2.443	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)N1CCN2CCCC[C@@H]2C1	ZINC000154104999	402192798	/nfs/dbraw/zinc/19/27/98/402192798.db2.gz	NUWNZLIYHIQAJI-IAGOWNOFSA-N	0	3	322.497	2.131	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1CCC(c2ccnn2C)CC1	ZINC000124798807	402198040	/nfs/dbraw/zinc/19/80/40/402198040.db2.gz	ZCPNWXWMMZAFBV-MRXNPFEDSA-N	0	3	304.438	2.001	10	0		DEAEHN
CCN(CCNC(=O)N(C)Cc1ccc(Cl)nc1)C1CC1	ZINC000102067396	402162359	/nfs/dbraw/zinc/16/23/59/402162359.db2.gz	AZWCBVLHLOHLRO-UHFFFAOYSA-N	0	3	310.829	2.361	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N(C)CCC1CCOCC1	ZINC000125214916	402219774	/nfs/dbraw/zinc/21/97/74/402219774.db2.gz	CZURVYWKCZBVSO-MRXNPFEDSA-N	0	3	313.486	2.421	10	0		DEAEHN
Cc1ccc(NC(=O)NCC2(C)COC2)c(OCCN(C)C)c1	ZINC000154685026	402225741	/nfs/dbraw/zinc/22/57/41/402225741.db2.gz	ILSOUTKNRWHLJI-UHFFFAOYSA-N	0	3	321.421	2.093	10	0		DEAEHN
C[C@@H]1CN(CC2CCN(C(=O)C3=COCCC3)CC2)C[C@H](C)O1	ZINC000107586587	402236030	/nfs/dbraw/zinc/23/60/30/402236030.db2.gz	WABIYFXKCPOAGX-GASCZTMLSA-N	0	3	322.449	2.029	10	0		DEAEHN
CCN(CC)CC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000154851637	402236197	/nfs/dbraw/zinc/23/61/97/402236197.db2.gz	QBFDYRBKHODUII-IBGZPJMESA-N	0	3	317.477	2.499	10	0		DEAEHN
CSCCC(=O)NC1CCN([C@H](C)c2ccncc2)CC1	ZINC000155262182	402250756	/nfs/dbraw/zinc/25/07/56/402250756.db2.gz	GXPQIVMBHJQGOM-CYBMUJFWSA-N	0	3	307.463	2.476	10	0		DEAEHN
O=C(CCN1CCN(C2CC2)CC1)Nc1cccc(Cl)c1	ZINC000125925073	402256758	/nfs/dbraw/zinc/25/67/58/402256758.db2.gz	MOABDKOJPHMLKB-UHFFFAOYSA-N	0	3	307.825	2.449	10	0		DEAEHN
CCOc1cccnc1C(=O)NC[C@H](C)N1CCC[C@H](C)C1	ZINC000176070653	402275377	/nfs/dbraw/zinc/27/53/77/402275377.db2.gz	MWGFPUMCLNQNQY-KBPBESRZSA-N	0	3	305.422	2.331	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1cc(F)ccc1C	ZINC000110085322	402281067	/nfs/dbraw/zinc/28/10/67/402281067.db2.gz	IZRDHNVVFQLOSJ-CQSZACIVSA-N	0	3	309.385	2.366	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000176132612	402281848	/nfs/dbraw/zinc/28/18/48/402281848.db2.gz	CMZFKXHXKQWJLQ-MRXNPFEDSA-N	0	3	324.428	2.470	10	0		DEAEHN
C[C@@H](NCC(=O)N1CC(=O)Nc2ccccc21)C1CCCC1	ZINC000184648086	402288155	/nfs/dbraw/zinc/28/81/55/402288155.db2.gz	NZMHSFUSVFFOIY-GFCCVEGCSA-N	0	3	301.390	2.140	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@H]1COc2ccccc2C1	ZINC000176235981	402293209	/nfs/dbraw/zinc/29/32/09/402293209.db2.gz	GDQPEALRQMFXAT-HZPDHXFCSA-N	0	3	317.433	2.116	10	0		DEAEHN
COc1c(CNC[C@](C)(O)c2cccc(Cl)c2)c(C)nn1C	ZINC000185112954	402325214	/nfs/dbraw/zinc/32/52/14/402325214.db2.gz	UMPMWXYRTYQEMJ-INIZCTEOSA-N	0	3	323.824	2.388	10	0		DEAEHN
O=C(c1c[nH]nc1-c1ccccc1F)N1CCN2CCC[C@@H]2C1	ZINC000176298897	402298067	/nfs/dbraw/zinc/29/80/67/402298067.db2.gz	HCQQMABILKNNQJ-GFCCVEGCSA-N	0	3	314.364	2.136	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1nc2c(s1)COCC2	ZINC000176357860	402302632	/nfs/dbraw/zinc/30/26/32/402302632.db2.gz	MLJSLLIPMDIIOH-NSHDSACASA-N	0	3	324.450	2.164	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1cnn(CC(F)F)c1	ZINC000176363531	402303317	/nfs/dbraw/zinc/30/33/17/402303317.db2.gz	IITYKBXWMGESLM-GFCCVEGCSA-N	0	3	315.368	2.096	10	0		DEAEHN
C[C@H](CCNCc1cccc(C(N)=O)c1)NC(=O)OC(C)(C)C	ZINC000222078810	402305794	/nfs/dbraw/zinc/30/57/94/402305794.db2.gz	LMWZXTVGWWRJTP-GFCCVEGCSA-N	0	3	321.421	2.178	10	0		DEAEHN
CO[C@@H](C)c1nc(C)c(C(=O)N2CC[C@H](N3CCCC3)C2)s1	ZINC000176399470	402306049	/nfs/dbraw/zinc/30/60/49/402306049.db2.gz	RVQLLBSVIKZWCX-STQMWFEESA-N	0	3	323.462	2.469	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)N2CCC[C@H](N(C)C)C2)s1	ZINC000176407872	402306552	/nfs/dbraw/zinc/30/65/52/402306552.db2.gz	JLPUZLGRFWISBE-NEPJUHHUSA-N	0	3	311.451	2.325	10	0		DEAEHN
O=C(NCc1ccccc1)C1CCN(CCOCC2CC2)CC1	ZINC000158593584	402308606	/nfs/dbraw/zinc/30/86/06/402308606.db2.gz	UYYFSTKDAGMUQY-UHFFFAOYSA-N	0	3	316.445	2.441	10	0		DEAEHN
CCN(CCNC(=O)N[C@H](C)COCc1ccccc1)C1CC1	ZINC000176457804	402311081	/nfs/dbraw/zinc/31/10/81/402311081.db2.gz	VEDROXCLWBDKQS-OAHLLOKOSA-N	0	3	319.449	2.375	10	0		DEAEHN
CCO[C@@H](CCNC(=O)N1CC[C@H](N(C)C)C1)C1CCCC1	ZINC000176504688	402315559	/nfs/dbraw/zinc/31/55/59/402315559.db2.gz	ORCFXENCBDKSLS-HOTGVXAUSA-N	0	3	311.470	2.317	10	0		DEAEHN
COc1ccc([C@@H](NC[C@@H](C)CS(C)(=O)=O)C2CC2)cc1	ZINC000176956414	402354224	/nfs/dbraw/zinc/35/42/24/402354224.db2.gz	HJCWROMCBMPLMX-WBMJQRKESA-N	0	3	311.447	2.417	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CCc1nnc(C(C)C)o1	ZINC000176973603	402355801	/nfs/dbraw/zinc/35/58/01/402355801.db2.gz	RDQVLBQTPGIPQA-CYBMUJFWSA-N	0	3	308.426	2.068	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(N2CCCC2)nc1	ZINC000176982425	402356838	/nfs/dbraw/zinc/35/68/38/402356838.db2.gz	XYMHEUCPWKQDIU-MRXNPFEDSA-N	0	3	316.449	2.238	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@@H](c1ccccc1)N(C)C	ZINC000177001249	402358126	/nfs/dbraw/zinc/35/81/26/402358126.db2.gz	FYYBZYIOKPSCNK-DLBZAZTESA-N	0	3	303.450	2.232	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)/C=C/c1ccncn1	ZINC000185534887	402359730	/nfs/dbraw/zinc/35/97/30/402359730.db2.gz	XTPDDHHUPPKNHM-HVHJFMEUSA-N	0	3	310.401	2.127	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CCc1nc(C(C)C)no1	ZINC000177028033	402360757	/nfs/dbraw/zinc/36/07/57/402360757.db2.gz	MTSBMKDKBWQMEU-CYBMUJFWSA-N	0	3	308.426	2.068	10	0		DEAEHN
COC[C@H](C)OC[C@H](O)CN(C)Cc1ccc(Cl)cc1	ZINC000234807348	402360810	/nfs/dbraw/zinc/36/08/10/402360810.db2.gz	GPJKYYCXCRTLCX-SWLSCSKDSA-N	0	3	301.814	2.184	10	0		DEAEHN
CCC1CCC(NC(=O)N[C@H](C)CCN2CCN(C)CC2)CC1	ZINC000185569368	402361979	/nfs/dbraw/zinc/36/19/79/402361979.db2.gz	GYZZMNAVWVMHSC-KLAILNCOSA-N	0	3	324.513	2.280	10	0		DEAEHN
CN(C)c1cc(C(=O)N2CC[C@@H](N(C)C)C2)c2ccccc2n1	ZINC000185820504	402380317	/nfs/dbraw/zinc/38/03/17/402380317.db2.gz	KEKNTMXQAKJZPQ-CYBMUJFWSA-N	0	3	312.417	2.077	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1C(=O)[C@@H](C)N1CCCCCC1	ZINC000177222543	402383052	/nfs/dbraw/zinc/38/30/52/402383052.db2.gz	LTOSSVRDPHXDHS-NVXWUHKLSA-N	0	3	318.465	2.447	10	0		DEAEHN
COC(=O)c1nc(N2CC[C@@H]3[C@@H](CCCN3C)C2)sc1C	ZINC000228208691	402336819	/nfs/dbraw/zinc/33/68/19/402336819.db2.gz	IXCKRQZORVIEHW-NWDGAFQWSA-N	0	3	309.435	2.159	10	0		DEAEHN
Cc1ccc(CS(=O)(=O)C(C)C(=O)N2CCCCC2)c(C)n1	ZINC000185246547	402337875	/nfs/dbraw/zinc/33/78/75/402337875.db2.gz	LZKNOZLGCZBTIL-AWEZNQCLSA-N	0	3	324.446	2.014	10	0		DEAEHN
CCC[C@H](C(=O)N1CCN(c2ccc(Cl)cn2)CC1)N(C)C	ZINC000161793069	402399670	/nfs/dbraw/zinc/39/96/70/402399670.db2.gz	PRINXMZQBRKECG-CQSZACIVSA-N	0	3	324.856	2.114	10	0		DEAEHN
CCC[C@H](C(=O)NCCc1nc2c(cccc2F)n1C)N(C)C	ZINC000162070742	402408650	/nfs/dbraw/zinc/40/86/50/402408650.db2.gz	VNNFMCZNZPYBGZ-CQSZACIVSA-N	0	3	320.412	2.101	10	0		DEAEHN
CN(C)C(=O)c1cccc(CN2CCN3CCCC[C@@H]3C2)c1	ZINC000177769647	402434718	/nfs/dbraw/zinc/43/47/18/402434718.db2.gz	DDSWEZZJRALHQL-QGZVFWFLSA-N	0	3	301.434	2.059	10	0		DEAEHN
COc1cccc(NC(=O)CCN2CCN3CCCC[C@@H]3C2)c1	ZINC000177774861	402434925	/nfs/dbraw/zinc/43/49/25/402434925.db2.gz	PGCLUMRMYPFMNK-MRXNPFEDSA-N	0	3	317.433	2.194	10	0		DEAEHN
CCOC(=O)[C@@H]1CCCN1CCN(C)Cc1ccc(F)cc1	ZINC000161616949	402393742	/nfs/dbraw/zinc/39/37/42/402393742.db2.gz	LWOMZEOKRVABOC-INIZCTEOSA-N	0	3	308.397	2.285	10	0		DEAEHN
CCc1nc(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cs1	ZINC000246119571	402511832	/nfs/dbraw/zinc/51/18/32/402511832.db2.gz	IHKDLHQGEZWOKY-AAEUAGOBSA-N	0	3	310.467	2.330	10	0		DEAEHN
O=C1NCCCC[C@@H]1N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000245589657	402473398	/nfs/dbraw/zinc/47/33/98/402473398.db2.gz	FUUCURVIZGMLFX-IKGGRYGDSA-N	0	3	302.418	2.243	10	0		DEAEHN
CSC[C@H](C)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245608314	402473805	/nfs/dbraw/zinc/47/38/05/402473805.db2.gz	AVJREGNFIHESFG-QEJZJMRPSA-N	0	3	307.463	2.483	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccnc(OC2CCC2)c1	ZINC000245628915	402475268	/nfs/dbraw/zinc/47/52/68/402475268.db2.gz	RXIIDKWWGSBZOB-ZFWWWQNUSA-N	0	3	315.417	2.322	10	0		DEAEHN
Cc1cc(CNC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)on1	ZINC000245653950	402477060	/nfs/dbraw/zinc/47/70/60/402477060.db2.gz	NPSLZBYYKYTGSV-CVEARBPZSA-N	0	3	314.389	2.228	10	0		DEAEHN
CN1CC[C@H](NC(=O)NC[C@@H]2CCCOC2)[C@H]1c1ccccc1	ZINC000245680215	402478762	/nfs/dbraw/zinc/47/87/62/402478762.db2.gz	VCGXVHBHVCZELA-BHYGNILZSA-N	0	3	317.433	2.158	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1Cc1nnc(-c2ccco2)o1	ZINC000178309189	402483520	/nfs/dbraw/zinc/48/35/20/402483520.db2.gz	KZKOKHYHRHJHNP-ZDUSSCGKSA-N	0	3	313.361	2.499	10	0		DEAEHN
COc1cc(CN(C)C[C@H]2CCC[C@H]2O)cc2c1OCCO2	ZINC000245743798	402484808	/nfs/dbraw/zinc/48/48/08/402484808.db2.gz	GLSJBZLVLXLMMI-ZIAGYGMSSA-N	0	3	307.390	2.059	10	0		DEAEHN
C[C@H]1CN(CC2=Cc3ccccc3OC2)C[C@H]1N1CCOCC1	ZINC000245767343	402486488	/nfs/dbraw/zinc/48/64/88/402486488.db2.gz	RBLDZNUEKZXJEF-MAUKXSAKSA-N	0	3	314.429	2.115	10	0		DEAEHN
CC(C)Cc1ncc(CN2C[C@@H](C)[C@H](N3CCOCC3)C2)s1	ZINC000245781553	402487904	/nfs/dbraw/zinc/48/79/04/402487904.db2.gz	UKNKZCMHFZIEIW-GDBMZVCRSA-N	0	3	323.506	2.494	10	0		DEAEHN
CN(C[C@@H]1COc2ccccc2O1)[C@H]1Cc2ccccc2[C@@H]1O	ZINC000245868621	402492792	/nfs/dbraw/zinc/49/27/92/402492792.db2.gz	QWZPKFVUXGRVBN-ALKREAHSSA-N	0	3	311.381	2.417	10	0		DEAEHN
Cn1c(CN2CCN(C)CC23CCCCC3)nnc1C1CC1	ZINC000178399416	402493998	/nfs/dbraw/zinc/49/39/98/402493998.db2.gz	ITFGDSBBBQKLBC-UHFFFAOYSA-N	0	3	303.454	2.143	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)Cc2ccccc2)[C@@H](C)C1	ZINC000246041749	402505646	/nfs/dbraw/zinc/50/56/46/402505646.db2.gz	BFUKFUDAVWVSLD-HOCLYGCPSA-N	0	3	310.463	2.179	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccccc1F	ZINC000246078996	402508156	/nfs/dbraw/zinc/50/81/56/402508156.db2.gz	FRLIHXSSWMKRSI-STQMWFEESA-N	0	3	312.410	2.073	10	0		DEAEHN
COc1ccccc1C/C(C)=C/C(=O)N1CCN2CCC[C@H]2C1	ZINC000170946116	402543770	/nfs/dbraw/zinc/54/37/70/402543770.db2.gz	VTJQEFBDNXKSFA-VOGRQWBCSA-N	0	3	314.429	2.491	10	0		DEAEHN
O=C1[C@H](N2CCN3CCC[C@H]3C2)CCCN1c1cccc(F)c1	ZINC000246812585	402545579	/nfs/dbraw/zinc/54/55/79/402545579.db2.gz	OEGINSPNMGSFHZ-DLBZAZTESA-N	0	3	317.408	2.101	10	0		DEAEHN
O=C(NCCC1=CCCC1)N1CCN(CC2CCOCC2)CC1	ZINC000178867920	402548393	/nfs/dbraw/zinc/54/83/93/402548393.db2.gz	KHPWQVMDICHTFC-UHFFFAOYSA-N	0	3	321.465	2.241	10	0		DEAEHN
O=C(CN1CCC[C@@H]2CCC[C@@H]21)N1CCO[C@H]2CCCC[C@H]21	ZINC000247700731	402574744	/nfs/dbraw/zinc/57/47/44/402574744.db2.gz	XUXCOLHXGUTGAN-NXOAAHMSSA-N	0	3	306.450	2.421	10	0		DEAEHN
C[C@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N1CCCN(C2CC2)CC1	ZINC000178869380	402548836	/nfs/dbraw/zinc/54/88/36/402548836.db2.gz	LKFABFQJNBZNID-OWCLPIDISA-N	0	3	307.482	2.335	10	0		DEAEHN
CCC(=O)Nc1ccc(NC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000171077696	402555140	/nfs/dbraw/zinc/55/51/40/402555140.db2.gz	VNCFAQTVRNRTRT-AWEZNQCLSA-N	0	3	304.394	2.203	10	0		DEAEHN
COCCCOc1ccccc1NC(=O)N1CC[C@H](N(C)C)C1	ZINC000171080700	402555971	/nfs/dbraw/zinc/55/59/71/402555971.db2.gz	QWNRROJXKLFTFV-AWEZNQCLSA-N	0	3	321.421	2.270	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cn(-c3ccccc3)nc2C)C1	ZINC000171088096	402556409	/nfs/dbraw/zinc/55/64/09/402556409.db2.gz	DSEKUPXSPQHCDV-OAHLLOKOSA-N	0	3	312.417	2.395	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1Cc1nc(-c2ccsc2)no1	ZINC000247162408	402558936	/nfs/dbraw/zinc/55/89/36/402558936.db2.gz	KKMVXHOHWPVFNG-AAEUAGOBSA-N	0	3	304.419	2.467	10	0		DEAEHN
CCOCCN1CCN(C[C@@H](O)c2ccccc2)C[C@@H]1CC	ZINC000247238694	402560558	/nfs/dbraw/zinc/56/05/58/402560558.db2.gz	SBFHFYLWMGJQGZ-ZWKOTPCHSA-N	0	3	306.450	2.153	10	0		DEAEHN
COCCCN1CCC(NC(=O)N[C@H](C)c2ccc(C)o2)CC1	ZINC000171192031	402565152	/nfs/dbraw/zinc/56/51/52/402565152.db2.gz	ROKQPGLFPSUHIX-CQSZACIVSA-N	0	3	323.437	2.449	10	0		DEAEHN
C[C@@H](NC(=O)CN1CCN2CCC[C@@H]2C1)c1ccc(Cl)cc1	ZINC000178619581	402518236	/nfs/dbraw/zinc/51/82/36/402518236.db2.gz	XMEFICWUWBLAFF-CZUORRHYSA-N	0	3	321.852	2.297	10	0		DEAEHN
O=C(CN1CCN2CCC[C@@H]2C1)Nc1cc(Cl)ccc1F	ZINC000178627282	402518821	/nfs/dbraw/zinc/51/88/21/402518821.db2.gz	DEBIOYOIAWGRGL-GFCCVEGCSA-N	0	3	311.788	2.198	10	0		DEAEHN
C[C@H]1CCc2ccccc2N1C(=O)CN1CCN2CCC[C@@H]2C1	ZINC000178634342	402520177	/nfs/dbraw/zinc/52/01/77/402520177.db2.gz	RKRVLLCNVDXQGB-DOTOQJQBSA-N	0	3	313.445	2.134	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC[C@@H](n2ccnc2CC)C1)N(C)C	ZINC000179110093	402573475	/nfs/dbraw/zinc/57/34/75/402573475.db2.gz	JLGBSVQBZVVQAP-CABCVRRESA-N	0	3	306.454	2.339	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@@H](c2cccc(F)c2)C1)N(C)C	ZINC000178656541	402522399	/nfs/dbraw/zinc/52/23/99/402522399.db2.gz	GKNTWTZXFFDZPK-HZPDHXFCSA-N	0	3	308.397	2.456	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC[C@@H](n2ccnc2CC)C1)N(C)C	ZINC000179110109	402573650	/nfs/dbraw/zinc/57/36/50/402573650.db2.gz	JLGBSVQBZVVQAP-HUUCEWRRSA-N	0	3	306.454	2.339	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000246324688	402525257	/nfs/dbraw/zinc/52/52/57/402525257.db2.gz	NEONIFQZFMDFSN-FVQBIDKESA-N	0	3	317.433	2.492	10	0		DEAEHN
CC[C@H](Oc1ccccc1C)C(=O)N1CCN2CCC[C@H]2C1	ZINC000246397386	402529105	/nfs/dbraw/zinc/52/91/05/402529105.db2.gz	FCIZZGKHUHZTGH-HOTGVXAUSA-N	0	3	302.418	2.459	10	0		DEAEHN
Cc1noc(C)c1C[C@H](C)NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000246405216	402529496	/nfs/dbraw/zinc/52/94/96/402529496.db2.gz	RTLMGXQKMNTGHL-HUBLWGQQSA-N	0	3	322.453	2.347	10	0		DEAEHN
COc1ccc(F)cc1[C@@H](C)NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170830869	402530380	/nfs/dbraw/zinc/53/03/80/402530380.db2.gz	XNDHLKYVIIQQID-DGCLKSJQSA-N	0	3	309.385	2.241	10	0		DEAEHN
CC(C)COC[C@@H](NC(=O)N1CC[C@H](N(C)C)C1)c1ccco1	ZINC000170836066	402531562	/nfs/dbraw/zinc/53/15/62/402531562.db2.gz	BFZDQVSLKXLUEH-LSDHHAIUSA-N	0	3	323.437	2.339	10	0		DEAEHN
CC(C)COC[C@H](NC(=O)N1CC[C@H](N(C)C)C1)c1ccco1	ZINC000170836065	402531575	/nfs/dbraw/zinc/53/15/75/402531575.db2.gz	BFZDQVSLKXLUEH-GJZGRUSLSA-N	0	3	323.437	2.339	10	0		DEAEHN
C/C=C/c1ccc(OCC(=O)N2CC[C@@H](N(C)C)C2)c(OC)c1	ZINC000170861252	402534187	/nfs/dbraw/zinc/53/41/87/402534187.db2.gz	WPISYVFWEHUHFL-LLYBFZRZSA-N	0	3	318.417	2.270	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)NCCC(C)(C)C	ZINC000178748422	402534488	/nfs/dbraw/zinc/53/44/88/402534488.db2.gz	XMYZJAKTENGITE-HNNXBMFYSA-N	0	3	306.454	2.208	10	0		DEAEHN
COC(=O)c1cccc(OCCN2CC[C@H](C)[C@@H](OC)C2)c1	ZINC000189348683	402534555	/nfs/dbraw/zinc/53/45/55/402534555.db2.gz	QQKUEEKNYOWCFG-BBRMVZONSA-N	0	3	307.390	2.209	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cccn2Cc2cccs2)C1	ZINC000170864638	402535072	/nfs/dbraw/zinc/53/50/72/402535072.db2.gz	SAWYUOSCORYTSE-ZDUSSCGKSA-N	0	3	303.431	2.374	10	0		DEAEHN
Cc1oc(-c2ccsc2)nc1CC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170868359	402535633	/nfs/dbraw/zinc/53/56/33/402535633.db2.gz	RWXBOFCGBXPPTQ-CYBMUJFWSA-N	0	3	319.430	2.417	10	0		DEAEHN
CCOCCN1CCN(Cc2cccc(COC)c2)C[C@@H]1C	ZINC000179212928	402581532	/nfs/dbraw/zinc/58/15/32/402581532.db2.gz	DDMAQUTVACFFSG-INIZCTEOSA-N	0	3	306.450	2.376	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cccc(NC(=O)OC)c2)C1	ZINC000171479463	402589424	/nfs/dbraw/zinc/58/94/24/402589424.db2.gz	CEJGJOPWGCAYPG-AWEZNQCLSA-N	0	3	305.378	2.079	10	0		DEAEHN
Cn1cc(CN2CCC(n3cncn3)CC2)c(C(C)(C)C)n1	ZINC000179902578	402603154	/nfs/dbraw/zinc/60/31/54/402603154.db2.gz	FZHRRDOPAVHIIU-UHFFFAOYSA-N	0	3	302.426	2.146	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@@](C)(O)C2CCCCC2)C1	ZINC000248812937	402609347	/nfs/dbraw/zinc/60/93/47/402609347.db2.gz	CNMMMZQTSSCFHH-NVXWUHKLSA-N	0	3	311.470	2.101	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)[C@H]2CCOC[C@H]2C)CN1Cc1ccccc1	ZINC000248833280	402609959	/nfs/dbraw/zinc/60/99/59/402609959.db2.gz	MXPDGWRZQNSISH-LMSBXDPUSA-N	0	3	316.445	2.438	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@@](C)(OC)c2ccccc2F)C1	ZINC000248846193	402611140	/nfs/dbraw/zinc/61/11/40/402611140.db2.gz	RUCKTAKWJJOCGI-DYVFJYSZSA-N	0	3	308.397	2.288	10	0		DEAEHN
C[C@H]1CN(CCC(=O)NC(=O)Nc2ccccc2)CCS1	ZINC000171695968	402611323	/nfs/dbraw/zinc/61/13/23/402611323.db2.gz	VYNWKDFOCXUZSJ-LBPRGKRZSA-N	0	3	307.419	2.162	10	0		DEAEHN
C[C@H](CNC(=O)c1cn2ccnc2s1)N1CCC[C@@H](C)C1	ZINC000248963861	402616147	/nfs/dbraw/zinc/61/61/47/402616147.db2.gz	RKASKDVCXIHCQQ-VXGBXAGGSA-N	0	3	306.435	2.246	10	0		DEAEHN
C[C@@H](CC(=O)N(C)c1ccccc1)NCC1(C)OCCCO1	ZINC000190661681	402616582	/nfs/dbraw/zinc/61/65/82/402616582.db2.gz	FMRNRAYUVRRZJI-AWEZNQCLSA-N	0	3	306.406	2.171	10	0		DEAEHN
O=C([C@@H]1C[C@@H]1c1ccc(F)c(F)c1)N1CCN2CCC[C@@H]2C1	ZINC000171744913	402617569	/nfs/dbraw/zinc/61/75/69/402617569.db2.gz	NMHZQBXHURNWSS-MGPQQGTHSA-N	0	3	306.356	2.375	10	0		DEAEHN
CC(C)c1nc2n(n1)C[C@H](N[C@@H]1CCCc3c1cnn3C)CC2	ZINC000180635358	402622190	/nfs/dbraw/zinc/62/21/90/402622190.db2.gz	KTYQICBHBZLPKZ-TZMCWYRMSA-N	0	3	314.437	2.117	10	0		DEAEHN
COC(=O)[C@H]1C[C@@H](c2ccccc2)CN(Cc2c[nH]nc2C)C1	ZINC000180721102	402624577	/nfs/dbraw/zinc/62/45/77/402624577.db2.gz	BHBNACHHOFJCDI-CVEARBPZSA-N	0	3	313.401	2.497	10	0		DEAEHN
CC[C@](C)(O)CN1CCC[C@@H](N(C)C(=O)OC(C)(C)C)C1	ZINC000249433703	402629637	/nfs/dbraw/zinc/62/96/37/402629637.db2.gz	ZPSMRUWXXHLWKE-CJNGLKHVSA-N	0	3	300.443	2.479	10	0		DEAEHN
CCc1ccccc1S(=O)(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000249489246	402631219	/nfs/dbraw/zinc/63/12/19/402631219.db2.gz	XYCIQFDAZNWPCX-UKRRQHHQSA-N	0	3	310.463	2.256	10	0		DEAEHN
Cc1ccc(CNC(=O)CN(C)[C@@]2(CO)CC[C@@H](C)C2)cc1	ZINC000249545598	402634056	/nfs/dbraw/zinc/63/40/56/402634056.db2.gz	GETFXUVBAZIEMU-QAPCUYQASA-N	0	3	304.434	2.094	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)COc1ccc(F)cc1F	ZINC000172060045	402638768	/nfs/dbraw/zinc/63/87/68/402638768.db2.gz	HZNWHOACKRLUGN-DGCLKSJQSA-N	0	3	310.344	2.039	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCSCC[C@@H]1C	ZINC000191119642	402643595	/nfs/dbraw/zinc/64/35/95/402643595.db2.gz	QXEPDAZIGQOGKH-KBPBESRZSA-N	0	3	301.500	2.500	10	0		DEAEHN
COC[C@@H](N[C@H](CO)c1cccc(Br)c1)C1CC1	ZINC000181391058	402644284	/nfs/dbraw/zinc/64/42/84/402644284.db2.gz	XOIBIQOHMKBJEW-ZIAGYGMSSA-N	0	3	314.223	2.497	10	0		DEAEHN
CC(C)C[C@@H]1OCCC[C@H]1NC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000251552710	402648303	/nfs/dbraw/zinc/64/83/03/402648303.db2.gz	HTVDMMMZJAXPNA-ZACQAIPSSA-N	0	3	321.465	2.236	10	0		DEAEHN
C[C@H]1OCCC[C@H]1C(=O)NCCCN(C)Cc1ccccc1	ZINC000191312805	402660197	/nfs/dbraw/zinc/66/01/97/402660197.db2.gz	KQFUIBBSIQDEEL-NVXWUHKLSA-N	0	3	304.434	2.440	10	0		DEAEHN
Cc1nc(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)sc1C	ZINC000173650079	402706870	/nfs/dbraw/zinc/70/68/70/402706870.db2.gz	HURMKTKXPORPNL-ZWNOBZJWSA-N	0	3	310.467	2.384	10	0		DEAEHN
CCC(CC)CS(=O)(=O)N1C[C@H]2CCCN2C[C@H]1CC	ZINC000173831324	402714637	/nfs/dbraw/zinc/71/46/37/402714637.db2.gz	XTHTVIMIFYHDNM-HUUCEWRRSA-N	0	3	302.484	2.311	10	0		DEAEHN
COc1ccnc(N2CCN(C[C@H](O)C3CCCCC3)CC2)c1	ZINC000191333304	402661448	/nfs/dbraw/zinc/66/14/48/402661448.db2.gz	JIHOMFHRPMIQHP-KRWDZBQOSA-N	0	3	319.449	2.153	10	0		DEAEHN
COc1ccc(-c2n[nH]cc2CNCC2(C)OCCCO2)cc1	ZINC000192251479	402719225	/nfs/dbraw/zinc/71/92/25/402719225.db2.gz	ILXPNTOPTRYYDI-UHFFFAOYSA-N	0	3	317.389	2.328	10	0		DEAEHN
C[C@H](CNC(=O)[C@@H]1CCCO[C@H]1C)N(C)Cc1ccccc1	ZINC000191564691	402678719	/nfs/dbraw/zinc/67/87/19/402678719.db2.gz	YGRZZUYBNXEYAR-HLLBOEOZSA-N	0	3	304.434	2.438	10	0		DEAEHN
CC[C@H]1CN(CCCOCc2ccccc2)CCN1C[C@@H](C)O	ZINC000182341298	402682328	/nfs/dbraw/zinc/68/23/28/402682328.db2.gz	VUZVYSALAWFXKY-MJGOQNOKSA-N	0	3	320.477	2.370	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@H](C)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000173215436	402688706	/nfs/dbraw/zinc/68/87/06/402688706.db2.gz	ZKDAUBPUQCVBSF-WOSRLPQWSA-N	0	3	320.481	2.157	10	0		DEAEHN
COc1cccc(F)c1[C@H](C)NC(=O)NC1CCN(C)CC1	ZINC000173393598	402695688	/nfs/dbraw/zinc/69/56/88/402695688.db2.gz	FQDQWNOCAQNASH-NSHDSACASA-N	0	3	309.385	2.289	10	0		DEAEHN
Cc1cnc([C@H](NC(=O)N2CCN3CCC[C@@H]3C2)C2CC2)s1	ZINC000173507268	402700936	/nfs/dbraw/zinc/70/09/36/402700936.db2.gz	SHELAARZQHBWPD-ZIAGYGMSSA-N	0	3	320.462	2.392	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NCCCC(C)(C)CO)c1ccccc1	ZINC000173562735	402703167	/nfs/dbraw/zinc/70/31/67/402703167.db2.gz	MXYKADAYFXSDHD-MRXNPFEDSA-N	0	3	321.465	2.387	10	0		DEAEHN
CC[C@H](CO)N1CCN(Cc2cc(F)cc3cccnc32)CC1	ZINC000174134966	402728199	/nfs/dbraw/zinc/72/81/99/402728199.db2.gz	ZCERUQGHCORLKH-QGZVFWFLSA-N	0	3	317.408	2.262	10	0		DEAEHN
CCc1ccc([C@@H](COC)NC(=O)N[C@@H]2CCCN(CC)C2)o1	ZINC000174236513	402733413	/nfs/dbraw/zinc/73/34/13/402733413.db2.gz	SPWVCAUDILRVDZ-UKRRQHHQSA-N	0	3	323.437	2.313	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@@H](C)Oc2ccccc2F)C1	ZINC000174235572	402733431	/nfs/dbraw/zinc/73/34/31/402733431.db2.gz	LPYUAHGYJVIAEX-ZIAGYGMSSA-N	0	3	323.412	2.377	10	0		DEAEHN
CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@H](C)[C@@H]2CCCO2)c1	ZINC000183142380	402743031	/nfs/dbraw/zinc/74/30/31/402743031.db2.gz	FVFSHXAHSBBSSM-WQGACYEGSA-N	0	3	319.405	2.129	10	0		DEAEHN
COc1ccc(Cl)cc1NC(=O)CN[C@@H](C)[C@@H]1CCCO1	ZINC000183152629	402743469	/nfs/dbraw/zinc/74/34/69/402743469.db2.gz	KAFZJCUNAKNXIT-GWCFXTLKSA-N	0	3	312.797	2.444	10	0		DEAEHN
CC[C@@H](OC1CCCCC1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263249301	402750237	/nfs/dbraw/zinc/75/02/37/402750237.db2.gz	PPXCJQSHASLFEK-UONOGXRCSA-N	0	3	308.426	2.446	10	0		DEAEHN
C/C(=C\c1ccc(F)cc1)c1nc([C@H]2CNCCN2C)no1	ZINC000263268831	402752609	/nfs/dbraw/zinc/75/26/09/402752609.db2.gz	RXFJCTMVLOZLHK-CFRMROPGSA-N	0	3	302.353	2.345	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2cccc(Br)c2)n1	ZINC000263318005	402758326	/nfs/dbraw/zinc/75/83/26/402758326.db2.gz	ZUDZDEZGMBDKSG-NSHDSACASA-N	0	3	323.194	2.075	10	0		DEAEHN
C[C@@H](C(=O)N1CC[C@H](C(=O)OC(C)(C)C)C1)N1CCCCCC1	ZINC000174955302	402765877	/nfs/dbraw/zinc/76/58/77/402765877.db2.gz	YDYPXPKZLNYWSF-GJZGRUSLSA-N	0	3	324.465	2.441	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@H](C(=O)OC(C)(C)C)C1)N1CCCCCC1	ZINC000174955322	402766327	/nfs/dbraw/zinc/76/63/27/402766327.db2.gz	YDYPXPKZLNYWSF-CABCVRRESA-N	0	3	324.465	2.441	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@@H](C(=O)OC(C)(C)C)C1)N1CCCCCC1	ZINC000174955351	402766349	/nfs/dbraw/zinc/76/63/49/402766349.db2.gz	YDYPXPKZLNYWSF-HUUCEWRRSA-N	0	3	324.465	2.441	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2nnc(CC(C)C)s2)C1	ZINC000194320477	402792013	/nfs/dbraw/zinc/79/20/13/402792013.db2.gz	PXWJUDWJTFCPBO-NSHDSACASA-N	0	3	311.455	2.342	10	0		DEAEHN
C=Cn1cc(CN[C@@H]2CCN(C(=O)C3CCCCC3)C2)cn1	ZINC000194369174	402794039	/nfs/dbraw/zinc/79/40/39/402794039.db2.gz	IWQDQWFDKINVDJ-MRXNPFEDSA-N	0	3	302.422	2.254	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)NCCC1=CCCCC1	ZINC000175341223	402798436	/nfs/dbraw/zinc/79/84/36/402798436.db2.gz	VCIQKHMTNIBICO-QGZVFWFLSA-N	0	3	307.482	2.409	10	0		DEAEHN
CC(C)Oc1cccc(CC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000195338743	402842784	/nfs/dbraw/zinc/84/27/84/402842784.db2.gz	XXIGTMKEKYSYCB-MRXNPFEDSA-N	0	3	302.418	2.323	10	0		DEAEHN
Cc1nccn1CCCCNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000175466376	402808950	/nfs/dbraw/zinc/80/89/50/402808950.db2.gz	FWBNNTQIMUKUAH-ZBFHGGJFSA-N	0	3	321.469	2.096	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)CCCc1nc2ccccc2[nH]1	ZINC000194703733	402811642	/nfs/dbraw/zinc/81/16/42/402811642.db2.gz	SLCFKTWVINQDNL-ZDUSSCGKSA-N	0	3	300.406	2.096	10	0		DEAEHN
Cc1nn(CC(C)C)c(C)c1CCC(=O)NC[C@@H]1CCCN1C	ZINC000194721373	402812240	/nfs/dbraw/zinc/81/22/40/402812240.db2.gz	UAUHJEPIQDVFSM-INIZCTEOSA-N	0	3	320.481	2.299	10	0		DEAEHN
COc1cc(C(=O)NC[C@@H]2CCCN2C)ccc1OC(F)F	ZINC000194748470	402814448	/nfs/dbraw/zinc/81/44/48/402814448.db2.gz	LGGDVCWRGILVDU-NSHDSACASA-N	0	3	314.332	2.121	10	0		DEAEHN
CCN1CCN(CCCCNC(=O)N2C[C@H](C)CC[C@H]2C)CC1	ZINC000175531912	402815322	/nfs/dbraw/zinc/81/53/22/402815322.db2.gz	QUPZZQKSDXSOIF-IAGOWNOFSA-N	0	3	324.513	2.234	10	0		DEAEHN
C[C@H](CNC(=O)[C@H]1C[C@H](C)CC(C)(C)C1)CN1CCN(C)CC1	ZINC000184067270	402815812	/nfs/dbraw/zinc/81/58/12/402815812.db2.gz	BEGKYCHOYGBQAV-BBWFWOEESA-N	0	3	323.525	2.449	10	0		DEAEHN
COc1ccc(/C=C/C(=O)N2CCCN(C3CC3)CC2)cc1O	ZINC000184317341	402834814	/nfs/dbraw/zinc/83/48/14/402834814.db2.gz	DHWXVHFZAZBWLN-XBXARRHUSA-N	0	3	316.401	2.111	10	0		DEAEHN
CCc1cc(C(=O)N[C@H](C)CCN2CCN(C)CC2)oc1CC	ZINC000184398121	402840976	/nfs/dbraw/zinc/84/09/76/402840976.db2.gz	JHTIPTLVTRRYQB-CQSZACIVSA-N	0	3	321.465	2.160	10	0		DEAEHN
CC[C@@H](C(=O)Nc1ccc(OC)cc1)N1CCN2CCC[C@@H]2C1	ZINC000175205905	402788116	/nfs/dbraw/zinc/78/81/16/402788116.db2.gz	JREROTMUKGNMJC-WBVHZDCISA-N	0	3	317.433	2.192	10	0		DEAEHN
CCN(CC)C(=O)[C@H](C)N1CC[C@H](CNc2ccccn2)C1	ZINC000195515908	402848909	/nfs/dbraw/zinc/84/89/09/402848909.db2.gz	SIVTTZCUNSJKGQ-LSDHHAIUSA-N	0	3	304.438	2.072	10	0		DEAEHN
c1cc(CNCCCO[C@@H]2CCOC2)n(-c2ccccc2)n1	ZINC000279133309	402907641	/nfs/dbraw/zinc/90/76/41/402907641.db2.gz	MYKLHUQMORQUNM-QGZVFWFLSA-N	0	3	301.390	2.158	10	0		DEAEHN
CCO[C@H]1C[C@H](NCc2cc(OC)cc(C)n2)C12CCOCC2	ZINC000274400823	403051873	/nfs/dbraw/zinc/05/18/73/403051873.db2.gz	FPSDKJARBAGNJF-IRXDYDNUSA-N	0	3	320.433	2.462	10	0		DEAEHN
Cc1nc(C)c(CN[C@H]2CCCC[C@H]2n2cc(CO)nn2)s1	ZINC000276316869	403163581	/nfs/dbraw/zinc/16/35/81/403163581.db2.gz	NRQOVIIXFROEKV-UONOGXRCSA-N	0	3	321.450	2.117	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)c2ncnc3c2ncn3C2CC2)CCN1C	ZINC000292665071	403374364	/nfs/dbraw/zinc/37/43/64/403374364.db2.gz	HKPMGIKHCCZAAZ-YPMHNXCESA-N	0	3	300.410	2.080	10	0		DEAEHN
C[C@H](CNC(=O)c1ccc2c(c1)NC(=O)C2(C)C)N(C)C1CC1	ZINC000293077860	403388524	/nfs/dbraw/zinc/38/85/24/403388524.db2.gz	QCIYYXSXINNRHD-LLVKDONJSA-N	0	3	315.417	2.129	10	0		DEAEHN
CCn1ccnc1[C@@H](NCC1CCOCC1)C1CCOCC1	ZINC000343404327	403573855	/nfs/dbraw/zinc/57/38/55/403573855.db2.gz	RGTBTUZRIZRYFM-INIZCTEOSA-N	0	3	307.438	2.387	10	0		DEAEHN
CCO[C@@H]1CCCC[C@H]1NCC(=O)N1CCO[C@H]2CCCC[C@@H]21	ZINC000333065856	403658307	/nfs/dbraw/zinc/65/83/07/403658307.db2.gz	JCIWRDIOKJJSNQ-TWMKSMIVSA-N	0	3	324.465	2.094	10	0		DEAEHN
CC[C@H]1CN(c2ncnc3c(F)cccc32)CCN1CCOC	ZINC000302660894	403712942	/nfs/dbraw/zinc/71/29/42/403712942.db2.gz	IHFJUFHIGZICFJ-ZDUSSCGKSA-N	0	3	318.396	2.316	10	0		DEAEHN
c1nc(-c2ccncc2)sc1CNCCN1CCSCC1	ZINC000347832728	403899634	/nfs/dbraw/zinc/89/96/34/403899634.db2.gz	OVBUASJWBWQOSL-UHFFFAOYSA-N	0	3	320.487	2.344	10	0		DEAEHN
CC(C)(C)OCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000308511236	403957090	/nfs/dbraw/zinc/95/70/90/403957090.db2.gz	GXXGUWJXTBWPKB-CYBMUJFWSA-N	0	3	301.814	2.484	10	0		DEAEHN
COCCC1(C)CN(C(=O)N[C@H](C)CN2CCC[C@@H](C)C2)C1	ZINC000358526209	292299508	/nfs/dbraw/zinc/29/95/08/292299508.db2.gz	BDPVRWOJRJJOTP-HUUCEWRRSA-N	0	3	311.470	2.175	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N)CCN2C(=O)Cc1c(C)noc1C	ZINC000365478471	286420905	/nfs/dbraw/zinc/42/09/05/286420905.db2.gz	ALSSACOHXHZFIB-HNNXBMFYSA-N	0	3	315.373	2.279	10	0		DEAEHN
CN(Cc1csnn1)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000328637248	404118653	/nfs/dbraw/zinc/11/86/53/404118653.db2.gz	ONCISPYARONPQA-ZFWWWQNUSA-N	0	3	303.435	2.058	10	0		DEAEHN
C[C@H](NC(=O)C1CCCCC1)C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000337949336	404328567	/nfs/dbraw/zinc/32/85/67/404328567.db2.gz	IHIRISOZKKPQCS-OFQRWUPVSA-N	0	3	323.481	2.013	10	0		DEAEHN
CO[C@@H]1COC[C@H]1n1cc(CN[C@@H]2CCC(C)(C)C[C@H]2C)nn1	ZINC000329545249	404371723	/nfs/dbraw/zinc/37/17/23/404371723.db2.gz	ZHAUQEALZOAGBA-DTZQCDIJSA-N	0	3	322.453	2.169	10	0		DEAEHN
CCS(=O)(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccccc1	ZINC000364674793	404495528	/nfs/dbraw/zinc/49/55/28/404495528.db2.gz	KLMURJKKZIBOES-CVEARBPZSA-N	0	3	308.447	2.075	10	0		DEAEHN
CC(=O)c1cccc(OC[C@H](O)CN(C(C)C)[C@H]2CCOC2)c1	ZINC000291953152	404597753	/nfs/dbraw/zinc/59/77/53/404597753.db2.gz	UQDHVGGJMKPNKV-DLBZAZTESA-N	0	3	321.417	2.128	10	0		DEAEHN
Cc1nc([C@H](C)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)no1	ZINC000330251722	404601718	/nfs/dbraw/zinc/60/17/18/404601718.db2.gz	NRIGRMXAVJHSJA-IHRRRGAJSA-N	0	3	322.453	2.260	10	0		DEAEHN
C/C(=C/c1ccc(Cl)cc1)CNCCS(=O)(=O)N(C)C	ZINC000353095000	404741842	/nfs/dbraw/zinc/74/18/42/404741842.db2.gz	OULBEBBOVBKARI-BENRWUELSA-N	0	3	316.854	2.224	10	0		DEAEHN
COc1ccccc1N1CCC[C@H](NCC2=CCCOC2)C1=O	ZINC000378188780	404887817	/nfs/dbraw/zinc/88/78/17/404887817.db2.gz	FMSVKCMVCQKMDA-HNNXBMFYSA-N	0	3	316.401	2.127	10	0		DEAEHN
CC(=O)N1CC[C@H](CN(C)Cc2cncc(C(F)(F)F)c2)C1	ZINC000361322868	405023134	/nfs/dbraw/zinc/02/31/34/405023134.db2.gz	ASETUMVGLOVMFB-GFCCVEGCSA-N	0	3	315.339	2.401	10	0		DEAEHN
CC1CCC(O)(CN2CCOC[C@@H]2[C@@H]2CCCC[C@H]2O)CC1	ZINC000408040854	405097194	/nfs/dbraw/zinc/09/71/94/405097194.db2.gz	AFTIDHSPQYCUNW-XTJLLSPMSA-N	0	3	311.466	2.180	10	0		DEAEHN
Cn1c2ccc(CN3CC[C@@]4(O)CCCC[C@H]4C3)cc2oc1=O	ZINC000408066787	405102565	/nfs/dbraw/zinc/10/25/65/405102565.db2.gz	CRZWQEHNZXPKRU-KSSFIOAISA-N	0	3	316.401	2.259	10	0		DEAEHN
COC1(CN2CCN(c3ccnc(C)n3)CC2)CCCCC1	ZINC000361593454	405153037	/nfs/dbraw/zinc/15/30/37/405153037.db2.gz	ICCBQZRLROLXHT-UHFFFAOYSA-N	0	3	304.438	2.256	10	0		DEAEHN
CSc1c(F)cccc1C(=O)NCCNc1ccncc1	ZINC000438252646	405239860	/nfs/dbraw/zinc/23/98/60/405239860.db2.gz	CNILSLLBQUXXKM-UHFFFAOYSA-N	0	3	305.378	2.206	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NC[C@H](Cc1ccccc1)OC	ZINC000452834666	405249470	/nfs/dbraw/zinc/24/94/70/405249470.db2.gz	YXERAWKRKZBKJD-DLBZAZTESA-N	0	3	304.434	2.235	10	0		DEAEHN
COc1cccc(CCNCc2cc(C(F)(F)F)n[nH]2)n1	ZINC000440624435	405319790	/nfs/dbraw/zinc/31/97/90/405319790.db2.gz	ATVQJPWZACDYBF-UHFFFAOYSA-N	0	3	300.284	2.164	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@@H](C)N2C[C@H]3CCC[C@@H](C2)N3)c1	ZINC000420351417	405329438	/nfs/dbraw/zinc/32/94/38/405329438.db2.gz	WZZGKXSNDLLWNZ-JLZZUVOBSA-N	0	3	315.417	2.043	10	0		DEAEHN
O=S1(=O)CCCN1CCNC1(c2ccccc2)CCCCC1	ZINC000440920747	405330958	/nfs/dbraw/zinc/33/09/58/405330958.db2.gz	UTEDFEVEKFDNNM-UHFFFAOYSA-N	0	3	322.474	2.471	10	0		DEAEHN
CS(=O)(=O)c1cccc(CN2CCC[C@H](N3CCCC3)C2)c1	ZINC000449019466	405502059	/nfs/dbraw/zinc/50/20/59/405502059.db2.gz	WQGZQNWSJGXFOK-INIZCTEOSA-N	0	3	322.474	2.150	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2cc(C)ccc2C)CC12COC2	ZINC000449367541	405529511	/nfs/dbraw/zinc/52/95/11/405529511.db2.gz	WYHXMNAIOLGHLY-INIZCTEOSA-N	0	3	303.402	2.315	10	0		DEAEHN
CC(C)(CN1CCCC1)NC(=O)c1cc(-c2cccnc2)on1	ZINC000457060986	405676463	/nfs/dbraw/zinc/67/64/63/405676463.db2.gz	YRKQDTDICKLECW-UHFFFAOYSA-N	0	3	314.389	2.341	10	0		DEAEHN
CC(=O)c1cc(C(=O)N[C@@H]2C[C@@H](N(C)C)C2(C)C)c(C)nc1C	ZINC000636103079	405742567	/nfs/dbraw/zinc/74/25/67/405742567.db2.gz	ZDRKJSJCIKFCHG-HZPDHXFCSA-N	0	3	317.433	2.360	10	0		DEAEHN
CC(=O)c1cc(C(=O)N[C@H]2C[C@@H](N3CCCC3)C2)c(C)nc1C	ZINC000636110525	405747420	/nfs/dbraw/zinc/74/74/20/405747420.db2.gz	BVERMMABTXHQFP-GASCZTMLSA-N	0	3	315.417	2.258	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N[C@H](CO)Cc1ccc(C)c(C)c1	ZINC000457320457	405798577	/nfs/dbraw/zinc/79/85/77/405798577.db2.gz	MPUJBFODWACWRX-ROUUACIJSA-N	0	3	318.461	2.197	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@H]1CCO[C@@]2(CCSC2)C1	ZINC000495135829	405822385	/nfs/dbraw/zinc/82/23/85/405822385.db2.gz	BSOYWKLNAMEAFK-LZWOXQAQSA-N	0	3	312.479	2.032	10	0		DEAEHN
C(CN1CCCC[C@@H]1CN1CCOCC1)OCC1CCCC1	ZINC000459338875	405860340	/nfs/dbraw/zinc/86/03/40/405860340.db2.gz	BEBOLIFGODJWHD-GOSISDBHSA-N	0	3	310.482	2.380	10	0		DEAEHN
C[C@H](O)CCN1CCN(c2cccc(Br)c2)CC1	ZINC000450927178	405987247	/nfs/dbraw/zinc/98/72/47/405987247.db2.gz	BFVLBUYVGFLJBE-LBPRGKRZSA-N	0	3	313.239	2.342	10	0		DEAEHN
CC(=O)CCC(C)(C)C(=O)Nc1cnn(C2CCN(C)CC2)c1	ZINC000634092823	406000477	/nfs/dbraw/zinc/00/04/77/406000477.db2.gz	DPJBBKYJCSPCJU-UHFFFAOYSA-N	0	3	320.437	2.484	10	0		DEAEHN
CC(C)OC[C@@H](O)CN1CCC[C@H](CC(=O)OC(C)(C)C)C1	ZINC000532124856	406047877	/nfs/dbraw/zinc/04/78/77/406047877.db2.gz	JERDMMJYYAVQTB-CABCVRRESA-N	0	3	315.454	2.216	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@@H]1[C@H]2CCO[C@H]2C1(C)C	ZINC000487280110	406221190	/nfs/dbraw/zinc/22/11/90/406221190.db2.gz	QULSNFIDJDJTOK-GGZOMVNGSA-N	0	3	314.227	2.086	10	0		DEAEHN
CCCN(Cc1ccc(C)cc1)C(=O)CN1CC[C@@H](CO)[C@H]1C	ZINC000488800135	406350053	/nfs/dbraw/zinc/35/00/53/406350053.db2.gz	DVRFNOWQBCUPFR-AEFFLSMTSA-N	0	3	318.461	2.436	10	0		DEAEHN
O=C(NCc1ccc(Cn2ccnc2)cc1)[C@@H]1CCCN1C1CC1	ZINC000570502119	406402295	/nfs/dbraw/zinc/40/22/95/406402295.db2.gz	SZBNTAUCNYMYMQ-SFHVURJKSA-N	0	3	324.428	2.174	10	0		DEAEHN
Cc1nc2ccccc2n1CCC(=O)NC[C@@H]1CCCN(C)C1	ZINC000547473834	406414281	/nfs/dbraw/zinc/41/42/81/406414281.db2.gz	QQLCFZZNUKSZHB-HNNXBMFYSA-N	0	3	314.433	2.193	10	0		DEAEHN
CN1CCCC(C)(C)[C@H]1CNC(=O)c1ccnc2ccncc21	ZINC000548075740	406477583	/nfs/dbraw/zinc/47/75/83/406477583.db2.gz	RINBTISWBFWEEZ-MRXNPFEDSA-N	0	3	312.417	2.480	10	0		DEAEHN
c1ccc(N2CCO[C@@H](CN3CCOCC4(CC4)C3)C2)cc1	ZINC000571176401	406487952	/nfs/dbraw/zinc/48/79/52/406487952.db2.gz	VWENHMPFFRJBLN-KRWDZBQOSA-N	0	3	302.418	2.004	10	0		DEAEHN
C[C@H](NC(=O)[C@@H]1OCC[C@@H]1N)c1ccc(Cl)cc1Cl	ZINC000637885269	406462676	/nfs/dbraw/zinc/46/26/76/406462676.db2.gz	UAWVWMWOOGFEAF-CQFDHEJISA-N	0	3	303.189	2.287	10	0		DEAEHN
CC(C)C1CCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)CC1	ZINC000638023552	406528200	/nfs/dbraw/zinc/52/82/00/406528200.db2.gz	OJEDRUGXQILOAZ-SFHVURJKSA-N	0	3	317.477	2.340	10	0		DEAEHN
Cc1ccc2[nH]c(CN[C@H](C)C3CCS(=O)(=O)CC3)nc2c1	ZINC000526988912	406565577	/nfs/dbraw/zinc/56/55/77/406565577.db2.gz	WIDZOYAFRXHADV-GFCCVEGCSA-N	0	3	321.446	2.174	10	0		DEAEHN
Cc1ccc2nc(CN[C@H](C)C3CCS(=O)(=O)CC3)[nH]c2c1	ZINC000526988912	406565582	/nfs/dbraw/zinc/56/55/82/406565582.db2.gz	WIDZOYAFRXHADV-GFCCVEGCSA-N	0	3	321.446	2.174	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NCCCC(C)(C)C	ZINC000638014502	406523623	/nfs/dbraw/zinc/52/36/23/406523623.db2.gz	FIFKNRWVRFXAAT-MRXNPFEDSA-N	0	3	305.466	2.388	10	0		DEAEHN
COc1nsc(CNC2CCN(C)CC2)c1Br	ZINC000638303366	406684404	/nfs/dbraw/zinc/68/44/04/406684404.db2.gz	DIEXHWBCIURRMX-UHFFFAOYSA-N	0	3	320.256	2.098	10	0		DEAEHN
Cc1cc(CNCCN2CCN(Cc3ccccc3)CC2)ccn1	ZINC000527633263	406698821	/nfs/dbraw/zinc/69/88/21/406698821.db2.gz	XFUHEXSUTJYFNR-UHFFFAOYSA-N	0	3	324.472	2.297	10	0		DEAEHN
CN1CCC2(CCCN2C(=O)NCCOCC2CCC2)CC1	ZINC000577553879	406842441	/nfs/dbraw/zinc/84/24/41/406842441.db2.gz	OAZCETRBGCDZLS-UHFFFAOYSA-N	0	3	309.454	2.073	10	0		DEAEHN
CC(C(=O)N(Cc1ccoc1)C1CCCCC1)S(C)(=O)=O	ZINC000129456821	196050845	/nfs/dbraw/zinc/05/08/45/196050845.db2.gz	OLGOOWFOLNKJDV-LBPRGKRZSA-N	0	3	313.419	2.374	10	0		DEAEHN
CC(C)NCc1cc(Cl)cc(Cl)c1OC[C@H](O)CO	ZINC000130441958	196084334	/nfs/dbraw/zinc/08/43/34/196084334.db2.gz	IYOMCBWTEFCMOA-LLVKDONJSA-N	0	3	308.205	2.223	10	0		DEAEHN
C[C@H](CN1C(=O)C2(CC2)N[C@H]1c1cccs1)N1CCCC1	ZINC000130797275	196110634	/nfs/dbraw/zinc/11/06/34/196110634.db2.gz	NLPYNHQJTCLXPL-TZMCWYRMSA-N	0	3	305.447	2.195	10	0		DEAEHN
COCCCS(=O)(=O)Cc1ccc(CNC(C)(C)C)o1	ZINC000130926174	196123270	/nfs/dbraw/zinc/12/32/70/196123270.db2.gz	OUESFUMOYPTRTM-UHFFFAOYSA-N	0	3	303.424	2.119	10	0		DEAEHN
CN[C@@H](C)c1cccc(S(=O)(=O)NCC[C@H](C)SC)c1	ZINC000130940706	196124966	/nfs/dbraw/zinc/12/49/66/196124966.db2.gz	YOIZZYMGZMGCDB-RYUDHWBXSA-N	0	3	316.492	2.387	10	0		DEAEHN
CSCC[C@@H](N)C(=O)Nc1ccc(Br)c(C)n1	ZINC000131269975	196156788	/nfs/dbraw/zinc/15/67/88/196156788.db2.gz	IIVITHIFFLRJHK-SECBINFHSA-N	0	3	318.240	2.171	10	0		DEAEHN
CN[C@@H](Cc1ccc(C(F)(F)F)cc1)[C@@H](C)S(C)(=O)=O	ZINC000131473884	196172308	/nfs/dbraw/zinc/17/23/08/196172308.db2.gz	GPTJHHKAOWSSEM-SKDRFNHKSA-N	0	3	309.353	2.269	10	0		DEAEHN
CC[S@@](=O)CCNCc1ccc(Br)c(F)c1	ZINC000131649892	196188106	/nfs/dbraw/zinc/18/81/06/196188106.db2.gz	JDXOQTWJSNDMCU-INIZCTEOSA-N	0	3	308.216	2.446	10	0		DEAEHN
CS(=O)(=O)N1CCC[C@@H](CN2CCC[C@@H]2c2ccco2)C1	ZINC000131732624	196194312	/nfs/dbraw/zinc/19/43/12/196194312.db2.gz	ZGECPXWPRQDHTE-UONOGXRCSA-N	0	3	312.435	2.088	10	0		DEAEHN
CCCN[C@@H](Cc1ccc(F)cc1C)[C@H](C)S(C)(=O)=O	ZINC000131922056	196210784	/nfs/dbraw/zinc/21/07/84/196210784.db2.gz	PCJHAVGKZLZCSE-WFASDCNBSA-N	0	3	301.427	2.478	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CCO[C@H](c3ccco3)C2)C1	ZINC000132339909	196246890	/nfs/dbraw/zinc/24/68/90/196246890.db2.gz	WORZEVZXSQIWKZ-YCPHGPKFSA-N	0	3	321.421	2.091	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1[C@](C)(O)C1(C)CC1	ZINC000132838663	196288961	/nfs/dbraw/zinc/28/89/61/196288961.db2.gz	DZHWMKZWLNRTEP-ZDUSSCGKSA-N	0	3	316.243	2.215	10	0		DEAEHN
C[C@@H](N[C@@H]1CCC(=O)N(C)C1)c1ccc2c(c1)OCCCO2	ZINC000132990098	196302686	/nfs/dbraw/zinc/30/26/86/196302686.db2.gz	YRKZEUYXURBFRN-TZMCWYRMSA-N	0	3	304.390	2.119	10	0		DEAEHN
COCc1nc(NN)cc(Nc2ccc(Br)cc2)n1	ZINC000133082329	196309964	/nfs/dbraw/zinc/30/99/64/196309964.db2.gz	JDTOFGAYLIDDCQ-UHFFFAOYSA-N	0	3	324.182	2.415	10	0		DEAEHN
COC(=O)C[C@@H](NC(=O)[C@]1(C)CCCCN1)c1cccs1	ZINC000133171508	196318409	/nfs/dbraw/zinc/31/84/09/196318409.db2.gz	USKMLPUUZOAYNO-ABAIWWIYSA-N	0	3	310.419	2.001	10	0		DEAEHN
CN[C@H](CC[C@@H]1CCCO1)c1c(Cl)cnn1CCOC	ZINC000133969937	196350185	/nfs/dbraw/zinc/35/01/85/196350185.db2.gz	LVLFZXUYFUDPPY-WCQYABFASA-N	0	3	301.818	2.403	10	0		DEAEHN
CN[C@H](CC[C@H]1CCCO1)c1c(Cl)cnn1CCOC	ZINC000133970339	196350378	/nfs/dbraw/zinc/35/03/78/196350378.db2.gz	LVLFZXUYFUDPPY-DGCLKSJQSA-N	0	3	301.818	2.403	10	0		DEAEHN
CN[C@H](Cc1ccc(Cl)cc1F)C(C)(C)S(C)(=O)=O	ZINC000134225308	196371613	/nfs/dbraw/zinc/37/16/13/196371613.db2.gz	RVANPVGALCMQDG-GFCCVEGCSA-N	0	3	307.818	2.433	10	0		DEAEHN
CN[C@@H](Cc1ccc(Cl)cc1F)C(C)(C)S(C)(=O)=O	ZINC000134225325	196371639	/nfs/dbraw/zinc/37/16/39/196371639.db2.gz	RVANPVGALCMQDG-LBPRGKRZSA-N	0	3	307.818	2.433	10	0		DEAEHN
CC[C@H](CCO)NCC(=O)Nc1cccc(Br)c1	ZINC000134399584	196386161	/nfs/dbraw/zinc/38/61/61/196386161.db2.gz	DRXNDDNSPJRPKW-LLVKDONJSA-N	0	3	315.211	2.138	10	0		DEAEHN
CCC[C@@H](N)CC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000135848953	196505787	/nfs/dbraw/zinc/50/57/87/196505787.db2.gz	NNCJYJMOILZARC-SECBINFHSA-N	0	3	320.361	2.139	10	0		DEAEHN
CN(C)CCN(Cc1ccco1)C(=O)NC[C@@H]1CCC(C)(C)O1	ZINC000188180012	225012759	/nfs/dbraw/zinc/01/27/59/225012759.db2.gz	DGIQTGBXKJMWMX-AWEZNQCLSA-N	0	3	323.437	2.310	10	0		DEAEHN
NC(=O)[C@@H]1CN(c2ccnc3ccccc32)C[C@H]1C(F)(F)F	ZINC000299742977	229379006	/nfs/dbraw/zinc/37/90/06/229379006.db2.gz	LEJOXNRKPWRFLC-GHMZBOCLSA-N	0	3	309.291	2.335	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC[C@@H](c2c[nH]nc2N)CC1	ZINC000616602302	422516479	/nfs/dbraw/zinc/51/64/79/422516479.db2.gz	XDDGAOHCTSPXTQ-GFCCVEGCSA-N	0	3	323.441	2.086	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1cc(Br)c[nH]1	ZINC000037505975	424808255	/nfs/dbraw/zinc/80/82/55/424808255.db2.gz	ORFOTBSJGLKVQT-NSHDSACASA-N	0	3	316.243	2.483	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCCC[C@H]1[C@@H](C)O	ZINC000106865474	424849993	/nfs/dbraw/zinc/84/99/93/424849993.db2.gz	KVUBOHAVADPFCQ-WBVHZDCISA-N	0	3	304.434	2.270	10	0		DEAEHN
Nc1ccncc1C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000310102036	424894838	/nfs/dbraw/zinc/89/48/38/424894838.db2.gz	YFMADIPFOWGXHU-INIZCTEOSA-N	0	3	324.428	2.306	10	0		DEAEHN
CN(C)c1nccc(NC[C@@H]2CCCN2Cc2ccccc2)n1	ZINC000354341512	425062874	/nfs/dbraw/zinc/06/28/74/425062874.db2.gz	VXHASVRIEXNYSD-INIZCTEOSA-N	0	3	311.433	2.619	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC(c2ccnc(N)c2)CC1	ZINC000616620341	425098269	/nfs/dbraw/zinc/09/82/69/425098269.db2.gz	WLQYFPJABBPWID-UHFFFAOYSA-N	0	3	320.437	2.368	10	0		DEAEHN
CN(C(=O)c1ccc(Br)o1)[C@H](CN)C(F)(F)F	ZINC000662974979	425769409	/nfs/dbraw/zinc/76/94/09/425769409.db2.gz	CIWQSUCNUHCCHB-ZCFIWIBFSA-N	0	3	315.089	2.004	10	0		DEAEHN
O[C@@H]1c2ccccc2C[C@@H]1N1CCC(Nc2cccnn2)CC1	ZINC000182753337	275055406	/nfs/dbraw/zinc/05/54/06/275055406.db2.gz	TVGVXLCCLRANMQ-FUHWJXTLSA-N	0	3	310.401	2.011	10	0		DEAEHN
Brc1cccc2c1CC[C@H]2NCCn1cncn1	ZINC000271732103	275374323	/nfs/dbraw/zinc/37/43/23/275374323.db2.gz	CJMAHJVMVACONT-CYBMUJFWSA-N	0	3	307.195	2.318	10	0		DEAEHN
CC(C)c1nc2n(n1)C[C@H](N[C@H]1CCCc3c1cnn3C)CC2	ZINC000180635397	276066852	/nfs/dbraw/zinc/06/68/52/276066852.db2.gz	KTYQICBHBZLPKZ-OCCSQVGLSA-N	0	3	314.437	2.117	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@H]1COc2ccccc21	ZINC000245899753	276232844	/nfs/dbraw/zinc/23/28/44/276232844.db2.gz	RTQMTMUUDRFZKI-YCPHGPKFSA-N	0	3	315.417	2.388	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(C(=O)[C@@H]1C[C@@H](C)CCN1)CC2	ZINC000423911915	277114073	/nfs/dbraw/zinc/11/40/73/277114073.db2.gz	SKAYKPJZJDJXEY-UGSOOPFHSA-N	0	3	314.429	2.205	10	0		DEAEHN
C[C@@H](C(=O)N1CCC(c2ccnn2C)CC1)N1CCCCCC1	ZINC000174030640	277540284	/nfs/dbraw/zinc/54/02/84/277540284.db2.gz	ASJRUWXBUAXULU-HNNXBMFYSA-N	0	3	318.465	2.391	10	0		DEAEHN
CC1(C)C[C@H]1C(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000269790641	278392065	/nfs/dbraw/zinc/39/20/65/278392065.db2.gz	YVJITLFUZACOLA-KRWDZBQOSA-N	0	3	316.445	2.306	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCCC[C@H]2c2ccnn2C)C1	ZINC000332827243	279293305	/nfs/dbraw/zinc/29/33/05/279293305.db2.gz	YCOBAHKMWAPAJK-ZBFHGGJFSA-N	0	3	319.453	2.141	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)N([C@H](C)C1CC1)C1CC1	ZINC000245475092	279327120	/nfs/dbraw/zinc/32/71/20/279327120.db2.gz	ROODHZIUXKTSGE-PBHICJAKSA-N	0	3	307.482	2.192	10	0		DEAEHN
C[C@H](N[C@@H](C)[C@H]1CCCO1)C(=O)N1CCc2sccc2C1	ZINC000183153736	279497561	/nfs/dbraw/zinc/49/75/61/279497561.db2.gz	XVRXXDFCQXYRSH-SGMGOOAPSA-N	0	3	308.447	2.178	10	0		DEAEHN
CC[C@H]1CCCCCN1C(=O)NC[C@@H]1CCCN1CCOC	ZINC000120341161	288184041	/nfs/dbraw/zinc/18/40/41/288184041.db2.gz	UNHUTEUTJGFMFZ-HOTGVXAUSA-N	0	3	311.470	2.461	10	0		DEAEHN
Cc1ccn2ncc(C(=O)NC[C@H](c3ccccc3)N(C)C)c2n1	ZINC000068647006	281443372	/nfs/dbraw/zinc/44/33/72/281443372.db2.gz	OWHDRHBZFLICKG-MRXNPFEDSA-N	0	3	323.400	2.070	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)NCc1ccoc1	ZINC000057202330	281490314	/nfs/dbraw/zinc/49/03/14/281490314.db2.gz	XSKLCVZADZOGBI-MRXNPFEDSA-N	0	3	301.390	2.252	10	0		DEAEHN
C[C@@H]1c2ccccc2CCN1C[C@@H]1CCCN(S(C)(=O)=O)C1	ZINC000176333207	289075951	/nfs/dbraw/zinc/07/59/51/289075951.db2.gz	OZNRKZYPHHQSLM-CABCVRRESA-N	0	3	322.474	2.277	10	0		DEAEHN
C[C@H](C(=O)NC(=O)NC1CC1)N1CCC[C@]2(CC=CCC2)C1	ZINC000246381813	289333052	/nfs/dbraw/zinc/33/30/52/289333052.db2.gz	NPMPMWKOXITLPO-CXAGYDPISA-N	0	3	305.422	2.185	10	0		DEAEHN
C[C@H](C(=O)NC1CCC(C)CC1)N1CCCN(C2CC2)CC1	ZINC000172345808	289346094	/nfs/dbraw/zinc/34/60/94/289346094.db2.gz	LNASCMMEUNCEDM-HWOWSKLDSA-N	0	3	307.482	2.240	10	0		DEAEHN
C[C@H](CSc1nnc(COc2ccccc2)n1C)N(C)C	ZINC000358776298	289726073	/nfs/dbraw/zinc/72/60/73/289726073.db2.gz	BTGLVKXVPGAKJP-GFCCVEGCSA-N	0	3	306.435	2.436	10	0		DEAEHN
C[C@@H](C(=O)NCc1ccc(CO)c(F)c1)N1[C@H](C)CC[C@H]1C	ZINC000170855506	325715783	/nfs/dbraw/zinc/71/57/83/325715783.db2.gz	CYBIAEOMFNURLX-UPJWGTAASA-N	0	3	308.397	2.196	10	0		DEAEHN
COc1cccc2c1CCN(CCCN1CCCC1=O)CC2	ZINC000573389385	326052823	/nfs/dbraw/zinc/05/28/23/326052823.db2.gz	XEVJWYDQNPJHDW-UHFFFAOYSA-N	0	3	302.418	2.108	10	0		DEAEHN
OCc1cn([C@@H]2CCCC[C@@H]2NCc2ccc(Cl)cn2)nn1	ZINC000575202091	326228720	/nfs/dbraw/zinc/22/87/20/326228720.db2.gz	DBPOADZXEWSYTE-LSDHHAIUSA-N	0	3	321.812	2.092	10	0		DEAEHN
CCc1nc(C(C)(C)NC(=O)NC[C@@H]2CCCCN2CC)no1	ZINC000577336549	326357702	/nfs/dbraw/zinc/35/77/02/326357702.db2.gz	TUAYROYDRROJIY-LBPRGKRZSA-N	0	3	323.441	2.041	10	0		DEAEHN
COC[C@H](C)CN1CCCN(C(=O)c2cccc(C)c2)CC1	ZINC000189640797	333191258	/nfs/dbraw/zinc/19/12/58/333191258.db2.gz	IKVANZUUXHPDEB-MRXNPFEDSA-N	0	3	304.434	2.425	10	0		DEAEHN
COc1ccc([C@H](O)CN(C)Cc2ccccc2)cc1CCO	ZINC000584595063	337373886	/nfs/dbraw/zinc/37/38/86/337373886.db2.gz	OBRPIAXYMNPXOW-GOSISDBHSA-N	0	3	315.413	2.395	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1C	ZINC000247452776	518227400	/nfs/dbraw/zinc/22/74/00/518227400.db2.gz	SWIDRTWJXMWAIL-YGRLFVJLSA-N	0	3	305.422	2.293	10	0		DEAEHN
CCCn1nc(C)c(CN2CCC[C@H](Cn3cncn3)C2)c1C	ZINC000128540786	521667991	/nfs/dbraw/zinc/66/79/91/521667991.db2.gz	LDGRFSKYRILDQV-INIZCTEOSA-N	0	3	316.453	2.414	10	0		DEAEHN
CO[C@@H](C)c1cccc(NC(=O)N2CCO[C@H](CN(C)C)C2)c1	ZINC000118816192	523447255	/nfs/dbraw/zinc/44/72/55/523447255.db2.gz	PXVSYMRWRXQSQL-XJKSGUPXSA-N	0	3	321.421	2.188	10	0		DEAEHN
CO[C@@H]1CC[C@H]2OCCN(CCCCCn3cccn3)[C@@H]2C1	ZINC000158447091	523724556	/nfs/dbraw/zinc/72/45/56/523724556.db2.gz	CPEKPVBJMRTZER-BRWVUGGUSA-N	0	3	307.438	2.322	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(C)Cc1ccc(C)cc1	ZINC000111866029	523832122	/nfs/dbraw/zinc/83/21/22/523832122.db2.gz	RDFDARYKIKVPOH-KRWDZBQOSA-N	0	3	319.449	2.247	10	0		DEAEHN
Cc1ccc(F)c(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000249234312	524814245	/nfs/dbraw/zinc/81/42/45/524814245.db2.gz	VXEPFJCUYXJBHO-QWHCGFSZSA-N	0	3	321.396	2.014	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC[C@H](C)N2CCOCC2)c1	ZINC000123252685	524907522	/nfs/dbraw/zinc/90/75/22/524907522.db2.gz	MGELOZXIYQVUKJ-KBPBESRZSA-N	0	3	308.422	2.075	10	0		DEAEHN
CCCCOC[C@H](O)CN[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000195215061	528625951	/nfs/dbraw/zinc/62/59/51/528625951.db2.gz	CDMJTCKSAIBZIU-WMLDXEAASA-N	0	3	318.421	2.096	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc(C)c(OC)c2)CCN1C[C@@H](C)O	ZINC000193899872	529297058	/nfs/dbraw/zinc/29/70/58/529297058.db2.gz	PUPBXGWBNMQRMM-WBVHZDCISA-N	0	3	306.450	2.281	10	0		DEAEHN
CC(C)Oc1ccccc1-c1nc([C@@H]2CNCCN2C)no1	ZINC000263166187	535052386	/nfs/dbraw/zinc/05/23/86/535052386.db2.gz	FGFPMUZPFVCELD-ZDUSSCGKSA-N	0	3	302.378	2.100	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)NCC1=CCN(C)CC1)CC2	ZINC000372466573	535382398	/nfs/dbraw/zinc/38/23/98/535382398.db2.gz	PZXUTXJCFSSZCA-CQSZACIVSA-N	0	3	316.449	2.016	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NCC1=CCN(C)CC1)C2	ZINC000372466573	535382400	/nfs/dbraw/zinc/38/24/00/535382400.db2.gz	PZXUTXJCFSSZCA-CQSZACIVSA-N	0	3	316.449	2.016	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2ccnn2C)[C@H]1Oc1ccccc1	ZINC000248540256	535413964	/nfs/dbraw/zinc/41/39/64/535413964.db2.gz	BEVCDXHFUSZMOP-BRWVUGGUSA-N	0	3	301.390	2.135	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)N1CCC[C@H](c2noc(C3CC3)n2)C1	ZINC000262324269	535523997	/nfs/dbraw/zinc/52/39/97/535523997.db2.gz	SMPFAHYJNRPERU-BLLLJJGKSA-N	0	3	306.410	2.171	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@H](C)N1CC[C@@H](CNc2ccccn2)C1	ZINC000249805992	536162886	/nfs/dbraw/zinc/16/28/86/536162886.db2.gz	BFPAPIHJEYMPMR-KKUMJFAQSA-N	0	3	304.438	2.119	10	0		DEAEHN
COCCOc1cccc(NC(=O)[C@H]2NCCCC2(C)C)c1	ZINC000262575870	536727151	/nfs/dbraw/zinc/72/71/51/536727151.db2.gz	YDNQCDLINWKXQH-OAHLLOKOSA-N	0	3	306.406	2.429	10	0		DEAEHN
CCC[C@H](C(=O)NCc1cc2c(cc1OC)C[C@H](C)O2)N(C)C	ZINC000162666270	625600675	/nfs/dbraw/zinc/60/06/75/625600675.db2.gz	DPIDHMHXLREZIR-SWLSCSKDSA-N	0	3	320.433	2.365	10	0		DEAEHN
COC(=O)/C(C)=C\CN1CCCN(Cc2ccc(F)cc2)CC1	ZINC000746498981	638349322	/nfs/dbraw/zinc/34/93/22/638349322.db2.gz	AVNFJTNPKZPNHS-NVNXTCNLSA-N	0	3	320.408	2.453	10	0		DEAEHN
COC(=O)c1ccc2c(cnn2CN2CCC[C@H]2C[C@@H](C)O)c1	ZINC000752803317	639221855	/nfs/dbraw/zinc/22/18/55/639221855.db2.gz	IMSYUEJFKFMBHF-DOMZBBRYSA-N	0	3	317.389	2.016	10	0		DEAEHN
COc1cc(C[NH2+][C@@H](C)[C@@H](C)O)cc(Br)c1[O-]	ZINC000342244799	639500559	/nfs/dbraw/zinc/50/05/59/639500559.db2.gz	YOMMXKSKSHHBHJ-JGVFFNPUSA-N	0	3	304.184	2.022	10	0		DEAEHN
COC1(CO)CCN(Cc2ccc([Si](C)(C)C)cc2)CC1	ZINC000801951482	645468240	/nfs/dbraw/zinc/46/82/40/645468240.db2.gz	GUPWYDWFCWKOEV-UHFFFAOYSA-N	0	3	307.510	2.205	10	0		DEAEHN
COCCN1CCC[C@H](NC(=O)/C=C(\C)c2cccc(F)c2)C1	ZINC000732080110	647539854	/nfs/dbraw/zinc/53/98/54/647539854.db2.gz	VVQXGRKGCXHNIF-WKOYGUFESA-N	0	3	320.408	2.456	10	0		DEAEHN
COCc1ccsc1C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000181432523	648653420	/nfs/dbraw/zinc/65/34/20/648653420.db2.gz	IANXHMVOCHBCGF-NSHDSACASA-N	0	3	315.354	2.251	10	0		DEAEHN
COc1cc(Cl)cc(C[N@@H+]2C[C@@H](C(N)=O)CC[C@H]2C)c1[O-]	ZINC000184680343	649344569	/nfs/dbraw/zinc/34/45/69/649344569.db2.gz	QLPIIUXKAMHEER-ZJUUUORDSA-N	0	3	312.797	2.140	10	0		DEAEHN
COc1cc(Cl)cc(C[N@H+]2C[C@@H](C(N)=O)CC[C@H]2C)c1[O-]	ZINC000184680343	649344570	/nfs/dbraw/zinc/34/45/70/649344570.db2.gz	QLPIIUXKAMHEER-ZJUUUORDSA-N	0	3	312.797	2.140	10	0		DEAEHN
c1ncn(Cc2ccc(CN[C@@H]3CCCc4n[nH]cc43)cc2)n1	ZINC000353440685	685344754	/nfs/dbraw/zinc/34/47/54/685344754.db2.gz	ZYJROVWGMMOFNE-MRXNPFEDSA-N	0	3	308.389	2.217	10	0		DEAEHN
C[C@H](CN1CCCCC1)NCc1nc(Br)c[nH]1	ZINC000380079751	685394214	/nfs/dbraw/zinc/39/42/14/685394214.db2.gz	RWWHAKKTEXLYTC-SNVBAGLBSA-N	0	3	301.232	2.136	10	0		DEAEHN
CN(C)C(=O)Sc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000084061831	684001598	/nfs/dbraw/zinc/00/15/98/684001598.db2.gz	QFWDVJJZODVENR-UHFFFAOYSA-N	0	3	321.446	2.158	10	0		DEAEHN
CC(C)[C@H](C(=O)OCCN1CCSCC1)N1CCCCC1	ZINC000120496069	684096881	/nfs/dbraw/zinc/09/68/81/684096881.db2.gz	ICAVOEWPYJNTEF-OAHLLOKOSA-N	0	3	314.495	2.089	10	0		DEAEHN
O=C(/C=C/c1ccncn1)O[C@H]1CCN(Cc2ccccc2)C1	ZINC000158940204	684307484	/nfs/dbraw/zinc/30/74/84/684307484.db2.gz	YIFDDBMMAJGCEK-LXXRFIIISA-N	0	3	309.369	2.308	10	0		DEAEHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@H]2CCCO[C@H]2C)c1	ZINC000192196677	684444193	/nfs/dbraw/zinc/44/41/93/684444193.db2.gz	DRUQBVADSXCZOE-TUKIKUTGSA-N	0	3	316.357	2.158	10	0		DEAEHN
CCNS(=O)(=O)CCN[C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000223163090	685107495	/nfs/dbraw/zinc/10/74/95/685107495.db2.gz	IHUCOAVMWHDFDG-CQSZACIVSA-N	0	3	316.854	2.320	10	0		DEAEHN
CN1CC[C@H](NC(=O)C[C@H]2CCCOC2)[C@H]1c1ccccc1	ZINC000249093206	685174253	/nfs/dbraw/zinc/17/42/53/685174253.db2.gz	LAJXNPDEQRCPGU-UWWQBHOKSA-N	0	3	302.418	2.365	10	0		DEAEHN
FC(F)(F)[C@@H]1CC[C@H](CN2CCC(C3OCCO3)CC2)O1	ZINC000721464827	777053611	/nfs/dbraw/zinc/05/36/11/777053611.db2.gz	FFRRJLJGCXEQNU-NEPJUHHUSA-N	0	3	309.328	2.181	10	0		DEAEHN
CN1C[C@H](CCNCc2ccsc2Br)CC1=O	ZINC000723547031	777121391	/nfs/dbraw/zinc/12/13/91/777121391.db2.gz	CBUQYYSSQKKDLQ-SECBINFHSA-N	0	3	317.252	2.469	10	0		DEAEHN
CCn1ccnc1CNC[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000723836310	777178995	/nfs/dbraw/zinc/17/89/95/777178995.db2.gz	KTSQMOCDXUSEKV-ZIAGYGMSSA-N	0	3	322.453	2.496	10	0		DEAEHN
Cc1c(CN[C@@H]2CN(C(=O)OC(C)(C)C)CC2(C)C)cnn1C	ZINC000721895187	781584360	/nfs/dbraw/zinc/58/43/60/781584360.db2.gz	CNQJWAWSMQEFMO-CQSZACIVSA-N	0	3	322.453	2.464	10	0		DEAEHN
COc1nsc(CNC[C@H]2C[C@H](OC)C2)c1Br	ZINC000714684309	792335583	/nfs/dbraw/zinc/33/55/83/792335583.db2.gz	VUJCURQBVBFPBF-ZKCHVHJHSA-N	0	3	321.240	2.429	10	0		DEAEHN
COc1cccc(/C(C)=C\C(=O)N[C@@H]2CCN(C3CC3)C2)c1	ZINC000751362851	792339054	/nfs/dbraw/zinc/33/90/54/792339054.db2.gz	LVCQJHSRNHAOTK-VSKPTYQZSA-N	0	3	300.402	2.451	10	0		DEAEHN
Cn1cc(CNCC[C@H]2CC(C)(C)CO2)c(Br)n1	ZINC000717350444	799381429	/nfs/dbraw/zinc/38/14/29/799381429.db2.gz	ZTJYETSSYWDMGO-NSHDSACASA-N	0	3	316.243	2.477	10	0		DEAEHN
CCCNC(=O)CCN1CCN(c2cccc(Cl)c2)CC1	ZINC000034668620	1078142437	/nfs/dbraw/zinc/14/24/37/1078142437.db2.gz	PTDXQVUFDSSPSO-UHFFFAOYSA-N	0	3	309.841	2.378	10	0		DEAEHN
C=Cn1cc(CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)cn1	ZINC000721933033	1084510528	/nfs/dbraw/zinc/51/05/28/1084510528.db2.gz	JZOIKKWKQLQJQA-TZMCWYRMSA-N	0	3	306.410	2.329	10	0		DEAEHN
Cn1cc(CN[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c(Br)n1	ZINC000720657861	1085818638	/nfs/dbraw/zinc/81/86/38/1085818638.db2.gz	VMRXBLNYRQGENH-GMTAPVOTSA-N	0	3	314.227	2.086	10	0		DEAEHN
CN1CCC[C@H]2[C@H]1CCN2C(=O)c1cccnc1Br	ZINC000720829355	1086184136	/nfs/dbraw/zinc/18/41/36/1086184136.db2.gz	MBWJUDTWGVJCSL-NEPJUHHUSA-N	0	3	324.222	2.153	10	0		DEAEHN
CN1CCC[C@H]2[C@@H]1CCN2C(=O)c1cccnc1Br	ZINC000720829359	1086184529	/nfs/dbraw/zinc/18/45/29/1086184529.db2.gz	MBWJUDTWGVJCSL-RYUDHWBXSA-N	0	3	324.222	2.153	10	0		DEAEHN
O=S(=O)([N-][C@]12CCC[C@@H]1[NH2+]CC2)c1cccc(Cl)c1F	ZINC000711639407	1087175554	/nfs/dbraw/zinc/17/55/54/1087175554.db2.gz	LHBRCCJAHSWESE-AAEUAGOBSA-N	0	3	318.801	2.042	10	0		DEAEHN
C[C@H]1[C@H](NC(=O)c2ccc(Br)c(F)c2)CCN1C	ZINC000719384706	1089053729	/nfs/dbraw/zinc/05/37/29/1089053729.db2.gz	DPOGMKSDGOXIRW-QPUJVOFHSA-N	0	3	315.186	2.411	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)cc1	ZINC000278250027	214047905	/nfs/dbraw/zinc/04/79/05/214047905.db2.gz	BWFBMGOPMYPALM-CXAGYDPISA-N	0	3	317.433	2.082	10	0		DEAEHN
CCc1ccc([C@@H](N)[C@H](C)SCCS(C)(=O)=O)cc1	ZINC000081768195	192321811	/nfs/dbraw/zinc/32/18/11/192321811.db2.gz	ITQJMAVIFYQECK-FZMZJTMJSA-N	0	3	301.477	2.415	10	0		DEAEHN
CCN[C@@H](c1ccc(OC)cc1)[C@@H](C)Sc1nnnn1C	ZINC000081843719	192330384	/nfs/dbraw/zinc/33/03/84/192330384.db2.gz	NSSTYHNPVLNVFN-ZWNOBZJWSA-N	0	3	307.423	2.050	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@@H]1S(=O)(=O)c1ccc(C)cc1C	ZINC000081922486	192339161	/nfs/dbraw/zinc/33/91/61/192339161.db2.gz	PCHSXTHLQDRATE-ZBFHGGJFSA-N	0	3	311.447	2.234	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@H]1S(=O)(=O)c1ccccc1Cl	ZINC000081920551	192339226	/nfs/dbraw/zinc/33/92/26/192339226.db2.gz	DVSQGTKQZVIJDW-TZMCWYRMSA-N	0	3	317.838	2.271	10	0		DEAEHN
Cc1ncc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c(C(C)C)n1	ZINC000246758968	282147114	/nfs/dbraw/zinc/14/71/14/282147114.db2.gz	BRUSBCFSVSGWTB-DOMZBBRYSA-N	0	3	304.438	2.367	10	0		DEAEHN
CCN[C@H](c1ccc(CC)cc1)[C@H](C)S(=O)(=O)CCOC	ZINC000081944998	192344973	/nfs/dbraw/zinc/34/49/73/192344973.db2.gz	OOHJJPSXYOBMNH-BBRMVZONSA-N	0	3	313.463	2.349	10	0		DEAEHN
Cc1cc(C(=O)N2CC[C@H](N(C)C)C2)c(C)n1-c1nccs1	ZINC000170867099	282180541	/nfs/dbraw/zinc/18/05/41/282180541.db2.gz	UIAUSTAXUPPHKR-ZDUSSCGKSA-N	0	3	318.446	2.327	10	0		DEAEHN
Cc1nnc([C@H]2CCCCN2C(=O)[C@H](C)[NH+]2CCCCCC2)[n-]1	ZINC000328674718	231300435	/nfs/dbraw/zinc/30/04/35/231300435.db2.gz	KCBCKOLXNNMNGN-DZGCQCFKSA-N	0	3	319.453	2.431	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(CCn3cccn3)C2)c1	ZINC000083402939	185222297	/nfs/dbraw/zinc/22/22/97/185222297.db2.gz	GWUUOCCIUCCZAF-CQSZACIVSA-N	0	3	301.390	2.390	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@]1(CN)Nc1cccc(Cl)c1	ZINC000087913636	185237409	/nfs/dbraw/zinc/23/74/09/185237409.db2.gz	QFVUFGOXGZMESE-CHWSQXEVSA-N	0	3	302.827	2.047	10	0		DEAEHN
NC[C@H](NC[C@@H]1CCCO1)c1ccc(Br)cc1F	ZINC000087928579	185237604	/nfs/dbraw/zinc/23/76/04/185237604.db2.gz	FCIKQTIYEWDMAR-GWCFXTLKSA-N	0	3	317.202	2.357	10	0		DEAEHN
COc1ccc(Br)c(C[C@@H](N)c2cnccn2)c1	ZINC000087791829	185232309	/nfs/dbraw/zinc/23/23/09/185232309.db2.gz	DCMRWEKOJFTQPB-GFCCVEGCSA-N	0	3	308.179	2.490	10	0		DEAEHN
Nc1nc2ccc(C(=O)NCCN3CCCCC3)cc2s1	ZINC000087847507	185233507	/nfs/dbraw/zinc/23/35/07/185233507.db2.gz	CJAZPXRSHUZOAY-UHFFFAOYSA-N	0	3	304.419	2.094	10	0		DEAEHN
COc1ccc(Br)c(NC(=O)[C@H](N)C(C)C)c1	ZINC000088321285	185245399	/nfs/dbraw/zinc/24/53/99/185245399.db2.gz	ASCNPEKZDVXVAD-LLVKDONJSA-N	0	3	301.184	2.380	10	0		DEAEHN
C[C@H](CN)S(=O)(=O)Nc1ccccc1Cc1ccccc1	ZINC000088472175	185252370	/nfs/dbraw/zinc/25/23/70/185252370.db2.gz	NEBIRTTYLJWAGA-CYBMUJFWSA-N	0	3	304.415	2.366	10	0		DEAEHN
CN[C@@](C)(CCCN1CCC[C@H](C(F)(F)F)C1)C(=O)OC	ZINC000088435228	185249954	/nfs/dbraw/zinc/24/99/54/185249954.db2.gz	DBYSJMHAZLFTPH-AAEUAGOBSA-N	0	3	310.360	2.192	10	0		DEAEHN
N[C@@](CO)(CN1CCC(C(F)(F)F)CC1)c1ccccc1	ZINC000088439722	185250833	/nfs/dbraw/zinc/25/08/33/185250833.db2.gz	LLABCQHRDNGTRU-CQSZACIVSA-N	0	3	302.340	2.107	10	0		DEAEHN
C[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)(C)CC(C)(C)C)o1	ZINC000088540232	185255728	/nfs/dbraw/zinc/25/57/28/185255728.db2.gz	PDBPNIVISOZJGW-UHFFFAOYSA-N	0	3	302.440	2.492	10	0		DEAEHN
CCOC(=O)[C@@H]1CNCCN1[C@@H](C)c1ccc(F)cc1Cl	ZINC000088657834	185261806	/nfs/dbraw/zinc/26/18/06/185261806.db2.gz	HXHHONOMDVAWLE-HZMBPMFUSA-N	0	3	314.788	2.377	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1C(=O)[C@@H]1CCCc2[nH]ncc21	ZINC000134469587	282213461	/nfs/dbraw/zinc/21/34/61/282213461.db2.gz	PSVZJJAJZDHBTI-UONOGXRCSA-N	0	3	313.405	2.026	10	0		DEAEHN
COCCCS(=O)(=O)[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1N	ZINC000081986029	192350007	/nfs/dbraw/zinc/35/00/07/192350007.db2.gz	DLTQWHAUQSTCQN-OWCLPIDISA-N	0	3	311.447	2.101	10	0		DEAEHN
CCC[C@@H](C(=O)NCC[C@H](C)NC(=O)OC(C)(C)C)N(C)C	ZINC000179148303	282216271	/nfs/dbraw/zinc/21/62/71/282216271.db2.gz	WSPRYLBDFAPRLW-STQMWFEESA-N	0	3	315.458	2.136	10	0		DEAEHN
N[C@@H](C[S@](=O)c1ccccc1)c1ccc2c(c1)OCCO2	ZINC000082001208	192353296	/nfs/dbraw/zinc/35/32/96/192353296.db2.gz	KHSQXXOSPLWHSI-LHSJRXKWSA-N	0	3	303.383	2.265	10	0		DEAEHN
CN(Cc1cccc(Br)c1)[C@@H](CN)c1cncn1C	ZINC000090167505	185284710	/nfs/dbraw/zinc/28/47/10/185284710.db2.gz	CXOVHQFLZUCRKG-ZDUSSCGKSA-N	0	3	323.238	2.314	10	0		DEAEHN
N[C@@H]1COC[C@H]1C(=O)Nc1ccccc1SCC(F)(F)F	ZINC000090380238	185293420	/nfs/dbraw/zinc/29/34/20/185293420.db2.gz	KGWLQTZXUIXIEL-RKDXNWHRSA-N	0	3	320.336	2.253	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1c(Cl)ccc(C)c1Cl	ZINC000090431446	185295844	/nfs/dbraw/zinc/29/58/44/185295844.db2.gz	GATUYKIZHZQVSK-PSASIEDQSA-N	0	3	303.189	2.475	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)N(C)Cc1ccc(Cl)c(Cl)c1	ZINC000090434549	185296090	/nfs/dbraw/zinc/29/60/90/185296090.db2.gz	NMMRCPIVAFGNPA-GXFFZTMASA-N	0	3	317.216	2.186	10	0		DEAEHN
CCCOc1ccc(NC(=O)[C@]2(C)COC[C@H]2N)cc1Cl	ZINC000090590087	185305513	/nfs/dbraw/zinc/30/55/13/185305513.db2.gz	GZGIEFHJYZSYQN-UKRRQHHQSA-N	0	3	312.797	2.431	10	0		DEAEHN
C[C@]1(C(=O)Nc2cc(C(F)(F)F)ccc2F)COC[C@@H]1N	ZINC000090603845	185305975	/nfs/dbraw/zinc/30/59/75/185305975.db2.gz	CCIWZXJILSMFFM-JQWIXIFHSA-N	0	3	306.259	2.147	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@]2(C)COC[C@H]2N)cc1Br	ZINC000090604363	185306166	/nfs/dbraw/zinc/30/61/66/185306166.db2.gz	TZDPEWYBLHCDHA-YPMHNXCESA-N	0	3	313.195	2.060	10	0		DEAEHN
C[C@@]1(c2nc(-c3ccccc3Br)no2)COC[C@H]1N	ZINC000090573565	185304463	/nfs/dbraw/zinc/30/44/63/185304463.db2.gz	OJEOYUVIUKZKHG-ZWNOBZJWSA-N	0	3	324.178	2.114	10	0		DEAEHN
C[C@]1(C(=O)NCCc2ccc(Cl)cc2Cl)COC[C@H]1N	ZINC000090581432	185304849	/nfs/dbraw/zinc/30/48/49/185304849.db2.gz	NWVKHHIVDMNWJV-OCCSQVGLSA-N	0	3	317.216	2.016	10	0		DEAEHN
O=C(c1ccno1)N1CCCSC[C@@H]1CN1CCCCC1	ZINC000090701136	185310416	/nfs/dbraw/zinc/31/04/16/185310416.db2.gz	QEJPAOOOCDMYHG-ZDUSSCGKSA-N	0	3	309.435	2.108	10	0		DEAEHN
Cc1nc(NC(=O)CNC(C)(C)C)ccc1Br	ZINC000092461642	185320257	/nfs/dbraw/zinc/32/02/57/185320257.db2.gz	VFRVVVLBBIYCFB-UHFFFAOYSA-N	0	3	300.200	2.479	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)CCc2ccccc2)C[C@@H]1C	ZINC000182341670	282238187	/nfs/dbraw/zinc/23/81/87/282238187.db2.gz	KFYKMZBYYAGOED-PKOBYXMFSA-N	0	3	320.477	2.023	10	0		DEAEHN
Cc1cc(CN2CCC(n3cncn3)CC2)ccc1-n1cncn1	ZINC000092647598	185331421	/nfs/dbraw/zinc/33/14/21/185331421.db2.gz	DPBWIECEWWWPAJ-UHFFFAOYSA-N	0	3	323.404	2.004	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NC[C@@H](C)c1nccs1	ZINC000184257713	282249860	/nfs/dbraw/zinc/24/98/60/282249860.db2.gz	HOMWXXRQEMWRFJ-OLZOCXBDSA-N	0	3	310.467	2.372	10	0		DEAEHN
CC[C@@H](CSC)N(C)S(=O)(=O)c1cc(CN)sc1C	ZINC000168552464	197725354	/nfs/dbraw/zinc/72/53/54/197725354.db2.gz	XDEBHOHQCDNBNS-JTQLQIEISA-N	0	3	322.521	2.277	10	0		DEAEHN
CN[C@@H](Cc1ccc(Cl)cc1)[C@H]1CCCCS1(=O)=O	ZINC000168601856	197725458	/nfs/dbraw/zinc/72/54/58/197725458.db2.gz	PSPZQYYMQSYBCK-UONOGXRCSA-N	0	3	301.839	2.438	10	0		DEAEHN
CN(Cc1ccc(OC[C@H]2CCCO2)cc1)CC1(CO)CC1	ZINC000186784053	282283957	/nfs/dbraw/zinc/28/39/57/282283957.db2.gz	CWCPOSCWNQEZOF-QGZVFWFLSA-N	0	3	305.418	2.449	10	0		DEAEHN
C[C@H]1CC[C@](CO)(N(C)CC(=O)NCc2cccc(Cl)c2)C1	ZINC000187903924	282294462	/nfs/dbraw/zinc/29/44/62/282294462.db2.gz	GRHUFKMHJSWFHI-GUYCJALGSA-N	0	3	324.852	2.439	10	0		DEAEHN
COC[C@H](NCc1cn2c(cccc2C)n1)C1CCOCC1	ZINC000187992337	282294722	/nfs/dbraw/zinc/29/47/22/282294722.db2.gz	XDSJGOPERARNKG-INIZCTEOSA-N	0	3	303.406	2.174	10	0		DEAEHN
CCCCCOCC(=O)Nc1ccc(-c2nnc(CN)[nH]2)cc1	ZINC000193334699	282347801	/nfs/dbraw/zinc/34/78/01/282347801.db2.gz	NMXBBMIWKHTNJG-UHFFFAOYSA-N	0	3	317.393	2.076	10	0		DEAEHN
C=Cn1cc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)cn1	ZINC000194783557	282365398	/nfs/dbraw/zinc/36/53/98/282365398.db2.gz	NRJDBBVXRNFFCJ-KRWDZBQOSA-N	0	3	311.433	2.333	10	0		DEAEHN
CCc1nc(CN2CC[C@@H](CNc3cccc(C)n3)C2)n[nH]1	ZINC000181713022	199342437	/nfs/dbraw/zinc/34/24/37/199342437.db2.gz	UTULSFXUANQNTR-ZDUSSCGKSA-N	0	3	300.410	2.005	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)Nc2cnc(C3CC3)nc2)C1	ZINC000122598750	539462486	/nfs/dbraw/zinc/46/24/86/539462486.db2.gz	XJBXRMBMWQGPCQ-RISCZKNCSA-N	0	3	303.410	2.204	10	0		DEAEHN
Cn1nccc1[C@H]1[C@H](NC2CC3(CCC3)C2)CC(=O)N1C1CC1	ZINC000333814039	282970933	/nfs/dbraw/zinc/97/09/33/282970933.db2.gz	HLICKXUQBOIFNS-RHSMWYFYSA-N	0	3	314.433	2.147	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2	ZINC000291663586	404468408	/nfs/dbraw/zinc/46/84/08/404468408.db2.gz	FKSLWNBMVIKCFF-KSZLIROESA-N	0	3	324.428	2.374	10	0		DEAEHN
N[C@H](Cc1cc(F)ccc1Cl)[C@H]1CCCCS1(=O)=O	ZINC000126605500	185878479	/nfs/dbraw/zinc/87/84/79/185878479.db2.gz	ANRZDCSVOHVAKR-CHWSQXEVSA-N	0	3	305.802	2.316	10	0		DEAEHN
COC(=O)c1ccc(F)c(CN2CCN3CCCC[C@@H]3C2)c1	ZINC000182007905	199373467	/nfs/dbraw/zinc/37/34/67/199373467.db2.gz	QBMNKZUANCVHEZ-OAHLLOKOSA-N	0	3	306.381	2.282	10	0		DEAEHN
CC(C)(N)c1cn(Cc2ccc(F)c(Br)c2)nn1	ZINC000070118587	190858824	/nfs/dbraw/zinc/85/88/24/190858824.db2.gz	VAMUFIRSWQTTQH-UHFFFAOYSA-N	0	3	313.174	2.422	10	0		DEAEHN
CCc1nn(C)cc1CN1CCC[C@H](Cc2noc(C)n2)C1	ZINC000180000019	539642958	/nfs/dbraw/zinc/64/29/58/539642958.db2.gz	RHVXPZHJLUVCRU-CYBMUJFWSA-N	0	3	303.410	2.129	10	0		DEAEHN
CN(C)CCN(C)C(=O)Cc1ccc(OC(F)(F)F)cc1	ZINC000080394686	192155103	/nfs/dbraw/zinc/15/51/03/192155103.db2.gz	DGBKFQGMYUGCNO-UHFFFAOYSA-N	0	3	304.312	2.148	10	0		DEAEHN
Cc1cc(N2CCC[C@H](NCc3ccccc3C)C2=O)n(C)n1	ZINC000080526658	192165087	/nfs/dbraw/zinc/16/50/87/192165087.db2.gz	WRUNKYJXKZJEDP-INIZCTEOSA-N	0	3	312.417	2.322	10	0		DEAEHN
Cc1cc(Br)c([C@@H](N)[C@H]2CCS(=O)(=O)C2)s1	ZINC000083677989	192378661	/nfs/dbraw/zinc/37/86/61/192378661.db2.gz	NZEVHZNIEHTOPZ-CBAPKCEASA-N	0	3	324.265	2.254	10	0		DEAEHN
NC[C@H](NC[C@@H]1CCCO1)c1ccc(Br)s1	ZINC000083774172	192383154	/nfs/dbraw/zinc/38/31/54/192383154.db2.gz	KMQFJYVDTSCPCA-IUCAKERBSA-N	0	3	305.241	2.279	10	0		DEAEHN
CCN(Cc1ccc(Br)s1)C(=O)C1(N)CC1	ZINC000083834773	192385199	/nfs/dbraw/zinc/38/51/99/192385199.db2.gz	RPUROPFLDPBYGA-UHFFFAOYSA-N	0	3	303.225	2.350	10	0		DEAEHN
CN[C@@H](C[S@@](=O)CCOC)c1cccc(C(F)(F)F)c1	ZINC000084035321	192396615	/nfs/dbraw/zinc/39/66/15/192396615.db2.gz	XKZWKIMUXBNGGO-FKIZINRSSA-N	0	3	309.353	2.361	10	0		DEAEHN
[NH3+]CCc1nc(CC(=O)Nc2cc(Cl)ccc2[O-])cs1	ZINC000071695893	191009053	/nfs/dbraw/zinc/00/90/53/191009053.db2.gz	PKPKTYZUQXULMM-UHFFFAOYSA-N	0	3	311.794	2.185	10	0		DEAEHN
CC(C)NCc1cc(F)c(F)c(S(=O)(=O)N(C)C(C)C)c1	ZINC000138333812	186015943	/nfs/dbraw/zinc/01/59/43/186015943.db2.gz	GCOVXKXHORKELB-UHFFFAOYSA-N	0	3	320.405	2.492	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2ccc(C)s2)N(C2CCN(C)CC2)C1=O	ZINC000141225885	186029314	/nfs/dbraw/zinc/02/93/14/186029314.db2.gz	KKJKQLZNIJYCJU-DZGCQCFKSA-N	0	3	307.463	2.360	10	0		DEAEHN
CCCNCc1cc(S(=O)(=O)NCC(F)F)cn1C(C)C	ZINC000148182451	186043748	/nfs/dbraw/zinc/04/37/48/186043748.db2.gz	LSGXFYJILVHWFQ-UHFFFAOYSA-N	0	3	323.409	2.112	10	0		DEAEHN
CCc1cc(Br)ccc1NC[C@H](O)CN(C)C	ZINC000148292994	186043838	/nfs/dbraw/zinc/04/38/38/186043838.db2.gz	JQUXWDDUUVMXHP-LBPRGKRZSA-N	0	3	301.228	2.346	10	0		DEAEHN
CN1CCC[C@@H](CN2C(=O)C3(CC3)N[C@H]2c2cccs2)C1	ZINC000144250383	186034928	/nfs/dbraw/zinc/03/49/28/186034928.db2.gz	RCIKQPDPMDUNPY-TZMCWYRMSA-N	0	3	305.447	2.053	10	0		DEAEHN
CCNCc1cc(F)c(C)c(S(=O)(=O)N(C)C2CCC2)c1	ZINC000144613091	186036048	/nfs/dbraw/zinc/03/60/48/186036048.db2.gz	XDWOUHVQHQUZBQ-UHFFFAOYSA-N	0	3	314.426	2.417	10	0		DEAEHN
C[N-]S(=O)(=O)c1ccc(C[NH2+][C@H]2CCCC(C)(C)C2)o1	ZINC000149311243	186049316	/nfs/dbraw/zinc/04/93/16/186049316.db2.gz	IPEONYVEFKGNKW-NSHDSACASA-N	0	3	300.424	2.246	10	0		DEAEHN
CN[C@@H](C[C@H]1CN(C)CCN1C)c1ccc(F)c(F)c1F	ZINC000149554833	186051071	/nfs/dbraw/zinc/05/10/71/186051071.db2.gz	LIIFYOHZVFKSHB-GWCFXTLKSA-N	0	3	301.356	2.000	10	0		DEAEHN
C[C@H](N)c1cc(Br)ccc1OCc1nncn1C	ZINC000150046701	186054098	/nfs/dbraw/zinc/05/40/98/186054098.db2.gz	CTGWSTJHBWRZKH-QMMMGPOBSA-N	0	3	311.183	2.176	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1cc(Br)ccc1F	ZINC000159616986	186130778	/nfs/dbraw/zinc/13/07/78/186130778.db2.gz	DVCYFWAQCRUWQT-SNVBAGLBSA-N	0	3	319.174	2.281	10	0		DEAEHN
C[C@@H]1C[C@H](C)CN1S(=O)(=O)c1ccc(CN)cc1Cl	ZINC000164242891	186153416	/nfs/dbraw/zinc/15/34/16/186153416.db2.gz	ZOVZLLKLLPCOPV-VHSXEESVSA-N	0	3	302.827	2.218	10	0		DEAEHN
CC(C(=O)NCc1cc(F)ccc1Br)=C1CNC1	ZINC000164312244	186155661	/nfs/dbraw/zinc/15/56/61/186155661.db2.gz	LIHBJAGDVRWELR-UHFFFAOYSA-N	0	3	313.170	2.124	10	0		DEAEHN
CC(C)COc1ncccc1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000171480305	186166604	/nfs/dbraw/zinc/16/66/04/186166604.db2.gz	CVZITVWXVHIMMJ-CQSZACIVSA-N	0	3	303.406	2.037	10	0		DEAEHN
C[C@H]1CC[C@](CO)(N(C)Cc2cc(-c3cnn(C)c3)no2)C1	ZINC000187992601	186240424	/nfs/dbraw/zinc/24/04/24/186240424.db2.gz	NUQJRBKEVQHXIF-LRDDRELGSA-N	0	3	304.394	2.058	10	0		DEAEHN
CC(C)(C)N1CC[C@H]1CNC(=O)c1cc(Br)c[nH]1	ZINC000617019939	363001321	/nfs/dbraw/zinc/00/13/21/363001321.db2.gz	VEWHZZDEKUQUPH-JTQLQIEISA-N	0	3	314.227	2.380	10	0		DEAEHN
O=C(Nc1ccccc1-n1cccn1)N1CCN2CCC[C@@H]2C1	ZINC000171889668	198002396	/nfs/dbraw/zinc/00/23/96/198002396.db2.gz	MNMFCYKRKOPPID-CQSZACIVSA-N	0	3	311.389	2.184	10	0		DEAEHN
CC(=O)Nc1cccc(NC(=O)N2CCN3CCC[C@H]3C2)c1C	ZINC000171888296	198002558	/nfs/dbraw/zinc/00/25/58/198002558.db2.gz	SMDKAXFNNZKVDC-AWEZNQCLSA-N	0	3	316.405	2.265	10	0		DEAEHN
Cc1ccc(-c2cc(C(=O)N3C[C@H]4CCC[N@H+]4C[C@@H]3C)[n-]n2)o1	ZINC000172056522	198031976	/nfs/dbraw/zinc/03/19/76/198031976.db2.gz	VHLSUHDLKWQUQZ-WCQYABFASA-N	0	3	314.389	2.287	10	0		DEAEHN
Cc1ccc(-c2cc(C(=O)N3C[C@H]4CCC[N@@H+]4C[C@@H]3C)[n-]n2)o1	ZINC000172056522	198031977	/nfs/dbraw/zinc/03/19/77/198031977.db2.gz	VHLSUHDLKWQUQZ-WCQYABFASA-N	0	3	314.389	2.287	10	0		DEAEHN
O=C(C[C@@H]1CCOc2ccccc21)N1CCN2CCC[C@@H]2C1	ZINC000172120147	198042804	/nfs/dbraw/zinc/04/28/04/198042804.db2.gz	VOYAFBZAROBMOK-LSDHHAIUSA-N	0	3	300.402	2.249	10	0		DEAEHN
O=C(Cc1c[nH]c2ccc(F)cc12)N1CCN2CCC[C@H]2C1	ZINC000172217279	198059278	/nfs/dbraw/zinc/05/92/78/198059278.db2.gz	ZGQKDOMORFXLCM-AWEZNQCLSA-N	0	3	301.365	2.156	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c(C)c1	ZINC000173275263	198205479	/nfs/dbraw/zinc/20/54/79/198205479.db2.gz	BDKHDFPSAZOYCO-CABCVRRESA-N	0	3	310.463	2.407	10	0		DEAEHN
CCc1cnc(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)s1	ZINC000173398781	198210079	/nfs/dbraw/zinc/21/00/79/198210079.db2.gz	SPWKBRVQBLVLBX-VXGBXAGGSA-N	0	3	310.467	2.330	10	0		DEAEHN
CO[C@H](CNC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccccc1	ZINC000173701359	198242549	/nfs/dbraw/zinc/24/25/49/198242549.db2.gz	ZTTJCUSCFJKMOS-DLBZAZTESA-N	0	3	315.417	2.030	10	0		DEAEHN
COc1cccc(CCNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000173748115	198247494	/nfs/dbraw/zinc/24/74/94/198247494.db2.gz	PLUVRKNMAAFLKM-GDBMZVCRSA-N	0	3	319.449	2.362	10	0		DEAEHN
Cc1ccccc1OCCNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000174204762	198305804	/nfs/dbraw/zinc/30/58/04/198305804.db2.gz	MTNAXBYKSPAJII-HZPDHXFCSA-N	0	3	319.449	2.498	10	0		DEAEHN
COc1ccc(OC)c([C@@H](C)NC(=O)C2CCN(C)CC2)c1	ZINC000174442234	198335903	/nfs/dbraw/zinc/33/59/03/198335903.db2.gz	XMKKJQCJERYCKF-GFCCVEGCSA-N	0	3	306.406	2.223	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCc1coc(-c2ccccc2)n1	ZINC000174351947	198323424	/nfs/dbraw/zinc/32/34/24/198323424.db2.gz	YIXZZQQWAJRGPG-HNNXBMFYSA-N	0	3	314.389	2.235	10	0		DEAEHN
O[C@@H](CNc1cncc(Br)c1)CN1CCCCC1	ZINC000174684430	198370184	/nfs/dbraw/zinc/37/01/84/198370184.db2.gz	FROOVRIICIYKTK-ZDUSSCGKSA-N	0	3	314.227	2.103	10	0		DEAEHN
CC(C)C[C@@H](N)C(=O)Nc1ccc(OCC(F)(F)F)nc1	ZINC000037012551	354166548	/nfs/dbraw/zinc/16/65/48/354166548.db2.gz	XFSRRVNJHFFTOE-SNVBAGLBSA-N	0	3	305.300	2.335	10	0		DEAEHN
O=C(CCCCO)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000379607412	540121406	/nfs/dbraw/zinc/12/14/06/540121406.db2.gz	DZIDVLXVGIODPO-KRWDZBQOSA-N	0	3	304.434	2.320	10	0		DEAEHN
O=C1CCCN1C[C@@H](O)CN(Cc1ccc(Cl)cc1)C1CC1	ZINC000111684179	355749428	/nfs/dbraw/zinc/74/94/28/355749428.db2.gz	JHGROFNMMSXGMC-MRXNPFEDSA-N	0	3	322.836	2.288	10	0		DEAEHN
CN1CCC(N(C[C@H]2CCOC2)C(=O)Cc2cccs2)CC1	ZINC000169749124	355980342	/nfs/dbraw/zinc/98/03/42/355980342.db2.gz	CGSMFUMZDLWIAD-CQSZACIVSA-N	0	3	322.474	2.250	10	0		DEAEHN
CCC[C@@H](C)CN1CCN(CC(=O)N2CCCCCC2)CC1	ZINC000179621633	356029182	/nfs/dbraw/zinc/02/91/82/356029182.db2.gz	DCUPTPCBBPZXDX-QGZVFWFLSA-N	0	3	309.498	2.443	10	0		DEAEHN
C[C@@H](CN[C@@H]1CCCS(=O)(=O)C1)c1ccc(F)cc1F	ZINC000183051564	356158136	/nfs/dbraw/zinc/15/81/36/356158136.db2.gz	ZIYMKMLFKBAZDY-CMPLNLGQSA-N	0	3	303.374	2.235	10	0		DEAEHN
CS(=O)(=O)[C@H]1CCCC[C@H]1NCCc1cc(F)ccc1F	ZINC000183065691	356158764	/nfs/dbraw/zinc/15/87/64/356158764.db2.gz	SEVSHTATHKXHHV-CABCVRRESA-N	0	3	317.401	2.453	10	0		DEAEHN
COc1cc(C[NH2+][C@H](CO)C(C)C)cc(Br)c1[O-]	ZINC000080789531	192191200	/nfs/dbraw/zinc/19/12/00/192191200.db2.gz	LERJOHISCQEJHD-LLVKDONJSA-N	0	3	318.211	2.270	10	0		DEAEHN
NCc1cncc(I)c1OC(F)(F)F	ZINC000238571742	356304248	/nfs/dbraw/zinc/30/42/48/356304248.db2.gz	JDHRFKAXJYGSGI-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
C[C@@H](N[C@@H](C)c1nncn1C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000400399503	283156682	/nfs/dbraw/zinc/15/66/82/283156682.db2.gz	KFICWALKDICHII-FRRDWIJNSA-N	0	3	323.441	2.111	10	0		DEAEHN
Brc1ccccc1CN1CC[C@@H]2OCCN[C@@H]2C1	ZINC000404054532	283164507	/nfs/dbraw/zinc/16/45/07/283164507.db2.gz	GHFBQEFQYVBBSP-KGLIPLIRSA-N	0	3	311.223	2.012	10	0		DEAEHN
CC(C)CN(CCN(C)C)c1nnc(Br)s1	ZINC000081664301	192308297	/nfs/dbraw/zinc/30/82/97/192308297.db2.gz	ZWDQVSQHDHKFKM-UHFFFAOYSA-N	0	3	307.261	2.325	10	0		DEAEHN
CC[C@H](C)[C@H]([NH3+])C(=O)Nc1n[n-]c(-c2ccccc2Cl)n1	ZINC000236936562	202081605	/nfs/dbraw/zinc/08/16/05/202081605.db2.gz	CUPMPPWETHWXPS-KWQFWETISA-N	0	3	307.785	2.437	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)NCCc1nc(-c2ccccn2)cs1	ZINC000236976015	202103072	/nfs/dbraw/zinc/10/30/72/202103072.db2.gz	DTDCHTUNTOSXQA-IAQYHMDHSA-N	0	3	318.446	2.237	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)NCCCc1cc(OC)ccc1OC	ZINC000237028385	202126766	/nfs/dbraw/zinc/12/67/66/202126766.db2.gz	QQPDBVQJBZEMCF-LRDDRELGSA-N	0	3	308.422	2.126	10	0		DEAEHN
COc1cc(C[NH2+][C@@H]2CO[C@H](C)C2)cc(Br)c1[O-]	ZINC000402030760	356728571	/nfs/dbraw/zinc/72/85/71/356728571.db2.gz	YUWZIYSAOPZMRM-SCZZXKLOSA-N	0	3	316.195	2.430	10	0		DEAEHN
CCNCc1ccc(F)c(S(=O)(=O)N2CCC[C@@H](C)C2)c1	ZINC000088912908	192654818	/nfs/dbraw/zinc/65/48/18/192654818.db2.gz	XLCZJSFAYXZBAR-GFCCVEGCSA-N	0	3	314.426	2.356	10	0		DEAEHN
CC(C)N(C)S(=O)(=O)c1ccc(Cl)c(CN)c1Cl	ZINC000088917279	192655588	/nfs/dbraw/zinc/65/55/88/192655588.db2.gz	TXAJTJHZDNNCRU-UHFFFAOYSA-N	0	3	311.234	2.481	10	0		DEAEHN
CCC(CC)N(C)S(=O)(=O)c1c[nH]c(CNC(C)C)c1	ZINC000088963797	192671204	/nfs/dbraw/zinc/67/12/04/192671204.db2.gz	DHBKVXIFVDHHBF-UHFFFAOYSA-N	0	3	301.456	2.322	10	0		DEAEHN
CS(=O)(=O)Nc1cccc(CNCCc2ccccc2O)c1	ZINC000589649721	357487870	/nfs/dbraw/zinc/48/78/70/357487870.db2.gz	HAMVEELJOOMVBP-UHFFFAOYSA-N	0	3	320.414	2.096	10	0		DEAEHN
CN(C)CCn1cc(NC(=O)NCc2ccc(Cl)cc2)cn1	ZINC000591401533	357717910	/nfs/dbraw/zinc/71/79/10/357717910.db2.gz	RWFKFHAGAYRMBP-UHFFFAOYSA-N	0	3	321.812	2.420	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H](C)Cc1ccc(OC)c(OC)c1)N(C)C	ZINC000179233819	199002448	/nfs/dbraw/zinc/00/24/48/199002448.db2.gz	YGIYTCWVKZBNAE-HIFRSBDPSA-N	0	3	322.449	2.481	10	0		DEAEHN
CC[C@@H](C)N1CCN(CC(=O)Nc2ccccc2OC)CC1	ZINC000181136468	199255588	/nfs/dbraw/zinc/25/55/88/199255588.db2.gz	AWRYZJDUFDYTTD-CQSZACIVSA-N	0	3	305.422	2.050	10	0		DEAEHN
CCC(C)(C)N(C)S(=O)(=O)c1n[nH]c(C)c1CNC(C)C	ZINC000089039458	192713860	/nfs/dbraw/zinc/71/38/60/192713860.db2.gz	BVZDYYHIJGUHPC-UHFFFAOYSA-N	0	3	316.471	2.025	10	0		DEAEHN
Cc1csc([C@@H](C)CNC(=O)N2CC[C@@H](N3CC=CC3)C2)n1	ZINC000186809624	200013971	/nfs/dbraw/zinc/01/39/71/200013971.db2.gz	IRJLPUOFCHHMEB-GXTWGEPZSA-N	0	3	320.462	2.211	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCc2cc(Cl)cc3c2OCC3)C1	ZINC000186846275	200020860	/nfs/dbraw/zinc/02/08/60/200020860.db2.gz	BMZGNENWUGTKKH-AWEZNQCLSA-N	0	3	323.824	2.120	10	0		DEAEHN
CS(=O)(=O)NCC1CCN(Cc2cccc3ccoc32)CC1	ZINC000449314347	240352682	/nfs/dbraw/zinc/35/26/82/240352682.db2.gz	CGLYIVHTXUWTEO-UHFFFAOYSA-N	0	3	322.430	2.194	10	0		DEAEHN
Cc1c(-c2cc(CN(C)[C@]3(CO)CC[C@H](C)C3)on2)cnn1C	ZINC000187958026	200182994	/nfs/dbraw/zinc/18/29/94/200182994.db2.gz	ASBYZQPYSPAALC-YVEFUNNKSA-N	0	3	318.421	2.366	10	0		DEAEHN
C[C@H]1CC[C@](CO)(N(C)CC(=O)N(C)Cc2cccs2)C1	ZINC000187963735	200183890	/nfs/dbraw/zinc/18/38/90/200183890.db2.gz	ZPPFRSGRTHSOKX-BBRMVZONSA-N	0	3	310.463	2.189	10	0		DEAEHN
CO[C@H](C)[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000188412805	200242002	/nfs/dbraw/zinc/24/20/02/200242002.db2.gz	YHDMYIIVLVFHGJ-SJXGUFTOSA-N	0	3	305.422	2.154	10	0		DEAEHN
CCOC[C@@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)C(C)C	ZINC000189363938	200387508	/nfs/dbraw/zinc/38/75/08/200387508.db2.gz	AFNRKVSPOYBUBP-SWLSCSKDSA-N	0	3	314.451	2.046	10	0		DEAEHN
O[C@@H]1[C@H]2C[C@H]3CN(Cc4cnc(-c5ccncc5)s4)[C@H]1[C@H]3C2	ZINC000442967975	238095384	/nfs/dbraw/zinc/09/53/84/238095384.db2.gz	PXTQISDEEXZOBJ-YERCRUGSSA-N	0	3	313.426	2.406	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NC[C@@H]1OCCc2ccccc21	ZINC000603343292	360801035	/nfs/dbraw/zinc/80/10/35/360801035.db2.gz	ZKLOOJNLBNUHAH-IRXDYDNUSA-N	0	3	302.418	2.291	10	0		DEAEHN
O[C@]1(Cn2ccnn2)CCN(Cc2ccc(-c3ccccc3)o2)C1	ZINC000671493127	540978380	/nfs/dbraw/zinc/97/83/80/540978380.db2.gz	VKUKKCQJPQNNAW-GOSISDBHSA-N	0	3	324.384	2.175	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1C[C@H](C(F)(F)F)O[C@@H](C)C1	ZINC000608597724	361236215	/nfs/dbraw/zinc/23/62/15/361236215.db2.gz	AZSYQVVJLMFSEM-QJPTWQEYSA-N	0	3	308.344	2.039	10	0		DEAEHN
CCCN(C)CC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000610823009	361472346	/nfs/dbraw/zinc/47/23/46/361472346.db2.gz	DGCFBKJBSIWBAB-INIZCTEOSA-N	0	3	320.433	2.385	10	0		DEAEHN
COC(=O)C(C)(C)[C@H](NCCN1CCCC1=O)c1ccccc1	ZINC000611405510	361593283	/nfs/dbraw/zinc/59/32/83/361593283.db2.gz	FYXMGYWHSJGGPD-MRXNPFEDSA-N	0	3	318.417	2.139	10	0		DEAEHN
CO[C@@H]1CN(Cc2ccc(C(C)C)nc2C)C[C@H]1c1c[nH]nn1	ZINC000621316490	364349796	/nfs/dbraw/zinc/34/97/96/364349796.db2.gz	ZRFJBHDLEDINMY-WMLDXEAASA-N	0	3	315.421	2.246	10	0		DEAEHN
c1cc(CN[C@@H]2CCOC3(CCC3)C2)nc(N2CCOCC2)c1	ZINC000449258963	240266157	/nfs/dbraw/zinc/26/61/57/240266157.db2.gz	RREPUTMAVCBQFV-OAHLLOKOSA-N	0	3	317.433	2.110	10	0		DEAEHN
c1cc(CNC[C@H]2CN(Cc3ccncc3)CCO2)cs1	ZINC000623780822	365173648	/nfs/dbraw/zinc/17/36/48/365173648.db2.gz	YOASDCQRIGEWPO-INIZCTEOSA-N	0	3	303.431	2.134	10	0		DEAEHN
CN1CCOC[C@H]1CNCc1ccc(Br)c(F)c1	ZINC000623711651	365141550	/nfs/dbraw/zinc/14/15/50/365141550.db2.gz	KUNAVQPICQIEGI-LLVKDONJSA-N	0	3	317.202	2.008	10	0		DEAEHN
CN1CCOC[C@H]1CNCc1cccc(F)c1Br	ZINC000623712738	365141679	/nfs/dbraw/zinc/14/16/79/365141679.db2.gz	KGDRLLIRSOHSNI-LLVKDONJSA-N	0	3	317.202	2.008	10	0		DEAEHN
O=C(C[C@@H]1CNCCO1)Nc1c2ncsc2ccc1Cl	ZINC000091299738	193033836	/nfs/dbraw/zinc/03/38/36/193033836.db2.gz	VAAZUWIITZSDPH-MRVPVSSYSA-N	0	3	311.794	2.267	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccc(Br)nc2)C1	ZINC000091448224	193057978	/nfs/dbraw/zinc/05/79/78/193057978.db2.gz	VCBICHJYDXXYQU-NSHDSACASA-N	0	3	312.211	2.058	10	0		DEAEHN
C1=CCN([C@@H]2CCN(c3nc4ccccc4n4cncc34)C2)C1	ZINC000623997455	365248189	/nfs/dbraw/zinc/24/81/89/365248189.db2.gz	NBNOWUYOKNWVAV-CQSZACIVSA-N	0	3	305.385	2.333	10	0		DEAEHN
CC(C)c1c(CNC(C)(C)C)cnn1[C@H]1CCS(=O)(=O)C1	ZINC000091336284	193042911	/nfs/dbraw/zinc/04/29/11/193042911.db2.gz	XALWZJKFODZRPK-ZDUSSCGKSA-N	0	3	313.467	2.254	10	0		DEAEHN
CCCC(CCC)(C(N)=S)C(=O)N1CCC[C@H](N(C)C)C1	ZINC000091392133	193051274	/nfs/dbraw/zinc/05/12/74/193051274.db2.gz	ATOHCNZTXUNEHU-ZDUSSCGKSA-N	0	3	313.511	2.412	10	0		DEAEHN
Cc1cccc(NC(=O)[C@@H]2CCCN(CC3=CCCOC3)C2)n1	ZINC000091686441	193091405	/nfs/dbraw/zinc/09/14/05/193091405.db2.gz	JLPGCWXAXRZRJA-MRXNPFEDSA-N	0	3	315.417	2.387	10	0		DEAEHN
COc1ccc(Cl)cc1C[C@H](O)[C@H]1CN2CCC[C@@H]2CO1	ZINC000091715105	193097399	/nfs/dbraw/zinc/09/73/99/193097399.db2.gz	FFWIPJQZKBYDNG-IJEWVQPXSA-N	0	3	311.809	2.115	10	0		DEAEHN
CCS(=O)(=O)CCC[C@H](O)C1(N2CCCCC2)CCCC1	ZINC000091641752	193082597	/nfs/dbraw/zinc/08/25/97/193082597.db2.gz	BUPGAPCSZICALN-HNNXBMFYSA-N	0	3	317.495	2.361	10	0		DEAEHN
C[C@@H]1CC[C@H]([N-]S(=O)(=O)c2cc(Cl)cc(Cl)c2)C[NH2+]1	ZINC000624406897	365413425	/nfs/dbraw/zinc/41/34/25/365413425.db2.gz	OKDIPRYUFUMFBV-KCJUWKMLSA-N	0	3	323.245	2.412	10	0		DEAEHN
Cc1ccn2c(CN3CCC(Cn4ccnn4)CC3)cnc2c1	ZINC000092098256	193157104	/nfs/dbraw/zinc/15/71/04/193157104.db2.gz	HPDHRFSUSZZSAC-UHFFFAOYSA-N	0	3	310.405	2.146	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2ccc(Cl)c(CN)c2)C[C@@H]1C	ZINC000092113600	193161418	/nfs/dbraw/zinc/16/14/18/193161418.db2.gz	SQDSGFFIWYIDDH-UWVGGRQHSA-N	0	3	302.827	2.075	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)ccc1C	ZINC000092113766	193161786	/nfs/dbraw/zinc/16/17/86/193161786.db2.gz	SKVCEGWETSCYBZ-OKILXGFUSA-N	0	3	310.463	2.381	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)ccc1F	ZINC000092113603	193161859	/nfs/dbraw/zinc/16/18/59/193161859.db2.gz	DTLVLHIJBMYBGX-VXGBXAGGSA-N	0	3	314.426	2.212	10	0		DEAEHN
CC(C)(C)NS(=O)(=O)c1ccc(CNC2CC2)cc1F	ZINC000092115776	193163174	/nfs/dbraw/zinc/16/31/74/193163174.db2.gz	KPYXGZPVUDSSOI-UHFFFAOYSA-N	0	3	300.399	2.155	10	0		DEAEHN
C[NH2+]Cc1ccc(S(=O)(=O)[N-]Cc2ccccc2)c(F)c1	ZINC000092115828	193163406	/nfs/dbraw/zinc/16/34/06/193163406.db2.gz	MJCSARNLNQMVMI-UHFFFAOYSA-N	0	3	308.378	2.024	10	0		DEAEHN
CC1(C)CCCN(S(=O)(=O)c2ccc(CN)cc2F)C1	ZINC000092116220	193164495	/nfs/dbraw/zinc/16/44/95/193164495.db2.gz	XVAGNMJPWSELRO-UHFFFAOYSA-N	0	3	300.399	2.095	10	0		DEAEHN
CC(C)[NH2+]Cc1ccc(S(=O)(=O)[N-][C@@H]2C[C@@H]2C)c(F)c1	ZINC000092116074	193164550	/nfs/dbraw/zinc/16/45/50/193164550.db2.gz	LHDXKYQOLRIVLY-GXFFZTMASA-N	0	3	300.399	2.010	10	0		DEAEHN
c1c(CNC[C@H]2C[C@@H]2c2ccccc2)nnn1C[C@@H]1CCOC1	ZINC000631165573	368056447	/nfs/dbraw/zinc/05/64/47/368056447.db2.gz	NWKOKQDUKWNBHK-YXJHDRRASA-N	0	3	312.417	2.208	10	0		DEAEHN
C[C@H]1c2ccccc2C[C@H]1NCc1cn(C[C@@H]2CCOC2)nn1	ZINC000631171509	368059900	/nfs/dbraw/zinc/05/99/00/368059900.db2.gz	JXVDFZRXJCWUMM-SUNYJGFJSA-N	0	3	312.417	2.133	10	0		DEAEHN
COC[C@H](O)CN1CC[C@@H](c2cccc(Br)c2)C1	ZINC000451573232	243140554	/nfs/dbraw/zinc/14/05/54/243140554.db2.gz	UFUGFHILBFHKPD-TZMCWYRMSA-N	0	3	314.223	2.246	10	0		DEAEHN
C[C@@H](C(N)=S)N1CCN(C[C@H]2CSc3ccccc32)CC1	ZINC000092275971	193183819	/nfs/dbraw/zinc/18/38/19/193183819.db2.gz	PGDWAQYGVHFONO-STQMWFEESA-N	0	3	321.515	2.168	10	0		DEAEHN
COC(=O)[C@H](C)Oc1ccc(CN2CCC([C@@H](C)O)CC2)cc1	ZINC000092970849	193190102	/nfs/dbraw/zinc/19/01/02/193190102.db2.gz	HBEGWPGRHCNLIW-KGLIPLIRSA-N	0	3	321.417	2.220	10	0		DEAEHN
CNCc1sc(N(CCOC)[C@H](C)COC)nc1C(C)C	ZINC000093000059	193192860	/nfs/dbraw/zinc/19/28/60/193192860.db2.gz	HGEDRCUESJYGRO-GFCCVEGCSA-N	0	3	315.483	2.474	10	0		DEAEHN
COc1ccc(CN2CCCC[C@H]2CN2CCOCC2)cc1	ZINC000093012071	193194030	/nfs/dbraw/zinc/19/40/30/193194030.db2.gz	KALHRPXHGSBXTQ-KRWDZBQOSA-N	0	3	304.434	2.382	10	0		DEAEHN
CCCN[C@@H](Cc1c(Cl)c(CC)nn1C)C(OC)OC	ZINC000093305489	193227740	/nfs/dbraw/zinc/22/77/40/193227740.db2.gz	ZIKXBKMSGMWFNP-NSHDSACASA-N	0	3	303.834	2.166	10	0		DEAEHN
CN(CCc1cccs1)S(=O)(=O)c1ccccc1CN	ZINC000093294745	193226444	/nfs/dbraw/zinc/22/64/44/193226444.db2.gz	RGLHXZKBURJYGI-UHFFFAOYSA-N	0	3	310.444	2.070	10	0		DEAEHN
CCOC(OCC)[C@H](Cc1c(Cl)c(C)nn1CC)NC	ZINC000093306917	193227166	/nfs/dbraw/zinc/22/71/66/193227166.db2.gz	IIDXPSKLKNKRCM-NSHDSACASA-N	0	3	303.834	2.394	10	0		DEAEHN
CC(C)N[C@@]1(C(N)=O)CC[C@@H](N(CC(F)(F)F)C(C)C)C1	ZINC000093826241	193312796	/nfs/dbraw/zinc/31/27/96/193312796.db2.gz	RVVDAKLZZZFQGD-YPMHNXCESA-N	0	3	309.376	2.034	10	0		DEAEHN
CN[C@H](Cc1c(Cl)cccc1Cl)[C@H]1CN(C)CCN1C	ZINC000093894846	193324511	/nfs/dbraw/zinc/32/45/11/193324511.db2.gz	QOKTVIFXVJWRFI-HUUCEWRRSA-N	0	3	316.276	2.370	10	0		DEAEHN
CCN[C@H](Cc1c(F)cccc1Cl)[C@@H]1CN(C)CCN1C	ZINC000093895496	193325581	/nfs/dbraw/zinc/32/55/81/193325581.db2.gz	MZOSCTHQNVASSY-CVEARBPZSA-N	0	3	313.848	2.246	10	0		DEAEHN
CN[C@H]1COC[C@H]1c1nc(-c2ncc(Cl)cc2Cl)no1	ZINC000094199326	193348581	/nfs/dbraw/zinc/34/85/81/193348581.db2.gz	LVJLRYQEIPGZKS-APPZFPTMSA-N	0	3	315.160	2.140	10	0		DEAEHN
CCOC(=O)[C@]1(NCCN(CC)CC)CCCS[C@@H]1C	ZINC000094479799	193372740	/nfs/dbraw/zinc/37/27/40/193372740.db2.gz	QPBOANDXGQXIIY-HIFRSBDPSA-N	0	3	302.484	2.135	10	0		DEAEHN
CCCN[C@@H](c1cc(Cl)cnc1N)[C@H]1CSCCO1	ZINC000094504391	193374734	/nfs/dbraw/zinc/37/47/34/193374734.db2.gz	XTMWSOBOLCJZQG-NEPJUHHUSA-N	0	3	301.843	2.490	10	0		DEAEHN
CCC[C@@H](C[NH3+])C(=O)Nc1cc(Br)ccc1[O-]	ZINC000094573694	193381605	/nfs/dbraw/zinc/38/16/05/193381605.db2.gz	ZXLNGUNVHLOLSV-QMMMGPOBSA-N	0	3	301.184	2.468	10	0		DEAEHN
Brc1ccc2nc(NCCN3CCCCC3)nn2c1	ZINC000094604698	193383703	/nfs/dbraw/zinc/38/37/03/193383703.db2.gz	FTVCJQXQMXDSLK-UHFFFAOYSA-N	0	3	324.226	2.390	10	0		DEAEHN
CN1CCCC[C@H]1CNc1nc2c(Br)cccn2n1	ZINC000094604876	193383972	/nfs/dbraw/zinc/38/39/72/193383972.db2.gz	AVSIXRPUHBQICS-JTQLQIEISA-N	0	3	324.226	2.388	10	0		DEAEHN
CCOc1ccc([C@H](N)[C@H]2COCCO2)c(Br)c1	ZINC000094930819	193406324	/nfs/dbraw/zinc/40/63/24/193406324.db2.gz	BSEKVLMOCKEGKH-OLZOCXBDSA-N	0	3	316.195	2.263	10	0		DEAEHN
Cc1cc2cn[nH]c2c(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000266078188	205081100	/nfs/dbraw/zinc/08/11/00/205081100.db2.gz	MEGWBOWSHZIKEC-JSGCOSHPSA-N	0	3	300.406	2.426	10	0		DEAEHN
Cc1c(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)[nH]c2c1C(=O)CCC2	ZINC000266103258	205099727	/nfs/dbraw/zinc/09/97/27/205099727.db2.gz	SITOPOPQRDDRKT-YPMHNXCESA-N	0	3	317.433	2.397	10	0		DEAEHN
c1c2c(cc3c1OCCC[C@H]3NC[C@H]1COCCN1)CCCC2	ZINC000530220127	284376913	/nfs/dbraw/zinc/37/69/13/284376913.db2.gz	IZXVZSKHXNYCNQ-FUHWJXTLSA-N	0	3	316.445	2.357	10	0		DEAEHN
CN[C@H](CCc1ccccn1)c1c(Br)cnn1C	ZINC000097461513	193722126	/nfs/dbraw/zinc/72/21/26/193722126.db2.gz	RICZQTJYJZWZCL-GFCCVEGCSA-N	0	3	309.211	2.471	10	0		DEAEHN
CO[C@]1(CN[C@H](C)c2ccc(Br)o2)CCOC1	ZINC000160086684	197384748	/nfs/dbraw/zinc/38/47/48/197384748.db2.gz	WZEPHUOBSUQNJI-SKDRFNHKSA-N	0	3	304.184	2.498	10	0		DEAEHN
Cc1cccc([C@H](CN)N2CCN(c3nccs3)CC2)c1	ZINC000022153980	182311382	/nfs/dbraw/zinc/31/13/82/182311382.db2.gz	RCPZLDGRNKFELP-HNNXBMFYSA-N	0	3	302.447	2.274	10	0		DEAEHN
CCCOc1ccc(OCCN2CCO[C@@H](CN(C)C)C2)cc1	ZINC000155300069	291603541	/nfs/dbraw/zinc/60/35/41/291603541.db2.gz	IWFRMVTWFMLJGM-SFHVURJKSA-N	0	3	322.449	2.117	10	0		DEAEHN
Cc1cc(F)ccc1S(=O)(=O)NC[C@@H](N)c1ccccc1	ZINC000036297534	182813816	/nfs/dbraw/zinc/81/38/16/182813816.db2.gz	IIQFWHPGBUGCCM-CQSZACIVSA-N	0	3	308.378	2.112	10	0		DEAEHN
CC[C@H](NCc1c(Br)cnn1C)C1CCOCC1	ZINC000487306339	248753451	/nfs/dbraw/zinc/75/34/51/248753451.db2.gz	WUFVAYUBISOHAM-LBPRGKRZSA-N	0	3	316.243	2.477	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2ccc(Cl)c3cccnc23)C1	ZINC000040634091	183111788	/nfs/dbraw/zinc/11/17/88/183111788.db2.gz	FOOOJBGADONOGS-NOZJJQNGSA-N	0	3	305.765	2.204	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2cc(Br)ccc2C)C1	ZINC000040633597	183111973	/nfs/dbraw/zinc/11/19/73/183111973.db2.gz	XXVXRRWKIDAVHI-ZYHUDNBSSA-N	0	3	313.195	2.073	10	0		DEAEHN
Cc1nn(-c2cccc(F)c2)c2ncnc(NCCN(C)C)c12	ZINC000041471852	183193380	/nfs/dbraw/zinc/19/33/80/183193380.db2.gz	FZUPZZJIRDMNSN-UHFFFAOYSA-N	0	3	314.368	2.237	10	0		DEAEHN
CCCNC(=O)[C@@H](C)Oc1c(Br)cccc1CN	ZINC000042411320	183265263	/nfs/dbraw/zinc/26/52/63/183265263.db2.gz	HXDLXTFRPRTAJW-SECBINFHSA-N	0	3	315.211	2.201	10	0		DEAEHN
C[C@@H](CN1CCCC1)NC(=O)c1cncc(Br)c1	ZINC000042371205	183260726	/nfs/dbraw/zinc/26/07/26/183260726.db2.gz	VMLRUMRFJJJYRT-JTQLQIEISA-N	0	3	312.211	2.058	10	0		DEAEHN
CS(=O)(=O)c1cccc(O[C@@H](CN)c2cccc(F)c2)c1	ZINC000042974199	183325028	/nfs/dbraw/zinc/32/50/28/183325028.db2.gz	UPNBBFBQMXKLCG-HNNXBMFYSA-N	0	3	309.362	2.308	10	0		DEAEHN
CC[C@H](N)[C@H](c1cccc(Cl)c1)N(C)CC(=O)NC1CC1	ZINC000043014411	183327614	/nfs/dbraw/zinc/32/76/14/183327614.db2.gz	SYLSHAJZKYEIAD-HOCLYGCPSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccccc1Cl)N1CCS(=O)CC1	ZINC000043052237	183332503	/nfs/dbraw/zinc/33/25/03/183332503.db2.gz	AJZUYSQENTXJLW-KBPBESRZSA-N	0	3	300.855	2.183	10	0		DEAEHN
CCN(CC(F)(F)F)S(=O)(=O)c1cccc([C@@H](C)N)c1	ZINC000042782185	183308387	/nfs/dbraw/zinc/30/83/87/183308387.db2.gz	XOAPXSBQHJRTRX-SECBINFHSA-N	0	3	310.341	2.279	10	0		DEAEHN
CCC[NH2+][C@H](C)c1ccccc1[N-]S(=O)(=O)CCOC	ZINC000042808998	183311615	/nfs/dbraw/zinc/31/16/15/183311615.db2.gz	BLYOPNNAOOELJS-GFCCVEGCSA-N	0	3	300.424	2.135	10	0		DEAEHN
NC[C@H](Sc1nc(N)cc(N)n1)c1ccc(Cl)s1	ZINC000043258277	183348144	/nfs/dbraw/zinc/34/81/44/183348144.db2.gz	JJKDDBWNKZOZFT-LURJTMIESA-N	0	3	301.828	2.148	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccc(Br)s1)N1CCN(C)CC1	ZINC000043258593	183348454	/nfs/dbraw/zinc/34/84/54/183348454.db2.gz	BQAMDGSPYVZYIT-BXKDBHETSA-N	0	3	318.284	2.146	10	0		DEAEHN
CN[C@H](c1cccc(Br)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000043300587	183352214	/nfs/dbraw/zinc/35/22/14/183352214.db2.gz	SRQFIDCGFGIHCR-ZYHUDNBSSA-N	0	3	318.236	2.144	10	0		DEAEHN
CNCc1cc(Cl)c(OCC(=O)OC(C)C)c(OC)c1	ZINC000043445937	183364047	/nfs/dbraw/zinc/36/40/47/183364047.db2.gz	HUADLYFIFYKIQE-UHFFFAOYSA-N	0	3	301.770	2.398	10	0		DEAEHN
CN(C)C(=O)CCCOc1ccc(Br)cc1CN	ZINC000043447991	183364094	/nfs/dbraw/zinc/36/40/94/183364094.db2.gz	VYOMXLJIOZREBK-UHFFFAOYSA-N	0	3	315.211	2.155	10	0		DEAEHN
CNCc1cccc(Br)c1O[C@H](C)C(=O)OC	ZINC000043641288	183377180	/nfs/dbraw/zinc/37/71/80/183377180.db2.gz	ZKMHBFRSALTXHZ-MRVPVSSYSA-N	0	3	302.168	2.109	10	0		DEAEHN
CCC(CC)NC(=O)[C@@H](C)N(CCC(N)=S)CC(C)C	ZINC000043418460	183360962	/nfs/dbraw/zinc/36/09/62/183360962.db2.gz	ZKFHCTXAIBZKDV-GFCCVEGCSA-N	0	3	301.500	2.314	10	0		DEAEHN
CC(C)CCNC(=O)[C@@H](C)N(CCC(N)=S)CC(C)C	ZINC000043418456	183361194	/nfs/dbraw/zinc/36/11/94/183361194.db2.gz	DJQLGBSMGHUYQQ-CYBMUJFWSA-N	0	3	301.500	2.171	10	0		DEAEHN
COC(=O)CCNC(=O)CN[C@H](C)c1ccc(CC(C)C)cc1	ZINC000102685579	193916313	/nfs/dbraw/zinc/91/63/13/193916313.db2.gz	JGLFYIBATYGGME-CQSZACIVSA-N	0	3	320.433	2.215	10	0		DEAEHN
C[C@@H](CNCc1ccc(Br)c(F)c1)[S@](C)=O	ZINC000159789302	197364821	/nfs/dbraw/zinc/36/48/21/197364821.db2.gz	XJGVFYJOBZOWQB-ZKANADHPSA-N	0	3	308.216	2.445	10	0		DEAEHN
C[C@@H](CNC(=O)N(C)Cc1ccc(Cl)nc1)N(C)C1CC1	ZINC000105268235	194090146	/nfs/dbraw/zinc/09/01/46/194090146.db2.gz	IPRGLYNLBUJBGG-NSHDSACASA-N	0	3	310.829	2.359	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)N(C)Cc2ccccc2C)c1	ZINC000105881729	194156310	/nfs/dbraw/zinc/15/63/10/194156310.db2.gz	MSNZBOVUXWDNNZ-MRXNPFEDSA-N	0	3	314.433	2.137	10	0		DEAEHN
CC(C)c1cccc(NC(=O)CN2CCO[C@H](CN(C)C)C2)c1	ZINC000105927490	194173370	/nfs/dbraw/zinc/17/33/70/194173370.db2.gz	HJIGVWUVCZSMIA-QGZVFWFLSA-N	0	3	319.449	2.011	10	0		DEAEHN
CC[C@@H](C(N)=S)N1CCN(Cc2ccc(C)c(C)c2)CC1	ZINC000109469228	194267555	/nfs/dbraw/zinc/26/75/55/194267555.db2.gz	SGDLSMCWFIHSCI-INIZCTEOSA-N	0	3	305.491	2.486	10	0		DEAEHN
COc1ccc([C@H](CN)N2CCOC[C@@H]2C)c(Cl)c1OC	ZINC000110828053	194362336	/nfs/dbraw/zinc/36/23/36/194362336.db2.gz	XWKHLADBKRZFOM-JQWIXIFHSA-N	0	3	314.813	2.078	10	0		DEAEHN
CN[C@@H](C)c1ccc(C)cc1OCC(=O)NCC(F)(F)F	ZINC000110960315	194374100	/nfs/dbraw/zinc/37/41/00/194374100.db2.gz	IZZNHCNDEINCNT-JTQLQIEISA-N	0	3	304.312	2.333	10	0		DEAEHN
CCOc1cc(C[NH2+]CCOC)cc(Br)c1[O-]	ZINC000057901201	184061213	/nfs/dbraw/zinc/06/12/13/184061213.db2.gz	BEBHBITVSWSLGN-UHFFFAOYSA-N	0	3	304.184	2.289	10	0		DEAEHN
O=C(N[C@@H]1COc2ccccc21)NC1CCN(C2CC2)CC1	ZINC000058577249	184122780	/nfs/dbraw/zinc/12/27/80/184122780.db2.gz	OZNPSSUTXNDCHS-OAHLLOKOSA-N	0	3	301.390	2.046	10	0		DEAEHN
CCc1ccccc1NC(=O)CN1CCCN(C2CC2)CC1	ZINC000061041546	184160986	/nfs/dbraw/zinc/16/09/86/184160986.db2.gz	JUZKJYFYLDKJEL-UHFFFAOYSA-N	0	3	301.434	2.358	10	0		DEAEHN
[NH3+]Cc1ccc(S(=O)(=O)[N-]c2cc(F)c(F)cc2F)cc1	ZINC000061094194	184161659	/nfs/dbraw/zinc/16/16/59/184161659.db2.gz	UKXHQPJHIUFRDL-UHFFFAOYSA-N	0	3	316.304	2.363	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccccc1C(N)=S)N(C)CC1CCC1	ZINC000061457956	184171487	/nfs/dbraw/zinc/17/14/87/184171487.db2.gz	LRGSRWWJXONJQE-NSHDSACASA-N	0	3	305.447	2.380	10	0		DEAEHN
COc1ccc(CCC(=O)N2CCCN(C3CC3)CC2)cc1F	ZINC000061604989	184177518	/nfs/dbraw/zinc/17/75/18/184177518.db2.gz	IOSOXGQVDWYNAX-UHFFFAOYSA-N	0	3	320.408	2.464	10	0		DEAEHN
Cc1cc(C)cc(S(=O)(=O)NCc2ccccc2CN)c1	ZINC000061841338	184189496	/nfs/dbraw/zinc/18/94/96/184189496.db2.gz	ADPOKAUREAJBHI-UHFFFAOYSA-N	0	3	304.415	2.241	10	0		DEAEHN
C[C@H]1CN(CCC(=O)Nc2ccc(Cl)cc2N)CCCO1	ZINC000061912929	184195121	/nfs/dbraw/zinc/19/51/21/184195121.db2.gz	OLKCLOLSTLOAFK-NSHDSACASA-N	0	3	311.813	2.362	10	0		DEAEHN
CC(C)N(CCO)c1nc2sccn2c1CNC(C)(C)C	ZINC000062737595	184251955	/nfs/dbraw/zinc/25/19/55/184251955.db2.gz	VUCBXPICLQLWQU-UHFFFAOYSA-N	0	3	310.467	2.491	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2cc(C(F)(F)F)ccc2F)C1	ZINC000062657515	184246874	/nfs/dbraw/zinc/24/68/74/184246874.db2.gz	AWAJJOJSNMBJOZ-KCJUWKMLSA-N	0	3	306.259	2.160	10	0		DEAEHN
NNc1ccc(Cl)c(CN2CCOc3ccccc3C2)n1	ZINC000063013393	184266662	/nfs/dbraw/zinc/26/66/62/184266662.db2.gz	IIMLNACKJVRHQZ-UHFFFAOYSA-N	0	3	304.781	2.415	10	0		DEAEHN
[NH3+][C@H]1CCC[C@@H]1[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000063175823	184276492	/nfs/dbraw/zinc/27/64/92/184276492.db2.gz	GGEREEBUWAXNRJ-UWVGGRQHSA-N	0	3	309.218	2.152	10	0		DEAEHN
COC(=O)c1ccc(C)c(NC(=O)[C@@H](C)N[C@H](C)[C@@H](C)OC)c1	ZINC000555121644	291787187	/nfs/dbraw/zinc/78/71/87/291787187.db2.gz	GRSOEBHIBXDTPS-JHJVBQTASA-N	0	3	322.405	2.122	10	0		DEAEHN
O=C1[C@H](N[C@@H]2CCCc3ccccc32)CCN1C1CCOCC1	ZINC000358190445	285003699	/nfs/dbraw/zinc/00/36/99/285003699.db2.gz	NXMMTRVINIUMAN-QZTJIDSGSA-N	0	3	314.429	2.434	10	0		DEAEHN
COCCN1CCCN(C[C@H](C)Cc2ccccc2)CC1=O	ZINC000191698919	285017683	/nfs/dbraw/zinc/01/76/83/285017683.db2.gz	ARPDDVHDBCBVDU-MRXNPFEDSA-N	0	3	304.434	2.046	10	0		DEAEHN
CCOc1ccc(Cl)cc1NC(=O)[C@H](N)CCCOC	ZINC000159275916	197341909	/nfs/dbraw/zinc/34/19/09/197341909.db2.gz	WIBMSCLIEGVYKE-LLVKDONJSA-N	0	3	300.786	2.431	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2CCCCC2)cc(C)c1F	ZINC000159056225	197322865	/nfs/dbraw/zinc/32/28/65/197322865.db2.gz	RFNBFHCEELRQKB-UHFFFAOYSA-N	0	3	314.426	2.418	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCCC2)cc(CNC(C)C)c1F	ZINC000159048272	197321962	/nfs/dbraw/zinc/32/19/62/197321962.db2.gz	GEBVNZQSRJVAOU-UHFFFAOYSA-N	0	3	314.426	2.417	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2ccc(-c3ccccc3)nn2)C1	ZINC000158952620	197313811	/nfs/dbraw/zinc/31/38/11/197313811.db2.gz	YTVZBELTLSRMKC-AWEZNQCLSA-N	0	3	311.389	2.311	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)c2cccc(-n3cccn3)c2)[C@@H](C)C1	ZINC000158908409	197310663	/nfs/dbraw/zinc/31/06/63/197310663.db2.gz	ZMWRGCTVBQWAMJ-YOEHRIQHSA-N	0	3	312.417	2.331	10	0		DEAEHN
COc1cnn(C)c1[C@H](N)Cc1cccc(Br)c1	ZINC000158476863	197276253	/nfs/dbraw/zinc/27/62/53/197276253.db2.gz	DKAJMGVMQYBQSG-LLVKDONJSA-N	0	3	310.195	2.434	10	0		DEAEHN
C[C@H]1C[C@@H](Nc2nc3ccc(Br)cn3n2)CCN1C	ZINC000158444082	197273449	/nfs/dbraw/zinc/27/34/49/197273449.db2.gz	YEEBLHYKBGULJI-ONGXEEELSA-N	0	3	324.226	2.386	10	0		DEAEHN
Cc1cc(-n2cc(Br)cn2)c(C(N)=S)c(C)n1	ZINC000157525548	197194169	/nfs/dbraw/zinc/19/41/69/197194169.db2.gz	QSTCBUMTTRMWGF-UHFFFAOYSA-N	0	3	311.208	2.281	10	0		DEAEHN
CC[C@@H]1CN([C@@H](CN)c2ccc3c(c2)OCCO3)CCS1	ZINC000157406110	197185741	/nfs/dbraw/zinc/18/57/41/197185741.db2.gz	SWEHBSMPAZLSRR-KGLIPLIRSA-N	0	3	308.447	2.285	10	0		DEAEHN
COc1cccc(OC)c1CC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000157123762	197163757	/nfs/dbraw/zinc/16/37/57/197163757.db2.gz	TWNHUPDFDCNAQP-AWEZNQCLSA-N	0	3	322.449	2.339	10	0		DEAEHN
CCCNc1nc(Cl)nc(N2CC[C@H]3CC[C@@H](C2)N3C)n1	ZINC000157115404	197163105	/nfs/dbraw/zinc/16/31/05/197163105.db2.gz	CIKCXYKSLKIHFR-MNOVXSKESA-N	0	3	310.833	2.020	10	0		DEAEHN
CN[C@H](Cc1c(Br)c(C)nn1C)c1ccnc(C)n1	ZINC000156575109	197124970	/nfs/dbraw/zinc/12/49/70/197124970.db2.gz	QAAXITDEDRBWLO-LLVKDONJSA-N	0	3	324.226	2.093	10	0		DEAEHN
COc1cccc2sc(C(=O)NC[C@@H](C)N(C)C)c(N)c21	ZINC000156177579	197092992	/nfs/dbraw/zinc/09/29/92/197092992.db2.gz	DWGOXSBLDAHFRE-SECBINFHSA-N	0	3	307.419	2.172	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)ccc1C	ZINC000155382675	197049864	/nfs/dbraw/zinc/04/98/64/197049864.db2.gz	JCWPUDRINXPBJS-GUYCJALGSA-N	0	3	317.433	2.412	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)ccc1C	ZINC000155382591	197049434	/nfs/dbraw/zinc/04/94/34/197049434.db2.gz	JCWPUDRINXPBJS-SUMWQHHRSA-N	0	3	317.433	2.412	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N(C)[C@H]1CCN(C)C[C@H]1C	ZINC000120449581	195168415	/nfs/dbraw/zinc/16/84/15/195168415.db2.gz	MHWVOEHIZFBHTH-LGWLGOQQSA-N	0	3	302.418	2.350	10	0		DEAEHN
Cc1nc(CN2CC[C@@]3(CCC[C@H]3C(=O)N3CCCC3)C2)c[nH]1	ZINC000248014015	257112330	/nfs/dbraw/zinc/11/23/30/257112330.db2.gz	GXJHQNWHKRKBQD-WMZOPIPTSA-N	0	3	316.449	2.333	10	0		DEAEHN
Cc1ncc(CN2CC[C@@]3(CCC[C@H]3C(=O)N3CCCC3)C2)[nH]1	ZINC000248014015	257112331	/nfs/dbraw/zinc/11/23/31/257112331.db2.gz	GXJHQNWHKRKBQD-WMZOPIPTSA-N	0	3	316.449	2.333	10	0		DEAEHN
c1cncc(C[C@@H]2[C@H](OCC3CC3)CCN2[C@H]2CCOC2)c1	ZINC000247851490	257116319	/nfs/dbraw/zinc/11/63/19/257116319.db2.gz	RUSYQJTWRATFLC-RCCFBDPRSA-N	0	3	302.418	2.283	10	0		DEAEHN
O=C(NC1CC1)[C@@H]1CO[C@@H]2CCN(Cc3ccsc3)C[C@@H]2C1	ZINC000247735998	257118327	/nfs/dbraw/zinc/11/83/27/257118327.db2.gz	KQSVFQJCBNMGOG-OFQRWUPVSA-N	0	3	320.458	2.254	10	0		DEAEHN
CC[C@@H](C)OCC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000328619521	257264170	/nfs/dbraw/zinc/26/41/70/257264170.db2.gz	FZGZDQLSILZVDW-HFTRVMKXSA-N	0	3	319.449	2.348	10	0		DEAEHN
COC[C@H](C)C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000163359863	285332034	/nfs/dbraw/zinc/33/20/34/285332034.db2.gz	RMSRAGYHVRZXAT-MAUKXSAKSA-N	0	3	304.434	2.440	10	0		DEAEHN
CN1CCC(CN2C(=O)C3(CC3)N[C@@H]2c2ccsc2)CC1	ZINC000121984334	195385860	/nfs/dbraw/zinc/38/58/60/195385860.db2.gz	NKTVCIGSQNNXTN-AWEZNQCLSA-N	0	3	305.447	2.053	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2ccc(N3CCCC3)nc2)CCN1C	ZINC000127558237	195888474	/nfs/dbraw/zinc/88/84/74/195888474.db2.gz	XVABXRAITXGDSW-GDBMZVCRSA-N	0	3	316.449	2.237	10	0		DEAEHN
CCN1CCN(C(=O)[C@@H](C)N2CCC3(C2)CCCCC3)CC1	ZINC000357726687	133096261	/nfs/dbraw/zinc/09/62/61/133096261.db2.gz	HTDYVWJOSRXHTM-MRXNPFEDSA-N	0	3	307.482	2.195	10	0		DEAEHN
CN(C[C@H]1CCCN(C)C1)C(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000360073581	133160357	/nfs/dbraw/zinc/16/03/57/133160357.db2.gz	GINXWFKKIADVPZ-AWEZNQCLSA-N	0	3	314.429	2.158	10	0		DEAEHN
COc1c(C)cnc(CN(C)C(=O)CC2CCN(C)CC2)c1C	ZINC000362665176	133244355	/nfs/dbraw/zinc/24/43/55/133244355.db2.gz	NZHSWJUHGOXGBT-UHFFFAOYSA-N	0	3	319.449	2.397	10	0		DEAEHN
COC[C@H](C)OC[C@H](O)CN1CC[C@H](C)C[C@@H]1c1ccco1	ZINC000377082181	133318081	/nfs/dbraw/zinc/31/80/81/133318081.db2.gz	KBHRMLOXORPJOQ-CAOSSQGBSA-N	0	3	311.422	2.465	10	0		DEAEHN
O=C(C1=Cc2cc(Cl)ccc2OC1)N1CCN2CCC1CC2	ZINC000188646548	145014999	/nfs/dbraw/zinc/01/49/99/145014999.db2.gz	NJVUVTKQLFNNLH-UHFFFAOYSA-N	0	3	318.804	2.422	10	0		DEAEHN
CCOC1CC(CCNC(=O)N[C@H](CC(C)C)CN(C)C)C1	ZINC000190125600	145038075	/nfs/dbraw/zinc/03/80/75/145038075.db2.gz	JNBUQPLDQNLNAS-HWOWSKLDSA-N	0	3	313.486	2.467	10	0		DEAEHN
CCC[C@@H](C)NC(=O)[C@H](C)N1CCC(c2n[nH]c(CC)n2)CC1	ZINC000190662759	145045558	/nfs/dbraw/zinc/04/55/58/145045558.db2.gz	PFJJJIRFRJEPHF-OLZOCXBDSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCC[C@@H](C)NC(=O)[C@H](C)N1CCC(c2nc(CC)n[nH]2)CC1	ZINC000190662759	145045559	/nfs/dbraw/zinc/04/55/59/145045559.db2.gz	PFJJJIRFRJEPHF-OLZOCXBDSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCC[C@@H](C)NC(=O)[C@H](C)N1CCC(c2nnc(CC)[nH]2)CC1	ZINC000190662759	145045560	/nfs/dbraw/zinc/04/55/60/145045560.db2.gz	PFJJJIRFRJEPHF-OLZOCXBDSA-N	0	3	321.469	2.240	10	0		DEAEHN
CO[C@@H](C)[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C)o1	ZINC000190675808	145046691	/nfs/dbraw/zinc/04/66/91/145046691.db2.gz	RWBZKSZOBJJKBQ-KBPBESRZSA-N	0	3	311.426	2.085	10	0		DEAEHN
Oc1cccc(CN2CCN(C[C@@H](O)C3CCCCC3)CC2)c1	ZINC000190882661	145049775	/nfs/dbraw/zinc/04/97/75/145049775.db2.gz	GENCHXAOGWNQFB-LJQANCHMSA-N	0	3	318.461	2.451	10	0		DEAEHN
C[C@@H](CCNC(=O)N1CCO[C@@H](CN(C)C)C1)CC(C)(C)C	ZINC000190991928	145051971	/nfs/dbraw/zinc/05/19/71/145051971.db2.gz	WLTDUIKYNNARTC-GJZGRUSLSA-N	0	3	313.486	2.421	10	0		DEAEHN
CCc1nnc(C2CCN(Cc3cn4ccccc4n3)CC2)[nH]1	ZINC000191694104	145062490	/nfs/dbraw/zinc/06/24/90/145062490.db2.gz	SWTMKWVLNFFIGM-UHFFFAOYSA-N	0	3	310.405	2.394	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCN2CCC[C@H]2C1)Oc1cccc(F)c1	ZINC000246139847	145093807	/nfs/dbraw/zinc/09/38/07/145093807.db2.gz	JKVUQSUKZHFTBM-ZFWWWQNUSA-N	0	3	321.396	2.083	10	0		DEAEHN
COC(=O)CCCN1C[C@H](C(=O)OC)C[C@H](c2ccccc2)C1	ZINC000246227650	145095549	/nfs/dbraw/zinc/09/55/49/145095549.db2.gz	FNTQTZPQYNQYAQ-JKSUJKDBSA-N	0	3	319.401	2.218	10	0		DEAEHN
C[C@H]1CN(CCOc2ccc(Cl)cc2)C[C@H]1N1CCOCC1	ZINC000246322620	145098893	/nfs/dbraw/zinc/09/88/93/145098893.db2.gz	DCWFHFBOYQRIEU-WMLDXEAASA-N	0	3	324.852	2.371	10	0		DEAEHN
CCc1ccccc1NC(=O)C(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000246345002	145099363	/nfs/dbraw/zinc/09/93/63/145099363.db2.gz	HFZVNUPRDXTYTJ-CZUORRHYSA-N	0	3	317.433	2.032	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NC(=O)N[C@H]2CCCN(CC)C2)C12CCC2	ZINC000246336267	145099756	/nfs/dbraw/zinc/09/97/56/145099756.db2.gz	OQVFNNCIKYPKNP-RRFJBIMHSA-N	0	3	309.454	2.118	10	0		DEAEHN
O=C(CN1CCN2CCC[C@H]2C1)Nc1cccc2c1N=S=N2	ZINC000246400308	145101795	/nfs/dbraw/zinc/10/17/95/145101795.db2.gz	PYBQILCTLHAADV-NSHDSACASA-N	0	3	317.418	2.132	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)[C@@H](C)N1CCN2CCC[C@H]2C1	ZINC000246410862	145102171	/nfs/dbraw/zinc/10/21/71/145102171.db2.gz	QSLRBYXBYYLVJM-AEFFLSMTSA-N	0	3	315.461	2.204	10	0		DEAEHN
C[C@H](C(=O)NCc1ccccc1F)N1CC[C@H]2OCCC[C@H]2C1	ZINC000246445710	145103026	/nfs/dbraw/zinc/10/30/26/145103026.db2.gz	BOZHSDIPLNHNGB-UKPHBRMFSA-N	0	3	320.408	2.331	10	0		DEAEHN
CC[C@H]1CN(CCCc2cccc(OC)c2)CCN1C[C@H](C)O	ZINC000246514758	145104565	/nfs/dbraw/zinc/10/45/65/145104565.db2.gz	BNFIAMSOLBZVQA-WMZOPIPTSA-N	0	3	320.477	2.405	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000246598605	145108439	/nfs/dbraw/zinc/10/84/39/145108439.db2.gz	ZJZSSEQDAHHQPL-CABCVRRESA-N	0	3	317.433	2.087	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@H]1C(=O)NCCN1CCC[C@@H](C)C1	ZINC000246640720	145109118	/nfs/dbraw/zinc/10/91/18/145109118.db2.gz	DUFYJAJRKFEBMF-CKEIUWERSA-N	0	3	302.418	2.399	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)CSCc2cccnc2)C1	ZINC000247012947	145123189	/nfs/dbraw/zinc/12/31/89/145123189.db2.gz	HFDMWZRCNBKVIN-DZGCQCFKSA-N	0	3	307.463	2.160	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cnc(-c2ccccc2)nc1	ZINC000247020306	145123687	/nfs/dbraw/zinc/12/36/87/145123687.db2.gz	GBAOJSKYQZLVTB-YOEHRIQHSA-N	0	3	322.412	2.452	10	0		DEAEHN
Cc1cnn([C@H]2CCCN(C[C@@H](O)COc3ccccc3)C2)c1	ZINC000247039750	145124617	/nfs/dbraw/zinc/12/46/17/145124617.db2.gz	DRCNGAILOVAOHO-DLBZAZTESA-N	0	3	315.417	2.268	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@H](C)N2CCN3CCC[C@H]3C2)c(F)c1	ZINC000247064186	145124761	/nfs/dbraw/zinc/12/47/61/145124761.db2.gz	GBJVUHJTBMQMSG-KGLIPLIRSA-N	0	3	305.397	2.241	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)CSCc1cccnc1	ZINC000247063024	145124902	/nfs/dbraw/zinc/12/49/02/145124902.db2.gz	HJIZBYVEFKWPQJ-ZFWWWQNUSA-N	0	3	305.447	2.010	10	0		DEAEHN
O=C([C@@H]1C[C@H]1c1c(F)cccc1F)N1CCN2CCC[C@H]2C1	ZINC000247256333	145130650	/nfs/dbraw/zinc/13/06/50/145130650.db2.gz	QASYMQWHGBQXQM-YNEHKIRRSA-N	0	3	306.356	2.375	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCOc3ccccc32)CCN1C	ZINC000247296510	145132027	/nfs/dbraw/zinc/13/20/27/145132027.db2.gz	GRZSSJKJGHBQSE-FMKPAKJESA-N	0	3	302.418	2.494	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@H](c2ccccc2)N(C)C)CCN1C	ZINC000247342971	145134183	/nfs/dbraw/zinc/13/41/83/145134183.db2.gz	JHGJCWURZSQCDH-OIISXLGYSA-N	0	3	303.450	2.230	10	0		DEAEHN
Cc1ccc(C)c(OCCN2CCN(C[C@H](C)O)[C@@H](C)C2)c1	ZINC000247400636	145136262	/nfs/dbraw/zinc/13/62/62/145136262.db2.gz	YJFGEKHPMFBFRK-IRXDYDNUSA-N	0	3	306.450	2.069	10	0		DEAEHN
O[C@@H](CN1CCCC[C@H]1CN1CCOCC1)c1ccc(F)cc1	ZINC000247495734	145139301	/nfs/dbraw/zinc/13/93/01/145139301.db2.gz	HKPAHDBHAIYYDQ-ROUUACIJSA-N	0	3	322.424	2.046	10	0		DEAEHN
O=C(N[C@H]1CCCOC1)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000247808432	145144683	/nfs/dbraw/zinc/14/46/83/145144683.db2.gz	UBFVVLWCFGPREC-WBVHZDCISA-N	0	3	320.408	2.333	10	0		DEAEHN
CCN(C(=O)[C@H](C)COC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000248719226	145164782	/nfs/dbraw/zinc/16/47/82/145164782.db2.gz	HCCKMCRWAALSRE-WBVHZDCISA-N	0	3	304.434	2.392	10	0		DEAEHN
CCOCCN1CCN(C[C@@H](O)CC2CCCC2)C[C@@H]1CC	ZINC000248879960	145171589	/nfs/dbraw/zinc/17/15/89/145171589.db2.gz	GBSGSMQRSVKYNS-ROUUACIJSA-N	0	3	312.498	2.360	10	0		DEAEHN
COc1ccc(F)c(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c1OC	ZINC000249045578	145176524	/nfs/dbraw/zinc/17/65/24/145176524.db2.gz	NMDBICQKNIBHKS-NEPJUHHUSA-N	0	3	322.380	2.152	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1N[C@H]1CCN(c2ccc(Cl)cc2)C1=O	ZINC000249387089	145183598	/nfs/dbraw/zinc/18/35/98/145183598.db2.gz	XBQAUXDYFFCJHB-UGFHNGPFSA-N	0	3	308.809	2.460	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(C[C@@H](O)CSC)C2)c1	ZINC000249487306	145185633	/nfs/dbraw/zinc/18/56/33/145185633.db2.gz	XFOTXZMXFYCKPJ-TZMCWYRMSA-N	0	3	311.447	2.217	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN(CC(=O)N[C@H](C)C(C)C)C2)n1	ZINC000249884068	145190639	/nfs/dbraw/zinc/19/06/39/145190639.db2.gz	OKPHYCQVBYOKCX-HZPDHXFCSA-N	0	3	318.465	2.285	10	0		DEAEHN
C[C@@H]1OCCC[C@H]1C(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000250120617	145192719	/nfs/dbraw/zinc/19/27/19/145192719.db2.gz	IPWJXESBALYKKL-USXIJHARSA-N	0	3	304.434	2.091	10	0		DEAEHN
CCOCCN1CCN(CCCOc2ccccc2)C[C@H]1C	ZINC000252321827	145198885	/nfs/dbraw/zinc/19/88/85/145198885.db2.gz	ZCDLTKOYHPPYSD-QGZVFWFLSA-N	0	3	306.450	2.498	10	0		DEAEHN
CC1(C)[C@H](NCC(=O)NCCc2ccccc2)[C@@H]2CCCO[C@H]21	ZINC000252734534	145200475	/nfs/dbraw/zinc/20/04/75/145200475.db2.gz	NGYLVSSNSNACNT-CGTJXYLNSA-N	0	3	316.445	2.139	10	0		DEAEHN
COc1cc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)ccc1F	ZINC000261632088	145212209	/nfs/dbraw/zinc/21/22/09/145212209.db2.gz	DDJHQDNEQXSTFF-HYSWKAIVSA-N	0	3	322.380	2.305	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)Nc1ccc2c(c1)CCO2	ZINC000261640009	145212367	/nfs/dbraw/zinc/21/23/67/145212367.db2.gz	DSYFXQHANLLIRE-SIIHOXLZSA-N	0	3	316.401	2.093	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)CN2CCNC[C@@H]2c2cccnc2)c1	ZINC000261768663	145224414	/nfs/dbraw/zinc/22/44/14/145224414.db2.gz	OPXLRKUBXNJNGO-GOSISDBHSA-N	0	3	324.428	2.283	10	0		DEAEHN
CCCOc1ccc([C@H](C)NC(=O)C2(N)CCOCC2)cc1	ZINC000261785022	145225981	/nfs/dbraw/zinc/22/59/81/145225981.db2.gz	HUBHIGIFJKYESP-ZDUSSCGKSA-N	0	3	306.406	2.161	10	0		DEAEHN
N[C@@H]1CN(C(=O)COc2cccc(F)c2)C[C@H]1c1ccccc1	ZINC000261802055	145228003	/nfs/dbraw/zinc/22/80/03/145228003.db2.gz	QYOKPAPWIWSOKW-DLBZAZTESA-N	0	3	314.360	2.158	10	0		DEAEHN
CN(Cc1ccccc1C(F)(F)F)C(=O)C1(N)CCOCC1	ZINC000261851626	145233669	/nfs/dbraw/zinc/23/36/69/145233669.db2.gz	MKTAUHHCGDOVKT-UHFFFAOYSA-N	0	3	316.323	2.172	10	0		DEAEHN
NC1(C(=O)NCC(c2ccccc2)c2ccccc2)CCOCC1	ZINC000261889328	145238020	/nfs/dbraw/zinc/23/80/20/145238020.db2.gz	QHOZKABZZQUIOT-UHFFFAOYSA-N	0	3	324.424	2.443	10	0		DEAEHN
COc1c(C)cc(CN2CCNC[C@@H]2c2nccn2C)cc1C	ZINC000261929143	145243153	/nfs/dbraw/zinc/24/31/53/145243153.db2.gz	COPGLSLSQMLAQT-MRXNPFEDSA-N	0	3	314.433	2.192	10	0		DEAEHN
COC(=O)[C@H]1CC12CCN(Cc1cccc3c1NCC3)CC2	ZINC000261927517	145243274	/nfs/dbraw/zinc/24/32/74/145243274.db2.gz	LBXPJQQRDYYQRY-OAHLLOKOSA-N	0	3	300.402	2.430	10	0		DEAEHN
Cc1ccc(NC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)c(C)c1O	ZINC000261944487	145245066	/nfs/dbraw/zinc/24/50/66/145245066.db2.gz	VGPMDZOMPXEPFP-WBHUJUFNSA-N	0	3	318.417	2.480	10	0		DEAEHN
Cc1[nH]c2ccc(CNC(=O)[C@H](N)C3CCOCC3)cc2c1C	ZINC000262048131	145257204	/nfs/dbraw/zinc/25/72/04/145257204.db2.gz	QSEIFRLOSBYLFE-QGZVFWFLSA-N	0	3	315.417	2.155	10	0		DEAEHN
O=C(CCN1CCNC[C@@H]1c1cccnc1)Nc1ccccc1	ZINC000262233951	145271063	/nfs/dbraw/zinc/27/10/63/145271063.db2.gz	OEVJHBPVIYKPRO-QGZVFWFLSA-N	0	3	310.401	2.057	10	0		DEAEHN
CN(C)C(=O)c1ccc(NC(=O)[C@H]2NCCCC2(C)C)cc1	ZINC000262543791	145291620	/nfs/dbraw/zinc/29/16/20/145291620.db2.gz	RLSRFRLDEXUHRE-CQSZACIVSA-N	0	3	303.406	2.105	10	0		DEAEHN
C[C@H](c1nc([C@@H]2CNCCN2C)no1)c1ccc(F)c(F)c1	ZINC000263175533	145332981	/nfs/dbraw/zinc/33/29/81/145332981.db2.gz	GEPCLHSQGWQSFD-ZANVPECISA-N	0	3	308.332	2.076	10	0		DEAEHN
COc1cccc([C@@H](C)Cc2nc([C@@H]3CNCCN3C)no2)c1	ZINC000263199775	145335592	/nfs/dbraw/zinc/33/55/92/145335592.db2.gz	IWEWKGHTSQDFMG-WFASDCNBSA-N	0	3	316.405	2.001	10	0		DEAEHN
C[C@H](Oc1cccc(Cl)c1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263217860	145337386	/nfs/dbraw/zinc/33/73/86/145337386.db2.gz	LFRZWZZWQWRHKV-GWCFXTLKSA-N	0	3	322.796	2.439	10	0		DEAEHN
C[C@H](Cc1nc([C@H]2CNCCN2C)no1)c1ccc(F)cc1	ZINC000263222202	145337978	/nfs/dbraw/zinc/33/79/78/145337978.db2.gz	MCHSZQIDWKMCDH-BXUZGUMPSA-N	0	3	304.369	2.131	10	0		DEAEHN
COCCC1(C)CN(C(=O)NCCN(C)Cc2ccccc2)C1	ZINC000358546658	147153590	/nfs/dbraw/zinc/15/35/90/147153590.db2.gz	QGNYGQUTKFQZJU-UHFFFAOYSA-N	0	3	319.449	2.186	10	0		DEAEHN
C[C@H](C(=O)NCc1ccc2cc[nH]c2n1)N1[C@H](C)CC[C@H]1C	ZINC000359422354	147325145	/nfs/dbraw/zinc/32/51/45/147325145.db2.gz	MRKLHTLHBXQNHT-JHJVBQTASA-N	0	3	300.406	2.440	10	0		DEAEHN
NC(=O)[C@H](Cc1ccccc1)NCc1ccccc1-n1cccn1	ZINC000371870706	148148306	/nfs/dbraw/zinc/14/83/06/148148306.db2.gz	SGHVQNUWBIDAQS-KRWDZBQOSA-N	0	3	320.396	2.059	10	0		DEAEHN
C[C@@](O)(CNCc1cnc(N2CCCC2)nc1)C1CCCCC1	ZINC000565927339	292190806	/nfs/dbraw/zinc/19/08/06/292190806.db2.gz	UEEWTZJYWHTDJQ-GOSISDBHSA-N	0	3	318.465	2.498	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)C(C)(C)C	ZINC000074317990	401735472	/nfs/dbraw/zinc/73/54/72/401735472.db2.gz	NOWDFBDVEPYUFH-GFCCVEGCSA-N	0	3	305.422	2.351	10	0		DEAEHN
CCCc1noc(CCCC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)n1	ZINC000127701673	401746179	/nfs/dbraw/zinc/74/61/79/401746179.db2.gz	XXHGZJUEKZMGFN-ZIAGYGMSSA-N	0	3	322.453	2.286	10	0		DEAEHN
COc1cc(OCc2ccccc2)c([C@H](N)CO)cc1OC	ZINC000072199789	401703288	/nfs/dbraw/zinc/70/32/88/401703288.db2.gz	MHOFEXXFBOBIKO-CQSZACIVSA-N	0	3	303.358	2.275	10	0		DEAEHN
COc1cc([C@@H](C)NCCC[S@](C)=O)cc(OC)c1OC	ZINC000126828891	401710127	/nfs/dbraw/zinc/71/01/27/401710127.db2.gz	HHFBFRMVMXDABK-WSVYEEACSA-N	0	3	315.435	2.132	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H](C)CNc2ccccc2)C1	ZINC000127882524	401754132	/nfs/dbraw/zinc/75/41/32/401754132.db2.gz	BTPDRUJTDWGUIR-GOEBONIOSA-N	0	3	304.438	2.271	10	0		DEAEHN
CC(C)N(CC(=O)NC(=O)Nc1ccccc1)C1CCOCC1	ZINC000077356920	401811927	/nfs/dbraw/zinc/81/19/27/401811927.db2.gz	REJVGFCFORJIRH-UHFFFAOYSA-N	0	3	319.405	2.224	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N2CC[C@H]3OCCC[C@H]3C2)c1	ZINC000128115749	401763411	/nfs/dbraw/zinc/76/34/11/401763411.db2.gz	GQOBSLZLOVUUFF-DLBZAZTESA-N	0	3	302.418	2.389	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2cccn2Cc2cccs2)CCO1	ZINC000128205044	401767103	/nfs/dbraw/zinc/76/71/03/401767103.db2.gz	YBSPAQNNMPARTH-MRXNPFEDSA-N	0	3	319.474	2.360	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cnn(Cc2ccccc2)c1	ZINC000113226568	401770541	/nfs/dbraw/zinc/77/05/41/401770541.db2.gz	KGTXFJUMULAJRC-MAUKXSAKSA-N	0	3	324.428	2.240	10	0		DEAEHN
Cc1ccc(C)c(OCC(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000113233332	401772619	/nfs/dbraw/zinc/77/26/19/401772619.db2.gz	VOLPSUIDEIXMCM-HOTGVXAUSA-N	0	3	302.418	2.377	10	0		DEAEHN
CCCC(=O)NCC(=O)Nc1cc(CN2CCCC2)ccc1C	ZINC000128545932	401782248	/nfs/dbraw/zinc/78/22/48/401782248.db2.gz	XVJABQCRELOMNJ-UHFFFAOYSA-N	0	3	317.433	2.446	10	0		DEAEHN
CSCCCNC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000077572360	401820974	/nfs/dbraw/zinc/82/09/74/401820974.db2.gz	BRJKNXCYSARWFZ-OAHLLOKOSA-N	0	3	309.479	2.212	10	0		DEAEHN
Cc1ccc(CN(C[C@H](O)CN2CCCC2=O)C2CC2)cc1C	ZINC000077657323	401823819	/nfs/dbraw/zinc/82/38/19/401823819.db2.gz	ZVCRSOGSMOVENH-GOSISDBHSA-N	0	3	316.445	2.251	10	0		DEAEHN
COc1ccc(CC(=O)N[C@H](CC(C)C)CN(C)C)cc1OC	ZINC000077730529	401827698	/nfs/dbraw/zinc/82/76/98/401827698.db2.gz	WFNPNGQUQGQTMS-OAHLLOKOSA-N	0	3	322.449	2.339	10	0		DEAEHN
CN(C[C@@H]1CCCN(C)C1)C(=O)N[C@@H]1COc2ccccc21	ZINC000115813426	401837575	/nfs/dbraw/zinc/83/75/75/401837575.db2.gz	BFDYWODVYOLMRM-UKRRQHHQSA-N	0	3	303.406	2.103	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2cccc(Cl)c2Cl)CCO1	ZINC000116784510	401858404	/nfs/dbraw/zinc/85/84/04/401858404.db2.gz	UFSGWTMUEDADBN-SNVBAGLBSA-N	0	3	317.216	2.396	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)C(C)(C)c2ccc(Cl)cc2)CCO1	ZINC000116795128	401859413	/nfs/dbraw/zinc/85/94/13/401859413.db2.gz	SUFMMYUZIIZHTG-OAHLLOKOSA-N	0	3	324.852	2.407	10	0		DEAEHN
CN(C)Cc1cccc(CNC(=O)[C@H]2CCCc3n[nH]cc32)c1	ZINC000132737943	401872790	/nfs/dbraw/zinc/87/27/90/401872790.db2.gz	UUAFDCTZOBAUKV-HNNXBMFYSA-N	0	3	312.417	2.208	10	0		DEAEHN
CCOCCC1(CNC(=O)N2CC[C@@H](N(C)C)C2)CCCC1	ZINC000119167114	401930735	/nfs/dbraw/zinc/93/07/35/401930735.db2.gz	VMCSYFAQLZXCJN-OAHLLOKOSA-N	0	3	311.470	2.319	10	0		DEAEHN
CCSCCN1CCCN(Cc2noc(C3CC3)n2)CC1	ZINC000119209496	401932941	/nfs/dbraw/zinc/93/29/41/401932941.db2.gz	DUVXBAYNUGMSOQ-UHFFFAOYSA-N	0	3	310.467	2.208	10	0		DEAEHN
C[C@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)[C@@H]1CCCO1	ZINC000079619961	401878117	/nfs/dbraw/zinc/87/81/17/401878117.db2.gz	CTYAAGMOLNSYIZ-GJZGRUSLSA-N	0	3	311.470	2.317	10	0		DEAEHN
COCCN(C)CCCNC(=O)C[C@@H]1CCOc2ccccc21	ZINC000117755465	401883154	/nfs/dbraw/zinc/88/31/54/401883154.db2.gz	UEUBFGPKAUUNBB-HNNXBMFYSA-N	0	3	320.433	2.027	10	0		DEAEHN
CCN1CCC[C@@H](Nc2ccc(-n3nc(C)cc3C)nn2)C1	ZINC000133442425	401886196	/nfs/dbraw/zinc/88/61/96/401886196.db2.gz	VRFYMPMDJYRRAE-CQSZACIVSA-N	0	3	300.410	2.175	10	0		DEAEHN
O=C(c1csc(Br)c1)N1CCN2CCC[C@H]2C1	ZINC000037845348	401917827	/nfs/dbraw/zinc/91/78/27/401917827.db2.gz	AKIPMZVAJNLAIS-JTQLQIEISA-N	0	3	315.236	2.431	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc2oc(C(=O)OC)cc2c1	ZINC000085902937	401919604	/nfs/dbraw/zinc/91/96/04/401919604.db2.gz	PZIDMAFZHGCQHM-QGZVFWFLSA-N	0	3	321.373	2.097	10	0		DEAEHN
OC[C@@H](NC[C@H]1CCCO1)c1cccc(Br)c1	ZINC000038114865	401922802	/nfs/dbraw/zinc/92/28/02/401922802.db2.gz	TUZCNJSFTMDPRD-CHWSQXEVSA-N	0	3	300.196	2.251	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC[C@@H]2CCN(C3CC3)C2)c(C)s1	ZINC000119443189	401950775	/nfs/dbraw/zinc/95/07/75/401950775.db2.gz	XUJVEESBQJTKPU-LBPRGKRZSA-N	0	3	314.476	2.128	10	0		DEAEHN
COc1c(C)cnc(CN2CCC[C@H](Cn3ccnn3)C2)c1C	ZINC000119447313	401950894	/nfs/dbraw/zinc/95/08/94/401950894.db2.gz	KGRLOLHVFZPWAE-HNNXBMFYSA-N	0	3	315.421	2.211	10	0		DEAEHN
COCCC1(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)CCC1	ZINC000119497230	401954061	/nfs/dbraw/zinc/95/40/61/401954061.db2.gz	LCUSZIJHRZMVOW-HUUCEWRRSA-N	0	3	311.470	2.317	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCO[C@H](c2cccs2)C1	ZINC000136011555	401957618	/nfs/dbraw/zinc/95/76/18/401957618.db2.gz	CRTULYPVQFNUNX-KGLIPLIRSA-N	0	3	323.462	2.315	10	0		DEAEHN
CC1CCN(CC(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000136194183	401963155	/nfs/dbraw/zinc/96/31/55/401963155.db2.gz	NDBLQUXOHIKZER-GOSISDBHSA-N	0	3	317.477	2.007	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2ccc(C)c(OC)c2)C1	ZINC000119831010	401968122	/nfs/dbraw/zinc/96/81/22/401968122.db2.gz	HZGAKRARHNVWFH-MRXNPFEDSA-N	0	3	319.449	2.330	10	0		DEAEHN
CCOc1cccc(CN2CCN(C[C@@H](C)O)[C@H](CC)C2)c1	ZINC000120677741	401998216	/nfs/dbraw/zinc/99/82/16/401998216.db2.gz	RLVYEZJSSVELLJ-NVXWUHKLSA-N	0	3	306.450	2.362	10	0		DEAEHN
CCOC(=O)CC[C@@H](C)NC(=O)c1cccc(CN(C)C)c1	ZINC000090002950	401977802	/nfs/dbraw/zinc/97/78/02/401977802.db2.gz	ZNCBZIINRMEKCP-CYBMUJFWSA-N	0	3	306.406	2.210	10	0		DEAEHN
CCCN(CCC)C(=O)CN1CCC[C@H](Cc2nccn2C)C1	ZINC000090004136	401978955	/nfs/dbraw/zinc/97/89/55/401978955.db2.gz	IERSOGABEUNHDC-MRXNPFEDSA-N	0	3	320.481	2.323	10	0		DEAEHN
CN(C)CCOc1nn(C(=O)OC(C)(C)C)c2cc(N)ccc12	ZINC000089197587	401938443	/nfs/dbraw/zinc/93/84/43/401938443.db2.gz	ZDUKTPKZXLNQDM-UHFFFAOYSA-N	0	3	320.393	2.342	10	0		DEAEHN
COC(=O)[C@H]1C[C@H](c2ccccc2)CN(Cc2cncn2C)C1	ZINC000135465043	401940874	/nfs/dbraw/zinc/94/08/74/401940874.db2.gz	IZTUDPUKWSWPPB-HOTGVXAUSA-N	0	3	313.401	2.199	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCc1nc(C)c(C)s1	ZINC000151161290	402020788	/nfs/dbraw/zinc/02/07/88/402020788.db2.gz	GFXIHAPHXAWQMD-CQSZACIVSA-N	0	3	324.494	2.428	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)CCc2ncc(C)s2)C1	ZINC000121262021	402024306	/nfs/dbraw/zinc/02/43/06/402024306.db2.gz	NPLSASGNEGKMEU-ZDUSSCGKSA-N	0	3	310.467	2.120	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)Cc2ccccc2OC)C1	ZINC000052592785	402044134	/nfs/dbraw/zinc/04/41/34/402044134.db2.gz	AKDMHBXMMFXWEH-OAHLLOKOSA-N	0	3	305.422	2.321	10	0		DEAEHN
Cc1nc(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)no1	ZINC000122417705	402077250	/nfs/dbraw/zinc/07/72/50/402077250.db2.gz	RGVBRKICGJYDHC-KRWDZBQOSA-N	0	3	314.389	2.163	10	0		DEAEHN
C[C@H]1CC[C@@H](C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)O1	ZINC000153006106	402121785	/nfs/dbraw/zinc/12/17/85/402121785.db2.gz	QILBKAMRGOCVNV-WFASDCNBSA-N	0	3	319.405	2.061	10	0		DEAEHN
Cc1noc2ncc(C(=O)N(C)[C@H]3CCN(C)[C@H](C)C3)cc12	ZINC000123068440	402108704	/nfs/dbraw/zinc/10/87/04/402108704.db2.gz	XQXIHTPORWWLPT-MFKMUULPSA-N	0	3	302.378	2.086	10	0		DEAEHN
Cc1noc2ncc(C(=O)N(C)[C@@H]3CCN(C)[C@H](C)C3)cc12	ZINC000123068242	402108744	/nfs/dbraw/zinc/10/87/44/402108744.db2.gz	XQXIHTPORWWLPT-ZWNOBZJWSA-N	0	3	302.378	2.086	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)Cc1c(Cl)cccc1OC	ZINC000152869874	402113918	/nfs/dbraw/zinc/11/39/18/402113918.db2.gz	OXYGQPPPNRVWMD-LBPRGKRZSA-N	0	3	310.825	2.492	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cc3ccccc3oc2=O)CCN1C	ZINC000123178301	402114344	/nfs/dbraw/zinc/11/43/44/402114344.db2.gz	MVAKSTQFQXNIJE-JSGCOSHPSA-N	0	3	314.385	2.348	10	0		DEAEHN
COc1ccc([C@@H](C)NC[C@@H](C)N2CCOCC2)c(OC)c1	ZINC000123481468	402130220	/nfs/dbraw/zinc/13/02/20/402130220.db2.gz	ZRVQQGYFOBAULC-ZIAGYGMSSA-N	0	3	308.422	2.075	10	0		DEAEHN
C[C@H]1CN(C2CCN(Cc3cn4ccsc4n3)CC2)CCO1	ZINC000066562386	402136877	/nfs/dbraw/zinc/13/68/77/402136877.db2.gz	NTATYDGNTANSQA-ZDUSSCGKSA-N	0	3	320.462	2.081	10	0		DEAEHN
CC[C@](C)(O)CN1CCCN(C(=O)c2cccc(C)c2)CC1	ZINC000123345971	402123473	/nfs/dbraw/zinc/12/34/73/402123473.db2.gz	AXZAZMJYBZMFTK-SFHVURJKSA-N	0	3	304.434	2.304	10	0		DEAEHN
CC(C)[C@@H](O)CNC(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000153511107	402150091	/nfs/dbraw/zinc/15/00/91/402150091.db2.gz	SZGHBQAVGMSZLF-IRXDYDNUSA-N	0	3	319.449	2.140	10	0		DEAEHN
Cc1ccc(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)cc1F	ZINC000124516591	402183824	/nfs/dbraw/zinc/18/38/24/402183824.db2.gz	QLWMMAQNCDMDBD-MRXNPFEDSA-N	0	3	320.408	2.205	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC2(C)Cc3ccccc3C2)C1	ZINC000124835169	402200208	/nfs/dbraw/zinc/20/02/08/402200208.db2.gz	LKPZWOXJWXYGFW-INIZCTEOSA-N	0	3	301.434	2.327	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCC1(CCOC)CCC1	ZINC000124298190	402173405	/nfs/dbraw/zinc/17/34/05/402173405.db2.gz	OBJDVEAYOHKYLR-OAHLLOKOSA-N	0	3	311.470	2.319	10	0		DEAEHN
CC(C)NC(=O)CCN1CCC[C@@H]1c1ccc2c(c1)OCO2	ZINC000102929111	402174666	/nfs/dbraw/zinc/17/46/66/402174666.db2.gz	XETUIIAILIPKOF-CQSZACIVSA-N	0	3	304.390	2.467	10	0		DEAEHN
CC(C)COc1ccc(CC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000106770336	402215658	/nfs/dbraw/zinc/21/56/58/402215658.db2.gz	GSOUKYXLCSWBHY-INIZCTEOSA-N	0	3	304.434	2.426	10	0		DEAEHN
c1ccc(-c2nnc([C@H]3CCCN3CCC3OCCO3)[nH]2)cc1	ZINC000125216074	402219826	/nfs/dbraw/zinc/21/98/26/402219826.db2.gz	CNRKZFCSRUZNPV-CQSZACIVSA-N	0	3	314.389	2.372	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)NCCc1cccc(O)c1	ZINC000069415187	402221550	/nfs/dbraw/zinc/22/15/50/402221550.db2.gz	BRQNGTGBWGNFNP-AWEZNQCLSA-N	0	3	305.422	2.108	10	0		DEAEHN
CC(C)COC1CCN(C(=O)NC[C@@H]2CCCN(C)C2)CC1	ZINC000108588577	402258029	/nfs/dbraw/zinc/25/80/29/402258029.db2.gz	ODYKIQVEQHNWHU-HNNXBMFYSA-N	0	3	311.470	2.175	10	0		DEAEHN
c1cncc(-c2cc(N3CCNCC3)nc(-c3ccncc3)n2)c1	ZINC000070451638	402260442	/nfs/dbraw/zinc/26/04/42/402260442.db2.gz	BHSHTZATYCWBTQ-UHFFFAOYSA-N	0	3	318.384	2.010	10	0		DEAEHN
CCCCOC(=O)CCN1CCC(c2nncn2CC)CC1	ZINC000105929244	402211648	/nfs/dbraw/zinc/21/16/48/402211648.db2.gz	BHBAJQYXRKFPRZ-UHFFFAOYSA-N	0	3	308.426	2.211	10	0		DEAEHN
C[C@H](CNC(=O)N1CCN2CCC[C@@H]2C1)Oc1cccc(F)c1	ZINC000176097437	402278555	/nfs/dbraw/zinc/27/85/55/402278555.db2.gz	JKVUQSUKZHFTBM-UKRRQHHQSA-N	0	3	321.396	2.083	10	0		DEAEHN
Cc1c(-c2cc(CN3CC[C@H]4OCCC[C@@H]4C3)on2)cnn1C	ZINC000184628964	402286002	/nfs/dbraw/zinc/28/60/02/402286002.db2.gz	IREBYDRLPLDQAV-CXAGYDPISA-N	0	3	316.405	2.384	10	0		DEAEHN
CCOc1cccnc1C(=O)N[C@@H](C)CN1CCC[C@H](C)C1	ZINC000176163290	402286068	/nfs/dbraw/zinc/28/60/68/402286068.db2.gz	XBAYJTXAWQXISI-KBPBESRZSA-N	0	3	305.422	2.331	10	0		DEAEHN
CC[C@H](C(=O)NCc1nc2ccccc2n1C1CC1)N(C)C	ZINC000185105303	402324610	/nfs/dbraw/zinc/32/46/10/402324610.db2.gz	OGEDNRBANGIWTO-CQSZACIVSA-N	0	3	300.406	2.328	10	0		DEAEHN
Cc1cnc(CCN(C)C[C@@H](O)COCc2ccco2)s1	ZINC000157670083	402297590	/nfs/dbraw/zinc/29/75/90/402297590.db2.gz	DMFXFPUJSKOXSE-CYBMUJFWSA-N	0	3	310.419	2.097	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1cccc(C(=O)OC)c1	ZINC000176298476	402297776	/nfs/dbraw/zinc/29/77/76/402297776.db2.gz	DHPRIFHELAIBPC-HNNXBMFYSA-N	0	3	319.405	2.421	10	0		DEAEHN
CSCc1ccccc1NC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000184824715	402302066	/nfs/dbraw/zinc/30/20/66/402302066.db2.gz	JNUBNRZEHATGEM-AWEZNQCLSA-N	0	3	323.462	2.344	10	0		DEAEHN
CCOC(=O)c1csc(N2CC[C@@H]3[C@@H](CCCN3C)C2)n1	ZINC000221026817	402302994	/nfs/dbraw/zinc/30/29/94/402302994.db2.gz	XCMXCMAOELQPQH-WCQYABFASA-N	0	3	309.435	2.240	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1cc(C)cnc1OC	ZINC000176384653	402304963	/nfs/dbraw/zinc/30/49/63/402304963.db2.gz	PTUAMQQYWWMBHX-CYBMUJFWSA-N	0	3	306.410	2.347	10	0		DEAEHN
CO[C@@H](C)c1nc(C)c(C(=O)NC[C@H]2CCCN(C)C2)s1	ZINC000176563534	402320290	/nfs/dbraw/zinc/32/02/90/402320290.db2.gz	NTUPJFJIRBSFCL-NWDGAFQWSA-N	0	3	311.451	2.231	10	0		DEAEHN
Cc1ncsc1CN(C)C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000176836946	402341397	/nfs/dbraw/zinc/34/13/97/402341397.db2.gz	UNLJPTXCKDFUKE-WCQYABFASA-N	0	3	310.467	2.322	10	0		DEAEHN
Cc1c(-c2cc(CN(C)[C@@H](CO)CC(C)C)on2)cnn1C	ZINC000185343908	402345369	/nfs/dbraw/zinc/34/53/69/402345369.db2.gz	KRBNAAHWPKKTBN-CYBMUJFWSA-N	0	3	306.410	2.222	10	0		DEAEHN
COCCCNC(=O)CN(C)c1ccnc2ccc(C)cc21	ZINC000185472771	402354570	/nfs/dbraw/zinc/35/45/70/402354570.db2.gz	ZECDACCLHWJJNN-UHFFFAOYSA-N	0	3	301.390	2.132	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Cc1cc(OC)ccc1OC	ZINC000176978056	402356485	/nfs/dbraw/zinc/35/64/85/402356485.db2.gz	LLNHVJANVMLLIN-HNNXBMFYSA-N	0	3	320.433	2.189	10	0		DEAEHN
CCCC(=O)N1CCCC[C@H]1C(=O)N(C)C[C@H]1CCCN1CC	ZINC000176990281	402357651	/nfs/dbraw/zinc/35/76/51/402357651.db2.gz	CEIGFYXRECFQNG-CVEARBPZSA-N	0	3	323.481	2.110	10	0		DEAEHN
Cc1cccc2c1ncc(C)c2N1CCS(=O)(=O)[C@H](C)C1	ZINC000185517743	402358399	/nfs/dbraw/zinc/35/83/99/402358399.db2.gz	KEHHJWKZTWYNKO-CYBMUJFWSA-N	0	3	304.415	2.475	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C[C@H]1OC(=O)c2ccccc21	ZINC000177020654	402360376	/nfs/dbraw/zinc/36/03/76/402360376.db2.gz	LMESTOCRHCKWJF-XJKSGUPXSA-N	0	3	316.401	2.231	10	0		DEAEHN
COc1ccc(F)cc1CC(=O)N1CCCN(C2CC2)CC1	ZINC000185750642	402374161	/nfs/dbraw/zinc/37/41/61/402374161.db2.gz	XHLWCYFJAGRDNV-UHFFFAOYSA-N	0	3	306.381	2.074	10	0		DEAEHN
C[NH+](C)[C@@H]1CCCN(C(=O)c2ccc3c(c2[O-])CCCC3)C1	ZINC000185777773	402376790	/nfs/dbraw/zinc/37/67/90/402376790.db2.gz	WFXMISKWMFZXAE-CQSZACIVSA-N	0	3	302.418	2.437	10	0		DEAEHN
C[C@H](NCC(=O)NCc1ccco1)c1ccccc1-n1cccn1	ZINC000177202137	402380888	/nfs/dbraw/zinc/38/08/88/402380888.db2.gz	WVHNJGGIWVJNSK-AWEZNQCLSA-N	0	3	324.384	2.432	10	0		DEAEHN
Cc1ccc(C)c(OCCN2C[C@@H](C)[C@H](N3CCOCC3)C2)c1	ZINC000177248307	402384948	/nfs/dbraw/zinc/38/49/48/402384948.db2.gz	LCYRHPFHUYGMFI-QZTJIDSGSA-N	0	3	318.461	2.335	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)Nc2nncs2)CN1Cc1ccccc1	ZINC000176677674	402327833	/nfs/dbraw/zinc/32/78/33/402327833.db2.gz	VTFPISPRRIKRTA-WCQYABFASA-N	0	3	317.418	2.323	10	0		DEAEHN
COCc1ccc(C(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)o1	ZINC000176694006	402328730	/nfs/dbraw/zinc/32/87/30/402328730.db2.gz	WBAXVYTYXVUBCI-ZIAGYGMSSA-N	0	3	324.421	2.045	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCN(c2ccc(Cl)cn2)CC1)N(C)C	ZINC000161792927	402399789	/nfs/dbraw/zinc/39/97/89/402399789.db2.gz	PRINXMZQBRKECG-AWEZNQCLSA-N	0	3	324.856	2.114	10	0		DEAEHN
COCCNCC(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1	ZINC000237225491	402400526	/nfs/dbraw/zinc/40/05/26/402400526.db2.gz	RVOHDOOUHBAPOJ-CQSZACIVSA-N	0	3	313.401	2.162	10	0		DEAEHN
CCC[C@H](C(=O)NCCc1csc(N2CCCC2)n1)N(C)C	ZINC000162155426	402411307	/nfs/dbraw/zinc/41/13/07/402411307.db2.gz	HIYSGXLNAAPQOX-CQSZACIVSA-N	0	3	324.494	2.132	10	0		DEAEHN
Cc1nc(C)c(C(=O)N[C@@H](C)CN2CCCCCC2)nc1C	ZINC000186293224	402418483	/nfs/dbraw/zinc/41/84/83/402418483.db2.gz	OVQXQXRRGXJRPU-LBPRGKRZSA-N	0	3	304.438	2.396	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2ccc(OC)c(O)c2)C12CCOCC2	ZINC000186306527	402419319	/nfs/dbraw/zinc/41/93/19/402419319.db2.gz	OPCWSDMCBCCOFI-IAGOWNOFSA-N	0	3	321.417	2.465	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)CSc2nccc3ccccc32)C1	ZINC000162600192	402425716	/nfs/dbraw/zinc/42/57/16/402425716.db2.gz	DEEMEZUDXBEXQC-CQSZACIVSA-N	0	3	315.442	2.489	10	0		DEAEHN
COc1ccc(NC(=O)CCN2CCN3CCCC[C@@H]3C2)cc1	ZINC000177752621	402432543	/nfs/dbraw/zinc/43/25/43/402432543.db2.gz	SBJDTKIFKPZPKJ-MRXNPFEDSA-N	0	3	317.433	2.194	10	0		DEAEHN
COc1ccc(F)cc1CC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000186498011	402436167	/nfs/dbraw/zinc/43/61/67/402436167.db2.gz	JJPWDPDXMFUOQA-WFASDCNBSA-N	0	3	308.397	2.318	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)c1cnccc1N)c1ccccc1	ZINC000178004959	402451547	/nfs/dbraw/zinc/45/15/47/402451547.db2.gz	AHIZYMRXUVDKQN-KRWDZBQOSA-N	0	3	312.417	2.477	10	0		DEAEHN
O=C(Nc1cccc(OCCF)c1)N1CCN2CCC[C@@H]2C1	ZINC000178029160	402453770	/nfs/dbraw/zinc/45/37/70/402453770.db2.gz	KNEDKKDAYTZMQU-CQSZACIVSA-N	0	3	307.369	2.347	10	0		DEAEHN
O=C(Nc1cccc(OCCF)c1)N1CCN2CCC[C@H]2C1	ZINC000178029181	402453966	/nfs/dbraw/zinc/45/39/66/402453966.db2.gz	KNEDKKDAYTZMQU-AWEZNQCLSA-N	0	3	307.369	2.347	10	0		DEAEHN
CC(C)[C@H](C(=O)N[C@H]1Cc2ccccc2[C@@H]1O)N1CCCCC1	ZINC000178561850	402512152	/nfs/dbraw/zinc/51/21/52/402512152.db2.gz	IXKTUBSMUAAWET-KSZLIROESA-N	0	3	316.445	2.271	10	0		DEAEHN
C[C@H](NC(=O)N1CCO[C@@H](CN(C)C)C1)[C@@H](C)c1ccccc1	ZINC000245471221	402464154	/nfs/dbraw/zinc/46/41/54/402464154.db2.gz	NRRZFULLJIIWEE-VYDXJSESSA-N	0	3	319.449	2.151	10	0		DEAEHN
C[C@H](Cc1ccc(O)cc1)NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000245660242	402477015	/nfs/dbraw/zinc/47/70/15/402477015.db2.gz	DAKUDFPRCLMYSK-IJEWVQPXSA-N	0	3	319.449	2.447	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@H](C)N[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000245733418	402483871	/nfs/dbraw/zinc/48/38/71/402483871.db2.gz	SJFLRVFKVQPPKO-MJBXVCDLSA-N	0	3	315.421	2.221	10	0		DEAEHN
O=S(=O)(CC1CCCC1)N1CCCC[C@H](N2CCCC2)C1	ZINC000178335628	402486317	/nfs/dbraw/zinc/48/63/17/402486317.db2.gz	UFWJSFXMIKUCII-INIZCTEOSA-N	0	3	314.495	2.457	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2ccc3c(c2)CC(C)(C)O3)C[C@@H]1C	ZINC000245805867	402489083	/nfs/dbraw/zinc/48/90/83/402489083.db2.gz	YOCMBFMCGPIZJV-GJZGRUSLSA-N	0	3	318.461	2.287	10	0		DEAEHN
O=C([C@@H]1C[C@H]1c1cccc(Br)c1)N1CCCNCC1	ZINC000178362787	402490096	/nfs/dbraw/zinc/49/00/96/402490096.db2.gz	JOYZGSPRQKUPCW-UONOGXRCSA-N	0	3	323.234	2.375	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c(C)o1	ZINC000245865475	402492637	/nfs/dbraw/zinc/49/26/37/402492637.db2.gz	INDZBGWZQCXTJX-ZIAGYGMSSA-N	0	3	312.435	2.001	10	0		DEAEHN
COCCOc1ccc(NC(=O)N2CC[C@@H](N(C)C)C2)c(C)c1	ZINC000171078867	402555160	/nfs/dbraw/zinc/55/51/60/402555160.db2.gz	IOJILQONDFMRNP-CQSZACIVSA-N	0	3	321.421	2.188	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1cc(N)nc(Cl)c1)c1ccccc1	ZINC000171184145	402564864	/nfs/dbraw/zinc/56/48/64/402564864.db2.gz	AZAXFNSOXYUVFX-ZDUSSCGKSA-N	0	3	318.808	2.350	10	0		DEAEHN
Cc1ccccc1-n1cc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cn1	ZINC000247527543	402571214	/nfs/dbraw/zinc/57/12/14/402571214.db2.gz	XEZOJLXPZONCST-WBVHZDCISA-N	0	3	324.428	2.489	10	0		DEAEHN
C[C@H](CNC(=O)N[C@@H](C)[C@H]1CCCO1)N(C)Cc1ccccc1	ZINC000247555606	402572117	/nfs/dbraw/zinc/57/21/17/402572117.db2.gz	QRXDGBIOTJZBQD-HLLBOEOZSA-N	0	3	319.449	2.374	10	0		DEAEHN
CC(C)(C)c1nc(CC(=O)N2CCN3CCC[C@@H]3C2)cs1	ZINC000171268679	402572990	/nfs/dbraw/zinc/57/29/90/402572990.db2.gz	BRHNOALDEUMYJM-CYBMUJFWSA-N	0	3	307.463	2.290	10	0		DEAEHN
O=C(Cc1cc(F)c(F)cc1F)N1CCCN(C2CC2)CC1	ZINC000178626699	402519171	/nfs/dbraw/zinc/51/91/71/402519171.db2.gz	YDAJQESGDSOXGI-UHFFFAOYSA-N	0	3	312.335	2.343	10	0		DEAEHN
CCN(C(=O)[C@H](C)N1CCN2CCC[C@@H]2C1)C1CCCCC1	ZINC000178634588	402520109	/nfs/dbraw/zinc/52/01/09/402520109.db2.gz	CDBVHTGCRIJGIL-DOTOQJQBSA-N	0	3	307.482	2.336	10	0		DEAEHN
Cc1nc2cc(NC(=O)N3CCN4CCC[C@@H]4C3)ccc2o1	ZINC000178644343	402521224	/nfs/dbraw/zinc/52/12/24/402521224.db2.gz	XMMIYEYFJGGYMA-CYBMUJFWSA-N	0	3	300.362	2.448	10	0		DEAEHN
CCC[C@H](NC(=O)CN1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000246260436	402521265	/nfs/dbraw/zinc/52/12/65/402521265.db2.gz	GFMCAWFJUAVCPP-ROUUACIJSA-N	0	3	315.461	2.424	10	0		DEAEHN
CCOC(=O)N1CCCN(C[C@](C)(O)c2ccccc2)CC1	ZINC000170777461	402524221	/nfs/dbraw/zinc/52/42/21/402524221.db2.gz	BIOAMIPVHOQCOW-KRWDZBQOSA-N	0	3	306.406	2.058	10	0		DEAEHN
COC(C)(C)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1	ZINC000178676210	402525131	/nfs/dbraw/zinc/52/51/31/402525131.db2.gz	AZZZVXJVMVKPDD-ZDUSSCGKSA-N	0	3	305.422	2.148	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000246341479	402526334	/nfs/dbraw/zinc/52/63/34/402526334.db2.gz	OUVPKARKLAMVEP-NVXWUHKLSA-N	0	3	319.449	2.375	10	0		DEAEHN
Cc1cc(C)n2c(CN[C@H](CO)Cc3ccccc3C)cnc2n1	ZINC000188925362	402527637	/nfs/dbraw/zinc/52/76/37/402527637.db2.gz	OFSWUTDFILXQPZ-KRWDZBQOSA-N	0	3	324.428	2.348	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)C1CCN(CCOCC(F)F)CC1	ZINC000188964066	402528994	/nfs/dbraw/zinc/52/89/94/402528994.db2.gz	WOSXHZVHGHNWHC-GFCCVEGCSA-N	0	3	306.397	2.141	10	0		DEAEHN
CC(C)Oc1ccc(CNC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170828473	402530521	/nfs/dbraw/zinc/53/05/21/402530521.db2.gz	ZZCAPPVZFXVFBO-OAHLLOKOSA-N	0	3	305.422	2.319	10	0		DEAEHN
Cc1cc(C)cc(OCCNC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000170833723	402531109	/nfs/dbraw/zinc/53/11/09/402531109.db2.gz	TUQGXRSEXRTNPU-OAHLLOKOSA-N	0	3	305.422	2.028	10	0		DEAEHN
COCCCN(C)CCNC(=O)NCc1ccc(C2CC2)cc1	ZINC000189282248	402533270	/nfs/dbraw/zinc/53/32/70/402533270.db2.gz	GCTHSZFZYBOIOR-UHFFFAOYSA-N	0	3	319.449	2.332	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1[C@H](C)C[C@@H]2CCCC[C@H]21	ZINC000246494265	402533779	/nfs/dbraw/zinc/53/37/79/402533779.db2.gz	IOONHVGEYUVELJ-YYIAUSFCSA-N	0	3	323.481	2.460	10	0		DEAEHN
CCOc1ccc2cc(C(=O)N3CC[C@H](N(C)C)C3)[nH]c2c1	ZINC000170865154	402534993	/nfs/dbraw/zinc/53/49/93/402534993.db2.gz	AYGLMDKYENVJRB-ZDUSSCGKSA-N	0	3	301.390	2.343	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COc2cc(C)ccc2C)CC[C@@H]1C	ZINC000189368355	402535316	/nfs/dbraw/zinc/53/53/16/402535316.db2.gz	WSRRTAPQAGLSRK-LZLYRXPVSA-N	0	3	307.434	2.400	10	0		DEAEHN
C[C@@H]1CN(C[C@H](O)c2ccc(Cl)cc2)C[C@H]1N1CCOCC1	ZINC000246563803	402536575	/nfs/dbraw/zinc/53/65/75/402536575.db2.gz	UYLYWNJUQYJLOX-XYPHTWIQSA-N	0	3	324.852	2.026	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(Cc2cccnc2)C2CC2)C1	ZINC000171351404	402579719	/nfs/dbraw/zinc/57/97/19/402579719.db2.gz	YYZQOZFOTKSKBU-OAHLLOKOSA-N	0	3	302.422	2.240	10	0		DEAEHN
c1nnc([C@H]2CCCCN2CC2CCC3(CC2)OCCO3)[nH]1	ZINC000190315937	402592397	/nfs/dbraw/zinc/59/23/97/402592397.db2.gz	BHLBASJGKUZCRI-CQSZACIVSA-N	0	3	306.410	2.265	10	0		DEAEHN
COc1ccc(/C=C/C(=O)N2CCN3CCC[C@@H]3C2)cc1OC	ZINC000171584441	402597175	/nfs/dbraw/zinc/59/71/75/402597175.db2.gz	INNYAUSKAARTAZ-PMGBHYCQSA-N	0	3	316.401	2.024	10	0		DEAEHN
COc1cc(CN2CCCN(C3CC3)CC2)cc(OC)c1OC	ZINC000179732429	402598693	/nfs/dbraw/zinc/59/86/93/402598693.db2.gz	ZGMLMVVPRWMLDB-UHFFFAOYSA-N	0	3	320.433	2.383	10	0		DEAEHN
c1ccc(N2CCOCC2)c(CN2CCCN(C3CC3)CC2)c1	ZINC000179732635	402599183	/nfs/dbraw/zinc/59/91/83/402599183.db2.gz	DFRANCLURFKGSZ-UHFFFAOYSA-N	0	3	315.461	2.193	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(CCn2c(C)csc2=O)C1	ZINC000171613573	402601460	/nfs/dbraw/zinc/60/14/60/402601460.db2.gz	WZZJNPNODZYXAM-AWEZNQCLSA-N	0	3	320.462	2.314	10	0		DEAEHN
O=C(CCN1CCC[C@H](n2cncn2)C1)Nc1ccc(F)cc1	ZINC000171619360	402602039	/nfs/dbraw/zinc/60/20/39/402602039.db2.gz	ZVWOHGDWAPENKY-HNNXBMFYSA-N	0	3	317.368	2.083	10	0		DEAEHN
COc1cc(CN2CCC(N3CCO[C@@H](C)C3)CC2)ccc1O	ZINC000180069349	402606603	/nfs/dbraw/zinc/60/66/03/402606603.db2.gz	CCJPJPVXBOVIFL-AWEZNQCLSA-N	0	3	320.433	2.086	10	0		DEAEHN
COc1ccccc1CN(CCO)C[C@@H](O)CC1CCCC1	ZINC000190511872	402606801	/nfs/dbraw/zinc/60/68/01/402606801.db2.gz	QMSPKPIUNKPUEN-KRWDZBQOSA-N	0	3	307.434	2.431	10	0		DEAEHN
Cc1c(-c2cc(CN3[C@H](C)C[C@@H](O)C[C@@H]3C)on2)cnn1C	ZINC000248826660	402610014	/nfs/dbraw/zinc/61/00/14/402610014.db2.gz	KKWNGLDFLIKSTO-PTEHBNRSSA-N	0	3	304.394	2.117	10	0		DEAEHN
C[C@@H]1C[C@@H](O)C[C@H](C)N1CCOCC(F)(F)C(F)(F)F	ZINC000248851434	402611322	/nfs/dbraw/zinc/61/13/22/402611322.db2.gz	UGIXCLCSVUCCNH-ILWJIGKKSA-N	0	3	305.287	2.434	10	0		DEAEHN
CCOC(=O)CSc1cncc(N[C@H]2CCCN(CC)C2)n1	ZINC000180422269	402616042	/nfs/dbraw/zinc/61/60/42/402616042.db2.gz	MENIABHJDSUQJF-LBPRGKRZSA-N	0	3	324.450	2.028	10	0		DEAEHN
CCC[C@@H]1CN(Cc2cnn(CCC)c2)CCN1CCOC	ZINC000180465589	402617489	/nfs/dbraw/zinc/61/74/89/402617489.db2.gz	ZQXKESJIBMSKTP-QGZVFWFLSA-N	0	3	308.470	2.226	10	0		DEAEHN
CC[C@H](N[C@@H]1CCc2ncnn2C1)c1ccc2c(c1)OCCO2	ZINC000180595738	402620745	/nfs/dbraw/zinc/62/07/45/402620745.db2.gz	JDFNGGCAKQIOGL-KGLIPLIRSA-N	0	3	314.389	2.105	10	0		DEAEHN
c1nc2n(n1)C[C@@H](N[C@H]1CSCCc3ccccc31)CC2	ZINC000180604541	402621334	/nfs/dbraw/zinc/62/13/34/402621334.db2.gz	FFODRLSVRDRCNM-ZFWWWQNUSA-N	0	3	300.431	2.213	10	0		DEAEHN
CC[C@@H](N[C@H]1CCc2nc(C(C)C)nn2C1)c1cnn(C)c1	ZINC000180650864	402622549	/nfs/dbraw/zinc/62/25/49/402622549.db2.gz	NTBXPJJNORSZPJ-UONOGXRCSA-N	0	3	302.426	2.191	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)NC/C=C/c1ccccc1	ZINC000171871075	402630313	/nfs/dbraw/zinc/63/03/13/402630313.db2.gz	MPFCCUWGXPHMAH-MPNRVQBSSA-N	0	3	317.433	2.110	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@H](C)OCc2cccc(OC)c2)C1	ZINC000249611358	402636884	/nfs/dbraw/zinc/63/68/84/402636884.db2.gz	LHJOURDINSRPDE-GOEBONIOSA-N	0	3	320.433	2.201	10	0		DEAEHN
Cc1ccc2cc(CN3CCN(C[C@@H](C)O)[C@@H](C)C3)ccc2n1	ZINC000249985595	402643715	/nfs/dbraw/zinc/64/37/15/402643715.db2.gz	ZBNPFZHMVBFMDF-JKSUJKDBSA-N	0	3	313.445	2.430	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)Nc1ccc(F)c(F)c1	ZINC000172346397	402651868	/nfs/dbraw/zinc/65/18/68/402651868.db2.gz	CAMYEBQGEFWYHH-UHFFFAOYSA-N	0	3	309.360	2.073	10	0		DEAEHN
O=S1(=O)CC[C@H](N[C@@H]2C[C@H]3OCCC[C@@H]23)c2ccccc21	ZINC000252059636	402652939	/nfs/dbraw/zinc/65/29/39/402652939.db2.gz	ZPSFZKWCOSUPEV-SPWCGHHHSA-N	0	3	307.415	2.062	10	0		DEAEHN
CSCCCN1CCCN(Cc2noc(C3CC3)n2)CC1	ZINC000173687498	402708303	/nfs/dbraw/zinc/70/83/03/402708303.db2.gz	IJHGGFQWLMWFOP-UHFFFAOYSA-N	0	3	310.467	2.208	10	0		DEAEHN
CCOC(=O)CCN[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1	ZINC000192151540	402714574	/nfs/dbraw/zinc/71/45/74/402714574.db2.gz	CUTGXFFVUSLXQT-CJNGLKHVSA-N	0	3	324.808	2.155	10	0		DEAEHN
Cc1ncsc1CCN1CCC(c2ccnn2CCO)CC1	ZINC000172531917	402660992	/nfs/dbraw/zinc/66/09/92/402660992.db2.gz	BVSUTIPYMQJQFD-UHFFFAOYSA-N	0	3	320.462	2.062	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)Cc2cc(=O)oc3cc([O-])ccc23)CC[N@@H+]1C	ZINC000182396898	402686888	/nfs/dbraw/zinc/68/68/88/402686888.db2.gz	XLXWPRMSTACNLM-TZMCWYRMSA-N	0	3	316.401	2.413	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)Cc2cc(=O)oc3cc([O-])ccc23)CC[N@H+]1C	ZINC000182396898	402686889	/nfs/dbraw/zinc/68/68/89/402686889.db2.gz	XLXWPRMSTACNLM-TZMCWYRMSA-N	0	3	316.401	2.413	10	0		DEAEHN
C[C@@H]1C[C@H]([N@H+](C)Cc2cc(=O)oc3cc([O-])ccc23)CCN1C	ZINC000182396898	402686890	/nfs/dbraw/zinc/68/68/90/402686890.db2.gz	XLXWPRMSTACNLM-TZMCWYRMSA-N	0	3	316.401	2.413	10	0		DEAEHN
C[C@@H]1C[C@H]([N@@H+](C)Cc2cc(=O)oc3cc([O-])ccc23)CCN1C	ZINC000182396898	402686891	/nfs/dbraw/zinc/68/68/91/402686891.db2.gz	XLXWPRMSTACNLM-TZMCWYRMSA-N	0	3	316.401	2.413	10	0		DEAEHN
CCc1nnc(CN[C@@H]2CCC[C@@H]2CNC(=O)OC(C)(C)C)[nH]1	ZINC000191916295	402698688	/nfs/dbraw/zinc/69/86/88/402698688.db2.gz	MXECWJSHIWHUSC-VXGBXAGGSA-N	0	3	323.441	2.150	10	0		DEAEHN
CCc1nnc(C[NH2+][C@@H]2CCC[C@@H]2CNC(=O)OC(C)(C)C)[n-]1	ZINC000191916295	402698690	/nfs/dbraw/zinc/69/86/90/402698690.db2.gz	MXECWJSHIWHUSC-VXGBXAGGSA-N	0	3	323.441	2.150	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(C(C)C)n(C)n1	ZINC000173493153	402699861	/nfs/dbraw/zinc/69/98/61/402699861.db2.gz	BWZGFEXRYJTKJZ-ZIAGYGMSSA-N	0	3	304.438	2.242	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)C[C@@H](C)C1	ZINC000262505518	402726855	/nfs/dbraw/zinc/72/68/55/402726855.db2.gz	MJPZHEXSLXUCCA-KQGRMCDKSA-N	0	3	308.466	2.460	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2cn(C)nc2C2CCCCC2)CCO1	ZINC000182933603	402727811	/nfs/dbraw/zinc/72/78/11/402727811.db2.gz	QXWAJXCDLZVGJS-QGZVFWFLSA-N	0	3	320.481	2.230	10	0		DEAEHN
Cc1cccnc1C(F)(F)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000192596642	402739423	/nfs/dbraw/zinc/73/94/23/402739423.db2.gz	DTOLSCSBANRCHC-CHWSQXEVSA-N	0	3	311.376	2.423	10	0		DEAEHN
COc1ccc2c(c1)CCCN2C(=O)CN[C@@H](C)[C@H]1CCCO1	ZINC000183119965	402740636	/nfs/dbraw/zinc/74/06/36/402740636.db2.gz	MCNVJFMSOAALKV-SUMWQHHRSA-N	0	3	318.417	2.132	10	0		DEAEHN
CCNC(=O)NC(=O)CN[C@@H]1c2ccccc2CCC1(C)C	ZINC000183130071	402741650	/nfs/dbraw/zinc/74/16/50/402741650.db2.gz	UQXFOQZOLLQVLD-OAHLLOKOSA-N	0	3	303.406	2.135	10	0		DEAEHN
C[C@H]1CC[C@H](C)N(C(=O)c2ccnc(OCCN(C)C)c2)C1	ZINC000183221162	402748638	/nfs/dbraw/zinc/74/86/38/402748638.db2.gz	VFRYCNVPKXUIQV-KBPBESRZSA-N	0	3	305.422	2.283	10	0		DEAEHN
C[C@@H](Oc1ccc(F)c(F)c1)c1nc([C@H]2CNCCN2C)no1	ZINC000263248453	402750119	/nfs/dbraw/zinc/75/01/19/402750119.db2.gz	PPDJYMVHHJOJOQ-NOZJJQNGSA-N	0	3	324.331	2.064	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@H]2c2cccc(F)c2F)n1	ZINC000263251781	402750760	/nfs/dbraw/zinc/75/07/60/402750760.db2.gz	PZJIHOBXWBZNLR-DMDPSCGWSA-N	0	3	320.343	2.195	10	0		DEAEHN
O=C(NCCCC1CCCC1)NC[C@@H](O)CN1CCCCC1	ZINC000192804608	402750898	/nfs/dbraw/zinc/75/08/98/402750898.db2.gz	OHNUHMQBPLZRIF-MRXNPFEDSA-N	0	3	311.470	2.103	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(C2(c3cccc(F)c3)CCC2)n1	ZINC000263292588	402755409	/nfs/dbraw/zinc/75/54/09/402755409.db2.gz	VUQRZCUCSJUMLM-CQSZACIVSA-N	0	3	316.380	2.255	10	0		DEAEHN
Cc1ccc(CCc2nc([C@H]3CNCCN3C)no2)c(C)c1	ZINC000263319429	402758427	/nfs/dbraw/zinc/75/84/27/402758427.db2.gz	ZZNQQMNMEBKTFV-OAHLLOKOSA-N	0	3	300.406	2.048	10	0		DEAEHN
O=C(NC[C@H]1CCc2ccccc21)N1CC[C@@H](N2CC=CC2)C1	ZINC000174836296	402759490	/nfs/dbraw/zinc/75/94/90/402759490.db2.gz	VLGFTNZNABXFLT-IAGOWNOFSA-N	0	3	311.429	2.372	10	0		DEAEHN
C[C@H](CNC(=O)N1CC[C@H](N2CC=CC2)C1)Oc1ccccc1	ZINC000174916090	402762501	/nfs/dbraw/zinc/76/25/01/402762501.db2.gz	AEKKXJYEWSFKIX-CVEARBPZSA-N	0	3	315.417	2.110	10	0		DEAEHN
COC(=O)c1coc(C(=O)NCC(C)(C)N2CCC[C@@H](C)C2)c1	ZINC000183445015	402768077	/nfs/dbraw/zinc/76/80/77/402768077.db2.gz	UHSSWWKWRCNKMR-GFCCVEGCSA-N	0	3	322.405	2.307	10	0		DEAEHN
Cc1cc(C)cc([C@H]2CCN(C[C@H](O)CN3CCCC3=O)C2)c1	ZINC000183473612	402770528	/nfs/dbraw/zinc/77/05/28/402770528.db2.gz	RHWNSCAWMYFDSF-WMZOPIPTSA-N	0	3	316.445	2.076	10	0		DEAEHN
CCOc1ncccc1C(=O)N1C[C@H]2CCCN2C[C@H]1CC	ZINC000175006296	402770871	/nfs/dbraw/zinc/77/08/71/402770871.db2.gz	YENMVDIZYWOTIC-ZIAGYGMSSA-N	0	3	303.406	2.179	10	0		DEAEHN
Cc1c(F)cccc1NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000175027302	402772713	/nfs/dbraw/zinc/77/27/13/402772713.db2.gz	PHCOYMKTWRKOEI-CYBMUJFWSA-N	0	3	309.385	2.102	10	0		DEAEHN
O=C(CN[C@@H](c1ccc(Cl)cc1)C1CC1)N1CCOCC1	ZINC000183707089	402790633	/nfs/dbraw/zinc/79/06/33/402790633.db2.gz	RHXSPSWKPOJXLN-MRXNPFEDSA-N	0	3	308.809	2.240	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2nnc(C(F)(F)F)s2)C1	ZINC000194326238	402791920	/nfs/dbraw/zinc/79/19/20/402791920.db2.gz	RYRKPEUPJVNRLN-SSDOTTSWSA-N	0	3	323.344	2.163	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc3c(c2)CCC(=O)N3)C1	ZINC000194333690	402792900	/nfs/dbraw/zinc/79/29/00/402792900.db2.gz	MVNZABKBCHQUIR-CQSZACIVSA-N	0	3	316.405	2.177	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2nnc(C(C)(C)C)s2)C1	ZINC000194354254	402793403	/nfs/dbraw/zinc/79/34/03/402793403.db2.gz	ZAMVGZZTTYDPTP-SNVBAGLBSA-N	0	3	311.455	2.441	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)Nc1cc(F)cc(F)c1	ZINC000175330841	402797929	/nfs/dbraw/zinc/79/79/29/402797929.db2.gz	YUDMLEQVOJRHDZ-OAHLLOKOSA-N	0	3	311.376	2.319	10	0		DEAEHN
CC(C)CC(C)(C)CNC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000175917072	402842735	/nfs/dbraw/zinc/84/27/35/402842735.db2.gz	YFRZPZIDNLAAEI-OAHLLOKOSA-N	0	3	313.486	2.205	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Cc2c[nH]c3ccc(OC)cc23)C1	ZINC000194659504	402808408	/nfs/dbraw/zinc/80/84/08/402808408.db2.gz	KKICPEGIGCMUQC-CQSZACIVSA-N	0	3	315.417	2.320	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)NC[C@H](C)N2CCC[C@H](C)C2)n1	ZINC000194676098	402809972	/nfs/dbraw/zinc/80/99/72/402809972.db2.gz	YGESPAHMCHODJY-VBNZEHGJSA-N	0	3	306.454	2.298	10	0		DEAEHN
Cc1noc2nc(C3CC3)cc(C(=O)NC[C@@H]3CCCN3C)c12	ZINC000194715819	402812416	/nfs/dbraw/zinc/81/24/16/402812416.db2.gz	IKBQAKBGMFCBQH-LBPRGKRZSA-N	0	3	314.389	2.233	10	0		DEAEHN
COc1cc(CN[C@H]2CCc3nnc(C(C)C)n3C2)ccc1O	ZINC000194977249	402825106	/nfs/dbraw/zinc/82/51/06/402825106.db2.gz	QSGHUAUBZFELJF-ZDUSSCGKSA-N	0	3	316.405	2.220	10	0		DEAEHN
CN(Cc1ccc2c(c1)sc(=O)n2C)[C@@H](CO)C(C)(C)C	ZINC000195039886	402828264	/nfs/dbraw/zinc/82/82/64/402828264.db2.gz	LQSSBHYKEWPLIO-AWEZNQCLSA-N	0	3	308.447	2.439	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NC[C@@H](CO)c1ccccc1	ZINC000175865435	402839053	/nfs/dbraw/zinc/83/90/53/402839053.db2.gz	DMSRKDHDCPPPRO-DLBZAZTESA-N	0	3	321.465	2.038	10	0		DEAEHN
CCCN1CCC(CNC(=O)C(=O)c2ccccc2OC)CC1	ZINC000183645936	402784793	/nfs/dbraw/zinc/78/47/93/402784793.db2.gz	LNVNYYYQRBVWOS-UHFFFAOYSA-N	0	3	318.417	2.116	10	0		DEAEHN
COCCN1CCC(Nc2ncnc3ccc(C)cc32)CC1	ZINC000299235458	403551771	/nfs/dbraw/zinc/55/17/71/403551771.db2.gz	JETFRADGWJQJRU-UHFFFAOYSA-N	0	3	300.406	2.461	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N2CCCC[C@H]2c2cc[nH]n2)C1	ZINC000332832968	403622930	/nfs/dbraw/zinc/62/29/30/403622930.db2.gz	BIZFMIKVXIJETA-BMFZPTHFSA-N	0	3	319.453	2.375	10	0		DEAEHN
C[C@@H]1C[C@@H](CNCc2c(Br)cnn2C)C[C@H](C)O1	ZINC000341489032	403996264	/nfs/dbraw/zinc/99/62/64/403996264.db2.gz	QDMSTOJVYUZNOM-JGPRNRPPSA-N	0	3	316.243	2.476	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(C[C@H](O)CCOC(C)C)CC2	ZINC000349885751	404244663	/nfs/dbraw/zinc/24/46/63/404244663.db2.gz	SVYZGSFUCMXIRD-LJQANCHMSA-N	0	3	319.445	2.466	10	0		DEAEHN
C[C@H](NC(=O)C1CCCCC1)C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000337949334	404328337	/nfs/dbraw/zinc/32/83/37/404328337.db2.gz	IHIRISOZKKPQCS-DZKIICNBSA-N	0	3	323.481	2.013	10	0		DEAEHN
Cc1nn(-c2ccncc2)cc1CN1CCC([C@H](C)O)CC1	ZINC000329764852	404445201	/nfs/dbraw/zinc/44/52/01/404445201.db2.gz	WGQAKTQESIAUKA-AWEZNQCLSA-N	0	3	300.406	2.169	10	0		DEAEHN
CN1CCC[C@@H](N2CCN(C(=O)[C@H]3CCCCC3(C)C)CC2)C1	ZINC000366059254	404749194	/nfs/dbraw/zinc/74/91/94/404749194.db2.gz	WLQLFTYSUNOTRZ-IAGOWNOFSA-N	0	3	321.509	2.441	10	0		DEAEHN
CC(C)CN(CCN(C)C)C(=O)N[C@H]1CCCc2nn(C)cc21	ZINC000375009662	404715821	/nfs/dbraw/zinc/71/58/21/404715821.db2.gz	YXWAMEURABSOMC-HNNXBMFYSA-N	0	3	321.469	2.027	10	0		DEAEHN
CC1(C)C[C@H](NCc2cccc(N3CCOCC3)n2)C(C)(C)O1	ZINC000360009669	404812356	/nfs/dbraw/zinc/81/23/56/404812356.db2.gz	AHBQVZYCMLQBAM-HNNXBMFYSA-N	0	3	319.449	2.354	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)N(C)CCCO)CCN1Cc1ccccc1	ZINC000367009404	404896876	/nfs/dbraw/zinc/89/68/76/404896876.db2.gz	GMKOPSNTZTWFGZ-NVXWUHKLSA-N	0	3	319.449	2.063	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCc2c(cccc2OC)C1	ZINC000360891981	404846698	/nfs/dbraw/zinc/84/66/98/404846698.db2.gz	UXVASBNDHLVGIW-INIZCTEOSA-N	0	3	302.418	2.454	10	0		DEAEHN
COC[C@@H](O)CCNCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000360976955	404867640	/nfs/dbraw/zinc/86/76/40/404867640.db2.gz	ZHNKWEQSWXPOSQ-HNNXBMFYSA-N	0	3	309.406	2.129	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCc1nc2cc(F)ccc2[nH]1	ZINC000361128991	404933627	/nfs/dbraw/zinc/93/36/27/404933627.db2.gz	NUFPVUARVDGMDS-AWEZNQCLSA-N	0	3	304.369	2.193	10	0		DEAEHN
O=C(NCCNc1ccncc1)NCC1(Cc2ccccc2)CC1	ZINC000435759823	405011693	/nfs/dbraw/zinc/01/16/93/405011693.db2.gz	MGGYGTAXFBYMTN-UHFFFAOYSA-N	0	3	324.428	2.238	10	0		DEAEHN
C/C=C/CNC[C@@H](O)COc1ccc(Br)cc1	ZINC000385081485	405034455	/nfs/dbraw/zinc/03/44/55/405034455.db2.gz	WULSDYBXFVLIOZ-QAVQXKDTSA-N	0	3	300.196	2.355	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)c2ncccc2N)CN1Cc1ccccc1	ZINC000398036982	405060521	/nfs/dbraw/zinc/06/05/21/405060521.db2.gz	JDVQFNVVSRRDKK-DZGCQCFKSA-N	0	3	310.401	2.057	10	0		DEAEHN
Fc1ccc(OCCN2CCC(O[C@@H]3CCOC3)CC2)cc1	ZINC000361438444	405075942	/nfs/dbraw/zinc/07/59/42/405075942.db2.gz	ZGDPTUUXBCRQGN-QGZVFWFLSA-N	0	3	309.381	2.474	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N2CC[C@H]3[C@H](CCCN3C3CC3)C2)[nH]1	ZINC000408025449	405091950	/nfs/dbraw/zinc/09/19/50/405091950.db2.gz	BWGAUTNWIQPZOO-DYVFJYSZSA-N	0	3	315.417	2.306	10	0		DEAEHN
C[C@H]1CCOCCN1CCC(=O)NCc1ccccc1Cl	ZINC000367663008	405117554	/nfs/dbraw/zinc/11/75/54/405117554.db2.gz	PARGLBIYGAPSPO-ZDUSSCGKSA-N	0	3	310.825	2.457	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)CNC(C)(C)CN2CCCC2)c1	ZINC000452097398	405164202	/nfs/dbraw/zinc/16/42/02/405164202.db2.gz	QTCBTCCOKQOJBU-UHFFFAOYSA-N	0	3	317.433	2.292	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N1CC(=O)N1CCO[C@H](c2cccc(O)c2)C1	ZINC000408351558	405182756	/nfs/dbraw/zinc/18/27/56/405182756.db2.gz	GFIPEQFUQJDQDM-CPUCHLNUSA-N	0	3	318.417	2.165	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCc2ccc(OC)cc2CC1	ZINC000440048554	405300522	/nfs/dbraw/zinc/30/05/22/405300522.db2.gz	DGNXILKUKCUVKW-SFHVURJKSA-N	0	3	316.445	2.497	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2cc(C)cc(C)c2)CC12COC2	ZINC000449365430	405527949	/nfs/dbraw/zinc/52/79/49/405527949.db2.gz	PMTGDJRAKOLOAG-INIZCTEOSA-N	0	3	303.402	2.315	10	0		DEAEHN
CC(C)CN(Cc1cnn(C)c1)C(=O)CC1CCN(C)CC1	ZINC000457346869	405805365	/nfs/dbraw/zinc/80/53/65/405805365.db2.gz	WBSFQIBGZSJTMY-UHFFFAOYSA-N	0	3	306.454	2.137	10	0		DEAEHN
CS(=O)(=O)NC[C@H]1CCCCN1C[C@@H]1C[C@H]1c1ccccc1	ZINC000459296604	405840465	/nfs/dbraw/zinc/84/04/65/405840465.db2.gz	JBGYFNVEMPYWRY-BBWFWOEESA-N	0	3	322.474	2.194	10	0		DEAEHN
CC(=O)N1CCC[C@H](CNCc2nc3ccccc3nc2C)C1	ZINC000639123611	405901561	/nfs/dbraw/zinc/90/15/61/405901561.db2.gz	MKZOYWISRRPHED-OAHLLOKOSA-N	0	3	312.417	2.286	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN1CC[C@H](OCCCc2ccccc2)C1	ZINC000450477065	405919737	/nfs/dbraw/zinc/91/97/37/405919737.db2.gz	UMSBMELCRXGHNY-ROUUACIJSA-N	0	3	305.418	2.050	10	0		DEAEHN
CC(=O)c1cnc(NC(=O)C[C@H](N)Cc2ccccc2)s1	ZINC000568870677	292373893	/nfs/dbraw/zinc/37/38/93/292373893.db2.gz	ACNVDXNDRXDMLE-GFCCVEGCSA-N	0	3	303.387	2.244	10	0		DEAEHN
CC(C)N(C)CC(=O)N1CCC[C@H](CC(=O)OC(C)(C)C)C1	ZINC000532379333	406072112	/nfs/dbraw/zinc/07/21/12/406072112.db2.gz	HMLRRNNTYYGDIK-CQSZACIVSA-N	0	3	312.454	2.297	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@@H]1CCCc2sccc21	ZINC000533817858	406163134	/nfs/dbraw/zinc/16/31/34/406163134.db2.gz	LIQCEZZITIWHTJ-CQSZACIVSA-N	0	3	301.415	2.213	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@H]1CCc2ccc(F)cc21	ZINC000533812683	406163538	/nfs/dbraw/zinc/16/35/38/406163538.db2.gz	KRXBANQYLSTWDU-INIZCTEOSA-N	0	3	314.364	2.041	10	0		DEAEHN
C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000471971395	406133271	/nfs/dbraw/zinc/13/32/71/406133271.db2.gz	AHDFOSLNRZJTPH-WRWGMCAJSA-N	0	3	307.360	2.451	10	0		DEAEHN
Cc1cccc2c1CC[C@H]2NC(=O)NCCNc1ccncc1	ZINC000535263454	406217770	/nfs/dbraw/zinc/21/77/70/406217770.db2.gz	YIARGDRUDVDVND-QGZVFWFLSA-N	0	3	310.401	2.211	10	0		DEAEHN
CCc1nc2n(c1CN)CCN(C(=O)OCc1ccccc1)C2	ZINC000536952683	406281194	/nfs/dbraw/zinc/28/11/94/406281194.db2.gz	DBWSFDAXLCNEIF-UHFFFAOYSA-N	0	3	314.389	2.057	10	0		DEAEHN
CC(=O)N1CCC[C@H](CNCc2nc3cc(F)ccc3o2)C1	ZINC000634978638	406383520	/nfs/dbraw/zinc/38/35/20/406383520.db2.gz	IIMHTXVJQVINFF-GFCCVEGCSA-N	0	3	305.353	2.315	10	0		DEAEHN
COC[C@](C)(O)CN[C@H]1CCCc2ncc(C(F)(F)F)cc21	ZINC000547659428	406429529	/nfs/dbraw/zinc/42/95/29/406429529.db2.gz	HQRYSWIIWMXCQY-UONOGXRCSA-N	0	3	318.339	2.465	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N[C@H]1C[C@@H]1c1ccccc1	ZINC000637911164	406473893	/nfs/dbraw/zinc/47/38/93/406473893.db2.gz	YFWLJJQCMMNAQM-QYZOEREBSA-N	0	3	323.440	2.118	10	0		DEAEHN
COC(=O)[C@@H](CC(C)C)NC(=O)CN1CCC2(C1)CCCCC2	ZINC000525635887	406491821	/nfs/dbraw/zinc/49/18/21/406491821.db2.gz	VTILYCRZLSSQQD-OAHLLOKOSA-N	0	3	324.465	2.347	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H](N)CN(C)Cc1ccccc1)c1ccccc1	ZINC000637868004	406454280	/nfs/dbraw/zinc/45/42/80/406454280.db2.gz	LFWNSPOWOQCFMF-QAPCUYQASA-N	0	3	311.429	2.323	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N[C@@H]1CC12CCCCC2	ZINC000638290289	406675805	/nfs/dbraw/zinc/67/58/05/406675805.db2.gz	FDDCNAPECMOYGK-IAGOWNOFSA-N	0	3	315.461	2.285	10	0		DEAEHN
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CSC2(C)C)cc1	ZINC000572596132	406699052	/nfs/dbraw/zinc/69/90/52/406699052.db2.gz	JTOJBRFROKKOMF-DZGCQCFKSA-N	0	3	309.431	2.113	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NCCCC1CCC1	ZINC000638414467	406758310	/nfs/dbraw/zinc/75/83/10/406758310.db2.gz	GLBKOYWCNJUMRP-KRWDZBQOSA-N	0	3	303.450	2.142	10	0		DEAEHN
COc1cccc(C(=O)N[C@H](CC(C)C)CN(C)C)c1OC	ZINC000128898992	196001710	/nfs/dbraw/zinc/00/17/10/196001710.db2.gz	REXPNHWSSLMSRX-CYBMUJFWSA-N	0	3	308.422	2.410	10	0		DEAEHN
CCNCc1c(Cl)cccc1N1CCC(OCCO)CC1	ZINC000129123330	196020629	/nfs/dbraw/zinc/02/06/29/196020629.db2.gz	GLNFKUHTMRZMED-UHFFFAOYSA-N	0	3	312.841	2.427	10	0		DEAEHN
NCc1cc(-c2nc3cc(Br)cnc3[nH]2)ccn1	ZINC000129608574	196061211	/nfs/dbraw/zinc/06/12/11/196061211.db2.gz	ZWSFUYKFTFOVIU-UHFFFAOYSA-N	0	3	304.151	2.241	10	0		DEAEHN
[NH3+]Cc1cc(-c2nc3cc(Br)cnc3[n-]2)ccn1	ZINC000129608574	196061213	/nfs/dbraw/zinc/06/12/13/196061213.db2.gz	ZWSFUYKFTFOVIU-UHFFFAOYSA-N	0	3	304.151	2.241	10	0		DEAEHN
c1ccc2nc(CN3CC[C@@H](CN4CCOCC4)C3)ccc2c1	ZINC000129607835	196061844	/nfs/dbraw/zinc/06/18/44/196061844.db2.gz	UBJJEXDKKGQFCV-INIZCTEOSA-N	0	3	311.429	2.389	10	0		DEAEHN
CS(=O)(=O)c1ccccc1Nc1cccc2c1CCNC2	ZINC000131065594	196136805	/nfs/dbraw/zinc/13/68/05/196136805.db2.gz	GPULNLCNUXLMND-UHFFFAOYSA-N	0	3	302.399	2.479	10	0		DEAEHN
CN[C@H](CCCS(C)(=O)=O)c1ccccc1OC(F)F	ZINC000131204320	196149597	/nfs/dbraw/zinc/14/95/97/196149597.db2.gz	SCGUCRHWBCHORY-LLVKDONJSA-N	0	3	307.362	2.373	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2cccc(C)c2Br)C1	ZINC000131399622	196164735	/nfs/dbraw/zinc/16/47/35/196164735.db2.gz	PISDLJWTGWKFTD-KOLCDFICSA-N	0	3	313.195	2.073	10	0		DEAEHN
CNc1nc(N[C@H](C)c2sc(C)nc2C)nc(N(C)C)n1	ZINC000131485532	196173609	/nfs/dbraw/zinc/17/36/09/196173609.db2.gz	RKTZHILWXQXPGS-MRVPVSSYSA-N	0	3	307.427	2.226	10	0		DEAEHN
N[C@H]1COC[C@@H]1C(=O)Nc1ccc(Cl)cc1Br	ZINC000131538209	196177899	/nfs/dbraw/zinc/17/78/99/196177899.db2.gz	PHBYXSCHOLJQNA-CBAPKCEASA-N	0	3	319.586	2.015	10	0		DEAEHN
CCN[C@H](C)c1ccc(O[C@@H]2CCS(=O)(=O)C2)c(F)c1	ZINC000131750334	196196248	/nfs/dbraw/zinc/19/62/48/196196248.db2.gz	DVFYNSLASQNICH-ZYHUDNBSSA-N	0	3	301.383	2.062	10	0		DEAEHN
Cc1nc(-c2ncccc2Br)nc2c1CCNC2	ZINC000132119638	196227531	/nfs/dbraw/zinc/22/75/31/196227531.db2.gz	KBVFEAOWKUKENH-UHFFFAOYSA-N	0	3	305.179	2.255	10	0		DEAEHN
Cc1cccc(-n2nnnc2CNCC(C)C)c1Br	ZINC000132218325	196236089	/nfs/dbraw/zinc/23/60/89/196236089.db2.gz	HYTSVEOCMQPXMW-UHFFFAOYSA-N	0	3	324.226	2.479	10	0		DEAEHN
NC(=O)CCN[C@@H]1CCCc2sc(Br)cc21	ZINC000132275244	196241800	/nfs/dbraw/zinc/24/18/00/196241800.db2.gz	NHIJXFCLZFRTIZ-MRVPVSSYSA-N	0	3	303.225	2.353	10	0		DEAEHN
C[C@H]1CNC[C@@H](COCc2ccc(F)c(Br)c2)O1	ZINC000132448737	196256939	/nfs/dbraw/zinc/25/69/39/196256939.db2.gz	CHWNLSVEDMSCJH-ONGXEEELSA-N	0	3	318.186	2.482	10	0		DEAEHN
Cc1csc(C2(NC(C)C)CCN(C(=O)N(C)C)CC2)n1	ZINC000132904715	196295782	/nfs/dbraw/zinc/29/57/82/196295782.db2.gz	ITBQNOPTORORMU-UHFFFAOYSA-N	0	3	310.467	2.422	10	0		DEAEHN
COC(=O)c1sc(N2CC[C@H](N3CCCCC3)C2)nc1C	ZINC000133237756	196324054	/nfs/dbraw/zinc/32/40/54/196324054.db2.gz	FPYWOCMJLDANQM-LBPRGKRZSA-N	0	3	309.435	2.303	10	0		DEAEHN
C[S@](=O)CCN[C@H]1CCc2cc(Br)ccc21	ZINC000133789490	196335766	/nfs/dbraw/zinc/33/57/66/196335766.db2.gz	FZNLYBSYMCUOGT-BLLLJJGKSA-N	0	3	302.237	2.405	10	0		DEAEHN
CC(C)c1ccc([C@H](O)CNC[C@@H]2CCCS2(=O)=O)cc1	ZINC000134097524	196360854	/nfs/dbraw/zinc/36/08/54/196360854.db2.gz	YNEOFCOIUHJWAU-JKSUJKDBSA-N	0	3	311.447	2.010	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@@H](CC)CSC)o1	ZINC000134258153	196375299	/nfs/dbraw/zinc/37/52/99/196375299.db2.gz	SZMPUSHILMQRRA-NSHDSACASA-N	0	3	320.480	2.199	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)c1ccc2c(c1)OCCCO2	ZINC000046860217	424822392	/nfs/dbraw/zinc/82/23/92/424822392.db2.gz	WHDPYMGSQNDICM-CQSZACIVSA-N	0	3	318.417	2.452	10	0		DEAEHN
Cc1cc(Cl)ccc1NC(=O)Cn1cc(C(C)(C)N)nn1	ZINC000070118643	424842069	/nfs/dbraw/zinc/84/20/69/424842069.db2.gz	ITXAJXVJXJJOJM-UHFFFAOYSA-N	0	3	307.785	2.072	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@H](C)N1CCC(Cc2nccn2C)CC1	ZINC000105876285	424849667	/nfs/dbraw/zinc/84/96/67/424849667.db2.gz	SHIGFVAOIGEGMK-GJZGRUSLSA-N	0	3	320.481	2.368	10	0		DEAEHN
Cc1c(Br)cccc1NC(=O)COC1(C)CNC1	ZINC000219014887	424885050	/nfs/dbraw/zinc/88/50/50/424885050.db2.gz	ZQUHLMJFGOIEIS-UHFFFAOYSA-N	0	3	313.195	2.075	10	0		DEAEHN
CN(Cc1cncc(Br)c1)[C@H]1CN2CCC1CC2	ZINC000386371339	424911428	/nfs/dbraw/zinc/91/14/28/424911428.db2.gz	RRINUAMPVXNISD-AWEZNQCLSA-N	0	3	310.239	2.370	10	0		DEAEHN
CN1C[C@H](CNCc2ccc(Br)cc2F)CC1=O	ZINC000657695006	425387746	/nfs/dbraw/zinc/38/77/46/425387746.db2.gz	SXQASJHBKAMXGI-VIFPVBQESA-N	0	3	315.186	2.156	10	0		DEAEHN
O=C(NCCCc1cccc(F)c1)N1CC[C@@H](N2CC=CC2)C1	ZINC000174818915	267509007	/nfs/dbraw/zinc/50/90/07/267509007.db2.gz	INHQGYAZKNPCBW-QGZVFWFLSA-N	0	3	317.408	2.414	10	0		DEAEHN
Cc1cccc(C[C@H](CO)NCc2cnc3nc(C)cc(C)n23)c1	ZINC000189011554	267686764	/nfs/dbraw/zinc/68/67/64/267686764.db2.gz	JPBYLDQLOSVBND-QGZVFWFLSA-N	0	3	324.428	2.348	10	0		DEAEHN
O=C1NCCC[C@@H]1N[C@@H]1CCc2ccc(Br)cc21	ZINC000336785204	275022934	/nfs/dbraw/zinc/02/29/34/275022934.db2.gz	BVGATEDQXDNQQI-OLZOCXBDSA-N	0	3	309.207	2.305	10	0		DEAEHN
CC(C)c1nn(C)c(Cl)c1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000172907661	276071196	/nfs/dbraw/zinc/07/11/96/276071196.db2.gz	SXEASPMMVWQCPN-LLVKDONJSA-N	0	3	310.829	2.117	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)Nc1ccc(Cl)cn1	ZINC000245471403	276170304	/nfs/dbraw/zinc/17/03/04/276170304.db2.gz	NWXQRYMEDAPJFF-TZMCWYRMSA-N	0	3	324.856	2.478	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000245424171	276179877	/nfs/dbraw/zinc/17/98/77/276179877.db2.gz	CBVCGPSCFAJGSK-QXULXFAOSA-N	0	3	306.450	2.325	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H]1COc2ccccc21	ZINC000176465031	276232747	/nfs/dbraw/zinc/23/27/47/276232747.db2.gz	RTQMTMUUDRFZKI-IJEWVQPXSA-N	0	3	315.417	2.388	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1CCc2c(nc(C(C)C)n2C)C1	ZINC000112667191	276361420	/nfs/dbraw/zinc/36/14/20/276361420.db2.gz	RMTIPIRSJJQVJD-MRXNPFEDSA-N	0	3	318.465	2.303	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(C(=O)[C@H]1C[C@H](C)CCN1)CC2	ZINC000423911910	277114217	/nfs/dbraw/zinc/11/42/17/277114217.db2.gz	SKAYKPJZJDJXEY-FZKQIMNGSA-N	0	3	314.429	2.205	10	0		DEAEHN
COC(=O)[C@@H](c1ccccc1)N(C)C(=O)CC1CCN(C)CC1	ZINC000362808814	277342177	/nfs/dbraw/zinc/34/21/77/277342177.db2.gz	MLDHCMBVJNUVCW-QGZVFWFLSA-N	0	3	318.417	2.091	10	0		DEAEHN
CO[C@]1(C)C[C@H](NC(=O)N2CCCN(C3CC3)CC2)C1(C)C	ZINC000074943819	277359930	/nfs/dbraw/zinc/35/99/30/277359930.db2.gz	SXRNRVGFCFCQLT-WMLDXEAASA-N	0	3	309.454	2.070	10	0		DEAEHN
CSc1nc2ncnc(N3CCN4CCC[C@H]4C3)c2s1	ZINC000246067622	278180345	/nfs/dbraw/zinc/18/03/45/278180345.db2.gz	IABLCNFDLTZICH-VIFPVBQESA-N	0	3	307.448	2.093	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)Nc1ccc(N2CCCC2)nc1	ZINC000262509465	278223059	/nfs/dbraw/zinc/22/30/59/278223059.db2.gz	MVHMGIFWZPLINE-HNNXBMFYSA-N	0	3	302.422	2.399	10	0		DEAEHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)c1cnn2c1CCCC2	ZINC000246351194	278258244	/nfs/dbraw/zinc/25/82/44/278258244.db2.gz	WDFWUQYXGCIREB-KGLIPLIRSA-N	0	3	304.438	2.070	10	0		DEAEHN
C[C@@H](CN1CCC[C@H](C)C1)NC(=O)c1cnn2c1CCCC2	ZINC000246351185	278259768	/nfs/dbraw/zinc/25/97/68/278259768.db2.gz	WDFWUQYXGCIREB-KBPBESRZSA-N	0	3	304.438	2.070	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000151288532	279295051	/nfs/dbraw/zinc/29/50/51/279295051.db2.gz	NZAYJQGOPYQXHN-HUUCEWRRSA-N	0	3	309.454	2.262	10	0		DEAEHN
C[C@H](NCC(=O)Nc1nc2ccccc2s1)[C@H]1CCCO1	ZINC000183130472	279461168	/nfs/dbraw/zinc/46/11/68/279461168.db2.gz	IDQIBHXGGSPKMB-CMPLNLGQSA-N	0	3	305.403	2.392	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N[C@@H]1CCc2ccccc21	ZINC000261943390	281459913	/nfs/dbraw/zinc/45/99/13/281459913.db2.gz	VBSRCXMVMSTWHT-MKSNKDDYSA-N	0	3	314.429	2.323	10	0		DEAEHN
CCCC[C@H](CC)CNC(=O)NC[C@H](O)CN1CCCCC1	ZINC000061955577	281502336	/nfs/dbraw/zinc/50/23/36/281502336.db2.gz	ZFLUPXFLMJVLKC-HOTGVXAUSA-N	0	3	313.486	2.349	10	0		DEAEHN
CN(C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C)c1ccc(F)cc1	ZINC000262468404	288916659	/nfs/dbraw/zinc/91/66/59/288916659.db2.gz	JBDZXNWZGVPNCI-GRDNDAEWSA-N	0	3	306.381	2.321	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@H](C2CCCC2)C(F)(F)F)C1	ZINC000127207857	289313223	/nfs/dbraw/zinc/31/32/23/289313223.db2.gz	ZJPKASHOLUVOPG-VXGBXAGGSA-N	0	3	307.360	2.453	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)N1CC[C@@H]2OCCC[C@H]2C1	ZINC000246710190	289564295	/nfs/dbraw/zinc/56/42/95/289564295.db2.gz	NSDSHQXQJSRTBK-PMPSAXMXSA-N	0	3	309.454	2.071	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)NCCOCC1CCC1	ZINC000575053037	326213688	/nfs/dbraw/zinc/21/36/88/326213688.db2.gz	DNQWVORLONAHJE-INIZCTEOSA-N	0	3	311.470	2.367	10	0		DEAEHN
COC[C@H](C)CN1CCN(c2ncnc3sc(C)cc32)CC1	ZINC000188757660	333054609	/nfs/dbraw/zinc/05/46/09/333054609.db2.gz	TZVYFJZNUMXDAQ-GFCCVEGCSA-N	0	3	320.462	2.404	10	0		DEAEHN
N[C@@H](CNC(=O)c1coc(Br)c1)c1ccccc1	ZINC000378918869	333063991	/nfs/dbraw/zinc/06/39/91/333063991.db2.gz	NZHPEPMRTVCJTO-NSHDSACASA-N	0	3	309.163	2.472	10	0		DEAEHN
COC[C@H](C)CN1CCCN(C(=O)c2ccccc2F)CC1	ZINC000189640132	333190991	/nfs/dbraw/zinc/19/09/91/333190991.db2.gz	ZXFJBZIUUKQWLI-CQSZACIVSA-N	0	3	308.397	2.256	10	0		DEAEHN
COC(C)(C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000398002291	337303427	/nfs/dbraw/zinc/30/34/27/337303427.db2.gz	XAAWODNGUAZXMI-GOEBONIOSA-N	0	3	304.434	2.438	10	0		DEAEHN
Cc1ccc([O-])c(C[NH2+]C[C@@H]2CCN(C)[C@H]2c2cccnc2)n1	ZINC000328639463	534197196	/nfs/dbraw/zinc/19/71/96/534197196.db2.gz	PNSWETLCBPWCGM-YJBOKZPZSA-N	0	3	312.417	2.273	10	0		DEAEHN
COc1ccc(O)cc1C(=O)NC[C@H](C)N1CCC[C@H](C)C1	ZINC000188084968	534211454	/nfs/dbraw/zinc/21/14/54/534211454.db2.gz	NQPAATHCTHFZPQ-STQMWFEESA-N	0	3	306.406	2.251	10	0		DEAEHN
Cc1nc(NC(=O)[C@H]2C[C@@H](C)CCN2)ccc1Br	ZINC000127387043	518192733	/nfs/dbraw/zinc/19/27/33/518192733.db2.gz	QVZASGWCWAXTSM-GZMMTYOYSA-N	0	3	312.211	2.479	10	0		DEAEHN
CC(=O)NCCCN1[C@@H]2CCCC[C@@H]2C[C@H]1C(=O)OC(C)(C)C	ZINC000249463073	534396383	/nfs/dbraw/zinc/39/63/83/534396383.db2.gz	ROGXHOPBABFTJR-OAGGEKHMSA-N	0	3	324.465	2.487	10	0		DEAEHN
Cc1nc([C@@H]2CCCN2C(=O)[C@@H](C)N2CCCCCC2)no1	ZINC000329416627	534568692	/nfs/dbraw/zinc/56/86/92/534568692.db2.gz	ZGRDBTCWEVIDKQ-OCCSQVGLSA-N	0	3	306.410	2.306	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H](COC)c2ccc(C)o2)C1	ZINC000245426915	521620439	/nfs/dbraw/zinc/62/04/39/521620439.db2.gz	GRMUDMKGIXDGEZ-ZIAGYGMSSA-N	0	3	309.410	2.059	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000156494164	521644869	/nfs/dbraw/zinc/64/48/69/521644869.db2.gz	MHZVAHXDKYAUNS-HOCLYGCPSA-N	0	3	319.449	2.449	10	0		DEAEHN
O=C(c1cc(-c2cccs2)on1)N1CCN2CCC[C@H]2C1	ZINC000195325042	534657459	/nfs/dbraw/zinc/65/74/59/534657459.db2.gz	JMINPPOTACHSOR-NSHDSACASA-N	0	3	303.387	2.323	10	0		DEAEHN
CC[C@](C)(CCO)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248042930	523455870	/nfs/dbraw/zinc/45/58/70/523455870.db2.gz	MGLVBVYXUSSTMC-SOLBZPMBSA-N	0	3	319.449	2.282	10	0		DEAEHN
COc1cccc2c1CCN(C(=O)[C@H](C(C)C)N(C)C)CC2	ZINC000364810763	524210050	/nfs/dbraw/zinc/21/00/50/524210050.db2.gz	MGXHSUJKCAJICT-KRWDZBQOSA-N	0	3	304.434	2.209	10	0		DEAEHN
Cc1ccccc1OCCCNC(=O)NC[C@@H]1CCCN1C	ZINC000105191778	525289126	/nfs/dbraw/zinc/28/91/26/525289126.db2.gz	IMSRNJODDMVMSN-HNNXBMFYSA-N	0	3	305.422	2.157	10	0		DEAEHN
Cc1c(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cnn1CC(C)C	ZINC000245801008	525649496	/nfs/dbraw/zinc/64/94/96/525649496.db2.gz	ZHUGJWAPEPIQQR-CJNGLKHVSA-N	0	3	306.454	2.306	10	0		DEAEHN
CCO[C@H](C)c1noc(CN2C[C@@H]3CCCCN3C[C@H]2C)n1	ZINC000328681225	528021347	/nfs/dbraw/zinc/02/13/47/528021347.db2.gz	VBEUZEMJAHQDII-MCIONIFRSA-N	0	3	308.426	2.226	10	0		DEAEHN
CCN1CCC[C@@H](CN(C)c2ncccn2)[C@@H]1c1cnn(C)c1	ZINC000328626757	529048426	/nfs/dbraw/zinc/04/84/26/529048426.db2.gz	MBBFFNDGYZYGHY-GOEBONIOSA-N	0	3	314.437	2.120	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)C(=O)c2ccc3c(c2)CCC3)C1	ZINC000247483872	535256225	/nfs/dbraw/zinc/25/62/25/535256225.db2.gz	WIJYQGZUIZEYTJ-CXAGYDPISA-N	0	3	314.429	2.203	10	0		DEAEHN
CCC1(CC)[C@H](NC(=O)N2CC[C@@H](N3CC=CC3)C2)C[C@@H]1OC	ZINC000246774497	535270344	/nfs/dbraw/zinc/27/03/44/535270344.db2.gz	IEZJJMMVFQGHQN-OAGGEKHMSA-N	0	3	321.465	2.236	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)N1CCC[C@H]1c1cnn(C)c1	ZINC000247471424	535484914	/nfs/dbraw/zinc/48/49/14/535484914.db2.gz	HBBZCHXAFUAJRY-CVEARBPZSA-N	0	3	319.453	2.141	10	0		DEAEHN
CCCc1nc(CN2CCN(C[C@@H](C)O)[C@@H](CC)C2)cs1	ZINC000246646869	535526088	/nfs/dbraw/zinc/52/60/88/535526088.db2.gz	AZXVQWQUSHESHW-HIFRSBDPSA-N	0	3	311.495	2.373	10	0		DEAEHN
CCN1CCC[C@@H](N[C@H](C)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000249614645	535541449	/nfs/dbraw/zinc/54/14/49/535541449.db2.gz	QCVZVKVBYADPJQ-UKRRQHHQSA-N	0	3	310.463	2.225	10	0		DEAEHN
CCc1cccc(OCCN2CCN(C[C@H](C)O)[C@@H](CC)C2)c1	ZINC000247240352	535907006	/nfs/dbraw/zinc/90/70/06/535907006.db2.gz	SGUNKCIWXCFYLF-WMZOPIPTSA-N	0	3	320.477	2.405	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)NC(C)(C)CN2CCCC2)c1	ZINC000457838246	536880796	/nfs/dbraw/zinc/88/07/96/536880796.db2.gz	BMGYBERLXQHBRC-UHFFFAOYSA-N	0	3	318.417	2.386	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1c[nH]c(=S)n1-c1ccccc1	ZINC000194723545	633307063	/nfs/dbraw/zinc/30/70/63/633307063.db2.gz	KIJCTGNXDIHNQB-ZDUSSCGKSA-N	0	3	316.430	2.359	10	0		DEAEHN
COC(=O)/C(C)=C/CN(CCCO)[C@H]1CCc2ccccc21	ZINC000748818225	638595463	/nfs/dbraw/zinc/59/54/63/638595463.db2.gz	SDLXKKGCSCYGNJ-SHRNQRGKSA-N	0	3	303.402	2.478	10	0		DEAEHN
CN(C)[C@H](CNC(=O)Cc1ccc(F)cn1)Cc1ccccc1	ZINC000806290135	645813769	/nfs/dbraw/zinc/81/37/69/645813769.db2.gz	HZDWMBKCUZVAEK-KRWDZBQOSA-N	0	3	315.392	2.052	10	0		DEAEHN
C[C@H](NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1nccn1C	ZINC000230412493	646728982	/nfs/dbraw/zinc/72/89/82/646728982.db2.gz	BWBFQSVZBXGIEJ-STQMWFEESA-N	0	3	308.426	2.328	10	0		DEAEHN
Cn1ccc(CN[C@H]2CCC[C@H]2CNC(=O)OC(C)(C)C)n1	ZINC000230685117	646743637	/nfs/dbraw/zinc/74/36/37/646743637.db2.gz	PMFIAXJMVPDVQC-JSGCOSHPSA-N	0	3	308.426	2.203	10	0		DEAEHN
Cc1ccc(-c2cnn(CN3CCO[C@H](CN(C)C)C3)c2)cc1	ZINC000153000428	647336750	/nfs/dbraw/zinc/33/67/50/647336750.db2.gz	PKMIXLOBBNWPDE-GOSISDBHSA-N	0	3	314.433	2.078	10	0		DEAEHN
COc1ccc(OC)c(CN(CCC2OCCO2)C2CC2)c1	ZINC000123575178	684126347	/nfs/dbraw/zinc/12/63/47/684126347.db2.gz	RFNXHYZESBZHPR-UHFFFAOYSA-N	0	3	307.390	2.431	10	0		DEAEHN
COCCO[C@@H]1CCCN(C[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000245857682	685119017	/nfs/dbraw/zinc/11/90/17/685119017.db2.gz	KJOXDFDXTODPQH-QZTJIDSGSA-N	0	3	307.434	2.464	10	0		DEAEHN
CCCCCCNC(=O)[C@H]1CCCN(C[C@@H](O)C(F)(F)F)C1	ZINC000248397677	685158527	/nfs/dbraw/zinc/15/85/27/685158527.db2.gz	SBSPHRSZBLHPOV-QWHCGFSZSA-N	0	3	324.387	2.318	10	0		DEAEHN
COCC1CCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)CC1	ZINC000724110736	777243033	/nfs/dbraw/zinc/24/30/33/777243033.db2.gz	JLEHKKMQOGPOBY-SNVBAGLBSA-N	0	3	305.287	2.293	10	0		DEAEHN
CO[C@]1(CN[C@H](C)c2cccc(Cl)c2)CCS(=O)(=O)C1	ZINC000721261838	781075076	/nfs/dbraw/zinc/07/50/76/781075076.db2.gz	SIDDKWWAUAJCFG-RISCZKNCSA-N	0	3	317.838	2.194	10	0		DEAEHN
CO[C@@]1(CN[C@@H](C)c2cccc(Cl)c2)CCS(=O)(=O)C1	ZINC000721261842	781075137	/nfs/dbraw/zinc/07/51/37/781075137.db2.gz	SIDDKWWAUAJCFG-SMDDNHRTSA-N	0	3	317.838	2.194	10	0		DEAEHN
CCO[C@@H]1C[C@@](CO)(NCc2cnc3cc(C)ccn23)C1(C)C	ZINC000186578239	784405630	/nfs/dbraw/zinc/40/56/30/784405630.db2.gz	ZWZZDDGIUXYMAA-QAPCUYQASA-N	0	3	317.433	2.298	10	0		DEAEHN
CC1(C)CCNCCN1S(=O)(=O)c1ccccc1Cl	ZINC000712505449	792190048	/nfs/dbraw/zinc/19/00/48/792190048.db2.gz	GLPVDXGWDSULRZ-UHFFFAOYSA-N	0	3	302.827	2.103	10	0		DEAEHN
C[C@@H](CNCc1nc(Br)c[nH]1)CC1(C)OCCO1	ZINC000715997675	792561003	/nfs/dbraw/zinc/56/10/03/792561003.db2.gz	KJKVUNXIIDMJHN-SECBINFHSA-N	0	3	318.215	2.051	10	0		DEAEHN
CS(=O)(=O)C1CC(NCc2cccc(C(F)(F)F)c2)C1	ZINC000716143194	792572004	/nfs/dbraw/zinc/57/20/04/792572004.db2.gz	UJDPAILPDGCVKD-UHFFFAOYSA-N	0	3	307.337	2.371	10	0		DEAEHN
C[C@@H]([N-]S(=O)(=O)c1ccc(Cl)s1)C1CC[NH2+]CC1	ZINC000716544663	792979451	/nfs/dbraw/zinc/97/94/51/792979451.db2.gz	JAEGTZKHTCEFOP-MRVPVSSYSA-N	0	3	308.856	2.068	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@H]1C[C@@H](NCc2cnccn2)C12CCC2	ZINC000404771845	802030963	/nfs/dbraw/zinc/03/09/63/802030963.db2.gz	ZQPPVODVYYSMOD-KGLIPLIRSA-N	0	3	318.421	2.402	10	0		DEAEHN
CC[C@@H]1C[C@@H](NCc2cn(C)nc2Br)CCO1	ZINC000720644803	1085809192	/nfs/dbraw/zinc/80/91/92/1085809192.db2.gz	GJQCRVRUQBPIJT-WDEREUQCSA-N	0	3	302.216	2.230	10	0		DEAEHN
Cn1cc(CN[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c(Br)n1	ZINC000720657858	1085819435	/nfs/dbraw/zinc/81/94/35/1085819435.db2.gz	VMRXBLNYRQGENH-AXFHLTTASA-N	0	3	314.227	2.086	10	0		DEAEHN
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C)c1cnn(C)c1	ZINC000700737924	1086333655	/nfs/dbraw/zinc/33/36/55/1086333655.db2.gz	VQAFPUZZTZZSGQ-SGMGOOAPSA-N	0	3	308.426	2.469	10	0		DEAEHN
C[C@H]1CN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)C(C)(C)C1	ZINC000702337964	1086424754	/nfs/dbraw/zinc/42/47/54/1086424754.db2.gz	KWIGOOINYIPWAG-ZBFHGGJFSA-N	0	3	303.450	2.093	10	0		DEAEHN
Cc1ccncc1CNCCOCCN(C)C(=O)OC(C)(C)C	ZINC000705923597	1086626113	/nfs/dbraw/zinc/62/61/13/1086626113.db2.gz	QFFOGGMZKAPAHH-UHFFFAOYSA-N	0	3	323.437	2.363	10	0		DEAEHN
COC1(OC)CC[C@H]1NC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000710947385	1086691753	/nfs/dbraw/zinc/69/17/53/1086691753.db2.gz	NYFFRAPUQGLUTG-QWHCGFSZSA-N	0	3	316.442	2.277	10	0		DEAEHN
C[C@@H]1[C@@H](NC(=O)c2ccc(F)cc2Br)CCN1C	ZINC000719387640	1089059198	/nfs/dbraw/zinc/05/91/98/1089059198.db2.gz	KYWAZBSTGXRJNV-PELKAZGASA-N	0	3	315.186	2.411	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCCc1cc2ccccc2[nH]1	ZINC000136520730	282087864	/nfs/dbraw/zinc/08/78/64/282087864.db2.gz	FCSSWSZOTOUHQV-HNNXBMFYSA-N	0	3	300.406	2.104	10	0		DEAEHN
CN[C@H](CSCCC(=O)OC)c1cc(OC)ccc1OC	ZINC000081790234	192324588	/nfs/dbraw/zinc/32/45/88/192324588.db2.gz	AGWUNHJNMACSGU-CYBMUJFWSA-N	0	3	313.419	2.261	10	0		DEAEHN
CN[C@@H](CSc1nc[nH]n1)c1ccc2c(c1)OCCCO2	ZINC000081849577	192331458	/nfs/dbraw/zinc/33/14/58/192331458.db2.gz	NJUVHWGGVBAJNI-NSHDSACASA-N	0	3	306.391	2.019	10	0		DEAEHN
CCC[C@@H](N)CS(=O)(=O)c1ccccc1Br	ZINC000081931337	192341662	/nfs/dbraw/zinc/34/16/62/192341662.db2.gz	LFWARCKRFACXOT-SECBINFHSA-N	0	3	306.225	2.350	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2ccccc2C(F)(F)F)CCO1	ZINC000116793723	282139807	/nfs/dbraw/zinc/13/98/07/282139807.db2.gz	ABWLLNUNJMGAOR-NSHDSACASA-N	0	3	316.323	2.108	10	0		DEAEHN
CCOC(=O)[C@](C)(NCCN(C)C)c1ccc(F)cc1Cl	ZINC000078901558	185126007	/nfs/dbraw/zinc/12/60/07/185126007.db2.gz	ZFLNSDCOUGSNJD-OAHLLOKOSA-N	0	3	316.804	2.409	10	0		DEAEHN
C[C@@H](O)c1ccc(N2CCN(CC(C)(C)O)CC2)cc1Cl	ZINC000078944936	185133118	/nfs/dbraw/zinc/13/31/18/185133118.db2.gz	HTWKCRBAHVEYNK-GFCCVEGCSA-N	0	3	312.841	2.286	10	0		DEAEHN
C[C@@H](O)c1ccc(N2CCN(CCN(C)C)CC2)cc1Cl	ZINC000078944581	185133229	/nfs/dbraw/zinc/13/32/29/185133229.db2.gz	WWHORFDMWKGBHZ-CYBMUJFWSA-N	0	3	311.857	2.077	10	0		DEAEHN
CC(C)(C)[C@H]1CCCN(S(=O)(=O)[C@@H]2CCCNC2)CC1	ZINC000079358441	185166863	/nfs/dbraw/zinc/16/68/63/185166863.db2.gz	OAEZEDQPGATMEF-UONOGXRCSA-N	0	3	302.484	2.216	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N[C@@H](C)CN1CCCCC1	ZINC000079527368	185173929	/nfs/dbraw/zinc/17/39/29/185173929.db2.gz	YTESPQWANLFEQF-AWEZNQCLSA-N	0	3	305.422	2.473	10	0		DEAEHN
CNCc1ccc(Br)cc1SCC(=O)OC	ZINC000082616153	185191083	/nfs/dbraw/zinc/19/10/83/185191083.db2.gz	CJEDIPRHNISKGA-UHFFFAOYSA-N	0	3	304.209	2.434	10	0		DEAEHN
CCN[C@H](CS(=O)(=O)CCOC)c1c(C)cc(C)cc1C	ZINC000081944441	192345924	/nfs/dbraw/zinc/34/59/24/192345924.db2.gz	ZTSYKOXDNDGGPU-OAHLLOKOSA-N	0	3	313.463	2.324	10	0		DEAEHN
CCC(CC)CS(=O)(=O)N1C[C@H]2CCCN2C[C@@H]1CC	ZINC000173831337	282172197	/nfs/dbraw/zinc/17/21/97/282172197.db2.gz	XTHTVIMIFYHDNM-LSDHHAIUSA-N	0	3	302.484	2.311	10	0		DEAEHN
COc1ccc(Br)cc1C[C@@H](N)c1cnn(C)c1	ZINC000087422940	185224236	/nfs/dbraw/zinc/22/42/36/185224236.db2.gz	WDANUBQBJCZCGW-GFCCVEGCSA-N	0	3	310.195	2.434	10	0		DEAEHN
COc1ccc(C[C@@H](N)c2ccn(C)n2)cc1Br	ZINC000087424184	185224366	/nfs/dbraw/zinc/22/43/66/185224366.db2.gz	NUFGYPFBOKFOHN-LLVKDONJSA-N	0	3	310.195	2.434	10	0		DEAEHN
CCN(C)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000173498954	282191152	/nfs/dbraw/zinc/19/11/52/282191152.db2.gz	VZYISIAJMMTZBG-QGZVFWFLSA-N	0	3	319.449	2.093	10	0		DEAEHN
CN1CCN(CCc2csc(N)n2)[C@H](c2ccccc2)C1	ZINC000088193196	185241506	/nfs/dbraw/zinc/24/15/06/185241506.db2.gz	VWUOOHNRXFLVEP-HNNXBMFYSA-N	0	3	302.447	2.257	10	0		DEAEHN
COc1cc(CNC[C@H](C)CO)cc(Br)c1OC	ZINC000088195353	185241581	/nfs/dbraw/zinc/24/15/81/185241581.db2.gz	ZZQBUWOBSZMBSP-VIFPVBQESA-N	0	3	318.211	2.184	10	0		DEAEHN
C[C@@H](CNC(=O)NC[C@@H]1CCCN1C)c1ccc(F)cc1F	ZINC000174351457	282193603	/nfs/dbraw/zinc/19/36/03/282193603.db2.gz	ASBINLYGQMCIRW-AAEUAGOBSA-N	0	3	311.376	2.462	10	0		DEAEHN
N[C@@H]1CCCN(c2c3nsnc3c(Cl)cc2Cl)C1=O	ZINC000088128027	185240301	/nfs/dbraw/zinc/24/03/01/185240301.db2.gz	YESBIHYRGCJLTH-SSDOTTSWSA-N	0	3	317.201	2.452	10	0		DEAEHN
CCCc1nnsc1C(=O)N1CCNCC12CCCCC2	ZINC000088395967	185248575	/nfs/dbraw/zinc/24/85/75/185248575.db2.gz	RXEMOOUKDVZGRH-UHFFFAOYSA-N	0	3	308.451	2.239	10	0		DEAEHN
NN=c1[nH]cc(C(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1Cl	ZINC000088438633	185250690	/nfs/dbraw/zinc/25/06/90/185250690.db2.gz	HWRQPKNRUHDROY-MRVPVSSYSA-N	0	3	322.718	2.435	10	0		DEAEHN
CCCNCc1ccc(S(=O)(=O)N(C)[C@@H](C)C(C)C)o1	ZINC000088543848	185256814	/nfs/dbraw/zinc/25/68/14/185256814.db2.gz	RZDFJKQKYKPZIS-LBPRGKRZSA-N	0	3	302.440	2.444	10	0		DEAEHN
CSCCC[N-]S(=O)(=O)c1ccc(C[NH2+]CC(C)C)o1	ZINC000088551132	185257305	/nfs/dbraw/zinc/25/73/05/185257305.db2.gz	IATTYHYVCMSHGI-UHFFFAOYSA-N	0	3	320.480	2.057	10	0		DEAEHN
C[C@@H]1CCCN1S(=O)(=O)c1ccc(CNC(C)(C)C)o1	ZINC000088543312	185256058	/nfs/dbraw/zinc/25/60/58/185256058.db2.gz	LBDNYABHWKXODO-LLVKDONJSA-N	0	3	300.424	2.341	10	0		DEAEHN
CC[C@@H]([N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1)C(C)C	ZINC000088542977	185256170	/nfs/dbraw/zinc/25/61/70/185256170.db2.gz	QFRRQFOCIJHGBA-CYBMUJFWSA-N	0	3	302.440	2.491	10	0		DEAEHN
CC[C@@H](NS(=O)(=O)c1ccc(CNC(C)C)o1)C(C)C	ZINC000088542977	185256171	/nfs/dbraw/zinc/25/61/71/185256171.db2.gz	QFRRQFOCIJHGBA-CYBMUJFWSA-N	0	3	302.440	2.491	10	0		DEAEHN
CN[C@@H]1CCC[C@H]1S(=O)(=O)c1cccc(Br)c1	ZINC000081982651	192349014	/nfs/dbraw/zinc/34/90/14/192349014.db2.gz	LDKJXTCJKQPJJX-VXGBXAGGSA-N	0	3	318.236	2.363	10	0		DEAEHN
CCCN[C@@H](c1ccccc1COC)[C@@H]1CCS(=O)(=O)C1	ZINC000088556544	185257963	/nfs/dbraw/zinc/25/79/63/185257963.db2.gz	STBYYLSAGZKCHY-GDBMZVCRSA-N	0	3	311.447	2.308	10	0		DEAEHN
C[C@H](CN1CCCC1)NC(=O)c1sc2ncccc2c1N	ZINC000088641864	185261017	/nfs/dbraw/zinc/26/10/17/185261017.db2.gz	UFPZPEFIVKZIAN-SNVBAGLBSA-N	0	3	304.419	2.093	10	0		DEAEHN
CC(C)[C@H]1CCCN1CC(=O)Nc1cccc(C(N)=S)c1	ZINC000088836974	185266962	/nfs/dbraw/zinc/26/69/62/185266962.db2.gz	XXHWFMYQAZXKFC-CQSZACIVSA-N	0	3	305.447	2.380	10	0		DEAEHN
CC[C@@H]([C@@H](NC)c1ccccc1)S(=O)(=O)C1CCOCC1	ZINC000081989826	192350946	/nfs/dbraw/zinc/35/09/46/192350946.db2.gz	WANRGNCJJDLSAD-HOTGVXAUSA-N	0	3	311.447	2.320	10	0		DEAEHN
CC(C)C[C@@](C)(O)CNCC(=O)Nc1c(F)cccc1F	ZINC000090272375	185288732	/nfs/dbraw/zinc/28/87/32/185288732.db2.gz	WNRBTYHTOMGJFS-OAHLLOKOSA-N	0	3	300.349	2.290	10	0		DEAEHN
C[C@@H](NC[C@@H](O)CO)c1cc2cc(Br)ccc2o1	ZINC000090282336	185289460	/nfs/dbraw/zinc/28/94/60/185289460.db2.gz	VQJDSDMXTQQEBU-LDYMZIIASA-N	0	3	314.179	2.199	10	0		DEAEHN
CCn1nc(C)c(Cl)c1Cn1cc(CNC(C)(C)C)nn1	ZINC000090298377	185290055	/nfs/dbraw/zinc/29/00/55/185290055.db2.gz	AOLHYTNWPVJLNV-UHFFFAOYSA-N	0	3	310.833	2.393	10	0		DEAEHN
CN[C@@H]1COC[C@H]1c1nc(Cc2ccc(F)cc2Cl)no1	ZINC000090423980	185295653	/nfs/dbraw/zinc/29/56/53/185295653.db2.gz	HZJRSJYYHBBCTP-ZYHUDNBSSA-N	0	3	311.744	2.155	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1ccccc1SC(F)F	ZINC000090431543	185295766	/nfs/dbraw/zinc/29/57/66/185295766.db2.gz	WDXFWDIPHDYRFZ-SCZZXKLOSA-N	0	3	302.346	2.174	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1ccc(SC(F)(F)F)cc1	ZINC000090433441	185296199	/nfs/dbraw/zinc/29/61/99/185296199.db2.gz	OELSYOSZDXZJAE-QWRGUYRKSA-N	0	3	320.336	2.471	10	0		DEAEHN
CCN(Cc1ccc(Cl)s1)C(=O)[C@]1(C)COC[C@H]1N	ZINC000090590620	185305431	/nfs/dbraw/zinc/30/54/31/185305431.db2.gz	KLXXUPLFZAKYQO-ZWNOBZJWSA-N	0	3	302.827	2.114	10	0		DEAEHN
C[C@]1(C(=O)N2CCC[C@@H]2c2cccc(Cl)c2)COC[C@H]1N	ZINC000090593669	185305672	/nfs/dbraw/zinc/30/56/72/185305672.db2.gz	XRWYMQVRRYHTGV-FMKPAKJESA-N	0	3	308.809	2.367	10	0		DEAEHN
Cc1cc(Br)ccc1NC(=O)[C@@]1(C)COC[C@H]1N	ZINC000090580361	185304809	/nfs/dbraw/zinc/30/48/09/185304809.db2.gz	SUWDLYOSKDVZDN-YPMHNXCESA-N	0	3	313.195	2.060	10	0		DEAEHN
CN(C)C[C@@H]1CSCCCN1C(=O)Cc1ccc(F)cc1	ZINC000090699960	185310491	/nfs/dbraw/zinc/31/04/91/185310491.db2.gz	UGGAVUKENTUHHV-OAHLLOKOSA-N	0	3	310.438	2.264	10	0		DEAEHN
Cc1ccc(OCC(=O)N2CCCSC[C@H]2CN(C)C)cc1	ZINC000090699945	185310621	/nfs/dbraw/zinc/31/06/21/185310621.db2.gz	WHDMOZPBXSEQKF-OAHLLOKOSA-N	0	3	322.474	2.270	10	0		DEAEHN
CC[C@@H]1CN(c2ccccc2)CCN1C(=O)CN(CC)CC	ZINC000184270567	282250789	/nfs/dbraw/zinc/25/07/89/282250789.db2.gz	BBWGRJACSKAIIW-MRXNPFEDSA-N	0	3	303.450	2.456	10	0		DEAEHN
CC1(C)C(CNS(=O)(=O)Cc2ccccc2CN)C1(C)C	ZINC000092817191	185343733	/nfs/dbraw/zinc/34/37/33/185343733.db2.gz	JARVQCQUHZFQCP-UHFFFAOYSA-N	0	3	310.463	2.247	10	0		DEAEHN
COC(=O)CNC(=O)[C@@H](C)N[C@@H](C)c1ccc2ccccc2c1	ZINC000181495005	199306314	/nfs/dbraw/zinc/30/63/14/199306314.db2.gz	PFGULCOGDLCTDE-QWHCGFSZSA-N	0	3	314.385	2.168	10	0		DEAEHN
CCN[C@@H](Cc1ccn(C(CC)CC)n1)[C@H](C)S(C)(=O)=O	ZINC000168913591	197730323	/nfs/dbraw/zinc/73/03/23/197730323.db2.gz	UOJAZSFGZXGFOE-WFASDCNBSA-N	0	3	315.483	2.198	10	0		DEAEHN
O=C1CC[C@@H](CN[C@@H]2CCc3cc(Br)ccc32)N1	ZINC000079928424	539375432	/nfs/dbraw/zinc/37/54/32/539375432.db2.gz	DRRYAGCCNYASPV-WCQYABFASA-N	0	3	309.207	2.305	10	0		DEAEHN
C[C@H]1CCNC[C@H]1NS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000193418260	282350535	/nfs/dbraw/zinc/35/05/35/282350535.db2.gz	GYVSXKWSHICDNW-SWLSCSKDSA-N	0	3	310.463	2.260	10	0		DEAEHN
CN(CC1=CCCOC1)C[C@H](c1cccs1)N1CCOCC1	ZINC000121741110	282385709	/nfs/dbraw/zinc/38/57/09/282385709.db2.gz	JOBUHTFEIWZCSZ-MRXNPFEDSA-N	0	3	322.474	2.400	10	0		DEAEHN
NC1(C(=O)NC[C@@H]2C[C@H]2c2ccccc2)Cc2ccccc2C1	ZINC000157778374	539574162	/nfs/dbraw/zinc/57/41/62/539574162.db2.gz	NVDGDQHVOWOKKO-ROUUACIJSA-N	0	3	306.409	2.403	10	0		DEAEHN
CCN1CCCN(Cc2nnc(-c3cc(C)oc3C)o2)CC1	ZINC000161890795	539593910	/nfs/dbraw/zinc/59/39/10/539593910.db2.gz	RBKSTYGDYAAVCH-UHFFFAOYSA-N	0	3	304.394	2.474	10	0		DEAEHN
C[C@@H](NCC(=O)N(C)c1nc2ccccc2s1)[C@H]1CCCO1	ZINC000183098515	539659225	/nfs/dbraw/zinc/65/92/25/539659225.db2.gz	BEMZAKXPUTXDQM-DGCLKSJQSA-N	0	3	319.430	2.416	10	0		DEAEHN
C[C@@H](NCC(=O)NCCc1ccc(Cl)cc1)[C@@H]1CCCO1	ZINC000183085974	539659806	/nfs/dbraw/zinc/65/98/06/539659806.db2.gz	BZRYMLYOFFBXPX-DOMZBBRYSA-N	0	3	310.825	2.156	10	0		DEAEHN
CCN[C@@H]1CCCN(c2cc(Cl)c(OC)cc2OC)C1=O	ZINC000071037863	190930642	/nfs/dbraw/zinc/93/06/42/190930642.db2.gz	KDKVFRTWLVVSMK-LLVKDONJSA-N	0	3	312.797	2.462	10	0		DEAEHN
CC[C@H]1CN(Cc2cccc(OC)c2F)CCN1CCOC	ZINC000192950883	539710239	/nfs/dbraw/zinc/71/02/39/539710239.db2.gz	JYBIBWIJUYIOQR-HNNXBMFYSA-N	0	3	310.413	2.377	10	0		DEAEHN
CN[C@H](C[S@@](=O)CCOC)c1cccc(C(F)(F)F)c1	ZINC000084035322	192396677	/nfs/dbraw/zinc/39/66/77/192396677.db2.gz	XKZWKIMUXBNGGO-MPBGBICISA-N	0	3	309.353	2.361	10	0		DEAEHN
CCCCN(C)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138304459	186015783	/nfs/dbraw/zinc/01/57/83/186015783.db2.gz	MHUPZABNHXGQFN-UHFFFAOYSA-N	0	3	306.378	2.105	10	0		DEAEHN
CC(C)NCc1cc(F)c(F)c(S(=O)(=O)N(C)C2CC2)c1	ZINC000138439174	186016831	/nfs/dbraw/zinc/01/68/31/186016831.db2.gz	AIYBCEKIYXHICV-UHFFFAOYSA-N	0	3	318.389	2.246	10	0		DEAEHN
CCCN(C)S(=O)(=O)c1cc(CNCC)cc(F)c1F	ZINC000138454728	186017317	/nfs/dbraw/zinc/01/73/17/186017317.db2.gz	PYQDASCHBVYYMF-UHFFFAOYSA-N	0	3	306.378	2.105	10	0		DEAEHN
CCC(CC)N(C)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138525425	186017995	/nfs/dbraw/zinc/01/79/95/186017995.db2.gz	KDUQJSCWNCPCQD-UHFFFAOYSA-N	0	3	320.405	2.493	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2cccs2)N([C@@H](C)CN2CCCC2)C1=O	ZINC000145831997	186037627	/nfs/dbraw/zinc/03/76/27/186037627.db2.gz	JVPVZVQXGSPPST-KCQAQPDRSA-N	0	3	307.463	2.441	10	0		DEAEHN
C[C@H](CN1CCCC1)N1C(=O)C2(CC2)N[C@H]1c1ccsc1	ZINC000145809260	186038021	/nfs/dbraw/zinc/03/80/21/186038021.db2.gz	BHZZVKOXTQAGCT-TZMCWYRMSA-N	0	3	305.447	2.195	10	0		DEAEHN
N[C@H](Cc1cn2ccsc2n1)[C@H]1COc2ccccc2O1	ZINC000149185982	186048606	/nfs/dbraw/zinc/04/86/06/186048606.db2.gz	ZNYSWBQISIMJOM-BXUZGUMPSA-N	0	3	301.371	2.106	10	0		DEAEHN
C[C@@H](c1cccc(Cl)c1)N(C)c1nc(N)nc(N(C)C)n1	ZINC000149601011	186051532	/nfs/dbraw/zinc/05/15/32/186051532.db2.gz	DOWVYPRXUBPKLO-VIFPVBQESA-N	0	3	306.801	2.371	10	0		DEAEHN
CN[C@@H](C[C@@H]1CN(C)CCN1C)c1cc(Cl)ccc1OC	ZINC000149594869	186051955	/nfs/dbraw/zinc/05/19/55/186051955.db2.gz	YFIUIWAFSIIQHH-HIFRSBDPSA-N	0	3	311.857	2.245	10	0		DEAEHN
CCN[C@@H](c1cnc2ccccc2c1)[C@@H]1CCS(=O)(=O)C1	ZINC000150100205	186054417	/nfs/dbraw/zinc/05/44/17/186054417.db2.gz	JNBCBNDLQRAHTI-CZUORRHYSA-N	0	3	304.415	2.320	10	0		DEAEHN
CN(Cc1ccsc1)C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C	ZINC000253269638	539785039	/nfs/dbraw/zinc/78/50/39/539785039.db2.gz	ZSIHJDINZZTBLY-XJKCOSOUSA-N	0	3	308.447	2.239	10	0		DEAEHN
CC(C)NC(=O)CN1CCN(C[C@H](C)Cc2ccccc2)CC1	ZINC000182028649	199376230	/nfs/dbraw/zinc/37/62/30/199376230.db2.gz	OQEJFSGAMDNLJB-QGZVFWFLSA-N	0	3	317.477	2.007	10	0		DEAEHN
CC(C)(C)c1nc2ccc(NC(=O)[C@@H]3C[C@@H](O)CN3)cc2s1	ZINC000155659960	186100775	/nfs/dbraw/zinc/10/07/75/186100775.db2.gz	HVXFZFWBLBVGQK-PWSUYJOCSA-N	0	3	319.430	2.255	10	0		DEAEHN
COc1cccc(C(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)c1[O-]	ZINC000155669194	186100913	/nfs/dbraw/zinc/10/09/13/186100913.db2.gz	YIIISOISNALLIN-ZDUSSCGKSA-N	0	3	306.406	2.109	10	0		DEAEHN
COc1cccc(C(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)c1[O-]	ZINC000155669194	186100914	/nfs/dbraw/zinc/10/09/14/186100914.db2.gz	YIIISOISNALLIN-ZDUSSCGKSA-N	0	3	306.406	2.109	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2cc(C)ccc2Br)C1	ZINC000163970683	186144290	/nfs/dbraw/zinc/14/42/90/186144290.db2.gz	KRJXDMHAABPPSA-BXKDBHETSA-N	0	3	313.195	2.073	10	0		DEAEHN
COCC[C@@H](N)C(=O)Nc1cc(C)ccc1Br	ZINC000163985680	186144634	/nfs/dbraw/zinc/14/46/34/186144634.db2.gz	QUPCCXAPNSOBNI-SNVBAGLBSA-N	0	3	301.184	2.060	10	0		DEAEHN
Cc1ccc([C@H](CN)N2CCN(C)CC2)c(Br)c1	ZINC000164055396	186147195	/nfs/dbraw/zinc/14/71/95/186147195.db2.gz	RHQLLNGBTBEJPD-AWEZNQCLSA-N	0	3	312.255	2.005	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1ccc(Br)cc1	ZINC000159569917	186127841	/nfs/dbraw/zinc/12/78/41/186127841.db2.gz	WCSMOBVQXGMJBL-LLVKDONJSA-N	0	3	301.184	2.142	10	0		DEAEHN
CSc1cc2c(cc1CNC[C@@H](C)[S@](C)=O)OCCO2	ZINC000159651278	186133061	/nfs/dbraw/zinc/13/30/61/186133061.db2.gz	QNRHMCURVQSFLG-CFMSYZGJSA-N	0	3	315.460	2.036	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(-n3cccc3)c(F)c2)C1	ZINC000171508373	186170532	/nfs/dbraw/zinc/17/05/32/186170532.db2.gz	FLTSYFQPDPSPDQ-CQSZACIVSA-N	0	3	301.365	2.393	10	0		DEAEHN
CC(C(=O)N(C)Cc1cccc(Br)c1)=C1CNC1	ZINC000164316024	186155993	/nfs/dbraw/zinc/15/59/93/186155993.db2.gz	RPWXGDARBONQOZ-UHFFFAOYSA-N	0	3	309.207	2.327	10	0		DEAEHN
Cn1c(CNC2CCCC2)nc2cc(S(C)(=O)=O)ccc21	ZINC000164377151	186158270	/nfs/dbraw/zinc/15/82/70/186158270.db2.gz	OGCHYUQYXQIDDN-UHFFFAOYSA-N	0	3	307.419	2.009	10	0		DEAEHN
COC[C@@H](C)C(=O)Nc1ccc(N2CCCN(C)CC2)cc1	ZINC000171453341	186162159	/nfs/dbraw/zinc/16/21/59/186162159.db2.gz	OVKMSCHUSNLSME-CQSZACIVSA-N	0	3	305.422	2.050	10	0		DEAEHN
O=C(Cc1ccccc1Br)N1CCN2CCC[C@H]2C1	ZINC000171471155	186165420	/nfs/dbraw/zinc/16/54/20/186165420.db2.gz	VWCMQUNCHPTCIU-ZDUSSCGKSA-N	0	3	323.234	2.298	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)Nc2nnc(C(F)F)s2)CCN1C	ZINC000175647411	186184924	/nfs/dbraw/zinc/18/49/24/186184924.db2.gz	ZPLMLOVFXCYJGJ-YUMQZZPRSA-N	0	3	319.381	2.422	10	0		DEAEHN
Cc1ccc(CNC(=O)CN(C)[C@]2(CO)CC[C@H](C)C2)cc1F	ZINC000188012175	186243297	/nfs/dbraw/zinc/24/32/97/186243297.db2.gz	NHHANRDWSKQPMP-SCLBCKFNSA-N	0	3	322.424	2.233	10	0		DEAEHN
Cc1cc(NC(=O)N2CCN3CCC[C@H]3C2)ccc1N(C)C	ZINC000171889145	198001865	/nfs/dbraw/zinc/00/18/65/198001865.db2.gz	WBBQITHNCKJMAE-HNNXBMFYSA-N	0	3	302.422	2.373	10	0		DEAEHN
CC(=O)Nc1cc(NC(=O)N2CCN3CCC[C@@H]3C2)ccc1C	ZINC000171889938	198002268	/nfs/dbraw/zinc/00/22/68/198002268.db2.gz	WKKKVHOKLJMIKB-OAHLLOKOSA-N	0	3	316.405	2.265	10	0		DEAEHN
O=C(Nc1ccc(-c2ncon2)cc1)N1CCN2CCC[C@@H]2C1	ZINC000171892886	198002918	/nfs/dbraw/zinc/00/29/18/198002918.db2.gz	VXHBNTGGFUMUTC-CQSZACIVSA-N	0	3	313.361	2.049	10	0		DEAEHN
CC[C@@H](NC(=O)N1CCN2CCC[C@@H]2C1)c1nc(C)cs1	ZINC000171907510	198006049	/nfs/dbraw/zinc/00/60/49/198006049.db2.gz	WFJJNDOUPUTPRQ-CHWSQXEVSA-N	0	3	308.451	2.392	10	0		DEAEHN
Cc1ccc(NC(=O)N[C@H]2CCCOC2)c(OCCN(C)C)c1	ZINC000172502054	198107114	/nfs/dbraw/zinc/10/71/14/198107114.db2.gz	PTRZUUKHJNDAMD-AWEZNQCLSA-N	0	3	321.421	2.236	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(-n3ccnc3)cc2)CCN1C	ZINC000172620616	198126642	/nfs/dbraw/zinc/12/66/42/198126642.db2.gz	MJJDQNWHASYQOS-PBHICJAKSA-N	0	3	312.417	2.427	10	0		DEAEHN
Cc1cc(NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)ccc1C(N)=O	ZINC000173081203	198183832	/nfs/dbraw/zinc/18/38/32/198183832.db2.gz	XEXVHGQLWOIKRL-OCCSQVGLSA-N	0	3	318.421	2.040	10	0		DEAEHN
CCn1nc(C)c(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1Cl	ZINC000173216802	198196891	/nfs/dbraw/zinc/19/68/91/198196891.db2.gz	CESPHMKLKXSGNY-ZYHUDNBSSA-N	0	3	312.845	2.420	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)Cc2cccc(C)c2)[C@H](C)C1	ZINC000173260909	198202309	/nfs/dbraw/zinc/20/23/09/198202309.db2.gz	WZGUDSYOWCOXNL-WBVHZDCISA-N	0	3	324.490	2.487	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)Cc2cccc(C)c2)[C@H](C)C1	ZINC000173260928	198202908	/nfs/dbraw/zinc/20/29/08/198202908.db2.gz	WZGUDSYOWCOXNL-NVXWUHKLSA-N	0	3	324.490	2.487	10	0		DEAEHN
C[C@H](CNC(=O)N1CCN2CCC[C@@H]2C1)Oc1ccccc1F	ZINC000173511031	198222840	/nfs/dbraw/zinc/22/28/40/198222840.db2.gz	RMMJKWWWSLUMEF-ZIAGYGMSSA-N	0	3	321.396	2.083	10	0		DEAEHN
COc1cccc(CCNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000173748140	198247773	/nfs/dbraw/zinc/24/77/73/198247773.db2.gz	PLUVRKNMAAFLKM-ZBFHGGJFSA-N	0	3	319.449	2.362	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCc2ccc3c(c2)OCO3)CCN1C	ZINC000173891995	198265236	/nfs/dbraw/zinc/26/52/36/198265236.db2.gz	WQXTWUVMHUCORK-OCCSQVGLSA-N	0	3	319.405	2.039	10	0		DEAEHN
C[C@@H](Cc1cccs1)NC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000173899395	198266133	/nfs/dbraw/zinc/26/61/33/198266133.db2.gz	KOAJDLLGRDEKEN-KBPBESRZSA-N	0	3	305.447	2.335	10	0		DEAEHN
CCc1c(Cl)nc(C)nc1NC[C@@H](O)CN1CCCCC1	ZINC000174684296	198370169	/nfs/dbraw/zinc/37/01/69/198370169.db2.gz	ULUBCIUIPYVUSL-GFCCVEGCSA-N	0	3	312.845	2.260	10	0		DEAEHN
CO[C@@H](CNC(=O)c1ccccc1OCCN(C)C)C(C)(C)C	ZINC000073211139	191293009	/nfs/dbraw/zinc/29/30/09/191293009.db2.gz	BRZHNVDMAZTWJF-INIZCTEOSA-N	0	3	322.449	2.418	10	0		DEAEHN
Fc1ccc2c(c1)[C@@H](N[C@@H]1CCc3ncnn3C1)CCCO2	ZINC000180599527	283003429	/nfs/dbraw/zinc/00/34/29/283003429.db2.gz	AEJVPTIWHMSVNC-OCCSQVGLSA-N	0	3	302.353	2.236	10	0		DEAEHN
Cn1cc(CN[C@H]2CC(=O)N(C)C2)c(-c2ccccc2Cl)n1	ZINC000066905815	354738813	/nfs/dbraw/zinc/73/88/13/354738813.db2.gz	VDOCQIXCCGZJJJ-LBPRGKRZSA-N	0	3	318.808	2.061	10	0		DEAEHN
c1[nH]nc(-c2ccc3c(c2)OCCO3)c1CNC[C@@H]1CCCO1	ZINC000069645369	354872128	/nfs/dbraw/zinc/87/21/28/354872128.db2.gz	JAJXVLRYGRLEMC-AWEZNQCLSA-N	0	3	315.373	2.117	10	0		DEAEHN
Cc1nnc([C@H](C)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)o1	ZINC000069016745	354844343	/nfs/dbraw/zinc/84/43/43/354844343.db2.gz	HFPSEYRFWDXUQG-MJBXVCDLSA-N	0	3	322.453	2.260	10	0		DEAEHN
CCN1C[C@@H](C)[C@H](NCc2ncc(Br)s2)C1	ZINC000390481852	540133685	/nfs/dbraw/zinc/13/36/85/540133685.db2.gz	NDZZKMZJKKEINN-RKDXNWHRSA-N	0	3	304.257	2.335	10	0		DEAEHN
NC[C@H](NC(=O)c1ccc(C(F)(F)F)cc1)C(F)(F)F	ZINC000401722275	540142284	/nfs/dbraw/zinc/14/22/84/540142284.db2.gz	OEWQBLUROHAHHV-QMMMGPOBSA-N	0	3	300.202	2.325	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)NCc1cccc(C)n1	ZINC000113406584	355758821	/nfs/dbraw/zinc/75/88/21/355758821.db2.gz	UAAANKLCHOGEPZ-INIZCTEOSA-N	0	3	304.438	2.454	10	0		DEAEHN
COCCN1CCC(NC(=O)N[C@@H](C)c2ccc(C)o2)CC1	ZINC000140231627	355883922	/nfs/dbraw/zinc/88/39/22/355883922.db2.gz	ZERPQEVPFUPYTK-ZDUSSCGKSA-N	0	3	309.410	2.059	10	0		DEAEHN
CCCc1cc(C(=O)N[C@H](Cc2ccccc2)CN(C)C)[nH]n1	ZINC000155329236	355947811	/nfs/dbraw/zinc/94/78/11/355947811.db2.gz	QWUKERJRNRBKFR-MRXNPFEDSA-N	0	3	314.433	2.265	10	0		DEAEHN
CN(C)C[C@@](C)(O)CNC(=O)CC1CCC(C(F)(F)F)CC1	ZINC000180751326	356058756	/nfs/dbraw/zinc/05/87/56/356058756.db2.gz	XFLYGFGSSLNTIG-YIZWMMSDSA-N	0	3	324.387	2.174	10	0		DEAEHN
C[C@H](CNC(=O)NCCN1CCCC[C@@H]1C)c1nccs1	ZINC000183045543	356157718	/nfs/dbraw/zinc/15/77/18/356157718.db2.gz	YBYDPRALCCUUPY-OLZOCXBDSA-N	0	3	310.467	2.420	10	0		DEAEHN
C[C@@H](C(=O)NC1CCCCC1)N(CC(N)=S)C1CCCC1	ZINC000080222902	192013972	/nfs/dbraw/zinc/01/39/72/192013972.db2.gz	GBHTZKSABUYBRK-LBPRGKRZSA-N	0	3	311.495	2.355	10	0		DEAEHN
CCOC(=O)C(C(=O)OCC)[C@H](c1ccc(C)cc1)N(C)C	ZINC000199147054	356266096	/nfs/dbraw/zinc/26/60/96/356266096.db2.gz	VYKKMRGMOLNTJO-HNNXBMFYSA-N	0	3	307.390	2.340	10	0		DEAEHN
CC[C@@](C)(CO)NCC(=O)Nc1cccc(Br)c1	ZINC000080897502	192199759	/nfs/dbraw/zinc/19/97/59/192199759.db2.gz	SYDPSWJTCXJEMO-ZDUSSCGKSA-N	0	3	315.211	2.138	10	0		DEAEHN
C[C@@H]1CCC[C@](N)(C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1	ZINC000080917103	192201318	/nfs/dbraw/zinc/20/13/18/192201318.db2.gz	DPMSSIPEDPRGQN-RFAUZJTJSA-N	0	3	309.797	2.285	10	0		DEAEHN
COc1ccc([C@H]2OCC[C@@H]2[NH2+]Cc2nc(C)ccc2[O-])cn1	ZINC000284415200	356369582	/nfs/dbraw/zinc/36/95/82/356369582.db2.gz	DJRNQDPPZHDNNP-SUMWQHHRSA-N	0	3	315.373	2.119	10	0		DEAEHN
C[C@@H]1CC[C@](N)(c2ncc(I)cn2)C1	ZINC000306647135	356404480	/nfs/dbraw/zinc/40/44/80/356404480.db2.gz	PFBKFJTXSFDKFT-GMSGAONNSA-N	0	3	303.147	2.055	10	0		DEAEHN
C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)C1CCN(C)CC1	ZINC000081329978	192251264	/nfs/dbraw/zinc/25/12/64/192251264.db2.gz	KYGIWCHVVZYMBM-PBHICJAKSA-N	0	3	302.418	2.317	10	0		DEAEHN
CNC(=O)[C@H](C)CN(C)Cc1cc(Cl)cc2c1OCOC2	ZINC000081527290	192282621	/nfs/dbraw/zinc/28/26/21/192282621.db2.gz	SHFQMUHMEVOJQK-SNVBAGLBSA-N	0	3	312.797	2.020	10	0		DEAEHN
C[C@H]1C[C@@H](c2nc(CC(=O)NC3CCCCC3)no2)CCN1C	ZINC000350499437	356531854	/nfs/dbraw/zinc/53/18/54/356531854.db2.gz	FNFLHDLETCZYRF-STQMWFEESA-N	0	3	320.437	2.259	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)Nc1nc(Cc2ccccc2)ns1	ZINC000236933996	202078836	/nfs/dbraw/zinc/07/88/36/202078836.db2.gz	HRQHXTRBXSEJID-GWCFXTLKSA-N	0	3	304.419	2.441	10	0		DEAEHN
COC(=O)c1cnc(NC[C@H](C)N(C)Cc2ccccc2)cn1	ZINC000390675743	356710006	/nfs/dbraw/zinc/71/00/06/356710006.db2.gz	XLOCMPLDGPGTGK-ZDUSSCGKSA-N	0	3	314.389	2.196	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N(CC)C2CC2)ccc1F	ZINC000088941054	192663289	/nfs/dbraw/zinc/66/32/89/192663289.db2.gz	KWVRNPUMVOPTLF-UHFFFAOYSA-N	0	3	300.399	2.108	10	0		DEAEHN
COCCC[C@H](C)[NH2+][C@@H](CC(C)C)c1nc(-c2nc[n-]n2)no1	ZINC000179809919	199083216	/nfs/dbraw/zinc/08/32/16/199083216.db2.gz	AIIOABZRUHLABR-RYUDHWBXSA-N	0	3	322.413	2.347	10	0		DEAEHN
COCCC[C@H](C)N[C@@H](CC(C)C)c1nc(-c2nc[nH]n2)no1	ZINC000179809919	199083218	/nfs/dbraw/zinc/08/32/18/199083218.db2.gz	AIIOABZRUHLABR-RYUDHWBXSA-N	0	3	322.413	2.347	10	0		DEAEHN
CCC[C@H](CN1CC[C@H](NS(C)(=O)=O)C1)c1ccccc1	ZINC000180334607	199147327	/nfs/dbraw/zinc/14/73/27/199147327.db2.gz	BNXJOHQOLBWNPG-CVEARBPZSA-N	0	3	310.463	2.194	10	0		DEAEHN
CNc1cc(N2CCC[C@@H]2CN[C@H](C)c2ccco2)ncn1	ZINC000180574804	199178557	/nfs/dbraw/zinc/17/85/57/199178557.db2.gz	GDSMTAPEGZDSIR-CHWSQXEVSA-N	0	3	301.394	2.431	10	0		DEAEHN
NC(=O)c1ccc(CN(C[C@H]2CCCO2)[C@H]2CCSC2)cc1	ZINC000245987620	283375564	/nfs/dbraw/zinc/37/55/64/283375564.db2.gz	WIDXNGBZRRDRKQ-JKSUJKDBSA-N	0	3	320.458	2.272	10	0		DEAEHN
Cc1ccc([C@H](CNC(=O)N(C)CC2(CO)CC2)N(C)C)cc1	ZINC000187046767	200052911	/nfs/dbraw/zinc/05/29/11/200052911.db2.gz	MNMMCOLBAFVIQV-INIZCTEOSA-N	0	3	319.449	2.012	10	0		DEAEHN
CSCc1cccc(CNC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000187410736	200109241	/nfs/dbraw/zinc/10/92/41/200109241.db2.gz	QNQXODZNVDDGPS-OAHLLOKOSA-N	0	3	307.463	2.395	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000187889571	200172035	/nfs/dbraw/zinc/17/20/35/200172035.db2.gz	GAOGQMYHCVZMEZ-SWLSCSKDSA-N	0	3	323.412	2.458	10	0		DEAEHN
COc1ccc(F)c(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1OC	ZINC000188568578	200267397	/nfs/dbraw/zinc/26/73/97/200267397.db2.gz	FEHOPYPHGAYUEM-YPMHNXCESA-N	0	3	324.396	2.301	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1cncc(Cl)n1)c1ccccc1	ZINC000188897048	200318982	/nfs/dbraw/zinc/31/89/82/200318982.db2.gz	DOULZKLRTDXKFQ-ZDUSSCGKSA-N	0	3	304.781	2.163	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000189182730	200361457	/nfs/dbraw/zinc/36/14/57/200361457.db2.gz	IPWJXESBALYKKL-XIRDDKMYSA-N	0	3	304.434	2.091	10	0		DEAEHN
CC(=O)c1cccc(C(=O)NCCCNCc2cccnc2)c1	ZINC000516937739	283530736	/nfs/dbraw/zinc/53/07/36/283530736.db2.gz	CTWAXJBQKKDIFE-UHFFFAOYSA-N	0	3	311.385	2.194	10	0		DEAEHN
CSCC[C@@H](C)N(C)C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000602455396	360380669	/nfs/dbraw/zinc/38/06/69/360380669.db2.gz	RXZYOLMGTTUNNB-GDBMZVCRSA-N	0	3	323.506	2.046	10	0		DEAEHN
CN(C[C@@H]1CCCN(C)C1)C(=O)Nc1ccc2nccn2c1	ZINC000608313838	361196652	/nfs/dbraw/zinc/19/66/52/361196652.db2.gz	OJTFLHIPVAKMFM-CYBMUJFWSA-N	0	3	301.394	2.140	10	0		DEAEHN
COC(=O)[C@H]1CCCN(CCOCc2ccc(OC)cc2)C1	ZINC000609388519	361308336	/nfs/dbraw/zinc/30/83/36/361308336.db2.gz	SRHXHBDCKLPUAC-HNNXBMFYSA-N	0	3	307.390	2.097	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000193707104	201108227	/nfs/dbraw/zinc/10/82/27/201108227.db2.gz	YLDYNTCSGPOCDP-DZGCQCFKSA-N	0	3	305.422	2.107	10	0		DEAEHN
Cc1nc(C)c(CNCCCn2cc(Br)cn2)o1	ZINC000628282126	366793151	/nfs/dbraw/zinc/79/31/51/366793151.db2.gz	QANUFMZWPOGZFB-UHFFFAOYSA-N	0	3	313.199	2.430	10	0		DEAEHN
COC(=O)C(C)(C)[C@@H](NC[C@H](O)COC(C)C)c1ccccc1	ZINC000611406869	361593383	/nfs/dbraw/zinc/59/33/83/361593383.db2.gz	ZCRNODXUMDRGQQ-HOTGVXAUSA-N	0	3	323.433	2.302	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(CC(=O)OC(C)(C)C)C1	ZINC000195301669	201375424	/nfs/dbraw/zinc/37/54/24/201375424.db2.gz	QHCMMHREUXCROP-INIZCTEOSA-N	0	3	319.449	2.177	10	0		DEAEHN
COc1ccc(-n2cc(CN3CC[C@@H](CO)[C@@H]3C)cn2)cc1	ZINC000449290823	240317435	/nfs/dbraw/zinc/31/74/35/240317435.db2.gz	YYGOMCILQWNXEO-ZFWWWQNUSA-N	0	3	301.390	2.084	10	0		DEAEHN
CC[C@](C)([C@@H](NC)c1cc(Cl)cnc1N)N1CCOCC1	ZINC000091612316	193079874	/nfs/dbraw/zinc/07/98/74/193079874.db2.gz	PYGMOOMRUARWFY-DZGCQCFKSA-N	0	3	312.845	2.079	10	0		DEAEHN
CC(C)C[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)cc1F	ZINC000092115803	193162985	/nfs/dbraw/zinc/16/29/85/193162985.db2.gz	UCORILBCJZGPSA-UHFFFAOYSA-N	0	3	302.415	2.258	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)c(F)c1	ZINC000092115491	193163570	/nfs/dbraw/zinc/16/35/70/193163570.db2.gz	PGGAUDAOKNPCDO-LBPRGKRZSA-N	0	3	314.426	2.356	10	0		DEAEHN
C[C@@H]1CC[C@H](C)CN1S(=O)(=O)c1ccc(CN)cc1F	ZINC000092116282	193163787	/nfs/dbraw/zinc/16/37/87/193163787.db2.gz	NKEBNOBKMIXTIR-WDEREUQCSA-N	0	3	300.399	2.094	10	0		DEAEHN
C[C@H](N[C@@H]1CCO[C@@H]1C1CC1)C(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C	ZINC000332993195	299392769	/nfs/dbraw/zinc/39/27/69/299392769.db2.gz	DDGKPDUSLJKLJF-WDFXUMBOSA-N	0	3	308.466	2.473	10	0		DEAEHN
COC(=O)[C@@H](C)Oc1ccc(CN2CCC([C@@H](C)O)CC2)cc1	ZINC000092970852	193190655	/nfs/dbraw/zinc/19/06/55/193190655.db2.gz	HBEGWPGRHCNLIW-ZIAGYGMSSA-N	0	3	321.417	2.220	10	0		DEAEHN
COCCCN(CCOC)[C@@H](CN)c1cc(Cl)cs1	ZINC000093095570	193203502	/nfs/dbraw/zinc/20/35/02/193203502.db2.gz	SAEKNCCTKUSJOL-LBPRGKRZSA-N	0	3	306.859	2.386	10	0		DEAEHN
COc1ccc(CN2C[C@H]3CCC[C@@H](C2)C3O)c(OC)c1OC	ZINC000093479701	193256760	/nfs/dbraw/zinc/25/67/60/193256760.db2.gz	ANHMKKMLSQVXTB-OCZCAGDBSA-N	0	3	321.417	2.305	10	0		DEAEHN
CC(C)CO[C@H]1C[C@@H](NCC(C)(C)S(C)(=O)=O)C1(C)C	ZINC000093523115	193262879	/nfs/dbraw/zinc/26/28/79/193262879.db2.gz	YBFZRASWHNNPRH-OLZOCXBDSA-N	0	3	305.484	2.239	10	0		DEAEHN
CCN[C@@H](c1ccc(Cl)c(OC)c1)[C@@H]1CN(C)CCN1C	ZINC000094009137	193338150	/nfs/dbraw/zinc/33/81/50/193338150.db2.gz	MYTSIOIJHPGMTE-HOCLYGCPSA-N	0	3	311.857	2.245	10	0		DEAEHN
CCOC(=O)[C@@]1(N)CC[C@@H](N2CCC(C(F)(F)F)CC2)C1	ZINC000093831935	193314600	/nfs/dbraw/zinc/31/46/00/193314600.db2.gz	FATSYPAJORRTNC-DGCLKSJQSA-N	0	3	308.344	2.074	10	0		DEAEHN
CN[C@]1(C(N)=O)CC[C@H](Sc2ccc(C(F)(F)F)cn2)C1	ZINC000093850373	193317732	/nfs/dbraw/zinc/31/77/32/193317732.db2.gz	LTPDUIHTWUPMQZ-JOYOIKCWSA-N	0	3	319.352	2.189	10	0		DEAEHN
N=C(N)c1ccc(C(F)(F)F)nc1OC[C@H]1CCCCO1	ZINC000094336832	193361179	/nfs/dbraw/zinc/36/11/79/193361179.db2.gz	LMMYOJDRVORVJU-MRVPVSSYSA-N	0	3	303.284	2.332	10	0		DEAEHN
CNCc1cc(F)c(O[C@@H](C)C(=O)NC(C)(C)C)c(F)c1	ZINC000094346417	193363507	/nfs/dbraw/zinc/36/35/07/193363507.db2.gz	DAHXTIGHWNBDNL-VIFPVBQESA-N	0	3	300.349	2.366	10	0		DEAEHN
CCS(=O)(=O)CCC[C@H](NC(C)C)c1ccc(F)cn1	ZINC000094047510	193341764	/nfs/dbraw/zinc/34/17/64/193341764.db2.gz	XQMRUKXKQOLQMZ-AWEZNQCLSA-N	0	3	302.415	2.475	10	0		DEAEHN
CC[NH2+][C@@H](C)CC(=O)Nc1cc(Br)ccc1[O-]	ZINC000094573762	193381827	/nfs/dbraw/zinc/38/18/27/193381827.db2.gz	MDIXTLCGXFLNSQ-QMMMGPOBSA-N	0	3	301.184	2.481	10	0		DEAEHN
CCN1CCC(Nc2nc3c(Br)cccn3n2)CC1	ZINC000094603767	193383885	/nfs/dbraw/zinc/38/38/85/193383885.db2.gz	DULIHLKBHHHALH-UHFFFAOYSA-N	0	3	324.226	2.388	10	0		DEAEHN
CCN1CCC[C@@H]1CNc1nc2c(Br)cccn2n1	ZINC000094602689	193384043	/nfs/dbraw/zinc/38/40/43/193384043.db2.gz	XEWQFHGZCPZHNX-SNVBAGLBSA-N	0	3	324.226	2.388	10	0		DEAEHN
CCN1C[C@H](N[C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1=O	ZINC000453356506	245092209	/nfs/dbraw/zinc/09/22/09/245092209.db2.gz	LSKHBCLLHNYORB-UAGQMJEPSA-N	0	3	302.418	2.365	10	0		DEAEHN
CNC(=O)CCCOc1c(C)cc(Br)cc1CN	ZINC000160673598	197430278	/nfs/dbraw/zinc/43/02/78/197430278.db2.gz	NOOAADIGIJUYKP-UHFFFAOYSA-N	0	3	315.211	2.121	10	0		DEAEHN
COc1ccc([N-]S(=O)(=O)c2cc(C[NH3+])ccc2C)cc1	ZINC000020189569	182195688	/nfs/dbraw/zinc/19/56/88/182195688.db2.gz	XKTYEWTYBCDNAJ-UHFFFAOYSA-N	0	3	306.387	2.263	10	0		DEAEHN
Cc1cccc(CNS(=O)(=O)c2ccc(F)c(CN)c2)c1	ZINC000020189125	182195740	/nfs/dbraw/zinc/19/57/40/182195740.db2.gz	PAPCRWZQIUKAOY-UHFFFAOYSA-N	0	3	308.378	2.071	10	0		DEAEHN
COCCNCCN(C)c1ncc(Cl)cc1Br	ZINC000160048388	197381946	/nfs/dbraw/zinc/38/19/46/197381946.db2.gz	YASTZJHCOBWKHX-UHFFFAOYSA-N	0	3	322.634	2.170	10	0		DEAEHN
CCN(CC)CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2	ZINC000077330623	284571244	/nfs/dbraw/zinc/57/12/44/284571244.db2.gz	OQNFAAWKLYSWAG-CQSZACIVSA-N	0	3	304.390	2.421	10	0		DEAEHN
C[C@@H](CNCc1ccc(F)c(Br)c1)[S@](C)=O	ZINC000159809377	197366591	/nfs/dbraw/zinc/36/65/91/197366591.db2.gz	MXCUFABDGUYPCP-ZKANADHPSA-N	0	3	308.216	2.445	10	0		DEAEHN
COc1ccc([C@@H](C)NCc2nc[nH]n2)cc1Br	ZINC000037919762	182937132	/nfs/dbraw/zinc/93/71/32/182937132.db2.gz	SKOZHBWTSHLGIN-MRVPVSSYSA-N	0	3	311.183	2.427	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2ccc(Cl)c3ncccc23)C1	ZINC000040633634	183111834	/nfs/dbraw/zinc/11/18/34/183111834.db2.gz	CLFBUXYQEIRTAH-NOZJJQNGSA-N	0	3	305.765	2.204	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2ccccc2SC(F)F)C1	ZINC000040630045	183110775	/nfs/dbraw/zinc/11/07/75/183110775.db2.gz	LJDFRKVEAYARSX-SCZZXKLOSA-N	0	3	302.346	2.317	10	0		DEAEHN
CC(C)N(CCCO)c1nc2sccn2c1CNC1CC1	ZINC000042511553	183278658	/nfs/dbraw/zinc/27/86/58/183278658.db2.gz	IEWIVRNYGCLYLB-UHFFFAOYSA-N	0	3	308.451	2.245	10	0		DEAEHN
C[C@H]1CCCC[C@H]1N(C)S(=O)(=O)Cc1ccccc1CN	ZINC000042609411	183290601	/nfs/dbraw/zinc/29/06/01/183290601.db2.gz	RXQDASQPQYSKKO-XJKSGUPXSA-N	0	3	310.463	2.486	10	0		DEAEHN
CC[C@H](N)[C@H](c1sccc1C)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043248010	183346696	/nfs/dbraw/zinc/34/66/96/183346696.db2.gz	CKTDYXVTKLAENH-BFHYXJOUSA-N	0	3	309.479	2.388	10	0		DEAEHN
CN[C@H](c1ccccc1OC(F)(F)F)[C@H]1CCS(=O)(=O)C1	ZINC000043300634	183352404	/nfs/dbraw/zinc/35/24/04/183352404.db2.gz	BNFHYUBZMDNYNK-CABZTGNLSA-N	0	3	323.336	2.280	10	0		DEAEHN
CCC(C)(C)NC(=O)[C@@H](C)N(CCC(N)=S)CC(C)C	ZINC000043418472	183360646	/nfs/dbraw/zinc/36/06/46/183360646.db2.gz	NVOIFZSLOHSBQK-GFCCVEGCSA-N	0	3	301.500	2.314	10	0		DEAEHN
CCCNCC(=O)Nc1ccccc1I	ZINC000044288122	183403066	/nfs/dbraw/zinc/40/30/66/183403066.db2.gz	CNKISXRDGLGRHA-UHFFFAOYSA-N	0	3	318.158	2.229	10	0		DEAEHN
CCN(CC)[C@@H](C(=O)NC[C@@H]1CCCN1C)c1ccccc1	ZINC000104867319	194048837	/nfs/dbraw/zinc/04/88/37/194048837.db2.gz	FPRDFZKZIQPRDT-DLBZAZTESA-N	0	3	303.450	2.280	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCCc2nc(C(C)(C)C)cs2)C1	ZINC000105295535	194093866	/nfs/dbraw/zinc/09/38/66/194093866.db2.gz	QIMCYUJOLZDCRA-LBPRGKRZSA-N	0	3	324.494	2.329	10	0		DEAEHN
O=c1[nH]c(CCN2CCC(c3ncc[nH]3)CC2)nc2ccccc21	ZINC000533026115	284748659	/nfs/dbraw/zinc/74/86/59/284748659.db2.gz	VVUUWDFTWISBPQ-UHFFFAOYSA-N	0	3	323.400	2.481	10	0		DEAEHN
c1ccc(OCCCN2CCCN(c3cccnn3)CC2)cc1	ZINC000105798825	194130625	/nfs/dbraw/zinc/13/06/25/194130625.db2.gz	FUPXFBRPUONXRS-UHFFFAOYSA-N	0	3	312.417	2.458	10	0		DEAEHN
CCN(C(=O)[C@H](C)NCCn1cc(C)cn1)c1ccccc1	ZINC000105881370	194155028	/nfs/dbraw/zinc/15/50/28/194155028.db2.gz	CPJQKQFFIBMNFB-HNNXBMFYSA-N	0	3	300.406	2.223	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)NCc2ccccc2Cl)c1	ZINC000105881471	194155571	/nfs/dbraw/zinc/15/55/71/194155571.db2.gz	XIURKQBZTMESJQ-ZDUSSCGKSA-N	0	3	320.824	2.139	10	0		DEAEHN
CC(C)(C)OC(=O)CCN1CCC(Nc2cccnn2)CC1	ZINC000105909931	194167290	/nfs/dbraw/zinc/16/72/90/194167290.db2.gz	CFRTXADIALKUAM-UHFFFAOYSA-N	0	3	306.410	2.085	10	0		DEAEHN
CCCCN(CCO)c1nc2sccn2c1CNCCC	ZINC000049013625	183701985	/nfs/dbraw/zinc/70/19/85/183701985.db2.gz	BWQGWOTXKSCMPF-UHFFFAOYSA-N	0	3	310.467	2.494	10	0		DEAEHN
CCOC(=O)[C@@H](CC)N1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000247216880	535458582	/nfs/dbraw/zinc/45/85/82/535458582.db2.gz	COXWBQQWQVGDEL-LSDHHAIUSA-N	0	3	305.422	2.466	10	0		DEAEHN
COc1cc(C[NH2+][C@@H]2CCCOC2)cc(Br)c1[O-]	ZINC000109543912	194273049	/nfs/dbraw/zinc/27/30/49/194273049.db2.gz	ZIJZKSMSLJVJBD-SNVBAGLBSA-N	0	3	316.195	2.432	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1cc(C)ccc1OC	ZINC000110085463	194308924	/nfs/dbraw/zinc/30/89/24/194308924.db2.gz	LTRANRWXKXTDRF-AWEZNQCLSA-N	0	3	321.421	2.236	10	0		DEAEHN
CCOc1ccccc1NC(=O)NC[C@@H]1CCCN1CCOC	ZINC000110085841	194309121	/nfs/dbraw/zinc/30/91/21/194309121.db2.gz	WQGOGNKUTPSNDT-AWEZNQCLSA-N	0	3	321.421	2.318	10	0		DEAEHN
CCNCc1cnc(N2CCN(c3nccs3)CC2)s1	ZINC000054901353	183953840	/nfs/dbraw/zinc/95/38/40/183953840.db2.gz	IEXNMLASJUAWOF-UHFFFAOYSA-N	0	3	309.464	2.036	10	0		DEAEHN
Cc1sc2[nH]c(CNCC3CCOCC3)nc(=O)c2c1C	ZINC000111162534	194397645	/nfs/dbraw/zinc/39/76/45/194397645.db2.gz	RZUQTFUNIQWDMN-UHFFFAOYSA-N	0	3	307.419	2.118	10	0		DEAEHN
CCCN(CC(F)(F)F)C(=O)[C@@]1(N)C[C@@H](OCC)C1(C)C	ZINC000156946276	197151580	/nfs/dbraw/zinc/15/15/80/197151580.db2.gz	LOMJMCXZOKAVRO-MFKMUULPSA-N	0	3	310.360	2.320	10	0		DEAEHN
CC(C)OCCCNC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000057202832	184029680	/nfs/dbraw/zinc/02/96/80/184029680.db2.gz	BYVUJAKNBATDQI-QGZVFWFLSA-N	0	3	321.465	2.274	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2nnc(C(F)F)s2)C1	ZINC000057292757	184032706	/nfs/dbraw/zinc/03/27/06/184032706.db2.gz	DECWBLZNPBOXQU-ZETCQYMHSA-N	0	3	305.354	2.082	10	0		DEAEHN
c1nc2ncnc(N[C@@H]3CCCN(Cc4ccccc4)C3)c2[nH]1	ZINC000059386710	184137704	/nfs/dbraw/zinc/13/77/04/184137704.db2.gz	ZZUWXRIKRNRVQO-CQSZACIVSA-N	0	3	308.389	2.429	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccc(C(N)=S)cc1)N(C)CC1CCC1	ZINC000061457996	184171192	/nfs/dbraw/zinc/17/11/92/184171192.db2.gz	RACZXQHBLGYBPR-NSHDSACASA-N	0	3	305.447	2.380	10	0		DEAEHN
NCc1ccccc1CNC(=O)c1ccc(Br)cn1	ZINC000061864111	184190521	/nfs/dbraw/zinc/19/05/21/184190521.db2.gz	HUPVOYHOZBJFSQ-UHFFFAOYSA-N	0	3	320.190	2.233	10	0		DEAEHN
C[C@H](CN1CCCC1)Nc1nc(Cl)nc(N2CCCC2)n1	ZINC000061539162	184173039	/nfs/dbraw/zinc/17/30/39/184173039.db2.gz	OFMIEEAPMUJLCD-LLVKDONJSA-N	0	3	310.833	2.021	10	0		DEAEHN
CC(C)[C@@H](CN(C)C)Nc1nc(Cl)nc(N2CCCC2)n1	ZINC000061539297	184173480	/nfs/dbraw/zinc/17/34/80/184173480.db2.gz	APRKESFXCMRWGN-LLVKDONJSA-N	0	3	312.849	2.123	10	0		DEAEHN
CCNc1ccc(Cl)c(C(=O)N2CCC[C@H]2CN(C)C)n1	ZINC000061656048	184181070	/nfs/dbraw/zinc/18/10/70/184181070.db2.gz	HUQOFZNDLYNLBA-NSHDSACASA-N	0	3	310.829	2.333	10	0		DEAEHN
CNc1nc(CN2CCC[C@@H]2CN(C)C)nc2sccc21	ZINC000061653195	184181100	/nfs/dbraw/zinc/18/11/00/184181100.db2.gz	GMPZEFKETRURET-LLVKDONJSA-N	0	3	305.451	2.259	10	0		DEAEHN
COc1ccc(Br)cc1[C@H](N)C[C@H](C)CC(N)=O	ZINC000061830213	184188949	/nfs/dbraw/zinc/18/89/49/184188949.db2.gz	ZDUJJEUIJNGLAD-GZMMTYOYSA-N	0	3	315.211	2.359	10	0		DEAEHN
NC[C@@H](c1ccc(Br)s1)N1CCCOCC1	ZINC000061914235	184195333	/nfs/dbraw/zinc/19/53/33/184195333.db2.gz	PJJNYEMBUFONCC-VIFPVBQESA-N	0	3	305.241	2.233	10	0		DEAEHN
COC(=O)[C@]1(Nc2ccc(Br)cc2)CCN(C)C1	ZINC000061991469	184199682	/nfs/dbraw/zinc/19/96/82/184199682.db2.gz	PJOWZJBUHVGBTC-ZDUSSCGKSA-N	0	3	313.195	2.108	10	0		DEAEHN
COc1ccc(CNCCN(C)C2CC2)cc1OC(F)F	ZINC000061992487	184200601	/nfs/dbraw/zinc/20/06/01/184200601.db2.gz	SABOTRRCUGVLIL-UHFFFAOYSA-N	0	3	300.349	2.480	10	0		DEAEHN
C[C@@H](c1ccccc1Cl)N(C)S(=O)(=O)[C@@H]1CCCNC1	ZINC000062027777	184201754	/nfs/dbraw/zinc/20/17/54/184201754.db2.gz	VAWGPPOZRWFEOB-NWDGAFQWSA-N	0	3	316.854	2.415	10	0		DEAEHN
CC(C)(C)N1C(=O)C[C@H](N)[C@H]1c1ccc(Br)o1	ZINC000062210195	184220679	/nfs/dbraw/zinc/22/06/79/184220679.db2.gz	NDBAJMCSMUVBKY-CPCISQLKSA-N	0	3	301.184	2.441	10	0		DEAEHN
CCOC(=O)COc1ccc(CNCCOC)cc1Cl	ZINC000062730532	184251282	/nfs/dbraw/zinc/25/12/82/184251282.db2.gz	LSUOSRXMYPIHLZ-UHFFFAOYSA-N	0	3	301.770	2.018	10	0		DEAEHN
CN(C)[C@@H]1CCN(CC(=O)c2ccc(Br)s2)C1	ZINC000062966550	184262961	/nfs/dbraw/zinc/26/29/61/184262961.db2.gz	SEODIBRYANTQQL-SECBINFHSA-N	0	3	317.252	2.329	10	0		DEAEHN
[NH3+][C@H]1CCC[C@H]1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000063174855	184276041	/nfs/dbraw/zinc/27/60/41/184276041.db2.gz	YFYQHLPXPVNWFL-WDEREUQCSA-N	0	3	309.218	2.152	10	0		DEAEHN
CCN(CC)CCNCc1cccc(OC)c1OCCOC	ZINC000066116660	184390846	/nfs/dbraw/zinc/39/08/46/184390846.db2.gz	IJNWFZBRIZDLEY-UHFFFAOYSA-N	0	3	310.438	2.152	10	0		DEAEHN
Cc1ccc(CNC[C@@H]2CN(C)CCO2)cc1Br	ZINC000119917097	195061309	/nfs/dbraw/zinc/06/13/09/195061309.db2.gz	YCHOIIOYMBMUSK-CYBMUJFWSA-N	0	3	313.239	2.178	10	0		DEAEHN
c1nc(N2CCCC2)ncc1CN1CCC[C@H]([C@@H]2CCOC2)C1	ZINC000539893985	285098965	/nfs/dbraw/zinc/09/89/65/285098965.db2.gz	FGHLSVQITHZTID-DLBZAZTESA-N	0	3	316.449	2.325	10	0		DEAEHN
CCc1ccc(NC(=O)NCCN(C)CCCOC)cc1F	ZINC000159167429	197332367	/nfs/dbraw/zinc/33/23/67/197332367.db2.gz	YUQMEFOWCBTJHI-UHFFFAOYSA-N	0	3	311.401	2.478	10	0		DEAEHN
CC(C)[C@@H]1CN[C@](C)(c2ccccc2)CN1CC[S@](C)=O	ZINC000159182065	197333710	/nfs/dbraw/zinc/33/37/10/197333710.db2.gz	HCVCOXZEQCMUAY-XGHQBKJUSA-N	0	3	308.491	2.210	10	0		DEAEHN
CCCC[C@@H](C)NS(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159105106	197327954	/nfs/dbraw/zinc/32/79/54/197327954.db2.gz	ANAYQCJARQQSQU-LLVKDONJSA-N	0	3	302.415	2.450	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N[C@@H]2CC2(C)C)cc(C)c1F	ZINC000159103673	197327633	/nfs/dbraw/zinc/32/76/33/197327633.db2.gz	WPRHTRNOJRTPCU-CYBMUJFWSA-N	0	3	314.426	2.320	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC(C)C)cc(CNC(C)C)c1F	ZINC000159080617	197325948	/nfs/dbraw/zinc/32/59/48/197325948.db2.gz	BOTDGJNQVAGDJI-UHFFFAOYSA-N	0	3	302.415	2.319	10	0		DEAEHN
CC(C)(C)NCc1cc(S(=O)(=O)NC2CC2)ccc1F	ZINC000159083988	197325460	/nfs/dbraw/zinc/32/54/60/197325460.db2.gz	YVEYGUZRYLOTAZ-UHFFFAOYSA-N	0	3	300.399	2.155	10	0		DEAEHN
COC[C@H](NC1CCN(c2cnccn2)CC1)c1ccccc1	ZINC000557274533	291863745	/nfs/dbraw/zinc/86/37/45/291863745.db2.gz	ONIQVJUEOAQOBL-KRWDZBQOSA-N	0	3	312.417	2.423	10	0		DEAEHN
CCn1nc(C)c(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1Cl	ZINC000158980133	197315883	/nfs/dbraw/zinc/31/58/83/197315883.db2.gz	NHEMSGFNLIVLQZ-JQWIXIFHSA-N	0	3	312.845	2.323	10	0		DEAEHN
COc1cccc(C[C@H](N)c2c(Br)cnn2C)c1	ZINC000158874112	197307973	/nfs/dbraw/zinc/30/79/73/197307973.db2.gz	LNYVOTDDASJQSC-LBPRGKRZSA-N	0	3	310.195	2.434	10	0		DEAEHN
C[C@H](N)c1cccc(S(=O)(=O)N2CCSC(C)(C)C2)c1	ZINC000158873402	197307319	/nfs/dbraw/zinc/30/73/19/197307319.db2.gz	VTUFXAUJBMEFQD-NSHDSACASA-N	0	3	314.476	2.222	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	ZINC000158910310	197310383	/nfs/dbraw/zinc/31/03/83/197310383.db2.gz	BJFIUPLYHRBZET-RXMQYKEDSA-N	0	3	312.238	2.075	10	0		DEAEHN
CCN[C@@H](CS(=O)(=O)c1ccc(C)cc1C)[C@@H]1CCOC1	ZINC000158736889	197298491	/nfs/dbraw/zinc/29/84/91/197298491.db2.gz	IBFZFGFDTIWIEZ-CABCVRRESA-N	0	3	311.447	2.092	10	0		DEAEHN
CCn1ncc(Br)c1[C@@H](O)[C@@](C)(CC)N(C)C	ZINC000157611861	197202184	/nfs/dbraw/zinc/20/21/84/197202184.db2.gz	UAYRGPLNNQTYCB-VXGBXAGGSA-N	0	3	304.232	2.429	10	0		DEAEHN
CC(C)CNCc1nnc(-n2ccc(C(F)(F)F)n2)s1	ZINC000157472304	197190214	/nfs/dbraw/zinc/19/02/14/197190214.db2.gz	DSESBIHRECKDPK-UHFFFAOYSA-N	0	3	305.329	2.488	10	0		DEAEHN
CCOC(=O)[C@@](C)(CCN(C)CCOC(C)C)NC(C)C	ZINC000157508813	197193357	/nfs/dbraw/zinc/19/33/57/197193357.db2.gz	LYXJRPVEWRAZIJ-MRXNPFEDSA-N	0	3	302.459	2.053	10	0		DEAEHN
CN[C@@H](C)c1cccc(S(=O)(=O)N(C)CCOC(C)C)c1	ZINC000157293033	197177062	/nfs/dbraw/zinc/17/70/62/197177062.db2.gz	BDNULORWRUEKIM-ZDUSSCGKSA-N	0	3	314.451	2.013	10	0		DEAEHN
CCCNc1nc(C)nc(NCC(C)(C)S(C)(=O)=O)c1C	ZINC000157294556	197176891	/nfs/dbraw/zinc/17/68/91/197176891.db2.gz	BSQLSXVSZULVHW-UHFFFAOYSA-N	0	3	314.455	2.150	10	0		DEAEHN
COc1ccc2[nH]cc(C3CCN(C(=O)[C@@H](C)N)CC3)c2c1	ZINC000157222347	197170723	/nfs/dbraw/zinc/17/07/23/197170723.db2.gz	SNGWJQKTSJSGNB-LLVKDONJSA-N	0	3	301.390	2.230	10	0		DEAEHN
CCCNc1nnc(CN2C[C@@H]3CCCCN3C[C@@H]2C)s1	ZINC000157056770	197159391	/nfs/dbraw/zinc/15/93/91/197159391.db2.gz	UWHZFBBDZXPFRG-STQMWFEESA-N	0	3	309.483	2.419	10	0		DEAEHN
CSc1nsc(NC(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)n1	ZINC000157049934	197158124	/nfs/dbraw/zinc/15/81/24/197158124.db2.gz	YOWYYLISMNJBHV-IUCAKERBSA-N	0	3	315.468	2.110	10	0		DEAEHN
C[C@](O)(Cc1cccc(Br)c1)C[C@H]1COCCN1	ZINC000156888568	197147974	/nfs/dbraw/zinc/14/79/74/197147974.db2.gz	OHBMVMQNZXJTAL-KBPBESRZSA-N	0	3	314.223	2.121	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)NCCN1CCCC[C@@H]1C	ZINC000187819400	533145324	/nfs/dbraw/zinc/14/53/24/533145324.db2.gz	NUGAGYZWHXFKDV-KBPBESRZSA-N	0	3	320.437	2.325	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCC(C)(C)[C@@H](O)C(C)C	ZINC000156148874	197089337	/nfs/dbraw/zinc/08/93/37/197089337.db2.gz	SOOLDUARFSIPBT-GJZGRUSLSA-N	0	3	315.502	2.305	10	0		DEAEHN
COC(=O)C1(NC(=O)CN(C)C[C@H]2CC=CCC2)CCCCC1	ZINC000542255404	285215342	/nfs/dbraw/zinc/21/53/42/285215342.db2.gz	YIXXXHDAXQCREK-HNNXBMFYSA-N	0	3	322.449	2.267	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccccc1CN)[S@@](=O)c1cccs1	ZINC000155970844	197078213	/nfs/dbraw/zinc/07/82/13/197078213.db2.gz	WWWZUHBMIRATLO-FVINQWEUSA-N	0	3	308.428	2.342	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2ccc(N(C)C)cc2F)CCN1C	ZINC000155088060	197020574	/nfs/dbraw/zinc/02/05/74/197020574.db2.gz	CXRPTPNSADYDGT-JSGCOSHPSA-N	0	3	307.413	2.446	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2ccc3c(c2)CC(C)(C)O3)C[C@H]1C	ZINC000120607492	195199755	/nfs/dbraw/zinc/19/97/55/195199755.db2.gz	YOCMBFMCGPIZJV-HUUCEWRRSA-N	0	3	318.461	2.287	10	0		DEAEHN
CC[C@H](C)CN1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000120593850	195197126	/nfs/dbraw/zinc/19/71/26/195197126.db2.gz	COPQHNAUIJJITR-DLBZAZTESA-N	0	3	306.450	2.090	10	0		DEAEHN
c1cncc(CO[C@@H]2CC[C@@H]3[C@H]2OCCN3C2CCOCC2)c1	ZINC000247813484	257117223	/nfs/dbraw/zinc/11/72/23/257117223.db2.gz	DYCUDVPTZGCWAP-KZNAEPCWSA-N	0	3	318.417	2.009	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2cccs2)N(CC2CCN(C)CC2)C1=O	ZINC000122004581	195388786	/nfs/dbraw/zinc/38/87/86/195388786.db2.gz	GKIRXBSJPFQTET-DZGCQCFKSA-N	0	3	307.463	2.299	10	0		DEAEHN
COc1cccc(CN[C@@H](C)c2ccc(S(N)(=O)=O)cc2)c1	ZINC000121528948	132156091	/nfs/dbraw/zinc/15/60/91/132156091.db2.gz	JRXWJBVFOXBPAA-LBPRGKRZSA-N	0	3	320.414	2.193	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(/C=C/Sc2ccccc2)n1	ZINC000263306149	132581457	/nfs/dbraw/zinc/58/14/57/132581457.db2.gz	XXEFDEIQNPLBGN-RSPDNQDQSA-N	0	3	302.403	2.409	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@H]2c2c(F)cccc2F)n1	ZINC000263314714	132582147	/nfs/dbraw/zinc/58/21/47/132582147.db2.gz	ZIAFMXAONAANBI-GIPNMCIBSA-N	0	3	320.343	2.195	10	0		DEAEHN
C[C@@H]1OCC[C@@H]1NC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000355848209	133052317	/nfs/dbraw/zinc/05/23/17/133052317.db2.gz	CMHVBOPIBQPZNY-YOEHRIQHSA-N	0	3	302.418	2.192	10	0		DEAEHN
CC1=CCN(CCNCc2cn(C)nc2-c2ccncc2)CC1	ZINC000358170285	133125715	/nfs/dbraw/zinc/12/57/15/133125715.db2.gz	QWDXJFCFBVGQEQ-UHFFFAOYSA-N	0	3	311.433	2.224	10	0		DEAEHN
Cc1cccc2c1CC[C@H]2N[C@@H]1CCN(C2CCOCC2)C1=O	ZINC000358191855	133127308	/nfs/dbraw/zinc/12/73/08/133127308.db2.gz	PDLHMOPHUMYSBQ-QZTJIDSGSA-N	0	3	314.429	2.352	10	0		DEAEHN
Cc1scc(C(=O)NC2CCN([C@H]3CCOC3)CC2)c1C	ZINC000362032069	133206480	/nfs/dbraw/zinc/20/64/80/133206480.db2.gz	IEFYPMSOGHNIRJ-AWEZNQCLSA-N	0	3	308.447	2.348	10	0		DEAEHN
C[C@@H](CNC(=O)CC1CCN(C)CC1)N1CCc2ccccc21	ZINC000362493551	133233715	/nfs/dbraw/zinc/23/37/15/133233715.db2.gz	XDPYWGGHHPOIEZ-HNNXBMFYSA-N	0	3	315.461	2.286	10	0		DEAEHN
c1nc2c([nH]1)C[C@@H](NCc1cnc([C@H]3CCCO3)s1)CC2	ZINC000368258168	133266722	/nfs/dbraw/zinc/26/67/22/133266722.db2.gz	IYHMZRVRQWUCRA-IINYFYTJSA-N	0	3	304.419	2.365	10	0		DEAEHN
Cc1cc(N2CCN3CCOC[C@H]3C2)c2cc(F)ccc2n1	ZINC000371800852	404474054	/nfs/dbraw/zinc/47/40/54/404474054.db2.gz	DAOHJZZTINZDQY-CQSZACIVSA-N	0	3	301.365	2.203	10	0		DEAEHN
C[C@H](CCNCc1cncc(Br)c1)[S@@](C)=O	ZINC000166506255	144803525	/nfs/dbraw/zinc/80/35/25/144803525.db2.gz	PLSSCEYHKHGREX-ABKXIKBNSA-N	0	3	305.241	2.091	10	0		DEAEHN
CCC(=O)c1cccc(NC(=O)N2CCO[C@@H](CN(C)C)C2)c1	ZINC000181246063	144902242	/nfs/dbraw/zinc/90/22/42/144902242.db2.gz	LMCWUNUFKZYJPV-HNNXBMFYSA-N	0	3	319.405	2.074	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)N2CCN3CCC2CC3)c1	ZINC000188634408	145015041	/nfs/dbraw/zinc/01/50/41/145015041.db2.gz	CMFIFYTTZMSQDA-IRXDYDNUSA-N	0	3	300.402	2.105	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1ccc(-n2ccnc2)cc1	ZINC000188725104	145016098	/nfs/dbraw/zinc/01/60/98/145016098.db2.gz	XHQUNZPYJDHJHK-UHFFFAOYSA-N	0	3	318.380	2.406	10	0		DEAEHN
COC[C@H](C)n1ccc(NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)n1	ZINC000189901816	145036171	/nfs/dbraw/zinc/03/61/71/145036171.db2.gz	IFEAAPPEOSTRRG-HZSPNIEDSA-N	0	3	323.441	2.037	10	0		DEAEHN
CCc1nc(C2CCN(CC(=O)N(C(C)C)C(C)C)CC2)n[nH]1	ZINC000190716052	145047388	/nfs/dbraw/zinc/04/73/88/145047388.db2.gz	QTQVBQCSAUWSHA-UHFFFAOYSA-N	0	3	321.469	2.192	10	0		DEAEHN
CCc1n[nH]c(C2CCN(CC(=O)N(C(C)C)C(C)C)CC2)n1	ZINC000190716052	145047389	/nfs/dbraw/zinc/04/73/89/145047389.db2.gz	QTQVBQCSAUWSHA-UHFFFAOYSA-N	0	3	321.469	2.192	10	0		DEAEHN
CCc1nnc(C2CCN(CC(=O)N(C(C)C)C(C)C)CC2)[nH]1	ZINC000190716052	145047390	/nfs/dbraw/zinc/04/73/90/145047390.db2.gz	QTQVBQCSAUWSHA-UHFFFAOYSA-N	0	3	321.469	2.192	10	0		DEAEHN
CN(CC(=O)OC(C)(C)C)[C@@H]1CCCN(Cc2c[nH]cn2)CC1	ZINC000190853831	145049004	/nfs/dbraw/zinc/04/90/04/145049004.db2.gz	BOGISQZDBWRLDA-OAHLLOKOSA-N	0	3	322.453	2.038	10	0		DEAEHN
CN(CC(=O)OC(C)(C)C)[C@@H]1CCCN(Cc2cnc[nH]2)CC1	ZINC000190853831	145049007	/nfs/dbraw/zinc/04/90/07/145049007.db2.gz	BOGISQZDBWRLDA-OAHLLOKOSA-N	0	3	322.453	2.038	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)C2CCCCC2)C[C@@H]1CC	ZINC000191335923	145056823	/nfs/dbraw/zinc/05/68/23/145056823.db2.gz	XOEHZBBZFAVTOS-ROUUACIJSA-N	0	3	312.498	2.360	10	0		DEAEHN
c1cc(CCCN2CCO[C@]3(CCOC3)C2)cc2c1OCC2	ZINC000193315397	145084183	/nfs/dbraw/zinc/08/41/83/145084183.db2.gz	WYHSYLXZCCNMBI-GOSISDBHSA-N	0	3	303.402	2.045	10	0		DEAEHN
COC(=O)CNC(=O)CN(Cc1ccccc1)C1CCCCC1	ZINC000193724029	145089680	/nfs/dbraw/zinc/08/96/80/145089680.db2.gz	XDPXTSSMCFPLRX-UHFFFAOYSA-N	0	3	318.417	2.111	10	0		DEAEHN
Cc1ccc(NC(=O)[C@H](C)N2CCN3CCC[C@H]3C2)cc1F	ZINC000246207149	145094311	/nfs/dbraw/zinc/09/43/11/145094311.db2.gz	ADERNTFZOXHYQI-ZFWWWQNUSA-N	0	3	305.397	2.241	10	0		DEAEHN
CCOC[C@H]1CCN([C@H]2CCN(c3ccc(C)cc3)C2=O)C1	ZINC000246283307	145097194	/nfs/dbraw/zinc/09/71/94/145097194.db2.gz	XCOJWCXQQHHVKI-RDJZCZTQSA-N	0	3	302.418	2.459	10	0		DEAEHN
Cc1ccccc1OCCCN1CCN(C[C@@H](C)O)[C@@H](C)C1	ZINC000246310293	145098242	/nfs/dbraw/zinc/09/82/42/145098242.db2.gz	AJAKBBGYLCOBEQ-DLBZAZTESA-N	0	3	306.450	2.151	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@H](C)N2CCN3CCC[C@H]3C2)cc1C	ZINC000246367686	145100042	/nfs/dbraw/zinc/10/00/42/145100042.db2.gz	NTROCMZVJVNXNO-WBVHZDCISA-N	0	3	301.434	2.410	10	0		DEAEHN
Cc1cccc(OCCN2C[C@H](N3CCOCC3)[C@@H](C)C2)c1	ZINC000246631112	145109087	/nfs/dbraw/zinc/10/90/87/145109087.db2.gz	ZKEPVJSFSYUJHR-WMZOPIPTSA-N	0	3	304.434	2.026	10	0		DEAEHN
C[C@@H](C(=O)Nc1cccc2ncccc21)N1CCN2CCC[C@H]2C1	ZINC000246718410	145111985	/nfs/dbraw/zinc/11/19/85/145111985.db2.gz	UWZOKVBHIUXRFI-GJZGRUSLSA-N	0	3	324.428	2.342	10	0		DEAEHN
Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)N1CCN2CCC[C@H]2C1	ZINC000246730516	145112035	/nfs/dbraw/zinc/11/20/35/145112035.db2.gz	VYFRHOHSGLGZIM-BBWFWOEESA-N	0	3	315.461	2.341	10	0		DEAEHN
CCc1ccc(OCC(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1	ZINC000246802154	145115104	/nfs/dbraw/zinc/11/51/04/145115104.db2.gz	BVQXPIPHRBKFPW-ZBFHGGJFSA-N	0	3	302.418	2.323	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2c[nH]c3ncccc23)C1	ZINC000246808991	145115307	/nfs/dbraw/zinc/11/53/07/145115307.db2.gz	RWQVYPQMKDDIIT-BBRMVZONSA-N	0	3	312.417	2.048	10	0		DEAEHN
CCn1nc(C)c(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1Cl	ZINC000246816062	145115544	/nfs/dbraw/zinc/11/55/44/145115544.db2.gz	SGDWTZWXWYUQDG-PWSUYJOCSA-N	0	3	310.829	2.174	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)CSCc2ccncc2)C1	ZINC000246836042	145116570	/nfs/dbraw/zinc/11/65/70/145116570.db2.gz	DYFWKYDBSNUBCQ-DZGCQCFKSA-N	0	3	307.463	2.160	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@H](C)C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000246904924	145119203	/nfs/dbraw/zinc/11/92/03/145119203.db2.gz	ZKDAUBPUQCVBSF-XEZPLFJOSA-N	0	3	320.481	2.157	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)CSCc1cccnc1	ZINC000246935765	145119899	/nfs/dbraw/zinc/11/98/99/145119899.db2.gz	KGTBFJVLBYUHRG-HOTGVXAUSA-N	0	3	319.474	2.400	10	0		DEAEHN
COC[C@@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)C1CC1	ZINC000247045332	145124190	/nfs/dbraw/zinc/12/41/90/145124190.db2.gz	MXOVYVWUQLVEQS-JKIFEVAISA-N	0	3	319.449	2.210	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@H]1CCN(c2ccccc2)C1=O	ZINC000247133960	145127163	/nfs/dbraw/zinc/12/71/63/145127163.db2.gz	SMIFZRXUANJBPU-ROUUACIJSA-N	0	3	324.428	2.461	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N[C@H]1CCCC[C@H]1C	ZINC000247187231	145129177	/nfs/dbraw/zinc/12/91/77/145129177.db2.gz	WGLOVZNKDYYPRO-PVAVHDDUSA-N	0	3	318.465	2.351	10	0		DEAEHN
C[C@@H]1CCN(C(=O)[C@H]2CCCc3[nH]ncc32)C[C@@H]1n1ccnc1	ZINC000247380452	145135220	/nfs/dbraw/zinc/13/52/20/145135220.db2.gz	IAFKVIBSFORLFK-WWGRRREGSA-N	0	3	313.405	2.136	10	0		DEAEHN
C[C@H](Oc1ccc(F)c(F)c1)C(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000247505086	145139774	/nfs/dbraw/zinc/13/97/74/145139774.db2.gz	VIOSZWKOAMFKLU-AVGNSLFASA-N	0	3	324.371	2.427	10	0		DEAEHN
CCOCCN1CCN(CCCCCn2cc(C)cn2)C[C@H]1C	ZINC000247581615	145141921	/nfs/dbraw/zinc/14/19/21/145141921.db2.gz	LMRCXXJSCFOIRJ-GOSISDBHSA-N	0	3	322.497	2.404	10	0		DEAEHN
CC1CCN(CC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CC1	ZINC000248132202	145148324	/nfs/dbraw/zinc/14/83/24/145148324.db2.gz	WSKJKHXLBXQSFU-MJGOQNOKSA-N	0	3	315.461	2.280	10	0		DEAEHN
C(c1nnc(C2CC2)n1C1CC1)N1CCN2CCCC[C@@H]2C1	ZINC000248385007	145152572	/nfs/dbraw/zinc/15/25/72/145152572.db2.gz	GWFGWONOYDVDRT-OAHLLOKOSA-N	0	3	301.438	2.161	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN(C[C@@H](O)C(F)(F)F)C2)n1	ZINC000248554486	145158692	/nfs/dbraw/zinc/15/86/92/145158692.db2.gz	HTUYBEXSBLBPAT-NWDGAFQWSA-N	0	3	303.328	2.047	10	0		DEAEHN
CO[C@@H]1CC[C@@H]2OCCN(C[C@@H](O)CCc3ccccc3)[C@H]2C1	ZINC000248564085	145158860	/nfs/dbraw/zinc/15/88/60/145158860.db2.gz	KFBICOVQQYDEEV-RDGPPVDQSA-N	0	3	319.445	2.248	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@@H](C)c1nc(C)cc(=O)[nH]1	ZINC000248759097	145167349	/nfs/dbraw/zinc/16/73/49/145167349.db2.gz	QHYMBOCNBBKZJC-JSGCOSHPSA-N	0	3	301.394	2.221	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1C	ZINC000248883772	145172314	/nfs/dbraw/zinc/17/23/14/145172314.db2.gz	DODHYHKVUOBSCZ-IUODEOHRSA-N	0	3	315.417	2.262	10	0		DEAEHN
O[C@H](CC1CCCC1)CN1CCC[C@@H](c2nnc3n2CCC3)C1	ZINC000248902786	145172732	/nfs/dbraw/zinc/17/27/32/145172732.db2.gz	LFFOJPDEFVOUGB-HZPDHXFCSA-N	0	3	318.465	2.345	10	0		DEAEHN
CO[C@@H]1CN(Cc2ccccc2N2CCOCC2)CC[C@@H]1C	ZINC000249126538	145179604	/nfs/dbraw/zinc/17/96/04/145179604.db2.gz	CJYFHESYZPNIKO-MAUKXSAKSA-N	0	3	304.434	2.380	10	0		DEAEHN
C[C@]1(CNC(=O)[C@H]2CCCO2)CCCN1Cc1ccccc1	ZINC000249435965	145184425	/nfs/dbraw/zinc/18/44/25/145184425.db2.gz	IPHGQEOUUVGYJG-SJLPKXTDSA-N	0	3	302.418	2.336	10	0		DEAEHN
Cc1nn(C)c(C)c1CN1C[C@@H](CO)[C@@H](c2ccsc2)C1	ZINC000249544627	145186204	/nfs/dbraw/zinc/18/62/04/145186204.db2.gz	FXDXKBKUPMDWRD-GOEBONIOSA-N	0	3	305.447	2.306	10	0		DEAEHN
C[C@H](C(=O)NCc1cccnc1N(C)C)N1[C@H](C)CC[C@@H]1C	ZINC000249763375	145189735	/nfs/dbraw/zinc/18/97/35/145189735.db2.gz	XYJPIEUFHKLRFM-HZSPNIEDSA-N	0	3	304.438	2.025	10	0		DEAEHN
Cc1nccn1C[C@H](C)CNC(=O)NCCN1CCCC[C@H]1C	ZINC000249838923	145190992	/nfs/dbraw/zinc/19/09/92/145190992.db2.gz	UMFBKHNMZYDPEX-HUUCEWRRSA-N	0	3	321.469	2.001	10	0		DEAEHN
Cc1cnc(-c2cccc(NC(=O)[C@@H](N)C3CCOCC3)c2)o1	ZINC000261627027	145212050	/nfs/dbraw/zinc/21/20/50/145212050.db2.gz	CQAUBAYTFREOCT-HNNXBMFYSA-N	0	3	315.373	2.342	10	0		DEAEHN
C[C@@H](c1ccc2ccccc2c1)N(C)CC(=O)N1CCNCC1	ZINC000261661169	145214555	/nfs/dbraw/zinc/21/45/55/145214555.db2.gz	GHUKOYQPZOIMIU-HNNXBMFYSA-N	0	3	311.429	2.264	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H](N)C1CCOCC1)C12CC3CC(CC(C3)C1)C2	ZINC000261720370	145219754	/nfs/dbraw/zinc/21/97/54/145219754.db2.gz	JFUJRLSRAYWQQS-WPVXRUBYSA-N	0	3	320.477	2.461	10	0		DEAEHN
COc1ccccc1[C@@H]1C[NH2+]CCN1Cc1nc(C)ccc1[O-]	ZINC000261769444	145224379	/nfs/dbraw/zinc/22/43/79/145224379.db2.gz	RYWKGXMYWAWFBW-INIZCTEOSA-N	0	3	313.401	2.251	10	0		DEAEHN
N[C@@H](C(=O)NCCc1csc2ccccc12)C1CCOCC1	ZINC000261813646	145229226	/nfs/dbraw/zinc/22/92/26/145229226.db2.gz	OXUHVMQSZHNVDN-MRXNPFEDSA-N	0	3	318.442	2.314	10	0		DEAEHN
C[C@@H]1CCCN1C(=O)CCN1CCNC[C@@H]1c1cccc(F)c1	ZINC000261829092	145231474	/nfs/dbraw/zinc/23/14/74/145231474.db2.gz	SUNKJJFFLQRJML-RHSMWYFYSA-N	0	3	319.424	2.173	10	0		DEAEHN
CC(C)n1cc2cc(NC(=O)[C@H](N)C3CCOCC3)ccc2n1	ZINC000261869831	145235996	/nfs/dbraw/zinc/23/59/96/145235996.db2.gz	SUUOITFOOBSBHA-MRXNPFEDSA-N	0	3	316.405	2.310	10	0		DEAEHN
C[C@@H](NC(=O)C1(N)CCOCC1)c1ccc(F)cc1Cl	ZINC000261894240	145238689	/nfs/dbraw/zinc/23/86/89/145238689.db2.gz	QVUKMBKQOBIYQK-SECBINFHSA-N	0	3	300.761	2.164	10	0		DEAEHN
C[C@@H](NC(=O)C1(N)CCOCC1)c1ccccc1C(F)(F)F	ZINC000261925554	145242895	/nfs/dbraw/zinc/24/28/95/145242895.db2.gz	VRBIITVXEFCFAJ-SNVBAGLBSA-N	0	3	316.323	2.391	10	0		DEAEHN
Cc1ccc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)c(C)c1O	ZINC000261944483	145245018	/nfs/dbraw/zinc/24/50/18/145245018.db2.gz	VGPMDZOMPXEPFP-CDHAZOANSA-N	0	3	318.417	2.480	10	0		DEAEHN
Cc1nc2ccccc2n1CCNC(=O)[C@H]1NCCCC1(C)C	ZINC000261968984	145247921	/nfs/dbraw/zinc/24/79/21/145247921.db2.gz	YSAQAZXRFLLOMW-MRXNPFEDSA-N	0	3	314.433	2.239	10	0		DEAEHN
C[C@@H](NC(=O)C1(N)CCOCC1)c1cccc(C(F)(F)F)c1	ZINC000262051100	145257088	/nfs/dbraw/zinc/25/70/88/145257088.db2.gz	CVGZCIALDOLPIX-SNVBAGLBSA-N	0	3	316.323	2.391	10	0		DEAEHN
COc1ccccc1OCCN1CCNC[C@H]1c1cccnc1	ZINC000262151893	145265913	/nfs/dbraw/zinc/26/59/13/145265913.db2.gz	GBPQOMSFYBQGNA-INIZCTEOSA-N	0	3	313.401	2.116	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)Nc1cccc(F)c1F	ZINC000262505704	145288909	/nfs/dbraw/zinc/28/89/09/145288909.db2.gz	MKMUOXCVWOPJPC-LQBHMHGISA-N	0	3	310.344	2.436	10	0		DEAEHN
CCc1nc(NC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)sc1C	ZINC000262575855	145294500	/nfs/dbraw/zinc/29/45/00/145294500.db2.gz	YDGADXMJSPVYBM-KNHMANMVSA-N	0	3	323.462	2.485	10	0		DEAEHN
CC(C)(C)[C@H](N)C(=O)N1CCC[C@@H](c2noc(C3CC3)n2)C1	ZINC000262626976	145297161	/nfs/dbraw/zinc/29/71/61/145297161.db2.gz	LPHURHHZXCHCGY-VXGBXAGGSA-N	0	3	306.410	2.026	10	0		DEAEHN
CC[C@H](C)Oc1ccc(-c2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263185050	145333608	/nfs/dbraw/zinc/33/36/08/145333608.db2.gz	HGDQXUBQUOYBPJ-SWLSCSKDSA-N	0	3	316.405	2.490	10	0		DEAEHN
CC(=O)CCC(=O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000309812885	145350376	/nfs/dbraw/zinc/35/03/76/145350376.db2.gz	XBMHPRCTAJRZST-RCCFBDPRSA-N	0	3	314.429	2.382	10	0		DEAEHN
COCCC1(C)CN(C(=O)NCc2ccc(CN(C)C)cc2)C1	ZINC000358470847	147141022	/nfs/dbraw/zinc/14/10/22/147141022.db2.gz	UGFOTPHRAVRHJZ-UHFFFAOYSA-N	0	3	319.449	2.316	10	0		DEAEHN
CN(C[C@H]1CCCN(C)C1)C(=O)NCc1ccc2cc[nH]c2n1	ZINC000360711872	147372208	/nfs/dbraw/zinc/37/22/08/147372208.db2.gz	GQPGQQPTDBDDOM-ZDUSSCGKSA-N	0	3	315.421	2.046	10	0		DEAEHN
Cc1ccnc([C@H](NC(=O)CC2CCN(C)CC2)C2CC2)n1	ZINC000362994819	147611058	/nfs/dbraw/zinc/61/10/58/147611058.db2.gz	ZUOBNTWNVILJNI-MRXNPFEDSA-N	0	3	302.422	2.084	10	0		DEAEHN
CCn1cc([C@H](C)NC[C@@H]2CCC3(CCOCC3)[C@H]2O)cn1	ZINC000374789990	148290030	/nfs/dbraw/zinc/29/00/30/148290030.db2.gz	ASMWFMOAJPSUHE-DZKIICNBSA-N	0	3	307.438	2.121	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@@H]1CCCc2occc21	ZINC000111824222	401724886	/nfs/dbraw/zinc/72/48/86/401724886.db2.gz	VSNRFQAHQRPFPZ-DZGCQCFKSA-N	0	3	321.421	2.067	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@@H]2CCc3ccccc32)C1	ZINC000111836862	401725514	/nfs/dbraw/zinc/72/55/14/401725514.db2.gz	PXLAMAVLMFGKST-JKSUJKDBSA-N	0	3	301.434	2.500	10	0		DEAEHN
CC(C)COC1CCN(C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)CC1	ZINC000127322654	401729161	/nfs/dbraw/zinc/72/91/61/401729161.db2.gz	PCZLBUMIWYBKBY-CABCVRRESA-N	0	3	323.481	2.458	10	0		DEAEHN
COc1ccc(CNCCCn2ccnn2)c(Cl)c1OC	ZINC000126444327	401694443	/nfs/dbraw/zinc/69/44/43/401694443.db2.gz	VZAGGKCDHLYDGP-UHFFFAOYSA-N	0	3	310.785	2.129	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H](C)c1ccc(-n2ccnn2)cc1)N(C)C	ZINC000126546090	401698951	/nfs/dbraw/zinc/69/89/51/401698951.db2.gz	IGQUVRAVARLAIC-XJKSGUPXSA-N	0	3	315.421	2.175	10	0		DEAEHN
O=c1[nH]c2ccccc2cc1CN1CCC[C@H](Cn2cncn2)C1	ZINC000111229136	401701937	/nfs/dbraw/zinc/70/19/37/401701937.db2.gz	GEHAOFQRPUSERQ-AWEZNQCLSA-N	0	3	323.400	2.032	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCO[C@@H](c2ccco2)C1	ZINC000126731728	401706276	/nfs/dbraw/zinc/70/62/76/401706276.db2.gz	KWOCMUOAFTUUGF-GOEBONIOSA-N	0	3	323.437	2.339	10	0		DEAEHN
COCCN(C)CCNC(=O)N1CCC[C@@]2(CC=CCC2)C1	ZINC000114526803	401802760	/nfs/dbraw/zinc/80/27/60/401802760.db2.gz	IXIOUYLZXXQZQW-KRWDZBQOSA-N	0	3	309.454	2.097	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1C	ZINC000113223523	401770412	/nfs/dbraw/zinc/77/04/12/401770412.db2.gz	ALTVEQVMPLTLHN-HZMBPMFUSA-N	0	3	303.406	2.143	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(-c2ccncc2)on1	ZINC000113222644	401770512	/nfs/dbraw/zinc/77/05/12/401770512.db2.gz	AVWHASIPSBEUDO-TZMCWYRMSA-N	0	3	312.373	2.045	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc2c(c(Cl)c1)OCO2	ZINC000113226672	401770631	/nfs/dbraw/zinc/77/06/31/401770631.db2.gz	HWVXFQFXFUZTFP-ZYHUDNBSSA-N	0	3	322.792	2.377	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc2c(s1)CCOC2	ZINC000113231176	401771915	/nfs/dbraw/zinc/77/19/15/401771915.db2.gz	FOFZDCFQSQQFFS-DGCLKSJQSA-N	0	3	306.431	2.130	10	0		DEAEHN
COc1cccc(CN2CCCC[C@@H]2CN2CCOCC2)c1	ZINC000075968740	401775339	/nfs/dbraw/zinc/77/53/39/401775339.db2.gz	BHEAARFQALRIFA-QGZVFWFLSA-N	0	3	304.434	2.382	10	0		DEAEHN
COc1cccc(OC)c1C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000113444725	401779197	/nfs/dbraw/zinc/77/91/97/401779197.db2.gz	OXGYDRANCFTGSF-CHWSQXEVSA-N	0	3	304.390	2.013	10	0		DEAEHN
CNC(=O)c1cccc(CN2CC[C@H](CNc3ccccn3)C2)c1	ZINC000113931393	401787371	/nfs/dbraw/zinc/78/73/71/401787371.db2.gz	ZYKOFGZCHXTGGY-MRXNPFEDSA-N	0	3	324.428	2.375	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)NCc1ccc(F)c(CN(C)C)c1	ZINC000115415291	401827061	/nfs/dbraw/zinc/82/70/61/401827061.db2.gz	HHOVHTAAWPBKFR-KRWDZBQOSA-N	0	3	321.440	2.378	10	0		DEAEHN
C[C@H](NC(=O)NCc1cccc(CN(C)C)c1)[C@H]1CCCO1	ZINC000077839668	401834716	/nfs/dbraw/zinc/83/47/16/401834716.db2.gz	MQBKEYKDIBUSNP-XJKSGUPXSA-N	0	3	305.422	2.115	10	0		DEAEHN
CCN(C)C(=O)CCN1CC[C@H](c2cc(OC)cc(OC)c2)C1	ZINC000130647456	401836455	/nfs/dbraw/zinc/83/64/55/401836455.db2.gz	QFRUQJUWBSOQIR-AWEZNQCLSA-N	0	3	320.433	2.362	10	0		DEAEHN
CCNC(=O)CCN1CCC[C@H]1c1cc(OC)ccc1OC	ZINC000025926942	401838013	/nfs/dbraw/zinc/83/80/13/401838013.db2.gz	FSMUXXZSCZSBBA-HNNXBMFYSA-N	0	3	306.406	2.367	10	0		DEAEHN
COc1ccccc1NC(=O)CN1CCN(C2CCCC2)CC1	ZINC000027118197	401844121	/nfs/dbraw/zinc/84/41/21/401844121.db2.gz	YIQMDOKGNSCOAK-UHFFFAOYSA-N	0	3	317.433	2.194	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CSCc1cscn1	ZINC000131491502	401851830	/nfs/dbraw/zinc/85/18/30/401851830.db2.gz	MOECFZDCTYGFPK-ZDUSSCGKSA-N	0	3	313.492	2.319	10	0		DEAEHN
CCCCOc1ccc(C(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000116788496	401859024	/nfs/dbraw/zinc/85/90/24/401859024.db2.gz	JHJWABUXVYBMJE-KRWDZBQOSA-N	0	3	320.433	2.268	10	0		DEAEHN
Cc1[nH]c2ccc(C(=O)N3CCO[C@H](CN(C)C)C3)cc2c1C	ZINC000116788132	401859090	/nfs/dbraw/zinc/85/90/90/401859090.db2.gz	RRSRHOOGDAGXOW-OAHLLOKOSA-N	0	3	315.417	2.187	10	0		DEAEHN
CSc1ccc(C)c(C(=O)N2CCO[C@H](CN(C)C)C2)c1	ZINC000116797671	401859710	/nfs/dbraw/zinc/85/97/10/401859710.db2.gz	QZVGHNRYBZDKCO-CYBMUJFWSA-N	0	3	308.447	2.120	10	0		DEAEHN
C/C(=C/C(=O)N1CCO[C@H](CN(C)C)C1)c1cccc(F)c1	ZINC000116797067	401860035	/nfs/dbraw/zinc/86/00/35/401860035.db2.gz	CUEYGTAANHYLHC-RCBBPTIPSA-N	0	3	306.381	2.018	10	0		DEAEHN
Cc1cccc([C@H](C)NC(=O)N2CCO[C@H](CN(C)C)C2)c1C	ZINC000117052182	401867608	/nfs/dbraw/zinc/86/76/08/401867608.db2.gz	JUYQILAJYXFOEY-JKSUJKDBSA-N	0	3	319.449	2.336	10	0		DEAEHN
CC(C)[C@@H]1CCC[C@@H](NC(=O)N2CCO[C@H](CN(C)C)C2)C1	ZINC000117045667	401867779	/nfs/dbraw/zinc/86/77/79/401867779.db2.gz	ZQUOHACUABOASH-BZUAXINKSA-N	0	3	311.470	2.173	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)CC1CCOCC1	ZINC000117241383	401870361	/nfs/dbraw/zinc/87/03/61/401870361.db2.gz	RDZMCOZVWRBKNQ-KRWDZBQOSA-N	0	3	304.434	2.092	10	0		DEAEHN
CCC[C@H](C(=O)NCCCOc1ccc(OC)cc1)N(C)C	ZINC000119081836	401924496	/nfs/dbraw/zinc/92/44/96/401924496.db2.gz	UFPGRHYTEQYQEE-MRXNPFEDSA-N	0	3	308.422	2.311	10	0		DEAEHN
COCCN1CCN(CCCc2cccc(OC)c2)C[C@@H]1C	ZINC000119157932	401929765	/nfs/dbraw/zinc/92/97/65/401929765.db2.gz	PVSKEAJLAYWHOM-INIZCTEOSA-N	0	3	306.450	2.280	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1CCO[C@H](c2cccc(O)c2)C1	ZINC000135229630	401931320	/nfs/dbraw/zinc/93/13/20/401931320.db2.gz	KSEMINFWWXTQOP-SJORKVTESA-N	0	3	318.417	2.167	10	0		DEAEHN
C[C@@H](CCC(=O)N1CCO[C@H](CN(C)C)C1)c1ccccc1	ZINC000133316573	401881914	/nfs/dbraw/zinc/88/19/14/401881914.db2.gz	JHKYUFGXXWPIJT-DOTOQJQBSA-N	0	3	304.434	2.359	10	0		DEAEHN
C[C@@H](Cc1ccc(O)cc1)NCC(=O)c1cc(O)cc(O)c1	ZINC000033505756	401891423	/nfs/dbraw/zinc/89/14/23/401891423.db2.gz	IFNGKZSCMSNIPZ-NSHDSACASA-N	0	3	301.342	2.207	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)Cc1ccccc1Cl	ZINC000036076814	401901694	/nfs/dbraw/zinc/90/16/94/401901694.db2.gz	JSKMOCAZKYOJKC-GFCCVEGCSA-N	0	3	318.870	2.490	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N(C)[C@H]1CCN(C)C[C@@H]1C	ZINC000085407874	401915850	/nfs/dbraw/zinc/91/58/50/401915850.db2.gz	GIFGDSNGSOYUPV-GJZGRUSLSA-N	0	3	321.469	2.021	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)CC/C=C/c2ccccc2)CCO1	ZINC000119051364	401921963	/nfs/dbraw/zinc/92/19/63/401921963.db2.gz	BSSOSNQIKOOPCX-DKISHCGFSA-N	0	3	302.418	2.269	10	0		DEAEHN
COCCN(C)CCNc1nccc(OCc2ccccc2)n1	ZINC000089596204	401953448	/nfs/dbraw/zinc/95/34/48/401953448.db2.gz	SRDRIMYQIJESPL-UHFFFAOYSA-N	0	3	316.405	2.046	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCCc1cc2ccccc2o1	ZINC000119733678	401965099	/nfs/dbraw/zinc/96/50/99/401965099.db2.gz	GRXJUEKCBBADBN-AWEZNQCLSA-N	0	3	301.390	2.369	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(C(=O)CN2CCC(C)CC2)C1	ZINC000136813956	401974414	/nfs/dbraw/zinc/97/44/14/401974414.db2.gz	GJPYWWXKNDWPIB-INIZCTEOSA-N	0	3	318.465	2.341	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H](c1ccc(F)cc1)N(C)C)N(C)C	ZINC000137056167	401978050	/nfs/dbraw/zinc/97/80/50/401978050.db2.gz	FEMQWDFHZIAPPO-HZPDHXFCSA-N	0	3	309.429	2.275	10	0		DEAEHN
CCN1CCN(C[C@@H](C)CNC(=O)Nc2ccccc2)CC1	ZINC000047270976	401980377	/nfs/dbraw/zinc/98/03/77/401980377.db2.gz	QYDULXKWAYYQTO-HNNXBMFYSA-N	0	3	304.438	2.082	10	0		DEAEHN
O=C(CCOCc1ccccc1)N1CCCN(C2CC2)CC1	ZINC000148886774	401992114	/nfs/dbraw/zinc/99/21/14/401992114.db2.gz	IKGCSYWWXDDIMX-UHFFFAOYSA-N	0	3	302.418	2.290	10	0		DEAEHN
Cc1noc(CCN[C@@H](C)c2ccc(N3CCCC3=O)cc2)n1	ZINC000089517866	401950516	/nfs/dbraw/zinc/95/05/16/401950516.db2.gz	UUKLPSROWHYPTC-LBPRGKRZSA-N	0	3	314.389	2.398	10	0		DEAEHN
COc1ccccc1/C=C/CN1CC[C@@H](N2CCOCC2)C1	ZINC000121026076	402011420	/nfs/dbraw/zinc/01/14/20/402011420.db2.gz	SSJUCUIROSFXSB-UKINESCASA-N	0	3	302.418	2.115	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(=O)N(CCN(C)C)Cc2cccc(F)c2)O1	ZINC000151044571	402012756	/nfs/dbraw/zinc/01/27/56/402012756.db2.gz	PHJBILORVRZZPF-CJNGLKHVSA-N	0	3	308.397	2.283	10	0		DEAEHN
CCN(C[C@@H]1CCN(C[C@H](O)C(F)(F)F)C1)CC(F)(F)F	ZINC000121422899	402034951	/nfs/dbraw/zinc/03/49/51/402034951.db2.gz	LSRMXCXLMRLMES-UWVGGRQHSA-N	0	3	322.293	2.116	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)CSCc1ccncc1	ZINC000120815451	402003531	/nfs/dbraw/zinc/00/35/31/402003531.db2.gz	QYMFCEXZULSGLH-CQSZACIVSA-N	0	3	307.463	2.305	10	0		DEAEHN
Cc1cccc(CNC(=O)NCCN(C)Cc2ccccc2)n1	ZINC000054761077	402071171	/nfs/dbraw/zinc/07/11/71/402071171.db2.gz	LGGJMXGKYNQMLL-UHFFFAOYSA-N	0	3	312.417	2.321	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cccc(OC(F)(F)F)c2)C1	ZINC000152150076	402078079	/nfs/dbraw/zinc/07/80/79/402078079.db2.gz	IGIXJSIZQBHQBU-NSHDSACASA-N	0	3	302.296	2.361	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)N[C@@H](Cc1ccccc1)C1CC1	ZINC000152513043	402099169	/nfs/dbraw/zinc/09/91/69/402099169.db2.gz	RDQDGIOYIHJAML-IRXDYDNUSA-N	0	3	301.434	2.401	10	0		DEAEHN
CC(C)[C@@H](O)CNC(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000152767859	402107540	/nfs/dbraw/zinc/10/75/40/402107540.db2.gz	BRXRBFNWLAHYAD-SJORKVTESA-N	0	3	319.449	2.140	10	0		DEAEHN
C[C@@H](NC(=O)NCc1cccc(CN(C)C)c1)[C@H]1CCCO1	ZINC000062009139	402108736	/nfs/dbraw/zinc/10/87/36/402108736.db2.gz	MQBKEYKDIBUSNP-CZUORRHYSA-N	0	3	305.422	2.115	10	0		DEAEHN
O=C(CN1CC[C@H]2OCCC[C@@H]2C1)N1CCc2sccc2C1	ZINC000153144484	402129703	/nfs/dbraw/zinc/12/97/03/402129703.db2.gz	GZMFKSZNLPLGAK-UKRRQHHQSA-N	0	3	320.458	2.134	10	0		DEAEHN
O=C(CN1CC[C@@H]2OCCC[C@@H]2C1)N1CCc2sccc2C1	ZINC000153144601	402129807	/nfs/dbraw/zinc/12/98/07/402129807.db2.gz	GZMFKSZNLPLGAK-HIFRSBDPSA-N	0	3	320.458	2.134	10	0		DEAEHN
c1ccc(OC2CCN(CCCN3CCOCC3)CC2)cc1	ZINC000097727571	402131502	/nfs/dbraw/zinc/13/15/02/402131502.db2.gz	DIESQUFVBBDVAU-UHFFFAOYSA-N	0	3	304.434	2.252	10	0		DEAEHN
CC(C)c1ccc([C@@H](C)N[C@H](C)C(=O)N2CCNC2=O)cc1	ZINC000067127591	402153194	/nfs/dbraw/zinc/15/31/94/402153194.db2.gz	NZBBQCQUDLERIV-CHWSQXEVSA-N	0	3	303.406	2.401	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(C(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000068224454	402187896	/nfs/dbraw/zinc/18/78/96/402187896.db2.gz	AQOOKHMJEMWHRD-AWEZNQCLSA-N	0	3	323.412	2.490	10	0		DEAEHN
CC(C)CO[C@H]1CCN(C[C@H](O)COCc2ccccc2)C1	ZINC000124619223	402188961	/nfs/dbraw/zinc/18/89/61/402188961.db2.gz	JKJVYNMXOVNTHL-ROUUACIJSA-N	0	3	307.434	2.311	10	0		DEAEHN
COc1cc([C@H](C)N[C@@H](C)CCS(C)(=O)=O)ccc1F	ZINC000154271509	402202816	/nfs/dbraw/zinc/20/28/16/402202816.db2.gz	VEKDUUCUAZZDEF-QWRGUYRKSA-N	0	3	303.399	2.308	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccn(-c3cccc(F)c3)n2)C1	ZINC000067844817	402175274	/nfs/dbraw/zinc/17/52/74/402175274.db2.gz	NERFZEDGYHUMBG-AWEZNQCLSA-N	0	3	316.380	2.226	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)NCCCc2cccc(F)c2)C1	ZINC000069467282	402225229	/nfs/dbraw/zinc/22/52/29/402225229.db2.gz	YYPMNKSZDLRIDB-MRXNPFEDSA-N	0	3	307.413	2.494	10	0		DEAEHN
COCCCCCNC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000125380426	402229501	/nfs/dbraw/zinc/22/95/01/402229501.db2.gz	AGUNEPMKWHRHSV-MRXNPFEDSA-N	0	3	307.438	2.405	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC[C@]2(CCO)CCOC2)c1	ZINC000125480337	402235015	/nfs/dbraw/zinc/23/50/15/402235015.db2.gz	LRWXQPSYGHFMOI-GUYCJALGSA-N	0	3	309.406	2.144	10	0		DEAEHN
CCOc1ccccc1CCNC(=O)N[C@@H]1CCCN(CC)C1	ZINC000069779795	402244265	/nfs/dbraw/zinc/24/42/65/402244265.db2.gz	JXAXZLLWJNHYCZ-MRXNPFEDSA-N	0	3	319.449	2.411	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)CSC[C@@H]2CCCCO2)C1	ZINC000155783768	402267342	/nfs/dbraw/zinc/26/73/42/402267342.db2.gz	NPOYFLMVGMHTNO-ILXRZTDVSA-N	0	3	314.495	2.134	10	0		DEAEHN
CN(C[C@H]1CCN(C)C1)C(=O)c1ccccc1Br	ZINC000071190419	402271495	/nfs/dbraw/zinc/27/14/95/402271495.db2.gz	AIYGFVNTDDSFPA-NSHDSACASA-N	0	3	311.223	2.473	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)Nc2cnc(C3CC3)nc2)CCN1C	ZINC000176113402	402280314	/nfs/dbraw/zinc/28/03/14/402280314.db2.gz	LLPCZIPXTJAAFT-SMDDNHRTSA-N	0	3	303.410	2.300	10	0		DEAEHN
Cc1cccc2[nH]c(CCC(=O)N3CCC[C@H](N(C)C)C3)nc21	ZINC000176116881	402280788	/nfs/dbraw/zinc/28/07/88/402280788.db2.gz	IJPAEAGVCWJEEV-AWEZNQCLSA-N	0	3	314.433	2.357	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1ccc(C(C)=O)cc1	ZINC000110083088	402280854	/nfs/dbraw/zinc/28/08/54/402280854.db2.gz	IPCQBPGWIUFLIE-INIZCTEOSA-N	0	3	319.405	2.122	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1cc(F)cc(F)c1	ZINC000110087647	402281443	/nfs/dbraw/zinc/28/14/43/402281443.db2.gz	FNTMXDUCLJZBOL-AWEZNQCLSA-N	0	3	313.348	2.197	10	0		DEAEHN
C[C@@H]1CN(CCC(Cl)(Cl)Cl)C[C@@H]1N1CCOCC1	ZINC000184608713	402283982	/nfs/dbraw/zinc/28/39/82/402283982.db2.gz	ICKPPAZHWGFPCC-MNOVXSKESA-N	0	3	315.672	2.399	10	0		DEAEHN
Fc1ccc2oc(CN3CCN(C[C@@H]4CCOC4)CC3)nc2c1	ZINC000176218347	402291416	/nfs/dbraw/zinc/29/14/16/402291416.db2.gz	CRYOINNEPANANZ-ZDUSSCGKSA-N	0	3	319.380	2.121	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c1	ZINC000157122953	402292350	/nfs/dbraw/zinc/29/23/50/402292350.db2.gz	GPWUXMORYVIOIU-NVXWUHKLSA-N	0	3	315.417	2.201	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2cc(F)ccc2F)C1	ZINC000176257646	402294601	/nfs/dbraw/zinc/29/46/01/402294601.db2.gz	PQCSVLGTQXUYBK-CQSZACIVSA-N	0	3	311.376	2.291	10	0		DEAEHN
Cc1oc2ccccc2c1C(=O)NC[C@@H](O)CN1CCCCC1	ZINC000184727835	402295520	/nfs/dbraw/zinc/29/55/20/402295520.db2.gz	CSEHUHIDVARHNR-CQSZACIVSA-N	0	3	316.401	2.318	10	0		DEAEHN
Cc1cnc(CCN(C)C[C@H](O)COCc2ccco2)s1	ZINC000157669949	402297220	/nfs/dbraw/zinc/29/72/20/402297220.db2.gz	DMFXFPUJSKOXSE-ZDUSSCGKSA-N	0	3	310.419	2.097	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1cnn(CC(F)F)c1	ZINC000176363549	402303215	/nfs/dbraw/zinc/30/32/15/402303215.db2.gz	IITYKBXWMGESLM-LBPRGKRZSA-N	0	3	315.368	2.096	10	0		DEAEHN
CC(C)[C@@](C)(O)CN1CCCN(C(=O)c2ccccc2F)CC1	ZINC000184956448	402312353	/nfs/dbraw/zinc/31/23/53/402312353.db2.gz	OIGSTFYFMPJIPN-SFHVURJKSA-N	0	3	322.424	2.381	10	0		DEAEHN
O=C(OCc1ccccc1)N1CCC(COC2CNC2)CC1	ZINC000224598301	402314538	/nfs/dbraw/zinc/31/45/38/402314538.db2.gz	WYSLTXQPICQESE-UHFFFAOYSA-N	0	3	304.390	2.024	10	0		DEAEHN
OCC1(NCc2csc(Br)c2)CCOCC1	ZINC000225253397	402315919	/nfs/dbraw/zinc/31/59/19/402315919.db2.gz	SNHUARBHSCIMNM-UHFFFAOYSA-N	0	3	306.225	2.142	10	0		DEAEHN
Cn1cc(-c2cc(CN[C@H](CCO)C3CCCCC3)on2)cn1	ZINC000185057148	402321284	/nfs/dbraw/zinc/32/12/84/402321284.db2.gz	RGOZFPLTLINCGY-MRXNPFEDSA-N	0	3	318.421	2.496	10	0		DEAEHN
COC1(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)CCCCC1	ZINC000185897436	402387695	/nfs/dbraw/zinc/38/76/95/402387695.db2.gz	MKYRSROJPTURKX-LSDHHAIUSA-N	0	3	311.470	2.460	10	0		DEAEHN
CCOc1ncccc1NC(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000177027927	402360548	/nfs/dbraw/zinc/36/05/48/402360548.db2.gz	CZVVZFMYPDXAKF-JSGCOSHPSA-N	0	3	306.410	2.331	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCc1ccc(F)cc1	ZINC000177024733	402360714	/nfs/dbraw/zinc/36/07/14/402360714.db2.gz	USLQHNAUWHOSIQ-MRXNPFEDSA-N	0	3	307.413	2.494	10	0		DEAEHN
CC(C)C[C@H](C)C(=O)NCc1ccnc(OCCN(C)C)c1	ZINC000185549105	402360889	/nfs/dbraw/zinc/36/08/89/402360889.db2.gz	ODGVDZOYDCBVLM-AWEZNQCLSA-N	0	3	307.438	2.320	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCOc1cccc(C)c1	ZINC000177025110	402361125	/nfs/dbraw/zinc/36/11/25/402361125.db2.gz	NCVOCQRWOZWNRM-INIZCTEOSA-N	0	3	319.449	2.500	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@H]2COc3ccccc3C2)C1	ZINC000177058961	402365613	/nfs/dbraw/zinc/36/56/13/402365613.db2.gz	NAHTWISZCHQUTL-BMFZPTHFSA-N	0	3	302.418	2.083	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)c2ccc3c(c2)OCCCO3)[C@@H](C)C1	ZINC000177061485	402365736	/nfs/dbraw/zinc/36/57/36/402365736.db2.gz	DSGSXLXIXVRPMP-ZFWWWQNUSA-N	0	3	318.417	2.306	10	0		DEAEHN
C[C@@H]1CN(CCOc2ccc(Cl)cc2)C[C@@H]1N1CCOCC1	ZINC000177228770	402383201	/nfs/dbraw/zinc/38/32/01/402383201.db2.gz	DCWFHFBOYQRIEU-PBHICJAKSA-N	0	3	324.852	2.371	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@H](c2ccccc2F)C1)N(C)C	ZINC000161968804	402405316	/nfs/dbraw/zinc/40/53/16/402405316.db2.gz	BUNOYVOIFNNCTH-HOTGVXAUSA-N	0	3	308.397	2.456	10	0		DEAEHN
CC1(C)[C@H](N[C@@H]2CCS(=O)(=O)c3ccccc32)[C@H]2CCO[C@@H]21	ZINC000186210642	402410635	/nfs/dbraw/zinc/41/06/35/402410635.db2.gz	RGEASEOVDYMELY-XOUADPBQSA-N	0	3	321.442	2.308	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCc1ccc(C)nc1	ZINC000177506147	402410661	/nfs/dbraw/zinc/41/06/61/402410661.db2.gz	LEOLTHMMIYTWAZ-INIZCTEOSA-N	0	3	304.438	2.058	10	0		DEAEHN
CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000186225751	402412785	/nfs/dbraw/zinc/41/27/85/402412785.db2.gz	HTVDMMMZJAXPNA-ULQDDVLXSA-N	0	3	321.465	2.236	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(C)C[C@H]2CCCN2CC)s1	ZINC000177556432	402415797	/nfs/dbraw/zinc/41/57/97/402415797.db2.gz	KCHVAVLSYWHPNE-CYBMUJFWSA-N	0	3	324.494	2.374	10	0		DEAEHN
CC[C@H](CO)N1CCN(CCSCc2ccccc2)CC1	ZINC000186421630	402430351	/nfs/dbraw/zinc/43/03/51/402430351.db2.gz	RRMUUGQTTBOXAG-QGZVFWFLSA-N	0	3	308.491	2.308	10	0		DEAEHN
COc1ccc([C@H](C)CC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000246108273	402510639	/nfs/dbraw/zinc/51/06/39/402510639.db2.gz	BRGQQHPIHYECBT-ZBFHGGJFSA-N	0	3	302.418	2.495	10	0		DEAEHN
CC[C@@H]1CN(CCN2C(=O)CNC2=O)CC[C@H]1c1ccccc1	ZINC000245411206	402458133	/nfs/dbraw/zinc/45/81/33/402458133.db2.gz	VUNQGHVRFSUACA-GDBMZVCRSA-N	0	3	315.417	2.054	10	0		DEAEHN
CC(=O)c1c[nH]c(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)c1	ZINC000245434883	402460706	/nfs/dbraw/zinc/46/07/06/402460706.db2.gz	COMZWAYNNCVJJB-CABCVRRESA-N	0	3	303.406	2.305	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2c(C)onc2-c2ccccn2)C1	ZINC000178106308	402461179	/nfs/dbraw/zinc/46/11/79/402461179.db2.gz	KBJOZGJZJHOGNN-ZDUSSCGKSA-N	0	3	314.389	2.259	10	0		DEAEHN
CC(C)N(C)C(=O)[C@@H](C)N1CC[C@@H](CNc2ccccn2)C1	ZINC000245480619	402464877	/nfs/dbraw/zinc/46/48/77/402464877.db2.gz	XLVVJOXSZNCLJO-CABCVRRESA-N	0	3	304.438	2.071	10	0		DEAEHN
CCOCc1cc(CN2C[C@H](C(N)=O)CC[C@H]2C)ccc1OC	ZINC000245549050	402469758	/nfs/dbraw/zinc/46/97/58/402469758.db2.gz	YQWLDKVMEDIWEK-UKRRQHHQSA-N	0	3	320.433	2.318	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cn(C)nc1C(C)(C)C	ZINC000245551379	402469874	/nfs/dbraw/zinc/46/98/74/402469874.db2.gz	BFKMRVNXJPJNGD-STQMWFEESA-N	0	3	304.438	2.026	10	0		DEAEHN
COCOc1ccc(OC)cc1CN1CCN2CCCC[C@H]2C1	ZINC000245566172	402471810	/nfs/dbraw/zinc/47/18/10/402471810.db2.gz	SLXQDFIOCGMRHU-INIZCTEOSA-N	0	3	320.433	2.348	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1ccccc1SC	ZINC000186955582	402473861	/nfs/dbraw/zinc/47/38/61/402473861.db2.gz	XTNKLFZGPXOMPQ-GFCCVEGCSA-N	0	3	316.492	2.417	10	0		DEAEHN
Cc1noc([C@@H]2CCCN(C[C@@](C)(O)c3ccccc3)C2)n1	ZINC000246166230	402514566	/nfs/dbraw/zinc/51/45/66/402514566.db2.gz	BJZUDDIHMQQKIX-RHSMWYFYSA-N	0	3	301.390	2.465	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2ccc(Cl)c(F)c2)C[C@H]1C	ZINC000245685993	402479160	/nfs/dbraw/zinc/47/91/60/402479160.db2.gz	ANWFWOUESWAPAI-NEPJUHHUSA-N	0	3	300.805	2.366	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)CC(=O)N(C2CC2)C2CCCC2)C1	ZINC000187922745	402513077	/nfs/dbraw/zinc/51/30/77/402513077.db2.gz	DKRQRROQJPYSPH-KDOFPFPSSA-N	0	3	308.466	2.403	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N[C@@H]1CCCC[C@@H]1C	ZINC000178313874	402484005	/nfs/dbraw/zinc/48/40/05/402484005.db2.gz	WGLOVZNKDYYPRO-BHYGNILZSA-N	0	3	318.465	2.351	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc(OC3COC3)cc2)C1	ZINC000187159982	402485831	/nfs/dbraw/zinc/48/58/31/402485831.db2.gz	UKXICPYIOYOKIZ-CQSZACIVSA-N	0	3	319.405	2.070	10	0		DEAEHN
CN1C(=O)CCc2cc(CN[C@H]3Cc4ccccc4[C@@H]3O)ccc21	ZINC000187245389	402490033	/nfs/dbraw/zinc/49/00/33/402490033.db2.gz	WJDFLMXKBVWKLB-PXNSSMCTSA-N	0	3	322.408	2.344	10	0		DEAEHN
COc1ccc(CNC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)cc1	ZINC000245856425	402491273	/nfs/dbraw/zinc/49/12/73/402491273.db2.gz	DQKDHJVJLJYOGS-RDJZCZTQSA-N	0	3	317.433	2.321	10	0		DEAEHN
O=S1(=O)CC[C@H](N[C@@H]2C[C@H]3OCCC[C@H]23)c2ccccc21	ZINC000187283443	402491843	/nfs/dbraw/zinc/49/18/43/402491843.db2.gz	ZPSFZKWCOSUPEV-FAAHXZRKSA-N	0	3	307.415	2.062	10	0		DEAEHN
COc1cc(C[NH2+][C@H](C)CN(C)C)cc(Br)c1[O-]	ZINC000168715838	402497994	/nfs/dbraw/zinc/49/79/94/402497994.db2.gz	UTDSBLNEBOWHQG-SECBINFHSA-N	0	3	317.227	2.203	10	0		DEAEHN
CC(C)CN(CCN(C)C)C(=O)NCCCc1ccccn1	ZINC000178439403	402498873	/nfs/dbraw/zinc/49/88/73/402498873.db2.gz	ZDKKXZSNIZSBRK-UHFFFAOYSA-N	0	3	306.454	2.243	10	0		DEAEHN
Cc1cc(C)n2c(CN(C)C[C@H]3CCCC[C@H]3O)cnc2n1	ZINC000245951851	402500055	/nfs/dbraw/zinc/50/00/55/402500055.db2.gz	LFYRXOKRSMYVPY-GDBMZVCRSA-N	0	3	302.422	2.329	10	0		DEAEHN
C[C@@H](NC(C)(C)CNC(=O)CCCCC(N)=O)c1ccccc1	ZINC000187482300	402502803	/nfs/dbraw/zinc/50/28/03/402502803.db2.gz	MJSAUDPLMBSXNV-CQSZACIVSA-N	0	3	319.449	2.278	10	0		DEAEHN
C[N@@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)NCc2ccc([O-])c(F)c2)C1	ZINC000246016742	402503537	/nfs/dbraw/zinc/50/35/37/402503537.db2.gz	UNAXLXYSKFISAU-DZGCQCFKSA-N	0	3	321.396	2.157	10	0		DEAEHN
C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)NCc2ccc([O-])c(F)c2)C1	ZINC000246016742	402503539	/nfs/dbraw/zinc/50/35/39/402503539.db2.gz	UNAXLXYSKFISAU-DZGCQCFKSA-N	0	3	321.396	2.157	10	0		DEAEHN
Cc1noc([C@H]2CCCN(C[C@@](C)(O)c3ccccc3)C2)n1	ZINC000246166235	402514246	/nfs/dbraw/zinc/51/42/46/402514246.db2.gz	BJZUDDIHMQQKIX-WMLDXEAASA-N	0	3	301.390	2.465	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)n1	ZINC000178524171	402507203	/nfs/dbraw/zinc/50/72/03/402507203.db2.gz	OEKAVKGKOISMCY-OAGGEKHMSA-N	0	3	304.438	2.004	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)N2CCO[C@@H](c3ccsc3)C2)C1	ZINC000246707296	402541516	/nfs/dbraw/zinc/54/15/16/402541516.db2.gz	SDHLQWQQPZKRIB-DZGCQCFKSA-N	0	3	323.462	2.173	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCc2nccs2)[C@@H]1c1ccccc1	ZINC000179128870	402574681	/nfs/dbraw/zinc/57/46/81/402574681.db2.gz	UQHKUCRQWVHTPA-ZFWWWQNUSA-N	0	3	316.430	2.388	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@@H](C(=O)OC(C)(C)C)C1)N1[C@H](C)CC[C@@H]1C	ZINC000247129895	402557903	/nfs/dbraw/zinc/55/79/03/402557903.db2.gz	SFHIFSFJJRUMMK-LXTVHRRPSA-N	0	3	324.465	2.438	10	0		DEAEHN
Cc1cccc(O[C@H](C)C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000247207765	402560146	/nfs/dbraw/zinc/56/01/46/402560146.db2.gz	LWNKIBRCIKFMMG-BZUAXINKSA-N	0	3	302.418	2.457	10	0		DEAEHN
CCN1CCN(CCC(=O)Nc2cccc([C@@H](C)OC)c2)CC1	ZINC000171130333	402560384	/nfs/dbraw/zinc/56/03/84/402560384.db2.gz	XTPPZOUIPCUVHE-OAHLLOKOSA-N	0	3	319.449	2.360	10	0		DEAEHN
COCCCN(CCO)Cc1ccc(Br)c(F)c1	ZINC000189889362	402565214	/nfs/dbraw/zinc/56/52/14/402565214.db2.gz	PWMHNOARSWPUHB-UHFFFAOYSA-N	0	3	320.202	2.419	10	0		DEAEHN
COCCN1CCC(NC(=O)N[C@H](C)c2cc(C)oc2C)CC1	ZINC000171194900	402566038	/nfs/dbraw/zinc/56/60/38/402566038.db2.gz	LKVNQANMLDBQIM-CYBMUJFWSA-N	0	3	323.437	2.367	10	0		DEAEHN
C[C@@H](CN[C@@H](C)c1cccc(-n2ccnc2)c1)CS(C)(=O)=O	ZINC000189914499	402567204	/nfs/dbraw/zinc/56/72/04/402567204.db2.gz	PYGWVYFCSWMAGP-KBPBESRZSA-N	0	3	321.446	2.204	10	0		DEAEHN
CC(C)NC(=O)CCN(CCCO)Cc1cccc(Cl)c1	ZINC000179077724	402570543	/nfs/dbraw/zinc/57/05/43/402570543.db2.gz	ZXLFUOPORLQVPN-UHFFFAOYSA-N	0	3	312.841	2.439	10	0		DEAEHN
CCN(CCNC(=O)N1CCC[C@@H](C(F)(F)F)C1)C1CC1	ZINC000171252351	402571803	/nfs/dbraw/zinc/57/18/03/402571803.db2.gz	KOCLWZDIVLWMNR-LLVKDONJSA-N	0	3	307.360	2.455	10	0		DEAEHN
CCOCCC1(CNC(=O)N2CCCN(C3CC3)CC2)CC1	ZINC000179093540	402572118	/nfs/dbraw/zinc/57/21/18/402572118.db2.gz	JAKHVBYDTIEDOR-UHFFFAOYSA-N	0	3	309.454	2.073	10	0		DEAEHN
Cc1cnc(CCN(C)C(=O)NCCN2CCC(C)CC2)s1	ZINC000179141543	402575860	/nfs/dbraw/zinc/57/58/60/402575860.db2.gz	FPVGZAWTUIQWHR-UHFFFAOYSA-N	0	3	324.494	2.367	10	0		DEAEHN
CCOC(=O)CCN1C[C@H](C(=O)OC)C[C@H](c2ccccc2)C1	ZINC000246196090	402517813	/nfs/dbraw/zinc/51/78/13/402517813.db2.gz	AGOVXMGEGTXHKW-JKSUJKDBSA-N	0	3	319.401	2.218	10	0		DEAEHN
COC(=O)Cc1cccc(C(=O)NCCN2CCCC[C@H]2C)c1	ZINC000188264038	402518310	/nfs/dbraw/zinc/51/83/10/402518310.db2.gz	YXVALMUZODQRBJ-CQSZACIVSA-N	0	3	318.417	2.006	10	0		DEAEHN
CCN(C(=O)[C@H](C)N1CCN2CCC[C@H]2C1)C1CCCCC1	ZINC000246228836	402518911	/nfs/dbraw/zinc/51/89/11/402518911.db2.gz	CDBVHTGCRIJGIL-RDJZCZTQSA-N	0	3	307.482	2.336	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@H](CC(C)C)N2CCCCC2=O)C1	ZINC000246219777	402519018	/nfs/dbraw/zinc/51/90/18/402519018.db2.gz	VAXPXIFJQOAYQK-CVEARBPZSA-N	0	3	323.481	2.014	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@H](C)Oc2ccc(F)cc2)C1	ZINC000246307685	402523856	/nfs/dbraw/zinc/52/38/56/402523856.db2.gz	NMXBPVRJAKDTCG-DZGCQCFKSA-N	0	3	323.412	2.377	10	0		DEAEHN
Cc1noc(C)c1C[C@H](C)NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000246405223	402528901	/nfs/dbraw/zinc/52/89/01/402528901.db2.gz	RTLMGXQKMNTGHL-SLEUVZQESA-N	0	3	322.453	2.347	10	0		DEAEHN
Cc1cccc(C(C)C)c1NC(=O)C(=O)N1CC[C@@H](N(C)C)C1	ZINC000170845126	402532091	/nfs/dbraw/zinc/53/20/91/402532091.db2.gz	MGLAZTSVZATLRC-CQSZACIVSA-N	0	3	317.433	2.219	10	0		DEAEHN
Cc1nc2cc(F)cc(C(=O)N3CC[C@H](N(C)C)C3)c2nc1C	ZINC000170864875	402535208	/nfs/dbraw/zinc/53/52/08/402535208.db2.gz	WXAAQFPXJLOTHV-ZDUSSCGKSA-N	0	3	316.380	2.162	10	0		DEAEHN
C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000170866547	402535226	/nfs/dbraw/zinc/53/52/26/402535226.db2.gz	WNRRZMGFOSBGMF-KCXAZCMYSA-N	0	3	315.417	2.057	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CC1(CC(=O)OC)CCCC1	ZINC000189378130	402535712	/nfs/dbraw/zinc/53/57/12/402535712.db2.gz	DYBYWXGBPUCVRR-HNNXBMFYSA-N	0	3	324.465	2.443	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)COc2ccc(F)c(Cl)c2)C1	ZINC000170867610	402535872	/nfs/dbraw/zinc/53/58/72/402535872.db2.gz	IDEQVEHIKDSIQR-JTQLQIEISA-N	0	3	300.761	2.020	10	0		DEAEHN
CN(C)CCNC(=O)NCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000179219372	402582135	/nfs/dbraw/zinc/58/21/35/402582135.db2.gz	OOLMFFOSWHKIFC-UHFFFAOYSA-N	0	3	321.421	2.003	10	0		DEAEHN
C[C@H]1CCCN(c2cc(N3CCCN(C4CC4)CC3)ncn2)C1	ZINC000171831407	402626905	/nfs/dbraw/zinc/62/69/05/402626905.db2.gz	DUXZTGGONKRTAU-HNNXBMFYSA-N	0	3	315.465	2.387	10	0		DEAEHN
c1nn2ccccc2c1CN1CCCC[C@@H]1CN1CCOCC1	ZINC000179393089	402588507	/nfs/dbraw/zinc/58/85/07/402588507.db2.gz	SYJPMMKSXIYKAH-QGZVFWFLSA-N	0	3	314.433	2.021	10	0		DEAEHN
CCN(C)[C@@H](C(=O)N[C@H]1CCCN(CC)C1)c1ccccc1	ZINC000171479451	402589542	/nfs/dbraw/zinc/58/95/42/402589542.db2.gz	MVWKJANQQVDEEC-DLBZAZTESA-N	0	3	303.450	2.280	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2ccc3c(c2)CCCC(=O)N3)C1	ZINC000171522977	402591087	/nfs/dbraw/zinc/59/10/87/402591087.db2.gz	KQMTYIQYQNDWOP-CQSZACIVSA-N	0	3	316.405	2.129	10	0		DEAEHN
CCCCN(CCO)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179473315	402591379	/nfs/dbraw/zinc/59/13/79/402591379.db2.gz	ZSMPEKLQGUKXPK-DLBZAZTESA-N	0	3	319.449	2.236	10	0		DEAEHN
O=C(c1cc(F)c(F)c(F)c1F)N1CCN2CCC[C@H]2C1	ZINC000171585819	402597786	/nfs/dbraw/zinc/59/77/86/402597786.db2.gz	ZSDKKXWNNVACBD-QMMMGPOBSA-N	0	3	302.271	2.163	10	0		DEAEHN
C[C@@H]1CN(CCC(Cl)(Cl)Cl)C[C@H]1N1CCOCC1	ZINC000248611069	402598840	/nfs/dbraw/zinc/59/88/40/402598840.db2.gz	ICKPPAZHWGFPCC-GHMZBOCLSA-N	0	3	315.672	2.399	10	0		DEAEHN
C[C@H](C(=O)Nc1cc(F)ccc1F)N1CCN2CCC[C@@H]2C1	ZINC000171639035	402604398	/nfs/dbraw/zinc/60/43/98/402604398.db2.gz	ICFUYSMVCGPDPR-DGCLKSJQSA-N	0	3	309.360	2.072	10	0		DEAEHN
CCO[C@H]1C[C@@H](O)C12CCN(Cc1ccc(O)c(OC)c1)CC2	ZINC000180086789	402607074	/nfs/dbraw/zinc/60/70/74/402607074.db2.gz	FQNKSMFTKZPHSV-SJORKVTESA-N	0	3	321.417	2.153	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)[C@H]2CCOC[C@H]2C)CN1Cc1ccccc1	ZINC000248833271	402610054	/nfs/dbraw/zinc/61/00/54/402610054.db2.gz	MXPDGWRZQNSISH-FZCLSBEQSA-N	0	3	316.445	2.438	10	0		DEAEHN
CN(CC(=O)OC(C)(C)C)C1CCN(Cc2cccn2C)CC1	ZINC000190583893	402611243	/nfs/dbraw/zinc/61/12/43/402611243.db2.gz	GBHSPOCMGXUMAW-UHFFFAOYSA-N	0	3	321.465	2.263	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1csc(C(F)(F)F)n1	ZINC000248913294	402614432	/nfs/dbraw/zinc/61/44/32/402614432.db2.gz	NPAXTZPTXVADBU-IUCAKERBSA-N	0	3	319.352	2.471	10	0		DEAEHN
CCn1cc([C@H](C)N[C@@H]2CCc3nnc(C(C)C)n3C2)cn1	ZINC000180535851	402619007	/nfs/dbraw/zinc/61/90/07/402619007.db2.gz	KSRQWBZHUKEVRW-GXTWGEPZSA-N	0	3	302.426	2.284	10	0		DEAEHN
CCS(=O)(=O)CCCCCN1CC[C@@]2(O)CCCC[C@H]2C1	ZINC000249115891	402621270	/nfs/dbraw/zinc/62/12/70/402621270.db2.gz	RWFVFYUVDOCMRO-HOTGVXAUSA-N	0	3	317.495	2.218	10	0		DEAEHN
CCOc1ncc(C(=O)N[C@@H]2CCCN(CC)C2)cc1Cl	ZINC000171804579	402623579	/nfs/dbraw/zinc/62/35/79/402623579.db2.gz	OOIMAGPFHQWOSK-GFCCVEGCSA-N	0	3	311.813	2.348	10	0		DEAEHN
O=C(N[C@@H]1CCCOc2ccccc21)N1CCN2CCC[C@@H]2C1	ZINC000171906210	402632736	/nfs/dbraw/zinc/63/27/36/402632736.db2.gz	PDGDUVSXXDWPAP-GDBMZVCRSA-N	0	3	315.417	2.390	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccc(OC[C@H]2CCCO2)cc1	ZINC000249732773	402639572	/nfs/dbraw/zinc/63/95/72/402639572.db2.gz	BMURQYZGWZOIEM-DOTOQJQBSA-N	0	3	318.417	2.068	10	0		DEAEHN
CC[C@H](NC(=O)N1CCO[C@H](CN(C)C)C1)c1ccc(C)cc1	ZINC000172115765	402640739	/nfs/dbraw/zinc/64/07/39/402640739.db2.gz	FWWBXHDPYHQMQB-SJORKVTESA-N	0	3	319.449	2.418	10	0		DEAEHN
COc1ccc([C@H](C)N[C@@H]2C[C@@H](O)C2(C)C)cc1NC(C)=O	ZINC000249788285	402641944	/nfs/dbraw/zinc/64/19/44/402641944.db2.gz	DUMPVKPRDJHWGM-AMKSKSKJSA-N	0	3	306.406	2.464	10	0		DEAEHN
O=C(Cc1coc(-c2ccc(F)cc2)n1)NCCN1CCCC1	ZINC000172166699	402643140	/nfs/dbraw/zinc/64/31/40/402643140.db2.gz	NHUYACOVSASHPC-UHFFFAOYSA-N	0	3	317.364	2.235	10	0		DEAEHN
COC[C@@H](N[C@@H](CO)c1cccc(Br)c1)C1CC1	ZINC000181391020	402644170	/nfs/dbraw/zinc/64/41/70/402644170.db2.gz	XOIBIQOHMKBJEW-UONOGXRCSA-N	0	3	314.223	2.497	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)C1	ZINC000250153249	402645491	/nfs/dbraw/zinc/64/54/91/402645491.db2.gz	LICJLUIAKMDEEZ-XHSDSOJGSA-N	0	3	305.397	2.465	10	0		DEAEHN
Cc1ccccc1C(C)(C)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000172304903	402649149	/nfs/dbraw/zinc/64/91/49/402649149.db2.gz	YHTJPZIJBGRCRI-HNNXBMFYSA-N	0	3	304.434	2.062	10	0		DEAEHN
Cc1ccccc1C(C)(C)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000172304900	402649189	/nfs/dbraw/zinc/64/91/89/402649189.db2.gz	YHTJPZIJBGRCRI-OAHLLOKOSA-N	0	3	304.434	2.062	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](C)c1ccccc1)N1CCCN(C2CC2)CC1	ZINC000172347175	402651206	/nfs/dbraw/zinc/65/12/06/402651206.db2.gz	SLBYRUJKYZOTBH-JKSUJKDBSA-N	0	3	315.461	2.422	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)NCc1ccc(Cl)cc1	ZINC000172346942	402651842	/nfs/dbraw/zinc/65/18/42/402651842.db2.gz	XARCJMLXZDRNJQ-UHFFFAOYSA-N	0	3	321.852	2.126	10	0		DEAEHN
C[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)c1nccn1C	ZINC000182639525	402705779	/nfs/dbraw/zinc/70/57/79/402705779.db2.gz	XUNOKVUROIYNII-CQSZACIVSA-N	0	3	312.417	2.376	10	0		DEAEHN
CN1C(=O)C[C@H](NCCn2cccn2)[C@H]1c1ccc(Cl)cc1	ZINC000192151185	402714630	/nfs/dbraw/zinc/71/46/30/402714630.db2.gz	MSKMMKIUYDQVRC-GOEBONIOSA-N	0	3	318.808	2.098	10	0		DEAEHN
COC(=O)CCCN[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1	ZINC000192150665	402714705	/nfs/dbraw/zinc/71/47/05/402714705.db2.gz	KCYAHDYQFODTIZ-BBRMVZONSA-N	0	3	324.808	2.155	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)Nc1ccc2c(c1)CCO2	ZINC000261640007	402715023	/nfs/dbraw/zinc/71/50/23/402715023.db2.gz	DSYFXQHANLLIRE-JOQOYGCGSA-N	0	3	316.401	2.093	10	0		DEAEHN
Cc1ccccc1CS(=O)(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000173886129	402716802	/nfs/dbraw/zinc/71/68/02/402716802.db2.gz	VALPADTZYZLVQD-HOCLYGCPSA-N	0	3	310.463	2.143	10	0		DEAEHN
O=C1[C@@H](N2CCN3CCC[C@@H]3C2)CCN1c1ccc(Cl)cc1	ZINC000172624699	402666675	/nfs/dbraw/zinc/66/66/75/402666675.db2.gz	DGXSIQRGOXQRIR-CVEARBPZSA-N	0	3	319.836	2.225	10	0		DEAEHN
COC(=O)[C@@H](C)Oc1ccc(CN[C@@H]2C[C@H]3CC[C@@H]2O3)cc1	ZINC000182224697	402674033	/nfs/dbraw/zinc/67/40/33/402674033.db2.gz	VVWNMUARAJJXSW-MPESAESLSA-N	0	3	305.374	2.036	10	0		DEAEHN
Cc1nc(C)c(CN2CCCC[C@H]2CN2CCOCC2)s1	ZINC000172802074	402676210	/nfs/dbraw/zinc/67/62/10/402676210.db2.gz	ZDBDTICSXVHRTE-HNNXBMFYSA-N	0	3	309.479	2.447	10	0		DEAEHN
c1cc(OCCCN2CCN3CCCC[C@@H]3C2)cc2c1OCO2	ZINC000172805339	402676581	/nfs/dbraw/zinc/67/65/81/402676581.db2.gz	QNHXGULHRNODJW-OAHLLOKOSA-N	0	3	318.417	2.354	10	0		DEAEHN
Cc1nc(CC2CC2)sc1C(=O)NC[C@H]1CCCN(C)C1	ZINC000191571674	402679447	/nfs/dbraw/zinc/67/94/47/402679447.db2.gz	QXSTWFBAIGUTAZ-CYBMUJFWSA-N	0	3	307.463	2.476	10	0		DEAEHN
CCOC(=O)c1csc(C2CCN(CCCCO)CC2)n1	ZINC000191575639	402680031	/nfs/dbraw/zinc/68/00/31/402680031.db2.gz	UCCOOZPPXCUDDY-UHFFFAOYSA-N	0	3	312.435	2.272	10	0		DEAEHN
COc1cccc(CCN[C@@H]2CCCC[C@H]2S(C)(=O)=O)c1	ZINC000182464088	402692219	/nfs/dbraw/zinc/69/22/19/402692219.db2.gz	YOEXFWBCAJTGLG-HZPDHXFCSA-N	0	3	311.447	2.183	10	0		DEAEHN
Cc1ccc(/C=C\CC(=O)NCCCN2CCN(C)CC2)cc1	ZINC000255847146	402697047	/nfs/dbraw/zinc/69/70/47/402697047.db2.gz	PTWLVWBRWIAORB-HYXAFXHYSA-N	0	3	315.461	2.152	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)N1CCc2ccc(F)cc21	ZINC000261964697	402720883	/nfs/dbraw/zinc/72/08/83/402720883.db2.gz	YEVDXIJEDYLJIU-DDUZABMNSA-N	0	3	318.392	2.247	10	0		DEAEHN
COc1cccc(F)c1[C@H](C)NC(=O)NC[C@H]1CCCN1C	ZINC000174355578	402737938	/nfs/dbraw/zinc/73/79/38/402737938.db2.gz	DZUNFBSJBVBVJM-NWDGAFQWSA-N	0	3	309.385	2.289	10	0		DEAEHN
C[C@H](NCc1ccc(S(=O)(=O)C(F)F)cc1)[C@H]1CCCO1	ZINC000183125195	402741347	/nfs/dbraw/zinc/74/13/47/402741347.db2.gz	WSTRGUIDVPONDK-GXFFZTMASA-N	0	3	319.373	2.340	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(C2(c3cccc(F)c3)CCC2)n1	ZINC000263292587	402755359	/nfs/dbraw/zinc/75/53/59/402755359.db2.gz	VUQRZCUCSJUMLM-AWEZNQCLSA-N	0	3	316.380	2.255	10	0		DEAEHN
COc1ccc(C)cc1/C=C/c1nc([C@H]2CNCCN2C)no1	ZINC000263297801	402755714	/nfs/dbraw/zinc/75/57/14/402755714.db2.gz	WOSYFZZBIPIFPC-HZRUHFOJSA-N	0	3	314.389	2.133	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cnc2ccccc2n1	ZINC000174985507	402769280	/nfs/dbraw/zinc/76/92/80/402769280.db2.gz	AKVKWUYAVHLWGQ-UONOGXRCSA-N	0	3	310.401	2.329	10	0		DEAEHN
CN(C)c1ccncc1C(=O)NC[C@@H](c1ccccc1)N(C)C	ZINC000183466978	402769788	/nfs/dbraw/zinc/76/97/88/402769788.db2.gz	SIOLAJHOUUEJQC-KRWDZBQOSA-N	0	3	312.417	2.180	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@H]2C[NH2+]CC[C@@H]2C)c(Cl)cc1F	ZINC000193399908	402770860	/nfs/dbraw/zinc/77/08/60/402770860.db2.gz	XTEAGIINMUMSMZ-UFBFGSQYSA-N	0	3	320.817	2.064	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc([S@](C)=O)cc1	ZINC000175037379	402773451	/nfs/dbraw/zinc/77/34/51/402773451.db2.gz	YNBUQIWYNUDOIW-HLFMIMNKSA-N	0	3	320.458	2.123	10	0		DEAEHN
CN(C(=O)c1cnn(CCC(F)(F)F)c1)[C@H]1CCCN(C)C1	ZINC000182870431	402723319	/nfs/dbraw/zinc/72/33/19/402723319.db2.gz	KBZRVVYBFVRFIT-LBPRGKRZSA-N	0	3	318.343	2.002	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc(NC(C)=O)cc2)C1	ZINC000194326835	402792338	/nfs/dbraw/zinc/79/23/38/402792338.db2.gz	RWPQDGFPYGSBLS-OAHLLOKOSA-N	0	3	304.394	2.251	10	0		DEAEHN
C=Cn1cc(CN[C@@H]2CCN(c3ncccc3Cl)C2)cn1	ZINC000194365147	402794343	/nfs/dbraw/zinc/79/43/43/402794343.db2.gz	BFXNRSDTLLMGMO-CYBMUJFWSA-N	0	3	303.797	2.401	10	0		DEAEHN
O=C(CCCOCCc1ccccc1)N1CCN2CCC[C@@H]2C1	ZINC000195335074	402842310	/nfs/dbraw/zinc/84/23/10/402842310.db2.gz	PITRVQQAQXTFNI-GOSISDBHSA-N	0	3	316.445	2.333	10	0		DEAEHN
CCC[N@H+](C)C[C@H]1CCN(C(=O)c2cccc(OC)c2[O-])C1	ZINC000175313135	402796723	/nfs/dbraw/zinc/79/67/23/402796723.db2.gz	GTQFTCPIPLSZEX-CYBMUJFWSA-N	0	3	306.406	2.205	10	0		DEAEHN
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cccc(OC)c2[O-])C1	ZINC000175313135	402796725	/nfs/dbraw/zinc/79/67/25/402796725.db2.gz	GTQFTCPIPLSZEX-CYBMUJFWSA-N	0	3	306.406	2.205	10	0		DEAEHN
Cc1cc(CCCC(=O)N2CCO[C@H](CN(C)C)C2)c(C)s1	ZINC000175421323	402805315	/nfs/dbraw/zinc/80/53/15/402805315.db2.gz	DCIKNSGCNIZFNM-MRXNPFEDSA-N	0	3	324.490	2.477	10	0		DEAEHN
CCCN(C)c1ccc(C(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000195339377	402842906	/nfs/dbraw/zinc/84/29/06/402842906.db2.gz	ZAXJFDLRLHFOHP-QGZVFWFLSA-N	0	3	301.434	2.453	10	0		DEAEHN
COc1ccc(OCCCC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000194736420	402813463	/nfs/dbraw/zinc/81/34/63/402813463.db2.gz	HTUORDYXUMBQGW-AWEZNQCLSA-N	0	3	306.406	2.065	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)Nc1ccc(OCCN(C)C)cc1	ZINC000194068958	402783449	/nfs/dbraw/zinc/78/34/49/402783449.db2.gz	RNTMACNLDIFSID-CJNGLKHVSA-N	0	3	306.406	2.238	10	0		DEAEHN
CC(C)OC(=O)C[C@H]1CCCN(C[C@H](O)COC(C)(C)C)C1	ZINC000184452533	402844896	/nfs/dbraw/zinc/84/48/96/402844896.db2.gz	OCIWVUGEKBDIQV-CABCVRRESA-N	0	3	315.454	2.216	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)N(C)CCN(C)C2CC2)c1	ZINC000184453476	402844964	/nfs/dbraw/zinc/84/49/64/402844964.db2.gz	VDZSQSKBVYFOAQ-UHFFFAOYSA-N	0	3	318.421	2.227	10	0		DEAEHN
CC(C)CCNC(=O)[C@H](C)N1CC[C@H](CNc2ccccn2)C1	ZINC000195515890	402848919	/nfs/dbraw/zinc/84/89/19/402848919.db2.gz	AAUOTJHZEUEAMH-JKSUJKDBSA-N	0	3	318.465	2.366	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@H]1NCc1ccc(F)c(Br)c1	ZINC000282043150	403116354	/nfs/dbraw/zinc/11/63/54/403116354.db2.gz	AROPHZCZFDFPOX-PRHODGIISA-N	0	3	315.186	2.345	10	0		DEAEHN
CN(CCCCO)Cc1ccc(I)cc1	ZINC000276325337	403163696	/nfs/dbraw/zinc/16/36/96/403163696.db2.gz	DXYAOJYLDMHLSJ-UHFFFAOYSA-N	0	3	319.186	2.496	10	0		DEAEHN
CCO[C@@H]1C[C@H](N(C)C(=O)NC2CCN(C)CC2)C12CCCC2	ZINC000152899145	286318564	/nfs/dbraw/zinc/31/85/64/286318564.db2.gz	OMIKTXLUOZEKET-JKSUJKDBSA-N	0	3	323.481	2.460	10	0		DEAEHN
c1[nH]c(-c2ccccc2)nc1CNCC1(N2CCOCC2)CC1	ZINC000277519705	403226419	/nfs/dbraw/zinc/22/64/19/403226419.db2.gz	SJDFOAUGMQSWQN-UHFFFAOYSA-N	0	3	312.417	2.031	10	0		DEAEHN
c1nc(-c2ccccc2)[nH]c1CNCC1(N2CCOCC2)CC1	ZINC000277519705	403226422	/nfs/dbraw/zinc/22/64/22/403226422.db2.gz	SJDFOAUGMQSWQN-UHFFFAOYSA-N	0	3	312.417	2.031	10	0		DEAEHN
CCO[C@@H]1C[C@H](N(C)C[C@H](C)CS(C)(=O)=O)C12CCCC2	ZINC000246442993	286333177	/nfs/dbraw/zinc/33/31/77/286333177.db2.gz	DNWJQMYWVAYJKQ-SOUVJXGZSA-N	0	3	317.495	2.337	10	0		DEAEHN
CN(C)CC1(NC(=O)c2ccc3c(c2)NC(=O)C3(C)C)CCC1	ZINC000293493996	403487205	/nfs/dbraw/zinc/48/72/05/403487205.db2.gz	AUZRLHZLBYLMEN-UHFFFAOYSA-N	0	3	315.417	2.130	10	0		DEAEHN
CN1CCC[C@@]2(CCN(C(=O)c3cc4c(s3)CCOC4)C2)C1	ZINC000293926799	403601092	/nfs/dbraw/zinc/60/10/92/403601092.db2.gz	IVVOQZYRCATWNU-QGZVFWFLSA-N	0	3	320.458	2.379	10	0		DEAEHN
C(CN1CCCCC1)O[C@H]1CCN(c2nnc(C3CC3)s2)C1	ZINC000301858461	403692238	/nfs/dbraw/zinc/69/22/38/403692238.db2.gz	SGGCTZVGVPGHSI-AWEZNQCLSA-N	0	3	322.478	2.497	10	0		DEAEHN
O=C(CN1CCCC[C@@H]1[C@H]1CCC[C@H]1O)NCc1ccccc1	ZINC000303678954	403755922	/nfs/dbraw/zinc/75/59/22/403755922.db2.gz	RGZFSBJEOYKMJH-KZNAEPCWSA-N	0	3	316.445	2.318	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)[C@H](C)N[C@@H]1CCOC1(C)C	ZINC000295366579	403884598	/nfs/dbraw/zinc/88/45/98/403884598.db2.gz	ZOLGPKRSWHLLAA-XHDPSFHLSA-N	0	3	304.390	2.373	10	0		DEAEHN
COC(C)(C)C(=O)N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000323650725	404092739	/nfs/dbraw/zinc/09/27/39/404092739.db2.gz	WRRGCAQHCQINGP-HNNXBMFYSA-N	0	3	304.434	2.392	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(Cc2ccc(CO)o2)C1	ZINC000328646206	404121527	/nfs/dbraw/zinc/12/15/27/404121527.db2.gz	SNGDKAOIGPQJKI-INIZCTEOSA-N	0	3	315.417	2.121	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(-c2nc([C@H]3CC(=O)N(C)C3)no2)s1	ZINC000329748019	404439247	/nfs/dbraw/zinc/43/92/47/404439247.db2.gz	ZUAWINOIZMDPEH-BDAKNGLRSA-N	0	3	322.390	2.155	10	0		DEAEHN
COCCCN1CCC(NC(=O)N2CCCC23CCC3)CC1	ZINC000373099068	404528474	/nfs/dbraw/zinc/52/84/74/404528474.db2.gz	MDCUVIIOIJFMAI-UHFFFAOYSA-N	0	3	309.454	2.215	10	0		DEAEHN
c1ccc(CN2CC[C@@H](N3CCO[C@@]4(CCCOC4)C3)C2)cc1	ZINC000297285846	404534817	/nfs/dbraw/zinc/53/48/17/404534817.db2.gz	ACTSGTHRVZVUGL-MOPGFXCFSA-N	0	3	316.445	2.142	10	0		DEAEHN
C[C@@H]1[C@@H](C)N(C(=O)c2cccc(CN3CCCC3)c2)CCN1C	ZINC000356886076	404717016	/nfs/dbraw/zinc/71/70/16/404717016.db2.gz	SRBCWNQXDMNFPR-HZPDHXFCSA-N	0	3	315.461	2.447	10	0		DEAEHN
COc1ccc2c(c1)CCN(C[C@@H](O)CC(F)(F)F)CC2	ZINC000375981588	404783052	/nfs/dbraw/zinc/78/30/52/404783052.db2.gz	RLYWGEUFXULDJG-ZDUSSCGKSA-N	0	3	303.324	2.409	10	0		DEAEHN
C[NH+]1CCC2(CCCN(C(=O)/C=C/c3cncc([O-])c3)C2)CC1	ZINC000366846318	404856518	/nfs/dbraw/zinc/85/65/18/404856518.db2.gz	BICDPXHBDODUGE-ONEGZZNKSA-N	0	3	315.417	2.135	10	0		DEAEHN
C[C@](O)(CN1CCC(C(=O)N2CCCCC2)CC1)C(F)(F)F	ZINC000366847497	404857415	/nfs/dbraw/zinc/85/74/15/404857415.db2.gz	SQMATSDSLJEBDZ-AWEZNQCLSA-N	0	3	322.371	2.024	10	0		DEAEHN
CC(C)C[C@@H](C)C(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000361209614	404974529	/nfs/dbraw/zinc/97/45/29/404974529.db2.gz	HFLCSJJNTAWFNY-VQIMIIECSA-N	0	3	318.461	2.422	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@@H](C)NC1CCS(=O)(=O)CC1	ZINC000408241170	405150329	/nfs/dbraw/zinc/15/03/29/405150329.db2.gz	HZBGXWOVZSSKPF-LLVKDONJSA-N	0	3	313.467	2.174	10	0		DEAEHN
C(CN1CCCCC1)O[C@@H]1CCN(c2nc(C3CCC3)no2)C1	ZINC000568474251	292342312	/nfs/dbraw/zinc/34/23/12/292342312.db2.gz	ZOMBPJIFLRCSMQ-OAHLLOKOSA-N	0	3	320.437	2.418	10	0		DEAEHN
CC(C)(C)c1nnsc1C(=O)N[C@@H]1CCN2CCCC[C@@H]12	ZINC000408320362	405172710	/nfs/dbraw/zinc/17/27/10/405172710.db2.gz	KZCFXWHMMSLQOO-MNOVXSKESA-N	0	3	308.451	2.192	10	0		DEAEHN
C[C@@H](C(=O)NCCNc1ccncc1)c1cccc(Cl)c1	ZINC000439040995	405263507	/nfs/dbraw/zinc/26/35/07/405263507.db2.gz	PCXXEKAPACPHLD-GFCCVEGCSA-N	0	3	303.793	2.489	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@H]1C[C@@H]1c1cccc(F)c1F	ZINC000439044797	405263615	/nfs/dbraw/zinc/26/36/15/405263615.db2.gz	ZXJFMQXEYRVKPQ-KGLIPLIRSA-N	0	3	317.339	2.114	10	0		DEAEHN
CN1CC[C@@H]2CN(C(=O)[C@H]3C[C@@H]3c3cc(F)ccc3F)C[C@@H]21	ZINC000453036292	405277623	/nfs/dbraw/zinc/27/76/23/405277623.db2.gz	NVZBGRJYHRCQSV-ILHHOCCXSA-N	0	3	306.356	2.231	10	0		DEAEHN
CN(C[C@@H]1CCCN1C)C(=O)c1ncsc1Br	ZINC000421710049	405604210	/nfs/dbraw/zinc/60/42/10/405604210.db2.gz	IMCKNQXVJROJIR-QMMMGPOBSA-N	0	3	318.240	2.072	10	0		DEAEHN
O=C(NCCNc1ccncc1)NCC[C@H]1CCc2ccccc21	ZINC000458922007	405655248	/nfs/dbraw/zinc/65/52/48/405655248.db2.gz	NLJZKFDONYCWPF-MRXNPFEDSA-N	0	3	324.428	2.335	10	0		DEAEHN
COc1nsc(CNCCCCCO)c1Br	ZINC000639117016	405896071	/nfs/dbraw/zinc/89/60/71/405896071.db2.gz	AXZIFWAAALKTGT-UHFFFAOYSA-N	0	3	309.229	2.166	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N[C@H](C)CN2CCCCC2)c1	ZINC000457430748	405840599	/nfs/dbraw/zinc/84/05/99/405840599.db2.gz	BGQSXRICBFOWBX-CQSZACIVSA-N	0	3	318.417	2.386	10	0		DEAEHN
COC[C@@H](NC(=O)NC[C@H]1CCCN(C)C1)c1ccc(F)cc1	ZINC000530768858	405857299	/nfs/dbraw/zinc/85/72/99/405857299.db2.gz	DNSSEZZNLJDYAR-CZUORRHYSA-N	0	3	323.412	2.154	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCC(CCC(=O)OC)CC1	ZINC000531476547	405964733	/nfs/dbraw/zinc/96/47/33/405964733.db2.gz	FXZRFMQHWAIMHL-HNNXBMFYSA-N	0	3	310.438	2.053	10	0		DEAEHN
CCCN(C)CC(=O)N1CCC[C@H](CC(=O)OC(C)(C)C)C1	ZINC000531615529	405984724	/nfs/dbraw/zinc/98/47/24/405984724.db2.gz	QXKQGFLWQZHUFY-CQSZACIVSA-N	0	3	312.454	2.299	10	0		DEAEHN
c1nc2n(n1)[C@@H](CN1CC(c3nc4ccccc4s3)C1)CC2	ZINC000639555696	406144589	/nfs/dbraw/zinc/14/45/89/406144589.db2.gz	REHCQEMXNUFYBZ-GFCCVEGCSA-N	0	3	311.414	2.475	10	0		DEAEHN
c1nc([C@H]2CCCN(CCc3cnccn3)C2)n2c1CCCC2	ZINC000639626332	406175711	/nfs/dbraw/zinc/17/57/11/406175711.db2.gz	PACIGBCAFRIHMC-HNNXBMFYSA-N	0	3	311.433	2.432	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@H]1CCO[C@H](C2CC2)C1	ZINC000487533371	406242174	/nfs/dbraw/zinc/24/21/74/406242174.db2.gz	DRCSWRCARUTESH-GWCFXTLKSA-N	0	3	314.227	2.230	10	0		DEAEHN
COC[C@@H](O)CN1CCC[C@H](c2nc3ccccc3s2)C1	ZINC000537516691	406293364	/nfs/dbraw/zinc/29/33/64/406293364.db2.gz	FSLUXLNCMRMBHK-STQMWFEESA-N	0	3	306.431	2.483	10	0		DEAEHN
CC[C@@H](Oc1cccc(C)c1)C(=O)NCCNc1ccncc1	ZINC000488580093	406332643	/nfs/dbraw/zinc/33/26/43/406332643.db2.gz	KLLTVAIFZUNLHN-QGZVFWFLSA-N	0	3	313.401	2.198	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NC1(C)CCCCC1	ZINC000637938474	406485624	/nfs/dbraw/zinc/48/56/24/406485624.db2.gz	YLXOARRMLZQFBA-MRXNPFEDSA-N	0	3	303.450	2.285	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)Nc1ccc(OC2COC2)cc1	ZINC000547739719	406440926	/nfs/dbraw/zinc/44/09/26/406440926.db2.gz	UKXHPGGMLLIDAQ-MRXNPFEDSA-N	0	3	304.390	2.277	10	0		DEAEHN
C[C@H](NC(=O)[C@H](N)CN(C)Cc1ccccc1)c1ccccc1	ZINC000637868003	406453580	/nfs/dbraw/zinc/45/35/80/406453580.db2.gz	LFWNSPOWOQCFMF-MAUKXSAKSA-N	0	3	311.429	2.323	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H]1OCC[C@@H]1N)c1ccc(Cl)c(Cl)c1	ZINC000637884896	406462522	/nfs/dbraw/zinc/46/25/22/406462522.db2.gz	UWOKJIVDPYJOCU-VSYUYLJXSA-N	0	3	303.189	2.287	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N(C)CCN1CCCC1)C2	ZINC000526001964	406530601	/nfs/dbraw/zinc/53/06/01/406530601.db2.gz	AIUQHGLFUBTYTC-CQSZACIVSA-N	0	3	318.465	2.192	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)N(C)CCN1CCCC1)CC2	ZINC000526001964	406530605	/nfs/dbraw/zinc/53/06/05/406530605.db2.gz	AIUQHGLFUBTYTC-CQSZACIVSA-N	0	3	318.465	2.192	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N1CCC[C@H]1C1CCC1	ZINC000637968960	406501578	/nfs/dbraw/zinc/50/15/78/406501578.db2.gz	CUMCNYZDJKZNHD-MSOLQXFVSA-N	0	3	315.461	2.237	10	0		DEAEHN
c1cc(CNC[C@@H](c2ccccc2)N2CCOCC2)sn1	ZINC000638329801	406704445	/nfs/dbraw/zinc/70/44/45/406704445.db2.gz	PHGQHYVIASASGF-INIZCTEOSA-N	0	3	303.431	2.306	10	0		DEAEHN
CN(Cc1cccc(Cl)c1Cl)C(=O)[C@H]1CNCCOC1	ZINC000643618635	407018244	/nfs/dbraw/zinc/01/82/44/407018244.db2.gz	WXBFQBBOPASNLL-NSHDSACASA-N	0	3	317.216	2.188	10	0		DEAEHN
Brc1cccc(-c2noc([C@H]3CNCCOC3)n2)c1	ZINC000644511191	407133185	/nfs/dbraw/zinc/13/31/85/407133185.db2.gz	FFBNAEBCYIBJOO-JTQLQIEISA-N	0	3	324.178	2.203	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1CCCCCS(=O)(=O)CC	ZINC000190909388	287224482	/nfs/dbraw/zinc/22/44/82/287224482.db2.gz	BUZFWIXPKQLPLW-HZPDHXFCSA-N	0	3	316.511	2.150	10	0		DEAEHN
CC(C)CN1CCC[C@@H]1CNC(=O)C(=O)Nc1ccccc1F	ZINC000129395172	196044640	/nfs/dbraw/zinc/04/46/40/196044640.db2.gz	SHWCCRMYZWJHDN-CYBMUJFWSA-N	0	3	321.396	2.001	10	0		DEAEHN
Cc1cc([C@@H](C)NC(=O)C(C)(C)N2CCNCC2)c(C)s1	ZINC000129617328	196062475	/nfs/dbraw/zinc/06/24/75/196062475.db2.gz	KOGMGYIGSMKKNL-GFCCVEGCSA-N	0	3	309.479	2.226	10	0		DEAEHN
C[C@@H](N[C@H]1CCc2ccccc2C1)C(=O)NCC(F)(F)F	ZINC000130503756	196086623	/nfs/dbraw/zinc/08/66/23/196086623.db2.gz	QSBMEDHYRJRALH-MFKMUULPSA-N	0	3	300.324	2.201	10	0		DEAEHN
Cc1cc2c(=O)n(CCNCc3ccc(Cl)s3)ccn2n1	ZINC000130750112	196106752	/nfs/dbraw/zinc/10/67/52/196106752.db2.gz	YKDUMXMYEGKSQP-UHFFFAOYSA-N	0	3	322.821	2.309	10	0		DEAEHN
C[C@@H]1CC[C@H](C(=O)NCC2(N3CCSCC3)CCCC2)O1	ZINC000130942785	196125625	/nfs/dbraw/zinc/12/56/25/196125625.db2.gz	URGQCBHRLCDEAF-ZIAGYGMSSA-N	0	3	312.479	2.032	10	0		DEAEHN
O=S1(=O)CCC[C@@H]1CNC1=NCC2(CCCCC2)CS1	ZINC000131173451	196146248	/nfs/dbraw/zinc/14/62/48/196146248.db2.gz	LDIHJAPNIGPTOU-GFCCVEGCSA-N	0	3	316.492	2.207	10	0		DEAEHN
Cc1nc([C@@H]2CCS(=O)(=O)C2)sc1CNC(C)(C)C	ZINC000131268690	196155025	/nfs/dbraw/zinc/15/50/25/196155025.db2.gz	KUCOQQUQKIFTBG-SNVBAGLBSA-N	0	3	302.465	2.242	10	0		DEAEHN
CCC(O)(CC)c1c(Br)cnn1CCN(C)C	ZINC000131404129	196165482	/nfs/dbraw/zinc/16/54/82/196165482.db2.gz	WVBLYJMILRXFJY-UHFFFAOYSA-N	0	3	304.232	2.215	10	0		DEAEHN
O[C@@H](CN[C@H]1CCOC1)COc1c(Cl)cccc1Cl	ZINC000131467357	196171184	/nfs/dbraw/zinc/17/11/84/196171184.db2.gz	FVNCWMJHFAKWAX-UWVGGRQHSA-N	0	3	306.189	2.112	10	0		DEAEHN
CC[C@@H](C)[C@H](O)c1c(Br)cnn1CCN(C)C	ZINC000132029078	196220678	/nfs/dbraw/zinc/22/06/78/196220678.db2.gz	LBBWFHATFRCFCG-SKDRFNHKSA-N	0	3	304.232	2.287	10	0		DEAEHN
CN(C)CCn1ncc(Cl)c1[C@@H](O)c1cc(F)ccc1F	ZINC000132050900	196222423	/nfs/dbraw/zinc/22/24/23/196222423.db2.gz	CCUGSPLEXVZEST-AWEZNQCLSA-N	0	3	315.751	2.458	10	0		DEAEHN
CC(C)C[C@@H](O)c1c(Br)cnn1CCN(C)C	ZINC000132155448	196230547	/nfs/dbraw/zinc/23/05/47/196230547.db2.gz	YHRGLZAVELRXEE-LLVKDONJSA-N	0	3	304.232	2.287	10	0		DEAEHN
COC[C@@](C)(CCO)NCCOc1ccc(C(F)(F)F)cc1	ZINC000132542835	196264244	/nfs/dbraw/zinc/26/42/44/196264244.db2.gz	YGWZHHVDYAISMD-CQSZACIVSA-N	0	3	321.339	2.461	10	0		DEAEHN
C[C@H]1CNC[C@@H](COCc2ccc(F)cc2Br)O1	ZINC000132805895	196284768	/nfs/dbraw/zinc/28/47/68/196284768.db2.gz	BVTQDPFCPNCNHB-CABZTGNLSA-N	0	3	318.186	2.482	10	0		DEAEHN
COCc1nc(NN)cc(Nc2cc(Cl)ccc2OC)n1	ZINC000133075889	196310197	/nfs/dbraw/zinc/31/01/97/196310197.db2.gz	STFQNMPHTCLZJF-UHFFFAOYSA-N	0	3	309.757	2.314	10	0		DEAEHN
CN[C@H](CC[C@H]1CCCO1)c1c(Br)cnn1C	ZINC000133733621	196332837	/nfs/dbraw/zinc/33/28/37/196332837.db2.gz	FOBWGJIHQDHHHH-MWLCHTKSSA-N	0	3	302.216	2.402	10	0		DEAEHN
CC[C@@H](CCO)NCC(=O)Nc1cccc(Br)c1	ZINC000134399565	196386220	/nfs/dbraw/zinc/38/62/20/196386220.db2.gz	DRXNDDNSPJRPKW-NSHDSACASA-N	0	3	315.211	2.138	10	0		DEAEHN
COCCNC(=O)CCN[C@H]1C[C@H](C)Sc2sccc21	ZINC000135120606	196445887	/nfs/dbraw/zinc/44/58/87/196445887.db2.gz	VCDMQQLWOPPCIT-JQWIXIFHSA-N	0	3	314.476	2.416	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1Nc1nccnc1N(C)C	ZINC000302211577	230168783	/nfs/dbraw/zinc/16/87/83/230168783.db2.gz	ZKKWSHOXQJGZOR-GDBMZVCRSA-N	0	3	311.433	2.475	10	0		DEAEHN
CC(C)Cc1ccc([C@@H](C)NC(=O)C(C)S(C)(=O)=O)cc1	ZINC000045765845	424818366	/nfs/dbraw/zinc/81/83/66/424818366.db2.gz	CDCLEDDNDKIMPK-OLZOCXBDSA-N	0	3	311.447	2.495	10	0		DEAEHN
CC(C)(N)c1cn(Cc2ccc(OC(F)(F)F)cc2)nn1	ZINC000070118569	424842086	/nfs/dbraw/zinc/84/20/86/424842086.db2.gz	PSANVCZNYPJGMB-UHFFFAOYSA-N	0	3	300.284	2.419	10	0		DEAEHN
c1ccc2c(c1)oc1c2ncnc1NC[C@@H]1CN2CCC[C@H]2CO1	ZINC000363197132	424854746	/nfs/dbraw/zinc/85/47/46/424854746.db2.gz	HWTZBUIQVFSLFA-QWHCGFSZSA-N	0	3	324.384	2.651	10	0		DEAEHN
CC[C@H]1COC(C)(C)CN1C[C@@H](O)COCc1ccccc1	ZINC000403898834	424925603	/nfs/dbraw/zinc/92/56/03/424925603.db2.gz	YZDUCJXPXAINAW-DLBZAZTESA-N	0	3	307.434	2.454	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NCc1nnn(C(C)(C)C)n1	ZINC000657428293	425331815	/nfs/dbraw/zinc/33/18/15/425331815.db2.gz	HOOOBJGSSRHGLU-AWEZNQCLSA-N	0	3	316.453	2.038	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)CCc1nnc(C(C)C)o1	ZINC000176656334	267541077	/nfs/dbraw/zinc/54/10/77/267541077.db2.gz	NVRCHCWJBPOSNA-CYBMUJFWSA-N	0	3	310.442	2.218	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NC(=O)C1(N)CC2(CCC2)C1	ZINC000659271983	425564266	/nfs/dbraw/zinc/56/42/66/425564266.db2.gz	XVVVBOOVQVJWKK-AWEZNQCLSA-N	0	3	302.418	2.370	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000396403852	269103228	/nfs/dbraw/zinc/10/32/28/269103228.db2.gz	ZJJWKQMNPWWHQB-MJGOQNOKSA-N	0	3	320.477	2.370	10	0		DEAEHN
Cc1cc(CCN[C@H](C)c2ccc(S(C)(=O)=O)cc2)on1	ZINC000507222313	269315631	/nfs/dbraw/zinc/31/56/31/269315631.db2.gz	SUCKBAOABWDOSK-GFCCVEGCSA-N	0	3	308.403	2.280	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNCC[C@@H]1CCCOC1	ZINC000527741184	269539545	/nfs/dbraw/zinc/53/95/45/269539545.db2.gz	YJLIGMQRMBPOBY-INIZCTEOSA-N	0	3	300.406	2.233	10	0		DEAEHN
C[C@@H](N[C@@H]1CCc2ncnn2C1)c1ccc(-n2ccnc2)cc1	ZINC000180590647	274259581	/nfs/dbraw/zinc/25/95/81/274259581.db2.gz	STLHUCOQJXIMOD-UKRRQHHQSA-N	0	3	308.389	2.129	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)Nc1ccc2c(c1)CCC(=O)N2	ZINC000262411008	275815573	/nfs/dbraw/zinc/81/55/73/275815573.db2.gz	DDJPUYDQRPELFK-OAHLLOKOSA-N	0	3	301.390	2.288	10	0		DEAEHN
CCC[C@H](C(=O)NCC1(CC(=O)OC)CCCCC1)N(C)C	ZINC000186558549	276038227	/nfs/dbraw/zinc/03/82/27/276038227.db2.gz	SQGJHFKGWRLTTF-CQSZACIVSA-N	0	3	312.454	2.347	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1C[C@H](CO)[C@H](c2ccsc2)C1	ZINC000187724349	276153738	/nfs/dbraw/zinc/15/37/38/276153738.db2.gz	YUDZJEXFCDOMHA-OWCLPIDISA-N	0	3	322.474	2.157	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)[C@H](Cc1ccccc1)N(C)C	ZINC000247653864	276157430	/nfs/dbraw/zinc/15/74/30/276157430.db2.gz	XMYSAZBASYVXIJ-MSOLQXFVSA-N	0	3	317.477	2.150	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)NCCc1ccccc1F	ZINC000261958523	276161163	/nfs/dbraw/zinc/16/11/63/276161163.db2.gz	XKAUKDGLVBPWKU-JCKWVBRZSA-N	0	3	320.408	2.017	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)C2=COCCC2)c2ccccc2O1	ZINC000372783072	276803901	/nfs/dbraw/zinc/80/39/01/276803901.db2.gz	HGHKSRWWWRJMHW-AWEZNQCLSA-N	0	3	302.374	2.037	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3c(s2)CCOC3)C1	ZINC000246816722	277181505	/nfs/dbraw/zinc/18/15/05/277181505.db2.gz	SATPPMHYCRVQFV-JSGCOSHPSA-N	0	3	320.458	2.377	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@@H]2CCO[C@H]2C)c2ccc(F)cc2C1	ZINC000248689153	278057040	/nfs/dbraw/zinc/05/70/40/278057040.db2.gz	AEVRSZWYXBKLKU-JECHBYEQSA-N	0	3	306.381	2.386	10	0		DEAEHN
CS[C@@H]1CCC[C@H](NC(=O)N2CC[C@H](N3CC=CC3)C2)C1	ZINC000175034818	278144705	/nfs/dbraw/zinc/14/47/05/278144705.db2.gz	BCOJUQCAVQUJSD-SOUVJXGZSA-N	0	3	309.479	2.316	10	0		DEAEHN
Cc1cccnc1CNC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000105093975	278972000	/nfs/dbraw/zinc/97/20/00/278972000.db2.gz	TZHFKEFXBUQNQN-QGZVFWFLSA-N	0	3	312.417	2.492	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@H]1NCc1ccc(Br)c(F)c1	ZINC000282480410	279028193	/nfs/dbraw/zinc/02/81/93/279028193.db2.gz	VHRXSVSMGZTDGJ-QPUJVOFHSA-N	0	3	315.186	2.345	10	0		DEAEHN
CCN(CC)C(=O)[C@@H](C)N1CC[C@@H](CNc2ccccn2)C1	ZINC000249898720	279074693	/nfs/dbraw/zinc/07/46/93/279074693.db2.gz	SIVTTZCUNSJKGQ-CABCVRRESA-N	0	3	304.438	2.072	10	0		DEAEHN
CC(C)C[C@H](CO)N(C)C(=O)N[C@@H](C)CN1CCC[C@H](C)C1	ZINC000249486007	279166837	/nfs/dbraw/zinc/16/68/37/279166837.db2.gz	YGFIMBLTGUALJV-HRCADAONSA-N	0	3	313.486	2.155	10	0		DEAEHN
CC(C)N(C)CC(=O)N1CCCC[C@@H]1c1nnc2n1CCCC2	ZINC000176419444	279350529	/nfs/dbraw/zinc/35/05/29/279350529.db2.gz	YLCOXEDZLRUSDD-CQSZACIVSA-N	0	3	319.453	2.008	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)c1cnccc1N(C)C	ZINC000183571120	281058175	/nfs/dbraw/zinc/05/81/75/281058175.db2.gz	WLSHOFFGUQHZET-AWEZNQCLSA-N	0	3	304.438	2.142	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN(C[C@H](O)CC(F)(F)F)C2)n1	ZINC000189367296	281247014	/nfs/dbraw/zinc/24/70/14/281247014.db2.gz	MKTBBXLYOJNYQH-CHWSQXEVSA-N	0	3	317.355	2.437	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@@H]2CCCOc3c(F)cccc32)C1	ZINC000183827646	289312283	/nfs/dbraw/zinc/31/22/83/289312283.db2.gz	MUWKKVZORDGMQN-IUODEOHRSA-N	0	3	321.396	2.385	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1	ZINC000105881211	293002996	/nfs/dbraw/zinc/00/29/96/293002996.db2.gz	CTZADLUNCCAMLM-HUUCEWRRSA-N	0	3	312.417	2.147	10	0		DEAEHN
Cc1nnc([C@H]2CCCCN2C(=O)[C@@H](C)[NH+]2CCCCCC2)[n-]1	ZINC000328674722	293382588	/nfs/dbraw/zinc/38/25/88/293382588.db2.gz	KCBCKOLXNNMNGN-UKRRQHHQSA-N	0	3	319.453	2.431	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@@]2(O)CCCC[C@@H]2C1)N1CCCCCC1	ZINC000121043481	298081837	/nfs/dbraw/zinc/08/18/37/298081837.db2.gz	CFPCVABGLLAIHU-NUJGCVRESA-N	0	3	308.466	2.405	10	0		DEAEHN
Cn1nccc1[C@H]1[C@H](N[C@@H]2CCC23CCC3)CC(=O)N1C1CC1	ZINC000329049827	303097328	/nfs/dbraw/zinc/09/73/28/303097328.db2.gz	WEFNUXJUVMGKAT-FRFSOERESA-N	0	3	314.433	2.147	10	0		DEAEHN
CC1CC(C(=O)NCC2(O)CCN(Cc3ccccc3)CC2)C1	ZINC000575892776	326254109	/nfs/dbraw/zinc/25/41/09/326254109.db2.gz	CABJQLNHYCEKOZ-UHFFFAOYSA-N	0	3	316.445	2.176	10	0		DEAEHN
O=C(NCCNc1ccncc1)Nc1scnc1C1CC1	ZINC000576129067	326271964	/nfs/dbraw/zinc/27/19/64/326271964.db2.gz	RDQJRECVRYKXMK-UHFFFAOYSA-N	0	3	303.391	2.071	10	0		DEAEHN
COC[C@H](C)CN[C@H](CO)c1cccc(Br)c1	ZINC000188104730	333031613	/nfs/dbraw/zinc/03/16/13/333031613.db2.gz	UQDATDOPQPJJDJ-ZWNOBZJWSA-N	0	3	302.212	2.355	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2ccc(F)c(F)c2)C1	ZINC000188892453	333057703	/nfs/dbraw/zinc/05/77/03/333057703.db2.gz	XTCPNIGIMIPLEK-CYBMUJFWSA-N	0	3	311.376	2.291	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)c2csc(C(F)(F)F)n2)C1	ZINC000193197842	333304986	/nfs/dbraw/zinc/30/49/86/333304986.db2.gz	MMXDNNDVVUSWDY-MRVPVSSYSA-N	0	3	307.341	2.234	10	0		DEAEHN
Cn1nccc1CCN1CCC[C@@H](CC(=O)OC(C)(C)C)C1	ZINC000582229243	336035206	/nfs/dbraw/zinc/03/52/06/336035206.db2.gz	YGDMVIYTBLXYDW-AWEZNQCLSA-N	0	3	307.438	2.406	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1c[nH]c(=O)c2ccccc12	ZINC000190380759	336263784	/nfs/dbraw/zinc/26/37/84/336263784.db2.gz	VHUZHXPYMGOJDQ-ZDUSSCGKSA-N	0	3	315.417	2.234	10	0		DEAEHN
C[C@@H](NC1CCOCC1)C(=O)Nc1cnc(Cl)cc1Cl	ZINC000584649035	337380541	/nfs/dbraw/zinc/38/05/41/337380541.db2.gz	TUILEJHGGITVQR-MRVPVSSYSA-N	0	3	318.204	2.484	10	0		DEAEHN
C[C@H](NC1CCOCC1)C(=O)Nc1cnc(Cl)cc1Cl	ZINC000584649036	337380516	/nfs/dbraw/zinc/38/05/16/337380516.db2.gz	TUILEJHGGITVQR-QMMMGPOBSA-N	0	3	318.204	2.484	10	0		DEAEHN
C[C@H]1CN(CC(=O)NC(C)(C)C)CCN(Cc2ccccc2)C1	ZINC000448552107	533908661	/nfs/dbraw/zinc/90/86/61/533908661.db2.gz	MGRVCAOGZAIPNV-MRXNPFEDSA-N	0	3	317.477	2.355	10	0		DEAEHN
CCCOc1cc(CN2CCO[C@H](CN(C)C)C2)ccc1OC	ZINC000128212845	520306797	/nfs/dbraw/zinc/30/67/97/520306797.db2.gz	JVSWGSLYHAUAGS-MRXNPFEDSA-N	0	3	322.449	2.246	10	0		DEAEHN
CCCC[C@H](COC)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000157119627	521200916	/nfs/dbraw/zinc/20/09/16/521200916.db2.gz	GLJDHEYNJPWDFH-GDBMZVCRSA-N	0	3	305.422	2.372	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000156494277	521620109	/nfs/dbraw/zinc/62/01/09/521620109.db2.gz	MHZVAHXDKYAUNS-GOEBONIOSA-N	0	3	319.449	2.449	10	0		DEAEHN
COc1cc(C)ccc1OCC(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000247041711	522279487	/nfs/dbraw/zinc/27/94/87/522279487.db2.gz	IBPALDMTRBGTPR-CABCVRRESA-N	0	3	320.433	2.227	10	0		DEAEHN
COC[C@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)C1CC1	ZINC000157276438	522750565	/nfs/dbraw/zinc/75/05/65/522750565.db2.gz	MXOVYVWUQLVEQS-CPUCHLNUSA-N	0	3	319.449	2.210	10	0		DEAEHN
O=C(C[C@@H]1CCCCC(=O)N1)N1CC[C@H](N2CCCCC2)C1	ZINC000328681154	534687494	/nfs/dbraw/zinc/68/74/94/534687494.db2.gz	UYIDTHSYOOMTHX-GJZGRUSLSA-N	0	3	307.438	2.362	10	0		DEAEHN
CC[C@@H]1CN(CCOc2ccc(OC)cc2)CCN1CCOC	ZINC000105835865	523443005	/nfs/dbraw/zinc/44/30/05/523443005.db2.gz	QIUALYQYRDEYRI-MRXNPFEDSA-N	0	3	322.449	2.117	10	0		DEAEHN
COCCN1CCC[C@H]1CN[C@H](C)c1ccc(OC)cc1OC	ZINC000163420652	523834814	/nfs/dbraw/zinc/83/48/14/523834814.db2.gz	UJRWBTRGDKFIAA-CABCVRRESA-N	0	3	322.449	2.465	10	0		DEAEHN
C[C@@H](CC(=O)N1CCO[C@H](CN(C)C)C1)c1ccccc1F	ZINC000116787499	524357763	/nfs/dbraw/zinc/35/77/63/524357763.db2.gz	FIVDOWPCXMHNQD-UONOGXRCSA-N	0	3	308.397	2.108	10	0		DEAEHN
C[C@H](CNC(=O)NCc1cscn1)N(C)Cc1ccccc1	ZINC000111482769	524422241	/nfs/dbraw/zinc/42/22/41/524422241.db2.gz	RIRWZWAIZCBOFH-CYBMUJFWSA-N	0	3	318.446	2.463	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2ccc([S@@](C)=O)cc2)CCN1C	ZINC000245455806	525244128	/nfs/dbraw/zinc/24/41/28/525244128.db2.gz	AYBHQKOGDRAZCM-UZRORNOBSA-N	0	3	323.462	2.370	10	0		DEAEHN
c1ncn(Cc2ccccc2CN[C@@H]2CCCc3n[nH]cc32)n1	ZINC000367613980	526617238	/nfs/dbraw/zinc/61/72/38/526617238.db2.gz	GVJPMATZXFQLFB-MRXNPFEDSA-N	0	3	308.389	2.217	10	0		DEAEHN
CC(=O)N1CCN(CCNc2ccnc3ccc(C)cc32)CC1	ZINC000302142061	526627641	/nfs/dbraw/zinc/62/76/41/526627641.db2.gz	FJNMNLDRCSVBLO-UHFFFAOYSA-N	0	3	312.417	2.119	10	0		DEAEHN
CC(C)OC1CC(N[C@H](C)Cn2ncc3ccccc3c2=O)C1	ZINC000189553490	527882845	/nfs/dbraw/zinc/88/28/45/527882845.db2.gz	XPROTJMWCLAZIA-IUDNXUCKSA-N	0	3	315.417	2.331	10	0		DEAEHN
CC(C)c1cccc(OCC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000195330906	528180966	/nfs/dbraw/zinc/18/09/66/528180966.db2.gz	CUBXXOGWQJNEQI-MRXNPFEDSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H]1CCO[C@@H](C2CC2)C1	ZINC000248943741	529067530	/nfs/dbraw/zinc/06/75/30/529067530.db2.gz	ZAZVWRUZQGSRGM-BZUAXINKSA-N	0	3	309.454	2.070	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](N[C@@H](C(=O)NC2CC2)c2ccccc2)C1	ZINC000246300495	535258977	/nfs/dbraw/zinc/25/89/77/535258977.db2.gz	VFGACBOMCKLDIW-ZTFGCOKTSA-N	0	3	315.461	2.325	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)N1CCC[C@@H](c2noc(C3CC3)n2)C1	ZINC000262324271	535524037	/nfs/dbraw/zinc/52/40/37/535524037.db2.gz	SMPFAHYJNRPERU-MLGOLLRUSA-N	0	3	306.410	2.171	10	0		DEAEHN
CCO[C@@H]1C[C@](N)(C(=O)N[C@H]2C[C@H]2c2ccccc2)C1(C)C	ZINC000262541413	535536221	/nfs/dbraw/zinc/53/62/21/535536221.db2.gz	RDSZMKZWMWOVQX-AFIMGQEJSA-N	0	3	302.418	2.191	10	0		DEAEHN
CCN1CCN([C@@H](C)CNC(=O)[C@@H](C)Cc2ccccc2)CC1	ZINC000358457982	535727295	/nfs/dbraw/zinc/72/72/95/535727295.db2.gz	SPXIYCMIQSJZAU-IRXDYDNUSA-N	0	3	317.477	2.007	10	0		DEAEHN
CN(c1cccnn1)C1CCN(C[C@H](O)CC2CCCC2)CC1	ZINC000191333999	536299539	/nfs/dbraw/zinc/29/95/39/536299539.db2.gz	HKOHSZZQIKCKLU-QGZVFWFLSA-N	0	3	318.465	2.318	10	0		DEAEHN
CN(Cc1cc2ccccc2o1)C(=O)[C@H](N)C1CCOCC1	ZINC000261703795	536461576	/nfs/dbraw/zinc/46/15/76/536461576.db2.gz	BNSZVCOMPUIVGZ-MRXNPFEDSA-N	0	3	302.374	2.145	10	0		DEAEHN
COC[C@@H](CC(C)C)NCc1cccc(N2CCOCC2)n1	ZINC000360005868	536592404	/nfs/dbraw/zinc/59/24/04/536592404.db2.gz	HMOIPORGCYVWMZ-MRXNPFEDSA-N	0	3	307.438	2.069	10	0		DEAEHN
COC1([C@@H](C)NCc2ccnc(OC(F)F)c2)CCOCC1	ZINC000453221665	536710658	/nfs/dbraw/zinc/71/06/58/536710658.db2.gz	YEDORIIRVJSRHT-LLVKDONJSA-N	0	3	316.348	2.357	10	0		DEAEHN
COc1ccccc1CCCN1CCN(C[C@H](C)O)[C@@H](C)C1	ZINC000248517702	537028827	/nfs/dbraw/zinc/02/88/27/537028827.db2.gz	ALXXJMDFQCFQNE-HOTGVXAUSA-N	0	3	306.450	2.015	10	0		DEAEHN
O=C(CCn1cccn1)O[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000183170507	625294986	/nfs/dbraw/zinc/29/49/86/625294986.db2.gz	SIODHJYHIPVCMU-QGZVFWFLSA-N	0	3	313.401	2.481	10	0		DEAEHN
O=S(=O)(/C=C\c1ccccc1)NCCN1CCCCCC1	ZINC000255623472	625532519	/nfs/dbraw/zinc/53/25/19/625532519.db2.gz	SDDRTASNSFDEFO-GDNBJRDFSA-N	0	3	308.447	2.453	10	0		DEAEHN
COCCO[C@H]1CCCN(C[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000179359103	625617719	/nfs/dbraw/zinc/61/77/19/625617719.db2.gz	KJOXDFDXTODPQH-ROUUACIJSA-N	0	3	307.434	2.464	10	0		DEAEHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@@H]2CCOC[C@H]2C)c1	ZINC000248873218	634451430	/nfs/dbraw/zinc/45/14/30/634451430.db2.gz	IJLVAIVLTKFKMO-BPLDGKMQSA-N	0	3	300.358	2.315	10	0		DEAEHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCO[C@H]2C)c1	ZINC000248965758	634460371	/nfs/dbraw/zinc/46/03/71/634460371.db2.gz	HMCBKDFUYDOSDT-NWANDNLSSA-N	0	3	300.358	2.458	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@@H]1CCCN(C/C=C(/C)C(=O)OC)C1	ZINC000746501447	638349940	/nfs/dbraw/zinc/34/99/40/638349940.db2.gz	LSHALLSWSXDMHK-PONMJGQJSA-N	0	3	310.438	2.123	10	0		DEAEHN
COC(=O)/C(C)=C/CN1C[C@@H]2CN(c3ccccc3)C[C@@H]2C1	ZINC000748812792	638593423	/nfs/dbraw/zinc/59/34/23/638593423.db2.gz	HQRAYKNLEIGJNN-BRRGMZCASA-N	0	3	300.402	2.174	10	0		DEAEHN
C[C@H]1CN(C[C@@H](O)Cc2ccccc2C(F)(F)F)CCN1C	ZINC000751572819	639439823	/nfs/dbraw/zinc/43/98/23/639439823.db2.gz	CKSSGMAJVQOFHP-JSGCOSHPSA-N	0	3	316.367	2.245	10	0		DEAEHN
CC[C@@H]1CN(C[C@H](O)c2cc(C)cc(C)c2)CCN1CCOC	ZINC000174782671	647346169	/nfs/dbraw/zinc/34/61/69/647346169.db2.gz	WJVQDVJSGAHRFM-MOPGFXCFSA-N	0	3	320.477	2.379	10	0		DEAEHN
CN(Cc1cccs1)C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000228894702	647406370	/nfs/dbraw/zinc/40/63/70/647406370.db2.gz	GDJCQJFTQWDONG-DVOMOZLQSA-N	0	3	308.447	2.239	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc(OC(C)=O)cc2)CCN1CCOC	ZINC000123090137	684122132	/nfs/dbraw/zinc/12/21/32/684122132.db2.gz	JDCJZLFZACRXDN-QGZVFWFLSA-N	0	3	320.433	2.155	10	0		DEAEHN
C[C@H]1[C@@H](NCc2cncnc2)CCCN1C(=O)OC(C)(C)C	ZINC000189531112	684383549	/nfs/dbraw/zinc/38/35/49/684383549.db2.gz	CBLWVEFYGDKFIC-JSGCOSHPSA-N	0	3	306.410	2.354	10	0		DEAEHN
CN(C)Cc1cc(O[C@H]2CCN(Cc3cncs3)C2)ccn1	ZINC000886068856	691997016	/nfs/dbraw/zinc/99/70/16/691997016.db2.gz	YNIKTSWOPDTHRZ-HNNXBMFYSA-N	0	3	318.446	2.253	10	0		DEAEHN
CCn1nccc1[C@H]1OCC[C@@H]1NCc1cncn1C(C)C	ZINC000886079831	691998548	/nfs/dbraw/zinc/99/85/48/691998548.db2.gz	JSGVWHYTWZJDGW-HOCLYGCPSA-N	0	3	303.410	2.300	10	0		DEAEHN
COc1ccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)cn1	ZINC000721879603	780533745	/nfs/dbraw/zinc/53/37/45/780533745.db2.gz	HTTSWMNXDDZBLO-TZMCWYRMSA-N	0	3	321.421	2.435	10	0		DEAEHN
Brc1ccsc1CNC[C@H]1C[C@@H]2COC[C@@H]2O1	ZINC000724660515	787352525	/nfs/dbraw/zinc/35/25/25/787352525.db2.gz	QINFWSBCRRYNMG-KKZNHRDASA-N	0	3	318.236	2.404	10	0		DEAEHN
COC(=O)c1coc(CNCC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000397776232	790218459	/nfs/dbraw/zinc/21/84/59/790218459.db2.gz	XDLPDLLRRALUPN-UHFFFAOYSA-N	0	3	324.377	2.023	10	0		DEAEHN
Cc1cc(CN[C@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)n(C)n1	ZINC000401810913	801852897	/nfs/dbraw/zinc/85/28/97/801852897.db2.gz	UEYUAYUIBXVSSQ-OCCSQVGLSA-N	0	3	322.453	2.464	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)Cn2nnc3ccccc32)c1	ZINC000047453446	1078394033	/nfs/dbraw/zinc/39/40/33/1078394033.db2.gz	LPCBXODVFQIRMV-UHFFFAOYSA-N	0	3	309.373	2.132	10	0		DEAEHN
c1nc(CNCCCN2CCN(c3ccccc3)CC2)cs1	ZINC000060523551	1078870265	/nfs/dbraw/zinc/87/02/65/1078870265.db2.gz	GDEIWSVJWZBFFL-UHFFFAOYSA-N	0	3	316.474	2.445	10	0		DEAEHN
Cc1ncc(CN[C@@H]2CN(C(=O)OC(C)(C)C)CC2(C)C)n1C	ZINC000721939238	1084717057	/nfs/dbraw/zinc/71/70/57/1084717057.db2.gz	KGBFJXLWLLPSQO-CQSZACIVSA-N	0	3	322.453	2.464	10	0		DEAEHN
Cn1cc(CN[C@]23CCC[C@H]2CN(C(=O)OC(C)(C)C)C3)cn1	ZINC000711383913	1087083636	/nfs/dbraw/zinc/08/36/36/1087083636.db2.gz	KOZPLJKUZHTGJG-YOEHRIQHSA-N	0	3	320.437	2.299	10	0		DEAEHN
C[C@H]1[C@H](NC(=O)c2ccc(F)c(Br)c2)CCN1C	ZINC000719384326	1089078285	/nfs/dbraw/zinc/07/82/85/1089078285.db2.gz	CUCAITFCPATXBO-QPUJVOFHSA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@@H]1[C@H](NC(=O)c2cc(F)ccc2Br)CCN1C	ZINC000719384269	1089078778	/nfs/dbraw/zinc/07/87/78/1089078778.db2.gz	CPDCMGVRCSDJPF-PRHODGIISA-N	0	3	315.186	2.411	10	0		DEAEHN
COC(OC)C(=O)N(C)C[C@@H]1CCCCN1Cc1ccccc1	ZINC000719950077	1089418065	/nfs/dbraw/zinc/41/80/65/1089418065.db2.gz	KLIHKORZYQLCKE-INIZCTEOSA-N	0	3	320.433	2.118	10	0		DEAEHN
CCc1nn(C)cc1CNCCOC(F)(F)C(F)(F)F	ZINC000720229974	1089536990	/nfs/dbraw/zinc/53/69/90/1089536990.db2.gz	JAUHADAZLYITGE-UHFFFAOYSA-N	0	3	301.259	2.244	10	0		DEAEHN
CCCOc1ccc([C@H](N)CSCCS(C)(=O)=O)cc1	ZINC000081768324	192322461	/nfs/dbraw/zinc/32/24/61/192322461.db2.gz	BIMLROOUNYNOLF-CQSZACIVSA-N	0	3	317.476	2.253	10	0		DEAEHN
CN[C@H](CSCCS(C)(=O)=O)c1cc(C)ccc1C	ZINC000081768720	192323294	/nfs/dbraw/zinc/32/32/94/192323294.db2.gz	HVMFYKOGLBXQQQ-CQSZACIVSA-N	0	3	301.477	2.342	10	0		DEAEHN
CC(C)[C@H](SCCS(C)(=O)=O)[C@@H](N)c1ccccc1	ZINC000081768785	192323533	/nfs/dbraw/zinc/32/35/33/192323533.db2.gz	DHCAEKVXLDKFKO-KBPBESRZSA-N	0	3	301.477	2.489	10	0		DEAEHN
CN(C[C@H](O)COCc1ccccc1Cl)C[C@@H]1CCCO1	ZINC000076745150	185037970	/nfs/dbraw/zinc/03/79/70/185037970.db2.gz	NUMJMAJPBMBEFZ-GJZGRUSLSA-N	0	3	313.825	2.328	10	0		DEAEHN
CSCC[C@H](C)N(C)S(=O)(=O)c1cc(CN)ccc1F	ZINC000162541487	197572918	/nfs/dbraw/zinc/57/29/18/197572918.db2.gz	RPCIPWGHRQSZNU-JTQLQIEISA-N	0	3	320.455	2.047	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@@H]1S(=O)(=O)c1ccc(C)c(C)c1	ZINC000081921886	192339074	/nfs/dbraw/zinc/33/90/74/192339074.db2.gz	YHSCOZLAEXEZIV-CVEARBPZSA-N	0	3	311.447	2.234	10	0		DEAEHN
CCC[C@H]1CCN(S(=O)(=O)c2ccc(CNC)s2)C1	ZINC000163622477	197641387	/nfs/dbraw/zinc/64/13/87/197641387.db2.gz	KEVQFAFIJZFDMJ-NSHDSACASA-N	0	3	302.465	2.278	10	0		DEAEHN
CC[C@H](N)[C@H](C)S(=O)(=O)c1ccccc1Br	ZINC000081931518	192341123	/nfs/dbraw/zinc/34/11/23/192341123.db2.gz	HYTQGPJMFATWTD-WPRPVWTQSA-N	0	3	306.225	2.349	10	0		DEAEHN
CCN[C@@H](C)CS(=O)(=O)c1ccccc1Br	ZINC000081931838	192341690	/nfs/dbraw/zinc/34/16/90/192341690.db2.gz	YAHGKPLDQJSXLR-VIFPVBQESA-N	0	3	306.225	2.221	10	0		DEAEHN
CCN[C@@H](CC)[C@@H](C)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000081935444	192343083	/nfs/dbraw/zinc/34/30/83/192343083.db2.gz	JXJKRZJZAPGQPN-YPMHNXCESA-N	0	3	313.419	2.008	10	0		DEAEHN
CC[C@@H]1CN(CCOc2cccc(OC)c2)CCN1CCOC	ZINC000152612389	282149478	/nfs/dbraw/zinc/14/94/78/282149478.db2.gz	LORSJXZWWFSYJN-MRXNPFEDSA-N	0	3	322.449	2.117	10	0		DEAEHN
COC(=O)CS(=O)(=O)[C@H]1CCCCCCCCCC[C@H]1N	ZINC000081976055	192347460	/nfs/dbraw/zinc/34/74/60/192347460.db2.gz	OQMXAQCYJXOAEZ-KGLIPLIRSA-N	0	3	319.467	2.185	10	0		DEAEHN
O=C(c1ccc(I)cc1)[C@@H]1CCCN1	ZINC000082954549	185209565	/nfs/dbraw/zinc/20/95/65/185209565.db2.gz	SRRJFVVYAGWFTN-JTQLQIEISA-N	0	3	301.127	2.226	10	0		DEAEHN
CC[C@H]1CNCCN1c1ccccc1I	ZINC000083086712	185212999	/nfs/dbraw/zinc/21/29/99/185212999.db2.gz	VBAGBOLHKSTBQQ-JTQLQIEISA-N	0	3	316.186	2.479	10	0		DEAEHN
C[C@H]1CNCCN1c1ccccc1I	ZINC000083086710	185213014	/nfs/dbraw/zinc/21/30/14/185213014.db2.gz	BDMGYNJTTNNQHR-VIFPVBQESA-N	0	3	302.159	2.089	10	0		DEAEHN
O=c1[nH]ccnc1N1CCC[C@H](NCc2cccc3cc[nH]c32)C1	ZINC000328646617	231281292	/nfs/dbraw/zinc/28/12/92/231281292.db2.gz	STHRVYTYACHYOR-HNNXBMFYSA-N	0	3	323.400	2.422	10	0		DEAEHN
CC(C)[C@H](C[NH3+])[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000087404449	185223811	/nfs/dbraw/zinc/22/38/11/185223811.db2.gz	AQFWZNSONZCRGS-JTQLQIEISA-N	0	3	311.234	2.255	10	0		DEAEHN
Cc1nnc([C@H]2CCCCN2C(=O)CN2[C@H](C)CC[C@@H]2C)[nH]1	ZINC000328703917	231313893	/nfs/dbraw/zinc/31/38/93/231313893.db2.gz	YCDVQXBSZSHOBP-MBNYWOFBSA-N	0	3	305.426	2.040	10	0		DEAEHN
COCCNCc1ccc(OCOC)c(Br)c1	ZINC000087888196	185234731	/nfs/dbraw/zinc/23/47/31/185234731.db2.gz	ACJCHMSLLPUTCV-UHFFFAOYSA-N	0	3	304.184	2.168	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NC(=O)N2CCN3CCC[C@@H]3C2)C12CCCC2	ZINC000173513273	282190946	/nfs/dbraw/zinc/19/09/46/282190946.db2.gz	IVZXMJORLQNAQA-BZUAXINKSA-N	0	3	321.465	2.214	10	0		DEAEHN
COCCN(Cc1ccc2nc(N)sc2c1)[C@@H](C)COC	ZINC000087848107	185233446	/nfs/dbraw/zinc/23/34/46/185233446.db2.gz	UIJYNERWZGPLSQ-NSHDSACASA-N	0	3	309.435	2.362	10	0		DEAEHN
O=C(CNC1CC1)Nc1c(F)cc(Br)cc1F	ZINC000088168596	185240843	/nfs/dbraw/zinc/24/08/43/185240843.db2.gz	RFUHYCOUPYKETL-UHFFFAOYSA-N	0	3	305.122	2.418	10	0		DEAEHN
CC(C)CNCc1nnnn1-c1c2nsnc2ccc1Cl	ZINC000088127764	185240316	/nfs/dbraw/zinc/24/03/16/185240316.db2.gz	VEUDONNRNJFDRC-UHFFFAOYSA-N	0	3	323.813	2.066	10	0		DEAEHN
CCN(CC)CC(=O)N[C@H]1CCN(c2c(F)cccc2F)C1	ZINC000088250381	185243464	/nfs/dbraw/zinc/24/34/64/185243464.db2.gz	IMGLKZYSRNKDAA-LBPRGKRZSA-N	0	3	311.376	2.002	10	0		DEAEHN
CC(C)c1nnsc1C(=O)N1CCNCC12CCCCC2	ZINC000088396101	185248392	/nfs/dbraw/zinc/24/83/92/185248392.db2.gz	HBWLOSKJFJUQTQ-UHFFFAOYSA-N	0	3	308.451	2.410	10	0		DEAEHN
CCOC(=O)[C@@](C)(N)C[C@H](C)N1CCC(C(F)(F)F)CC1	ZINC000088435424	185250303	/nfs/dbraw/zinc/25/03/03/185250303.db2.gz	PZGGVLMNQIUUBC-GWCFXTLKSA-N	0	3	310.360	2.320	10	0		DEAEHN
CCOC(=O)[C@](C)(CCN1CCC[C@H](C(F)(F)F)C1)NC	ZINC000088435331	185250445	/nfs/dbraw/zinc/25/04/45/185250445.db2.gz	FUHMZKPFXFOCFL-AAEUAGOBSA-N	0	3	310.360	2.192	10	0		DEAEHN
C[C@@H]1CC[C@@H](NCc2ccc(S(=O)(=O)N(C)C)o2)[C@@H]1C	ZINC000088540949	185255693	/nfs/dbraw/zinc/25/56/93/185255693.db2.gz	YGJUIRQACPYPKM-NQBHXWOUSA-N	0	3	300.424	2.054	10	0		DEAEHN
CN[C@@H]1CCC[C@@H]1S(=O)(=O)c1cccc(Br)c1	ZINC000081982647	192348728	/nfs/dbraw/zinc/34/87/28/192348728.db2.gz	LDKJXTCJKQPJJX-NEPJUHHUSA-N	0	3	318.236	2.363	10	0		DEAEHN
CN[C@H](C)[C@H](C)S(=O)(=O)c1cccc(Br)c1	ZINC000081982671	192349990	/nfs/dbraw/zinc/34/99/90/192349990.db2.gz	DJCBZUIQSFGMRZ-BDAKNGLRSA-N	0	3	306.225	2.219	10	0		DEAEHN
N[C@H](C[S@](=O)c1ccccc1)c1ccc2c(c1)OCCO2	ZINC000082001210	192353304	/nfs/dbraw/zinc/35/33/04/192353304.db2.gz	KHSQXXOSPLWHSI-SPLOXXLWSA-N	0	3	303.383	2.265	10	0		DEAEHN
Cc1nc(-c2ccc(NC(=O)[C@H]3COC[C@@H]3N)cc2)cs1	ZINC000090383767	185293832	/nfs/dbraw/zinc/29/38/32/185293832.db2.gz	XRQXSSPUZHSRHB-STQMWFEESA-N	0	3	303.387	2.031	10	0		DEAEHN
C[C@@]1(C(=O)Nc2ccccc2SC(F)F)COC[C@H]1N	ZINC000090580456	185304978	/nfs/dbraw/zinc/30/49/78/185304978.db2.gz	MLDGCCXMDSONKD-ZWNOBZJWSA-N	0	3	302.346	2.304	10	0		DEAEHN
Cc1noc(C)c1C(=O)N1CCCSC[C@H]1CN1CCCC1	ZINC000090700909	185310394	/nfs/dbraw/zinc/31/03/94/185310394.db2.gz	RHRQERZSHCTBBO-CQSZACIVSA-N	0	3	323.462	2.335	10	0		DEAEHN
Cc1nc(C)c(C(=O)N2CCCSC[C@@H]2CN(C)C)s1	ZINC000090700060	185310602	/nfs/dbraw/zinc/31/06/02/185310602.db2.gz	TXDKCZNCHLGXSG-LBPRGKRZSA-N	0	3	313.492	2.269	10	0		DEAEHN
Cc1ccc(CN(C)C)cc1NC(=O)c1nc(C)c(C)[nH]c1=O	ZINC000092497143	185322448	/nfs/dbraw/zinc/32/24/48/185322448.db2.gz	XAARHPXTXXRZJG-UHFFFAOYSA-N	0	3	314.389	2.009	10	0		DEAEHN
CC[C@H]1CN(c2ccccc2)CCN1C(=O)CN(CC)CC	ZINC000184270582	282250758	/nfs/dbraw/zinc/25/07/58/282250758.db2.gz	BBWGRJACSKAIIW-INIZCTEOSA-N	0	3	303.450	2.456	10	0		DEAEHN
CCO[C@H]1C[C@@H](NCc2cnc3ccccn23)C12CCOCC2	ZINC000185663394	282264123	/nfs/dbraw/zinc/26/41/23/282264123.db2.gz	NKCGHIYWHBMHIR-CVEARBPZSA-N	0	3	315.417	2.398	10	0		DEAEHN
Cc1ccc(CS(=O)(=O)C(C)C(=O)NC2CCCC2)c(C)n1	ZINC000185233328	282261050	/nfs/dbraw/zinc/26/10/50/282261050.db2.gz	FNDZWOBIXSWPKC-CYBMUJFWSA-N	0	3	324.446	2.061	10	0		DEAEHN
CC[N@@H+]1CC[C@@H](CNC(=O)c2ccc3c(c2[O-])CCCC3)C1	ZINC000185425084	282262181	/nfs/dbraw/zinc/26/21/81/282262181.db2.gz	DRYOWQYQMGWDPY-ZDUSSCGKSA-N	0	3	302.418	2.343	10	0		DEAEHN
CC[N@H+]1CC[C@@H](CNC(=O)c2ccc3c(c2[O-])CCCC3)C1	ZINC000185425084	282262183	/nfs/dbraw/zinc/26/21/83/282262183.db2.gz	DRYOWQYQMGWDPY-ZDUSSCGKSA-N	0	3	302.418	2.343	10	0		DEAEHN
COC(=O)[C@H](C)CN(Cc1ccccc1)C[C@H](O)CSC	ZINC000187805907	282290924	/nfs/dbraw/zinc/29/09/24/282290924.db2.gz	MGTNWLOZWRILAB-HIFRSBDPSA-N	0	3	311.447	2.022	10	0		DEAEHN
CN(C[C@@H](O)Cc1ccccc1C(F)(F)F)CC1(CO)CC1	ZINC000190028114	529944131	/nfs/dbraw/zinc/94/41/31/529944131.db2.gz	BVIUVOSPPVJTGT-ZDUSSCGKSA-N	0	3	317.351	2.313	10	0		DEAEHN
CN(C[C@H](O)Cc1ccccc1C(F)(F)F)[C@H]1CCOC1	ZINC000443622937	529961802	/nfs/dbraw/zinc/96/18/02/529961802.db2.gz	XXLMOLLPAGIWLZ-QWHCGFSZSA-N	0	3	303.324	2.330	10	0		DEAEHN
CCN[C@@H](C)c1cc(Br)ccc1OCC(=O)NC	ZINC000052067346	190681588	/nfs/dbraw/zinc/68/15/88/190681588.db2.gz	VXRWOSOOKQQRTK-VIFPVBQESA-N	0	3	315.211	2.244	10	0		DEAEHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)NCCc1ccccc1O	ZINC000448258234	530051566	/nfs/dbraw/zinc/05/15/66/530051566.db2.gz	VLDIXEXVNFCUEE-INIZCTEOSA-N	0	3	319.449	2.354	10	0		DEAEHN
CC1(OCC(=O)N(Cc2ccc(Cl)cc2)C2CC2)CNC1	ZINC000098060837	539436072	/nfs/dbraw/zinc/43/60/72/539436072.db2.gz	YVEGUSVJIYVHMV-UHFFFAOYSA-N	0	3	308.809	2.210	10	0		DEAEHN
CC(=O)CCC(C)(C)C(=O)N1CCN(c2ccncc2)CC1	ZINC000130443527	539495382	/nfs/dbraw/zinc/49/53/82/539495382.db2.gz	WWWQQLUCGJXHPU-UHFFFAOYSA-N	0	3	303.406	2.126	10	0		DEAEHN
COc1ccc(-c2nc(CN3CCN4CCC[C@@H]4C3)no2)cc1	ZINC000171641156	539616117	/nfs/dbraw/zinc/61/61/17/539616117.db2.gz	CLFHWSNVZCDRKM-CQSZACIVSA-N	0	3	314.389	2.025	10	0		DEAEHN
COCCN1C(=O)CC[C@H](N)[C@H]1c1ccc(Cl)c(F)c1	ZINC000070292897	190877491	/nfs/dbraw/zinc/87/74/91/190877491.db2.gz	BJSAXLMVUNRMGW-GXTWGEPZSA-N	0	3	300.761	2.116	10	0		DEAEHN
C[C@@H](N)c1cccc(S(=O)(=O)N[C@H](C)c2nccs2)c1	ZINC000080343711	192150504	/nfs/dbraw/zinc/15/05/04/192150504.db2.gz	CAUSGIGIURQSAH-NXEZZACHSA-N	0	3	311.432	2.202	10	0		DEAEHN
CNC(=O)[C@H](NCCOc1ccc(C(F)(F)F)cc1)C(C)C	ZINC000183635300	539663856	/nfs/dbraw/zinc/66/38/56/539663856.db2.gz	DHIPMMHJYANKQZ-CYBMUJFWSA-N	0	3	318.339	2.444	10	0		DEAEHN
CNC(=O)c1ccc(Cl)c(NC(=O)[C@@H]2CCCCCN2)c1	ZINC000083896780	192390911	/nfs/dbraw/zinc/39/09/11/192390911.db2.gz	PEIBZFDXVFUCCV-LBPRGKRZSA-N	0	3	309.797	2.170	10	0		DEAEHN
CC(C)C[C@@](C)(O)c1c(Br)cnn1CCN(C)C	ZINC000133450232	185985373	/nfs/dbraw/zinc/98/53/73/185985373.db2.gz	TVQBIVXDHYNSHB-CYBMUJFWSA-N	0	3	318.259	2.461	10	0		DEAEHN
CC(C)[NH2+]Cc1ccc(F)c(S(=O)(=O)[N-]C2CC(C)C2)c1	ZINC000133621337	186000309	/nfs/dbraw/zinc/00/03/09/186000309.db2.gz	ADZZYTITLHHJON-UHFFFAOYSA-N	0	3	314.426	2.401	10	0		DEAEHN
CCN(CC)C(=O)NC1CCN(CCc2ccncc2)CC1	ZINC000072078957	191033844	/nfs/dbraw/zinc/03/38/44/191033844.db2.gz	ZUJUHXIJBASHEB-UHFFFAOYSA-N	0	3	304.438	2.140	10	0		DEAEHN
CCN[C@@H](C)c1ccc(OC)cc1OCCCS(C)(=O)=O	ZINC000138532284	186017638	/nfs/dbraw/zinc/01/76/38/186017638.db2.gz	AWGKITHCQRASFO-LBPRGKRZSA-N	0	3	315.435	2.179	10	0		DEAEHN
CC(C)[C@@H]1N[C@H](c2ccsc2)N(C2CCN(C)CC2)C1=O	ZINC000141241848	186029081	/nfs/dbraw/zinc/02/90/81/186029081.db2.gz	JBSTYQJZXGEZHH-GJZGRUSLSA-N	0	3	307.463	2.297	10	0		DEAEHN
CNCc1sc([C@@H]2CCS(=O)(=O)C2)nc1-c1ccccc1	ZINC000150327099	186056730	/nfs/dbraw/zinc/05/67/30/186056730.db2.gz	LHPXTLKLYDROCT-GFCCVEGCSA-N	0	3	322.455	2.432	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)ccc1F	ZINC000155718900	186106509	/nfs/dbraw/zinc/10/65/09/186106509.db2.gz	PTCVXUHACYXVSP-BZNIZROVSA-N	0	3	321.396	2.243	10	0		DEAEHN
CCCNc1nc(N(C)C)nc(N2C[C@@H](C)S[C@H](C)C2)n1	ZINC000155889721	186121018	/nfs/dbraw/zinc/12/10/18/186121018.db2.gz	BRIANOLUFKVTSO-GHMZBOCLSA-N	0	3	310.471	2.090	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1ccc(C)cc1Br	ZINC000159546748	186126126	/nfs/dbraw/zinc/12/61/26/186126126.db2.gz	UREQXALMIIEENV-NSHDSACASA-N	0	3	315.211	2.450	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1ccc(Br)c(C)c1	ZINC000159556374	186126794	/nfs/dbraw/zinc/12/67/94/186126794.db2.gz	UIWUDOXZBWUXFI-GFCCVEGCSA-N	0	3	315.211	2.450	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)N1CCC[C@H](Cc2noc(C)n2)C1	ZINC000171510326	186170824	/nfs/dbraw/zinc/17/08/24/186170824.db2.gz	PLARXMAUTUFGQU-CABCVRRESA-N	0	3	320.437	2.034	10	0		DEAEHN
CC(C(=O)N(Cc1cccs1)C[C@H]1CCCO1)=C1CNC1	ZINC000164168780	186151497	/nfs/dbraw/zinc/15/14/97/186151497.db2.gz	MCVVYKXMFNJFFN-CQSZACIVSA-N	0	3	306.431	2.175	10	0		DEAEHN
C[C@@H]1C[C@H](C)N(S(=O)(=O)c2ccc(CN)cc2Cl)C1	ZINC000164242547	186153354	/nfs/dbraw/zinc/15/33/54/186153354.db2.gz	ZOVZLLKLLPCOPV-ZJUUUORDSA-N	0	3	302.827	2.218	10	0		DEAEHN
Cc1ccc([C@@H](N)[C@H]2CCS(=O)(=O)C2)c(Br)c1	ZINC000164264759	186153640	/nfs/dbraw/zinc/15/36/40/186153640.db2.gz	FGRTUWVHYSDVJD-CABZTGNLSA-N	0	3	318.236	2.192	10	0		DEAEHN
Cc1ccc([C@H](N)[C@H]2CCS(=O)(=O)C2)c(Br)c1	ZINC000164264655	186153755	/nfs/dbraw/zinc/15/37/55/186153755.db2.gz	FGRTUWVHYSDVJD-JOYOIKCWSA-N	0	3	318.236	2.192	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)Nc2nnc(C(F)F)s2)CCN1C	ZINC000175647370	186184543	/nfs/dbraw/zinc/18/45/43/186184543.db2.gz	ZPLMLOVFXCYJGJ-JGVFFNPUSA-N	0	3	319.381	2.422	10	0		DEAEHN
Cc1csc(NC(=O)c2cnc([C@H]3CCCN(C)C3)cn2)n1	ZINC000072365610	191133863	/nfs/dbraw/zinc/13/38/63/191133863.db2.gz	GLXDKTUSSBTAGA-NSHDSACASA-N	0	3	317.418	2.303	10	0		DEAEHN
O=C(Nc1ccc2c(c1)CCCO2)N1CCN2CCC[C@@H]2C1	ZINC000171892556	198002793	/nfs/dbraw/zinc/00/27/93/198002793.db2.gz	OOMSBIHIFGBSMV-OAHLLOKOSA-N	0	3	301.390	2.324	10	0		DEAEHN
COc1cc(F)c(NC(=O)N2CCN3CCC[C@H]3C2)cc1OC	ZINC000171894950	198002811	/nfs/dbraw/zinc/00/28/11/198002811.db2.gz	ZJMPGDNNOSLDAT-NSHDSACASA-N	0	3	323.368	2.155	10	0		DEAEHN
O=C(NCCc1cccc(Cl)c1)N1CCN2CCC[C@H]2C1	ZINC000171898260	198003879	/nfs/dbraw/zinc/00/38/79/198003879.db2.gz	QDCQQHRRIBIUJS-HNNXBMFYSA-N	0	3	307.825	2.372	10	0		DEAEHN
O=C(NCc1nc2ccccc2s1)N1CCN2CCC[C@@H]2C1	ZINC000171897157	198004244	/nfs/dbraw/zinc/00/42/44/198004244.db2.gz	BUADSNAIWPVUCP-GFCCVEGCSA-N	0	3	316.430	2.286	10	0		DEAEHN
Cc1ccccc1C[C@@H](C)NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171902859	198004629	/nfs/dbraw/zinc/00/46/29/198004629.db2.gz	XZWLVSGQOFKKCI-NVXWUHKLSA-N	0	3	301.434	2.416	10	0		DEAEHN
CC[C@@H](Cc1ccccc1)NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171906967	198005751	/nfs/dbraw/zinc/00/57/51/198005751.db2.gz	YJMXPTGXHSBZGK-DLBZAZTESA-N	0	3	301.434	2.497	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)C[C@H]2CCCc3ccccc32)CCO1	ZINC000172306684	198077185	/nfs/dbraw/zinc/07/71/85/198077185.db2.gz	NKXWYICRLONDDZ-SJORKVTESA-N	0	3	316.445	2.286	10	0		DEAEHN
CCn1cnnc1[C@H]1CCCN(CCc2scnc2C)C1	ZINC000172532063	198110830	/nfs/dbraw/zinc/11/08/30/198110830.db2.gz	YRFUPYDWQIYYDD-ZDUSSCGKSA-N	0	3	305.451	2.485	10	0		DEAEHN
O=C([C@@H]1C[C@@H]1c1cccc(F)c1F)N1CCN2CCC[C@@H]2C1	ZINC000172907591	198166364	/nfs/dbraw/zinc/16/63/64/198166364.db2.gz	HRSBPRRBUWCVPO-MRVWCRGKSA-N	0	3	306.356	2.375	10	0		DEAEHN
Cc1nc([C@@H](C)NC(=O)N[C@H](C)C2=CCN(C)CC2)cs1	ZINC000332843470	539941598	/nfs/dbraw/zinc/94/15/98/539941598.db2.gz	WOBKCOLKMJCNJO-GHMZBOCLSA-N	0	3	308.451	2.462	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCN2CCC[C@@H]2C1)Cc1cccs1	ZINC000173505090	198221601	/nfs/dbraw/zinc/22/16/01/198221601.db2.gz	HGQSLFKSPBEKIY-ZIAGYGMSSA-N	0	3	307.463	2.416	10	0		DEAEHN
O=C(NCCc1cccc(F)c1)N1CC[C@@H](N2CC=CC2)C1	ZINC000173541220	198225628	/nfs/dbraw/zinc/22/56/28/198225628.db2.gz	UHRHCSQNIILSOK-MRXNPFEDSA-N	0	3	303.381	2.024	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCCOc2cccc(F)c2)CCN1C	ZINC000174046730	198285390	/nfs/dbraw/zinc/28/53/90/198285390.db2.gz	QKUKEUZEGNXCIF-UKRRQHHQSA-N	0	3	323.412	2.329	10	0		DEAEHN
CN(Cc1cnn(-c2ccccc2)c1)C(=O)C1CCN(C)CC1	ZINC000174460682	198337467	/nfs/dbraw/zinc/33/74/67/198337467.db2.gz	KVKYZQJLWOQJRR-UHFFFAOYSA-N	0	3	312.417	2.173	10	0		DEAEHN
Cc1cccc2c(CCNC(=O)NC[C@@H]3CCCN3C)c[nH]c21	ZINC000174351963	198323101	/nfs/dbraw/zinc/32/31/01/198323101.db2.gz	VCHWQDMSSMFUOT-HNNXBMFYSA-N	0	3	314.433	2.412	10	0		DEAEHN
COc1cc(CNC[C@](C)(O)c2ccco2)cc2c1OCCO2	ZINC000174528596	198348199	/nfs/dbraw/zinc/34/81/99/198348199.db2.gz	SRPILNNXZOVLNB-KRWDZBQOSA-N	0	3	319.357	2.057	10	0		DEAEHN
CC1(C)OC(=O)C(=CC(=O)C=CCN2CCCCC2)C(=O)O1	ZINC000048546653	354353625	/nfs/dbraw/zinc/35/36/25/354353625.db2.gz	BXTKDOZXIDWPGQ-NGSBCVAZSA-N	0	3	307.346	2.190	10	0		DEAEHN
CC(C)(C)CCN1CCN(C(=O)NCc2cscn2)CC1	ZINC000051751734	354389033	/nfs/dbraw/zinc/38/90/33/354389033.db2.gz	NQWWEWJSLAJLFL-UHFFFAOYSA-N	0	3	310.467	2.407	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCC2CCOCC2)[C@H]1c1ccccc1	ZINC000245656942	283051390	/nfs/dbraw/zinc/05/13/90/283051390.db2.gz	OMPVQDHBBIBCHM-IAGOWNOFSA-N	0	3	317.433	2.158	10	0		DEAEHN
COc1cccc(F)c1[C@H](C)NC(=O)N[C@H]1CCN(C2CC2)C1	ZINC000074267403	355018330	/nfs/dbraw/zinc/01/83/30/355018330.db2.gz	SYNDMDMBEQEKMD-RYUDHWBXSA-N	0	3	321.396	2.431	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCCCC(C)(C)CO	ZINC000073722602	191348729	/nfs/dbraw/zinc/34/87/29/191348729.db2.gz	KVHPCVNEQZQTBK-AWEZNQCLSA-N	0	3	301.475	2.061	10	0		DEAEHN
CCN(CC)C[C@H](C)NS(=O)(=O)c1ccc(F)cc1C	ZINC000440071404	540181043	/nfs/dbraw/zinc/18/10/43/540181043.db2.gz	BNHJXNKDYAPDFE-LBPRGKRZSA-N	0	3	302.415	2.143	10	0		DEAEHN
COc1ccc2c(CC(=O)NC[C@@H]3CCCN(C)C3)coc2c1	ZINC000108335719	355734273	/nfs/dbraw/zinc/73/42/73/355734273.db2.gz	LYZRTXJFERFCEP-ZDUSSCGKSA-N	0	3	316.401	2.442	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCC(F)(F)F)[C@H]1c1ccccc1	ZINC000245704080	283125144	/nfs/dbraw/zinc/12/51/44/283125144.db2.gz	ZYYLYNZRXBDYOB-NWDGAFQWSA-N	0	3	301.312	2.293	10	0		DEAEHN
CC(=O)N1CC[C@H](CN(C)Cc2cnc(-c3ccccc3)[nH]2)C1	ZINC000180825857	356061709	/nfs/dbraw/zinc/06/17/09/356061709.db2.gz	MJHXKNCWJICWIX-OAHLLOKOSA-N	0	3	312.417	2.377	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCCC[C@H]1NCCc1cc(F)ccc1F	ZINC000183065672	356159043	/nfs/dbraw/zinc/15/90/43/356159043.db2.gz	SEVSHTATHKXHHV-HUUCEWRRSA-N	0	3	317.401	2.453	10	0		DEAEHN
COc1cc(C[NH2+][C@H](C)[C@@H](C)CO)cc(Br)c1[O-]	ZINC000080204298	192012508	/nfs/dbraw/zinc/01/25/08/192012508.db2.gz	MYNPJDWAZXTQGH-DTWKUNHWSA-N	0	3	318.211	2.270	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CCc3ccccc3[C@H]2CN)s1	ZINC000227721812	356280425	/nfs/dbraw/zinc/28/04/25/356280425.db2.gz	UJZXOGAIIRQHQU-CQSZACIVSA-N	0	3	322.455	2.303	10	0		DEAEHN
NCc1ccc(OC(F)(F)F)c(I)n1	ZINC000238682443	356305295	/nfs/dbraw/zinc/30/52/95/356305295.db2.gz	NSLHRIMGZNWGFY-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
C[C@H]1CCC[C@](N)(C(=O)Nc2ccc(C(N)=O)c(Cl)c2)C1	ZINC000080917111	192200288	/nfs/dbraw/zinc/20/02/88/192200288.db2.gz	DPMSSIPEDPRGQN-BJOHPYRUSA-N	0	3	309.797	2.285	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)CC/C=C\c2ccccc2)CCO1	ZINC000254994329	356337348	/nfs/dbraw/zinc/33/73/48/356337348.db2.gz	BSSOSNQIKOOPCX-IVEQORNPSA-N	0	3	302.418	2.269	10	0		DEAEHN
COC[C@H]1CCN([C@@H](CN)c2ccc(Br)o2)C1	ZINC000081049408	192218716	/nfs/dbraw/zinc/21/87/16/192218716.db2.gz	WFUGOBSWHHPIKV-UWVGGRQHSA-N	0	3	303.200	2.010	10	0		DEAEHN
O[C@H](CN1CCOC[C@@H]1[C@H]1CCCC[C@H]1O)C1CCCCC1	ZINC000408043319	283165784	/nfs/dbraw/zinc/16/57/84/283165784.db2.gz	JVZNYNCJXJECAX-BRSBDYLESA-N	0	3	311.466	2.180	10	0		DEAEHN
O[C@H](CN1CCOC[C@@H]1[C@@H]1CCCC[C@@H]1O)C1CCCCC1	ZINC000408043321	283165806	/nfs/dbraw/zinc/16/58/06/283165806.db2.gz	JVZNYNCJXJECAX-XWTMOSNGSA-N	0	3	311.466	2.180	10	0		DEAEHN
CC(C)c1cc(C(=O)N(C)C[C@@H]2CCc3nccn3C2)n[nH]1	ZINC000328628967	356464209	/nfs/dbraw/zinc/46/42/09/356464209.db2.gz	OGZYIZKQCMVWKI-LBPRGKRZSA-N	0	3	301.394	2.064	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N[C@@H]1CN(C)Cc2ccccc21	ZINC000536036063	540240801	/nfs/dbraw/zinc/24/08/01/540240801.db2.gz	PZANPNWSEXRRQF-SJORKVTESA-N	0	3	301.434	2.164	10	0		DEAEHN
C([C@H]1CCCO1)N1CCN(C[C@H]2CCCO2)[C@@H]2CCCC[C@H]21	ZINC000550453376	540242835	/nfs/dbraw/zinc/24/28/35/540242835.db2.gz	USNKYCBTIFIBOR-BRSBDYLESA-N	0	3	308.466	2.273	10	0		DEAEHN
COc1cc(C[NH2+][C@H]2CO[C@H](C)C2)cc(Br)c1[O-]	ZINC000402030759	356728497	/nfs/dbraw/zinc/72/84/97/356728497.db2.gz	YUWZIYSAOPZMRM-PSASIEDQSA-N	0	3	316.195	2.430	10	0		DEAEHN
Brc1csc(CN2CC[C@H]3OCCN[C@@H]3C2)c1	ZINC000404186549	356732491	/nfs/dbraw/zinc/73/24/91/356732491.db2.gz	FAMIMYLZSCWIFY-VXGBXAGGSA-N	0	3	317.252	2.073	10	0		DEAEHN
CNCc1csc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)c1	ZINC000088919100	192657267	/nfs/dbraw/zinc/65/72/67/192657267.db2.gz	ZCEIXKIBCIJUAR-QWRGUYRKSA-N	0	3	302.465	2.134	10	0		DEAEHN
CN(CC(=O)NC(=O)NC1CCCCC1)C[C@@H]1CC=CCC1	ZINC000581659589	357224519	/nfs/dbraw/zinc/22/45/19/357224519.db2.gz	OXBOZZPVZNZRQF-CQSZACIVSA-N	0	3	307.438	2.433	10	0		DEAEHN
CCN(C1CCCC1)S(=O)(=O)c1cc(CN)ccc1OC	ZINC000088959868	192669417	/nfs/dbraw/zinc/66/94/17/192669417.db2.gz	UFPFXOGKLHTXFY-UHFFFAOYSA-N	0	3	312.435	2.107	10	0		DEAEHN
CC[C@H](Nc1ccccc1)C(=O)Nc1cnn(CCN(C)C)c1	ZINC000588763914	357421566	/nfs/dbraw/zinc/42/15/66/357421566.db2.gz	AJKJACVORRROOH-INIZCTEOSA-N	0	3	315.421	2.274	10	0		DEAEHN
CN(C)CCn1cc(NC(=O)c2cnc(C3CC3)s2)cn1	ZINC000591170400	357685469	/nfs/dbraw/zinc/68/54/69/357685469.db2.gz	ICQHSSVHQVCHGW-UHFFFAOYSA-N	0	3	305.407	2.031	10	0		DEAEHN
O[C@H](CNc1ncc(C(F)(F)F)s1)CN1CCCCC1	ZINC000276745311	213081327	/nfs/dbraw/zinc/08/13/27/213081327.db2.gz	GZGSVNPMVABZAC-SECBINFHSA-N	0	3	309.357	2.421	10	0		DEAEHN
COc1ccc(C[C@H](C)CNC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000179511269	199047334	/nfs/dbraw/zinc/04/73/34/199047334.db2.gz	GWRUHOMDZZGIRJ-GOEBONIOSA-N	0	3	319.449	2.219	10	0		DEAEHN
CC(C)C1CCN(C(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)CC1	ZINC000262426562	535378334	/nfs/dbraw/zinc/37/83/34/535378334.db2.gz	FLRMLCSDVCHXIC-RLFYNMQTSA-N	0	3	308.466	2.414	10	0		DEAEHN
COCCC[C@H](C)[NH2+][C@H](CC(C)C)c1nc(-c2nc[n-]n2)no1	ZINC000179809933	199083249	/nfs/dbraw/zinc/08/32/49/199083249.db2.gz	AIIOABZRUHLABR-NWDGAFQWSA-N	0	3	322.413	2.347	10	0		DEAEHN
COCCC[C@H](C)N[C@H](CC(C)C)c1nc(-c2nc[nH]n2)no1	ZINC000179809933	199083251	/nfs/dbraw/zinc/08/32/51/199083251.db2.gz	AIIOABZRUHLABR-NWDGAFQWSA-N	0	3	322.413	2.347	10	0		DEAEHN
CCCn1cc(C(=O)N[C@@H](CN(C)C)c2ccccc2)cn1	ZINC000180564818	199177099	/nfs/dbraw/zinc/17/70/99/199177099.db2.gz	XSBSAGUMWJACCF-INIZCTEOSA-N	0	3	300.406	2.326	10	0		DEAEHN
COc1ccc(C[C@H](C)C(=O)NC[C@@H]2CCCN2C)cc1OC	ZINC000180613345	199184676	/nfs/dbraw/zinc/18/46/76/199184676.db2.gz	SHBUUSLSHZSPDH-ZFWWWQNUSA-N	0	3	320.433	2.093	10	0		DEAEHN
CCn1cc([C@@H](C)N[C@@H]2CCCN(c3cccnn3)C2)cn1	ZINC000180934944	199230219	/nfs/dbraw/zinc/23/02/19/199230219.db2.gz	KSCIFZCHRKYPNC-UKRRQHHQSA-N	0	3	300.410	2.013	10	0		DEAEHN
COc1cc(CN(C)C[C@H]2CCCC[C@@H]2O)cc2c1OCCO2	ZINC000181094381	199251431	/nfs/dbraw/zinc/25/14/31/199251431.db2.gz	QUASEJRATYKPGH-CABCVRRESA-N	0	3	321.417	2.449	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)Nc2ccc3scnc3c2)CCO1	ZINC000181192968	199263928	/nfs/dbraw/zinc/26/39/28/199263928.db2.gz	QZBVARMWNVEDEI-GFCCVEGCSA-N	0	3	320.418	2.091	10	0		DEAEHN
CCc1nn(C)c(CNC[C@@H]2CCCOC2)c1Br	ZINC000089317172	192766391	/nfs/dbraw/zinc/76/63/91/192766391.db2.gz	GXSJNNKJDODQPP-JTQLQIEISA-N	0	3	316.243	2.261	10	0		DEAEHN
CN(C[C@H](O)CO[C@@H]1CCCc2ccccc21)CC1(CO)CC1	ZINC000186806185	200014575	/nfs/dbraw/zinc/01/45/75/200014575.db2.gz	CQQWHJLLOODART-FUHWJXTLSA-N	0	3	319.445	2.146	10	0		DEAEHN
C[C@H](NCc1ccc(Cl)cn1)C1CCS(=O)(=O)CC1	ZINC000187420759	200110792	/nfs/dbraw/zinc/11/07/92/200110792.db2.gz	JIPUJLPMWMUNAH-JTQLQIEISA-N	0	3	302.827	2.038	10	0		DEAEHN
O[C@@H](CN1CC[C@@H](CNc2ccccn2)C1)CC(F)(F)F	ZINC000189366868	200389055	/nfs/dbraw/zinc/38/90/55/200389055.db2.gz	ATRQTRLDHZSMAM-NWDGAFQWSA-N	0	3	303.328	2.129	10	0		DEAEHN
COc1ccc([C@@H](C)NC(=O)N[C@H]2CCN(C3CC3)C2)cc1F	ZINC000604161813	360887417	/nfs/dbraw/zinc/88/74/17/360887417.db2.gz	NFCNOKQFVHKMJL-YPMHNXCESA-N	0	3	321.396	2.431	10	0		DEAEHN
CCc1cnc(NC(=O)Nc2cnn(CCN(C)C)c2)s1	ZINC000608333196	361197955	/nfs/dbraw/zinc/19/79/55/361197955.db2.gz	FXYWVAQAPMTUGW-UHFFFAOYSA-N	0	3	308.411	2.108	10	0		DEAEHN
CCOCCOCC(=O)N[C@@H](CN)c1ccc2ccccc2c1	ZINC000193438857	201052488	/nfs/dbraw/zinc/05/24/88/201052488.db2.gz	NMAOTNYMHWRKCD-KRWDZBQOSA-N	0	3	316.401	2.009	10	0		DEAEHN
Cc1nc2n(n1)CCC[C@H]2N[C@H]1[C@H]2CCO[C@H]2C12CCCC2	ZINC000194111699	201180421	/nfs/dbraw/zinc/18/04/21/201180421.db2.gz	ZZDWNYZLTYTCLZ-APIJFGDWSA-N	0	3	302.422	2.359	10	0		DEAEHN
CCOC(=O)CCN[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000611406208	361593965	/nfs/dbraw/zinc/59/39/65/361593965.db2.gz	VXJHHFZDLRUALF-HNNXBMFYSA-N	0	3	307.390	2.470	10	0		DEAEHN
CCO[C@H](CNC(=O)N1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000195187358	201356258	/nfs/dbraw/zinc/35/62/58/201356258.db2.gz	HYABEWLPQHMHAH-IAGOWNOFSA-N	0	3	317.433	2.254	10	0		DEAEHN
O[C@@H]1COCC[C@@H]1NCc1ccc(Br)cc1Cl	ZINC000623765771	365166525	/nfs/dbraw/zinc/16/65/25/365166525.db2.gz	WYTMDCHBWHYCGV-NWDGAFQWSA-N	0	3	320.614	2.342	10	0		DEAEHN
c1cc(CNC[C@@H]2CN(Cc3ccncc3)CCO2)cs1	ZINC000623780823	365173707	/nfs/dbraw/zinc/17/37/07/365173707.db2.gz	YOASDCQRIGEWPO-MRXNPFEDSA-N	0	3	303.431	2.134	10	0		DEAEHN
CN(CC1CC(O)C1)[C@@H](CN)c1ccc(Br)s1	ZINC000091451484	193058708	/nfs/dbraw/zinc/05/87/08/193058708.db2.gz	QHVNYXLZBUIKCH-RTBKNWGFSA-N	0	3	319.268	2.213	10	0		DEAEHN
C1=CCN([C@H]2CCN(c3nc4ccccc4n4cncc34)C2)C1	ZINC000623997454	365248800	/nfs/dbraw/zinc/24/88/00/365248800.db2.gz	NBNOWUYOKNWVAV-AWEZNQCLSA-N	0	3	305.385	2.333	10	0		DEAEHN
C[S@](=O)CCN[C@@H]1CCc2c1cccc2Br	ZINC000091341902	193044045	/nfs/dbraw/zinc/04/40/45/193044045.db2.gz	UUBRPKCUEHAMGI-MLGOLLRUSA-N	0	3	302.237	2.405	10	0		DEAEHN
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(Br)cc1	ZINC000450663232	242079605	/nfs/dbraw/zinc/07/96/05/242079605.db2.gz	RONPLPQGVDDKLP-NOZJJQNGSA-N	0	3	300.196	2.440	10	0		DEAEHN
Cc1nn(C)cc1CC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450701072	242116097	/nfs/dbraw/zinc/11/60/97/242116097.db2.gz	VMHMITPLNZAFMF-KBXCAEBGSA-N	0	3	314.433	2.079	10	0		DEAEHN
CCNCc1csc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)c1	ZINC000092113451	193161153	/nfs/dbraw/zinc/16/11/53/193161153.db2.gz	CXSSRQHABRSTPE-PHIMTYICSA-N	0	3	302.465	2.134	10	0		DEAEHN
CCc1ccc(CNC)cc1S(=O)(=O)N1C[C@H](C)[C@H](C)C1	ZINC000092113823	193161845	/nfs/dbraw/zinc/16/18/45/193161845.db2.gz	YGULWOFSJUSKHZ-BETUJISGSA-N	0	3	310.463	2.245	10	0		DEAEHN
CC[C@@H]1CCCN1S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115746	193163533	/nfs/dbraw/zinc/16/35/33/193163533.db2.gz	AJYUTPXTSGBMCI-GFCCVEGCSA-N	0	3	300.399	2.108	10	0		DEAEHN
C[NH2+]Cc1ccc(S(=O)(=O)[N-]C[C@H](C)C(C)C)c(F)c1	ZINC000092116248	193163873	/nfs/dbraw/zinc/16/38/73/193163873.db2.gz	FUHRYBLCOKJHFS-NSHDSACASA-N	0	3	302.415	2.116	10	0		DEAEHN
CC(C)[NH2+]Cc1ccc(S(=O)(=O)[N-][C@@H]2C[C@H]2C)c(F)c1	ZINC000092116073	193163912	/nfs/dbraw/zinc/16/39/12/193163912.db2.gz	LHDXKYQOLRIVLY-ZWNOBZJWSA-N	0	3	300.399	2.010	10	0		DEAEHN
CC(C)[NH2+]Cc1ccc(S(=O)(=O)[N-][C@H]2CC2(C)C)c(F)c1	ZINC000092116019	193164602	/nfs/dbraw/zinc/16/46/02/193164602.db2.gz	ATJAMVBPVIWJSH-AWEZNQCLSA-N	0	3	314.426	2.401	10	0		DEAEHN
O[C@@H]1COCC[C@@H]1NCc1cccc(Br)c1Cl	ZINC000631182962	368067354	/nfs/dbraw/zinc/06/73/54/368067354.db2.gz	GPQZPKKOEZKMPE-WDEREUQCSA-N	0	3	320.614	2.342	10	0		DEAEHN
c1cc(CN[C@@H]2COC3(CCC3)C2)cc(N2CCSCC2)n1	ZINC000631723349	368358583	/nfs/dbraw/zinc/35/85/83/368358583.db2.gz	HSGCCPRWLBPPQG-HNNXBMFYSA-N	0	3	319.474	2.436	10	0		DEAEHN
COCC[C@@H](NC[C@H](O)COC)c1cccc(C(F)(F)F)c1	ZINC000451695499	243316522	/nfs/dbraw/zinc/31/65/22/243316522.db2.gz	QGCDZGRMIQWRKK-UONOGXRCSA-N	0	3	321.339	2.380	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N(CC)C[C@@H](C)CC)c[nH]1	ZINC000093265794	193222618	/nfs/dbraw/zinc/22/26/18/193222618.db2.gz	HGRHJELFEOPGMB-LBPRGKRZSA-N	0	3	301.456	2.181	10	0		DEAEHN
CC[C@H](C)CN(CC)S(=O)(=O)c1cc(CNC)n(CC)c1	ZINC000093265895	193222787	/nfs/dbraw/zinc/22/27/87/193222787.db2.gz	VOBPCHJJJCTNBK-ZDUSSCGKSA-N	0	3	315.483	2.284	10	0		DEAEHN
CCC[NH2+][C@]1(C(=O)[O-])CCC[C@@H](N(CC)CCOCC)C1	ZINC000093755076	193299262	/nfs/dbraw/zinc/29/92/62/193299262.db2.gz	HVZBWJRDHFOUOS-GDBMZVCRSA-N	0	3	300.443	2.110	10	0		DEAEHN
Cc1ccc2[nH]c(S[C@@H]3CCC[C@@](N)(C(N)=O)C3)nc2c1	ZINC000093779494	193305520	/nfs/dbraw/zinc/30/55/20/193305520.db2.gz	JYPRALNDSKZNAM-BMIGLBTASA-N	0	3	304.419	2.089	10	0		DEAEHN
Cc1ccc2nc(S[C@@H]3CCC[C@@](N)(C(N)=O)C3)[nH]c2c1	ZINC000093779494	193305523	/nfs/dbraw/zinc/30/55/23/193305523.db2.gz	JYPRALNDSKZNAM-BMIGLBTASA-N	0	3	304.419	2.089	10	0		DEAEHN
COc1cc(CN2CC[C@]3(CCOC3)C2)cc2c1OCCO2	ZINC000093820171	193312984	/nfs/dbraw/zinc/31/29/84/193312984.db2.gz	JITSQMCPDNVTNJ-KRWDZBQOSA-N	0	3	305.374	2.079	10	0		DEAEHN
CN[C@H](c1ccc(Cl)c(Cl)c1)[C@@H]1CN(C)CCN1C	ZINC000093894636	193325125	/nfs/dbraw/zinc/32/51/25/193325125.db2.gz	ZSMHPYVTHVDKNE-UONOGXRCSA-N	0	3	302.249	2.500	10	0		DEAEHN
CCOC(=O)C[C@]1(N2CCN(C)CC2)CSCCC1(C)C	ZINC000094485593	193372690	/nfs/dbraw/zinc/37/26/90/193372690.db2.gz	HLISKKTWJKWPGD-INIZCTEOSA-N	0	3	314.495	2.089	10	0		DEAEHN
CCN1CCC[C@H](Nc2nc(Br)cn3ccnc23)C1	ZINC000094488920	193373222	/nfs/dbraw/zinc/37/32/22/193373222.db2.gz	HRFKXAABCWQNBO-JTQLQIEISA-N	0	3	324.226	2.388	10	0		DEAEHN
CN[C@@H](Cc1c(Cl)cccc1Cl)[C@H]1CN2CCN1CC2	ZINC000094509039	193376083	/nfs/dbraw/zinc/37/60/83/193376083.db2.gz	XFTYKRDXUVTDOK-LSDHHAIUSA-N	0	3	314.260	2.124	10	0		DEAEHN
CN1CCCN(c2cc(F)c(Br)cc2N)CC1	ZINC000097368191	193711458	/nfs/dbraw/zinc/71/14/58/193711458.db2.gz	PKCPOKDEIJCRJL-UHFFFAOYSA-N	0	3	302.191	2.312	10	0		DEAEHN
CCN[C@@H](C[C@H]1CCS(=O)(=O)C1)c1cccc2c1OCC2	ZINC000097460628	193721936	/nfs/dbraw/zinc/72/19/36/193721936.db2.gz	QIXSLNOPADDRQC-DOMZBBRYSA-N	0	3	309.431	2.097	10	0		DEAEHN
C[C@H]1CN([C@@H](CN)c2ccc(Br)s2)CCO1	ZINC000019266431	182111479	/nfs/dbraw/zinc/11/14/79/182111479.db2.gz	HAJWAOYPOPXXLT-IUCAKERBSA-N	0	3	305.241	2.231	10	0		DEAEHN
CCN1CCN([C@@H](CN)c2ccc(Br)s2)CC1	ZINC000019281785	182112134	/nfs/dbraw/zinc/11/21/34/182112134.db2.gz	APZHQJIOIFSWPJ-JTQLQIEISA-N	0	3	318.284	2.148	10	0		DEAEHN
CC(C)CNCc1nnc(-n2cc(Br)cn2)s1	ZINC000160414302	197408215	/nfs/dbraw/zinc/40/82/15/197408215.db2.gz	DAMOSYHIKGOMGN-UHFFFAOYSA-N	0	3	316.228	2.232	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCN([C@@H](CN)c2cccs2)CC1	ZINC000020179230	182194529	/nfs/dbraw/zinc/19/45/29/182194529.db2.gz	QXEUWYLNHZBUBK-LBPRGKRZSA-N	0	3	311.451	2.301	10	0		DEAEHN
Nc1ccc(Cl)cc1NC(=O)CCCN1CCC(O)CC1	ZINC000020552523	182230850	/nfs/dbraw/zinc/23/08/50/182230850.db2.gz	RMMIOBJSGLMCJP-UHFFFAOYSA-N	0	3	311.813	2.098	10	0		DEAEHN
O=C([C@@H]1CCCN(Cc2ccccc2Cl)C1)N1CCOCC1	ZINC000038832726	183011065	/nfs/dbraw/zinc/01/10/65/183011065.db2.gz	PBIMCSUCZNLMJD-OAHLLOKOSA-N	0	3	322.836	2.411	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2ccc(Cl)c3ncccc23)C1	ZINC000040633636	183111897	/nfs/dbraw/zinc/11/18/97/183111897.db2.gz	CLFBUXYQEIRTAH-RNCFNFMXSA-N	0	3	305.765	2.204	10	0		DEAEHN
C[C@@H]1CN(c2ccc(CNCc3cccn3C)cn2)C[C@H](C)O1	ZINC000161657126	291676754	/nfs/dbraw/zinc/67/67/54/291676754.db2.gz	XPBUOONJQKHXHI-GASCZTMLSA-N	0	3	314.433	2.324	10	0		DEAEHN
COc1ccc([C@H](CNC(=O)c2cscn2)N(C)C)cc1	ZINC000041499433	183194582	/nfs/dbraw/zinc/19/45/82/183194582.db2.gz	IYFNYQOZCWKNBJ-AWEZNQCLSA-N	0	3	305.403	2.184	10	0		DEAEHN
CC(C)CNC(=O)COc1c(Br)cccc1CN	ZINC000042411355	183265158	/nfs/dbraw/zinc/26/51/58/183265158.db2.gz	VVGPQPKDNFJGLL-UHFFFAOYSA-N	0	3	315.211	2.059	10	0		DEAEHN
CNC(=O)COc1c(Br)cccc1CNC(C)C	ZINC000042411884	183266061	/nfs/dbraw/zinc/26/60/61/183266061.db2.gz	ZSKUVOUZJVOIPZ-UHFFFAOYSA-N	0	3	315.211	2.072	10	0		DEAEHN
CC[C@H](N)[C@@H](c1cccc(Cl)c1)N1CCC[C@@H]1C(=O)NC	ZINC000043015789	183327952	/nfs/dbraw/zinc/32/79/52/183327952.db2.gz	PHPNBFVCNLXAIM-RRFJBIMHSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC(C)N(CC(F)(F)F)S(=O)(=O)c1ccccc1CN	ZINC000042768661	183307022	/nfs/dbraw/zinc/30/70/22/183307022.db2.gz	CTZIJWDGPSNBRU-UHFFFAOYSA-N	0	3	310.341	2.107	10	0		DEAEHN
C[C@H](N(C)S(=O)(=O)c1cccc2c1CCNC2)C(C)(C)C	ZINC000042781274	183308223	/nfs/dbraw/zinc/30/82/23/183308223.db2.gz	UFODMXJJSUARDU-LBPRGKRZSA-N	0	3	310.463	2.387	10	0		DEAEHN
Cn1cc([C@H](CN)Oc2ccc(F)cc2Br)cn1	ZINC000043233231	183345858	/nfs/dbraw/zinc/34/58/58/183345858.db2.gz	OMLSKQARHUCAET-LBPRGKRZSA-N	0	3	314.158	2.401	10	0		DEAEHN
CC[C@@H](N)[C@H](c1sccc1C)N(C)CC(=O)N1CCCC1	ZINC000043248501	183347245	/nfs/dbraw/zinc/34/72/45/183347245.db2.gz	HWPLOMQDTDAMGR-UKRRQHHQSA-N	0	3	309.479	2.389	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccc(Cl)s1)N(C)CC(=O)N1CCCC1	ZINC000043253443	183347623	/nfs/dbraw/zinc/34/76/23/183347623.db2.gz	WCGXNWCUWRRZIW-QMTHXVAHSA-N	0	3	315.870	2.344	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)s1)N1CCC[C@@H]1C(=O)NC	ZINC000043253669	183347658	/nfs/dbraw/zinc/34/76/58/183347658.db2.gz	UDTGBUHUTMPTKL-BREBYQMCSA-N	0	3	315.870	2.390	10	0		DEAEHN
C[C@H](N)[C@H](c1ccc(Br)s1)N1CCOCC1	ZINC000043258523	183347754	/nfs/dbraw/zinc/34/77/54/183347754.db2.gz	BJGPKJWDBUZDSZ-GZMMTYOYSA-N	0	3	305.241	2.231	10	0		DEAEHN
CN[C@H](c1ccccc1C(F)(F)F)[C@H]1CCS(=O)(=O)C1	ZINC000043300415	183352150	/nfs/dbraw/zinc/35/21/50/183352150.db2.gz	HQXKFGXZUQWNFW-CABZTGNLSA-N	0	3	307.337	2.401	10	0		DEAEHN
CCN[C@H](c1ccccc1OC(F)F)[C@H]1CCS(=O)(=O)C1	ZINC000043300992	183352598	/nfs/dbraw/zinc/35/25/98/183352598.db2.gz	FXBAYXMNLLMVBH-GWCFXTLKSA-N	0	3	319.373	2.373	10	0		DEAEHN
COCCN(CCOC)[C@@H](CN)c1ccc(Cl)c(F)c1	ZINC000043390387	183358111	/nfs/dbraw/zinc/35/81/11/183358111.db2.gz	DYBQGKNKJZUDQM-AWEZNQCLSA-N	0	3	304.793	2.074	10	0		DEAEHN
CN1CCN(C(C)(C)C[NH2+]Cc2ccc([O-])c(Cl)c2)CC1	ZINC000043477304	183365843	/nfs/dbraw/zinc/36/58/43/183365843.db2.gz	OWNGYPWIHQDLEP-UHFFFAOYSA-N	0	3	311.857	2.161	10	0		DEAEHN
C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000175852764	296277156	/nfs/dbraw/zinc/27/71/56/296277156.db2.gz	QWJSAEXKLRAQSH-KFWWJZLASA-N	0	3	311.470	2.173	10	0		DEAEHN
Cc1ccc(-n2c(O)c3onc(-c4ccccc4)c3c2O)cc1	ZINC000105592271	194112580	/nfs/dbraw/zinc/11/25/80/194112580.db2.gz	DUSCDCLNXOSETO-HOCLYGCPSA-N	0	3	306.321	2.288	10	0		DEAEHN
CC[C@H]1CN(CCCOc2ccc(F)cc2)CCN1C[C@@H](C)O	ZINC000105825919	194138193	/nfs/dbraw/zinc/13/81/93/194138193.db2.gz	HBDTVUCCYVGAOI-WBVHZDCISA-N	0	3	324.440	2.372	10	0		DEAEHN
O[C@@H](CN1CCC(Nc2cccnn2)CC1)c1ccc(F)cc1	ZINC000105805287	194133492	/nfs/dbraw/zinc/13/34/92/194133492.db2.gz	MZGVJVOSRZUFMR-INIZCTEOSA-N	0	3	316.380	2.226	10	0		DEAEHN
Cc1nn(C)c(C)c1CN1CCC(Cc2nccn2C)CC1	ZINC000105876789	194154566	/nfs/dbraw/zinc/15/45/66/194154566.db2.gz	PLCVEAKEAJJLFL-UHFFFAOYSA-N	0	3	301.438	2.225	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(Cc2ccc(C(N)=O)cc2)C1	ZINC000105897082	194163192	/nfs/dbraw/zinc/16/31/92/194163192.db2.gz	AKCFMJQDFGFBOE-INIZCTEOSA-N	0	3	312.417	2.382	10	0		DEAEHN
CC(C)Oc1ccc(CNC[C@@H]2CN(C3CC3)CCO2)cc1	ZINC000106379546	194203364	/nfs/dbraw/zinc/20/33/64/194203364.db2.gz	VAIXBPKKPURDKI-GOSISDBHSA-N	0	3	304.434	2.427	10	0		DEAEHN
Cc1cc([C@@H](C)NS(=O)(=O)C[C@H]2CCCCN2)c(C)s1	ZINC000049631472	183749354	/nfs/dbraw/zinc/74/93/54/183749354.db2.gz	HTHKZCNATDCVDP-DGCLKSJQSA-N	0	3	316.492	2.487	10	0		DEAEHN
Cn1cnnc1CCNCc1ccc(F)cc1Br	ZINC000109423488	194262294	/nfs/dbraw/zinc/26/22/94/194262294.db2.gz	KTOYVRSBMMRHTI-UHFFFAOYSA-N	0	3	313.174	2.049	10	0		DEAEHN
CC[C@H]1CNCCN1c1ccccc1S(=O)(=O)C(F)(F)F	ZINC000110678169	194349231	/nfs/dbraw/zinc/34/92/31/194349231.db2.gz	SYKUNTCAZOENRT-JTQLQIEISA-N	0	3	322.352	2.168	10	0		DEAEHN
NC(=S)c1cc2c(nc1NCCN1CCCC1)CCCC2	ZINC000054134560	183925643	/nfs/dbraw/zinc/92/56/43/183925643.db2.gz	MSMPQIDXBPRWQX-UHFFFAOYSA-N	0	3	304.463	2.102	10	0		DEAEHN
CN(CCC(=O)N1CCc2sccc2C1)C[C@@H]1CCCO1	ZINC000056494949	184013603	/nfs/dbraw/zinc/01/36/03/184013603.db2.gz	VRNGEPRXSVTSQP-AWEZNQCLSA-N	0	3	308.447	2.134	10	0		DEAEHN
CCCN[C@@](C)(CCN(C)CCOC(C)C)C(=O)OCC	ZINC000157513207	197193125	/nfs/dbraw/zinc/19/31/25/197193125.db2.gz	VOGOYASLFAAYLL-INIZCTEOSA-N	0	3	302.459	2.055	10	0		DEAEHN
CCNC(C)(C)C(=O)Nc1cccc(Cl)c1-n1cncn1	ZINC000061292374	184167965	/nfs/dbraw/zinc/16/79/65/184167965.db2.gz	UTQOTBSBLPGIAW-UHFFFAOYSA-N	0	3	307.785	2.247	10	0		DEAEHN
Cc1ccccc1[C@H](N)CN1CCN(CC(F)(F)F)CC1	ZINC000061941106	184197585	/nfs/dbraw/zinc/19/75/85/184197585.db2.gz	XUZRADFCMNRDPQ-CQSZACIVSA-N	0	3	301.356	2.175	10	0		DEAEHN
C[C@H](N)[C@H](c1cccs1)N1CCN(CC(F)(F)F)CC1	ZINC000061940831	184197614	/nfs/dbraw/zinc/19/76/14/184197614.db2.gz	PXQFQVPOAMDEKF-CMPLNLGQSA-N	0	3	307.385	2.316	10	0		DEAEHN
N[C@@H]1CCCc2nc(N3CCN(CC(F)(F)F)CC3)sc21	ZINC000061948533	184197801	/nfs/dbraw/zinc/19/78/01/184197801.db2.gz	SLFWDXSLBPKXKR-SECBINFHSA-N	0	3	320.384	2.164	10	0		DEAEHN
CS(=O)(=O)c1cccc([C@@H](N)c2ccc3c(c2)COC3)c1	ZINC000062332381	184230844	/nfs/dbraw/zinc/23/08/44/184230844.db2.gz	FBXGAVMNZYJGRI-MRXNPFEDSA-N	0	3	303.383	2.168	10	0		DEAEHN
[NH3+][C@H]1CCCCC[C@H]1[N-]S(=O)(=O)c1cccc(Cl)c1F	ZINC000063213655	184278903	/nfs/dbraw/zinc/27/89/03/184278903.db2.gz	ABXIMJXUVKVXSM-WDEREUQCSA-N	0	3	320.817	2.417	10	0		DEAEHN
CN[C@@H](C)c1cc(Cl)ccc1OCCCS(C)(=O)=O	ZINC000063014449	184266583	/nfs/dbraw/zinc/26/65/83/184266583.db2.gz	ARWMYWNVZYJPSB-JTQLQIEISA-N	0	3	305.827	2.434	10	0		DEAEHN
CC[C@H](C)NCC(=O)Nc1ccc(C(=O)N(CC)CC)cc1	ZINC000066068133	184386270	/nfs/dbraw/zinc/38/62/70/184386270.db2.gz	KDIIIBMGQAVJRH-ZDUSSCGKSA-N	0	3	305.422	2.495	10	0		DEAEHN
CNc1ncc(Br)c(N[C@H]2CCN(C)[C@@H](C)C2)n1	ZINC000159241361	197339257	/nfs/dbraw/zinc/33/92/57/197339257.db2.gz	GBOLHPNTJFQYEN-IUCAKERBSA-N	0	3	314.231	2.175	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccccc2NC(=O)C(C)(C)C)C1	ZINC000112897474	194532552	/nfs/dbraw/zinc/53/25/52/194532552.db2.gz	BIJJHXYLBCCFPE-ZDUSSCGKSA-N	0	3	317.433	2.447	10	0		DEAEHN
CCn1ncc(Br)c1[C@H](C[C@H]1CCOC1)NC	ZINC000162046438	197538850	/nfs/dbraw/zinc/53/88/50/197538850.db2.gz	XXLQZEYBTRNZRI-KOLCDFICSA-N	0	3	302.216	2.353	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CCC2(CCCC2)C1	ZINC000173175436	285032957	/nfs/dbraw/zinc/03/29/57/285032957.db2.gz	CZYNNBWVYGYILQ-HNNXBMFYSA-N	0	3	309.454	2.073	10	0		DEAEHN
CCCNCc1cccc(Cl)c1OCCS(C)(=O)=O	ZINC000159153846	197331480	/nfs/dbraw/zinc/33/14/80/197331480.db2.gz	BIZKLTUZNMMQIH-UHFFFAOYSA-N	0	3	305.827	2.263	10	0		DEAEHN
CCNCc1cccc(Cl)c1OCCS(=O)(=O)CC	ZINC000159134014	197330799	/nfs/dbraw/zinc/33/07/99/197330799.db2.gz	WTMWFMFBQJWWCZ-UHFFFAOYSA-N	0	3	305.827	2.263	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(CC2CC2)C2CC2)cc(CN)c1F	ZINC000159121348	197328923	/nfs/dbraw/zinc/32/89/23/197328923.db2.gz	AKQQZIIAYWAEDT-UHFFFAOYSA-N	0	3	312.410	2.156	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)[C@H](C)C2CC2)cc(CN)c1F	ZINC000159071317	197324328	/nfs/dbraw/zinc/32/43/28/197324328.db2.gz	CUFPRBNDMWUHDG-SNVBAGLBSA-N	0	3	300.399	2.012	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2C[C@H](C)C[C@H](C)C2)cc(CN)c1F	ZINC000159055508	197323082	/nfs/dbraw/zinc/32/30/82/197323082.db2.gz	DPVOVKQQVMAVLZ-PHIMTYICSA-N	0	3	314.426	2.259	10	0		DEAEHN
NCc1csc(S(=O)(=O)N2CCCOc3ccccc32)c1	ZINC000158857482	197306748	/nfs/dbraw/zinc/30/67/48/197306748.db2.gz	RLTMDANMODAOKV-UHFFFAOYSA-N	0	3	324.427	2.185	10	0		DEAEHN
CNCc1cccc(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)c1C	ZINC000158743968	197298256	/nfs/dbraw/zinc/29/82/56/197298256.db2.gz	AZYJKDAFEGGGAN-GJZGRUSLSA-N	0	3	308.447	2.135	10	0		DEAEHN
CCCN[C@H](CS(=O)(=O)c1ccc(F)cc1)[C@H]1CCOC1	ZINC000158729472	197297181	/nfs/dbraw/zinc/29/71/81/197297181.db2.gz	GHWDWXUVYDESIX-SWLSCSKDSA-N	0	3	315.410	2.004	10	0		DEAEHN
CN(CCN[C@@H]1CCCc2[nH]c(=O)ccc21)C(=O)OC(C)(C)C	ZINC000158730592	197297024	/nfs/dbraw/zinc/29/70/24/197297024.db2.gz	LSSLDFBTJMEYGI-CYBMUJFWSA-N	0	3	321.421	2.209	10	0		DEAEHN
CN(C(=O)c1ncsc1Br)C1CCN(C)CC1	ZINC000288664244	220330634	/nfs/dbraw/zinc/33/06/34/220330634.db2.gz	PEEZMDAQTKBRDW-UHFFFAOYSA-N	0	3	318.240	2.072	10	0		DEAEHN
CCN[C@H](CS(=O)(=O)c1ccccc1Cl)[C@H]1CCOC1	ZINC000158719190	197296402	/nfs/dbraw/zinc/29/64/02/197296402.db2.gz	RGULCPGHJQQHPM-WCQYABFASA-N	0	3	317.838	2.128	10	0		DEAEHN
C[C@@H]1C[C@@H](Nc2nc3ccc(Br)cn3n2)CCN1C	ZINC000158443938	197273354	/nfs/dbraw/zinc/27/33/54/197273354.db2.gz	YEEBLHYKBGULJI-KOLCDFICSA-N	0	3	324.226	2.386	10	0		DEAEHN
CC[C@H]1CN(S(=O)(=O)c2cc(CN)sc2C)CCS1	ZINC000158427376	197272385	/nfs/dbraw/zinc/27/23/85/197272385.db2.gz	VXOCLSHVSPNBHU-JTQLQIEISA-N	0	3	320.505	2.031	10	0		DEAEHN
CC[C@@H]1CN(S(=O)(=O)c2cc(CN)sc2C)CCS1	ZINC000158427229	197272012	/nfs/dbraw/zinc/27/20/12/197272012.db2.gz	VXOCLSHVSPNBHU-SNVBAGLBSA-N	0	3	320.505	2.031	10	0		DEAEHN
COCc1cc([C@H](C)NC2CCS(=O)CC2)ccc1OC	ZINC000158014004	197235949	/nfs/dbraw/zinc/23/59/49/197235949.db2.gz	OFMWMTUVDKSDJS-LVYFYGABSA-N	0	3	311.447	2.403	10	0		DEAEHN
COC(=O)[C@](C)(C[C@H](C)N(C)CCOC(C)C)NC(C)C	ZINC000157500065	197192072	/nfs/dbraw/zinc/19/20/72/197192072.db2.gz	UVXJJCLCFKCVPW-HOCLYGCPSA-N	0	3	302.459	2.052	10	0		DEAEHN
CC(C)CNCc1nnc(-n2cc(C(F)(F)F)cn2)s1	ZINC000157473384	197190117	/nfs/dbraw/zinc/19/01/17/197190117.db2.gz	OTCDFJOAMPLRQY-UHFFFAOYSA-N	0	3	305.329	2.488	10	0		DEAEHN
CS(=O)(=O)c1ccc(N[C@H]2C[C@H](N)c3ccccc32)cn1	ZINC000157305282	197178151	/nfs/dbraw/zinc/17/81/51/197178151.db2.gz	MMLBPOQZNMNTJK-KBPBESRZSA-N	0	3	303.387	2.042	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1nnc(Cl)s1)c1ccccc1	ZINC000157246190	197173733	/nfs/dbraw/zinc/17/37/33/197173733.db2.gz	UXMOYQLDVFIZJY-SNVBAGLBSA-N	0	3	310.810	2.224	10	0		DEAEHN
C[C@@](O)(Cc1ccc(Br)s1)C[C@H]1COCCN1	ZINC000156804781	197142249	/nfs/dbraw/zinc/14/22/49/197142249.db2.gz	NSPDCQQVNNTSJZ-CABZTGNLSA-N	0	3	320.252	2.183	10	0		DEAEHN
C[C@@](O)(Cc1cccc(C(F)(F)F)c1)C[C@@H]1COCCN1	ZINC000156777852	197140350	/nfs/dbraw/zinc/14/03/50/197140350.db2.gz	XODUCFHAOXANQH-ZIAGYGMSSA-N	0	3	303.324	2.377	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC[C@@H]1c1c(C)nn(C)c1C)N(C)C	ZINC000155631695	197073337	/nfs/dbraw/zinc/07/33/37/197073337.db2.gz	MVKGTKKKGHSFCX-HUUCEWRRSA-N	0	3	306.454	2.431	10	0		DEAEHN
COc1ccc([C@@H]2C[C@@H](C)N(CCN3CCCC3=O)C2)cc1	ZINC000155257769	197038113	/nfs/dbraw/zinc/03/81/13/197038113.db2.gz	OZVKEUYTJIVQOW-GDBMZVCRSA-N	0	3	302.418	2.495	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)NCc1ccccc1OCCN(C)C	ZINC000120417193	195161771	/nfs/dbraw/zinc/16/17/71/195161771.db2.gz	GNJUEYGFUOTCHN-AWEZNQCLSA-N	0	3	307.438	2.471	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c(C)c1	ZINC000120534528	195185459	/nfs/dbraw/zinc/18/54/59/195185459.db2.gz	ZMOAZKBNUSMWSC-HUUCEWRRSA-N	0	3	317.433	2.183	10	0		DEAEHN
COc1ccc([C@H]2CCCN2C(=O)[C@@]2(F)CCNC2)c(OC)c1	ZINC000408513563	533203860	/nfs/dbraw/zinc/20/38/60/533203860.db2.gz	QDDFDIWNRVQSPV-RHSMWYFYSA-N	0	3	322.380	2.069	10	0		DEAEHN
Cc1cc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)ccc1F	ZINC000120701218	195219603	/nfs/dbraw/zinc/21/96/03/195219603.db2.gz	HTPIVFWXBATWPE-TZMCWYRMSA-N	0	3	321.396	2.014	10	0		DEAEHN
COCCN1CCN(Cc2c[nH]nc2-c2ccccc2)C[C@H]1C	ZINC000120798059	195239610	/nfs/dbraw/zinc/23/96/10/195239610.db2.gz	OUSWMXJITNXQHK-OAHLLOKOSA-N	0	3	314.433	2.229	10	0		DEAEHN
CN(C)CCOc1cccc(NC(=O)NC(C)(C)C(C)(C)O)c1	ZINC000543564813	285293557	/nfs/dbraw/zinc/29/35/57/285293557.db2.gz	OMBXMFKFJNIIQZ-UHFFFAOYSA-N	0	3	323.437	2.298	10	0		DEAEHN
Cc1cccc(CN2C(=O)C[C@H]3[C@H]2CCN3Cc2ccncc2)n1	ZINC000247862335	257116312	/nfs/dbraw/zinc/11/63/12/257116312.db2.gz	GYSZRRZUGDJXEH-MSOLQXFVSA-N	0	3	322.412	2.160	10	0		DEAEHN
O=C([C@@H]1C[C@@H]2[C@@H](CCN2CCc2ccccc2)O1)N1CCCC1	ZINC000247761308	257118433	/nfs/dbraw/zinc/11/84/33/257118433.db2.gz	HMJRDRVJKBNORI-KURKYZTESA-N	0	3	314.429	2.083	10	0		DEAEHN
CC(=O)c1csc(NC(=O)c2cccc3c2CCNC3)n1	ZINC000124310944	195627379	/nfs/dbraw/zinc/62/73/79/195627379.db2.gz	VFZCNTQGFGYRDU-UHFFFAOYSA-N	0	3	301.371	2.244	10	0		DEAEHN
COC1CCN(C(C)(C)CNC(=O)c2cccc(O)c2)CC1	ZINC000357429781	133077799	/nfs/dbraw/zinc/07/77/99/133077799.db2.gz	JRFUVRXDBDLPMO-UHFFFAOYSA-N	0	3	306.406	2.011	10	0		DEAEHN
C[C@H](NC(=O)NCc1ccc2cc[nH]c2n1)C1=CCN(C)CC1	ZINC000357915036	133109276	/nfs/dbraw/zinc/10/92/76/133109276.db2.gz	IHIULXSZRLFHSS-LBPRGKRZSA-N	0	3	313.405	2.013	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NC[C@H](C)Oc1cccc(OC)c1	ZINC000359606306	133134367	/nfs/dbraw/zinc/13/43/67/133134367.db2.gz	WFZHUJFFUJERRM-YOEHRIQHSA-N	0	3	320.433	2.453	10	0		DEAEHN
Cc1ccccc1N1CCN(C(=O)CC2CCN(C)CC2)CC1	ZINC000362463799	133231722	/nfs/dbraw/zinc/23/17/22/133231722.db2.gz	HZIIQFXSIQXPJM-UHFFFAOYSA-N	0	3	315.461	2.376	10	0		DEAEHN
CNC(=O)c1cccc(NC(=O)CC2CCN(C)CC2)c1C	ZINC000362564093	133238740	/nfs/dbraw/zinc/23/87/40/133238740.db2.gz	HGHBJWGMADZEEX-UHFFFAOYSA-N	0	3	303.406	2.025	10	0		DEAEHN
Cc1ccnc(C2CCN(C[C@H]3CC4(CC4)C(=O)O3)CC2)n1	ZINC000373038518	133375198	/nfs/dbraw/zinc/37/51/98/133375198.db2.gz	UWDAHXXXERQHMM-CQSZACIVSA-N	0	3	301.390	2.060	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccc(O[C@@H]3CCOC3)cc2)C1	ZINC000329868640	404478044	/nfs/dbraw/zinc/47/80/44/404478044.db2.gz	XRKAIYGWIJVIAQ-NVXWUHKLSA-N	0	3	318.417	2.068	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)CSCc2cccnc2)CCN1C	ZINC000124119304	144706734	/nfs/dbraw/zinc/70/67/34/144706734.db2.gz	AXYGFJVLXWFADC-UKRRQHHQSA-N	0	3	307.463	2.256	10	0		DEAEHN
CN(C)CCOc1cc(C(=O)NCCC2CCCC2)ccn1	ZINC000183108421	144924974	/nfs/dbraw/zinc/92/49/74/144924974.db2.gz	KMCDHOCRESLMOB-UHFFFAOYSA-N	0	3	305.422	2.332	10	0		DEAEHN
CC(C)N(C)C(=O)[C@@H](C)N1C[C@H](CO)[C@H](c2ccsc2)C1	ZINC000188127431	145007649	/nfs/dbraw/zinc/00/76/49/145007649.db2.gz	UJFLQKKOOHDEGL-YUELXQCFSA-N	0	3	310.463	2.011	10	0		DEAEHN
Cc1nn(C)c(C)c1CN1C[C@H](CO)[C@H](c2ccsc2)C1	ZINC000188136556	145007674	/nfs/dbraw/zinc/00/76/74/145007674.db2.gz	FXDXKBKUPMDWRD-ZBFHGGJFSA-N	0	3	305.447	2.306	10	0		DEAEHN
C[C@@H]1CC[C@@H](CN2CCC(c3nnc4ccccn43)CC2)O1	ZINC000188568884	145013926	/nfs/dbraw/zinc/01/39/26/145013926.db2.gz	FISFVGCZOCXVSZ-HIFRSBDPSA-N	0	3	300.406	2.476	10	0		DEAEHN
O=C([C@H]1C[C@@H]1c1cccc(F)c1F)N1CCN2CCC1CC2	ZINC000188668592	145015420	/nfs/dbraw/zinc/01/54/20/145015420.db2.gz	YUTSRXMUGPZWHW-KGLIPLIRSA-N	0	3	306.356	2.375	10	0		DEAEHN
CCc1nn(C)c(CC)c1CC(=O)NCCN1CCCC[C@H]1C	ZINC000188730718	145016658	/nfs/dbraw/zinc/01/66/58/145016658.db2.gz	MRNJQRWAAGTVKX-CQSZACIVSA-N	0	3	320.481	2.078	10	0		DEAEHN
C[C@H]1OCCC[C@H]1C(=O)Nc1ccc(OCCN(C)C)cc1	ZINC000188956743	145019913	/nfs/dbraw/zinc/01/99/13/145019913.db2.gz	AFFQPCJQJBQKIE-CZUORRHYSA-N	0	3	306.406	2.381	10	0		DEAEHN
CCCOc1cc(OC)ccc1C(=O)N1CC[C@H](N(C)C)C1	ZINC000191173412	145054305	/nfs/dbraw/zinc/05/43/05/145054305.db2.gz	NSLIMXNRGOSIMA-ZDUSSCGKSA-N	0	3	306.406	2.260	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)CC2CCCC2)C[C@H]1CC	ZINC000191335864	145056266	/nfs/dbraw/zinc/05/62/66/145056266.db2.gz	GBSGSMQRSVKYNS-QZTJIDSGSA-N	0	3	312.498	2.360	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2cccc(C3SCCS3)c2)C1	ZINC000191879434	145067015	/nfs/dbraw/zinc/06/70/15/145067015.db2.gz	XGPHHYJMCXQENY-QWHCGFSZSA-N	0	3	324.471	2.481	10	0		DEAEHN
O=C(Nc1cc(C(F)(F)F)ccn1)N1CCN2CCC[C@H]2C1	ZINC000192425474	145073713	/nfs/dbraw/zinc/07/37/13/145073713.db2.gz	SYGBTVWHMWOMMQ-NSHDSACASA-N	0	3	314.311	2.412	10	0		DEAEHN
Cn1c2ccc(CN3CC[C@@]4(CCOC4)C3)cc2sc1=O	ZINC000192626262	145076041	/nfs/dbraw/zinc/07/60/41/145076041.db2.gz	QJPNJWPVSZKAJL-MRXNPFEDSA-N	0	3	304.415	2.212	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCC(c2cnn(CC)c2)CC1	ZINC000193376048	145085141	/nfs/dbraw/zinc/08/51/41/145085141.db2.gz	CNOSCAKHKVWSKT-KRWDZBQOSA-N	0	3	309.454	2.260	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2OCCc3ccccc32)CCN1C	ZINC000246231307	145096112	/nfs/dbraw/zinc/09/61/12/145096112.db2.gz	GFNAUWFFWIGXFB-UKPHBRMFSA-N	0	3	302.418	2.242	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC000246354633	145100080	/nfs/dbraw/zinc/10/00/80/145100080.db2.gz	OFLOSZSXGRMHEZ-XIRDDKMYSA-N	0	3	302.418	2.399	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCC[C@@H]3OCC[C@H]32)CCN1C	ZINC000246370277	145100185	/nfs/dbraw/zinc/10/01/85/145100185.db2.gz	LLUOPPMHDVXFGV-LJIZCISZSA-N	0	3	309.454	2.068	10	0		DEAEHN
CCc1cccc(NC(=O)C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000246497101	145104759	/nfs/dbraw/zinc/10/47/59/145104759.db2.gz	RXJJENMIXUQEPP-CZUORRHYSA-N	0	3	317.433	2.032	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000246585421	145107311	/nfs/dbraw/zinc/10/73/11/145107311.db2.gz	YMKZLNWPQTYKJB-ZBFHGGJFSA-N	0	3	317.433	2.087	10	0		DEAEHN
C[C@@H](C(=O)NCc1ccccc1Cl)N1CCN2CCC[C@H]2C1	ZINC000246730234	145111853	/nfs/dbraw/zinc/11/18/53/145111853.db2.gz	VXBVUWNLERUPGE-ZFWWWQNUSA-N	0	3	321.852	2.125	10	0		DEAEHN
CCc1ccccc1OCC(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000246770510	145114190	/nfs/dbraw/zinc/11/41/90/145114190.db2.gz	AWBKNCXGQBZLEJ-GDBMZVCRSA-N	0	3	302.418	2.323	10	0		DEAEHN
O=C(CCN1CCS[C@@H]2COCC[C@H]21)Nc1ccccc1F	ZINC000246907158	145119330	/nfs/dbraw/zinc/11/93/30/145119330.db2.gz	MMLJXZBUSGJLHG-HUUCEWRRSA-N	0	3	324.421	2.361	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000246995104	145122099	/nfs/dbraw/zinc/12/20/99/145122099.db2.gz	BENTYPUMPWCUCO-ZOBUZTSGSA-N	0	3	301.434	2.032	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)COc1ccc(F)cc1F	ZINC000247085846	145126483	/nfs/dbraw/zinc/12/64/83/145126483.db2.gz	HZNWHOACKRLUGN-AAEUAGOBSA-N	0	3	310.344	2.039	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(CC(=O)N2CCCC[C@H]2C)C1	ZINC000247154967	145127239	/nfs/dbraw/zinc/12/72/39/145127239.db2.gz	LXZJKEWXTPJHAU-CVEARBPZSA-N	0	3	318.465	2.483	10	0		DEAEHN
CSc1cccc(NC(=O)CN2CCN3CCC[C@H]3C2)c1	ZINC000247185643	145127924	/nfs/dbraw/zinc/12/79/24/145127924.db2.gz	NWBLZUCIJXHPPH-AWEZNQCLSA-N	0	3	305.447	2.127	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@H]1CCCN(C(C)C)C1=O	ZINC000247193207	145129214	/nfs/dbraw/zinc/12/92/14/145129214.db2.gz	WQSGLMIORYSFER-CVEARBPZSA-N	0	3	304.438	2.055	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccn(-c3ccccc3)n2)C1	ZINC000247307357	145133008	/nfs/dbraw/zinc/13/30/08/145133008.db2.gz	QGUQNYKASSLUFD-YJBOKZPZSA-N	0	3	324.428	2.429	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H]1CCC[C@@H]2OCC[C@@H]21	ZINC000247476646	145138390	/nfs/dbraw/zinc/13/83/90/145138390.db2.gz	QRAHPYPTIHYENE-FPCVCCKLSA-N	0	3	309.454	2.070	10	0		DEAEHN
Cc1ccc(C)c(OCCN2CCC(C(=O)N(C)C)CC2)c1	ZINC000247962656	145145742	/nfs/dbraw/zinc/14/57/42/145145742.db2.gz	FUBLMECOFSXPOZ-UHFFFAOYSA-N	0	3	304.434	2.482	10	0		DEAEHN
Cc1cc(C)n(CC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)n1	ZINC000248120503	145148490	/nfs/dbraw/zinc/14/84/90/145148490.db2.gz	UEFKTICFONUSDA-WMZOPIPTSA-N	0	3	312.417	2.062	10	0		DEAEHN
c1ccc(NC[C@@H]2CCN(CCO[C@H]3CCCCO3)C2)nc1	ZINC000248538972	145157889	/nfs/dbraw/zinc/15/78/89/145157889.db2.gz	ASCRIVCOWMTXMB-RDJZCZTQSA-N	0	3	305.422	2.359	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(COC(C)(C)C)on1	ZINC000248558820	145158913	/nfs/dbraw/zinc/15/89/13/145158913.db2.gz	DQJDCMCXOONIDF-STQMWFEESA-N	0	3	321.421	2.298	10	0		DEAEHN
O=S1(=O)CC[C@H](N[C@@H]2CCC[C@H]3OCC[C@H]32)c2ccccc21	ZINC000248587161	145160416	/nfs/dbraw/zinc/16/04/16/145160416.db2.gz	YBTGMCUUEOMSST-DRPJVOAASA-N	0	3	321.442	2.452	10	0		DEAEHN
O[C@H](CN1CC[C@H](CNc2ccccn2)C1)CC(F)(F)F	ZINC000248865257	145170765	/nfs/dbraw/zinc/17/07/65/145170765.db2.gz	ATRQTRLDHZSMAM-NEPJUHHUSA-N	0	3	303.328	2.129	10	0		DEAEHN
C[C@@H]1CCC[C@H]1CC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000249054372	145177105	/nfs/dbraw/zinc/17/71/05/145177105.db2.gz	XHHNQBFTAHLQLT-FGTMMUONSA-N	0	3	321.509	2.441	10	0		DEAEHN
c1ncc(N2CCN3CCC[C@H]3C2)nc1OC1CCCCC1	ZINC000249270805	145181801	/nfs/dbraw/zinc/18/18/01/145181801.db2.gz	AXWUAXGMIZJZTA-AWEZNQCLSA-N	0	3	302.422	2.473	10	0		DEAEHN
O=C(Nc1ccc2c(c1F)CCNC2)c1ccnc(C2CC2)n1	ZINC000261729337	145221530	/nfs/dbraw/zinc/22/15/30/145221530.db2.gz	MQUWEMPYIBGBIG-UHFFFAOYSA-N	0	3	312.348	2.391	10	0		DEAEHN
Cc1ccc(NC(=O)CN2CCNC[C@@H]2c2cccnc2)cc1C	ZINC000261759433	145223376	/nfs/dbraw/zinc/22/33/76/145223376.db2.gz	NWVVLLZRDACGNI-GOSISDBHSA-N	0	3	324.428	2.283	10	0		DEAEHN
c1cn(-c2ccc(CN3CCNC[C@@H]3c3cccnc3)cc2)cn1	ZINC000261802066	145228340	/nfs/dbraw/zinc/22/83/40/145228340.db2.gz	QYQSMTWTAMKBQF-LJQANCHMSA-N	0	3	319.412	2.414	10	0		DEAEHN
CCOC(=O)C[C@H]1C[C@@H](OC)CN1Cc1cccc2c1NCC2	ZINC000261928387	145243190	/nfs/dbraw/zinc/24/31/90/145243190.db2.gz	LFPSXPZQGRSACG-HZPDHXFCSA-N	0	3	318.417	2.197	10	0		DEAEHN
COc1cc(NC(=O)[C@@H]2NCCCC2(C)C)cc(OC)c1OC	ZINC000261942443	145245102	/nfs/dbraw/zinc/24/51/02/145245102.db2.gz	UYGFOXYYQCILSL-HNNXBMFYSA-N	0	3	322.405	2.429	10	0		DEAEHN
CCC[C@](C)(N)C(=O)N1CCC[C@@H](c2noc(C3CC3)n2)C1	ZINC000262324272	145276497	/nfs/dbraw/zinc/27/64/97/145276497.db2.gz	SMPFAHYJNRPERU-WBMJQRKESA-N	0	3	306.410	2.171	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)NCc1ccccc1Cl	ZINC000262495938	145287900	/nfs/dbraw/zinc/28/79/00/145287900.db2.gz	LJAUXGYBGFPTKF-QEORTHHSSA-N	0	3	322.836	2.489	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N1C[C@@H]2CCCC[C@H]2C1	ZINC000262587015	145295429	/nfs/dbraw/zinc/29/54/29/145295429.db2.gz	ZVLUSPSITUUGJE-IBTNMTNLSA-N	0	3	306.450	2.168	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2ccccc2Br)n1	ZINC000263112086	145326370	/nfs/dbraw/zinc/32/63/70/145326370.db2.gz	AJEWSSHVWDPGGZ-NSHDSACASA-N	0	3	323.194	2.075	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2C[C@H]2c2ccc(F)cc2F)n1	ZINC000263210831	145336544	/nfs/dbraw/zinc/33/65/44/145336544.db2.gz	KFYAPPXUZXXHQQ-SGMGOOAPSA-N	0	3	320.343	2.195	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(C2(c3ccc(Cl)cc3)CC2)n1	ZINC000263213560	145336973	/nfs/dbraw/zinc/33/69/73/145336973.db2.gz	KNICWJUERIQWMM-CYBMUJFWSA-N	0	3	318.808	2.379	10	0		DEAEHN
C[C@@H](CC1CCCCC1)C(=O)N1CCN(CCN(C)C)CC1	ZINC000358490805	147143673	/nfs/dbraw/zinc/14/36/73/147143673.db2.gz	DJRMFDMGRJVYAE-INIZCTEOSA-N	0	3	309.498	2.299	10	0		DEAEHN
COc1ccc(C)cc1-n1nnnc1SC[C@H](C)N(C)C	ZINC000358863861	147220494	/nfs/dbraw/zinc/22/04/94/147220494.db2.gz	SOXPWQCLVYBKOR-NSHDSACASA-N	0	3	307.423	2.022	10	0		DEAEHN
Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)CC1CCN(C)CC1	ZINC000371803441	148141818	/nfs/dbraw/zinc/14/18/18/148141818.db2.gz	PLRKVSZTERKXKX-HNNXBMFYSA-N	0	3	304.438	2.422	10	0		DEAEHN
CC(C)n1nccc1CNC[C@H]1CCC2(CCOCC2)[C@@H]1O	ZINC000374684621	148277555	/nfs/dbraw/zinc/27/75/55/148277555.db2.gz	AQJWBHURFSNTGP-GDBMZVCRSA-N	0	3	307.438	2.121	10	0		DEAEHN
CN(Cc1ccc(F)cc1)C(=O)CN1CC[C@@]2(C1)CCCOC2	ZINC000375280782	148351542	/nfs/dbraw/zinc/35/15/42/148351542.db2.gz	KHTBIBFNWMTGPT-GOSISDBHSA-N	0	3	320.408	2.287	10	0		DEAEHN
C/C(=C\C(C)(C)C)C(=O)N1CC[C@H](N2CCN(C)CC2)[C@@H](C)C1	ZINC000375379949	148365178	/nfs/dbraw/zinc/36/51/78/148365178.db2.gz	OGMIAHFAQPUJNZ-LFUXOTAPSA-N	0	3	321.509	2.463	10	0		DEAEHN
O[C@H](COC1CCOCC1)CN1CC=C(c2ccccc2)CC1	ZINC000127158744	401722616	/nfs/dbraw/zinc/72/26/16/401722616.db2.gz	IWDOWXPVRWGWHL-SFHVURJKSA-N	0	3	317.429	2.332	10	0		DEAEHN
CC[C@@H](O)CC[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000127396402	401732726	/nfs/dbraw/zinc/73/27/26/401732726.db2.gz	BVRVBTIKKUWLIT-SNVBAGLBSA-N	0	3	318.211	2.414	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@@H](c2ccccc2)N(C)C)CCN1C	ZINC000127565827	401740620	/nfs/dbraw/zinc/74/06/20/401740620.db2.gz	JHGJCWURZSQCDH-HYVNUMGLSA-N	0	3	303.450	2.230	10	0		DEAEHN
FC(F)(F)Oc1ccccc1CNCCCn1ccnn1	ZINC000126441195	401694287	/nfs/dbraw/zinc/69/42/87/401694287.db2.gz	KNCUCFQHQKALCV-UHFFFAOYSA-N	0	3	300.284	2.357	10	0		DEAEHN
COCc1nc(C)c(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)s1	ZINC000126469559	401695693	/nfs/dbraw/zinc/69/56/93/401695693.db2.gz	HQZGEOIFNYRZSP-JQWIXIFHSA-N	0	3	311.451	2.056	10	0		DEAEHN
CN(C)Cc1ccc([C@@]2(O)c3ccccc3C3=NCCN32)cc1	ZINC000013491057	401799889	/nfs/dbraw/zinc/79/98/89/401799889.db2.gz	DGZRWRJCFZDZKJ-LJQANCHMSA-N	0	3	307.397	2.017	10	0		DEAEHN
Cc1ccc(NC(=O)C2(N)CCOCC2)cc1Br	ZINC000127943623	401756724	/nfs/dbraw/zinc/75/67/24/401756724.db2.gz	DSNOPKNJAQHHSX-UHFFFAOYSA-N	0	3	313.195	2.204	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)Cc2cc(Cl)cn2C)C1	ZINC000128077178	401761915	/nfs/dbraw/zinc/76/19/15/401761915.db2.gz	NJNGOFISQQXRBH-ZDUSSCGKSA-N	0	3	312.845	2.304	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)CSCc1ccncc1	ZINC000113231372	401771404	/nfs/dbraw/zinc/77/14/04/401771404.db2.gz	RHLYGUPPSKGZHG-UKRRQHHQSA-N	0	3	305.447	2.010	10	0		DEAEHN
Cc1ccc(OCC(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c(C)c1	ZINC000113231999	401771413	/nfs/dbraw/zinc/77/14/13/401771413.db2.gz	JUYCSCGXXLMNFU-HOTGVXAUSA-N	0	3	302.418	2.377	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(-c2ccccc2)n[nH]1	ZINC000113233416	401772332	/nfs/dbraw/zinc/77/23/32/401772332.db2.gz	SAGRMXFEEAITBB-DZGCQCFKSA-N	0	3	310.401	2.385	10	0		DEAEHN
CN(C(=O)CN1CC[C@]2(O)CCCC[C@@H]2C1)C1CCCCC1	ZINC000128437188	401776602	/nfs/dbraw/zinc/77/66/02/401776602.db2.gz	UGIFMCUSAGUZFN-CRAIPNDOSA-N	0	3	308.466	2.405	10	0		DEAEHN
COc1cc(C)cc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1O	ZINC000113444819	401779396	/nfs/dbraw/zinc/77/93/96/401779396.db2.gz	VGHOAKQKZHPINU-STQMWFEESA-N	0	3	304.390	2.018	10	0		DEAEHN
COc1ccccc1CNC(=O)CN(C(C)C)C1CCOCC1	ZINC000077322872	401810531	/nfs/dbraw/zinc/81/05/31/401810531.db2.gz	IBSDNMNWXWLLSU-UHFFFAOYSA-N	0	3	320.433	2.201	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)NCC[C@@H](C)O)c1ccccc1	ZINC000114819607	401811128	/nfs/dbraw/zinc/81/11/28/401811128.db2.gz	BGBDUHKSNDYFOZ-ZBFHGGJFSA-N	0	3	307.438	2.140	10	0		DEAEHN
CC(C)CC[C@@](C)(O)CNC(=O)NCCN1CCC[C@H](C)C1	ZINC000077774382	401830057	/nfs/dbraw/zinc/83/00/57/401830057.db2.gz	GQWYQJJDLGGUID-DOTOQJQBSA-N	0	3	313.486	2.205	10	0		DEAEHN
Cn1cc([C@@H]2CCN(CCC(=O)N3CCc4ccccc43)C2)cn1	ZINC000116316033	401849497	/nfs/dbraw/zinc/84/94/97/401849497.db2.gz	VLKNNDFBFZPMEV-MRXNPFEDSA-N	0	3	324.428	2.189	10	0		DEAEHN
CCOCCN1CCN(C(=O)c2cc(C(C)C)[nH]n2)C[C@@H]1CC	ZINC000116767885	401857854	/nfs/dbraw/zinc/85/78/54/401857854.db2.gz	PYFKHKLVGCUMEJ-AWEZNQCLSA-N	0	3	322.453	2.106	10	0		DEAEHN
Cc1c2ccccc2oc1C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000116790225	401859095	/nfs/dbraw/zinc/85/90/95/401859095.db2.gz	UGFAJPSSPKJTSV-ZDUSSCGKSA-N	0	3	302.374	2.144	10	0		DEAEHN
C[C@@H]1CCc2c(C(=O)N3CCO[C@H](CN(C)C)C3)csc2C1	ZINC000116791780	401859127	/nfs/dbraw/zinc/85/91/27/401859127.db2.gz	APGMEYVXJXDXMM-CHWSQXEVSA-N	0	3	322.474	2.276	10	0		DEAEHN
C[C@@H](CC(=O)N1CCO[C@H](CN(C)C)C1)c1cccc(F)c1	ZINC000116797049	401859946	/nfs/dbraw/zinc/85/99/46/401859946.db2.gz	UVDRMOPECBOVLU-XJKSGUPXSA-N	0	3	308.397	2.108	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2ccc(Cl)cc2Cl)CCO1	ZINC000116797979	401859968	/nfs/dbraw/zinc/85/99/68/401859968.db2.gz	AUBQIMAVGAKMMH-LLVKDONJSA-N	0	3	317.216	2.396	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)c1cc(C)n(-c2ccccc2)n1	ZINC000078767953	401865113	/nfs/dbraw/zinc/86/51/13/401865113.db2.gz	IPKYWNQLHJDQLT-MRXNPFEDSA-N	0	3	312.417	2.395	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)CSCc2cscn2)CCN1C	ZINC000132538981	401869339	/nfs/dbraw/zinc/86/93/39/401869339.db2.gz	RSRNEVPRSPYIAK-AAEUAGOBSA-N	0	3	313.492	2.317	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)CC1CCOCC1	ZINC000117241379	401870292	/nfs/dbraw/zinc/87/02/92/401870292.db2.gz	RDZMCOZVWRBKNQ-QGZVFWFLSA-N	0	3	304.434	2.092	10	0		DEAEHN
CC(C)CSCCCNC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000129944232	401812846	/nfs/dbraw/zinc/81/28/46/401812846.db2.gz	YUYPETIRYTUYLE-OAHLLOKOSA-N	0	3	311.495	2.421	10	0		DEAEHN
COc1cccc(CCCN2CCN(C[C@@H](C)O)[C@@H](C)C2)c1	ZINC000119140181	401928133	/nfs/dbraw/zinc/92/81/33/401928133.db2.gz	HCWGASYMENBYFI-JKSUJKDBSA-N	0	3	306.450	2.015	10	0		DEAEHN
CCN(CCNC(=O)N1CCO[C@@H](c2ccc(C)o2)C1)C1CC1	ZINC000119199664	401932284	/nfs/dbraw/zinc/93/22/84/401932284.db2.gz	CJXQFIMOVYLVRT-MRXNPFEDSA-N	0	3	321.421	2.155	10	0		DEAEHN
COCCN(C)CCNC(=O)N1CC=C(c2cccs2)CC1	ZINC000117965418	401888395	/nfs/dbraw/zinc/88/83/95/401888395.db2.gz	JUGNEIFOQZFIPF-UHFFFAOYSA-N	0	3	323.462	2.125	10	0		DEAEHN
CC(C)C[C@@H](C)S(=O)(=O)N1CCC(N2CCCC2)CC1	ZINC000118426696	401898801	/nfs/dbraw/zinc/89/88/01/401898801.db2.gz	UYKCNGDEKUFIBA-CQSZACIVSA-N	0	3	302.484	2.311	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)N(C)CC3CC3)cc2)CC1	ZINC000118776205	401907486	/nfs/dbraw/zinc/90/74/86/401907486.db2.gz	PVVNOJJGQZLYCC-UHFFFAOYSA-N	0	3	301.434	2.311	10	0		DEAEHN
CC(C)CCOCCN[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000045094140	401954424	/nfs/dbraw/zinc/95/44/24/401954424.db2.gz	VHZQEQIGYVTAAI-ZDUSSCGKSA-N	0	3	314.451	2.047	10	0		DEAEHN
CCN(CCO)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000119593900	401960765	/nfs/dbraw/zinc/96/07/65/401960765.db2.gz	WGECWGKQUZGXSK-SFHVURJKSA-N	0	3	319.449	2.065	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccnc(N2CCCCC2)c1)N(C)C	ZINC000136515490	401969070	/nfs/dbraw/zinc/96/90/70/401969070.db2.gz	VNOWYOCVIRAYCZ-MRXNPFEDSA-N	0	3	318.465	2.418	10	0		DEAEHN
CCOC(=O)CC[C@@H](C)NC(=O)c1ccc(CN(C)C)cc1	ZINC000089881115	401969782	/nfs/dbraw/zinc/96/97/82/401969782.db2.gz	BTIZDOSZKCBPRW-CYBMUJFWSA-N	0	3	306.406	2.210	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)NC[C@@]1(C)CCCO1	ZINC000119988833	401972934	/nfs/dbraw/zinc/97/29/34/401972934.db2.gz	MRQYVPKMWAIRHY-FUHWJXTLSA-N	0	3	319.449	2.028	10	0		DEAEHN
COC(=O)CCCN1C[C@@H](C(=O)OC)C[C@@H](c2ccccc2)C1	ZINC000135464595	401940639	/nfs/dbraw/zinc/94/06/39/401940639.db2.gz	FNTQTZPQYNQYAQ-CVEARBPZSA-N	0	3	319.401	2.218	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H](C)N1CCc2ccccc2C1)N(C)C	ZINC000135516298	401943229	/nfs/dbraw/zinc/94/32/29/401943229.db2.gz	HXFJGDITFWWHQD-QAPCUYQASA-N	0	3	317.477	2.280	10	0		DEAEHN
CCC(CC)CN1CCN([C@H](C)C(=O)NC2CCCC2)CC1	ZINC000093078220	402011448	/nfs/dbraw/zinc/01/14/48/402011448.db2.gz	XCZLXSMNIHDYLI-OAHLLOKOSA-N	0	3	309.498	2.488	10	0		DEAEHN
C[C@@H](C(=O)NC1CCCC1)N1CCN(C[C@H]2CC=CCC2)CC1	ZINC000093077592	402011456	/nfs/dbraw/zinc/01/14/56/402011456.db2.gz	MHOPZASNJAVUJV-IRXDYDNUSA-N	0	3	319.493	2.408	10	0		DEAEHN
CC(C)C1CCC(NC(=O)N2CCO[C@H](CN(C)C)C2)CC1	ZINC000121290092	402026004	/nfs/dbraw/zinc/02/60/04/402026004.db2.gz	ZQJTZCHZQPJSNF-UYSNPLJNSA-N	0	3	311.470	2.173	10	0		DEAEHN
CC(C)c1ncc(Cl)c(C(=O)N2CCN3CCC[C@H]3C2)n1	ZINC000050227590	402026740	/nfs/dbraw/zinc/02/67/40/402026740.db2.gz	ONJZYZLCDBCXBK-NSHDSACASA-N	0	3	308.813	2.174	10	0		DEAEHN
C[C@H](N[C@H]1CCO[C@@H]1C)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000121392352	402032886	/nfs/dbraw/zinc/03/28/86/402032886.db2.gz	QBLKTQAGYQEVMK-CWSCBRNRSA-N	0	3	301.383	2.057	10	0		DEAEHN
O=C(CCN(Cc1ccco1)C1CCCC1)N1CCOCC1	ZINC000052077255	402039431	/nfs/dbraw/zinc/03/94/31/402039431.db2.gz	SFDWGEBEXNDGMX-UHFFFAOYSA-N	0	3	306.406	2.273	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)NCc1cccc2c1OCO2	ZINC000052524768	402043544	/nfs/dbraw/zinc/04/35/44/402043544.db2.gz	NPFXBHHVLXREOG-CYBMUJFWSA-N	0	3	319.405	2.089	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)Cc2ccc3c(c2)OCO3)C1	ZINC000052594762	402044446	/nfs/dbraw/zinc/04/44/46/402044446.db2.gz	HNAWCBPYJSQNCO-AWEZNQCLSA-N	0	3	319.405	2.041	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(=O)[nH]c(C(C)C)c1	ZINC000121587016	402045092	/nfs/dbraw/zinc/04/50/92/402045092.db2.gz	OMLMQLBLFQXHHQ-CQSZACIVSA-N	0	3	305.422	2.467	10	0		DEAEHN
O=C(NCCCN1CCC(O)CC1)[C@H]1C[C@@H]1C1CCCCC1	ZINC000121626290	402047077	/nfs/dbraw/zinc/04/70/77/402047077.db2.gz	IFEJKSIAGVFWEY-SJORKVTESA-N	0	3	308.466	2.166	10	0		DEAEHN
O=C(CCN1CCC[C@H](Cn2cncn2)C1)c1ccc(F)cc1	ZINC000122070113	402060886	/nfs/dbraw/zinc/06/08/86/402060886.db2.gz	JQCWYZLNOGZTDO-AWEZNQCLSA-N	0	3	316.380	2.402	10	0		DEAEHN
CCOC(=O)c1cnc2c(Cl)cccc2c1N1CCNCC1	ZINC000053994909	402060975	/nfs/dbraw/zinc/06/09/75/402060975.db2.gz	RFFAJTXCKZYCEE-UHFFFAOYSA-N	0	3	319.792	2.475	10	0		DEAEHN
CCO[C@@H](C)c1nc(CN2CCO[C@H](CN(C)C)C2)cs1	ZINC000120736658	402000454	/nfs/dbraw/zinc/00/04/54/402000454.db2.gz	RXABHOUKVHCCHH-GXTWGEPZSA-N	0	3	313.467	2.003	10	0		DEAEHN
CC(C)C[C@H](CCO)CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000120861298	402004660	/nfs/dbraw/zinc/00/46/60/402004660.db2.gz	YOYNLUQJBYXUHU-HRCADAONSA-N	0	3	313.486	2.155	10	0		DEAEHN
CCN(CC)[C@@H](C)CNC(=O)CSCC(=O)c1ccccc1	ZINC000121017857	402010733	/nfs/dbraw/zinc/01/07/33/402010733.db2.gz	BJCQPFQMABMSDC-AWEZNQCLSA-N	0	3	322.474	2.449	10	0		DEAEHN
COC(=O)[C@H](C)[C@@H](NCCC(=O)NC(C)C)c1ccccc1	ZINC000152095206	402075114	/nfs/dbraw/zinc/07/51/14/402075114.db2.gz	HZPHAGUGZQODFR-CZUORRHYSA-N	0	3	306.406	2.041	10	0		DEAEHN
COc1cccc(OCC(=O)NCCN2CCCC[C@@H]2C)c1	ZINC000055377126	402081058	/nfs/dbraw/zinc/08/10/58/402081058.db2.gz	GYJMJSLUHANJIB-AWEZNQCLSA-N	0	3	306.406	2.065	10	0		DEAEHN
CN(CCC(=O)N1CCc2sccc2C1)C[C@H]1CCCO1	ZINC000056494951	402089539	/nfs/dbraw/zinc/08/95/39/402089539.db2.gz	VRNGEPRXSVTSQP-CQSZACIVSA-N	0	3	308.447	2.134	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N[C@H]1CCC(=O)N(C)C1)CCCO2	ZINC000152355328	402091648	/nfs/dbraw/zinc/09/16/48/402091648.db2.gz	FZWKORHESFIAIQ-SWLSCSKDSA-N	0	3	304.390	2.119	10	0		DEAEHN
CN1CCC(Oc2ccc(NC(=O)[C@]3(C)CCCO3)cn2)CC1	ZINC000152990349	402121070	/nfs/dbraw/zinc/12/10/70/402121070.db2.gz	VDJWBRZSCUGHFB-KRWDZBQOSA-N	0	3	319.405	2.062	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2CCOc3ccccc32)CCN1C	ZINC000122962601	402103326	/nfs/dbraw/zinc/10/33/26/402103326.db2.gz	GRZSSJKJGHBQSE-IJEWVQPXSA-N	0	3	302.418	2.494	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2	ZINC000123252610	402118030	/nfs/dbraw/zinc/11/80/30/402118030.db2.gz	BJTDSTRBCOBGOC-QXSJWSMHSA-N	0	3	321.465	2.070	10	0		DEAEHN
CC(=O)Nc1cccc([C@H](C)NC[C@H](C)N2CCOCC2)c1	ZINC000123251715	402118048	/nfs/dbraw/zinc/11/80/48/402118048.db2.gz	YQPZYEUZNPMDMO-KBPBESRZSA-N	0	3	305.422	2.016	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)[C@H](C)CO	ZINC000151882400	402062972	/nfs/dbraw/zinc/06/29/72/402062972.db2.gz	ZDDPIYUCBBNAKK-IIAWOOMASA-N	0	3	322.424	2.171	10	0		DEAEHN
Cc1cccc(NC(=O)[C@H]2CCCN(CCOC(C)C)C2)n1	ZINC000054204426	402064427	/nfs/dbraw/zinc/06/44/27/402064427.db2.gz	MJHJCTMOCDUPSZ-HNNXBMFYSA-N	0	3	305.422	2.466	10	0		DEAEHN
O=C(NCc1nc(C2CC2)cs1)N1CC[C@@H](N2CC=CC2)C1	ZINC000123369919	402124669	/nfs/dbraw/zinc/12/46/69/402124669.db2.gz	QNOGVZPCTQWRHH-CYBMUJFWSA-N	0	3	318.446	2.176	10	0		DEAEHN
CC(C)[C@H](O)CC(=O)NC(C)(C)CN(C)Cc1ccccc1	ZINC000153119072	402127778	/nfs/dbraw/zinc/12/77/78/402127778.db2.gz	CWSNZKQUYHQQNX-MRXNPFEDSA-N	0	3	306.450	2.420	10	0		DEAEHN
Cc1cc(F)cc(NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000153202875	402133086	/nfs/dbraw/zinc/13/30/86/402133086.db2.gz	WGGQXLDJVXFXSP-HNNXBMFYSA-N	0	3	323.412	2.165	10	0		DEAEHN
CC[C@](C)(O)CN1CCCN(C(=O)Cc2cccc(F)c2)CC1	ZINC000123636597	402139017	/nfs/dbraw/zinc/13/90/17/402139017.db2.gz	FPJGZEQZHSOZDA-SFHVURJKSA-N	0	3	322.424	2.064	10	0		DEAEHN
Cc1nc(CN2CCCN(CCc3ccc(C)cc3)CC2)no1	ZINC000124621405	402188766	/nfs/dbraw/zinc/18/87/66/402188766.db2.gz	UWCLZVAHNCIKEL-UHFFFAOYSA-N	0	3	314.433	2.437	10	0		DEAEHN
CC1CCN(CCSc2nnnn2-c2ccccc2)CC1	ZINC000154194078	402197551	/nfs/dbraw/zinc/19/75/51/402197551.db2.gz	ULCDKSMOESZCNJ-UHFFFAOYSA-N	0	3	303.435	2.486	10	0		DEAEHN
C[C@@H](NC(=O)NC[C@@H]1CCCN(C)C1)c1ccc2c(c1)OCO2	ZINC000108546612	402256408	/nfs/dbraw/zinc/25/64/08/402256408.db2.gz	GKNIFHNDRVIMNI-OLZOCXBDSA-N	0	3	319.405	2.117	10	0		DEAEHN
Cc1nc(C)n(C[C@@H]2CCCN(CCC(=O)OC(C)(C)C)C2)n1	ZINC000105919700	402211188	/nfs/dbraw/zinc/21/11/88/402211188.db2.gz	LLKBKJWLPNEQSH-OAHLLOKOSA-N	0	3	322.453	2.339	10	0		DEAEHN
CCOc1cc(C)ccc1CNC(=O)N1CCN2CCC[C@H]2C1	ZINC000176605258	402322633	/nfs/dbraw/zinc/32/26/33/402322633.db2.gz	HIYYSTJDHNEYIJ-INIZCTEOSA-N	0	3	317.433	2.383	10	0		DEAEHN
CN1CCC(Oc2ccc(NC(=O)c3cccnc3)cn2)CC1	ZINC000071564905	402275395	/nfs/dbraw/zinc/27/53/95/402275395.db2.gz	ITOBHXNMDOEFIG-UHFFFAOYSA-N	0	3	312.373	2.202	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)Cc1cc(-c2cnn(C)c2C)no1	ZINC000184595456	402281796	/nfs/dbraw/zinc/28/17/96/402281796.db2.gz	WWSVVPMOMQUTRP-AWEZNQCLSA-N	0	3	317.437	2.300	10	0		DEAEHN
Fc1cc(CN[C@@H]2CCCSC2)cnc1N1CCOCC1	ZINC000184948829	402312136	/nfs/dbraw/zinc/31/21/36/402312136.db2.gz	IXNZKGXYDWOVSE-CYBMUJFWSA-N	0	3	311.426	2.043	10	0		DEAEHN
Cn1cc(-c2cc(CN(C[C@@H]3CCOC3)C3CC3)on2)cn1	ZINC000184981571	402314830	/nfs/dbraw/zinc/31/48/30/402314830.db2.gz	PAOIZBIISSZPLJ-LBPRGKRZSA-N	0	3	302.378	2.076	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2c2ncncc2Br)C1	ZINC000229959862	402346127	/nfs/dbraw/zinc/34/61/27/402346127.db2.gz	DEZMKRXJFWVXIL-CMPLNLGQSA-N	0	3	311.227	2.160	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1ccccc1Cl	ZINC000176903010	402348022	/nfs/dbraw/zinc/34/80/22/402348022.db2.gz	MTQLXCFJIRBEEE-GFCCVEGCSA-N	0	3	323.824	2.221	10	0		DEAEHN
CCc1cccc(S(=O)(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000176922576	402350254	/nfs/dbraw/zinc/35/02/54/402350254.db2.gz	SQUYKJDZJQQMFG-DZGCQCFKSA-N	0	3	308.447	2.106	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1ccoc1Br	ZINC000234240001	402359472	/nfs/dbraw/zinc/35/94/72/402359472.db2.gz	ZYTGOVKSMQUYDZ-VIFPVBQESA-N	0	3	301.184	2.208	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Cc1noc2ccccc21	ZINC000177019510	402360303	/nfs/dbraw/zinc/36/03/03/402360303.db2.gz	ARFAPQCINQFPJV-CYBMUJFWSA-N	0	3	301.390	2.313	10	0		DEAEHN
CNc1cc(N2CCC[C@H]2CN[C@H](C)c2ccccn2)ncn1	ZINC000177125800	402372436	/nfs/dbraw/zinc/37/24/36/402372436.db2.gz	ZFUIQSGNJRGQSW-KGLIPLIRSA-N	0	3	312.421	2.233	10	0		DEAEHN
O=C1[C@H](N2CCN3CCC[C@@H]3C2)CCN1c1cccc(Cl)c1	ZINC000177143798	402374882	/nfs/dbraw/zinc/37/48/82/402374882.db2.gz	CPWXJBAJDZLONJ-HZPDHXFCSA-N	0	3	319.836	2.225	10	0		DEAEHN
CCCNC(=O)[C@H](C)N[C@@H](C)c1ccccc1-n1cccn1	ZINC000177185608	402379798	/nfs/dbraw/zinc/37/97/98/402379798.db2.gz	MVCZPPDYYAXJKZ-KBPBESRZSA-N	0	3	300.406	2.438	10	0		DEAEHN
CC(C)O[C@@H]1C[C@H](NCc2cccnc2-n2cncn2)C1(C)C	ZINC000185198558	402333634	/nfs/dbraw/zinc/33/36/34/402333634.db2.gz	CKMWMUDBVBYYHM-LSDHHAIUSA-N	0	3	315.421	2.344	10	0		DEAEHN
CC[C@@H]1CN(c2ncnc3cccc(C)c32)CCN1CCOC	ZINC000176807252	402339138	/nfs/dbraw/zinc/33/91/38/402339138.db2.gz	MMMNJXVJTUUSGP-OAHLLOKOSA-N	0	3	314.433	2.485	10	0		DEAEHN
CC[C@H]1CN(CCCCn2ccnc2C)CCN1CCOC	ZINC000161679450	402395745	/nfs/dbraw/zinc/39/57/45/402395745.db2.gz	AXIVCCDRQWSKJT-KRWDZBQOSA-N	0	3	308.470	2.014	10	0		DEAEHN
COCCN1CCC(NC(=O)[C@H]2C[C@H]2C2CCCCC2)CC1	ZINC000161793686	402399705	/nfs/dbraw/zinc/39/97/05/402399705.db2.gz	TZKSBYNOXYSWHV-IRXDYDNUSA-N	0	3	308.466	2.430	10	0		DEAEHN
CN(CC1CCN(C[C@@H](O)c2ccccc2)CC1)C(=O)C1CC1	ZINC000177461329	402404900	/nfs/dbraw/zinc/40/49/00/402404900.db2.gz	LWLNGRKIHQIBFP-GOSISDBHSA-N	0	3	316.445	2.300	10	0		DEAEHN
CCC[C@H](C(=O)NCCc1ccc(NC(C)=O)cc1)N(C)C	ZINC000162008559	402406619	/nfs/dbraw/zinc/40/66/19/402406619.db2.gz	XRWDDFUPFGCIII-MRXNPFEDSA-N	0	3	305.422	2.034	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)Nc1ccc(OC)cc1	ZINC000177697177	402427869	/nfs/dbraw/zinc/42/78/69/402427869.db2.gz	RDCANSVCCYEUHE-HNNXBMFYSA-N	0	3	305.422	2.050	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)NCc1ccc(F)cc1	ZINC000177713847	402429691	/nfs/dbraw/zinc/42/96/91/402429691.db2.gz	IZKXGJIXFOCQEA-WMLDXEAASA-N	0	3	321.440	2.247	10	0		DEAEHN
C[C@H](NCC[C@@H]1CCCO1)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000177844877	402440890	/nfs/dbraw/zinc/44/08/90/402440890.db2.gz	CJMNYDADEDEDCV-AAEUAGOBSA-N	0	3	315.410	2.449	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCc1ccn2ccnc2c1	ZINC000177968572	402447691	/nfs/dbraw/zinc/44/76/91/402447691.db2.gz	OGFZBYXJPLJAJC-OAHLLOKOSA-N	0	3	317.437	2.110	10	0		DEAEHN
O=C(N[C@@H]1C[C@@H]1c1cccc(F)c1)N1CC[C@@H](N2CC=CC2)C1	ZINC000246103550	402509816	/nfs/dbraw/zinc/50/98/16/402509816.db2.gz	HIDIXRCPBFNVPN-BRWVUGGUSA-N	0	3	315.392	2.337	10	0		DEAEHN
CCOC(=O)C[C@](C)(NCC(=O)NC(C)(C)CC)C(C)C	ZINC000186677139	402454284	/nfs/dbraw/zinc/45/42/84/402454284.db2.gz	KNQXBPISZQPVCZ-INIZCTEOSA-N	0	3	300.443	2.249	10	0		DEAEHN
Brc1cc(CNCCCn2ccnn2)cs1	ZINC000163773084	402456922	/nfs/dbraw/zinc/45/69/22/402456922.db2.gz	SOCJBRHTEQRLSZ-UHFFFAOYSA-N	0	3	301.213	2.282	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)N[C@H]1CCCC[C@@H]1C	ZINC000245458707	402462633	/nfs/dbraw/zinc/46/26/33/402462633.db2.gz	CZXFOYCTTSIBAQ-HZMVEIRTSA-N	0	3	309.498	2.486	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@H]1CC(C)(C)OC1(C)C	ZINC000245513653	402467026	/nfs/dbraw/zinc/46/70/26/402467026.db2.gz	APAJOGMQEUQRFR-KBPBESRZSA-N	0	3	311.470	2.458	10	0		DEAEHN
CCC[C@@H](N)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	ZINC000164981018	402471566	/nfs/dbraw/zinc/47/15/66/402471566.db2.gz	DAGCSOWTWPHLIM-CYBMUJFWSA-N	0	3	309.373	2.486	10	0		DEAEHN
O=C1NCCCC[C@@H]1N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000245589665	402472911	/nfs/dbraw/zinc/47/29/11/402472911.db2.gz	FUUCURVIZGMLFX-ULQDDVLXSA-N	0	3	302.418	2.243	10	0		DEAEHN
CCC[C@@H](N)C(=O)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000165512957	402476852	/nfs/dbraw/zinc/47/68/52/402476852.db2.gz	KENYVGGALUPUJU-OAHLLOKOSA-N	0	3	300.406	2.396	10	0		DEAEHN
COC(=O)c1occc1CN1CCC[C@H]1Cn1ccnc1C	ZINC000178306828	402482287	/nfs/dbraw/zinc/48/22/87/402482287.db2.gz	LUGOTQOBPAXXAG-AWEZNQCLSA-N	0	3	303.362	2.236	10	0		DEAEHN
CC(C)N1CCO[C@@H](CN2CCN(C[C@@H]3CC=CCC3)CC2)C1	ZINC000245764995	402486651	/nfs/dbraw/zinc/48/66/51/402486651.db2.gz	QLUXXUBMRHXYLX-MOPGFXCFSA-N	0	3	321.509	2.070	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCc2ccc(Cl)nc2)C1	ZINC000245923859	402497820	/nfs/dbraw/zinc/49/78/20/402497820.db2.gz	HJGWUZLMYJPNPF-UONOGXRCSA-N	0	3	322.840	2.361	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)NCc2ccccc2F)C1	ZINC000245948776	402500320	/nfs/dbraw/zinc/50/03/20/402500320.db2.gz	SGCHPVBUAXPXAH-HOCLYGCPSA-N	0	3	305.397	2.451	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(=O)NC[C@H]2CCCN2Cc2ccccc2)O1	ZINC000245983791	402502079	/nfs/dbraw/zinc/50/20/79/402502079.db2.gz	HGNQPLKVTSARRR-OIISXLGYSA-N	0	3	302.418	2.335	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2COc3ccccc3C2)CCN1C	ZINC000246097701	402509677	/nfs/dbraw/zinc/50/96/77/402509677.db2.gz	HABPMEKSBRBRSC-KBMXLJTQSA-N	0	3	317.433	2.114	10	0		DEAEHN
Cc1cnc(CCN(C)C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)s1	ZINC000246709030	402541652	/nfs/dbraw/zinc/54/16/52/402541652.db2.gz	NHYYVDRUVFVHFZ-TZMCWYRMSA-N	0	3	324.494	2.364	10	0		DEAEHN
Cc1ncc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c(C(C)C)n1	ZINC000246817009	402546028	/nfs/dbraw/zinc/54/60/28/402546028.db2.gz	VTLQVKDQNODLCM-OCCSQVGLSA-N	0	3	302.422	2.217	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NC[C@]1(C)CCCC[C@H]1O	ZINC000246880386	402548049	/nfs/dbraw/zinc/54/80/49/402548049.db2.gz	MQVCRHQYLWPNSZ-INMHGKMJSA-N	0	3	313.486	2.203	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@H](C)NCCN1CCO[C@@H](C)C1	ZINC000247075859	402556261	/nfs/dbraw/zinc/55/62/61/402556261.db2.gz	QMFLXJPXGXEYLN-KBPBESRZSA-N	0	3	308.470	2.318	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCCc1cccc(O)c1	ZINC000171108948	402558772	/nfs/dbraw/zinc/55/87/72/402558772.db2.gz	TWWUDMWMJCNUEE-HNNXBMFYSA-N	0	3	307.438	2.210	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000247197609	402560080	/nfs/dbraw/zinc/56/00/80/402560080.db2.gz	LNWJQFNZJUEBIU-YPMHNXCESA-N	0	3	314.838	2.197	10	0		DEAEHN
COc1cccc(C(=O)N2CCC(C[NH+]3CCCC3)CC2)c1[O-]	ZINC000171138754	402561263	/nfs/dbraw/zinc/56/12/63/402561263.db2.gz	QHOTZPIMKXDCLV-UHFFFAOYSA-N	0	3	318.417	2.349	10	0		DEAEHN
C[C@@H](C(=O)N1C[C@@H]2CCCN2C[C@H]1C)n1cnc2ccccc21	ZINC000247508814	402570267	/nfs/dbraw/zinc/57/02/67/402570267.db2.gz	VRFPLHAQYKQRHR-ILXRZTDVSA-N	0	3	312.417	2.292	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)ccc1C	ZINC000247559212	402572050	/nfs/dbraw/zinc/57/20/50/402572050.db2.gz	ZXAZEECMVZKPLR-CZUORRHYSA-N	0	3	315.417	2.262	10	0		DEAEHN
C[C@@H](C(=O)NCc1ccc(Cl)cc1)N1CCN2CCC[C@@H]2C1	ZINC000178626426	402518974	/nfs/dbraw/zinc/51/89/74/402518974.db2.gz	PIVXPNPRNFTMSG-XJKSGUPXSA-N	0	3	321.852	2.125	10	0		DEAEHN
C[C@@H]1CCc2ccccc2N1C(=O)CN1CCN2CCC[C@@H]2C1	ZINC000178634334	402520197	/nfs/dbraw/zinc/52/01/97/402520197.db2.gz	RKRVLLCNVDXQGB-NVXWUHKLSA-N	0	3	313.445	2.134	10	0		DEAEHN
CCC[C@@H](C(=O)NCCc1cc(OC)ccc1OC)N(C)C	ZINC000178652096	402521732	/nfs/dbraw/zinc/52/17/32/402521732.db2.gz	JINIZCKEYJMEAR-HNNXBMFYSA-N	0	3	308.422	2.093	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)Nc2nc3c(s2)COCC3)C1	ZINC000246281357	402522797	/nfs/dbraw/zinc/52/27/97/402522797.db2.gz	BNCREFQBBWVKRM-ZYHUDNBSSA-N	0	3	324.450	2.066	10	0		DEAEHN
Cc1nnc(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)n1C1CC1	ZINC000246426253	402530580	/nfs/dbraw/zinc/53/05/80/402530580.db2.gz	CJGVWAAIYGSJNS-WMLDXEAASA-N	0	3	315.465	2.370	10	0		DEAEHN
Cc1cccc(C)c1OC[C@H](C)NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170833987	402530952	/nfs/dbraw/zinc/53/09/52/402530952.db2.gz	FEQOYQBLXVONTP-JKSUJKDBSA-N	0	3	319.449	2.416	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Cc2cccc(C(F)(F)F)c2)C1	ZINC000170863460	402534379	/nfs/dbraw/zinc/53/43/79/402534379.db2.gz	LZKPYCXWNUAMSG-CYBMUJFWSA-N	0	3	300.324	2.410	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1csc(C(F)(F)F)n1	ZINC000189382661	402535407	/nfs/dbraw/zinc/53/54/07/402535407.db2.gz	NPAXTZPTXVADBU-DTWKUNHWSA-N	0	3	319.352	2.471	10	0		DEAEHN
Cc1c(C(=O)N2CC[C@H](N(C)C)C2)cnn1-c1ccc(F)cc1	ZINC000170867382	402535878	/nfs/dbraw/zinc/53/58/78/402535878.db2.gz	UXBJCYWEYZJFIO-HNNXBMFYSA-N	0	3	316.380	2.096	10	0		DEAEHN
Cc1cc(NC(=O)NC[C@H](O)CN2CCCCC2)ccc1F	ZINC000171520439	402591095	/nfs/dbraw/zinc/59/10/95/402591095.db2.gz	WTIONAHAFHJWGU-AWEZNQCLSA-N	0	3	309.385	2.102	10	0		DEAEHN
CCC[C@](C)(CO)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179477317	402591469	/nfs/dbraw/zinc/59/14/69/402591469.db2.gz	PWCVGEKHXHEHHK-JFIYKMOQSA-N	0	3	319.449	2.282	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H]2CCCO[C@H]2CC(C)C)C1	ZINC000248612999	402598691	/nfs/dbraw/zinc/59/86/91/402598691.db2.gz	YDXULGSEOFAALO-XHSDSOJGSA-N	0	3	311.470	2.364	10	0		DEAEHN
O=C(C[C@@H](O)c1ccc(Cl)cc1)N1CCCN(C2CC2)CC1	ZINC000179763959	402599603	/nfs/dbraw/zinc/59/96/03/402599603.db2.gz	LMJKNQDYRZWJGY-MRXNPFEDSA-N	0	3	322.836	2.460	10	0		DEAEHN
CCn1cc(CN[C@H]2CCCO[C@@H]2c2nccn2CC)cn1	ZINC000190430887	402600360	/nfs/dbraw/zinc/60/03/60/402600360.db2.gz	HFDHTNQOADGPIN-GJZGRUSLSA-N	0	3	303.410	2.129	10	0		DEAEHN
CN1CC[C@H](NC(=O)CC2CCOCC2)[C@@H]1c1ccccc1	ZINC000180160676	402609217	/nfs/dbraw/zinc/60/92/17/402609217.db2.gz	NKLXNNOBJQXNHL-WMZOPIPTSA-N	0	3	302.418	2.365	10	0		DEAEHN
COCCC1(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CC1	ZINC000180198450	402609561	/nfs/dbraw/zinc/60/95/61/402609561.db2.gz	ZKYSDXMRLJYCGK-CVEARBPZSA-N	0	3	302.418	2.365	10	0		DEAEHN
CCOc1ccc(OC[C@H](O)CN2[C@H](C)C[C@@H](O)C[C@@H]2C)cc1	ZINC000248829904	402610040	/nfs/dbraw/zinc/61/00/40/402610040.db2.gz	LHPBWDWTPLPOEK-QKPAOTATSA-N	0	3	323.433	2.059	10	0		DEAEHN
CC(C)Cc1ncc(CN2C[C@H](N3CCOCC3)[C@@H](C)C2)s1	ZINC000180237134	402610781	/nfs/dbraw/zinc/61/07/81/402610781.db2.gz	UKNKZCMHFZIEIW-HOCLYGCPSA-N	0	3	323.506	2.494	10	0		DEAEHN
C[C@@H](CNC(=O)[C@@H]1CCOC[C@H]1C)N(C)Cc1ccccc1	ZINC000248867379	402612314	/nfs/dbraw/zinc/61/23/14/402612314.db2.gz	NNNQZNNCKYBYAK-HLLBOEOZSA-N	0	3	304.434	2.296	10	0		DEAEHN
CCN1CCC2CCC(C1)N2C(=O)C1CCC(C(=O)OC)CC1	ZINC000180338954	402613624	/nfs/dbraw/zinc/61/36/24/402613624.db2.gz	WHFAGBAPRIRGKS-FJBKBRRZSA-N	0	3	322.449	2.051	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1CCC(C(=O)OC)CC1	ZINC000180338954	402613627	/nfs/dbraw/zinc/61/36/27/402613627.db2.gz	WHFAGBAPRIRGKS-FJBKBRRZSA-N	0	3	322.449	2.051	10	0		DEAEHN
CC[C@@H](C)OCC(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190620886	402614355	/nfs/dbraw/zinc/61/43/55/402614355.db2.gz	DRBKPWKLSLFEEB-WBVHZDCISA-N	0	3	319.449	2.177	10	0		DEAEHN
O[C@H](CN1CCC[C@@H]1C[C@H](O)c1ccco1)CC(F)(F)F	ZINC000248934802	402615618	/nfs/dbraw/zinc/61/56/18/402615618.db2.gz	BTZSAGAUJGQRGL-WOPDTQHZSA-N	0	3	307.312	2.481	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)NC[C@H]2CCC(C)(C)O2)C1	ZINC000249391681	402628267	/nfs/dbraw/zinc/62/82/67/402628267.db2.gz	ADDSDCOKWQPHDD-RBSFLKMASA-N	0	3	309.454	2.070	10	0		DEAEHN
C[C@H](NC[C@H](O)CN1CCCC1=O)c1cc2ccccc2o1	ZINC000180442643	402616759	/nfs/dbraw/zinc/61/67/59/402616759.db2.gz	BIBQOXROYDEVGC-JSGCOSHPSA-N	0	3	302.374	2.067	10	0		DEAEHN
CC(C)n1ccnc1CN1CCC(N2CCO[C@H](C)C2)CC1	ZINC000171749981	402618065	/nfs/dbraw/zinc/61/80/65/402618065.db2.gz	DCVCSUXPBZOPQC-OAHLLOKOSA-N	0	3	306.454	2.149	10	0		DEAEHN
C[C@@H]1COCC[C@H]1N[C@H]1CCCN(c2ccccc2F)C1=O	ZINC000249246491	402624162	/nfs/dbraw/zinc/62/41/62/402624162.db2.gz	DZHKDXXZUXURLW-YUELXQCFSA-N	0	3	306.381	2.336	10	0		DEAEHN
CSCCCNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000179168456	402577477	/nfs/dbraw/zinc/57/74/77/402577477.db2.gz	ZGELMEPQRZBYCJ-GJZGRUSLSA-N	0	3	307.463	2.484	10	0		DEAEHN
CCCCN(C)C(=O)C1CCN(C(=O)[C@@]2(C)CCCCN2)CC1	ZINC000180930367	402630572	/nfs/dbraw/zinc/63/05/72/402630572.db2.gz	MLOAHPIJFYCTDY-GOSISDBHSA-N	0	3	323.481	2.016	10	0		DEAEHN
CCN(CCNC(=O)Nc1ccc(-c2ncon2)cc1)C1CC1	ZINC000171892853	402632163	/nfs/dbraw/zinc/63/21/63/402632163.db2.gz	MNSHSKBETREOQN-UHFFFAOYSA-N	0	3	315.377	2.342	10	0		DEAEHN
C[C@H](NC(=O)N[C@H](Cc1ccccc1)CN(C)C)[C@@H]1CCCO1	ZINC000249684285	402638259	/nfs/dbraw/zinc/63/82/59/402638259.db2.gz	DGYCHKRNQFTPTC-UAGQMJEPSA-N	0	3	319.449	2.026	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cnn(CC(C)C)c1	ZINC000181221725	402638404	/nfs/dbraw/zinc/63/84/04/402638404.db2.gz	VLCXMMUVULAJML-JKSUJKDBSA-N	0	3	304.438	2.238	10	0		DEAEHN
C[C@@H]1CN([C@@H]2CC[C@](C)(c3ccccc3)C2)C[C@H](C(N)=O)O1	ZINC000249964809	402643703	/nfs/dbraw/zinc/64/37/03/402643703.db2.gz	WUTVGZFIVHTMPA-IIVZCXTMSA-N	0	3	302.418	2.071	10	0		DEAEHN
O=C(C[C@@H]1OCCc2ccccc21)N1CCCN(C2CC2)CC1	ZINC000172207355	402644991	/nfs/dbraw/zinc/64/49/91/402644991.db2.gz	WXVBBPHQOWDITC-SFHVURJKSA-N	0	3	314.429	2.387	10	0		DEAEHN
Cc1c(Cl)cccc1OCC(=O)N1CCN2CCC[C@H]2C1	ZINC000172515772	402660320	/nfs/dbraw/zinc/66/03/20/402660320.db2.gz	KAAIQKIGRAOBDP-ZDUSSCGKSA-N	0	3	308.809	2.334	10	0		DEAEHN
Cc1ccc(OC[C@H](O)CN2[C@@H](C)CC(O)C[C@@H]2C)c(C)c1	ZINC000191163041	402647066	/nfs/dbraw/zinc/64/70/66/402647066.db2.gz	PTGMPQZQWSWRGE-YQQAZPJKSA-N	0	3	307.434	2.277	10	0		DEAEHN
Cc1cc(F)c2[nH]c(=O)cc(C(=O)N3CC[C@H](N(C)C)C3)c2c1	ZINC000181502473	402647472	/nfs/dbraw/zinc/64/74/72/402647472.db2.gz	AYXCRQSQQGQXJT-NSHDSACASA-N	0	3	317.364	2.164	10	0		DEAEHN
C[C@H]1OCCC[C@@H]1C(=O)NCCCN(C)Cc1ccccc1	ZINC000191312835	402659861	/nfs/dbraw/zinc/65/98/61/402659861.db2.gz	KQFUIBBSIQDEEL-WBVHZDCISA-N	0	3	304.434	2.440	10	0		DEAEHN
C[C@@H](NC(=O)[C@H](C)N1CCCN(C2CC2)CC1)c1ccccc1	ZINC000172347183	402651588	/nfs/dbraw/zinc/65/15/88/402651588.db2.gz	SLBYRUJKYZOTBH-CVEARBPZSA-N	0	3	315.461	2.422	10	0		DEAEHN
CO[C@@H]1CN(C(=O)N[C@H](C)CN2CCC[C@H](C)C2)CC[C@H]1C	ZINC000251911560	402651720	/nfs/dbraw/zinc/65/17/20/402651720.db2.gz	RTCZDMUUXDDZMP-ZJIFWQFVSA-N	0	3	311.470	2.173	10	0		DEAEHN
COCCN1CCC(N[C@H](C)c2nc(C(C)(C)C)no2)CC1	ZINC000173639890	402706254	/nfs/dbraw/zinc/70/62/54/402706254.db2.gz	ZOXJRYSRWNRKPW-GFCCVEGCSA-N	0	3	310.442	2.129	10	0		DEAEHN
O=C1O[C@H](CN2CC[C@@H](CNc3ccccn3)C2)CC12CCC2	ZINC000192034362	402706676	/nfs/dbraw/zinc/70/66/76/402706676.db2.gz	XMHGRHPHDHQXIV-GJZGRUSLSA-N	0	3	315.417	2.301	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccccc2N(C)C)CCN1CCOC	ZINC000173680619	402708034	/nfs/dbraw/zinc/70/80/34/402708034.db2.gz	PJECSFAHKLQJHD-QGZVFWFLSA-N	0	3	305.466	2.295	10	0		DEAEHN
C[C@H](CS(C)(=O)=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000182677469	402708342	/nfs/dbraw/zinc/70/83/42/402708342.db2.gz	UPDPIUOCTNXYBZ-WBVHZDCISA-N	0	3	324.490	2.064	10	0		DEAEHN
COc1cc(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)ccc1O	ZINC000173709764	402709681	/nfs/dbraw/zinc/70/96/81/402709681.db2.gz	OMNGAZWLIWHDLV-OCCSQVGLSA-N	0	3	321.421	2.025	10	0		DEAEHN
Fc1ccc(OCCCN2CC[C@H](N3CCOCC3)C2)cc1	ZINC000173946894	402721375	/nfs/dbraw/zinc/72/13/75/402721375.db2.gz	BIKPKLDZNJDKHG-INIZCTEOSA-N	0	3	308.397	2.001	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2snnc2C(C)(C)C)CCN1C	ZINC000191430499	402668960	/nfs/dbraw/zinc/66/89/60/402668960.db2.gz	WBLBSSHDQUHTGI-QWRGUYRKSA-N	0	3	310.467	2.390	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@@H](C)C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000173256646	402689625	/nfs/dbraw/zinc/68/96/25/402689625.db2.gz	IVHPBQWSNVWDKE-CJNGLKHVSA-N	0	3	322.497	2.308	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)N1CCc2ccc(F)cc21	ZINC000261964709	402720614	/nfs/dbraw/zinc/72/06/14/402720614.db2.gz	YEVDXIJEDYLJIU-SIIHOXLZSA-N	0	3	318.392	2.247	10	0		DEAEHN
Cc1cc(N2CC[C@H](N3CCCC(C)(C)CC3)C2=O)n(C)n1	ZINC000173532369	402701959	/nfs/dbraw/zinc/70/19/59/402701959.db2.gz	CWVPKUDMLMJQRI-AWEZNQCLSA-N	0	3	304.438	2.346	10	0		DEAEHN
COc1ccc(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1O	ZINC000174072254	402725854	/nfs/dbraw/zinc/72/58/54/402725854.db2.gz	KYBGYKBBGMPANU-JSGCOSHPSA-N	0	3	321.421	2.025	10	0		DEAEHN
COCc1csc(NC(=O)N2CCC[C@@H]2CN2CCCC2)n1	ZINC000174373230	402738544	/nfs/dbraw/zinc/73/85/44/402738544.db2.gz	HREWHNSNUOWCGE-CYBMUJFWSA-N	0	3	324.450	2.382	10	0		DEAEHN
COCc1csc(NC(=O)N(C)C[C@H]2CCCN(C)C2)n1	ZINC000174393072	402738942	/nfs/dbraw/zinc/73/89/42/402738942.db2.gz	UXCXXCNPBQSSSL-NSHDSACASA-N	0	3	312.439	2.095	10	0		DEAEHN
C[C@@H](NCc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1CCCO1	ZINC000183125175	402740950	/nfs/dbraw/zinc/74/09/50/402740950.db2.gz	WSTRGUIDVPONDK-MFKMUULPSA-N	0	3	319.373	2.340	10	0		DEAEHN
CC(C)OC[C@H](O)CN[C@H](C)c1ccccc1-n1cccn1	ZINC000183143757	402742904	/nfs/dbraw/zinc/74/29/04/402742904.db2.gz	XNXLOJTVXLMKPQ-HUUCEWRRSA-N	0	3	303.406	2.309	10	0		DEAEHN
O=C(NCc1cc(F)ccc1F)N1CC[C@@H](N2CC=CC2)C1	ZINC000174752228	402755285	/nfs/dbraw/zinc/75/52/85/402755285.db2.gz	QTXYMLGPANNNBW-CQSZACIVSA-N	0	3	307.344	2.121	10	0		DEAEHN
C[C@@H]1CCc2c(-c3nc([C@H]4CNCCN4C)no3)csc2C1	ZINC000263312540	402757583	/nfs/dbraw/zinc/75/75/83/402757583.db2.gz	YXPISMVDXVUCEP-ZWNOBZJWSA-N	0	3	318.446	2.499	10	0		DEAEHN
C[C@H](Sc1ccccc1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263316184	402757935	/nfs/dbraw/zinc/75/79/35/402757935.db2.gz	ZMSIYDIPCOBOJB-AAEUAGOBSA-N	0	3	304.419	2.499	10	0		DEAEHN
C[C@@H](Sc1ccccc1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263316187	402757989	/nfs/dbraw/zinc/75/79/89/402757989.db2.gz	ZMSIYDIPCOBOJB-YPMHNXCESA-N	0	3	304.419	2.499	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cccc(NC(C)=O)c2)C1	ZINC000194326927	402791956	/nfs/dbraw/zinc/79/19/56/402791956.db2.gz	XQGLEBMYCLTMCZ-HNNXBMFYSA-N	0	3	304.394	2.251	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccc(F)cc1	ZINC000194353624	402793364	/nfs/dbraw/zinc/79/33/64/402793364.db2.gz	KIRTZJLIIVNYJU-PBHICJAKSA-N	0	3	322.424	2.389	10	0		DEAEHN
C[C@@H](CC(=O)OC(C)(C)C)NCCNC(=O)c1ccccc1	ZINC000183740455	402793476	/nfs/dbraw/zinc/79/34/76/402793476.db2.gz	SBFFTIZLQMYLPO-ZDUSSCGKSA-N	0	3	306.406	2.126	10	0		DEAEHN
C=Cn1cc(CN[C@H]2CCN(C(=O)C3CCCCC3)C2)cn1	ZINC000194369192	402793977	/nfs/dbraw/zinc/79/39/77/402793977.db2.gz	IWQDQWFDKINVDJ-INIZCTEOSA-N	0	3	302.422	2.254	10	0		DEAEHN
Cc1nc(C(F)(F)F)ccc1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000195329373	402842242	/nfs/dbraw/zinc/84/22/42/402842242.db2.gz	OAADKGVVGNUVSG-LLVKDONJSA-N	0	3	313.323	2.329	10	0		DEAEHN
O=C(c1cc(-c2cccs2)n[nH]1)N1CCN2CCC[C@@H]2C1	ZINC000195333032	402842371	/nfs/dbraw/zinc/84/23/71/402842371.db2.gz	LKAYGLDWPUZCQF-LLVKDONJSA-N	0	3	302.403	2.058	10	0		DEAEHN
CC1=NN(c2ccc(C(=O)N3CCN4CCC[C@H]4C3)cc2)CC1	ZINC000195332219	402842539	/nfs/dbraw/zinc/84/25/39/402842539.db2.gz	GWNUSRHWNBSKNK-KRWDZBQOSA-N	0	3	312.417	2.193	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)S(=O)(=O)Cc1ccccc1F	ZINC000175391845	402802430	/nfs/dbraw/zinc/80/24/30/402802430.db2.gz	LWPQGBOLKATGAP-CQSZACIVSA-N	0	3	314.426	2.072	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)S(=O)(=O)Cc1cccc(F)c1	ZINC000175392606	402802560	/nfs/dbraw/zinc/80/25/60/402802560.db2.gz	JPCPWSMNQLVUJP-HNNXBMFYSA-N	0	3	314.426	2.072	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)S(=O)(=O)c1cc(C)ccc1C	ZINC000175399500	402803246	/nfs/dbraw/zinc/80/32/46/402803246.db2.gz	NGNQKFOFKMZNIA-OAHLLOKOSA-N	0	3	310.463	2.408	10	0		DEAEHN
Cc1c(C(=O)NC[C@@H]2CCCN2C)cnn1Cc1ccccc1	ZINC000194699072	402811271	/nfs/dbraw/zinc/81/12/71/402811271.db2.gz	RUQGLVXUYZMBOQ-INIZCTEOSA-N	0	3	312.417	2.064	10	0		DEAEHN
O=C(Nc1cccc2c1OCC[C@@H]2O)C1CCN(C2CC2)CC1	ZINC000194865375	402820115	/nfs/dbraw/zinc/82/01/15/402820115.db2.gz	FYGOQJUDEBROOG-INIZCTEOSA-N	0	3	316.401	2.315	10	0		DEAEHN
CCOC[C@@H]1CCN(Cc2ccc3c(c2)sc(=O)n3C)C1	ZINC000195040007	402828134	/nfs/dbraw/zinc/82/81/34/402828134.db2.gz	HNQNKUAIRKBRLO-CYBMUJFWSA-N	0	3	306.431	2.458	10	0		DEAEHN
O=C(NC[C@H](O)CN1CCCCC1)Nc1cccc2[nH]ccc21	ZINC000195161054	402834796	/nfs/dbraw/zinc/83/47/96/402834796.db2.gz	FWALCWZTYGYPDM-ZDUSSCGKSA-N	0	3	316.405	2.136	10	0		DEAEHN
CCN(CC)c1ccc(C(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000195314845	402841579	/nfs/dbraw/zinc/84/15/79/402841579.db2.gz	UORVBPHBTODXGR-KRWDZBQOSA-N	0	3	301.434	2.453	10	0		DEAEHN
C[C@@H](CCc1cccn1C)NC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000176032846	402849134	/nfs/dbraw/zinc/84/91/34/402849134.db2.gz	MIIVFEZUQLKJNV-DOTOQJQBSA-N	0	3	316.449	2.002	10	0		DEAEHN
Cc1c(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)[nH]c2c1C(=O)CCC2	ZINC000268430703	403082540	/nfs/dbraw/zinc/08/25/40/403082540.db2.gz	YCXLESJEGWOVPU-SMDDNHRTSA-N	0	3	317.433	2.301	10	0		DEAEHN
COc1ccc(CN2CCNC[C@H]2c2cccnc2)cc1F	ZINC000261635857	286306033	/nfs/dbraw/zinc/30/60/33/286306033.db2.gz	FFXWSOPXOHZHMH-INIZCTEOSA-N	0	3	301.365	2.376	10	0		DEAEHN
CN1CC[C@H]2OCCN(c3ncnc4c5ccccc5oc43)[C@H]2C1	ZINC000284426362	403267723	/nfs/dbraw/zinc/26/77/23/403267723.db2.gz	AEXRXYFGGRFKCH-DZGCQCFKSA-N	0	3	324.384	2.285	10	0		DEAEHN
C[C@H](NC1CC(OCc2ccccc2)C1)C(=O)N1CCCC1	ZINC000343502162	403615674	/nfs/dbraw/zinc/61/56/74/403615674.db2.gz	JZVOXCADTIDSDQ-OOHWJJMZSA-N	0	3	302.418	2.335	10	0		DEAEHN
O=C(Nc1ccc2c(c1F)CCNC2)N1CCO[C@@H](C2CC2)C1	ZINC000333342189	403729582	/nfs/dbraw/zinc/72/95/82/403729582.db2.gz	PWLZDALRAYFLEW-OAHLLOKOSA-N	0	3	319.380	2.114	10	0		DEAEHN
O=C(CN1CCCC[C@@H]1[C@H]1CCC[C@@H]1O)NCc1ccccc1	ZINC000303678953	403755780	/nfs/dbraw/zinc/75/57/80/403755780.db2.gz	RGZFSBJEOYKMJH-KURKYZTESA-N	0	3	316.445	2.318	10	0		DEAEHN
Nc1cccnc1C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000303621475	403756106	/nfs/dbraw/zinc/75/61/06/403756106.db2.gz	WCNPZEYWXXDPHV-UHFFFAOYSA-N	0	3	310.401	2.058	10	0		DEAEHN
Cc1cn[nH]c1CN[C@@H]1CC(=O)N(c2ccccc2Cl)C1	ZINC000368674658	403819419	/nfs/dbraw/zinc/81/94/19/403819419.db2.gz	BNSZOIZJGALUAW-LLVKDONJSA-N	0	3	304.781	2.267	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@@H](C)N[C@H]2CCOC2(C)C)c1	ZINC000295372414	403888156	/nfs/dbraw/zinc/88/81/56/403888156.db2.gz	ZZHKMUOPYSMVGD-ABAIWWIYSA-N	0	3	304.390	2.373	10	0		DEAEHN
CCNC(=O)N1CC[C@H](NCc2cc3ccc(F)cc3[nH]2)C1	ZINC000362926090	404006740	/nfs/dbraw/zinc/00/67/40/404006740.db2.gz	XMGPLHCBHKWVAR-ZDUSSCGKSA-N	0	3	304.369	2.200	10	0		DEAEHN
Cc1nnc([C@@H]2CCCCN2C(=O)[C@H](C)[NH+]2CCCCCC2)[n-]1	ZINC000328674724	404129183	/nfs/dbraw/zinc/12/91/83/404129183.db2.gz	KCBCKOLXNNMNGN-ZFWWWQNUSA-N	0	3	319.453	2.431	10	0		DEAEHN
Cc1noc([C@@H]2CCN(Cc3ccc(-n4cncn4)c(C)c3)C2)n1	ZINC000344826136	404389373	/nfs/dbraw/zinc/38/93/73/404389373.db2.gz	KRJUXRVWPSIQQG-OAHLLOKOSA-N	0	3	324.388	2.257	10	0		DEAEHN
Cc1ccc([C@H](C)NCCCS(=O)(=O)N(C)C)cc1F	ZINC000342250106	404466618	/nfs/dbraw/zinc/46/66/18/404466618.db2.gz	YZTMPERWTNVMRV-LBPRGKRZSA-N	0	3	302.415	2.066	10	0		DEAEHN
Cc1ccnc(C2CCN(C[C@@H]3CC4(CCC4)C(=O)O3)CC2)n1	ZINC000365273868	404595405	/nfs/dbraw/zinc/59/54/05/404595405.db2.gz	KZAJHIMCFZGWNR-HNNXBMFYSA-N	0	3	315.417	2.450	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2cn(C)nc2C2CC2)CCN1C	ZINC000292018777	404630291	/nfs/dbraw/zinc/63/02/91/404630291.db2.gz	JMJRKMYSSBWNSP-YPMHNXCESA-N	0	3	305.426	2.244	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCc2cccc(OC)c2CC1	ZINC000376083613	404800145	/nfs/dbraw/zinc/80/01/45/404800145.db2.gz	ORRFWLDUIOUWQT-MRXNPFEDSA-N	0	3	307.434	2.273	10	0		DEAEHN
CN(CC1CC1)C(=O)CN1CCC(CCCn2ccnc2)CC1	ZINC000361057926	404898465	/nfs/dbraw/zinc/89/84/65/404898465.db2.gz	AJTSBEIYWPOUCH-UHFFFAOYSA-N	0	3	318.465	2.244	10	0		DEAEHN
O=C(NC[C@H]1CN2CCC[C@@H]2CO1)N1CCC2(C1)CCCCC2	ZINC000377877459	404849425	/nfs/dbraw/zinc/84/94/25/404849425.db2.gz	BRRBAYVIWCWJBL-CVEARBPZSA-N	0	3	321.465	2.215	10	0		DEAEHN
c1cc(-c2ccc(CNC[C@@H]3COC4(CCCC4)O3)o2)n[nH]1	ZINC000366836483	404855671	/nfs/dbraw/zinc/85/56/71/404855671.db2.gz	NFXASKNXEYYGIX-CYBMUJFWSA-N	0	3	303.362	2.445	10	0		DEAEHN
CC(C)OCCN1CCC(NC(=O)N2CCC23CCC3)CC1	ZINC000435558829	404990143	/nfs/dbraw/zinc/99/01/43/404990143.db2.gz	NYPCWICJACKMII-UHFFFAOYSA-N	0	3	309.454	2.214	10	0		DEAEHN
c1cnn([C@H]2CCN(CCOCCOc3ccccc3)C2)c1	ZINC000361590813	405149463	/nfs/dbraw/zinc/14/94/63/405149463.db2.gz	KLZYCWKOWQKMSK-INIZCTEOSA-N	0	3	301.390	2.226	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cc3nc[nH]c3cc2F)CCN1C	ZINC000408464597	405212517	/nfs/dbraw/zinc/21/25/17/405212517.db2.gz	FJVKRGHOFAJHNA-GHMZBOCLSA-N	0	3	304.369	2.257	10	0		DEAEHN
CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)NCCNc1ccncc1	ZINC000439041324	405263706	/nfs/dbraw/zinc/26/37/06/405263706.db2.gz	QGXAEWOIAAVKIC-XIRDDKMYSA-N	0	3	319.449	2.406	10	0		DEAEHN
C[C@@H](CNC(=O)N1C[C@@H](C)O[C@@H](c2ccccc2)C1)N(C)C	ZINC000455430153	405408979	/nfs/dbraw/zinc/40/89/79/405408979.db2.gz	JLGWKBDMLDMQCA-SQWLQELKSA-N	0	3	305.422	2.108	10	0		DEAEHN
C[C@H]1OCC[C@H]1NCC(=O)N(C)Cc1ccc(Cl)s1	ZINC000429398156	405428695	/nfs/dbraw/zinc/42/86/95/405428695.db2.gz	LAYZZFYGIIKZQZ-MWLCHTKSSA-N	0	3	302.827	2.127	10	0		DEAEHN
CCOc1cc(/C=C\C(=O)N2CCN3CCC[C@@H]3C2)ccc1O	ZINC000492405848	405500218	/nfs/dbraw/zinc/50/02/18/405500218.db2.gz	LEFQQOKKIRKCQL-DDJMYBDESA-N	0	3	316.401	2.111	10	0		DEAEHN
CCOC(=O)[C@H]1CN(C[C@H](C)c2ccc(F)cc2)CC12COC2	ZINC000449367930	405528840	/nfs/dbraw/zinc/52/88/40/405528840.db2.gz	ZYONEIOTPTZQAI-XJKSGUPXSA-N	0	3	321.392	2.441	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(C[C@@H](C)c2ccc(F)cc2)CC12COC2	ZINC000449367928	405528957	/nfs/dbraw/zinc/52/89/57/405528957.db2.gz	ZYONEIOTPTZQAI-CJNGLKHVSA-N	0	3	321.392	2.441	10	0		DEAEHN
CN(C)[C@@]1(CNC(=O)N[C@H]2CCCC(F)(F)C2)CCSC1	ZINC000494422288	405694546	/nfs/dbraw/zinc/69/45/46/405694546.db2.gz	BQTVPKOIVMMWOB-WCQYABFASA-N	0	3	321.437	2.301	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]([NH+](C)C)C2(C)C)cc1[O-]	ZINC000636090501	405731348	/nfs/dbraw/zinc/73/13/48/405731348.db2.gz	GOABVOMIKMLJHF-HUUCEWRRSA-N	0	3	304.390	2.053	10	0		DEAEHN
O=C(NCCNc1ccncc1)Nc1cccc2c1OCCC2	ZINC000560360903	405797283	/nfs/dbraw/zinc/79/72/83/405797283.db2.gz	BBHVFRLCENRNNT-UHFFFAOYSA-N	0	3	312.373	2.062	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@@H](CO)Cc1ccc(C)c(C)c1	ZINC000457320456	405798541	/nfs/dbraw/zinc/79/85/41/405798541.db2.gz	MPUJBFODWACWRX-QZTJIDSGSA-N	0	3	318.461	2.197	10	0		DEAEHN
O=C(N[C@@H]1CCCC(F)(F)C1)N1CC[C@H](N2CCCC2)C1	ZINC000531772283	406004406	/nfs/dbraw/zinc/00/44/06/406004406.db2.gz	CGFUPXPRTXAFCK-OLZOCXBDSA-N	0	3	301.381	2.444	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N1CC(=O)NCc1cccc2c1CCOC2	ZINC000634315591	406094911	/nfs/dbraw/zinc/09/49/11/406094911.db2.gz	OQTOTPQUJLCGEK-OKILXGFUSA-N	0	3	302.418	2.248	10	0		DEAEHN
CN1CCN(Cc2ccccc2)[C@H](CNCc2ccns2)C1	ZINC000639326081	406046801	/nfs/dbraw/zinc/04/68/01/406046801.db2.gz	DCEVZNQDNSEMHG-MRXNPFEDSA-N	0	3	316.474	2.049	10	0		DEAEHN
C[C@@H]1C[C@@H]1CNC(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000471668752	406107609	/nfs/dbraw/zinc/10/76/09/406107609.db2.gz	LYJQIACMXRWRLK-DJIMGWMZSA-N	0	3	301.434	2.464	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCCc1c[nH]c2ncccc12	ZINC000533100710	406121674	/nfs/dbraw/zinc/12/16/74/406121674.db2.gz	OXHLCPIAHGZDCP-HNNXBMFYSA-N	0	3	300.406	2.096	10	0		DEAEHN
CO[C@@H]1CC[C@H](NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000471825252	406122643	/nfs/dbraw/zinc/12/26/43/406122643.db2.gz	KBTSHBUQXKWRIJ-GVDBMIGSSA-N	0	3	319.449	2.026	10	0		DEAEHN
C[C@H]1CCCN(CCNCc2c(Br)cnn2C)C1	ZINC000486972442	406194557	/nfs/dbraw/zinc/19/45/57/406194557.db2.gz	PMRAFNUSKFTMEN-NSHDSACASA-N	0	3	315.259	2.004	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@H]1CCOC2(CCC2)C1	ZINC000487277596	406221100	/nfs/dbraw/zinc/22/11/00/406221100.db2.gz	LRYJGMGXRGOUGB-JTQLQIEISA-N	0	3	314.227	2.374	10	0		DEAEHN
CCN1CCCC[C@@H]1CNCc1c(Br)cnn1C	ZINC000487280701	406221252	/nfs/dbraw/zinc/22/12/52/406221252.db2.gz	RTPBGUPMTKCJAG-LLVKDONJSA-N	0	3	315.259	2.147	10	0		DEAEHN
COCCN(C)CCCNC(=O)Nc1cc(C)cc(OC)c1C	ZINC000489693256	406425815	/nfs/dbraw/zinc/42/58/15/406425815.db2.gz	XLGWOKIYZIUBOJ-UHFFFAOYSA-N	0	3	323.437	2.402	10	0		DEAEHN
COc1ccc(Cl)cc1CN[C@H]1CCCS(=O)(=O)CC1	ZINC000634956649	406370870	/nfs/dbraw/zinc/37/08/70/406370870.db2.gz	OGPRJOICRMUTPZ-ZDUSSCGKSA-N	0	3	317.838	2.406	10	0		DEAEHN
CC[C@@H]1CCCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)C1	ZINC000637935769	406484765	/nfs/dbraw/zinc/48/47/65/406484765.db2.gz	UVNRTTDTKVLZRU-NVXWUHKLSA-N	0	3	303.450	2.094	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)CC1	ZINC000637957179	406495373	/nfs/dbraw/zinc/49/53/73/406495373.db2.gz	DKPDPDWLZIXCNE-WBVHZDCISA-N	0	3	303.450	2.094	10	0		DEAEHN
CC[C@@H]1CCC[C@H]1NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638032768	406533620	/nfs/dbraw/zinc/53/36/20/406533620.db2.gz	APJPZPUZDLQUMG-IXDOHACOSA-N	0	3	303.450	2.141	10	0		DEAEHN
Cc1ccc(NC(=O)[C@H](N)CN(C)Cc2ccccc2)c(C)n1	ZINC000638072976	406556363	/nfs/dbraw/zinc/55/63/63/406556363.db2.gz	ASLXTLKEPTZHFZ-MRXNPFEDSA-N	0	3	312.417	2.096	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NCC1(C)CCCC1	ZINC000637990475	406512691	/nfs/dbraw/zinc/51/26/91/406512691.db2.gz	XOGPEMQCAPQJPX-INIZCTEOSA-N	0	3	303.450	2.142	10	0		DEAEHN
Cc1ccncc1CN[C@H](CN1CCN(C)CC1)c1ccccc1	ZINC000527223050	406598183	/nfs/dbraw/zinc/59/81/83/406598183.db2.gz	LXYURPBXWAGZRJ-HXUWFJFHSA-N	0	3	324.472	2.468	10	0		DEAEHN
c1c[nH]c(-c2noc(C3CCN([C@H]4CCSC4)CC3)n2)n1	ZINC000572542116	406689427	/nfs/dbraw/zinc/68/94/27/406689427.db2.gz	TZZUMQJNYNVVBU-NSHDSACASA-N	0	3	305.407	2.145	10	0		DEAEHN
Cc1occc1CN(C)C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638382466	406738338	/nfs/dbraw/zinc/73/83/38/406738338.db2.gz	WTKBLFUJJQKCRK-KRWDZBQOSA-N	0	3	315.417	2.006	10	0		DEAEHN
O=C(c1cc(Cl)ncc1Cl)N1CCN2CCC[C@@H]2C1	ZINC000129157138	196024574	/nfs/dbraw/zinc/02/45/74/196024574.db2.gz	XHJHZWULMAMSOX-SECBINFHSA-N	0	3	300.189	2.309	10	0		DEAEHN
CN(CC[C@@H]1COCCN1)Cc1cc(Br)cs1	ZINC000129418857	196046811	/nfs/dbraw/zinc/04/68/11/196046811.db2.gz	SGQDWYJCXAHSLP-LLVKDONJSA-N	0	3	319.268	2.321	10	0		DEAEHN
CCNc1ncc(C(=O)N2C[C@H]3CCCN3C[C@@H]2CC)s1	ZINC000129650731	196064963	/nfs/dbraw/zinc/06/49/63/196064963.db2.gz	FTYRLEPBVJZVRY-NWDGAFQWSA-N	0	3	308.451	2.274	10	0		DEAEHN
CC[C@@H]1N[C@H](c2ccsc2)N(C[C@@H](C)N2CCCC2)C1=O	ZINC000130800326	196111097	/nfs/dbraw/zinc/11/10/97/196111097.db2.gz	NHQUMDKQSNVADT-SNPRPXQTSA-N	0	3	307.463	2.441	10	0		DEAEHN
C[C@@H](N)c1cccc(S(=O)(=O)NCCCC(F)(F)F)c1	ZINC000130866198	196116993	/nfs/dbraw/zinc/11/69/93/196116993.db2.gz	CQYRJPUENXKAEW-SECBINFHSA-N	0	3	310.341	2.327	10	0		DEAEHN
Cc1cc(C(=O)N2CCO[C@@H](CN(C)C)C2)c(Cl)cc1F	ZINC000130880723	196119784	/nfs/dbraw/zinc/11/97/84/196119784.db2.gz	WOMGMWBSNNCKEZ-NSHDSACASA-N	0	3	314.788	2.190	10	0		DEAEHN
Cc1nc(-c2cncc(Br)c2)nc2c1CNCC2	ZINC000130912733	196121662	/nfs/dbraw/zinc/12/16/62/196121662.db2.gz	YTPJAVUYEKPGGN-UHFFFAOYSA-N	0	3	305.179	2.255	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)Nc1nc(N)ncc1Br	ZINC000131178372	196147412	/nfs/dbraw/zinc/14/74/12/196147412.db2.gz	UXIRWXXJJJDHSD-SECBINFHSA-N	0	3	316.247	2.210	10	0		DEAEHN
O[C@@H](CN[C@@H]1CCOC1)COc1c(Cl)cccc1Cl	ZINC000131466938	196171611	/nfs/dbraw/zinc/17/16/11/196171611.db2.gz	FVNCWMJHFAKWAX-ZJUUUORDSA-N	0	3	306.189	2.112	10	0		DEAEHN
CCNc1nc(Cl)nc(N[C@@H](CC(C)C)CN(C)C)n1	ZINC000131582771	196181759	/nfs/dbraw/zinc/18/17/59/196181759.db2.gz	OOBKLPPXVUPVJK-JTQLQIEISA-N	0	3	300.838	2.345	10	0		DEAEHN
N[C@@H]1COC[C@@H]1C(=O)Nc1cc(Cl)ccc1Br	ZINC000131637320	196185937	/nfs/dbraw/zinc/18/59/37/196185937.db2.gz	JFQBHFBYNGAKCF-IONNQARKSA-N	0	3	319.586	2.015	10	0		DEAEHN
CC[C@H](C)[C@@H](O)c1c(Br)cnn1CCN(C)C	ZINC000132029743	196220837	/nfs/dbraw/zinc/22/08/37/196220837.db2.gz	LBBWFHATFRCFCG-JOYOIKCWSA-N	0	3	304.232	2.287	10	0		DEAEHN
C[C@@H](NCCNC(=O)N(C)C)c1cccc(Br)c1	ZINC000132092362	196225930	/nfs/dbraw/zinc/22/59/30/196225930.db2.gz	RGRDISGQZHPUIS-SNVBAGLBSA-N	0	3	314.227	2.371	10	0		DEAEHN
C[C@H](NCCNC(=O)N(C)C)c1ccc(Br)s1	ZINC000132350352	196247758	/nfs/dbraw/zinc/24/77/58/196247758.db2.gz	LPSPIKMRSHWKKN-QMMMGPOBSA-N	0	3	320.256	2.432	10	0		DEAEHN
NC(=O)NCCN[C@@H]1CCCc2sc(Br)cc21	ZINC000132537255	196263042	/nfs/dbraw/zinc/26/30/42/196263042.db2.gz	XCXUHYSPHPQEEE-MRVPVSSYSA-N	0	3	318.240	2.146	10	0		DEAEHN
NC(=O)NCCN[C@H]1CCCc2sc(Br)cc21	ZINC000132537030	196263890	/nfs/dbraw/zinc/26/38/90/196263890.db2.gz	XCXUHYSPHPQEEE-QMMMGPOBSA-N	0	3	318.240	2.146	10	0		DEAEHN
CC[C@@H](CSC)NCC(=O)Nc1ccc2c(c1)OCCO2	ZINC000132603836	196269984	/nfs/dbraw/zinc/26/99/84/196269984.db2.gz	ICLHNESHDGPIMP-NSHDSACASA-N	0	3	310.419	2.128	10	0		DEAEHN
CCn1ncc(Br)c1[C@@]1(O)CCN2CCC[C@@H]2C1	ZINC000132986740	196302166	/nfs/dbraw/zinc/30/21/66/196302166.db2.gz	ZVFSGUFUPZCABF-ZWNOBZJWSA-N	0	3	314.227	2.111	10	0		DEAEHN
CCN[C@@H](Cc1cc(C)ccc1OC)C(C)(C)S(C)(=O)=O	ZINC000133171688	196317794	/nfs/dbraw/zinc/31/77/94/196317794.db2.gz	ILBCVWVMFHVDDQ-HNNXBMFYSA-N	0	3	313.463	2.347	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@@H]1NC(=O)c1cc(Cl)nc(Cl)c1	ZINC000133729742	196332570	/nfs/dbraw/zinc/33/25/70/196332570.db2.gz	FVKGHEJPEBYPIJ-SCZZXKLOSA-N	0	3	302.205	2.458	10	0		DEAEHN
COc1ccccc1C1CC(NC[C@H]2CCCS2(=O)=O)C1	ZINC000133872497	196342238	/nfs/dbraw/zinc/34/22/38/196342238.db2.gz	CGGZMQLONRBCKK-JXQTWKCFSA-N	0	3	309.431	2.108	10	0		DEAEHN
COCc1nnc2sc([C@@H]3CC[C@H]4CCCC[C@@H]4N3)nn12	ZINC000133942469	196348084	/nfs/dbraw/zinc/34/80/84/196348084.db2.gz	VVFQKYBQAQXQHF-VWYCJHECSA-N	0	3	307.423	2.316	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NC[C@@H]1CCC(C)(C)O1	ZINC000189635208	225057713	/nfs/dbraw/zinc/05/77/13/225057713.db2.gz	WYZRUVCZORUJSR-AWEZNQCLSA-N	0	3	320.433	2.314	10	0		DEAEHN
Cc1nnc([C@@H](C)N2CC[C@H](CN(C)Cc3cccnc3)C2)o1	ZINC000195293658	225202421	/nfs/dbraw/zinc/20/24/21/225202421.db2.gz	FRKJWCGKMQHDQG-CZUORRHYSA-N	0	3	315.421	2.288	10	0		DEAEHN
Cc1cc(C)c(OCC(=O)N2CCN3CCC[C@H]3C2)c(C)c1	ZINC000195309359	225202566	/nfs/dbraw/zinc/20/25/66/225202566.db2.gz	HGIKPJYBXAYJJJ-INIZCTEOSA-N	0	3	302.418	2.297	10	0		DEAEHN
Cc1nnc(NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)nc1C	ZINC000359574191	424830264	/nfs/dbraw/zinc/83/02/64/424830264.db2.gz	HHUULAZFYUSIDE-ZFWWWQNUSA-N	0	3	317.462	3.045	10	0		DEAEHN
CCCN(CCC)C(=O)CN1CCC(Cc2nccn2C)CC1	ZINC000105875870	424849261	/nfs/dbraw/zinc/84/92/61/424849261.db2.gz	BXCLCGDXQCHSOM-UHFFFAOYSA-N	0	3	320.481	2.323	10	0		DEAEHN
CCn1cc(NC(=O)N[C@H](CN(C)C)c2ccccc2)cn1	ZINC000192766611	424865711	/nfs/dbraw/zinc/86/57/11/424865711.db2.gz	HYUVSSQAJNUEKY-OAHLLOKOSA-N	0	3	301.394	2.327	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Cc2cc(Cl)ccc2OC)C1	ZINC000194641844	424878045	/nfs/dbraw/zinc/87/80/45/424878045.db2.gz	ZMNVEWZKOODROQ-AWEZNQCLSA-N	0	3	310.825	2.492	10	0		DEAEHN
CCn1cc(NC(=O)N[C@@H](CN(C)C)c2ccccc2)cn1	ZINC000192766593	424865016	/nfs/dbraw/zinc/86/50/16/424865016.db2.gz	HYUVSSQAJNUEKY-HNNXBMFYSA-N	0	3	301.394	2.327	10	0		DEAEHN
Cc1ccc(CNCC[C@]2(O)CCOC2)c(Br)c1	ZINC000404212358	424925868	/nfs/dbraw/zinc/92/58/68/424925868.db2.gz	QTUAUABOWTYBNW-AWEZNQCLSA-N	0	3	314.223	2.389	10	0		DEAEHN
O[C@@]1(CCNCc2ccc(Br)c(F)c2)CCOC1	ZINC000404208131	424926210	/nfs/dbraw/zinc/92/62/10/424926210.db2.gz	OHBWZAASKFDHBV-ZDUSSCGKSA-N	0	3	318.186	2.219	10	0		DEAEHN
O[C@@H]1C[C@H]2CN(Cc3ccc(Cl)cc3Cl)CCN2C1	ZINC000405301959	424930915	/nfs/dbraw/zinc/93/09/15/424930915.db2.gz	IZFKKQOZZGXWFX-QWHCGFSZSA-N	0	3	301.217	2.244	10	0		DEAEHN
O=C(NCC1(O)CCN(Cc2ccccc2)CC1)C1CCCC1	ZINC000397574321	269106694	/nfs/dbraw/zinc/10/66/94/269106694.db2.gz	BHWNQVSOAJLEDW-UHFFFAOYSA-N	0	3	316.445	2.320	10	0		DEAEHN
Cc1noc(CN2CCN(C[C@@H]3C(C)=CCC[C@@H]3C)CC2)n1	ZINC000443404523	269137087	/nfs/dbraw/zinc/13/70/87/269137087.db2.gz	GHBGWMOTDOPZDY-GOEBONIOSA-N	0	3	304.438	2.488	10	0		DEAEHN
CC(C)[C@H](NC(=O)N1CC[C@H](N2CCCC2)C1)C(F)(F)F	ZINC000526068184	269502738	/nfs/dbraw/zinc/50/27/38/269502738.db2.gz	WMHZMXWJWXCDHM-RYUDHWBXSA-N	0	3	307.360	2.453	10	0		DEAEHN
Cc1ccc(-c2nc(NC(=O)[C@H]3C[C@@H](O)CN3)sc2C)s1	ZINC000262549667	274732676	/nfs/dbraw/zinc/73/26/76/274732676.db2.gz	ONFVMUCZALKRQG-NXEZZACHSA-N	0	3	323.443	2.150	10	0		DEAEHN
CCC[C@H](CC)NC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000180437196	276041536	/nfs/dbraw/zinc/04/15/36/276041536.db2.gz	QDQSZLWAFPCUDZ-DLBZAZTESA-N	0	3	324.513	2.377	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H]2CCOc3ccc(F)cc32)C1	ZINC000069411280	276177766	/nfs/dbraw/zinc/17/77/66/276177766.db2.gz	ZLNAGHSJMKSKKR-DZGCQCFKSA-N	0	3	321.396	2.433	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCCC[C@H]1c1ncc[nH]1	ZINC000246418240	276184934	/nfs/dbraw/zinc/18/49/34/276184934.db2.gz	SIWJAESCNSNILD-KBPBESRZSA-N	0	3	305.426	2.131	10	0		DEAEHN
CCOC(=O)[C@@H]1CN([C@@H]2CCc3ccc(F)cc32)CC12COC2	ZINC000451137801	276289154	/nfs/dbraw/zinc/28/91/54/276289154.db2.gz	PNVCFBRZUUPKMW-JKSUJKDBSA-N	0	3	319.376	2.325	10	0		DEAEHN
C/C(=C/c1ccccc1)CNC[C@H]1CCCCN1S(C)(=O)=O	ZINC000353089469	276824372	/nfs/dbraw/zinc/82/43/72/276824372.db2.gz	MRRSPJSEVINTPA-MLRPBERTSA-N	0	3	322.474	2.494	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000123257584	277076316	/nfs/dbraw/zinc/07/63/16/277076316.db2.gz	JLJPNLOBWWPCSJ-RISCZKNCSA-N	0	3	321.396	2.339	10	0		DEAEHN
CN1CC[C@H](NC(=O)C[C@@](C)(O)C2CC2)[C@@H]1c1ccccc1	ZINC000270399067	277165194	/nfs/dbraw/zinc/16/51/94/277165194.db2.gz	CFFKAODSTQHPEO-RYQLBKOJSA-N	0	3	302.418	2.099	10	0		DEAEHN
CN1CC[C@H](NC(=O)NC[C@@]2(C)CCCO2)[C@@H]1c1ccccc1	ZINC000245641794	277166973	/nfs/dbraw/zinc/16/69/73/277166973.db2.gz	KQCIQNMRZFBJSF-XYJFISCASA-N	0	3	317.433	2.300	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N1CCCC[C@H]1CN(C)C	ZINC000246660339	278109019	/nfs/dbraw/zinc/10/90/19/278109019.db2.gz	GRTSPARGCTUILT-KEYYUXOJSA-N	0	3	302.418	2.494	10	0		DEAEHN
CSCCCNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000245700911	278129269	/nfs/dbraw/zinc/12/92/69/278129269.db2.gz	ZGELMEPQRZBYCJ-LSDHHAIUSA-N	0	3	307.463	2.484	10	0		DEAEHN
C[C@H](NC[C@H]1CCCC[C@H]1O)c1ccc(S(C)(=O)=O)cc1	ZINC000246880237	278264808	/nfs/dbraw/zinc/26/48/08/278264808.db2.gz	KGMGNJXQJXQMBW-JGGQBBKZSA-N	0	3	311.447	2.292	10	0		DEAEHN
C[C@@H]1OCCC[C@H]1C(=O)N1C[C@H](N(C)C)Cc2ccccc21	ZINC000191536786	279040223	/nfs/dbraw/zinc/04/02/23/279040223.db2.gz	JSVZSLOPWSWHTG-NUEKZKHPSA-N	0	3	302.418	2.321	10	0		DEAEHN
C[C@@H]1[C@H](C)N(C(=O)c2[nH]nc3ccc(Cl)cc32)CCN1C	ZINC000408022919	279102248	/nfs/dbraw/zinc/10/22/48/279102248.db2.gz	OYMSZKZIRJLNCZ-ZJUUUORDSA-N	0	3	306.797	2.381	10	0		DEAEHN
CC(C)C[C@H](CO)N(C)C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000188407323	279166922	/nfs/dbraw/zinc/16/69/22/279166922.db2.gz	MEEPDLZHKCQGPY-LSDHHAIUSA-N	0	3	301.475	2.011	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NC[C@H](c1ccco1)N(C)C	ZINC000245457966	279325811	/nfs/dbraw/zinc/32/58/11/279325811.db2.gz	CJWTXBPYLPPEQW-LSDHHAIUSA-N	0	3	322.453	2.008	10	0		DEAEHN
C[C@@H]1CN(CCC2CC[NH+](CCCC(=O)[O-])CC2)C[C@@H](C)O1	ZINC000175797185	288156661	/nfs/dbraw/zinc/15/66/61/288156661.db2.gz	BOKZWCGLGKNVQX-HUUCEWRRSA-N	0	3	312.454	2.063	10	0		DEAEHN
CC(C)[C@H](C)CC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000176674882	280196577	/nfs/dbraw/zinc/19/65/77/280196577.db2.gz	SEWWSQUYAUVKTR-SJORKVTESA-N	0	3	309.498	2.297	10	0		DEAEHN
O=C1NCCC[C@@H]1N[C@H]1CCc2c1cccc2Br	ZINC000221799089	280287336	/nfs/dbraw/zinc/28/73/36/280287336.db2.gz	JPXMLTJMHFNHMK-STQMWFEESA-N	0	3	309.207	2.305	10	0		DEAEHN
O=C1[C@@H](N2CCN3CCC[C@@H]3C2)CCCN1c1ccccc1F	ZINC000179310656	280313974	/nfs/dbraw/zinc/31/39/74/280313974.db2.gz	MGLINLPOLHRZSW-PBHICJAKSA-N	0	3	317.408	2.101	10	0		DEAEHN
C[C@@]1(C(N)=O)CCCCN1CCCOCCc1ccccc1	ZINC000185945777	289155277	/nfs/dbraw/zinc/15/52/77/289155277.db2.gz	LIRVBOPJOJAYJF-SFHVURJKSA-N	0	3	304.434	2.366	10	0		DEAEHN
CO[C@H](C(=O)N1CCCC12CCN(C)CC2)c1ccc(O)cc1	ZINC000408153420	294176667	/nfs/dbraw/zinc/17/66/67/294176667.db2.gz	CAYQSBMZWGGKEU-INIZCTEOSA-N	0	3	318.417	2.167	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1c[nH]nc1-c1ccccc1	ZINC000247246655	300318866	/nfs/dbraw/zinc/31/88/66/300318866.db2.gz	YMPOOPJRCSOFFJ-ZFWWWQNUSA-N	0	3	310.401	2.385	10	0		DEAEHN
Cc1cccc(CN(CCN(C)C)C(=O)[C@@H]2CC[C@@H](C)O2)c1	ZINC000152349304	301984155	/nfs/dbraw/zinc/98/41/55/301984155.db2.gz	MIEKPHONBUSLFO-WBVHZDCISA-N	0	3	304.434	2.453	10	0		DEAEHN
C[C@@H](N[C@H]1CCC(=O)N(C)C1)c1ccc(Br)cn1	ZINC000576522201	326299896	/nfs/dbraw/zinc/29/98/96/326299896.db2.gz	ZJINVSOUQMDPLA-KOLCDFICSA-N	0	3	312.211	2.116	10	0		DEAEHN
COCc1nc2n(n1)CCC[C@H]2N[C@@H](C)C1CCSCC1	ZINC000187306180	332965949	/nfs/dbraw/zinc/96/59/49/332965949.db2.gz	QMESQFSFTPIYCX-WCQYABFASA-N	0	3	310.467	2.381	10	0		DEAEHN
CCN(C(=O)OC(C)(C)C)[C@H](C)CNCc1cnn(C)c1C	ZINC000387703578	333162026	/nfs/dbraw/zinc/16/20/26/333162026.db2.gz	XRJSNIBYSSNSJH-GFCCVEGCSA-N	0	3	310.442	2.464	10	0		DEAEHN
N=C(N)c1cn2ccnc2c(CCC(F)(F)C(F)(F)F)n1	ZINC000584605091	337371472	/nfs/dbraw/zinc/37/14/72/337371472.db2.gz	CIFWINSOXIQXGR-UHFFFAOYSA-N	0	3	307.226	2.144	10	0		DEAEHN
CCCCCOC[C@@H](O)CNCCOc1ccccc1OC	ZINC000584627854	337376131	/nfs/dbraw/zinc/37/61/31/337376131.db2.gz	LURGLDUMVOGMKH-HNNXBMFYSA-N	0	3	311.422	2.231	10	0		DEAEHN
CN1C[C@H](O)C[C@H](C(O)(c2cccs2)c2cccs2)C1	ZINC000584631762	337376974	/nfs/dbraw/zinc/37/69/74/337376974.db2.gz	UAQNWQBJYFDZLR-NWDGAFQWSA-N	0	3	309.456	2.358	10	0		DEAEHN
CC(C)CC[C@H]1CCCCN1CC(=O)N1CCC[C@H](C(N)=O)C1	ZINC000158131868	519693805	/nfs/dbraw/zinc/69/38/05/519693805.db2.gz	DNNVCHIXIIRZLT-JKSUJKDBSA-N	0	3	323.481	2.001	10	0		DEAEHN
CCCC(=O)N[C@H]1CCCN(CCCCCn2cccn2)C1	ZINC000104682562	519876617	/nfs/dbraw/zinc/87/66/17/519876617.db2.gz	QWFPQFCZXNTLPB-INIZCTEOSA-N	0	3	306.454	2.434	10	0		DEAEHN
CCCCCCN1CCN(C[C@H]2CN(C(C)C)CCO2)CC1	ZINC000157958252	520079080	/nfs/dbraw/zinc/07/90/80/520079080.db2.gz	MKOHKXPUHADIPL-SFHVURJKSA-N	0	3	311.514	2.294	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@@H](c2cccc(O)c2)C1)N(C)C	ZINC000158250640	520582509	/nfs/dbraw/zinc/58/25/09/520582509.db2.gz	QAVHOEVHWQFWQG-JKSUJKDBSA-N	0	3	306.406	2.022	10	0		DEAEHN
CCOc1cc2c(cc1CNC(=O)[C@H](N)[C@H](C)CC)O[C@H](C)C2	ZINC000246504933	520791992	/nfs/dbraw/zinc/79/19/92/520791992.db2.gz	QDMOIIIQPINQJE-PSTGCABASA-N	0	3	320.433	2.398	10	0		DEAEHN
CCCC[C@H](NCCn1cc(C)cn1)C(=O)Nc1cc(C)on1	ZINC000105881591	521239318	/nfs/dbraw/zinc/23/93/18/521239318.db2.gz	HDQPXOYOTQVSHJ-AWEZNQCLSA-N	0	3	319.409	2.275	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)NCCc1nc(-c2ccccn2)cs1	ZINC000237072735	521835319	/nfs/dbraw/zinc/83/53/19/521835319.db2.gz	DTDCHTUNTOSXQA-XHDPSFHLSA-N	0	3	318.446	2.237	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2ncc(-c3cccs3)o2)CCO1	ZINC000109133099	521852753	/nfs/dbraw/zinc/85/27/53/521852753.db2.gz	LRSSMGGJVMAZJP-GFCCVEGCSA-N	0	3	307.419	2.166	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CCC[C@@H]1C1CCC1	ZINC000111866107	523831918	/nfs/dbraw/zinc/83/19/18/523831918.db2.gz	MPPKZDVICNDKQN-JKSUJKDBSA-N	0	3	309.454	2.071	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CCC[C@@H]1C1CCCC1	ZINC000111864256	523832309	/nfs/dbraw/zinc/83/23/09/523832309.db2.gz	NJAPXTPMBOMDEM-DLBZAZTESA-N	0	3	323.481	2.461	10	0		DEAEHN
COCCOc1ccc(CN2CC[C@H](c3cnn(C)c3)C2)cc1	ZINC000128526258	524043693	/nfs/dbraw/zinc/04/36/93/524043693.db2.gz	LEZNDQOIBYGPNH-INIZCTEOSA-N	0	3	315.417	2.435	10	0		DEAEHN
C[C@H](CNCc1cccc2c1OC(C)(C)C2)N1CCOCC1	ZINC000161583966	524488456	/nfs/dbraw/zinc/48/84/56/524488456.db2.gz	WJUDERRPCPRJAY-CQSZACIVSA-N	0	3	304.434	2.210	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1F	ZINC000249148874	524991129	/nfs/dbraw/zinc/99/11/29/524991129.db2.gz	GVMSAQUFLBMQMC-GXTWGEPZSA-N	0	3	321.396	2.014	10	0		DEAEHN
C[C@H](C(=O)NC1CCCC1)N1CCC(Cc2nccn2C)CC1	ZINC000105875572	526027191	/nfs/dbraw/zinc/02/71/91/526027191.db2.gz	GPRVCNBNQSCKTA-CQSZACIVSA-N	0	3	318.465	2.122	10	0		DEAEHN
c1ccc(-n2nnnc2CCN2CCc3ccccc3C2)cc1	ZINC000338270348	526459429	/nfs/dbraw/zinc/45/94/29/526459429.db2.gz	FCIAESDMIIBTEE-UHFFFAOYSA-N	0	3	305.385	2.263	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)CN(C)[C@@H]2CCN(C)[C@H](C)C2)c1C	ZINC000299378126	527157818	/nfs/dbraw/zinc/15/78/18/527157818.db2.gz	SKSSJMTXRJXFNH-IAQYHMDHSA-N	0	3	319.449	2.431	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N(C)[C@@H]2CC[N@H+](C)[C@H](C)C2)cc1[O-]	ZINC000331336363	527235479	/nfs/dbraw/zinc/23/54/79/527235479.db2.gz	IWXUBFUNSOUDGU-BXUZGUMPSA-N	0	3	304.390	2.150	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1[O-]	ZINC000331336363	527235481	/nfs/dbraw/zinc/23/54/81/527235481.db2.gz	IWXUBFUNSOUDGU-BXUZGUMPSA-N	0	3	304.390	2.150	10	0		DEAEHN
C(c1noc(C2CCOCC2)n1)N1CC[C@H](N2CCCCC2)C1	ZINC000328608980	527497663	/nfs/dbraw/zinc/49/76/63/527497663.db2.gz	MHWWYVZMGOJMTF-HNNXBMFYSA-N	0	3	320.437	2.024	10	0		DEAEHN
CC(C)OC(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000295821695	527822959	/nfs/dbraw/zinc/82/29/59/527822959.db2.gz	BXYVYFDSSUVYRN-INIZCTEOSA-N	0	3	306.406	2.412	10	0		DEAEHN
CC1=CCN(CCNC(=O)NCCN2CCCC(C)(C)C2)CC1	ZINC000447834586	528117570	/nfs/dbraw/zinc/11/75/70/528117570.db2.gz	LNOLIKGGCGBFMB-UHFFFAOYSA-N	0	3	322.497	2.060	10	0		DEAEHN
CCC1(CC)CN(CCCN2CCCCC2)CC[S@]1=O	ZINC000189221271	529080400	/nfs/dbraw/zinc/08/04/00/529080400.db2.gz	GDPBEVHJUJTCBY-FQEVSTJZSA-N	0	3	300.512	2.486	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)N1Cc2ccccc2C1	ZINC000262544606	535043281	/nfs/dbraw/zinc/04/32/81/535043281.db2.gz	RPCQTKDBGKMILX-HDMKZQKVSA-N	0	3	300.402	2.061	10	0		DEAEHN
CCN(C[C@@H]1CCN(C[C@@H](O)C(F)(F)F)C1)CC(F)(F)F	ZINC000248393434	535770654	/nfs/dbraw/zinc/77/06/54/535770654.db2.gz	LSRMXCXLMRLMES-VHSXEESVSA-N	0	3	322.293	2.116	10	0		DEAEHN
COc1cc(C)c(C(=O)N[C@H](C)C2=CCN(C)CC2)cc1OC	ZINC000357923460	536561305	/nfs/dbraw/zinc/56/13/05/536561305.db2.gz	VTWVITCDOZBFJK-CYBMUJFWSA-N	0	3	318.417	2.392	10	0		DEAEHN
COCc1ccc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cc1	ZINC000246918108	536748730	/nfs/dbraw/zinc/74/87/30/536748730.db2.gz	WCYVMROQOSNOEO-DLBZAZTESA-N	0	3	302.418	2.389	10	0		DEAEHN
CO[C@H]1CC[C@H](NC(=O)N[C@@H](CC(C)C)CN2CCCC2)C1	ZINC000454838626	536765027	/nfs/dbraw/zinc/76/50/27/536765027.db2.gz	BKPMMKIACQMIEL-JYJNAYRXSA-N	0	3	311.470	2.364	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)N3C[C@@H]4CCCN4C[C@@H]3C)cc2c1	ZINC000248768164	536958678	/nfs/dbraw/zinc/95/86/78/536958678.db2.gz	ABLYZWGTSOULGU-JSGCOSHPSA-N	0	3	313.401	2.485	10	0		DEAEHN
CNC(=O)[C@H](NCc1ccc(SC(=O)N(C)C)cc1)C(C)C	ZINC000183643271	625311852	/nfs/dbraw/zinc/31/18/52/625311852.db2.gz	OKJLHKFKCJZGPU-CQSZACIVSA-N	0	3	323.462	2.321	10	0		DEAEHN
COCC[C@H](N)C(=O)Nc1cc(Br)ccc1C	ZINC000052792696	625320648	/nfs/dbraw/zinc/32/06/48/625320648.db2.gz	MQJHBMLZWNJVTH-JTQLQIEISA-N	0	3	301.184	2.060	10	0		DEAEHN
Cc1nccnc1[C@H](C)NC1CC(NC(=O)OC(C)(C)C)C1	ZINC000235520818	623335708	/nfs/dbraw/zinc/33/57/08/623335708.db2.gz	WBHCZCLJGGZDSX-HIFPTAJRSA-N	0	3	306.410	2.491	10	0		DEAEHN
CCCC1(c2noc(CN3CCCC[C@H](N)C3=O)n2)CCC1	ZINC000888078240	625058602	/nfs/dbraw/zinc/05/86/02/625058602.db2.gz	CFMYFEYNTPLYLA-LBPRGKRZSA-N	0	3	306.410	2.131	10	0		DEAEHN
COCC[C@@H](N)C(=O)N[C@@H]1CCSc2ccc(Cl)cc21	ZINC000052792482	625105004	/nfs/dbraw/zinc/10/50/04/625105004.db2.gz	YXFTWQSVQAUVPM-VXGBXAGGSA-N	0	3	314.838	2.357	10	0		DEAEHN
C[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NNc2ccncc2)cc1	ZINC000180439888	625185863	/nfs/dbraw/zinc/18/58/63/625185863.db2.gz	GDIQULSTKLBXIO-NHYWBVRUSA-N	0	3	310.357	2.433	10	0		DEAEHN
CCC[N@H+](CCC[N-]C(=O)C(F)(F)F)C[C@H]1CCCCO1	ZINC000091619089	635144401	/nfs/dbraw/zinc/14/44/01/635144401.db2.gz	ADGKNHIXCSMBHB-GFCCVEGCSA-N	0	3	310.360	2.336	10	0		DEAEHN
CCC[N@@H+](CCC[N-]C(=O)C(F)(F)F)C[C@H]1CCCCO1	ZINC000091619089	635144406	/nfs/dbraw/zinc/14/44/06/635144406.db2.gz	ADGKNHIXCSMBHB-GFCCVEGCSA-N	0	3	310.360	2.336	10	0		DEAEHN
C[C@H]1CN(C(=O)c2cccc(CN3CCCC3)c2)CCN1C	ZINC000742196097	637340991	/nfs/dbraw/zinc/34/09/91/637340991.db2.gz	LSQFFWUQJZCYCT-HNNXBMFYSA-N	0	3	301.434	2.059	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)Nc1ccc(Cl)nc1	ZINC000228934291	647407531	/nfs/dbraw/zinc/40/75/31/647407531.db2.gz	WZLJMKQYGROZGR-JVLSTEMRSA-N	0	3	309.797	2.206	10	0		DEAEHN
COCCN1CCC[C@@H](NC(=O)/C=C(/C)c2cccc(F)c2)C1	ZINC000732080109	647539607	/nfs/dbraw/zinc/53/96/07/647539607.db2.gz	VVQXGRKGCXHNIF-VWILAXROSA-N	0	3	320.408	2.456	10	0		DEAEHN
CC(=O)CCN(C)C[C@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000114461463	651957453	/nfs/dbraw/zinc/95/74/53/651957453.db2.gz	QOCLZHSBCPUTLK-ZDUSSCGKSA-N	0	3	319.323	2.356	10	0		DEAEHN
[NH3+][C@@H]1CC[C@H](C[N-]S(=O)(=O)c2c(Cl)cccc2Cl)C1	ZINC000389019325	685431838	/nfs/dbraw/zinc/43/18/38/685431838.db2.gz	YSABAASOEYSBNI-DTWKUNHWSA-N	0	3	323.245	2.399	10	0		DEAEHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCOC[C@H]2C)cc1	ZINC000192518198	684451333	/nfs/dbraw/zinc/45/13/33/684451333.db2.gz	RQXRJRHXXIYLQV-KCPJHIHWSA-N	0	3	316.357	2.015	10	0		DEAEHN
CCOCCN1CCN(C[C@@H](O)c2ccc(C)cc2)C[C@@H]1C	ZINC000246730267	685135255	/nfs/dbraw/zinc/13/52/55/685135255.db2.gz	MWOGXXPZIXOUJJ-FUHWJXTLSA-N	0	3	306.450	2.071	10	0		DEAEHN
Cn1cc(O[C@@H]2COC[C@@H]2NCc2cccc(C3CC3)c2)cn1	ZINC000862496502	686312791	/nfs/dbraw/zinc/31/27/91/686312791.db2.gz	YPPHRXLTLCEMEJ-ZWKOTPCHSA-N	0	3	313.401	2.234	10	0		DEAEHN
C[C@@H](N[C@@H]1CON(C(=O)OC(C)(C)C)C1)[C@H]1CCCCO1	ZINC000724664086	777444135	/nfs/dbraw/zinc/44/41/35/777444135.db2.gz	IPFHIHQPNSICER-FRRDWIJNSA-N	0	3	300.399	2.085	10	0		DEAEHN
NC(=O)c1csc(CNC[C@@H]2CC[C@@H](C(F)(F)F)O2)c1	ZINC000722402703	778707701	/nfs/dbraw/zinc/70/77/01/778707701.db2.gz	JLUBCPZLUNYECA-WPRPVWTQSA-N	0	3	308.325	2.047	10	0		DEAEHN
Cc1sc(C)c(S(=O)(=O)N2CCNCCC2(C)C)c1C	ZINC000722567080	787334193	/nfs/dbraw/zinc/33/41/93/787334193.db2.gz	LPLGHCBXWADCRD-UHFFFAOYSA-N	0	3	316.492	2.436	10	0		DEAEHN
CC[C@H](NCc1cn(C)nc1Br)[C@@H]1CCCOC1	ZINC000723959421	787346032	/nfs/dbraw/zinc/34/60/32/787346032.db2.gz	QYGPCPUAVZCUSE-PWSUYJOCSA-N	0	3	316.243	2.477	10	0		DEAEHN
C[C@@H](NCc1cn(C)nc1Br)[C@H]1CCCOC1	ZINC000712397230	792185427	/nfs/dbraw/zinc/18/54/27/792185427.db2.gz	LYHYKSXLOXNXSH-ZJUUUORDSA-N	0	3	302.216	2.087	10	0		DEAEHN
Cn1cc(CNCCC[C@@H]2CCOC2)c(Br)n1	ZINC000712403312	792186993	/nfs/dbraw/zinc/18/69/93/792186993.db2.gz	BKZDQWYFSWLXJM-SNVBAGLBSA-N	0	3	302.216	2.089	10	0		DEAEHN
Cn1cc(CNCCCC(C)(C)CO)c(Br)n1	ZINC000712489325	792190840	/nfs/dbraw/zinc/19/08/40/792190840.db2.gz	BULNKGJYOOTHLA-UHFFFAOYSA-N	0	3	304.232	2.071	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@H](N[C@@H]2CCCc3n[nH]cc32)C1	ZINC000401684939	801841441	/nfs/dbraw/zinc/84/14/41/801841441.db2.gz	MUECVJLDTOIXQG-WCQYABFASA-N	0	3	306.410	2.386	10	0		DEAEHN
C=CCOc1ccc(CN[C@H]2CCCCNC2=O)cc1OC	ZINC000054174238	1078604410	/nfs/dbraw/zinc/60/44/10/1078604410.db2.gz	FPBNLWMLYTXVPM-AWEZNQCLSA-N	0	3	304.390	2.018	10	0		DEAEHN
C[C@@H]1CCC[C@H](CNCCS(=O)(=O)C2CCCCC2)O1	ZINC000700004271	1086300488	/nfs/dbraw/zinc/30/04/88/1086300488.db2.gz	DAEPWWOVOVPISG-ZIAGYGMSSA-N	0	3	303.468	2.281	10	0		DEAEHN
Brc1cncc(CNCCOC2CCOCC2)c1	ZINC000701388843	1086362821	/nfs/dbraw/zinc/36/28/21/1086362821.db2.gz	GNEOXULMBILCKL-UHFFFAOYSA-N	0	3	315.211	2.129	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NCCSC(C)(C)C	ZINC000702411899	1086431449	/nfs/dbraw/zinc/43/14/49/1086431449.db2.gz	IECYHWJIWNXIDB-OAHLLOKOSA-N	0	3	323.506	2.094	10	0		DEAEHN
Cc1ccc(N(C)C(=O)[C@@H](N)CN(C)Cc2ccccc2)cc1	ZINC000702409115	1086431581	/nfs/dbraw/zinc/43/15/81/1086431581.db2.gz	OBIYOCUAOKWMFK-SFHVURJKSA-N	0	3	311.429	2.417	10	0		DEAEHN
Cn1ncc(Br)c1CNCC[C@@H]1CCSC1	ZINC000704844501	1086593266	/nfs/dbraw/zinc/59/32/66/1086593266.db2.gz	JVWDWVGZEVQTTH-SECBINFHSA-N	0	3	304.257	2.415	10	0		DEAEHN
Cc1ccc(CNCCOCCN(C)C(=O)OC(C)(C)C)nc1	ZINC000705923062	1086626339	/nfs/dbraw/zinc/62/63/39/1086626339.db2.gz	LQHVVATWBQGPHF-UHFFFAOYSA-N	0	3	323.437	2.363	10	0		DEAEHN
CC(C)(CNS(C)(=O)=O)NCc1csc2ccccc12	ZINC000708222440	1086677745	/nfs/dbraw/zinc/67/77/45/1086677745.db2.gz	HMTLKBPASDKRFI-UHFFFAOYSA-N	0	3	312.460	2.319	10	0		DEAEHN
Cn1nccc1CN[C@]12CCC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000711386886	1087080847	/nfs/dbraw/zinc/08/08/47/1087080847.db2.gz	TZOPANAKDJCOSA-GUYCJALGSA-N	0	3	320.437	2.299	10	0		DEAEHN
COc1ccncc1CNC[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000711404045	1087088197	/nfs/dbraw/zinc/08/81/97/1087088197.db2.gz	BSJOEDGSWVCCTQ-XBXGTLAGSA-N	0	3	321.421	2.483	10	0		DEAEHN
Cn1nccc1CN[C@@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000711638402	1087179180	/nfs/dbraw/zinc/17/91/80/1087179180.db2.gz	GCCWELJBAYPNNS-RHSMWYFYSA-N	0	3	320.437	2.442	10	0		DEAEHN
Cc1nc(CNC[C@H]2CC[C@H](O)C2)sc1Br	ZINC000719303362	1088942320	/nfs/dbraw/zinc/94/23/20/1088942320.db2.gz	BFZHACQQJPVXNU-IUCAKERBSA-N	0	3	305.241	2.465	10	0		DEAEHN
C[C@H]1[C@H](NC(=O)c2cc(F)ccc2Br)CCN1C	ZINC000719384274	1089077423	/nfs/dbraw/zinc/07/74/23/1089077423.db2.gz	CPDCMGVRCSDJPF-QPUJVOFHSA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@@H]1[C@@H](NC(=O)c2cscc2Br)CCN1C	ZINC000719399050	1089086780	/nfs/dbraw/zinc/08/67/80/1089086780.db2.gz	YNWWZCRNISESIF-XCBNKYQSSA-N	0	3	303.225	2.333	10	0		DEAEHN
CCCc1ccc([C@H](N)CSCCS(C)(=O)=O)cc1	ZINC000081768930	192323196	/nfs/dbraw/zinc/32/31/96/192323196.db2.gz	XHMCDSDGNPGZGF-CQSZACIVSA-N	0	3	301.477	2.417	10	0		DEAEHN
CN[C@@H](CSCCS(C)(=O)=O)c1ccc(C)c(C)c1	ZINC000081769002	192323489	/nfs/dbraw/zinc/32/34/89/192323489.db2.gz	BNYQDNUWXPXPPX-AWEZNQCLSA-N	0	3	301.477	2.342	10	0		DEAEHN
COc1ccc(Cl)cc1CNC(=O)NC[C@@H]1CCCN1C	ZINC000139694170	282101626	/nfs/dbraw/zinc/10/16/26/282101626.db2.gz	NUKVEEVCJHVSHO-ZDUSSCGKSA-N	0	3	311.813	2.242	10	0		DEAEHN
CCN(CCNC(=O)NC[C@@H]1CCCN1C)c1ccccc1C	ZINC000139603979	282101629	/nfs/dbraw/zinc/10/16/29/282101629.db2.gz	SMAMMDCGEKBFFN-INIZCTEOSA-N	0	3	318.465	2.215	10	0		DEAEHN
OCc1ccc(CN[C@H]2CCN(c3ncccc3Cl)C2)o1	ZINC000151228527	282113163	/nfs/dbraw/zinc/11/31/63/282113163.db2.gz	FKIHZSHQJOVPPP-NSHDSACASA-N	0	3	307.781	2.189	10	0		DEAEHN
COCCN(CCOC)[C@H](CN)c1ccc(F)c(Cl)c1	ZINC000163807921	197649367	/nfs/dbraw/zinc/64/93/67/197649367.db2.gz	IRBQGWYWMQWRLR-CQSZACIVSA-N	0	3	304.793	2.074	10	0		DEAEHN
CCC[C@@H](N)[C@H](CC)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000081935484	192343392	/nfs/dbraw/zinc/34/33/92/192343392.db2.gz	ZAZNDKOFLTVCRH-DOMZBBRYSA-N	0	3	313.419	2.138	10	0		DEAEHN
O=C(NC[C@H](O)CN1CCCCC1)[C@@H](c1ccccc1)C1CC1	ZINC000158694732	295676706	/nfs/dbraw/zinc/67/67/06/295676706.db2.gz	YPIIPBNFALCRKT-ROUUACIJSA-N	0	3	316.445	2.143	10	0		DEAEHN
CC(C)(C[C@H](N)c1cc2c(cc1Cl)OCCCO2)C(N)=O	ZINC000087722258	185230977	/nfs/dbraw/zinc/23/09/77/185230977.db2.gz	XGUHNLYRRNYZTM-NSHDSACASA-N	0	3	312.797	2.403	10	0		DEAEHN
NCc1ccccc1CS(=O)(=O)N1CCC[C@@H]2CCC[C@@H]21	ZINC000087768824	185231410	/nfs/dbraw/zinc/23/14/10/185231410.db2.gz	AHODQNHQTWHAEU-BBRMVZONSA-N	0	3	308.447	2.240	10	0		DEAEHN
COCCNCc1cc(Br)ccc1OCOC	ZINC000087888205	185234603	/nfs/dbraw/zinc/23/46/03/185234603.db2.gz	IGRUJEWCVVZJCM-UHFFFAOYSA-N	0	3	304.184	2.168	10	0		DEAEHN
O[C@@H]1CCOC[C@H]1[C@H]1CCCN1Cc1nc2cccnc2s1	ZINC000328807382	231353821	/nfs/dbraw/zinc/35/38/21/231353821.db2.gz	MBYXOPPWDJBAMY-IACUBPJLSA-N	0	3	319.430	2.053	10	0		DEAEHN
O=S(=O)([N-]c1ccccc1-c1ccccc1)[C@@H]1CC[NH2+]C1	ZINC000088056073	185238226	/nfs/dbraw/zinc/23/82/26/185238226.db2.gz	BTCLUHKEBSXGBL-CQSZACIVSA-N	0	3	302.399	2.457	10	0		DEAEHN
CN[C@H]1CCCN(c2c(F)cc(Br)cc2F)C1=O	ZINC000088172873	185240822	/nfs/dbraw/zinc/24/08/22/185240822.db2.gz	UWHBYFGQBFYGEM-JTQLQIEISA-N	0	3	319.149	2.442	10	0		DEAEHN
CN1CCCC[C@@H]1COc1ncc(Br)cc1N	ZINC000088165381	185240962	/nfs/dbraw/zinc/24/09/62/185240962.db2.gz	DLIDTXJDZVOKIZ-SNVBAGLBSA-N	0	3	300.200	2.289	10	0		DEAEHN
C[C@@H](C(=O)Nc1cccc(CN)c1)N(C)CCC(F)(F)F	ZINC000088417591	185249299	/nfs/dbraw/zinc/24/92/99/185249299.db2.gz	OFBQICWUAFKJNM-JTQLQIEISA-N	0	3	303.328	2.357	10	0		DEAEHN
CC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(S(=O)(=O)[N-]C)o1	ZINC000088540206	185255644	/nfs/dbraw/zinc/25/56/44/185255644.db2.gz	NJCSLEOPHBJAAP-WCQYABFASA-N	0	3	300.424	2.246	10	0		DEAEHN
C[C@H]1CCC[C@H](NCc2ccc(S(=O)(=O)N(C)C)o2)C1	ZINC000088540068	185255796	/nfs/dbraw/zinc/25/57/96/185255796.db2.gz	JILGEHQJDXPLLD-RYUDHWBXSA-N	0	3	300.424	2.198	10	0		DEAEHN
CC(C)(C)[NH2+]Cc1ccc(S(=O)(=O)[N-][C@@H]2CC2(C)C)o1	ZINC000088542947	185256012	/nfs/dbraw/zinc/25/60/12/185256012.db2.gz	JZCRYMZZVHAXLQ-LLVKDONJSA-N	0	3	300.424	2.245	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)CCCOC)c1ccc(C)cc1	ZINC000081985821	192348841	/nfs/dbraw/zinc/34/88/41/192348841.db2.gz	NRHLTUZWJSWXQC-INIZCTEOSA-N	0	3	313.463	2.487	10	0		DEAEHN
Cc1ccc2c(N)c(C(=O)NC[C@H]3CCN(C)C3)sc2c1	ZINC000088640955	185260676	/nfs/dbraw/zinc/26/06/76/185260676.db2.gz	PEDWINNVADDQMR-LLVKDONJSA-N	0	3	303.431	2.473	10	0		DEAEHN
O=S(=O)(N[C@H]1CC=CCC1)c1ccc(CNC2CC2)cc1	ZINC000088749074	185264164	/nfs/dbraw/zinc/26/41/64/185264164.db2.gz	ZUOPMIOMPNAZHQ-HNNXBMFYSA-N	0	3	306.431	2.326	10	0		DEAEHN
CN(C)CCN[C@@H](CO)c1cc(Cl)ccc1Br	ZINC000090252639	185288136	/nfs/dbraw/zinc/28/81/36/185288136.db2.gz	UOUBNCHWOHFOMB-LBPRGKRZSA-N	0	3	321.646	2.287	10	0		DEAEHN
CC[C@H](NC[C@](C)(O)CO)c1ccc(Br)cc1	ZINC000090284254	185289427	/nfs/dbraw/zinc/28/94/27/185289427.db2.gz	YARJWJNPZNEAKJ-STQMWFEESA-N	0	3	302.212	2.233	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000090293220	185289900	/nfs/dbraw/zinc/28/99/00/185289900.db2.gz	WHGZOKAZIRNTLF-UHFFFAOYSA-N	0	3	322.352	2.078	10	0		DEAEHN
N[C@H]1COC[C@@H]1c1nc(CSc2ccc(Cl)cc2)no1	ZINC000090365062	185292687	/nfs/dbraw/zinc/29/26/87/185292687.db2.gz	CTEPPMZYCDNDTI-QWRGUYRKSA-N	0	3	311.794	2.456	10	0		DEAEHN
N[C@@H]1COC[C@H]1C(=O)Nc1ccc(SC(F)(F)F)cc1	ZINC000090380642	185293430	/nfs/dbraw/zinc/29/34/30/185293430.db2.gz	DRWJISGHBCHLDN-NXEZZACHSA-N	0	3	306.309	2.211	10	0		DEAEHN
N[C@H]1COC[C@@H]1C(=O)Nc1ccc(Br)cc1Cl	ZINC000090379213	185293579	/nfs/dbraw/zinc/29/35/79/185293579.db2.gz	IKFPSKSMKGYSNV-CBAPKCEASA-N	0	3	319.586	2.015	10	0		DEAEHN
C[C@H](NC(=O)[C@@H]1COC[C@@H]1N)c1ccc(Cl)c(Cl)c1	ZINC000090383678	185293848	/nfs/dbraw/zinc/29/38/48/185293848.db2.gz	XHWVUVWNIMSSPX-VMAXQDLPSA-N	0	3	303.189	2.144	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)N(C)Cc1ccc(Cl)c(Cl)c1	ZINC000090434556	185296244	/nfs/dbraw/zinc/29/62/44/185296244.db2.gz	NMMRCPIVAFGNPA-MFKMUULPSA-N	0	3	317.216	2.186	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1ccc2nc(SC)sc2c1	ZINC000090433007	185296284	/nfs/dbraw/zinc/29/62/84/185296284.db2.gz	YXPFUKYYRIFPKT-ONGXEEELSA-N	0	3	323.443	2.191	10	0		DEAEHN
C[C@@]1(C(=O)Nc2ccc(SC(F)F)cc2)COC[C@@H]1N	ZINC000090585428	185305192	/nfs/dbraw/zinc/30/51/92/185305192.db2.gz	IXXBDEMFALRKIZ-GXFFZTMASA-N	0	3	302.346	2.304	10	0		DEAEHN
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)[C@]1(C)COC[C@H]1N	ZINC000090590499	185305351	/nfs/dbraw/zinc/30/53/51/185305351.db2.gz	RGRYJIDMDZOHIN-TZMCWYRMSA-N	0	3	317.216	2.316	10	0		DEAEHN
C[C@]1(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)COC[C@H]1N	ZINC000090597733	185305711	/nfs/dbraw/zinc/30/57/11/185305711.db2.gz	GXZXBSXPKCZWQU-PWSUYJOCSA-N	0	3	306.259	2.147	10	0		DEAEHN
C[C@]1(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)COC[C@H]1N	ZINC000090599246	185305839	/nfs/dbraw/zinc/30/58/39/185305839.db2.gz	FRHSYZLNQRFVGS-MFKMUULPSA-N	0	3	320.723	2.244	10	0		DEAEHN
Cc1ccc(NC(=O)[C@]2(C)COC[C@H]2N)cc1Br	ZINC000090604361	185306124	/nfs/dbraw/zinc/30/61/24/185306124.db2.gz	TZDPEWYBLHCDHA-DGCLKSJQSA-N	0	3	313.195	2.060	10	0		DEAEHN
Cc1cc(C(=O)N2CCCSC[C@H]2CN2CCCCC2)no1	ZINC000090701633	185310706	/nfs/dbraw/zinc/31/07/06/185310706.db2.gz	JQHAQXWEFWODPB-CQSZACIVSA-N	0	3	323.462	2.417	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)Nc1nnc(C(F)F)s1	ZINC000092598962	185328385	/nfs/dbraw/zinc/32/83/85/185328385.db2.gz	INNBNZTXHOBOJN-JGVFFNPUSA-N	0	3	317.365	2.176	10	0		DEAEHN
Cc1sc(CN)cc1S(=O)(=O)NCC1C(C)(C)C1(C)C	ZINC000092833186	185344800	/nfs/dbraw/zinc/34/48/00/185344800.db2.gz	DNSBSUMKAAWQCQ-UHFFFAOYSA-N	0	3	316.492	2.476	10	0		DEAEHN
CNCc1cc(S(=O)(=O)NC2C(C)(C)C2(C)C)cs1	ZINC000092833269	185344839	/nfs/dbraw/zinc/34/48/39/185344839.db2.gz	KQOCLSFJAQHGCJ-UHFFFAOYSA-N	0	3	302.465	2.180	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)NCCN1CCC[C@H](C)C1	ZINC000186298389	282271937	/nfs/dbraw/zinc/27/19/37/282271937.db2.gz	MZLUWUGJKNTNTO-ZDUSSCGKSA-N	0	3	323.412	2.365	10	0		DEAEHN
COCC[C@@H](C)N[C@H](CO)c1cccc(Br)c1	ZINC000181390579	199288998	/nfs/dbraw/zinc/28/89/98/199288998.db2.gz	WJZITYMBTYEFID-ZWNOBZJWSA-N	0	3	302.212	2.497	10	0		DEAEHN
CNCc1sc2ccccc2c1S(=O)(=O)NC1(C)CC1	ZINC000168550375	197724679	/nfs/dbraw/zinc/72/46/79/197724679.db2.gz	HBQDUQMFEVEDJY-UHFFFAOYSA-N	0	3	310.444	2.452	10	0		DEAEHN
COC(=O)[C@@H](C)CN(Cc1ccccc1)C[C@H](O)CSC	ZINC000187805888	282290849	/nfs/dbraw/zinc/29/08/49/282290849.db2.gz	MGTNWLOZWRILAB-ZFWWWQNUSA-N	0	3	311.447	2.022	10	0		DEAEHN
CN(CCNC(=O)c1cn2ccnc2s1)Cc1ccccc1	ZINC000188359625	282298317	/nfs/dbraw/zinc/29/83/17/282298317.db2.gz	FHKDFRGVXZWBQB-UHFFFAOYSA-N	0	3	314.414	2.258	10	0		DEAEHN
CS[C@@H]1CN(C(=O)c2cc(C)[nH]c2C)C[C@@H]1N1CCCC1	ZINC000614279333	362337919	/nfs/dbraw/zinc/33/79/19/362337919.db2.gz	VBQZMBPXCWWLCG-LSDHHAIUSA-N	0	3	307.463	2.283	10	0		DEAEHN
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)c2ccon2)CC1	ZINC000328636630	530005132	/nfs/dbraw/zinc/00/51/32/530005132.db2.gz	ODVUCNUIHIIFKR-OAHLLOKOSA-N	0	3	314.389	2.196	10	0		DEAEHN
CN(Cc1cocn1)C1CCN(CCc2ccccn2)CC1	ZINC000191937744	530019179	/nfs/dbraw/zinc/01/91/79/530019179.db2.gz	YKUQUCJLAXTWDF-UHFFFAOYSA-N	0	3	300.406	2.209	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C(=O)OC)c1ccccc1F	ZINC000245471986	282390621	/nfs/dbraw/zinc/39/06/21/282390621.db2.gz	OLWAIXBNVUZIIA-CZUORRHYSA-N	0	3	308.397	2.456	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)c1cnn(CCC(F)(F)F)c1	ZINC000181847822	199361881	/nfs/dbraw/zinc/36/18/81/199361881.db2.gz	UPFSOYQMDPUXCN-GFCCVEGCSA-N	0	3	318.343	2.050	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2coc(-c3cccc(F)c3)n2)CCO1	ZINC000069969661	190844658	/nfs/dbraw/zinc/84/46/58/190844658.db2.gz	MBACVYBESRUKMJ-MRXNPFEDSA-N	0	3	319.380	2.243	10	0		DEAEHN
C[C@@H](NCCn1cncn1)c1cc(Br)cs1	ZINC000279808329	215165141	/nfs/dbraw/zinc/16/51/41/215165141.db2.gz	XBAOFFILNLDFQY-MRVPVSSYSA-N	0	3	301.213	2.453	10	0		DEAEHN
NC[C@@H]1OCCN(C2CC2)[C@@H]1c1ccc(Br)cc1	ZINC000070289182	190877715	/nfs/dbraw/zinc/87/77/15/190877715.db2.gz	TVLZLNGUSCQFER-UONOGXRCSA-N	0	3	311.223	2.312	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCN[C@H](c2ccc(F)cc2)C1	ZINC000616634546	362901631	/nfs/dbraw/zinc/90/16/31/362901631.db2.gz	VCAWLLAISCPKDR-HNNXBMFYSA-N	0	3	323.412	2.297	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)c2coc(Br)c2)CN1C1CC1	ZINC000177185270	539629519	/nfs/dbraw/zinc/62/95/19/539629519.db2.gz	PYCPSSTWRRXZDF-PSASIEDQSA-N	0	3	313.195	2.397	10	0		DEAEHN
CCc1nn(C)cc1CN1CCC(c2nnc3ccccn32)CC1	ZINC000179611792	539641774	/nfs/dbraw/zinc/64/17/74/539641774.db2.gz	YQIBEKCXIJSOJN-UHFFFAOYSA-N	0	3	324.432	2.405	10	0		DEAEHN
C[C@@H](NS(=O)(=O)c1cccc([C@H](C)N)c1)c1nccs1	ZINC000080343706	192149845	/nfs/dbraw/zinc/14/98/45/192149845.db2.gz	CAUSGIGIURQSAH-VHSXEESVSA-N	0	3	311.432	2.202	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cccc(N3CCCC3=O)c2)C1	ZINC000194640232	539718793	/nfs/dbraw/zinc/71/87/93/539718793.db2.gz	OSWGGZPCQQLPGX-OAHLLOKOSA-N	0	3	315.417	2.028	10	0		DEAEHN
N[C@@H](C[S@](=O)c1cccs1)c1ccc2c(c1)OCCO2	ZINC000084030528	192396593	/nfs/dbraw/zinc/39/65/93/192396593.db2.gz	ZZHCSZPSVCSUHK-PRWKNARSSA-N	0	3	309.412	2.327	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N(C)[C@H](C)C2CC2)c1	ZINC000138517176	186017862	/nfs/dbraw/zinc/01/78/62/186017862.db2.gz	YBXDTLLALLITNX-SECBINFHSA-N	0	3	318.389	2.103	10	0		DEAEHN
CCC(CC)N(C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138528137	186017990	/nfs/dbraw/zinc/01/79/90/186017990.db2.gz	MSXKGLKQENYDGH-UHFFFAOYSA-N	0	3	306.378	2.233	10	0		DEAEHN
CCNCc1cc(F)c(F)c(S(=O)(=O)N(C)C2CCC2)c1	ZINC000139328286	186021501	/nfs/dbraw/zinc/02/15/01/186021501.db2.gz	LEEUZHXWMRQBHA-UHFFFAOYSA-N	0	3	318.389	2.247	10	0		DEAEHN
CN[C@H](Cc1cnccc1N)c1ncccc1Br	ZINC000140423538	186027139	/nfs/dbraw/zinc/02/71/39/186027139.db2.gz	LUBCLANXWWLJIA-GFCCVEGCSA-N	0	3	307.195	2.325	10	0		DEAEHN
CCc1ccc(S(=O)(=O)NCC(F)F)cc1CNC(C)C	ZINC000148191960	186044138	/nfs/dbraw/zinc/04/41/38/186044138.db2.gz	APOKCFRPVPMQTK-UHFFFAOYSA-N	0	3	320.405	2.290	10	0		DEAEHN
Cc1ccc([C@@H]2NCC(=O)N2[C@H](CC(C)C)CN(C)C)s1	ZINC000143962542	186034097	/nfs/dbraw/zinc/03/40/97/186034097.db2.gz	CCMQFIGKVRXNBI-CZUORRHYSA-N	0	3	309.479	2.463	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2cccs2)N(C[C@@H]2CCCCN2C)C1=O	ZINC000144354233	186035371	/nfs/dbraw/zinc/03/53/71/186035371.db2.gz	QYZDKKKYHJEZHD-KCQAQPDRSA-N	0	3	307.463	2.441	10	0		DEAEHN
CC[C@H](C)[C@@H]1N[C@@H](c2ccsc2)N([C@@H]2CCN(C)C2)C1=O	ZINC000145196772	186036445	/nfs/dbraw/zinc/03/64/45/186036445.db2.gz	SFXREVJMDSHKBF-PMOUVXMZSA-N	0	3	307.463	2.297	10	0		DEAEHN
CC(C)(C)c1nc2ccc(NC(=O)[C@@H]3C[C@H](O)CN3)cc2s1	ZINC000155659736	186100509	/nfs/dbraw/zinc/10/05/09/186100509.db2.gz	HVXFZFWBLBVGQK-JQWIXIFHSA-N	0	3	319.430	2.255	10	0		DEAEHN
COc1c(F)cc(NC(=O)N2CCN3CCC[C@H]3C2)cc1F	ZINC000171891107	198001794	/nfs/dbraw/zinc/00/17/94/198001794.db2.gz	UFCLRGGXULMQOV-NSHDSACASA-N	0	3	311.332	2.285	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)[C@@H]1Cc2ccccc2O1)c1ccccc1	ZINC000171888322	198001905	/nfs/dbraw/zinc/00/19/05/198001905.db2.gz	RXYJCCOGCNKCQN-AEFFLSMTSA-N	0	3	310.397	2.409	10	0		DEAEHN
CCOc1ccccc1CNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171903838	198004884	/nfs/dbraw/zinc/00/48/84/198004884.db2.gz	KFYVXPRZLCNSSF-OAHLLOKOSA-N	0	3	303.406	2.075	10	0		DEAEHN
CC1CCC(N2CCN(Cc3nnc(C4CC4)n3C)CC2)CC1	ZINC000172011211	198025525	/nfs/dbraw/zinc/02/55/25/198025525.db2.gz	XLBBLEOKHVIFHH-UHFFFAOYSA-N	0	3	317.481	2.389	10	0		DEAEHN
CSc1ccc(O[C@H](C)C(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000172605220	198123125	/nfs/dbraw/zinc/12/31/25/198123125.db2.gz	RCVHAWMMMMHXKC-ZIAGYGMSSA-N	0	3	320.458	2.482	10	0		DEAEHN
CCc1cnc(CNC(=O)NCCN2CCCC[C@H]2C)s1	ZINC000080623299	192174101	/nfs/dbraw/zinc/17/41/01/192174101.db2.gz	KDTZDHGKDNFDME-GFCCVEGCSA-N	0	3	310.467	2.379	10	0		DEAEHN
O=C(CCN1CCN2CCCC[C@@H]2C1)Nc1cccc(F)c1	ZINC000172800602	198150728	/nfs/dbraw/zinc/15/07/28/198150728.db2.gz	NLFZYVGFGAYEPV-MRXNPFEDSA-N	0	3	305.397	2.324	10	0		DEAEHN
COc1ccc(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1	ZINC000173189941	198193303	/nfs/dbraw/zinc/19/33/03/198193303.db2.gz	POTFUWOQRXJPBM-HIFRSBDPSA-N	0	3	305.422	2.319	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)c(C)s1	ZINC000173245677	198200748	/nfs/dbraw/zinc/20/07/48/198200748.db2.gz	SPUVLASLFMNOOO-GWCFXTLKSA-N	0	3	316.492	2.326	10	0		DEAEHN
O=C(NCc1ccc(Cl)cc1)N1CC[C@@H](N2CC=CC2)C1	ZINC000173227760	198198246	/nfs/dbraw/zinc/19/82/46/198198246.db2.gz	HVANPFXXTMTFFK-OAHLLOKOSA-N	0	3	305.809	2.496	10	0		DEAEHN
O=C(Nc1ccc2c(c1)CNC2)N1CC[C@@]2(O)CCCC[C@H]2C1	ZINC000333099097	539948726	/nfs/dbraw/zinc/94/87/26/539948726.db2.gz	ANKQPHJAYXNYHK-YJBOKZPZSA-N	0	3	315.417	2.449	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCCc2cccc(F)c2)CCN1C	ZINC000173541725	198225711	/nfs/dbraw/zinc/22/57/11/198225711.db2.gz	HOULPRGPKIUSMX-BBRMVZONSA-N	0	3	307.413	2.492	10	0		DEAEHN
CCOc1cccc(CNC(=O)N2CC[C@H](N3CC=CC3)C2)c1	ZINC000173767724	198250076	/nfs/dbraw/zinc/25/00/76/198250076.db2.gz	DCVHQCDXBKFNIF-INIZCTEOSA-N	0	3	315.417	2.241	10	0		DEAEHN
CCc1ccc(CNC(=O)N2CC[C@H](N3CC=CC3)C2)s1	ZINC000173955921	198273079	/nfs/dbraw/zinc/27/30/79/198273079.db2.gz	RCAWDRSTQCRVIO-ZDUSSCGKSA-N	0	3	305.447	2.466	10	0		DEAEHN
O=C(NCc1cccc2cccnc21)N1CC[C@@H](N2CC=CC2)C1	ZINC000174422444	198333030	/nfs/dbraw/zinc/33/30/30/198333030.db2.gz	XFOCZGZGMCSTIY-QGZVFWFLSA-N	0	3	322.412	2.391	10	0		DEAEHN
Cc1ccccc1O[C@@H](C)CNC(=O)NC[C@@H]1CCCN1C	ZINC000174352764	198322984	/nfs/dbraw/zinc/32/29/84/198322984.db2.gz	DEWKVQBOAPXVKL-GJZGRUSLSA-N	0	3	305.422	2.156	10	0		DEAEHN
Cc1ccccc1O[C@H](C)CNC(=O)NC[C@@H]1CCCN1C	ZINC000174352774	198323477	/nfs/dbraw/zinc/32/34/77/198323477.db2.gz	DEWKVQBOAPXVKL-CABCVRRESA-N	0	3	305.422	2.156	10	0		DEAEHN
Cc1ccc([C@H](O)CN2CCCN(c3cccnn3)CC2)cc1	ZINC000174780893	198384441	/nfs/dbraw/zinc/38/44/41/198384441.db2.gz	IXFJVRRAEIYGKC-QGZVFWFLSA-N	0	3	312.417	2.031	10	0		DEAEHN
CCCOc1ccc(C(=O)CCC(=O)N2CCC[C@@H]2CN)cc1	ZINC000236786688	202007323	/nfs/dbraw/zinc/00/73/23/202007323.db2.gz	QWMMQTBMDCBKCU-OAHLLOKOSA-N	0	3	318.417	2.388	10	0		DEAEHN
CC(C)CN1CCN(CC(=O)N[C@H](C)c2ccc(F)cc2)CC1	ZINC000049970048	354364754	/nfs/dbraw/zinc/36/47/54/354364754.db2.gz	LTTDLJLXCRGBLH-OAHLLOKOSA-N	0	3	321.440	2.277	10	0		DEAEHN
CCCN(C[C@H]1CCCCO1)C(=O)NC[C@H]1CCCN1CC	ZINC000074493020	355032707	/nfs/dbraw/zinc/03/27/07/355032707.db2.gz	ATNMSHZLEDWKNC-HZPDHXFCSA-N	0	3	311.470	2.461	10	0		DEAEHN
CCOC(=O)Cc1[nH]c(=O)sc1CN1[C@@H](C)CCC[C@@H]1C	ZINC000075231847	191447266	/nfs/dbraw/zinc/44/72/66/191447266.db2.gz	YXVQTUOTCNERRA-QWRGUYRKSA-N	0	3	312.435	2.305	10	0		DEAEHN
C[C@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](CN)C(F)(F)F	ZINC000401705865	540141437	/nfs/dbraw/zinc/14/14/37/540141437.db2.gz	DNOWNKJARZZPHR-XVKPBYJWSA-N	0	3	310.703	2.113	10	0		DEAEHN
CC1CCN(C(=O)CN[C@]2(CO)C[C@@H](C)CC(C)(C)C2)CC1	ZINC000080903334	355391612	/nfs/dbraw/zinc/39/16/12/355391612.db2.gz	CSUOSHIGYPTWOI-MAUKXSAKSA-N	0	3	310.482	2.412	10	0		DEAEHN
Cc1ccc2nc(C(=O)NCCN3CCCC[C@@H]3C)cn2c1	ZINC000097939161	355705978	/nfs/dbraw/zinc/70/59/78/355705978.db2.gz	XEDNDFKMQXHACP-AWEZNQCLSA-N	0	3	300.406	2.247	10	0		DEAEHN
CSCCCC(=O)NCc1cccc(OCCN(C)C)c1	ZINC000134785641	355861558	/nfs/dbraw/zinc/86/15/58/355861558.db2.gz	HAZYLNLJAWFITA-UHFFFAOYSA-N	0	3	310.463	2.386	10	0		DEAEHN
CNC(=O)N1CCC([C@H]2CCN(Cc3ccncc3F)C2)CC1	ZINC000169781624	355982899	/nfs/dbraw/zinc/98/28/99/355982899.db2.gz	PKMBVVUVQWFJFV-AWEZNQCLSA-N	0	3	320.412	2.094	10	0		DEAEHN
C[C@H](CN[C@H]1CCCS(=O)(=O)C1)c1ccc(F)cc1F	ZINC000183051607	356158181	/nfs/dbraw/zinc/15/81/81/356158181.db2.gz	ZIYMKMLFKBAZDY-PWSUYJOCSA-N	0	3	303.374	2.235	10	0		DEAEHN
CNCc1ccn(CCOc2cccc(Br)c2)n1	ZINC000080093814	192000872	/nfs/dbraw/zinc/00/08/72/192000872.db2.gz	VOAMLZFWLCDEII-UHFFFAOYSA-N	0	3	310.195	2.444	10	0		DEAEHN
CCN(Cc1ccccc1)[C@H](CN)CNC(=O)OC(C)(C)C	ZINC000226184785	356278293	/nfs/dbraw/zinc/27/82/93/356278293.db2.gz	BYAKMJGLGHPATI-OAHLLOKOSA-N	0	3	307.438	2.361	10	0		DEAEHN
NCc1ncc(OC(F)(F)F)cc1I	ZINC000238609471	356304447	/nfs/dbraw/zinc/30/44/47/356304447.db2.gz	MQOQBUWKDDGYMA-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
NCc1cc(OC(F)(F)F)cc(I)n1	ZINC000238675159	356305025	/nfs/dbraw/zinc/30/50/25/356305025.db2.gz	ZDPRTWGXHALHBP-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
C[C@H]1CO[C@@H](c2ccccc2)CN1C(=O)C1CCN(C)CC1	ZINC000081329985	192251359	/nfs/dbraw/zinc/25/13/59/192251359.db2.gz	KYGIWCHVVZYMBM-WMLDXEAASA-N	0	3	302.418	2.317	10	0		DEAEHN
CCO[C@H](C)c1nc(CN(C)C(=O)C2(N)CCCC2)cs1	ZINC000236922664	202072893	/nfs/dbraw/zinc/07/28/93/202072893.db2.gz	IZCLUXSEBQOVSC-LLVKDONJSA-N	0	3	311.451	2.471	10	0		DEAEHN
CCCCN(C)S(=O)(=O)c1cc(CNCC)ccc1F	ZINC000088915691	192656184	/nfs/dbraw/zinc/65/61/84/192656184.db2.gz	RSENZNDDXZNGED-UHFFFAOYSA-N	0	3	302.415	2.356	10	0		DEAEHN
O[C@H](COC[C@H]1CCCO1)CN1CC[C@@H](c2ccccc2F)C1	ZINC000582015117	357286671	/nfs/dbraw/zinc/28/66/71/357286671.db2.gz	HZRGVXUKNLROAX-OWCLPIDISA-N	0	3	323.408	2.172	10	0		DEAEHN
C[C@@H]1CCC[C@@H](N(C)S(=O)(=O)c2cc(CN)ccc2F)C1	ZINC000088995853	192687914	/nfs/dbraw/zinc/68/79/14/192687914.db2.gz	QHHYIXPDZMDKFN-DGCLKSJQSA-N	0	3	314.426	2.484	10	0		DEAEHN
c1cnc(N2CCC[C@@H](NCc3n[nH]c4ccccc34)C2)nc1	ZINC000589641631	357485949	/nfs/dbraw/zinc/48/59/49/357485949.db2.gz	UXHJSILWHUXXKX-CYBMUJFWSA-N	0	3	308.389	2.112	10	0		DEAEHN
c1cnc(N2CCC[C@@H](NCc3[nH]nc4ccccc43)C2)nc1	ZINC000589641631	357485953	/nfs/dbraw/zinc/48/59/53/357485953.db2.gz	UXHJSILWHUXXKX-CYBMUJFWSA-N	0	3	308.389	2.112	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCCCOc1ccccc1OC	ZINC000591213323	357690996	/nfs/dbraw/zinc/69/09/96/357690996.db2.gz	QKYBPXBYPFCAIV-HNNXBMFYSA-N	0	3	320.433	2.455	10	0		DEAEHN
C[C@H](O)C[C@H](C)CNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179486801	199044431	/nfs/dbraw/zinc/04/44/31/199044431.db2.gz	NFXNBXDIESAEOB-XJNFMUPTSA-N	0	3	319.449	2.138	10	0		DEAEHN
Cn1cc([C@@H]2CCN(Cc3cn(C)nc3C(C)(C)C)C2)cn1	ZINC000180331770	199146182	/nfs/dbraw/zinc/14/61/82/199146182.db2.gz	IRYVENLXWXCIQQ-CYBMUJFWSA-N	0	3	301.438	2.441	10	0		DEAEHN
C[C@@H](N[C@H]1CCc2ncnn2C1)c1cnn(Cc2ccccc2)c1	ZINC000180580984	199179968	/nfs/dbraw/zinc/17/99/68/199179968.db2.gz	OPILHUJNVBVQDW-PBHICJAKSA-N	0	3	322.416	2.189	10	0		DEAEHN
Cc1nccn1-c1ccc([C@@H](C)N[C@H]2CCc3ncnn3C2)cc1	ZINC000180589381	199180569	/nfs/dbraw/zinc/18/05/69/199180569.db2.gz	WKOHCONEJQIXMF-CJNGLKHVSA-N	0	3	322.416	2.438	10	0		DEAEHN
COc1cc(C)c(NC(=O)N2CCN3CCC[C@H]3C2)cc1F	ZINC000186736578	200000327	/nfs/dbraw/zinc/00/03/27/200000327.db2.gz	PZPNXQVJJVCAHR-LBPRGKRZSA-N	0	3	307.369	2.455	10	0		DEAEHN
CCN(CCO)CCNC(=O)N[C@H]1CC[C@H](C)c2ccccc21	ZINC000187380900	200103949	/nfs/dbraw/zinc/10/39/49/200103949.db2.gz	KADICSSBIJCDOD-YOEHRIQHSA-N	0	3	319.449	2.238	10	0		DEAEHN
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NCC[C@@H](C)O	ZINC000187480162	200117327	/nfs/dbraw/zinc/11/73/27/200117327.db2.gz	FJFLDPXGYITATH-NVXWUHKLSA-N	0	3	321.465	2.213	10	0		DEAEHN
CN(C)CCn1cc(NC(=O)c2c[nH]c(-c3ccccc3)n2)cn1	ZINC000605505717	360972986	/nfs/dbraw/zinc/97/29/86/360972986.db2.gz	JQUXFXWMGRNVKN-UHFFFAOYSA-N	0	3	324.388	2.087	10	0		DEAEHN
COc1cc(CN(C)CCOC[C@@H]2CCCO2)cc(OC)c1	ZINC000607357150	361083616	/nfs/dbraw/zinc/08/36/16/361083616.db2.gz	STYJJPLSYNIECG-HNNXBMFYSA-N	0	3	309.406	2.331	10	0		DEAEHN
CCCN(C)CC(=O)N[C@@H](Cc1nccn1C)c1ccccc1	ZINC000608207489	361184589	/nfs/dbraw/zinc/18/45/89/361184589.db2.gz	HDJNRTOVJJOFLB-INIZCTEOSA-N	0	3	314.433	2.162	10	0		DEAEHN
CCN(CC)CC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000610825899	361474141	/nfs/dbraw/zinc/47/41/41/361474141.db2.gz	RYXGRJHIRBGYCM-INIZCTEOSA-N	0	3	320.433	2.385	10	0		DEAEHN
COC[C@@H](NC[C@H](C)N1CCOCC1)c1ccc(Cl)cc1	ZINC000193957503	201153644	/nfs/dbraw/zinc/15/36/44/201153644.db2.gz	INGMWVPMQDUHKV-XJKSGUPXSA-N	0	3	312.841	2.338	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1nc2cccnc2s1	ZINC000193969408	201155131	/nfs/dbraw/zinc/15/51/31/201155131.db2.gz	AQXOCBKOCQDECB-VXGBXAGGSA-N	0	3	316.430	2.390	10	0		DEAEHN
Cc1ccc([C@@H](O)CNC(=O)N[C@H](CC(C)C)CN(C)C)cc1	ZINC000194191016	201195857	/nfs/dbraw/zinc/19/58/57/201195857.db2.gz	BNYPVMCCKPQVRB-SJORKVTESA-N	0	3	321.465	2.304	10	0		DEAEHN
CN1CC[C@@H](NC(=O)C2CCC(O)CC2)[C@@H]1c1ccccc1	ZINC000194526535	201244968	/nfs/dbraw/zinc/24/49/68/201244968.db2.gz	NOZBTFZSKBFZNQ-BACDZXNISA-N	0	3	302.418	2.099	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC(O)(c2ccccc2)CC1	ZINC000195219089	201361969	/nfs/dbraw/zinc/36/19/69/201361969.db2.gz	CHAGMDSPEMNHCZ-QGZVFWFLSA-N	0	3	307.434	2.148	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H](C)c1ccc2c(c1)CCC(=O)N2)N(C)C	ZINC000178657124	283791451	/nfs/dbraw/zinc/79/14/51/283791451.db2.gz	XIZUAXIDAKXSIX-MLGOLLRUSA-N	0	3	317.433	2.479	10	0		DEAEHN
O[C@H]1COCC[C@H]1NCc1ccc(Cl)c(Br)c1	ZINC000623767607	365168411	/nfs/dbraw/zinc/16/84/11/365168411.db2.gz	YPZVDADFYSRYRJ-NEPJUHHUSA-N	0	3	320.614	2.342	10	0		DEAEHN
O=C(C[C@@H]1CNCCO1)Nc1nc2ccc(Cl)cc2s1	ZINC000091298924	193034503	/nfs/dbraw/zinc/03/45/03/193034503.db2.gz	YAJGKUIYIHHEKQ-SECBINFHSA-N	0	3	311.794	2.267	10	0		DEAEHN
Cc1cc([C@H](CN)N2CCO[C@H](C)C2)ccc1Br	ZINC000091470390	193060367	/nfs/dbraw/zinc/06/03/67/193060367.db2.gz	ZUCCVANDDJHKKB-RISCZKNCSA-N	0	3	313.239	2.478	10	0		DEAEHN
C[C@@H](NC[C@H]1COCCN1C)c1ccccc1Br	ZINC000624172812	365317780	/nfs/dbraw/zinc/31/77/80/365317780.db2.gz	VBDPQNODYWZXBV-NEPJUHHUSA-N	0	3	313.239	2.430	10	0		DEAEHN
C[C@@H]1CN(S(=O)(=O)c2ccc(CNC(C)(C)C)o2)C[C@H]1C	ZINC000092113111	193160821	/nfs/dbraw/zinc/16/08/21/193160821.db2.gz	OGHKTYCSLBXDJT-VXGBXAGGSA-N	0	3	314.451	2.444	10	0		DEAEHN
CCCN(CC)S(=O)(=O)c1ccc(CNCC)cc1F	ZINC000092115602	193163688	/nfs/dbraw/zinc/16/36/88/193163688.db2.gz	VCYNTLJUNPIGHH-UHFFFAOYSA-N	0	3	302.415	2.356	10	0		DEAEHN
CC(C)NCc1ccc(S(=O)(=O)N2CC[C@H](C)C2)c(F)c1	ZINC000092115856	193164564	/nfs/dbraw/zinc/16/45/64/193164564.db2.gz	WVFURVKGCFYGHW-LBPRGKRZSA-N	0	3	314.426	2.354	10	0		DEAEHN
COc1cc(CNCC[C@H](O)C(F)F)cc(Cl)c1OC	ZINC000631220401	368086489	/nfs/dbraw/zinc/08/64/89/368086489.db2.gz	XPYKSZXUTGLJBP-JTQLQIEISA-N	0	3	309.740	2.463	10	0		DEAEHN
CC[C@@H](C(N)=S)N1CCN(CCSc2ccccc2)CC1	ZINC000092261138	193181830	/nfs/dbraw/zinc/18/18/30/193181830.db2.gz	UVRGITZFZAJDBT-HNNXBMFYSA-N	0	3	323.531	2.461	10	0		DEAEHN
O=C(N[C@@H]1CCOc2ccc(F)cc21)N1CCN2CCC[C@@H]2C1	ZINC000171908134	284081788	/nfs/dbraw/zinc/08/17/88/284081788.db2.gz	YZEQHOMVXJTFHL-UKRRQHHQSA-N	0	3	319.380	2.139	10	0		DEAEHN
O=C(N[C@@H]1CCOc2ccccc21)N1CC[C@H](N2CCCC2)C1	ZINC000066174549	284083607	/nfs/dbraw/zinc/08/36/07/284083607.db2.gz	CCSSIHOKHAXTDC-GOEBONIOSA-N	0	3	315.417	2.390	10	0		DEAEHN
CN(CC(C)(C)O)c1nc2sccn2c1CNC(C)(C)C	ZINC000092971023	193190890	/nfs/dbraw/zinc/19/08/90/193190890.db2.gz	NGWCJDOHIXXAGM-UHFFFAOYSA-N	0	3	310.467	2.491	10	0		DEAEHN
COCCCN(C)c1nc(C(C)C)c(CNCCOC)s1	ZINC000093000272	193192283	/nfs/dbraw/zinc/19/22/83/193192283.db2.gz	HVGAFBNBAMDMSA-UHFFFAOYSA-N	0	3	315.483	2.475	10	0		DEAEHN
CNCc1sc(N(CCCOC)CCOC)nc1C(C)C	ZINC000093000001	193192140	/nfs/dbraw/zinc/19/21/40/193192140.db2.gz	CLCRHMJPXQVBDY-UHFFFAOYSA-N	0	3	315.483	2.475	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2sc3cccc(F)c3c2N)C1	ZINC000093412226	193245837	/nfs/dbraw/zinc/24/58/37/193245837.db2.gz	MERAVZHLXNMENQ-SECBINFHSA-N	0	3	307.394	2.399	10	0		DEAEHN
NC(=O)[C@@]1(N)CCC[C@@H]1CCSc1cc(F)ccc1F	ZINC000093629593	193276628	/nfs/dbraw/zinc/27/66/28/193276628.db2.gz	CEOKZPRFLFASDL-YMTOWFKASA-N	0	3	300.374	2.430	10	0		DEAEHN
CC[C@H](CO)N1CCN(Cc2cc(C)c(OC)c(C)c2)CC1	ZINC000093739938	193297855	/nfs/dbraw/zinc/29/78/55/193297855.db2.gz	LYYNFDLKBGUDHC-QGZVFWFLSA-N	0	3	306.450	2.201	10	0		DEAEHN
CCOC(=O)[C@]1(NC)CCC[C@@H](N(C)CCC(F)(F)F)C1	ZINC000093756579	193300920	/nfs/dbraw/zinc/30/09/20/193300920.db2.gz	RCSDVJSNLJLJBI-YPMHNXCESA-N	0	3	310.360	2.335	10	0		DEAEHN
CCN[C@@]1(C(=O)OC)CCC[C@@H](N(C)CCC(F)(F)F)C1	ZINC000093756625	193302200	/nfs/dbraw/zinc/30/22/00/193302200.db2.gz	CTWYVPBSOZPPBL-YPMHNXCESA-N	0	3	310.360	2.335	10	0		DEAEHN
Cc1ccc2[nH]c(S[C@@H]3CCC[C@](N)(C(N)=O)C3)nc2c1	ZINC000093779492	193306433	/nfs/dbraw/zinc/30/64/33/193306433.db2.gz	JYPRALNDSKZNAM-MEBBXXQBSA-N	0	3	304.419	2.089	10	0		DEAEHN
Cc1ccc2nc(S[C@@H]3CCC[C@](N)(C(N)=O)C3)[nH]c2c1	ZINC000093779492	193306436	/nfs/dbraw/zinc/30/64/36/193306436.db2.gz	JYPRALNDSKZNAM-MEBBXXQBSA-N	0	3	304.419	2.089	10	0		DEAEHN
CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cnc[nH]2)C1	ZINC000093685001	193288315	/nfs/dbraw/zinc/28/83/15/193288315.db2.gz	DJPBSGIGQVHQFQ-LLVKDONJSA-N	0	3	318.343	2.033	10	0		DEAEHN
Cc1ccc(F)c(S(=O)(=O)[N-]C2C(C)(C)C([NH3+])C2(C)C)c1	ZINC000094006529	193338378	/nfs/dbraw/zinc/33/83/78/193338378.db2.gz	CKVBRQZXIJDZMH-UHFFFAOYSA-N	0	3	314.426	2.174	10	0		DEAEHN
CCOC(=O)[C@]1(N)CC[C@@H](N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000093831900	193315317	/nfs/dbraw/zinc/31/53/17/193315317.db2.gz	DEPLTBTXVPMNKF-LOWVWBTDSA-N	0	3	308.344	2.074	10	0		DEAEHN
NC(=O)[C@]1(N)CC[C@H](Sc2ccccc2Br)C1	ZINC000093849008	193317403	/nfs/dbraw/zinc/31/74/03/193317403.db2.gz	MYDLRLCXMAGURA-UFBFGSQYSA-N	0	3	315.236	2.277	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)cc1)N(C)CCS(C)(=O)=O	ZINC000094297103	193356647	/nfs/dbraw/zinc/35/66/47/193356647.db2.gz	YHXCGAPWAQZICU-ZIAGYGMSSA-N	0	3	318.870	2.095	10	0		DEAEHN
CCC(C)(C)NC(=O)[C@H](C)Oc1c(F)cc(CN)cc1F	ZINC000094346268	193363180	/nfs/dbraw/zinc/36/31/80/193363180.db2.gz	XIMKMOZREDASHD-VIFPVBQESA-N	0	3	300.349	2.496	10	0		DEAEHN
CCC(N)(CC)C(=O)Nc1cc(Cl)ccc1C(=O)N(C)C	ZINC000094243759	193354740	/nfs/dbraw/zinc/35/47/40/193354740.db2.gz	CBXPVYJDBLBJPZ-UHFFFAOYSA-N	0	3	311.813	2.498	10	0		DEAEHN
Cc1nn([C@@H]2CCC[C@H](S(C)(=O)=O)C2)cc1CNC(C)C	ZINC000094644431	193389955	/nfs/dbraw/zinc/38/99/55/193389955.db2.gz	FGXDWRAABQBJPV-CABCVRRESA-N	0	3	313.467	2.218	10	0		DEAEHN
CC(C)CNCc1cnn([C@H]2CCC[C@@H](S(C)(=O)=O)C2)c1	ZINC000094644016	193390022	/nfs/dbraw/zinc/39/00/22/193390022.db2.gz	HFRJEMRVSFBNHN-LSDHHAIUSA-N	0	3	313.467	2.157	10	0		DEAEHN
CNc1c(C(=O)N(C)CCN(C)C)cccc1C(F)(F)F	ZINC000094599125	193383316	/nfs/dbraw/zinc/38/33/16/193383316.db2.gz	NOHWAHBDQFZKDB-UHFFFAOYSA-N	0	3	303.328	2.381	10	0		DEAEHN
CCN[C@H](C)c1cc(F)ccc1O[C@@H]1CCS(=O)(=O)C1	ZINC000094618894	193385286	/nfs/dbraw/zinc/38/52/86/193385286.db2.gz	IHOJRYRMXQDDLJ-ZYHUDNBSSA-N	0	3	301.383	2.062	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2ccc(N(C)C)nc2)CCN1C	ZINC000266361451	205293693	/nfs/dbraw/zinc/29/36/93/205293693.db2.gz	JGLWMKHUFHBHGT-OCCSQVGLSA-N	0	3	305.426	2.094	10	0		DEAEHN
CN(C)CCCC(C)(C)NC(=O)C(=O)c1cnn(C(C)(C)C)c1	ZINC000456197659	247001329	/nfs/dbraw/zinc/00/13/29/247001329.db2.gz	IYYRXWUFQCKGIT-UHFFFAOYSA-N	0	3	322.453	2.057	10	0		DEAEHN
CO[C@H]1CCC[C@@H]1CNCc1c(Br)cnn1C	ZINC000487552140	248763771	/nfs/dbraw/zinc/76/37/71/248763771.db2.gz	WRSDMRCVAPPKRB-SKDRFNHKSA-N	0	3	302.216	2.087	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2ccc(SC(F)F)cc2)C1	ZINC000040632698	183111732	/nfs/dbraw/zinc/11/17/32/183111732.db2.gz	CLTZUFLCIYQZQE-GXSJLCMTSA-N	0	3	302.346	2.317	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2cc(Br)ccc2C)C1	ZINC000040633594	183111778	/nfs/dbraw/zinc/11/17/78/183111778.db2.gz	XXVXRRWKIDAVHI-JQWIXIFHSA-N	0	3	313.195	2.073	10	0		DEAEHN
CCOC(=O)C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCCC1	ZINC000040615575	183109507	/nfs/dbraw/zinc/10/95/07/183109507.db2.gz	CXEFHHWGMIVTTN-INIZCTEOSA-N	0	3	318.417	2.201	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2nc3ccc(Cl)cc3s2)C1	ZINC000040629926	183111171	/nfs/dbraw/zinc/11/11/71/183111171.db2.gz	GTHKXZBECWMHFH-WCBMZHEXSA-N	0	3	311.794	2.265	10	0		DEAEHN
CC(=O)Nc1ccc(NC(=O)C(C)(C)N)c(C(F)(F)F)c1	ZINC000040925596	183148836	/nfs/dbraw/zinc/14/88/36/183148836.db2.gz	HFCBGISYHQOVCO-UHFFFAOYSA-N	0	3	303.284	2.340	10	0		DEAEHN
CN(c1c2c(nc3ccccc31)CCC2)[C@@H]1CCS(=O)(=O)C1	ZINC000041477758	183193734	/nfs/dbraw/zinc/19/37/34/183193734.db2.gz	QJULYIINBQYKMO-GFCCVEGCSA-N	0	3	316.426	2.347	10	0		DEAEHN
Cc1ccc(C)c(CNCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000042307392	183252192	/nfs/dbraw/zinc/25/21/92/183252192.db2.gz	QBEGGCOZIZMRJW-UHFFFAOYSA-N	0	3	304.415	2.241	10	0		DEAEHN
CC(C)C[C@@H](C)N(C)S(=O)(=O)c1cccc2c1CCNC2	ZINC000042592568	183288651	/nfs/dbraw/zinc/28/86/51/183288651.db2.gz	NINPKRLOFYXGKY-CYBMUJFWSA-N	0	3	310.463	2.387	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccc(Cl)cc1)N(C)CC(=O)N1CCCC1	ZINC000042946063	183319580	/nfs/dbraw/zinc/31/95/80/183319580.db2.gz	OTAFUFTYPPSWEX-LRDDRELGSA-N	0	3	309.841	2.283	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1cccc(Cl)c1)N1CCC[C@@H]1C(=O)NC	ZINC000043015791	183327620	/nfs/dbraw/zinc/32/76/20/183327620.db2.gz	PHPNBFVCNLXAIM-RBSFLKMASA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@@H](N)[C@H](c1cccc(Cl)c1)N1CCCC[C@@H]1C(N)=O	ZINC000043015848	183327771	/nfs/dbraw/zinc/32/77/71/183327771.db2.gz	RVYCIOCETNYYOA-KFWWJZLASA-N	0	3	309.841	2.458	10	0		DEAEHN
NC[C@H](c1cccc(Br)c1)N1CCC[C@H](CO)C1	ZINC000043020890	183329705	/nfs/dbraw/zinc/32/97/05/183329705.db2.gz	QGRPHEKWOWAQHO-SMDDNHRTSA-N	0	3	313.239	2.153	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(C)s1)N1CCCC[C@@H]1C(=O)NC	ZINC000043242689	183347186	/nfs/dbraw/zinc/34/71/86/183347186.db2.gz	GJTYHUXKLARJDE-GZBFAFLISA-N	0	3	309.479	2.435	10	0		DEAEHN
CCNC(=O)CN(C)[C@H](c1ccc(Cl)s1)[C@@H](N)CC	ZINC000043253582	183347760	/nfs/dbraw/zinc/34/77/60/183347760.db2.gz	PRTYSPCWNVIKEY-ZANVPECISA-N	0	3	303.859	2.248	10	0		DEAEHN
C[C@@H](N)[C@H](c1cc(Br)cs1)N1CCOCC1	ZINC000043284354	183350731	/nfs/dbraw/zinc/35/07/31/183350731.db2.gz	IVFYRNSAYKRKLU-LDYMZIIASA-N	0	3	305.241	2.231	10	0		DEAEHN
COc1ccc2cc([C@@H](N)[C@H]3CCS(=O)(=O)C3)ccc2c1	ZINC000043299896	183351488	/nfs/dbraw/zinc/35/14/88/183351488.db2.gz	RSBUXWTYMDOQNO-GOEBONIOSA-N	0	3	305.399	2.283	10	0		DEAEHN
CCN1CCC[C@@H](Nc2nc3c(cc2C(N)=S)CCC3)C1	ZINC000043408861	183359450	/nfs/dbraw/zinc/35/94/50/183359450.db2.gz	YBQYJXITAKKDRI-GFCCVEGCSA-N	0	3	304.463	2.101	10	0		DEAEHN
CCN(CC)CC(=O)N1CCC[C@H](CC(=O)OC(C)(C)C)C1	ZINC000532379479	284687127	/nfs/dbraw/zinc/68/71/27/284687127.db2.gz	MSDSFZIRZQZBRL-CQSZACIVSA-N	0	3	312.454	2.299	10	0		DEAEHN
CO[C@H]1C[C@@H](CN(C)Cc2coc(-c3ccccc3)n2)N(C)C1	ZINC000284831141	218196124	/nfs/dbraw/zinc/19/61/24/218196124.db2.gz	OWOWKXRBUQMNCG-IRXDYDNUSA-N	0	3	315.417	2.493	10	0		DEAEHN
Cn1cc(CN2CCCN(Cc3cccc(F)c3)CC2)cn1	ZINC000105869311	194151450	/nfs/dbraw/zinc/15/14/50/194151450.db2.gz	GJZYUVZRCIHHGO-UHFFFAOYSA-N	0	3	302.397	2.267	10	0		DEAEHN
COc1cccc([C@H]2C[C@@H]2C(=O)N(C)C2CCN(C)CC2)c1	ZINC000106725414	194246555	/nfs/dbraw/zinc/24/65/55/194246555.db2.gz	KQMBJMKRIXUMID-SJORKVTESA-N	0	3	302.418	2.351	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1C(=O)c1ccc2cncn2c1	ZINC000285233518	218343687	/nfs/dbraw/zinc/34/36/87/218343687.db2.gz	KSPNGPIEUXMNCM-INIZCTEOSA-N	0	3	309.373	2.144	10	0		DEAEHN
CCC[C@@H](C(N)=S)N1CCN(CCOCCC(C)C)CC1	ZINC000109469957	194266430	/nfs/dbraw/zinc/26/64/30/194266430.db2.gz	CUEPYJSXTXOXGQ-HNNXBMFYSA-N	0	3	315.527	2.122	10	0		DEAEHN
COc1cc(C[NH2+][C@H]2CCCOC2)cc(Br)c1[O-]	ZINC000109543914	194272536	/nfs/dbraw/zinc/27/25/36/194272536.db2.gz	ZIJZKSMSLJVJBD-JTQLQIEISA-N	0	3	316.195	2.432	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@H]1SCCc2ccccc21	ZINC000534527796	284848239	/nfs/dbraw/zinc/84/82/39/284848239.db2.gz	VYGVUJBYLYTJCK-INIZCTEOSA-N	0	3	313.426	2.062	10	0		DEAEHN
C[NH2+][C@H](C)c1ccc(S(=O)(=O)[N-]c2ccncc2C)cc1	ZINC000111043914	194386076	/nfs/dbraw/zinc/38/60/76/194386076.db2.gz	RXXHAAOYVTVLFZ-GFCCVEGCSA-N	0	3	305.403	2.471	10	0		DEAEHN
CCOCCN(CC)S(=O)(=O)c1cccc([C@@H](N)CC)c1	ZINC000111125602	194393215	/nfs/dbraw/zinc/39/32/15/194393215.db2.gz	RSSVSKOYWSFHCN-HNNXBMFYSA-N	0	3	314.451	2.144	10	0		DEAEHN
CN(C)CCN(C)CC(=O)Nc1c(N)cc(Cl)cc1Cl	ZINC000111130144	194393247	/nfs/dbraw/zinc/39/32/47/194393247.db2.gz	VMVRMYTZZFBTQN-UHFFFAOYSA-N	0	3	319.236	2.008	10	0		DEAEHN
CN(C)CCN(C)CCNc1ccc(Br)cc1	ZINC000111150730	194396494	/nfs/dbraw/zinc/39/64/94/194396494.db2.gz	QPEBSMRQTMHFEY-UHFFFAOYSA-N	0	3	300.244	2.354	10	0		DEAEHN
CN(C[C@H]1CCCOC1)[C@@H](CN)c1cc(F)c(F)c(F)c1	ZINC000111158300	194397329	/nfs/dbraw/zinc/39/73/29/194397329.db2.gz	XFBQQRRTOBCBAS-YGRLFVJLSA-N	0	3	302.340	2.462	10	0		DEAEHN
CCN[C@H](Cc1ccc(C(F)(F)F)cc1)CS(C)(=O)=O	ZINC000060706161	184154504	/nfs/dbraw/zinc/15/45/04/184154504.db2.gz	OWCVQDGMNLATNO-GFCCVEGCSA-N	0	3	309.353	2.271	10	0		DEAEHN
CC[C@@H](Oc1ccc(Br)cc1[C@H](C)NC)C(N)=O	ZINC000061676075	184181808	/nfs/dbraw/zinc/18/18/08/184181808.db2.gz	BJXHBNBKGDMTNX-GZMMTYOYSA-N	0	3	315.211	2.372	10	0		DEAEHN
Cc1nc(N2CCN(CC(F)(F)F)CC2)sc1[C@@H](C)N	ZINC000061948528	184197825	/nfs/dbraw/zinc/19/78/25/184197825.db2.gz	FMTVJXLDBQKLGE-MRVPVSSYSA-N	0	3	308.373	2.156	10	0		DEAEHN
OC[C@@]1(Nc2cccc(Br)c2)CCN(C2CC2)C1	ZINC000061992156	184199652	/nfs/dbraw/zinc/19/96/52/184199652.db2.gz	KRRLEJPUJLDFNO-CQSZACIVSA-N	0	3	311.223	2.460	10	0		DEAEHN
CN(CCNC(=O)c1ccc(N)c(C(F)(F)F)c1)C1CC1	ZINC000062011857	184201139	/nfs/dbraw/zinc/20/11/39/184201139.db2.gz	GGFPAWMGHFKABB-UHFFFAOYSA-N	0	3	301.312	2.112	10	0		DEAEHN
CCN[C@@H](c1cc(F)c(F)c(F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000062706587	184248726	/nfs/dbraw/zinc/24/87/26/184248726.db2.gz	JKSPIBOJCFZYAP-ISVAXAHUSA-N	0	3	307.337	2.189	10	0		DEAEHN
COCCNCc1c(N2CCC[C@H](C)C2)nc2sccn12	ZINC000062734354	184251407	/nfs/dbraw/zinc/25/14/07/184251407.db2.gz	CVZYUSZFLFHHRS-LBPRGKRZSA-N	0	3	308.451	2.368	10	0		DEAEHN
COCCNCc1c(N2CCC[C@@H](C)C2)nc2sccn12	ZINC000062734353	184251440	/nfs/dbraw/zinc/25/14/40/184251440.db2.gz	CVZYUSZFLFHHRS-GFCCVEGCSA-N	0	3	308.451	2.368	10	0		DEAEHN
CCN[C@H](CCSc1ccc(Br)cc1)C(N)=O	ZINC000062596945	184244833	/nfs/dbraw/zinc/24/48/33/184244833.db2.gz	VXWZNFFIKUPYBI-LLVKDONJSA-N	0	3	317.252	2.395	10	0		DEAEHN
CN[C@H](CCSc1cccc(Br)c1)C(N)=O	ZINC000062604246	184244969	/nfs/dbraw/zinc/24/49/69/184244969.db2.gz	IXOXQBJTYOUDSJ-SNVBAGLBSA-N	0	3	303.225	2.005	10	0		DEAEHN
CCc1nn(C)c(CNCCCCOCCOC)c1Cl	ZINC000159112710	197328631	/nfs/dbraw/zinc/32/86/31/197328631.db2.gz	GCTCJLMZTAZWEM-UHFFFAOYSA-N	0	3	303.834	2.169	10	0		DEAEHN
CCNCC(=O)Nc1cccc(C(=O)N2CCC(C)CC2)c1	ZINC000066225774	184397930	/nfs/dbraw/zinc/39/79/30/184397930.db2.gz	FSCWGLGCYWSZJW-UHFFFAOYSA-N	0	3	303.406	2.107	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H](CCO)C2CCCCC2)C1	ZINC000137209409	207357565	/nfs/dbraw/zinc/35/75/65/207357565.db2.gz	RMSFBNJZWHOOLP-CVEARBPZSA-N	0	3	311.470	2.101	10	0		DEAEHN
CCN(CC)CC(=O)NC1(c2noc(C3CC3)n2)CCCC1	ZINC000175706972	207362475	/nfs/dbraw/zinc/36/24/75/207362475.db2.gz	IYUBEMCUKULPGY-UHFFFAOYSA-N	0	3	306.410	2.174	10	0		DEAEHN
CC(C)NC(=O)CCN1CCC(O)(Cc2cccc(F)c2)CC1	ZINC000186926723	207368887	/nfs/dbraw/zinc/36/88/87/207368887.db2.gz	GJVMTAUKLPFGKB-UHFFFAOYSA-N	0	3	322.424	2.110	10	0		DEAEHN
Brc1ccc(CN[C@H]2CCO[C@]3(CCOC3)C2)o1	ZINC000365154438	207404166	/nfs/dbraw/zinc/40/41/66/207404166.db2.gz	GLXUEYHRFAYHPD-GXFFZTMASA-N	0	3	316.195	2.470	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@@H]1CCCCC1(C)C	ZINC000150887164	285035164	/nfs/dbraw/zinc/03/51/64/285035164.db2.gz	VSURTZWEGWKBMH-LSDHHAIUSA-N	0	3	311.470	2.365	10	0		DEAEHN
Cc1c(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cnn1CC(C)C	ZINC000119799238	195039686	/nfs/dbraw/zinc/03/96/86/195039686.db2.gz	ZHUGJWAPEPIQQR-XJKSGUPXSA-N	0	3	306.454	2.306	10	0		DEAEHN
C[C@H](N[C@@H]1CCN(c2ncccc2Cl)C1)c1cnn(C)c1	ZINC000119967824	195072195	/nfs/dbraw/zinc/07/21/95/195072195.db2.gz	WQEGHWMUNACSAU-WCQYABFASA-N	0	3	305.813	2.398	10	0		DEAEHN
C[C@@H]1CN[C@@](C)(c2ccccc2)CN1C1CCS(=O)CC1	ZINC000159207102	197335809	/nfs/dbraw/zinc/33/58/09/197335809.db2.gz	HEJJNXQGGIEEJR-OOYBUDEJSA-N	0	3	306.475	2.107	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCC[C@@H]2C(C)C)cc(CN)c1F	ZINC000159123729	197329341	/nfs/dbraw/zinc/32/93/41/197329341.db2.gz	HPNUPNHDQWYDHJ-CQSZACIVSA-N	0	3	314.426	2.402	10	0		DEAEHN
O[C@H](CNc1c(F)c(F)c(F)c(F)c1F)CN1CCCC1	ZINC000158882350	197307958	/nfs/dbraw/zinc/30/79/58/197307958.db2.gz	MCUVQSFOXRGKEL-SSDOTTSWSA-N	0	3	310.266	2.251	10	0		DEAEHN
COc1csc([C@@H](O)c2c(Cl)cnn2CCN(C)C)c1	ZINC000158668495	197292591	/nfs/dbraw/zinc/29/25/91/197292591.db2.gz	PMEHPXMNKSPROT-CYBMUJFWSA-N	0	3	315.826	2.250	10	0		DEAEHN
CCn1ncc(Br)c1[C@H](C[C@H]1CCCO1)NC	ZINC000158642755	197290874	/nfs/dbraw/zinc/29/08/74/197290874.db2.gz	CCLYVZPKIDGKAX-KOLCDFICSA-N	0	3	302.216	2.495	10	0		DEAEHN
CC1(C)CN(C[C@H](O)c2ccc(C(N)=S)cc2)CCS1	ZINC000158782789	197300524	/nfs/dbraw/zinc/30/05/24/197300524.db2.gz	ZKCBRNHVIARBDI-ZDUSSCGKSA-N	0	3	310.488	2.182	10	0		DEAEHN
CCNCc1cccc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)c1	ZINC000158762417	197298952	/nfs/dbraw/zinc/29/89/52/197298952.db2.gz	DZYUBMSJYLAWGI-HUUCEWRRSA-N	0	3	308.447	2.217	10	0		DEAEHN
C[C@@H]1OCC[C@@H]1N(C)[C@@H](CN)c1ccccc1OC(F)F	ZINC000158609335	197287810	/nfs/dbraw/zinc/28/78/10/197287810.db2.gz	JBXSAWDCNXFPKI-DRZSPHRISA-N	0	3	300.349	2.397	10	0		DEAEHN
CCO[C@@H]1C[C@](N)(C(=O)NCCCCC(F)(F)F)C1(C)C	ZINC000157513000	197192912	/nfs/dbraw/zinc/19/29/12/197192912.db2.gz	ZDFUTQLWRFUVPE-MFKMUULPSA-N	0	3	310.360	2.368	10	0		DEAEHN
CC[C@@H](C(=O)N[C@H](C)c1ccccc1-n1cccn1)N(C)C	ZINC000157469135	197189736	/nfs/dbraw/zinc/18/97/36/197189736.db2.gz	RUJUVMUXEHDGQO-HIFRSBDPSA-N	0	3	300.406	2.390	10	0		DEAEHN
Cc1cc2sc(C(=O)NC[C@@H](C)N(C)C)c(N)c2c(C)n1	ZINC000157017601	197155521	/nfs/dbraw/zinc/15/55/21/197155521.db2.gz	SJCKODGVASOYQV-SECBINFHSA-N	0	3	306.435	2.175	10	0		DEAEHN
C[C@](O)(Cc1sccc1Br)C[C@H]1COCCN1	ZINC000156858974	197146143	/nfs/dbraw/zinc/14/61/43/197146143.db2.gz	CVLMZVIERRRRQC-JOYOIKCWSA-N	0	3	320.252	2.183	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N2CCC[C@H]2c2cnn(C)c2)c1	ZINC000156219447	197096504	/nfs/dbraw/zinc/09/65/04/197096504.db2.gz	AKQBXXDLYDNBIX-KRWDZBQOSA-N	0	3	312.417	2.459	10	0		DEAEHN
CN(C[C@@H]1CC=CCC1)C(=O)NCCCCN1CCN(C)CC1	ZINC000542264037	285215775	/nfs/dbraw/zinc/21/57/75/285215775.db2.gz	VGTYFBZTXYRNGY-QGZVFWFLSA-N	0	3	322.497	2.012	10	0		DEAEHN
CC1CCC2(CSC(NC[C@H]3CCCS3(=O)=O)=N2)CC1	ZINC000155417847	197052819	/nfs/dbraw/zinc/05/28/19/197052819.db2.gz	OVUWZEXSEKMKFR-MBHSVXNSSA-N	0	3	316.492	2.205	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)c1coc(Br)c1	ZINC000120882413	195257291	/nfs/dbraw/zinc/25/72/91/195257291.db2.gz	FMWKGZQKSLINES-KOLCDFICSA-N	0	3	315.211	2.454	10	0		DEAEHN
CN(C)CCO[C@@H]1CN(Cc2ccc(F)cc2)[C@H]2CCCO[C@@H]12	ZINC000247961520	257112818	/nfs/dbraw/zinc/11/28/18/257112818.db2.gz	FJCKEDGBPJKYGA-RCCFBDPRSA-N	0	3	322.424	2.136	10	0		DEAEHN
O=C(C[C@@H]1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2O1)NCC1CC1	ZINC000253616258	257104805	/nfs/dbraw/zinc/10/48/05/257104805.db2.gz	ODAMLUYTIYJUGV-SQNIBIBYSA-N	0	3	314.429	2.192	10	0		DEAEHN
C1CC1c1nnc([C@@H]2C[C@H]3CCN(C4CCOCC4)C[C@@H]3O2)o1	ZINC000253596494	257105892	/nfs/dbraw/zinc/10/58/92/257105892.db2.gz	RWURHEYDIIMMSX-SNPRPXQTSA-N	0	3	319.405	2.278	10	0		DEAEHN
CN(C)CCO[C@@H]1CN(Cc2ccc(F)cc2)[C@@H]2CCCO[C@@H]12	ZINC000503716207	257209261	/nfs/dbraw/zinc/20/92/61/257209261.db2.gz	FJCKEDGBPJKYGA-KZNAEPCWSA-N	0	3	322.424	2.136	10	0		DEAEHN
CN(C)CCOc1cc(Br)nc(C(C)(C)C)n1	ZINC000122975148	195528503	/nfs/dbraw/zinc/52/85/03/195528503.db2.gz	FOTCAHOIDVIRJZ-UHFFFAOYSA-N	0	3	302.216	2.477	10	0		DEAEHN
COc1cccc(C(=O)N[C@H](CN(C)C)c2ccccc2)c1O	ZINC000123457016	195585148	/nfs/dbraw/zinc/58/51/48/195585148.db2.gz	QZNVVCBOWOEYQD-OAHLLOKOSA-N	0	3	314.385	2.434	10	0		DEAEHN
C[C@@H](NCCO[C@H]1CCCCO1)c1ccc(-n2ccnn2)cc1	ZINC000193092405	533399091	/nfs/dbraw/zinc/39/90/91/533399091.db2.gz	JGASNIBBUVLYOB-PBHICJAKSA-N	0	3	316.405	2.461	10	0		DEAEHN
COc1cccc(CN(CCN(C)C)c2nc(C)ns2)c1	ZINC000357668651	133092681	/nfs/dbraw/zinc/09/26/81/133092681.db2.gz	BNRZWEBTYMZKOP-UHFFFAOYSA-N	0	3	306.435	2.423	10	0		DEAEHN
Cc1ccc([C@@H](C)N[C@H]2CCN(C3CCOCC3)C2=O)cc1	ZINC000358182581	133126919	/nfs/dbraw/zinc/12/69/19/133126919.db2.gz	CSXIIHJSWCEAPA-PBHICJAKSA-N	0	3	302.418	2.426	10	0		DEAEHN
Cc1nccn1CCCN1CCO[C@@H](COc2ccccc2)C1	ZINC000361984898	133203243	/nfs/dbraw/zinc/20/32/43/133203243.db2.gz	LWSTYBIZMYUFDZ-GOSISDBHSA-N	0	3	315.417	2.361	10	0		DEAEHN
CC(C)OC[C@H]1CN(C(=O)c2ccccc2CN(C)C)CCO1	ZINC000368281355	133267539	/nfs/dbraw/zinc/26/75/39/133267539.db2.gz	VNOLGOGMEKIQIR-MRXNPFEDSA-N	0	3	320.433	2.014	10	0		DEAEHN
CN1CCC(CC(=O)N2CC[C@H](Nc3ccccc3)C2)CC1	ZINC000376836883	133309370	/nfs/dbraw/zinc/30/93/70/133309370.db2.gz	OUTIMTOXTGPERC-KRWDZBQOSA-N	0	3	301.434	2.431	10	0		DEAEHN
COc1cc(CN2CCCC[C@H](CO)C2)cc2c1OCCO2	ZINC000377236537	133323502	/nfs/dbraw/zinc/32/35/02/133323502.db2.gz	FUFDJYTYQAXKTN-ZDUSSCGKSA-N	0	3	307.390	2.061	10	0		DEAEHN
CCN(CC)CC(=O)N1CCC(Nc2nc(C)cs2)CC1	ZINC000377357403	133327063	/nfs/dbraw/zinc/32/70/63/133327063.db2.gz	AXIQXMGHKSXUJE-UHFFFAOYSA-N	0	3	310.467	2.196	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N(C(=O)c2ccnc(OCCN(C)C)c2)C1	ZINC000183221184	144927139	/nfs/dbraw/zinc/92/71/39/144927139.db2.gz	VFRYCNVPKXUIQV-ZIAGYGMSSA-N	0	3	305.422	2.283	10	0		DEAEHN
O=C(Cc1noc2ccccc12)NCc1ccc2c(c1)CNC2	ZINC000188664761	145015378	/nfs/dbraw/zinc/01/53/78/145015378.db2.gz	DOOWGKKEDDAPFI-UHFFFAOYSA-N	0	3	307.353	2.290	10	0		DEAEHN
Cc1c2ccccc2oc(=O)c1C(=O)N1CCN2CCC1CC2	ZINC000188825676	145017763	/nfs/dbraw/zinc/01/77/63/145017763.db2.gz	IGHSQRRHTYFWEY-UHFFFAOYSA-N	0	3	312.369	2.022	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2cc(C)c(O)c(C)c2)C1	ZINC000188892591	145019139	/nfs/dbraw/zinc/01/91/39/145019139.db2.gz	DRTMWTTZGDCMFT-INIZCTEOSA-N	0	3	319.449	2.335	10	0		DEAEHN
C[C@H]1CN(Cc2cccc(-c3ccccn3)c2)CCN1CCO	ZINC000190236130	145039359	/nfs/dbraw/zinc/03/93/59/145039359.db2.gz	PFVYODVGEPYAIC-INIZCTEOSA-N	0	3	311.429	2.247	10	0		DEAEHN
CO[C@@H](C)[C@H](C)NC(=O)N(CCN(C)C)Cc1cccc(C)c1	ZINC000190661274	145045544	/nfs/dbraw/zinc/04/55/44/145045544.db2.gz	BGUGHQORWOQIFS-HOTGVXAUSA-N	0	3	321.465	2.492	10	0		DEAEHN
CCc1nc(C2CCN([C@@H](C)C(=O)NC(C)(C)CC)CC2)n[nH]1	ZINC000190683928	145046175	/nfs/dbraw/zinc/04/61/75/145046175.db2.gz	IGFZIHCJUKDVKN-LBPRGKRZSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCc1n[nH]c(C2CCN([C@@H](C)C(=O)NC(C)(C)CC)CC2)n1	ZINC000190683928	145046176	/nfs/dbraw/zinc/04/61/76/145046176.db2.gz	IGFZIHCJUKDVKN-LBPRGKRZSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCc1nnc(C2CCN([C@@H](C)C(=O)NC(C)(C)CC)CC2)[nH]1	ZINC000190683928	145046177	/nfs/dbraw/zinc/04/61/77/145046177.db2.gz	IGFZIHCJUKDVKN-LBPRGKRZSA-N	0	3	321.469	2.240	10	0		DEAEHN
O[C@H](CC1CCCC1)CN1CCC(Nc2cccnn2)CC1	ZINC000191333923	145056418	/nfs/dbraw/zinc/05/64/18/145056418.db2.gz	YLVSMMJHBRPYHW-MRXNPFEDSA-N	0	3	304.438	2.294	10	0		DEAEHN
Cc1ccc(OCCNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000246133362	145093326	/nfs/dbraw/zinc/09/33/26/145093326.db2.gz	JBDLRHWQUIZCEQ-JKSUJKDBSA-N	0	3	319.449	2.498	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@H](C)C(=O)N1CCC(C)CC1	ZINC000246914611	145119189	/nfs/dbraw/zinc/11/91/89/145119189.db2.gz	GFDAEFRMWICRJD-WBVHZDCISA-N	0	3	318.465	2.303	10	0		DEAEHN
C[C@H](C(=O)N1CCc2ccccc21)N1CC[C@@H]2OCCC[C@H]2C1	ZINC000246941878	145120270	/nfs/dbraw/zinc/12/02/70/145120270.db2.gz	WWCNXIOCGXQZOV-HFTRVMKXSA-N	0	3	314.429	2.465	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccc(F)cc1F)N1CCN2CCC[C@H]2C1	ZINC000247227261	145129616	/nfs/dbraw/zinc/12/96/16/145129616.db2.gz	QZVSKRYDEWEFGC-AAEUAGOBSA-N	0	3	309.360	2.072	10	0		DEAEHN
CC(C)OCCNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248554943	145158740	/nfs/dbraw/zinc/15/87/40/145158740.db2.gz	HVSUIAHQYXDNAR-CVEARBPZSA-N	0	3	305.422	2.156	10	0		DEAEHN
C[C@H](NC(=O)[C@H]1CCOC[C@H]1C)[C@H](c1ccccc1)N(C)C	ZINC000248840051	145170232	/nfs/dbraw/zinc/17/02/32/145170232.db2.gz	FNVPUIMISCJKLL-YQFWSFKMSA-N	0	3	304.434	2.467	10	0		DEAEHN
COCOc1ccc(OC)cc1CN[C@@H]1C[C@@H]2OCCC[C@@H]12	ZINC000249763664	145190128	/nfs/dbraw/zinc/19/01/28/145190128.db2.gz	ICIOWKRMVOHLQE-UXLLHSPISA-N	0	3	307.390	2.335	10	0		DEAEHN
COC(=O)CCCCC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000251852198	145197089	/nfs/dbraw/zinc/19/70/89/145197089.db2.gz	QLVIGIIABPHVMA-CRAIPNDOSA-N	0	3	318.417	2.281	10	0		DEAEHN
CN(C)c1cccc(CCC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c1	ZINC000253354246	145201948	/nfs/dbraw/zinc/20/19/48/145201948.db2.gz	JDHIEPOFUCOUDJ-AEFFLSMTSA-N	0	3	315.461	2.380	10	0		DEAEHN
COc1ccccc1/C=C\CN1CCN(CC(C)(C)O)CC1	ZINC000255030106	145203147	/nfs/dbraw/zinc/20/31/47/145203147.db2.gz	VBVCUUCOTRNMQS-VURMDHGXSA-N	0	3	304.434	2.097	10	0		DEAEHN
N[C@@H]1CN(C(=O)c2ccc3c(c2)CCN3)C[C@H]1c1ccccc1	ZINC000261732081	145221122	/nfs/dbraw/zinc/22/11/22/145221122.db2.gz	LZRIKTOOMRLTEH-DLBZAZTESA-N	0	3	307.397	2.222	10	0		DEAEHN
Cc1ccc([O-])c(CN2CC[NH2+]C[C@H]2c2cccc(F)c2)n1	ZINC000261753334	145222969	/nfs/dbraw/zinc/22/29/69/145222969.db2.gz	QIMSWUHGXOXAMJ-INIZCTEOSA-N	0	3	301.365	2.381	10	0		DEAEHN
CN(Cc1cccc(C(F)(F)F)c1)C(=O)C1(N)CCOCC1	ZINC000261789808	145226822	/nfs/dbraw/zinc/22/68/22/145226822.db2.gz	IBDNDBZMWJQCRX-UHFFFAOYSA-N	0	3	316.323	2.172	10	0		DEAEHN
Cc1ccc(NC(=O)CN2CCNC[C@H]2c2cccnc2)c(C)c1	ZINC000261854868	145233797	/nfs/dbraw/zinc/23/37/97/145233797.db2.gz	VWDOUYHWLHOEPX-SFHVURJKSA-N	0	3	324.428	2.283	10	0		DEAEHN
CC[C@H](C)Oc1cc(C)ccc1CNC(=O)C1(N)CCOCC1	ZINC000261890938	145238295	/nfs/dbraw/zinc/23/82/95/145238295.db2.gz	QLSWNPUFSLWAKK-AWEZNQCLSA-N	0	3	320.433	2.296	10	0		DEAEHN
C[C@@H]1CN(C(=O)C2(N)CCOCC2)CC[C@@H]1c1ccccc1	ZINC000261900768	145239109	/nfs/dbraw/zinc/23/91/09/145239109.db2.gz	RQWRESKDXQFPOG-ZBFHGGJFSA-N	0	3	302.418	2.147	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000261910868	145240811	/nfs/dbraw/zinc/24/08/11/145240811.db2.gz	QEUHSYJGUZOUQU-JTDSTZFVSA-N	0	3	316.445	2.486	10	0		DEAEHN
Cc1coc(-c2cc(NC(=O)C3(N)CCOCC3)ccc2C)n1	ZINC000261922563	145242689	/nfs/dbraw/zinc/24/26/89/145242689.db2.gz	VGKHAGJVQGHRHE-UHFFFAOYSA-N	0	3	315.373	2.405	10	0		DEAEHN
COc1c(C)cc(CN2CCNC[C@H]2c2nccn2C)cc1C	ZINC000261929140	145243543	/nfs/dbraw/zinc/24/35/43/145243543.db2.gz	COPGLSLSQMLAQT-INIZCTEOSA-N	0	3	314.433	2.192	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N[C@H]1C[C@@H]1c1ccccc1	ZINC000261940041	145244992	/nfs/dbraw/zinc/24/49/92/145244992.db2.gz	UQDLGVYBTCTAEJ-TVEAVKIZSA-N	0	3	314.429	2.191	10	0		DEAEHN
C[C@H](CNC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C)c1ccccc1	ZINC000261946344	145245764	/nfs/dbraw/zinc/24/57/64/145245764.db2.gz	VRBRUMDLCUIXGC-FVQSIRDASA-N	0	3	316.445	2.439	10	0		DEAEHN
Cc1nc2ccccc2n1CCNC(=O)[C@@H]1NCCCC1(C)C	ZINC000261968982	145248081	/nfs/dbraw/zinc/24/80/81/145248081.db2.gz	YSAQAZXRFLLOMW-INIZCTEOSA-N	0	3	314.433	2.239	10	0		DEAEHN
Fc1ccccc1OCCN1CCNC[C@@H]1c1cccnc1	ZINC000262117979	145263172	/nfs/dbraw/zinc/26/31/72/145263172.db2.gz	BSUVJVNSUVXRPY-MRXNPFEDSA-N	0	3	301.365	2.246	10	0		DEAEHN
CNC(=O)c1cc(NC(=O)[C@@H]2NCCCC2(C)C)ccc1Cl	ZINC000262554354	145292613	/nfs/dbraw/zinc/29/26/13/145292613.db2.gz	TUUMNQCMUROVKB-ZDUSSCGKSA-N	0	3	323.824	2.416	10	0		DEAEHN
C[C@@H](C(=O)NCc1cccnc1N(C)C)[C@H](N)c1ccccc1	ZINC000262661903	145298568	/nfs/dbraw/zinc/29/85/68/145298568.db2.gz	GLVZWNJSKLBFAM-CJNGLKHVSA-N	0	3	312.417	2.100	10	0		DEAEHN
Cc1cccc2[nH]c(CCC(=O)N3CCN[C@H](C)[C@@H]3C)nc21	ZINC000262772907	145304115	/nfs/dbraw/zinc/30/41/15/145304115.db2.gz	LNIIDQFUSGBRBZ-OLZOCXBDSA-N	0	3	300.406	2.013	10	0		DEAEHN
Cc1cccc2nc(CCC(=O)N3CCN[C@H](C)[C@@H]3C)[nH]c21	ZINC000262772907	145304116	/nfs/dbraw/zinc/30/41/16/145304116.db2.gz	LNIIDQFUSGBRBZ-OLZOCXBDSA-N	0	3	300.406	2.013	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(Cc2c(F)cccc2Cl)n1	ZINC000263173502	145332001	/nfs/dbraw/zinc/33/20/01/145332001.db2.gz	FZUNTKSXRZPKFU-LBPRGKRZSA-N	0	3	310.760	2.029	10	0		DEAEHN
CC[C@H](C)Oc1ccc(-c2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263185051	145333800	/nfs/dbraw/zinc/33/38/00/145333800.db2.gz	HGDQXUBQUOYBPJ-WFASDCNBSA-N	0	3	316.405	2.490	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(C(C)(C)c2ccc(F)cc2)n1	ZINC000263201442	145335354	/nfs/dbraw/zinc/33/53/54/145335354.db2.gz	JDOFRNFIYBAFRM-ZDUSSCGKSA-N	0	3	304.369	2.111	10	0		DEAEHN
Cc1noc(C)c1CN1CCN(CC2(O)CCC(C)CC2)CC1	ZINC000304265879	145340036	/nfs/dbraw/zinc/34/00/36/145340036.db2.gz	CZSICWJZXLAULT-UHFFFAOYSA-N	0	3	321.465	2.350	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCC[C@](C)(O)CC1	ZINC000336718205	145397275	/nfs/dbraw/zinc/39/72/75/145397275.db2.gz	REQWVULMEJXGBX-SFHVURJKSA-N	0	3	304.434	2.272	10	0		DEAEHN
c1nc(-c2ccccn2)sc1CN1CCN2CCC1CC2	ZINC000349320918	146368387	/nfs/dbraw/zinc/36/83/87/146368387.db2.gz	WJKMJRXWKQZGJZ-UHFFFAOYSA-N	0	3	300.431	2.485	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@@H](c2ccccc2)N(C)C)C1	ZINC000358488647	147142926	/nfs/dbraw/zinc/14/29/26/147142926.db2.gz	WVYLBKBRYZSBMB-INIZCTEOSA-N	0	3	319.449	2.357	10	0		DEAEHN
COCCC1(C)CN(C(=O)N[C@@H](C)CN2CCC[C@H](C)C2)C1	ZINC000358526208	147150141	/nfs/dbraw/zinc/15/01/41/147150141.db2.gz	BDPVRWOJRJJOTP-GJZGRUSLSA-N	0	3	311.470	2.175	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1CCNC(=O)NCCNc1ccncc1	ZINC000358626531	147168809	/nfs/dbraw/zinc/16/88/09/147168809.db2.gz	IILGQIDEYYGOQA-HUUCEWRRSA-N	0	3	304.438	2.431	10	0		DEAEHN
CC(=O)Nc1cccc(-n2cnnc2SC[C@H](C)N(C)C)c1	ZINC000358857131	147219990	/nfs/dbraw/zinc/21/99/90/147219990.db2.gz	YJWKHCOPDIJNIJ-NSHDSACASA-N	0	3	319.434	2.268	10	0		DEAEHN
CCCN(C)CC(=O)NCCCc1ccc(OC)c(OC)c1	ZINC000359249126	147291902	/nfs/dbraw/zinc/29/19/02/147291902.db2.gz	IIKVIMIPNQKUJD-UHFFFAOYSA-N	0	3	308.422	2.094	10	0		DEAEHN
O=C(NC1CCN([C@@H]2CCOC2)CC1)C1CCC(F)(F)CC1	ZINC000360738122	147375840	/nfs/dbraw/zinc/37/58/40/147375840.db2.gz	ZAMBNTSGPIIJMI-CQSZACIVSA-N	0	3	316.392	2.181	10	0		DEAEHN
CCOCCN(CC)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248123643	286078500	/nfs/dbraw/zinc/07/85/00/286078500.db2.gz	UXMFISPHGFOXOS-IRXDYDNUSA-N	0	3	319.449	2.500	10	0		DEAEHN
Cc1ccc([C@@H](C)NC(=O)NCC2CCN(CCO)CC2)cc1	ZINC000111833646	401725478	/nfs/dbraw/zinc/72/54/78/401725478.db2.gz	IUQFQRSTAMKYOK-OAHLLOKOSA-N	0	3	319.449	2.060	10	0		DEAEHN
Fc1cc(CNC[C@@H]2COCCO2)ccc1Br	ZINC000127406390	401733424	/nfs/dbraw/zinc/73/34/24/401733424.db2.gz	AEPQMPJVJHPCBA-SNVBAGLBSA-N	0	3	304.159	2.093	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2ccc3c(c2)CCC(=O)N3)CCN1C	ZINC000127462086	401735722	/nfs/dbraw/zinc/73/57/22/401735722.db2.gz	JUXAOEFXOFQNDV-SWLSCSKDSA-N	0	3	315.417	2.126	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CC[C@H](Nc2ccccc2)C1	ZINC000074497769	401740617	/nfs/dbraw/zinc/74/06/17/401740617.db2.gz	AXWQXGQJYFMSJS-DLBZAZTESA-N	0	3	316.449	2.367	10	0		DEAEHN
CC[C@@H]1CCCCCN1C(=O)NC[C@@H](C)CN1CCN(C)CC1	ZINC000074657115	401743144	/nfs/dbraw/zinc/74/31/44/401743144.db2.gz	IPKZKQVGLKNXKM-IAGOWNOFSA-N	0	3	324.513	2.234	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(C)C[C@@H]2CCCN(C)C2)s1	ZINC000074841674	401744746	/nfs/dbraw/zinc/74/47/46/401744746.db2.gz	RNLXPARNWPBVMG-CYBMUJFWSA-N	0	3	324.494	2.231	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCO[C@H](c2ccco2)C1	ZINC000126731305	401706207	/nfs/dbraw/zinc/70/62/07/401706207.db2.gz	KWOCMUOAFTUUGF-HOCLYGCPSA-N	0	3	323.437	2.339	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cccc(C[S@](C)=O)c2)CCN1C	ZINC000127780785	401750045	/nfs/dbraw/zinc/75/00/45/401750045.db2.gz	NZZCBILOMCYMSD-JFUMZLFPSA-N	0	3	322.474	2.120	10	0		DEAEHN
CC(C)N1CCO[C@@H](CN2CCN(CCC(C)(C)C)CC2)C1	ZINC000112697834	401754846	/nfs/dbraw/zinc/75/48/46/401754846.db2.gz	WPHJUIWPDKJROY-KRWDZBQOSA-N	0	3	311.514	2.149	10	0		DEAEHN
CCCn1c2ccccc2nc1CN1CCO[C@H](CN(C)C)C1	ZINC000128059399	401761343	/nfs/dbraw/zinc/76/13/43/401761343.db2.gz	UDBMQUYLECWFSO-OAHLLOKOSA-N	0	3	316.449	2.209	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(-n2cccn2)cc1	ZINC000113223346	401770788	/nfs/dbraw/zinc/77/07/88/401770788.db2.gz	UXUUWTXLKPGNII-WMLDXEAASA-N	0	3	310.401	2.181	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)COc1ccccc1Cl	ZINC000113223672	401770915	/nfs/dbraw/zinc/77/09/15/401770915.db2.gz	NQJVNJJIMUDVOI-CHWSQXEVSA-N	0	3	308.809	2.414	10	0		DEAEHN
CCc1cc(C(=O)NC[C@@H](C)CN2CCN(C)CC2)oc1CC	ZINC000128340229	401772317	/nfs/dbraw/zinc/77/23/17/401772317.db2.gz	OTOOFYWLQINHQI-CQSZACIVSA-N	0	3	321.465	2.018	10	0		DEAEHN
CCC[C@@H](C)CS(=O)(=O)N1CCC(N2CCCC2)CC1	ZINC000113280022	401775077	/nfs/dbraw/zinc/77/50/77/401775077.db2.gz	NSFTWVDBAFWDPZ-CQSZACIVSA-N	0	3	302.484	2.313	10	0		DEAEHN
CC[C@H](CO)N1CCN(CCOc2cc(C)ccc2C)CC1	ZINC000075957440	401775373	/nfs/dbraw/zinc/77/53/73/401775373.db2.gz	OOPCJKSILRVGGC-QGZVFWFLSA-N	0	3	306.450	2.071	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)CN1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000128432029	401776460	/nfs/dbraw/zinc/77/64/60/401776460.db2.gz	SLDXRWFXEAFVDS-JFIYKMOQSA-N	0	3	308.466	2.405	10	0		DEAEHN
COc1ccccc1CCNC(=O)CN1C[C@@H](C)CC[C@H]1C	ZINC000076149382	401784853	/nfs/dbraw/zinc/78/48/53/401784853.db2.gz	NLPSCRKAWCDBGZ-LSDHHAIUSA-N	0	3	304.434	2.474	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)N3CCCCC3)cc2)CC1	ZINC000114157323	401793227	/nfs/dbraw/zinc/79/32/27/401793227.db2.gz	WNGVGPGIORPYOM-UHFFFAOYSA-N	0	3	301.434	2.455	10	0		DEAEHN
COc1ccc([C@H]2C[C@H](C)N(CC(=O)N(C)C3CC3)C2)cc1	ZINC000076389124	401793401	/nfs/dbraw/zinc/79/34/01/401793401.db2.gz	IYOGAYVDXBVBHC-ZFWWWQNUSA-N	0	3	302.418	2.494	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000026160571	401839033	/nfs/dbraw/zinc/83/90/33/401839033.db2.gz	HZBZEYXAHTVQKW-MRXNPFEDSA-N	0	3	316.449	2.003	10	0		DEAEHN
O=C(Cc1ccc(Br)cc1)N1CCN2CCC[C@@H]2C1	ZINC000027932837	401848895	/nfs/dbraw/zinc/84/88/95/401848895.db2.gz	NQFRFUDIHZJSCF-CQSZACIVSA-N	0	3	323.234	2.298	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1ccc2c(c1)OCCO2	ZINC000078614379	401858643	/nfs/dbraw/zinc/85/86/43/401858643.db2.gz	OWPVMDNWROCACN-CQSZACIVSA-N	0	3	306.406	2.164	10	0		DEAEHN
COCCCN(C)CCNC(=O)c1cc(C)c(F)cc1Cl	ZINC000132336165	401865507	/nfs/dbraw/zinc/86/55/07/401865507.db2.gz	MWVIROYJEFXLPQ-UHFFFAOYSA-N	0	3	316.804	2.486	10	0		DEAEHN
COC(=O)c1ccc(N2CCN[C@@H](Cc3ccccc3)C2)cc1	ZINC000039952508	401924384	/nfs/dbraw/zinc/92/43/84/401924384.db2.gz	JWZSREPHUVKGND-KRWDZBQOSA-N	0	3	310.397	2.494	10	0		DEAEHN
CC1(C)Cc2cccc(CNC[C@H]3CN(C4CC4)CCO3)c2O1	ZINC000119131753	401927669	/nfs/dbraw/zinc/92/76/69/401927669.db2.gz	BQSYZNSTUHGJML-KRWDZBQOSA-N	0	3	316.445	2.353	10	0		DEAEHN
CN(C(=O)CCN1CCN2CCCC[C@@H]2C1)c1ccccc1	ZINC000135196412	401929784	/nfs/dbraw/zinc/92/97/84/401929784.db2.gz	PGBZFQSEFAUHHS-QGZVFWFLSA-N	0	3	301.434	2.210	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cc(Cl)c(N)c(Cl)c2)C1	ZINC000119162562	401929809	/nfs/dbraw/zinc/92/98/09/401929809.db2.gz	PMCOJRHKQQBREN-SECBINFHSA-N	0	3	302.205	2.352	10	0		DEAEHN
CCOC(=O)CCCCN1CCC(c2nncn2CC)CC1	ZINC000132989369	401877363	/nfs/dbraw/zinc/87/73/63/401877363.db2.gz	IIBYDWLOWSIMDU-UHFFFAOYSA-N	0	3	308.426	2.211	10	0		DEAEHN
C[C@H]1c2ccccc2O[C@H]1C(=O)NCCN1CCC(C)CC1	ZINC000117756270	401883287	/nfs/dbraw/zinc/88/32/87/401883287.db2.gz	IPJVTKWLKBRVMW-WMLDXEAASA-N	0	3	302.418	2.399	10	0		DEAEHN
COCCN(Cc1ccc(C)cc1)C[C@@H](O)COCC(C)C	ZINC000036094963	401902180	/nfs/dbraw/zinc/90/21/80/401902180.db2.gz	DMEJAOCBCZGTKF-GOSISDBHSA-N	0	3	309.450	2.477	10	0		DEAEHN
COCCN(Cc1ccc(C)s1)C[C@H](O)COC(C)C	ZINC000036101013	401902849	/nfs/dbraw/zinc/90/28/49/401902849.db2.gz	AFWGTUUHTBSFIJ-AWEZNQCLSA-N	0	3	301.452	2.291	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1C(=O)[C@H]1CCCc2[nH]ncc21	ZINC000134469629	401904650	/nfs/dbraw/zinc/90/46/50/401904650.db2.gz	PSVZJJAJZDHBTI-KBPBESRZSA-N	0	3	313.405	2.026	10	0		DEAEHN
CN(C)CCOc1cc(CNC(=O)Nc2ccccc2)ccn1	ZINC000134507000	401904995	/nfs/dbraw/zinc/90/49/95/401904995.db2.gz	NBBTWBYAWWZSOG-UHFFFAOYSA-N	0	3	314.389	2.344	10	0		DEAEHN
CN(C)CCOc1cc(CNC(=O)NC2CCCCC2)ccn1	ZINC000134507274	401905079	/nfs/dbraw/zinc/90/50/79/401905079.db2.gz	HKWQIJCFTRKNIZ-UHFFFAOYSA-N	0	3	320.437	2.154	10	0		DEAEHN
CCNC(=O)CN[C@H](C)CCc1ccc(OC(F)F)cc1	ZINC000036780412	401908073	/nfs/dbraw/zinc/90/80/73/401908073.db2.gz	KUAAIIGKEDKGKG-LLVKDONJSA-N	0	3	300.349	2.335	10	0		DEAEHN
COC(=O)[C@@H](O)C1CCN([C@H](C)c2cccc(OC)c2)CC1	ZINC000135352521	401936899	/nfs/dbraw/zinc/93/68/99/401936899.db2.gz	RTZQKDMHUVXJMB-WBMJQRKESA-N	0	3	307.390	2.002	10	0		DEAEHN
Cc1ccc(CCN2CC[C@H](S(=O)(=O)N3CCCC3)C2)cc1	ZINC000135685773	401950749	/nfs/dbraw/zinc/95/07/49/401950749.db2.gz	KNTPNVHBRUSSID-KRWDZBQOSA-N	0	3	322.474	2.037	10	0		DEAEHN
C[C@H](CC(N)=O)N[C@H]1CCOc2ccc(Br)cc21	ZINC000135720480	401951759	/nfs/dbraw/zinc/95/17/59/401951759.db2.gz	NRCUUTALIDQMPU-KCJUWKMLSA-N	0	3	313.195	2.126	10	0		DEAEHN
COCCOc1cccc(CN2CCC[C@@H](n3cncn3)C2)c1	ZINC000119487126	401953683	/nfs/dbraw/zinc/95/36/83/401953683.db2.gz	NAPPZOMHZQSDBC-MRXNPFEDSA-N	0	3	316.405	2.140	10	0		DEAEHN
CC1CCN(CC(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000136194150	401963100	/nfs/dbraw/zinc/96/31/00/401963100.db2.gz	NDBLQUXOHIKZER-SFHVURJKSA-N	0	3	317.477	2.007	10	0		DEAEHN
CCCn1cc(CN2CCC[C@H]2CN2C[C@@H](C)O[C@@H](C)C2)cn1	ZINC000120078782	401977630	/nfs/dbraw/zinc/97/76/30/401977630.db2.gz	VYUBBKUTYFNHMX-JZXOWHBKSA-N	0	3	320.481	2.367	10	0		DEAEHN
COc1cc(CNC2(CO)CC2)ccc1OCc1ccncc1	ZINC000120391193	401988640	/nfs/dbraw/zinc/98/86/40/401988640.db2.gz	PXRXTQHJFBTOJR-UHFFFAOYSA-N	0	3	314.385	2.284	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NCCCOCC1CC1)c1ccccc1	ZINC000048198259	401995491	/nfs/dbraw/zinc/99/54/91/401995491.db2.gz	IIBGICMYRIQEOJ-KRWDZBQOSA-N	0	3	319.449	2.405	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H](C)N1CCc2ccccc21)N(C)C	ZINC000135650046	401949358	/nfs/dbraw/zinc/94/93/58/401949358.db2.gz	UIUVYLJMDUHCMU-YOEHRIQHSA-N	0	3	303.450	2.284	10	0		DEAEHN
C[C@H](NCCc1ccsc1)c1cccc(S(N)(=O)=O)c1	ZINC000049153414	402013057	/nfs/dbraw/zinc/01/30/57/402013057.db2.gz	GPQMXAAIMQQOGP-NSHDSACASA-N	0	3	310.444	2.289	10	0		DEAEHN
Cc1ccc([C@@H]2CN(C(=O)NC[C@@H](C)N(C)C3CC3)CCO2)o1	ZINC000121313224	402027693	/nfs/dbraw/zinc/02/76/93/402027693.db2.gz	ZTXNNRIVCYWSRI-WBMJQRKESA-N	0	3	321.421	2.154	10	0		DEAEHN
C[C@H]1CC(CCN2CC[C@H](NS(C)(=O)=O)C2)C[C@H](C)C1	ZINC000151551195	402042572	/nfs/dbraw/zinc/04/25/72/402042572.db2.gz	CFDFVZWUYLKQIA-NFAWXSAZSA-N	0	3	302.484	2.072	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCCN(C)c2ccccc2)C1	ZINC000052500091	402043180	/nfs/dbraw/zinc/04/31/80/402043180.db2.gz	RKFQHIWOHNOFRM-MRXNPFEDSA-N	0	3	318.465	2.296	10	0		DEAEHN
O=S(=O)(/C=C/c1ccccc1)N1CC[C@@H](CN2CCCC2)C1	ZINC000151634664	402047632	/nfs/dbraw/zinc/04/76/32/402047632.db2.gz	UXRSYFSCRLDSNZ-VEMDQMBVSA-N	0	3	320.458	2.405	10	0		DEAEHN
CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1cccc(CN(C)C)c1	ZINC000055308285	402079663	/nfs/dbraw/zinc/07/96/63/402079663.db2.gz	FPEIGUVDZONKNA-MRXNPFEDSA-N	0	3	317.433	2.334	10	0		DEAEHN
CCOc1cc(C)ccc1CNC(=O)NC[C@@H]1CCCN1C	ZINC000123306423	402120759	/nfs/dbraw/zinc/12/07/59/402120759.db2.gz	DEVJOSDOGWDKNM-HNNXBMFYSA-N	0	3	305.422	2.287	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@H]2OCCc3ccccc32)CCN1C	ZINC000122641890	402088937	/nfs/dbraw/zinc/08/89/37/402088937.db2.gz	GFNAUWFFWIGXFB-UNEWFSDZSA-N	0	3	302.418	2.242	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)NCc1ccoc1	ZINC000057202332	402093406	/nfs/dbraw/zinc/09/34/06/402093406.db2.gz	XSKLCVZADZOGBI-INIZCTEOSA-N	0	3	301.390	2.252	10	0		DEAEHN
COCCOc1ccccc1C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000122758501	402093480	/nfs/dbraw/zinc/09/34/80/402093480.db2.gz	IPNMYASCMFJZLA-LSDHHAIUSA-N	0	3	320.433	2.267	10	0		DEAEHN
Cc1nc(CCNC(=O)NCCN2CCCC[C@H]2C)sc1C	ZINC000123002411	402105572	/nfs/dbraw/zinc/10/55/72/402105572.db2.gz	VTHZBJUZLMCBJO-GFCCVEGCSA-N	0	3	324.494	2.476	10	0		DEAEHN
Cc1noc(C)c1CNC(=O)c1ccccc1OCCN(C)C	ZINC000063111723	402111772	/nfs/dbraw/zinc/11/17/72/402111772.db2.gz	RYWBDSOZGQUMGS-UHFFFAOYSA-N	0	3	317.389	2.162	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)c1cncc(F)c1	ZINC000123176462	402114305	/nfs/dbraw/zinc/11/43/05/402114305.db2.gz	WFXWLGZVRAELDP-INIZCTEOSA-N	0	3	301.365	2.123	10	0		DEAEHN
C[C@H](CO)[C@H](C)NCc1cc2c(cc1Br)OCO2	ZINC000123242296	402117469	/nfs/dbraw/zinc/11/74/69/402117469.db2.gz	BGBSYQYMZVYBKP-BDAKNGLRSA-N	0	3	316.195	2.284	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2cccc(N(C)C)n2)CCN1C	ZINC000152961372	402119329	/nfs/dbraw/zinc/11/93/29/402119329.db2.gz	WXEWYOMYPVDOFZ-OLZOCXBDSA-N	0	3	305.426	2.094	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1cc(C)cc(F)c1	ZINC000152960325	402119500	/nfs/dbraw/zinc/11/95/00/402119500.db2.gz	VWEPRCHGMCACGJ-HNNXBMFYSA-N	0	3	309.385	2.366	10	0		DEAEHN
COc1cccc(OC)c1CC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000122215376	402067098	/nfs/dbraw/zinc/06/70/98/402067098.db2.gz	KHTUBJCAWHWWNJ-KGLIPLIRSA-N	0	3	320.433	2.187	10	0		DEAEHN
COc1cc(C[NH2+]C[C@@H](C)CCO)cc(Br)c1[O-]	ZINC000097440094	402125186	/nfs/dbraw/zinc/12/51/86/402125186.db2.gz	AEDGETXPCUTTGR-VIFPVBQESA-N	0	3	318.211	2.271	10	0		DEAEHN
COc1cc(OC)cc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000123425785	402127070	/nfs/dbraw/zinc/12/70/70/402127070.db2.gz	PFKJMXKAKWBZHF-OCCSQVGLSA-N	0	3	306.406	2.259	10	0		DEAEHN
Cc1ccc2c(c1)[C@H](NCC1(C(N)=O)CCOCC1)CCCO2	ZINC000153162832	402130360	/nfs/dbraw/zinc/13/03/60/402130360.db2.gz	IXBOFTRZGYCWJI-OAHLLOKOSA-N	0	3	318.417	2.080	10	0		DEAEHN
CC[C@@H](C(=O)N1CCO[C@@H](CN(C)C)C1)c1ccc(F)cc1	ZINC000123594791	402136939	/nfs/dbraw/zinc/13/69/39/402136939.db2.gz	LHVRFEALVYHFOY-JKSUJKDBSA-N	0	3	308.397	2.108	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2ccn(-c3ccccc3)n2)CCN1C	ZINC000123823015	402148546	/nfs/dbraw/zinc/14/85/46/402148546.db2.gz	MHXYBPNWQSMXGX-GDBMZVCRSA-N	0	3	312.417	2.427	10	0		DEAEHN
COc1ccc(NC(=O)NCCN2CCCC[C@@H]2C)c(C)n1	ZINC000124000534	402158237	/nfs/dbraw/zinc/15/82/37/402158237.db2.gz	TUUKULASRDJNRY-LBPRGKRZSA-N	0	3	306.410	2.395	10	0		DEAEHN
COc1ccc(OC)c(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000124480847	402181866	/nfs/dbraw/zinc/18/18/66/402181866.db2.gz	CICBPWHQAIYXHA-CHWSQXEVSA-N	0	3	306.406	2.259	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H](CCCO)c2ccccc2)C1	ZINC000153970255	402184324	/nfs/dbraw/zinc/18/43/24/402184324.db2.gz	SVQJRWOSNZHONT-SJORKVTESA-N	0	3	319.449	2.284	10	0		DEAEHN
CC1CCN(CCNC(=O)c2ccc(-c3ncon3)cc2)CC1	ZINC000107219828	402228047	/nfs/dbraw/zinc/22/80/47/402228047.db2.gz	QXJAOMHIQZYFKT-UHFFFAOYSA-N	0	3	314.389	2.198	10	0		DEAEHN
CCn1c(C)nnc1CN1CCCN(Cc2ccccc2)CC1	ZINC000154784099	402231621	/nfs/dbraw/zinc/23/16/21/402231621.db2.gz	KQIMEAQQSNHOHD-UHFFFAOYSA-N	0	3	313.449	2.314	10	0		DEAEHN
COC(=O)CC(C)(C)CC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000154798511	402232744	/nfs/dbraw/zinc/23/27/44/402232744.db2.gz	PRFQSHFQBLVIKM-HNNXBMFYSA-N	0	3	320.433	2.385	10	0		DEAEHN
CC(=O)c1c[nH]c(C(=O)N2CCCC[C@@H](N3CCCC3)C2)c1	ZINC000107666495	402236965	/nfs/dbraw/zinc/23/69/65/402236965.db2.gz	TYXXKIDFSDJBDB-OAHLLOKOSA-N	0	3	303.406	2.308	10	0		DEAEHN
CC(C)[C@H](O)CNC(=O)NCC(C)(C)N[C@H](C)c1ccccc1	ZINC000155075581	402244269	/nfs/dbraw/zinc/24/42/69/402244269.db2.gz	XECOWYNVTJSOQY-GDBMZVCRSA-N	0	3	321.465	2.432	10	0		DEAEHN
CCCO[C@H]1CCCN(C(=O)N[C@@H]2CCCN(CC)C2)CC1	ZINC000108562002	402257534	/nfs/dbraw/zinc/25/75/34/402257534.db2.gz	YISSUMHUPKKDFZ-CVEARBPZSA-N	0	3	311.470	2.461	10	0		DEAEHN
COc1ccccc1CCN(C)C(=O)NC[C@@H]1CCCN(C)C1	ZINC000108590343	402258132	/nfs/dbraw/zinc/25/81/32/402258132.db2.gz	TXUPLKIMRMPCIJ-HNNXBMFYSA-N	0	3	319.449	2.221	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)NC[C@@H]1CCCN1C	ZINC000154358514	402208151	/nfs/dbraw/zinc/20/81/51/402208151.db2.gz	UYOMGGKRSOANIX-JSGCOSHPSA-N	0	3	321.469	2.401	10	0		DEAEHN
Cc1cnn([C@@H]2CCCN(CCC(=O)NC3CCCC3)C2)c1	ZINC000105901604	402210551	/nfs/dbraw/zinc/21/05/51/402210551.db2.gz	RCRLPRXXUFZWAO-MRXNPFEDSA-N	0	3	304.438	2.277	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(Br)c(F)c2)C1	ZINC000071140012	402270178	/nfs/dbraw/zinc/27/01/78/402270178.db2.gz	LNPCDEPASOABNI-JTQLQIEISA-N	0	3	315.186	2.364	10	0		DEAEHN
OCCCN(CCO)CCOc1c(Cl)cccc1Cl	ZINC000109798248	402275840	/nfs/dbraw/zinc/27/58/40/402275840.db2.gz	ARGCJXVHZCZFCO-UHFFFAOYSA-N	0	3	308.205	2.049	10	0		DEAEHN
CCCNC(=O)[C@@H]1CCCN(Cc2ncc(C)c(OC)c2C)C1	ZINC000110030745	402280415	/nfs/dbraw/zinc/28/04/15/402280415.db2.gz	WPCRHBRCGNPMJU-OAHLLOKOSA-N	0	3	319.449	2.445	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1c(F)cccc1F	ZINC000110084818	402281376	/nfs/dbraw/zinc/28/13/76/402281376.db2.gz	SCAYVCFKVDIWCF-LLVKDONJSA-N	0	3	313.348	2.197	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1ccc2c(c1)OCCO2	ZINC000176244363	402294225	/nfs/dbraw/zinc/29/42/25/402294225.db2.gz	RFRAWXXBKMFVQC-AWEZNQCLSA-N	0	3	319.405	2.406	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Cc2c(Cl)cccc2OC)C1	ZINC000184764174	402298258	/nfs/dbraw/zinc/29/82/58/402298258.db2.gz	ZFGJKCXFLKQSIG-GFCCVEGCSA-N	0	3	310.825	2.492	10	0		DEAEHN
O=C1NCCC[C@H]1N[C@H]1CCc2c1cccc2Br	ZINC000221799152	402304523	/nfs/dbraw/zinc/30/45/23/402304523.db2.gz	JPXMLTJMHFNHMK-QWHCGFSZSA-N	0	3	309.207	2.305	10	0		DEAEHN
CCN(CC)CC(=O)N1CCCC[C@H]1c1nnc2n1CCCC2	ZINC000176407006	402306519	/nfs/dbraw/zinc/30/65/19/402306519.db2.gz	JDQZYWWCOVMYBL-AWEZNQCLSA-N	0	3	319.453	2.010	10	0		DEAEHN
CC(C)[C@@](C)(O)CN1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000184956293	402312370	/nfs/dbraw/zinc/31/23/70/402312370.db2.gz	OROFZSKWFNIEAJ-SFHVURJKSA-N	0	3	322.424	2.381	10	0		DEAEHN
CCOC(CN1CCC[C@@H](Cn2nc(C)nc2C)C1)OCC	ZINC000184968175	402313740	/nfs/dbraw/zinc/31/37/40/402313740.db2.gz	XSAIAJVSEBUHOY-OAHLLOKOSA-N	0	3	310.442	2.006	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)CSCc2ccccn2)C1	ZINC000159018942	402316006	/nfs/dbraw/zinc/31/60/06/402316006.db2.gz	DSPIJWSIHNYILP-HIFRSBDPSA-N	0	3	307.463	2.160	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1cc(C)ccc1F	ZINC000176895303	402347391	/nfs/dbraw/zinc/34/73/91/402347391.db2.gz	KZCYXUPPJIYIEQ-CYBMUJFWSA-N	0	3	321.396	2.015	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)N(C)C[C@@H]2CCCN2CC)cc1	ZINC000176895126	402347657	/nfs/dbraw/zinc/34/76/57/402347657.db2.gz	VDUTYJBSWUMDGB-INIZCTEOSA-N	0	3	317.433	2.130	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(NC(=O)OC)cc1	ZINC000176965063	402354624	/nfs/dbraw/zinc/35/46/24/402354624.db2.gz	BYKGBVYXFFAPJW-OAHLLOKOSA-N	0	3	319.405	2.421	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)N[C@@H]1CCCC[C@@H]1n1cccn1	ZINC000185495629	402357035	/nfs/dbraw/zinc/35/70/35/402357035.db2.gz	JTVBVRPNBWHAGG-CVEARBPZSA-N	0	3	319.453	2.102	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc2c(s1)CCOC2	ZINC000176992372	402357682	/nfs/dbraw/zinc/35/76/82/402357682.db2.gz	VINIAASVDMIWKK-CYBMUJFWSA-N	0	3	308.447	2.377	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CSCc1ccncc1	ZINC000177021703	402360130	/nfs/dbraw/zinc/36/01/30/402360130.db2.gz	KNMLQFUSKOJUPP-OAHLLOKOSA-N	0	3	307.463	2.258	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(F)c(NC(C)=O)c1	ZINC000177041099	402362794	/nfs/dbraw/zinc/36/27/94/402362794.db2.gz	MEAUJTNPAPLJAQ-CQSZACIVSA-N	0	3	321.396	2.340	10	0		DEAEHN
C[NH+](C)[C@H]1CCCN(C(=O)c2ccc3c(c2[O-])CCCC3)C1	ZINC000185777790	402376547	/nfs/dbraw/zinc/37/65/47/402376547.db2.gz	WFXMISKWMFZXAE-AWEZNQCLSA-N	0	3	302.418	2.437	10	0		DEAEHN
COC(=O)c1nc(N2CC[C@H]3[C@@H](CCCN3C)C2)sc1C	ZINC000228208701	402336691	/nfs/dbraw/zinc/33/66/91/402336691.db2.gz	IXCKRQZORVIEHW-RYUDHWBXSA-N	0	3	309.435	2.159	10	0		DEAEHN
COC(=O)c1ccccc1NC(=O)N(C)CCN(C)C1CC1	ZINC000185980752	402394525	/nfs/dbraw/zinc/39/45/25/402394525.db2.gz	AGVKMANJJBSZFS-UHFFFAOYSA-N	0	3	305.378	2.031	10	0		DEAEHN
Cc1nn(C)c(C)c1CCNC(=O)[C@@H](C)[C@@H](N)c1ccccc1	ZINC000237438305	402408324	/nfs/dbraw/zinc/40/83/24/402408324.db2.gz	LZRSJFLATHBHPQ-YVEFUNNKSA-N	0	3	314.433	2.032	10	0		DEAEHN
CCC[C@H](C(=O)NCCCc1nc2ccccc2n1C)N(C)C	ZINC000162169629	402411989	/nfs/dbraw/zinc/41/19/89/402411989.db2.gz	QFMXAVMFGKLYDN-MRXNPFEDSA-N	0	3	316.449	2.352	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1c(C)cccc1F	ZINC000186270534	402416692	/nfs/dbraw/zinc/41/66/92/402416692.db2.gz	QMIAYTHBKOWRRL-GFCCVEGCSA-N	0	3	302.415	2.143	10	0		DEAEHN
CC(=O)c1cc(C(=O)N[C@H](C)CN2CCCCCC2)n(C)c1	ZINC000186295479	402418905	/nfs/dbraw/zinc/41/89/05/402418905.db2.gz	WFYCUYSJANJYEX-CYBMUJFWSA-N	0	3	305.422	2.222	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NC[C@H]1CCCS1)c1ccccc1	ZINC000162890089	402435087	/nfs/dbraw/zinc/43/50/87/402435087.db2.gz	PAVHZTSGGICWRQ-CABCVRRESA-N	0	3	307.463	2.484	10	0		DEAEHN
COc1ccc(F)cc1CC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000186497952	402436544	/nfs/dbraw/zinc/43/65/44/402436544.db2.gz	JJPWDPDXMFUOQA-IUODEOHRSA-N	0	3	308.397	2.318	10	0		DEAEHN
CN(CCCCCc1cc(-c2ccc(F)cc2)n[nH]1)C(=O)CN	ZINC000237046754	402392856	/nfs/dbraw/zinc/39/28/56/402392856.db2.gz	UHHAPFSLRPFNLS-UHFFFAOYSA-N	0	3	318.396	2.346	10	0		DEAEHN
CCN1CC[C@H](N(C)CCS(=O)(=O)c2ccccc2)[C@@H](C)C1	ZINC000245415850	402458081	/nfs/dbraw/zinc/45/80/81/402458081.db2.gz	DPZJVEGEGMAYNE-RDJZCZTQSA-N	0	3	324.490	2.122	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C(=O)N(C)C)c1ccccc1	ZINC000245479498	402464716	/nfs/dbraw/zinc/46/47/16/402464716.db2.gz	WMUZFIHZVCKYIX-IAGOWNOFSA-N	0	3	303.450	2.232	10	0		DEAEHN
Cc1cc(N2CC[C@@H](N3CC[C@@H](CC(C)C)C3)C2=O)n(C)n1	ZINC000245484038	402465312	/nfs/dbraw/zinc/46/53/12/402465312.db2.gz	GQCYNGBPMCCPCP-LSDHHAIUSA-N	0	3	304.438	2.202	10	0		DEAEHN
COC(=O)c1nc(N2CC[C@@H](N3CCCCC3)C2)sc1C	ZINC000164669653	402467192	/nfs/dbraw/zinc/46/71/92/402467192.db2.gz	WJUXJOHNVDXKTH-GFCCVEGCSA-N	0	3	309.435	2.303	10	0		DEAEHN
CCC[C@H](N)C(=O)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000165512820	402476504	/nfs/dbraw/zinc/47/65/04/402476504.db2.gz	KENYVGGALUPUJU-HNNXBMFYSA-N	0	3	300.406	2.396	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H](c2ccccc2)CN(Cc2c[nH]nc2C)C1	ZINC000245698336	402480966	/nfs/dbraw/zinc/48/09/66/402480966.db2.gz	BHBNACHHOFJCDI-HZPDHXFCSA-N	0	3	313.401	2.497	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)Nc1cccc(F)c1	ZINC000178299435	402481817	/nfs/dbraw/zinc/48/18/17/402481817.db2.gz	XZFPYMGZVANODN-INIZCTEOSA-N	0	3	316.380	2.434	10	0		DEAEHN
CC[C@H]1CN(C(=O)[C@H]2CCCCN2CC)CCN1CC(F)F	ZINC000245723284	402482415	/nfs/dbraw/zinc/48/24/15/402482415.db2.gz	HXDZGIODXWYFRV-UONOGXRCSA-N	0	3	317.424	2.049	10	0		DEAEHN
O=C1[C@@H](N2CCN3CCC[C@H]3C2)CCCN1c1ccccc1F	ZINC000245781521	402487679	/nfs/dbraw/zinc/48/76/79/402487679.db2.gz	MGLINLPOLHRZSW-YOEHRIQHSA-N	0	3	317.408	2.101	10	0		DEAEHN
CCOC(=O)c1csc(N2CC[C@@H]3[C@H](CCCN3C)C2)n1	ZINC000166892737	402488239	/nfs/dbraw/zinc/48/82/39/402488239.db2.gz	XCMXCMAOELQPQH-DGCLKSJQSA-N	0	3	309.435	2.240	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)NCCc2ccc(F)cc2)C1	ZINC000245863827	402492109	/nfs/dbraw/zinc/49/21/09/402492109.db2.gz	FUCIAJZFVFPAFK-RDJZCZTQSA-N	0	3	319.424	2.494	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N[C@H](Cc2ccccc2)C(=O)N(C)C)C1(C)C	ZINC000245877074	402493378	/nfs/dbraw/zinc/49/33/78/402493378.db2.gz	KGQIVZPRWKCPIR-BRWVUGGUSA-N	0	3	318.461	2.479	10	0		DEAEHN
COc1ccc(O)cc1C(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000187328828	402494415	/nfs/dbraw/zinc/49/44/15/402494415.db2.gz	UGSXQGISAHNJNJ-INIZCTEOSA-N	0	3	314.385	2.434	10	0		DEAEHN
C[C@H](C(=O)N[C@H]1Cc2ccccc2[C@H]1O)N1CCCCCC1	ZINC000246009466	402503211	/nfs/dbraw/zinc/50/32/11/402503211.db2.gz	RGERTJXGYUXHEW-XOKHGSTOSA-N	0	3	302.418	2.025	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1C	ZINC000246034830	402504679	/nfs/dbraw/zinc/50/46/79/402504679.db2.gz	ARTBBOCNLZBALN-ZBFHGGJFSA-N	0	3	310.463	2.310	10	0		DEAEHN
Cc1ccccc1OCCN1C[C@H](N2CCOCC2)[C@@H](C)C1	ZINC000246095372	402509236	/nfs/dbraw/zinc/50/92/36/402509236.db2.gz	HPBUVYSSYQHUKU-IRXDYDNUSA-N	0	3	304.434	2.026	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1CC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000246971301	402551771	/nfs/dbraw/zinc/55/17/71/402551771.db2.gz	JCVUYYBCDNCWEC-ZIAGYGMSSA-N	0	3	310.438	2.051	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2cc3c(cc2Cl)OCO3)C1	ZINC000171073956	402554752	/nfs/dbraw/zinc/55/47/52/402554752.db2.gz	QLMYZHSYYXVDFJ-SECBINFHSA-N	0	3	311.769	2.237	10	0		DEAEHN
COC(=O)Nc1ccc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1	ZINC000247066520	402555792	/nfs/dbraw/zinc/55/57/92/402555792.db2.gz	ISKKCTURWQPAAS-SWLSCSKDSA-N	0	3	319.405	2.323	10	0		DEAEHN
CCOc1ccccc1OCCN1C[C@H](C(N)=O)CC[C@H]1C	ZINC000247708284	402575229	/nfs/dbraw/zinc/57/52/29/402575229.db2.gz	ZMQKLQVRFSNWED-ZIAGYGMSSA-N	0	3	306.406	2.050	10	0		DEAEHN
CN1CCC(C(=O)N2CC3(CCOCC3)c3ccccc32)CC1	ZINC000189830376	402561119	/nfs/dbraw/zinc/56/11/19/402561119.db2.gz	ITDLLVHSWRGZNF-UHFFFAOYSA-N	0	3	314.429	2.423	10	0		DEAEHN
Cc1noc2nc(C)cc(C(=O)N3C[C@H]4CCCN4C[C@H]3C)c12	ZINC000247403014	402566256	/nfs/dbraw/zinc/56/62/56/402566256.db2.gz	PNVQYXJGSBRLDI-DGCLKSJQSA-N	0	3	314.389	2.148	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N2CCOC3(CCCCC3)C2)C1	ZINC000247466729	402567970	/nfs/dbraw/zinc/56/79/70/402567970.db2.gz	UVUHOSAREOMBQS-HZPDHXFCSA-N	0	3	323.481	2.460	10	0		DEAEHN
COC(=O)[C@@H](C)CN(Cc1ncc(C)c(OC)c1C)C1CC1	ZINC000171235643	402570017	/nfs/dbraw/zinc/57/00/17/402570017.db2.gz	ZPRKTYXJPJKCAK-LBPRGKRZSA-N	0	3	306.406	2.481	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H](C)Oc2ccccc2F)C1	ZINC000246177390	402515790	/nfs/dbraw/zinc/51/57/90/402515790.db2.gz	LPYUAHGYJVIAEX-KBPBESRZSA-N	0	3	323.412	2.377	10	0		DEAEHN
CC(C)N(Cc1ccccc1)C(=O)CN1CCN2CCC[C@@H]2C1	ZINC000178622607	402518372	/nfs/dbraw/zinc/51/83/72/402518372.db2.gz	FKQYKUITKZJKPE-GOSISDBHSA-N	0	3	315.461	2.204	10	0		DEAEHN
C[C@@H](CNC(=O)c1cn2ccnc2s1)N1CCC[C@H](C)C1	ZINC000188306834	402519527	/nfs/dbraw/zinc/51/95/27/402519527.db2.gz	RKASKDVCXIHCQQ-RYUDHWBXSA-N	0	3	306.435	2.246	10	0		DEAEHN
Cc1ccc(NC(=O)CN2CCN3CCC[C@@H]3C2)c(Cl)c1	ZINC000178635523	402520320	/nfs/dbraw/zinc/52/03/20/402520320.db2.gz	IPKKNDGNPQHZKE-CYBMUJFWSA-N	0	3	307.825	2.367	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H](C)NC(=O)CC(C)(C)C	ZINC000188619019	402521727	/nfs/dbraw/zinc/52/17/27/402521727.db2.gz	WTLFEOLSCXUVCQ-KGLIPLIRSA-N	0	3	313.486	2.020	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)N[C@@H]1COc2ccccc21	ZINC000246273787	402522097	/nfs/dbraw/zinc/52/20/97/402522097.db2.gz	JCOPEMLUQQSADJ-BPLDGKMQSA-N	0	3	303.406	2.102	10	0		DEAEHN
CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)[C@@H](C)C1	ZINC000246305062	402524377	/nfs/dbraw/zinc/52/43/77/402524377.db2.gz	ATIOBQUTIDCWIC-SWLSCSKDSA-N	0	3	323.412	2.403	10	0		DEAEHN
CC[N@H+]1CC[C@@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)[C@@H](C)C1	ZINC000246305062	402524379	/nfs/dbraw/zinc/52/43/79/402524379.db2.gz	ATIOBQUTIDCWIC-SWLSCSKDSA-N	0	3	323.412	2.403	10	0		DEAEHN
COc1ccc([C@@H](NC(=O)N2CC[C@H](N(C)C)C2)C2CC2)cc1	ZINC000170827500	402529906	/nfs/dbraw/zinc/52/99/06/402529906.db2.gz	HIIWSQQHYPUSJR-RDJZCZTQSA-N	0	3	317.433	2.492	10	0		DEAEHN
CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)N1CCN2CCC[C@H]2C1	ZINC000246420082	402530544	/nfs/dbraw/zinc/53/05/44/402530544.db2.gz	RUGIDPFRDVUZGY-OWCLPIDISA-N	0	3	323.481	2.317	10	0		DEAEHN
CCOc1cccc([C@H](C)NC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000170835089	402530920	/nfs/dbraw/zinc/53/09/20/402530920.db2.gz	AHGXKQUHWBUKPX-ZFWWWQNUSA-N	0	3	305.422	2.492	10	0		DEAEHN
NC1(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)CCCC1	ZINC000178726794	402531667	/nfs/dbraw/zinc/53/16/67/402531667.db2.gz	QCMCLYIAADAKQN-QGZVFWFLSA-N	0	3	315.461	2.429	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)CCC(=O)c2ccc(Cl)cc2)C1	ZINC000170863393	402534513	/nfs/dbraw/zinc/53/45/13/402534513.db2.gz	FMVKXBUCACIFRR-AWEZNQCLSA-N	0	3	308.809	2.465	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cnn(-c3cccc(Cl)c3)c2)C1	ZINC000170864812	402535090	/nfs/dbraw/zinc/53/50/90/402535090.db2.gz	IETYHGJXKXWZNM-HNNXBMFYSA-N	0	3	318.808	2.302	10	0		DEAEHN
Cc1c(C(=O)N2CC[C@@H](N(C)C)C2)cnn1-c1ccccc1C	ZINC000170867052	402535795	/nfs/dbraw/zinc/53/57/95/402535795.db2.gz	JECKZVFXQZKNGO-OAHLLOKOSA-N	0	3	312.417	2.265	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)CCN1C	ZINC000246691865	402540983	/nfs/dbraw/zinc/54/09/83/402540983.db2.gz	MXGXKRHEUPLWHK-QCODTGAPSA-N	0	3	321.465	2.068	10	0		DEAEHN
CC[C@H](C)[C@H](O)CNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000248136234	402583805	/nfs/dbraw/zinc/58/38/05/402583805.db2.gz	XNLRIEVQHRGXRI-QMCVQRASSA-N	0	3	319.449	2.138	10	0		DEAEHN
Cc1nnc([C@@H](C)N2CC[C@@H](CN(C)Cc3cccnc3)C2)o1	ZINC000248644839	402601178	/nfs/dbraw/zinc/60/11/78/402601178.db2.gz	FRKJWCGKMQHDQG-CJNGLKHVSA-N	0	3	315.421	2.288	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)[C@H](C)N2CCN3CCC[C@@H]3C2)c1	ZINC000171640934	402605190	/nfs/dbraw/zinc/60/51/90/402605190.db2.gz	GNMACHLQEXWEHN-JKSUJKDBSA-N	0	3	301.434	2.410	10	0		DEAEHN
O=C(CCN1CCC[C@H](n2cncn2)C1)Nc1ccccc1F	ZINC000171701915	402611897	/nfs/dbraw/zinc/61/18/97/402611897.db2.gz	ZNKXTGVICNQUCR-ZDUSSCGKSA-N	0	3	317.368	2.083	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@H]1CCCc2cccnc21	ZINC000248895027	402613521	/nfs/dbraw/zinc/61/35/21/402613521.db2.gz	XGTAZBUBTFITEE-CVEARBPZSA-N	0	3	301.434	2.444	10	0		DEAEHN
CCn1cc([C@@H](C)N[C@@H]2CCc3nnc(C(C)C)n3C2)cn1	ZINC000180535833	402619189	/nfs/dbraw/zinc/61/91/89/402619189.db2.gz	KSRQWBZHUKEVRW-TZMCWYRMSA-N	0	3	302.426	2.284	10	0		DEAEHN
CCc1cc(NC(=O)C(=O)NC[C@H]2CCCN2CC)ccc1C	ZINC000180598340	402620917	/nfs/dbraw/zinc/62/09/17/402620917.db2.gz	LGRWLSHMRNKKMM-MRXNPFEDSA-N	0	3	317.433	2.096	10	0		DEAEHN
CCc1nc2n(n1)C[C@H](N[C@H](C)c1ccc3c(c1)OCO3)CC2	ZINC000180631097	402621930	/nfs/dbraw/zinc/62/19/30/402621930.db2.gz	HHTZGNZWDLINLF-DGCLKSJQSA-N	0	3	314.389	2.235	10	0		DEAEHN
CC[C@H](N[C@H]1CCc2nc(C(C)C)nn2C1)c1cnn(C)c1	ZINC000180650848	402622444	/nfs/dbraw/zinc/62/24/44/402622444.db2.gz	NTBXPJJNORSZPJ-KBPBESRZSA-N	0	3	302.426	2.191	10	0		DEAEHN
COc1cc(Br)ccc1CNC1(CO)CCC1	ZINC000180961907	402631101	/nfs/dbraw/zinc/63/11/01/402631101.db2.gz	FFBPPDUHFQYWOO-UHFFFAOYSA-N	0	3	300.196	2.462	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@@H](C)c1cccs1	ZINC000171898132	402632663	/nfs/dbraw/zinc/63/26/63/402632663.db2.gz	KSLZLSGVLSSPQS-STQMWFEESA-N	0	3	311.451	2.219	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cnn([C@H](C)C3CC3)c2)C1	ZINC000249522749	402632743	/nfs/dbraw/zinc/63/27/43/402632743.db2.gz	WJQMRUUFMVHCKI-TZMCWYRMSA-N	0	3	305.426	2.460	10	0		DEAEHN
Cc1cccc(CNC(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)n1	ZINC000249614027	402636846	/nfs/dbraw/zinc/63/68/46/402636846.db2.gz	WXBNGGKUEUFGFS-UKRRQHHQSA-N	0	3	304.438	2.310	10	0		DEAEHN
Cn1c(CN2CCC(c3ccn[nH]3)CC2)nnc1C1CCC1	ZINC000181209311	402637975	/nfs/dbraw/zinc/63/79/75/402637975.db2.gz	VSAJOZQENLNVCQ-UHFFFAOYSA-N	0	3	300.410	2.185	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)N1CC[C@H](C)[C@@H](OC)C1	ZINC000252061382	402652799	/nfs/dbraw/zinc/65/27/99/402652799.db2.gz	ZYKBTBBSEZUACJ-XHSDSOJGSA-N	0	3	311.470	2.317	10	0		DEAEHN
O=C(Cc1ccccc1OC(F)F)N1CCN2CCC[C@@H]2C1	ZINC000172380125	402653421	/nfs/dbraw/zinc/65/34/21/402653421.db2.gz	JMXHHXDEFWEHTH-CYBMUJFWSA-N	0	3	310.344	2.137	10	0		DEAEHN
COc1cccc(CN[C@@H]2CCN(c3ccccc3OC)C2)n1	ZINC000191314588	402660186	/nfs/dbraw/zinc/66/01/86/402660186.db2.gz	YMRBSUNGWCNXRH-OAHLLOKOSA-N	0	3	313.401	2.467	10	0		DEAEHN
Cc1cccc(C)c1OCCCN1CC[C@H](N2CCOCC2)C1	ZINC000173950950	402721287	/nfs/dbraw/zinc/72/12/87/402721287.db2.gz	DSFZUCUDRSCZQW-SFHVURJKSA-N	0	3	318.461	2.479	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2ccc3c(c2)OCCCO3)CCN1C	ZINC000172621996	402667157	/nfs/dbraw/zinc/66/71/57/402667157.db2.gz	OIQAAYGFKLSIMB-DZGCQCFKSA-N	0	3	318.417	2.403	10	0		DEAEHN
Cc1ccc(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c(=O)[nH]1	ZINC000253556121	402668670	/nfs/dbraw/zinc/66/86/70/402668670.db2.gz	JPFCHXYBOIJEFF-HOTGVXAUSA-N	0	3	311.385	2.271	10	0		DEAEHN
CC[C@@H](NC(=O)Nc1ccn(CCN(C)C)n1)c1nccs1	ZINC000173922820	402719336	/nfs/dbraw/zinc/71/93/36/402719336.db2.gz	HGPMRHPDCPSTIS-LLVKDONJSA-N	0	3	322.438	2.174	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)NC/C=C\c1ccccc1	ZINC000255005708	402675229	/nfs/dbraw/zinc/67/52/29/402675229.db2.gz	MPFCCUWGXPHMAH-OOYWPUHTSA-N	0	3	317.433	2.110	10	0		DEAEHN
Cc1ccc(C)c(OCCN2CC[C@H](N3CCOCC3)C2)c1	ZINC000173925138	402719597	/nfs/dbraw/zinc/71/95/97/402719597.db2.gz	GGVLVICNECBAKA-KRWDZBQOSA-N	0	3	304.434	2.089	10	0		DEAEHN
CCN(CCNC(=O)c1cnn(CCC(F)(F)F)c1)C1CC1	ZINC000182320774	402680559	/nfs/dbraw/zinc/68/05/59/402680559.db2.gz	VPEBJCJYKNXAMY-UHFFFAOYSA-N	0	3	318.343	2.050	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)[C@@H](C)N1CCCCCC1	ZINC000173490758	402700064	/nfs/dbraw/zinc/70/00/64/402700064.db2.gz	ADRYIRLHYNDJAT-CZUORRHYSA-N	0	3	320.481	2.349	10	0		DEAEHN
Cc1ccc([C@H](CNC(=O)[C@H]2CCOC[C@@H]2C)N(C)C)cc1	ZINC000192455974	402730245	/nfs/dbraw/zinc/73/02/45/402730245.db2.gz	PMUROGIIBRWQBQ-XIRDDKMYSA-N	0	3	304.434	2.387	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1CN1CCN(c2ccc3nncn3n2)CC1	ZINC000183054549	402735621	/nfs/dbraw/zinc/73/56/21/402735621.db2.gz	UIQXKNZYPZUDAV-HUUCEWRRSA-N	0	3	314.437	2.073	10	0		DEAEHN
CCCOc1ccc(CNC(=O)CN[C@H](C)[C@@H]2CCCO2)cc1	ZINC000183138586	402742420	/nfs/dbraw/zinc/74/24/20/402742420.db2.gz	MDYGCSMXTCAVSD-PBHICJAKSA-N	0	3	320.433	2.249	10	0		DEAEHN
CCCOc1cccc(CNC(=O)CN[C@H](C)[C@@H]2CCCO2)c1	ZINC000183222201	402748274	/nfs/dbraw/zinc/74/82/74/402748274.db2.gz	GKJFHSFWWKIBND-PBHICJAKSA-N	0	3	320.433	2.249	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)c2cc(C)oc2C)[C@H](C)C1	ZINC000183233651	402748933	/nfs/dbraw/zinc/74/89/33/402748933.db2.gz	IOLIOBUVEOPTCL-RISCZKNCSA-N	0	3	314.451	2.247	10	0		DEAEHN
CN(C)CCOc1cc(C(=O)NCCC2=CCCC2)ccn1	ZINC000183246454	402749789	/nfs/dbraw/zinc/74/97/89/402749789.db2.gz	JGIHLXPFAFRGCZ-UHFFFAOYSA-N	0	3	303.406	2.252	10	0		DEAEHN
CC[C@@H]1CN(c2ccccc2)CCN1CCN1CCO[C@H](C)C1	ZINC000192798953	402750449	/nfs/dbraw/zinc/75/04/49/402750449.db2.gz	HFAQZXLSBFGSKK-QZTJIDSGSA-N	0	3	317.477	2.308	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(C(C)(C)c2ccccc2F)n1	ZINC000263312619	402757414	/nfs/dbraw/zinc/75/74/14/402757414.db2.gz	YZOWVTYAXHROMK-ZDUSSCGKSA-N	0	3	304.369	2.111	10	0		DEAEHN
C[C@H](OC1CCCCCC1)c1nc([C@H]2CNCCN2C)no1	ZINC000263318512	402758430	/nfs/dbraw/zinc/75/84/30/402758430.db2.gz	ZVWCKBLWZSXJOO-GXTWGEPZSA-N	0	3	308.426	2.446	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NC(=O)N2CC[C@H](N(C)C)C2)C12CCCC2	ZINC000173515808	286263175	/nfs/dbraw/zinc/26/31/75/286263175.db2.gz	WRDLWWKWPIGEDS-RRFJBIMHSA-N	0	3	309.454	2.070	10	0		DEAEHN
CCc1nc([C@@H](C)NC(=O)N2CC[C@H](N3CC=CC3)C2)cs1	ZINC000174847738	402760156	/nfs/dbraw/zinc/76/01/56/402760156.db2.gz	QOCGHIOLTHHKMW-OLZOCXBDSA-N	0	3	320.462	2.422	10	0		DEAEHN
COc1cc(C(=O)N2CCN3CCC[C@@H]3C2)ccc1OC(C)C	ZINC000195314353	402841879	/nfs/dbraw/zinc/84/18/79/402841879.db2.gz	PWFJBDVQEGTURB-OAHLLOKOSA-N	0	3	318.417	2.403	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc(C(=O)OC)cc2)C1	ZINC000194340419	402792977	/nfs/dbraw/zinc/79/29/77/402792977.db2.gz	AJJBSQBUTKUQSS-AWEZNQCLSA-N	0	3	305.378	2.079	10	0		DEAEHN
CC[C@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccncc1	ZINC000175311107	402796532	/nfs/dbraw/zinc/79/65/32/402796532.db2.gz	HAAXUJRIGGDVKW-HOTGVXAUSA-N	0	3	300.406	2.188	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)NCCC1=CCCCC1	ZINC000175341248	402798588	/nfs/dbraw/zinc/79/85/88/402798588.db2.gz	VCIQKHMTNIBICO-KRWDZBQOSA-N	0	3	307.482	2.409	10	0		DEAEHN
CNC(=O)c1ccc(CN2CCCN(c3ccccn3)CC2)cc1	ZINC000183859334	402802471	/nfs/dbraw/zinc/80/24/71/402802471.db2.gz	HMAMANARJVYGEJ-UHFFFAOYSA-N	0	3	324.428	2.154	10	0		DEAEHN
O=C(c1cnc(-c2ccccc2)nc1)N1CCN2CCC[C@H]2C1	ZINC000195338057	402842864	/nfs/dbraw/zinc/84/28/64/402842864.db2.gz	GSKCEQVWPAHKJE-INIZCTEOSA-N	0	3	308.385	2.064	10	0		DEAEHN
CC1(C)CN(C(=O)Cc2coc(-c3ccc(F)cc3)n2)CCN1	ZINC000175436842	402806547	/nfs/dbraw/zinc/80/65/47/402806547.db2.gz	QTIXUWMCYCBPGN-UHFFFAOYSA-N	0	3	317.364	2.234	10	0		DEAEHN
CCN(CCO)CCNC(=O)CC1CCC(C(F)(F)F)CC1	ZINC000183940074	402806977	/nfs/dbraw/zinc/80/69/77/402806977.db2.gz	IPENCCAUWQMDRG-UHFFFAOYSA-N	0	3	324.387	2.176	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccc(NC(=O)C(C)C)cc2)C1	ZINC000194656406	402808118	/nfs/dbraw/zinc/80/81/18/402808118.db2.gz	SGVAJZMRUVKVHJ-INIZCTEOSA-N	0	3	317.433	2.495	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cc(F)cc(Br)c1	ZINC000194698412	402811083	/nfs/dbraw/zinc/81/10/83/402811083.db2.gz	DGTQHLOPYAIUDX-LBPRGKRZSA-N	0	3	315.186	2.412	10	0		DEAEHN
CC(C)c1noc2ncc(C(=O)NC[C@@H]3CCCN3C)cc21	ZINC000194715546	402812371	/nfs/dbraw/zinc/81/23/71/402812371.db2.gz	GUJORWFFSPEMOQ-LBPRGKRZSA-N	0	3	302.378	2.170	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)C2=Cc3cccc(OC)c3OC2)C1	ZINC000194827706	402817514	/nfs/dbraw/zinc/81/75/14/402817514.db2.gz	HYHXGBAISFUYRZ-OAHLLOKOSA-N	0	3	316.401	2.072	10	0		DEAEHN
CCN1CCN(c2cccc(NC(=O)C(C)(C)OC)c2)CC1	ZINC000184263401	402831549	/nfs/dbraw/zinc/83/15/49/402831549.db2.gz	XQAPNODVFQYULM-UHFFFAOYSA-N	0	3	305.422	2.192	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC[C@H](CC(=O)OC(C)C)C1)N(C)C	ZINC000184283617	402832536	/nfs/dbraw/zinc/83/25/36/402832536.db2.gz	DNUDAGWIHZYYLC-HUUCEWRRSA-N	0	3	312.454	2.297	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)Nc1ccc([S@](C)=O)cc1	ZINC000175787737	402833018	/nfs/dbraw/zinc/83/30/18/402833018.db2.gz	PJLAWZLDQUJMTB-DMZKTXOQSA-N	0	3	323.462	2.420	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCC[C@H](c2nnc(C3CC3)[nH]2)C1	ZINC000195206658	402836392	/nfs/dbraw/zinc/83/63/92/402836392.db2.gz	NAROCYUJUKZADN-GJZGRUSLSA-N	0	3	322.453	2.039	10	0		DEAEHN
CCn1cc(C2CCN(C[C@@H](O)COC(C)(C)C)CC2)cn1	ZINC000195513145	402848632	/nfs/dbraw/zinc/84/86/32/402848632.db2.gz	BIQGPXQUMQGZDB-MRXNPFEDSA-N	0	3	309.454	2.258	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@H](C)N1CC[C@H](CNc2ccccn2)C1	ZINC000195515880	402848807	/nfs/dbraw/zinc/84/88/07/402848807.db2.gz	BFPAPIHJEYMPMR-SOUVJXGZSA-N	0	3	304.438	2.119	10	0		DEAEHN
C[C@H](CCc1cccn1C)NC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000176032867	402849062	/nfs/dbraw/zinc/84/90/62/402849062.db2.gz	MIIVFEZUQLKJNV-NVXWUHKLSA-N	0	3	316.449	2.002	10	0		DEAEHN
COc1cccc(Cl)c1CC(=O)N1CCN2CCC[C@@H]2C1	ZINC000184528680	402849328	/nfs/dbraw/zinc/84/93/28/402849328.db2.gz	QLBFJDPUVKVYDG-GFCCVEGCSA-N	0	3	308.809	2.198	10	0		DEAEHN
C[C@H](O)CN1CCN(c2ncnc3cc(Cl)ccc32)C[C@H]1C	ZINC000264353950	402870602	/nfs/dbraw/zinc/87/06/02/402870602.db2.gz	STGBAFBBYNQXQY-NEPJUHHUSA-N	0	3	320.824	2.175	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)NCCN2CCC[C@H](C)C2)cc1	ZINC000279541199	402953791	/nfs/dbraw/zinc/95/37/91/402953791.db2.gz	QCLXIATYWMHRDF-AWEZNQCLSA-N	0	3	317.433	2.131	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2cc(OC)cc(C)n2)C12CCOCC2	ZINC000274400819	403051946	/nfs/dbraw/zinc/05/19/46/403051946.db2.gz	FPSDKJARBAGNJF-DLBZAZTESA-N	0	3	320.433	2.462	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@@H]1NCc1cc(Br)cs1	ZINC000282361480	403146688	/nfs/dbraw/zinc/14/66/88/403146688.db2.gz	NHVRDBYZWMLTTP-XVKPBYJWSA-N	0	3	303.225	2.267	10	0		DEAEHN
CC(=O)N(C[C@H]1CCCN1C[C@@H](O)Cc1ccccc1)C1CC1	ZINC000276598371	403190094	/nfs/dbraw/zinc/19/00/94/403190094.db2.gz	VHMPSIYCEBJHRS-MOPGFXCFSA-N	0	3	316.445	2.065	10	0		DEAEHN
Cc1cc(N2CCO[C@@H](CO)C2)c2cc(OC(F)F)ccc2n1	ZINC000301564306	403648703	/nfs/dbraw/zinc/64/87/03/403648703.db2.gz	PONLMGDQKBNHTM-GFCCVEGCSA-N	0	3	324.327	2.342	10	0		DEAEHN
O=C(Nc1ccc2cc[nH]c(=O)c2c1)N1CCN2CCC[C@@H]2C1	ZINC000333368946	403735906	/nfs/dbraw/zinc/73/59/06/403735906.db2.gz	IQGZANJVSVLDOL-CQSZACIVSA-N	0	3	312.373	2.252	10	0		DEAEHN
C(CN1CCO[C@H](C2CCC2)C1)CN1CCO[C@H](C2CCC2)C1	ZINC000411846675	403991352	/nfs/dbraw/zinc/99/13/52/403991352.db2.gz	LWVGOQBOUVHEQM-OALUTQOASA-N	0	3	322.493	2.378	10	0		DEAEHN
C(CN1CCO[C@H](C2CCC2)C1)CN1CCO[C@@H](C2CCC2)C1	ZINC000411846662	403992197	/nfs/dbraw/zinc/99/21/97/403992197.db2.gz	LWVGOQBOUVHEQM-KDURUIRLSA-N	0	3	322.493	2.378	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)c2ncccc2N)C1	ZINC000323645333	404092130	/nfs/dbraw/zinc/09/21/30/404092130.db2.gz	SRGDNDLNJUTHKG-OAHLLOKOSA-N	0	3	324.428	2.258	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)CCN(C[C@H](O)C(F)(F)F)C1	ZINC000323892156	404096385	/nfs/dbraw/zinc/09/63/85/404096385.db2.gz	GALHLXGFMIILOJ-ZFWWWQNUSA-N	0	3	316.367	2.364	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N[C@H]1CCc3ncnn3C1)CCCO2	ZINC000180604066	286429879	/nfs/dbraw/zinc/42/98/79/286429879.db2.gz	WRUZMHUAFYMUIX-SWLSCSKDSA-N	0	3	314.389	2.105	10	0		DEAEHN
C[C@H]1CN(C2CCOCC2)CCN1CCOc1ccc(F)cc1	ZINC000369631961	404173454	/nfs/dbraw/zinc/17/34/54/404173454.db2.gz	VGIYWLHWHSKCIW-HNNXBMFYSA-N	0	3	322.424	2.390	10	0		DEAEHN
CO[C@@H]1COC[C@H]1n1cc(CN[C@@H]2CCCC[C@@H]2C(C)C)nn1	ZINC000329509975	404361965	/nfs/dbraw/zinc/36/19/65/404361965.db2.gz	JVJUSDKWYLQUSO-QBPKDAKJSA-N	0	3	322.453	2.169	10	0		DEAEHN
Cc1noc([C@H]2CCN(Cc3ccc(-n4cncn4)c(C)c3)C2)n1	ZINC000344826135	404389866	/nfs/dbraw/zinc/38/98/66/404389866.db2.gz	KRJUXRVWPSIQQG-HNNXBMFYSA-N	0	3	324.388	2.257	10	0		DEAEHN
CCn1nccc1CCN1C[C@@H](O)C[C@@H]1c1ccc(F)cc1	ZINC000338569242	404409624	/nfs/dbraw/zinc/40/96/24/404409624.db2.gz	HSXMQAAJBKFNPH-DLBZAZTESA-N	0	3	303.381	2.393	10	0		DEAEHN
CC(=O)N1CC[C@@H](NCC2(C)OCCCO2)c2ccccc2C1	ZINC000373805650	404595356	/nfs/dbraw/zinc/59/53/56/404595356.db2.gz	FTDCXYFPKMHUAG-QGZVFWFLSA-N	0	3	318.417	2.223	10	0		DEAEHN
CCn1cc(CCN2CC[C@@H](c3nc(C4CC4)no3)C2)cn1	ZINC000375701872	404730989	/nfs/dbraw/zinc/73/09/89/404730989.db2.gz	PXXDODSBDGOTIV-CQSZACIVSA-N	0	3	301.394	2.195	10	0		DEAEHN
c1ccc(OCCN2CCC(c3nnc4n3CCC4)CC2)cc1	ZINC000375769277	404743210	/nfs/dbraw/zinc/74/32/10/404743210.db2.gz	FKMXPRIAKNXGLL-UHFFFAOYSA-N	0	3	312.417	2.483	10	0		DEAEHN
CCCCN(C)CCNC(=O)C(=O)N1CCC2(C1)CCCCC2	ZINC000357972566	404749749	/nfs/dbraw/zinc/74/97/49/404749749.db2.gz	IVLVOJGJRRWPOT-UHFFFAOYSA-N	0	3	323.481	2.017	10	0		DEAEHN
C[C@@H](C(=O)N1C[C@@]2(CCOC2)OC(C)(C)C1)N1CCCCCC1	ZINC000358228813	404757095	/nfs/dbraw/zinc/75/70/95/404757095.db2.gz	SZPPYKBPZFRRNA-MAUKXSAKSA-N	0	3	324.465	2.047	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCc2c(cccc2OC)C1	ZINC000360891982	404846599	/nfs/dbraw/zinc/84/65/99/404846599.db2.gz	UXVASBNDHLVGIW-MRXNPFEDSA-N	0	3	302.418	2.454	10	0		DEAEHN
C/C=C/CNC[C@H](O)COc1cccc(Br)c1	ZINC000385061322	405034112	/nfs/dbraw/zinc/03/41/12/405034112.db2.gz	UUUWVNDJSZSAHF-JDGPPOGSSA-N	0	3	300.196	2.355	10	0		DEAEHN
CN(C)CCOc1cccc(CNC(=O)N2CCC23CCC3)c1	ZINC000435586537	404993286	/nfs/dbraw/zinc/99/32/86/404993286.db2.gz	ZJSAXGQRRUCONR-UHFFFAOYSA-N	0	3	317.433	2.465	10	0		DEAEHN
Cn1ncc(Cl)c1CNCC[C@@H]1COc2ccccc2O1	ZINC000436316284	405069882	/nfs/dbraw/zinc/06/98/82/405069882.db2.gz	RRAVUBUXGAECIP-LLVKDONJSA-N	0	3	307.781	2.393	10	0		DEAEHN
C/C=C\C[C@H](NC(=O)c1cccc(CN(C)C)c1)C(=O)OCC	ZINC000361570820	405134909	/nfs/dbraw/zinc/13/49/09/405134909.db2.gz	YNBRFAPSFDTTSF-WRLNGNIRSA-N	0	3	318.417	2.376	10	0		DEAEHN
CCOc1cccc(CN(CCO)C[C@H](O)CC(F)(F)F)c1	ZINC000452050414	405142443	/nfs/dbraw/zinc/14/24/43/405142443.db2.gz	VFYLERUEMNITQX-CYBMUJFWSA-N	0	3	321.339	2.193	10	0		DEAEHN
C[C@@H]1CN(CCO)CCN1CCn1ccc2cc(Cl)ccc21	ZINC000452136162	405192287	/nfs/dbraw/zinc/19/22/87/405192287.db2.gz	XMFQBNZMAZUYMD-CQSZACIVSA-N	0	3	321.852	2.293	10	0		DEAEHN
C[NH+](C)[C@@H]1CCCN(C(=O)c2ccc3c(c2[O-])OC(C)(C)C3)C1	ZINC000408404810	405197378	/nfs/dbraw/zinc/19/73/78/405197378.db2.gz	ARCJUPIJNITBEO-CYBMUJFWSA-N	0	3	318.417	2.272	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@@H]1C[C@@H]1c1cccc(F)c1F	ZINC000439044799	405263593	/nfs/dbraw/zinc/26/35/93/405263593.db2.gz	ZXJFMQXEYRVKPQ-ZIAGYGMSSA-N	0	3	317.339	2.114	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC000439044798	405263678	/nfs/dbraw/zinc/26/36/78/405263678.db2.gz	ZXJFMQXEYRVKPQ-UONOGXRCSA-N	0	3	317.339	2.114	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@H]1C[C@H]1c1cc(F)ccc1F	ZINC000439042172	405263743	/nfs/dbraw/zinc/26/37/43/405263743.db2.gz	JUAHLCKECSCABA-ZFWWWQNUSA-N	0	3	317.339	2.114	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCc1csc([C@H](C)OC)n1	ZINC000438411458	405245860	/nfs/dbraw/zinc/24/58/60/405245860.db2.gz	YRFZMHMISQHANB-AAEUAGOBSA-N	0	3	311.451	2.341	10	0		DEAEHN
C[C@@H](NCCc1cn(C)cn1)c1cncc(Br)c1	ZINC000577627587	405483210	/nfs/dbraw/zinc/48/32/10/405483210.db2.gz	BJWHGQRFUDKNEO-SNVBAGLBSA-N	0	3	309.211	2.471	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2coc3ccccc23)CC12COC2	ZINC000449363594	405525474	/nfs/dbraw/zinc/52/54/74/405525474.db2.gz	MJRIATRKQKRYEE-HNNXBMFYSA-N	0	3	315.369	2.444	10	0		DEAEHN
CN1CC[C@@H]2CN(Cc3ncc(Br)s3)C[C@@H]21	ZINC000449520590	405594758	/nfs/dbraw/zinc/59/47/58/405594758.db2.gz	GCAGZOFXHZKRGW-BDAKNGLRSA-N	0	3	302.241	2.042	10	0		DEAEHN
O=C([C@H]1CNCCC1(F)F)N1CCC[C@@H](C(F)(F)F)C1	ZINC000638992455	405805375	/nfs/dbraw/zinc/80/53/75/405805375.db2.gz	DUZHTVMCHIGYRG-RKDXNWHRSA-N	0	3	300.271	2.032	10	0		DEAEHN
CO[C@@H](C)[C@@H](C)NC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000584086342	405820491	/nfs/dbraw/zinc/82/04/91/405820491.db2.gz	FIEQKSAUIHBIPU-VYDXJSESSA-N	0	3	319.449	2.374	10	0		DEAEHN
CCn1nncc1CN1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000459362300	405872418	/nfs/dbraw/zinc/87/24/18/405872418.db2.gz	PXCMWCCTNYWSPW-INIZCTEOSA-N	0	3	313.449	2.394	10	0		DEAEHN
c1ccc(N2CC[C@H](CN3CCO[C@@]4(CCCOC4)C3)C2)cc1	ZINC000639157392	405932828	/nfs/dbraw/zinc/93/28/28/405932828.db2.gz	NDTFHEPRWOPFQL-MJGOQNOKSA-N	0	3	316.445	2.394	10	0		DEAEHN
CC(=O)[C@](C)(O)CN(C)CCc1cccc(Br)c1	ZINC000451059723	406032960	/nfs/dbraw/zinc/03/29/60/406032960.db2.gz	OAMPZCABGNEYEW-CQSZACIVSA-N	0	3	314.223	2.263	10	0		DEAEHN
CCN(C)C(=O)CCN1CCC[C@@H](CC(=O)OC(C)(C)C)C1	ZINC000533207972	406129803	/nfs/dbraw/zinc/12/98/03/406129803.db2.gz	ZVRAWRVSCKWAKJ-AWEZNQCLSA-N	0	3	312.454	2.299	10	0		DEAEHN
c1cn(-c2ccc(CN3CC[C@H](Nc4ncccn4)C3)cc2)cn1	ZINC000567905305	406158443	/nfs/dbraw/zinc/15/84/43/406158443.db2.gz	QZATVZQEEGBSLA-INIZCTEOSA-N	0	3	320.400	2.349	10	0		DEAEHN
C/C(=C/c1ccccc1)CN(C)C[C@@H](O)CC1(O)CCOCC1	ZINC000639633661	406179930	/nfs/dbraw/zinc/17/99/30/406179930.db2.gz	OORLCSYAEXHSPK-XOQYZJNISA-N	0	3	319.445	2.314	10	0		DEAEHN
Cc1cc(C)c([C@H](C)[N@@H+]2CCC[C@]3(C2)NC(=O)[N-]C3=O)c(C)c1	ZINC000568160814	406199228	/nfs/dbraw/zinc/19/92/28/406199228.db2.gz	SOHSLSNPXMAYFD-KBXCAEBGSA-N	0	3	315.417	2.347	10	0		DEAEHN
Cc1cc(C)c([C@H](C)[N@H+]2CCC[C@]3(C2)NC(=O)[N-]C3=O)c(C)c1	ZINC000568160814	406199231	/nfs/dbraw/zinc/19/92/31/406199231.db2.gz	SOHSLSNPXMAYFD-KBXCAEBGSA-N	0	3	315.417	2.347	10	0		DEAEHN
COC[C@H](O)CN1CCC(C(=O)c2ccc(C)cc2C)CC1	ZINC000536642478	406271980	/nfs/dbraw/zinc/27/19/80/406271980.db2.gz	HUDZPAVBGCJWBH-MRXNPFEDSA-N	0	3	305.418	2.205	10	0		DEAEHN
CN(C)CCOCCNC(=O)c1cc(Cl)sc1Cl	ZINC000537545542	406292854	/nfs/dbraw/zinc/29/28/54/406292854.db2.gz	AIAHISFAOPEJIG-UHFFFAOYSA-N	0	3	311.234	2.363	10	0		DEAEHN
Cc1ccc(CNC(=O)[C@H](N)CN(C)Cc2ccccc2)cc1	ZINC000637875598	406458080	/nfs/dbraw/zinc/45/80/80/406458080.db2.gz	LKUZUCZNADFOPJ-GOSISDBHSA-N	0	3	311.429	2.071	10	0		DEAEHN
C[C@@H](NC(=O)[C@H](N)CN(C)Cc1ccccc1)C1CCCC1	ZINC000637990000	406513146	/nfs/dbraw/zinc/51/31/46/406513146.db2.gz	CPMCTOWDFFOGTR-RHSMWYFYSA-N	0	3	303.450	2.141	10	0		DEAEHN
CC[C@H](C)C[C@@H](C)NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638002290	406518106	/nfs/dbraw/zinc/51/81/06/406518106.db2.gz	CRTHHPYPZCKSHL-UXLLHSPISA-N	0	3	305.466	2.387	10	0		DEAEHN
Cc1nc2ccccc2n1CCC(=O)NCCN1CC[C@@H](C)C1	ZINC000548452627	406518220	/nfs/dbraw/zinc/51/82/20/406518220.db2.gz	RQNBWNPREYUFAS-CQSZACIVSA-N	0	3	314.433	2.193	10	0		DEAEHN
Cc1nn(C)c2ncc(CNC[C@H](CO)c3ccccc3)cc12	ZINC000572504880	406682418	/nfs/dbraw/zinc/68/24/18/406682418.db2.gz	MUNFONLUKUULJR-MRXNPFEDSA-N	0	3	310.401	2.142	10	0		DEAEHN
O[C@H](COC[C@H]1CCCO1)CN1CC[C@@H](c2cccc(F)c2)C1	ZINC000552254107	406699403	/nfs/dbraw/zinc/69/94/03/406699403.db2.gz	MHIKUCADSPTKAX-BPQIPLTHSA-N	0	3	323.408	2.172	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N1CCC[C@@H](CCF)C1	ZINC000638420924	406762449	/nfs/dbraw/zinc/76/24/49/406762449.db2.gz	WKNXTOQJYBBGJV-DLBZAZTESA-N	0	3	321.440	2.044	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CC[C@@H]2CCCC[C@@H]21	ZINC000638370499	406730517	/nfs/dbraw/zinc/73/05/17/406730517.db2.gz	KVFCIMKACVHDLO-BZSNNMDCSA-N	0	3	315.461	2.237	10	0		DEAEHN
C[C@@H](c1ccccc1)[C@@](C)(O)C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000176307820	287148676	/nfs/dbraw/zinc/14/86/76/287148676.db2.gz	VZTMZTUKOFYDFL-LORHWOILSA-N	0	3	316.445	2.236	10	0		DEAEHN
CC(C)CN1CCC[C@@H]1CNC(=O)C(=O)Nc1cccc(F)c1	ZINC000129306207	196037123	/nfs/dbraw/zinc/03/71/23/196037123.db2.gz	NVUYASDSOAANTF-OAHLLOKOSA-N	0	3	321.396	2.001	10	0		DEAEHN
CCN(CC)c1ncc(CNCC[C@H](C)[S@](C)=O)s1	ZINC000129399270	196044675	/nfs/dbraw/zinc/04/46/75/196044675.db2.gz	MZEBODCLPCSDEG-JEOXALJRSA-N	0	3	303.497	2.236	10	0		DEAEHN
COc1ccc(Oc2nnccc2CN)c(Br)c1	ZINC000129493752	196053334	/nfs/dbraw/zinc/05/33/34/196053334.db2.gz	KGTPDHGSUKHJKM-UHFFFAOYSA-N	0	3	310.151	2.499	10	0		DEAEHN
O=S1(=O)CC[C@H](CN[C@@H]2CCc3sc(Cl)cc32)C1	ZINC000129595191	196060783	/nfs/dbraw/zinc/06/07/83/196060783.db2.gz	SQPNIPBJEZZGPX-PSASIEDQSA-N	0	3	305.852	2.413	10	0		DEAEHN
O=S1(=O)CC[C@H](CN[C@H]2CCc3sc(Cl)cc32)C1	ZINC000129595013	196060797	/nfs/dbraw/zinc/06/07/97/196060797.db2.gz	SQPNIPBJEZZGPX-SCZZXKLOSA-N	0	3	305.852	2.413	10	0		DEAEHN
C[C@@H](NC(=O)C(C)(C)N1CCNCC1)c1ccc(Cl)s1	ZINC000129624657	196063050	/nfs/dbraw/zinc/06/30/50/196063050.db2.gz	DLZFRRRBYITZDB-SNVBAGLBSA-N	0	3	315.870	2.263	10	0		DEAEHN
O=C1C[C@@H](NCCCCC(F)(F)F)C(=O)N1C1CCCC1	ZINC000130550238	196089273	/nfs/dbraw/zinc/08/92/73/196089273.db2.gz	YXDABZUQBCMBEH-LLVKDONJSA-N	0	3	306.328	2.379	10	0		DEAEHN
CCCn1ncnc1C[C@@H](NC)c1ccc(Br)cn1	ZINC000130846197	196114795	/nfs/dbraw/zinc/11/47/95/196114795.db2.gz	CSFKCXDGFIDCSW-GFCCVEGCSA-N	0	3	324.226	2.349	10	0		DEAEHN
CNc1nc(NCCCC(F)(F)F)nc(N2CCCC2)n1	ZINC000131260768	196155437	/nfs/dbraw/zinc/15/54/37/196155437.db2.gz	UIXRJXJAHYDVHJ-UHFFFAOYSA-N	0	3	304.320	2.268	10	0		DEAEHN
CCN(CC)c1nc(N)nc(NCCCCC(F)(F)F)n1	ZINC000131269513	196156130	/nfs/dbraw/zinc/15/61/30/196156130.db2.gz	CTEUFAAJTHZCRN-UHFFFAOYSA-N	0	3	306.336	2.445	10	0		DEAEHN
O[C@H](CN[C@@H]1CCOC1)COc1c(Cl)cccc1Cl	ZINC000131466721	196171312	/nfs/dbraw/zinc/17/13/12/196171312.db2.gz	FVNCWMJHFAKWAX-NXEZZACHSA-N	0	3	306.189	2.112	10	0		DEAEHN
CNCc1sccc1S(=O)(=O)N1CC[C@@H](C)[C@@H](C)C1	ZINC000131777223	196198485	/nfs/dbraw/zinc/19/84/85/196198485.db2.gz	FRJHOZFOHHWKON-MNOVXSKESA-N	0	3	302.465	2.134	10	0		DEAEHN
CNc1ncc(Br)c(NC[C@H]2CCCN(C)C2)n1	ZINC000131952874	196213830	/nfs/dbraw/zinc/21/38/30/196213830.db2.gz	GHGFHWZIOBCDGJ-SECBINFHSA-N	0	3	314.231	2.035	10	0		DEAEHN
NC1(C(=O)Nc2nc3ccc(Cl)cc3s2)CCOCC1	ZINC000132058262	196223486	/nfs/dbraw/zinc/22/34/86/196223486.db2.gz	BBUJWFHREYKQPA-UHFFFAOYSA-N	0	3	311.794	2.396	10	0		DEAEHN
NC1(C(=O)Nc2cc(C(F)(F)F)ccc2F)CCOCC1	ZINC000132254106	196239023	/nfs/dbraw/zinc/23/90/23/196239023.db2.gz	KKYNIHPOIIKWRN-UHFFFAOYSA-N	0	3	306.259	2.291	10	0		DEAEHN
O=C(N[C@@H]1CCC[C@@H](OCC(F)(F)F)C1)[C@H]1CCCCN1	ZINC000132326380	196246373	/nfs/dbraw/zinc/24/63/73/196246373.db2.gz	CCWZKWOKQFNBOC-IJLUTSLNSA-N	0	3	308.344	2.135	10	0		DEAEHN
O=C(C[C@H]1CSCCN1)N1CCC[C@@H]1Cc1cccc(F)c1	ZINC000132581162	196267175	/nfs/dbraw/zinc/26/71/75/196267175.db2.gz	WJQHRHRWXPNKGG-JKSUJKDBSA-N	0	3	322.449	2.454	10	0		DEAEHN
CC[C@H](NCCNC(N)=O)c1cccc(Br)c1	ZINC000132744868	196280097	/nfs/dbraw/zinc/28/00/97/196280097.db2.gz	UTASHCMCZXGVGP-NSHDSACASA-N	0	3	300.200	2.158	10	0		DEAEHN
O=C(NCC1CCN(CCO)CC1)[C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000132983082	196302064	/nfs/dbraw/zinc/30/20/64/196302064.db2.gz	ZCYPLXGQFWYTQB-OKZBNKHCSA-N	0	3	322.493	2.413	10	0		DEAEHN
C[C@@]1(C(=O)Nc2cc3c(cc2Cl)NC(=O)C3)CCCCN1	ZINC000133145713	196315216	/nfs/dbraw/zinc/31/52/16/196315216.db2.gz	GWLUZFJROCDQSX-HNNXBMFYSA-N	0	3	307.781	2.305	10	0		DEAEHN
CCN[C@@H](Cc1ccc(Cl)cc1F)[C@H](C)S(C)(=O)=O	ZINC000134214256	196370792	/nfs/dbraw/zinc/37/07/92/196370792.db2.gz	JUNGLHZLKAIRTN-ZANVPECISA-N	0	3	307.818	2.433	10	0		DEAEHN
CCCN[C@H](Cc1ccc(Cl)cc1F)CS(C)(=O)=O	ZINC000134209100	196371343	/nfs/dbraw/zinc/37/13/43/196371343.db2.gz	RBVAIEGLWLEXDE-GFCCVEGCSA-N	0	3	307.818	2.434	10	0		DEAEHN
N[C@H](Cc1ccc(Cl)cc1F)[C@@H]1CCCCS1(=O)=O	ZINC000134222719	196371971	/nfs/dbraw/zinc/37/19/71/196371971.db2.gz	LGYXDICJTJWYQH-OLZOCXBDSA-N	0	3	305.802	2.316	10	0		DEAEHN
CCNc1nc(N[C@H](CC)CSC)nc(N2CCCC2)n1	ZINC000134269968	196374624	/nfs/dbraw/zinc/37/46/24/196374624.db2.gz	FJFIPDOHTKKYOX-LLVKDONJSA-N	0	3	310.471	2.457	10	0		DEAEHN
CN(C)C(=O)c1ccc(CNC[C@H]2CCO[C@@H]2C(C)(C)C)[nH]1	ZINC000189237069	225047184	/nfs/dbraw/zinc/04/71/84/225047184.db2.gz	ZJCGRHYOSBVDHB-DOMZBBRYSA-N	0	3	307.438	2.257	10	0		DEAEHN
Cc1cc(C(F)(F)F)ccc1CNC[C@H]1CN(C)CCO1	ZINC000190946763	225099096	/nfs/dbraw/zinc/09/90/96/225099096.db2.gz	GUWPXZPCOFEEQC-AWEZNQCLSA-N	0	3	302.340	2.434	10	0		DEAEHN
Cn1ccnc1CC1CCN(CC(=O)N2CCCCCC2)CC1	ZINC000105875662	424849683	/nfs/dbraw/zinc/84/96/83/424849683.db2.gz	GJSGHFAWDIPTFX-UHFFFAOYSA-N	0	3	318.465	2.077	10	0		DEAEHN
O=C(Cc1ccc(OC(F)F)cc1)N1CCN2CCC[C@@H]2C1	ZINC000195319266	424882381	/nfs/dbraw/zinc/88/23/81/424882381.db2.gz	ZTHBYOQLZKYODD-CYBMUJFWSA-N	0	3	310.344	2.137	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)c1nscc1Br	ZINC000404785165	424928782	/nfs/dbraw/zinc/92/87/82/424928782.db2.gz	DYPNRTAPCAPRBH-MRVPVSSYSA-N	0	3	318.240	2.120	10	0		DEAEHN
CCCCCCOCC(=O)Nc1ccn(C2CCN(C)CC2)n1	ZINC000373293994	424886678	/nfs/dbraw/zinc/88/66/78/424886678.db2.gz	WJLSTIOOALXTSK-UHFFFAOYSA-N	0	3	322.453	2.685	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)N(C)C3CCC3)cc2)CC1	ZINC000174495488	267499347	/nfs/dbraw/zinc/49/93/47/267499347.db2.gz	SKRFXXMLZFQBMB-UHFFFAOYSA-N	0	3	301.434	2.453	10	0		DEAEHN
CCN1CC[C@H](NC(=O)c2cc(Br)oc2C)C1	ZINC000396670364	269103510	/nfs/dbraw/zinc/10/35/10/269103510.db2.gz	FVAXLISWIUEXIZ-VIFPVBQESA-N	0	3	301.184	2.175	10	0		DEAEHN
Brc1cnn(C2CCN([C@@H]3CCOC3)CC2)c1	ZINC000363461693	269063179	/nfs/dbraw/zinc/06/31/79/269063179.db2.gz	WSWGBQUETAEGRM-GFCCVEGCSA-N	0	3	300.200	2.071	10	0		DEAEHN
C[C@H](COCc1ccccc1)NC(=O)[C@H]1NCCCC1(C)C	ZINC000390759546	269097865	/nfs/dbraw/zinc/09/78/65/269097865.db2.gz	YRKHMNXDWYXKEC-GDBMZVCRSA-N	0	3	304.434	2.486	10	0		DEAEHN
Cc1oc(Br)cc1C(=O)N(C)C[C@@H]1CCN(C)C1	ZINC000396656766	269103674	/nfs/dbraw/zinc/10/36/74/269103674.db2.gz	QOIUVCQCLHMYAJ-SNVBAGLBSA-N	0	3	315.211	2.374	10	0		DEAEHN
C[C@@H](C1CCN(C)CC1)N(C)C(=O)NCCOCC1CCC1	ZINC000515149449	269345371	/nfs/dbraw/zinc/34/53/71/269345371.db2.gz	SBRBUDWQIHANQD-AWEZNQCLSA-N	0	3	311.470	2.175	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C)N(C)C	ZINC000161802574	276021059	/nfs/dbraw/zinc/02/10/59/276021059.db2.gz	SEGLHAHQSXSERL-IRXDYDNUSA-N	0	3	305.466	2.444	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)Nc1ccccc1C(C)=O	ZINC000177709668	276182877	/nfs/dbraw/zinc/18/28/77/276182877.db2.gz	OXARKRQFNGAALE-HNNXBMFYSA-N	0	3	317.433	2.244	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H](C[C@H](C)O)c1ccccc1)N(C)C	ZINC000245754594	276282132	/nfs/dbraw/zinc/28/21/32/276282132.db2.gz	HJOVRVSQCPHGIA-BHYGNILZSA-N	0	3	306.450	2.388	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1ccc(Cl)cc1	ZINC000032073290	276339796	/nfs/dbraw/zinc/33/97/96/276339796.db2.gz	GKPKDMYNHHZYFE-LLVKDONJSA-N	0	3	304.843	2.349	10	0		DEAEHN
CCc1nc2c(s1)[C@H](N[C@@H]1CCc3ncnn3C1)CCC2	ZINC000180608044	276692614	/nfs/dbraw/zinc/69/26/14/276692614.db2.gz	MLNNSEOPBJTGBV-GHMZBOCLSA-N	0	3	303.435	2.279	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cc(-c3ccc(F)cc3)on2)C1	ZINC000135463156	276873784	/nfs/dbraw/zinc/87/37/84/276873784.db2.gz	HBKYRGIFXNRIPQ-ZDUSSCGKSA-N	0	3	303.337	2.257	10	0		DEAEHN
COC(=O)[C@]1(C)CCCN1CCN(C)Cc1ccc(F)cc1	ZINC000186356426	277143998	/nfs/dbraw/zinc/14/39/98/277143998.db2.gz	LHEKJDDLEOFFCG-KRWDZBQOSA-N	0	3	308.397	2.285	10	0		DEAEHN
C[C@@H](CNC(=O)N1CC[C@@H](C(F)(F)F)[C@H]1C)N(C)C1CC1	ZINC000471823021	278273009	/nfs/dbraw/zinc/27/30/09/278273009.db2.gz	CKKPXMUUACKDRP-HOSYDEDBSA-N	0	3	307.360	2.451	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCC[C@H]1c1cnn(C)c1	ZINC000170896337	279124206	/nfs/dbraw/zinc/12/42/06/279124206.db2.gz	ZVTROSOTPRFTIW-CVEARBPZSA-N	0	3	321.469	2.243	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N[C@@H]1CCC[C@H]2OCC[C@@H]21	ZINC000151575724	279128275	/nfs/dbraw/zinc/12/82/75/279128275.db2.gz	QGPVCBUCEBXUBM-KLHDSHLOSA-N	0	3	311.470	2.220	10	0		DEAEHN
C[C@H](C(=O)N1C[C@H](C)C[C@H](C)C1)N1CCCN(C2CC2)CC1	ZINC000172346185	279210529	/nfs/dbraw/zinc/21/05/29/279210529.db2.gz	RLPOOSGROQRZRC-OWCLPIDISA-N	0	3	307.482	2.050	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)N(C)Cc1cccs1	ZINC000175354152	279300703	/nfs/dbraw/zinc/30/07/03/279300703.db2.gz	PBAPHMGAMUTJNP-CQSZACIVSA-N	0	3	309.479	2.123	10	0		DEAEHN
N[C@H]1Cc2ccccc2N(S(=O)(=O)CCCC(F)(F)F)C1	ZINC000211854743	279691845	/nfs/dbraw/zinc/69/18/45/279691845.db2.gz	KFLWOCYETLKYMS-NSHDSACASA-N	0	3	322.352	2.049	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cnn(C(C)C)c1C	ZINC000245640261	288317196	/nfs/dbraw/zinc/31/71/96/288317196.db2.gz	YJFPZJOXXUBTQD-GJZGRUSLSA-N	0	3	304.438	2.471	10	0		DEAEHN
CCc1nc(C(C)(C)NC(=O)N[C@H](C)CN2CCCCC2)no1	ZINC000442367374	288617076	/nfs/dbraw/zinc/61/70/76/288617076.db2.gz	UAFVSLWDXLNGEU-GFCCVEGCSA-N	0	3	323.441	2.041	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)CCO1	ZINC000245944599	289200182	/nfs/dbraw/zinc/20/01/82/289200182.db2.gz	UKKVCIBZAPYFHI-YYIAUSFCSA-N	0	3	308.466	2.382	10	0		DEAEHN
CN1CC[C@@H](NC(=O)C2CCC(O)CC2)[C@H]1c1ccccc1	ZINC000248747201	290132665	/nfs/dbraw/zinc/13/26/65/290132665.db2.gz	NOZBTFZSKBFZNQ-BHUNQDJPSA-N	0	3	302.418	2.099	10	0		DEAEHN
COC[C@H](NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)C1CC1	ZINC000179207403	293136592	/nfs/dbraw/zinc/13/65/92/293136592.db2.gz	USIURASNTJSNGP-IKGGRYGDSA-N	0	3	317.433	2.156	10	0		DEAEHN
Fc1ccc2c(c1)OCCC[C@H]2N[C@@H]1CCc2ncnn2C1	ZINC000182131655	303132557	/nfs/dbraw/zinc/13/25/57/303132557.db2.gz	VTLSJDZYSYFNEG-TZMCWYRMSA-N	0	3	302.353	2.236	10	0		DEAEHN
Cc1c(C(=O)N2CC[C@H](N(C)C)C2)cnn1-c1ccccc1C	ZINC000170867050	325715919	/nfs/dbraw/zinc/71/59/19/325715919.db2.gz	JECKZVFXQZKNGO-HNNXBMFYSA-N	0	3	312.417	2.265	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(O)ccc1OC	ZINC000188224468	333039443	/nfs/dbraw/zinc/03/94/43/333039443.db2.gz	LRSNRYTXMYQMMH-OLZOCXBDSA-N	0	3	304.390	2.100	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)N3CC[C@@H](N4CCCC4)C3)cc2c1	ZINC000189229265	333066591	/nfs/dbraw/zinc/06/65/91/333066591.db2.gz	BPCZANFAYMEPPI-CQSZACIVSA-N	0	3	313.401	2.487	10	0		DEAEHN
COC[C@@H](C)CN1CCN(c2cc(C)nc(C(C)C)n2)CC1	ZINC000189591726	333150847	/nfs/dbraw/zinc/15/08/47/333150847.db2.gz	ANCHDBLJBMMACW-AWEZNQCLSA-N	0	3	306.454	2.313	10	0		DEAEHN
CCC1(NCc2c(Br)cnn2C)CCOCC1	ZINC000389501616	336397033	/nfs/dbraw/zinc/39/70/33/336397033.db2.gz	WAYGRIWZOREDKE-UHFFFAOYSA-N	0	3	302.216	2.231	10	0		DEAEHN
CCn1cc([C@H]2NC[C@]23CCN(C(=O)OC(C)(C)C)C3)cn1	ZINC000536957652	337868532	/nfs/dbraw/zinc/86/85/32/337868532.db2.gz	CQDICSAWUQDISA-CJNGLKHVSA-N	0	3	306.410	2.175	10	0		DEAEHN
Cn1c2ccc(CN[C@@H](CO)CC(C)(C)C)cc2sc1=O	ZINC000192646463	341878739	/nfs/dbraw/zinc/87/87/39/341878739.db2.gz	YWVSVBMROCEXEX-GFCCVEGCSA-N	0	3	308.447	2.487	10	0		DEAEHN
C[C@@H]1OCC[C@]1(O)CNCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000435034431	534208680	/nfs/dbraw/zinc/20/86/80/534208680.db2.gz	NEXNOEWKGWVNPT-UGSOOPFHSA-N	0	3	321.417	2.271	10	0		DEAEHN
COc1ccc(O)cc1C(=O)NCCN(C)Cc1ccccc1	ZINC000188733882	534211066	/nfs/dbraw/zinc/21/10/66/534211066.db2.gz	FMCDBLXUUHLIIZ-UHFFFAOYSA-N	0	3	314.385	2.263	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1C	ZINC000247452766	518228571	/nfs/dbraw/zinc/22/85/71/518228571.db2.gz	SWIDRTWJXMWAIL-QMTHXVAHSA-N	0	3	305.422	2.293	10	0		DEAEHN
O=C(NCCNc1ccncc1)C1(Cc2ccc(F)cc2)CC1	ZINC000438686440	534343521	/nfs/dbraw/zinc/34/35/21/534343521.db2.gz	YFTZIOBMNNGBMO-UHFFFAOYSA-N	0	3	313.376	2.194	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2ccc(-c3cc[nH]n3)o2)[C@]12CCCO2	ZINC000366009229	520367175	/nfs/dbraw/zinc/36/71/75/520367175.db2.gz	LIVVYKSLSAEDSQ-BRWVUGGUSA-N	0	3	317.389	2.486	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)NCCCc1nc(C(C)C)no1	ZINC000104342549	521599445	/nfs/dbraw/zinc/59/94/45/521599445.db2.gz	IEOZTSQJLPYGOK-ZDUSSCGKSA-N	0	3	308.426	2.116	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000249799306	521621006	/nfs/dbraw/zinc/62/10/06/521621006.db2.gz	YLDYNTCSGPOCDP-UKRRQHHQSA-N	0	3	305.422	2.107	10	0		DEAEHN
CCS(=O)(=O)NCCCN(Cc1ccco1)C1CCCC1	ZINC000130910993	521673134	/nfs/dbraw/zinc/67/31/34/521673134.db2.gz	VFWFHELFPMNKMA-UHFFFAOYSA-N	0	3	314.451	2.354	10	0		DEAEHN
COC[C@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)C(C)C	ZINC000157235258	522751585	/nfs/dbraw/zinc/75/15/85/522751585.db2.gz	NCXKSLUVZQXAKU-INMHGKMJSA-N	0	3	321.465	2.456	10	0		DEAEHN
COc1ccc(CC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1F	ZINC000124463722	523889269	/nfs/dbraw/zinc/88/92/69/523889269.db2.gz	UNPSMMQOFIZVJS-JSGCOSHPSA-N	0	3	308.397	2.318	10	0		DEAEHN
COc1ccc(CN2CCC[C@H](Cn3cncn3)C2)cc1OC	ZINC000128481457	524029584	/nfs/dbraw/zinc/02/95/84/524029584.db2.gz	WFTNLQXSYMNHJP-HNNXBMFYSA-N	0	3	316.405	2.208	10	0		DEAEHN
COCCOc1ccccc1CN1CC[C@@H](c2cnn(C)c2)C1	ZINC000128505907	524058097	/nfs/dbraw/zinc/05/80/97/524058097.db2.gz	RJBGJGMRGOCDCK-OAHLLOKOSA-N	0	3	315.417	2.435	10	0		DEAEHN
C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)[C@H](C)CO	ZINC000247010438	525291658	/nfs/dbraw/zinc/29/16/58/525291658.db2.gz	ZDDPIYUCBBNAKK-FMKPAKJESA-N	0	3	322.424	2.171	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)NCCN2CCCC[C@@H]2C)nc1	ZINC000347325639	534864976	/nfs/dbraw/zinc/86/49/76/534864976.db2.gz	HIYTVDHWQHUDCK-LBPRGKRZSA-N	0	3	304.394	2.280	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(C[C@@H](O)COC(C)C)CC2	ZINC000374365053	534882414	/nfs/dbraw/zinc/88/24/14/534882414.db2.gz	JBFMWNYDQYKWCG-GOSISDBHSA-N	0	3	305.418	2.076	10	0		DEAEHN
COc1cccc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1OC	ZINC000247333219	525827050	/nfs/dbraw/zinc/82/70/50/525827050.db2.gz	NBPWZRCCHDIANW-GXTWGEPZSA-N	0	3	306.406	2.162	10	0		DEAEHN
CC1(C)[C@H](N[C@@H]2CCS(=O)(=O)c3ccccc32)[C@@H]2CCO[C@H]21	ZINC000248571609	535077493	/nfs/dbraw/zinc/07/74/93/535077493.db2.gz	RGEASEOVDYMELY-SJXGUFTOSA-N	0	3	321.442	2.308	10	0		DEAEHN
CCCNC(=O)[C@H](C)N1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000249885021	535116248	/nfs/dbraw/zinc/11/62/48/535116248.db2.gz	OTRKVVRORDNKHV-GJZGRUSLSA-N	0	3	304.438	2.039	10	0		DEAEHN
CC(C)[C@H](c1nc([C@@H]2CNCCN2C)no1)c1ccccc1	ZINC000263174532	535169361	/nfs/dbraw/zinc/16/93/61/535169361.db2.gz	GCAAGDWKVIPXJX-GJZGRUSLSA-N	0	3	300.406	2.434	10	0		DEAEHN
CCc1cccc(OCCN2CCN(C[C@H](C)O)[C@H](C)C2)c1	ZINC000247120694	535907236	/nfs/dbraw/zinc/90/72/36/535907236.db2.gz	JRGFVHMHPYBXOR-CVEARBPZSA-N	0	3	306.450	2.015	10	0		DEAEHN
CCc1oc(C(=O)OC)cc1CN1CCN2CCCC[C@H]2C1	ZINC000246328761	535921966	/nfs/dbraw/zinc/92/19/66/535921966.db2.gz	KDECRZKTBOGNCR-AWEZNQCLSA-N	0	3	306.406	2.299	10	0		DEAEHN
CO[C@@H]1CN(Cc2cn(C)nc2-c2ccncc2)CC[C@H]1C	ZINC000249163898	536732118	/nfs/dbraw/zinc/73/21/18/536732118.db2.gz	JULMTBPRWBIKRV-CZUORRHYSA-N	0	3	300.406	2.339	10	0		DEAEHN
COc1cc(CN2CCNC[C@H]2c2cccnc2)cc(OC)c1	ZINC000261783677	536760301	/nfs/dbraw/zinc/76/03/01/536760301.db2.gz	UFPXSVRCRZCSFR-SFHVURJKSA-N	0	3	313.401	2.245	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)N3CC[C@H]4CC[C@@H](C3)N4C)cc2c1	ZINC000248771902	536958688	/nfs/dbraw/zinc/95/86/88/536958688.db2.gz	ALKMGIXFHMZBEA-KGLIPLIRSA-N	0	3	313.401	2.485	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@H]1CCC[C@@]2(C1)NCCc1nc[nH]c12	ZINC000724104173	563496578	/nfs/dbraw/zinc/49/65/78/563496578.db2.gz	ZBVCGFKBIVDBRN-ZBEGNZNMSA-N	0	3	306.410	2.218	10	0		DEAEHN
CCC[C@H](C(=O)NCc1cc2c(cc1OC)C[C@@H](C)O2)N(C)C	ZINC000162666540	625602183	/nfs/dbraw/zinc/60/21/83/625602183.db2.gz	DPIDHMHXLREZIR-IUODEOHRSA-N	0	3	320.433	2.365	10	0		DEAEHN
Cc1nonc1C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1	ZINC000741606495	637996923	/nfs/dbraw/zinc/99/69/23/637996923.db2.gz	QFUCXPOOSLOFHC-SMDDNHRTSA-N	0	3	320.418	2.252	10	0		DEAEHN
COC(=O)/C(C)=C\CN1C[C@@H]2CN(c3ccccc3)C[C@@H]2C1	ZINC000748812794	638593498	/nfs/dbraw/zinc/59/34/98/638593498.db2.gz	HQRAYKNLEIGJNN-FXCXASGTSA-N	0	3	300.402	2.174	10	0		DEAEHN
COC(=O)c1ccc2c(cnn2CN2CCC[C@H]2C[C@H](C)O)c1	ZINC000752803330	639222835	/nfs/dbraw/zinc/22/28/35/639222835.db2.gz	IMSYUEJFKFMBHF-WFASDCNBSA-N	0	3	317.389	2.016	10	0		DEAEHN
Cn1ccnc1[C@]([O-])(C[NH2+][C@H]1CC[C@H]1C1CCC1)C(F)(F)F	ZINC000800979595	645325963	/nfs/dbraw/zinc/32/59/63/645325963.db2.gz	SQGDDYJHEFMTLB-SGMGOOAPSA-N	0	3	317.355	2.338	10	0		DEAEHN
CCN1CC[C@H](N[C@H](C)c2ccc(N3CCCC3=O)cc2)C1=O	ZINC000802318007	645516792	/nfs/dbraw/zinc/51/67/92/645516792.db2.gz	LWVQFJGEFUSFQE-CJNGLKHVSA-N	0	3	315.417	2.085	10	0		DEAEHN
O=C(C[C@H]1COC(=O)C1)O[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000183167851	649045086	/nfs/dbraw/zinc/04/50/86/649045086.db2.gz	ANPWNIZDCKQKBH-JKSUJKDBSA-N	0	3	317.385	2.147	10	0		DEAEHN
C#CCCCCCOC(=O)C1CC[C@@H](C(F)(F)F)NC1=O	ZINC000185336003	649499235	/nfs/dbraw/zinc/49/92/35/649499235.db2.gz	YHLXXEGQTOHREW-MNOVXSKESA-N	0	3	305.296	2.180	10	0		DEAEHN
CN(C[C@@H]1CCCN(C)C1)S(=O)(=O)/C=C/c1ccccc1	ZINC000115586021	652175020	/nfs/dbraw/zinc/17/50/20/652175020.db2.gz	FQSPPJWNSAZXAJ-YBHKSSGVSA-N	0	3	308.447	2.261	10	0		DEAEHN
Cc1nc(CC(=O)N[C@H](CN(C)C)c2ccccc2)cs1	ZINC000111139365	652514088	/nfs/dbraw/zinc/51/40/88/652514088.db2.gz	MGTOGGSKOUZHEK-OAHLLOKOSA-N	0	3	303.431	2.413	10	0		DEAEHN
COCCNC(=S)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000379706947	685392453	/nfs/dbraw/zinc/39/24/53/685392453.db2.gz	SMMIPTMJEIGDJH-MRXNPFEDSA-N	0	3	321.490	2.152	10	0		DEAEHN
CC(C)(F)C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000092331057	684041942	/nfs/dbraw/zinc/04/19/42/684041942.db2.gz	MNDKOYNHBJQSST-UHFFFAOYSA-N	0	3	321.396	2.199	10	0		DEAEHN
C[C@H]1[C@H](NCc2ccnn2C)CCCN1C(=O)OC(C)(C)C	ZINC000189517981	684383323	/nfs/dbraw/zinc/38/33/23/684383323.db2.gz	YDYFUBHJTMTCQA-GXTWGEPZSA-N	0	3	308.426	2.298	10	0		DEAEHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCOC[C@@H]2C)cc1	ZINC000192518186	684451696	/nfs/dbraw/zinc/45/16/96/684451696.db2.gz	RQXRJRHXXIYLQV-TUKIKUTGSA-N	0	3	316.357	2.015	10	0		DEAEHN
O=C(N[C@@H]1COc2ccccc21)N1CCN(C2CCCC2)CC1	ZINC000195198241	685090465	/nfs/dbraw/zinc/09/04/65/685090465.db2.gz	PPNGLHJQQLROKO-MRXNPFEDSA-N	0	3	315.417	2.390	10	0		DEAEHN
COc1ccccc1[C@H](O)CNC(=O)[C@H](C)N1[C@@H](C)CC[C@@H]1C	ZINC000245201831	685109420	/nfs/dbraw/zinc/10/94/20/685109420.db2.gz	MZSIFYKGVWIMMJ-RZLSGREXSA-N	0	3	320.433	2.106	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)[C@H]1CC(c2ccccc2)=NO1	ZINC000249504294	685181195	/nfs/dbraw/zinc/18/11/95/685181195.db2.gz	FFTSBWJPDLNWMD-WMLDXEAASA-N	0	3	315.417	2.170	10	0		DEAEHN
C[C@@H](N[C@H]1C[C@@H](O)[C@@H]1n1cccn1)c1ccc(-n2cccn2)cc1	ZINC000886097047	692002950	/nfs/dbraw/zinc/00/29/50/692002950.db2.gz	KAPZRADOQODSOB-BVPBIZIASA-N	0	3	323.400	2.094	10	0		DEAEHN
COc1ccc(/C=C(/C)C(=O)N2CCCN(C)CC2)cc1F	ZINC000588443657	777196937	/nfs/dbraw/zinc/19/69/37/777196937.db2.gz	STDYKCSUQMYIJD-QBFSEMIESA-N	0	3	306.381	2.402	10	0		DEAEHN
CCn1nccc1CN[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000721843852	780253750	/nfs/dbraw/zinc/25/37/50/780253750.db2.gz	BVBHSHAIBPRELL-TZMCWYRMSA-N	0	3	308.426	2.248	10	0		DEAEHN
CCc1nn(C)cc1CN[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000721888467	781563390	/nfs/dbraw/zinc/56/33/90/781563390.db2.gz	OROZCYCMQAXVGB-IUODEOHRSA-N	0	3	322.453	2.328	10	0		DEAEHN
Cc1c(CN[C@H]2CN(C(=O)OC(C)(C)C)CC2(C)C)cnn1C	ZINC000721895185	781584265	/nfs/dbraw/zinc/58/42/65/781584265.db2.gz	CNQJWAWSMQEFMO-AWEZNQCLSA-N	0	3	322.453	2.464	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCn2c(C(C)C)nnc2[C@H]1C	ZINC000439781426	781809217	/nfs/dbraw/zinc/80/92/17/781809217.db2.gz	MEWPNUKONKBJAR-ZIAGYGMSSA-N	0	3	319.453	2.179	10	0		DEAEHN
COC[C@]1(C)CCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724074654	787348614	/nfs/dbraw/zinc/34/86/14/787348614.db2.gz	QJRBRTNELZIKFT-NXEZZACHSA-N	0	3	305.287	2.293	10	0		DEAEHN
CN1CCC[C@@H]2[C@@H]1CCN2C(=O)c1ncccc1Br	ZINC000720818270	1086169742	/nfs/dbraw/zinc/16/97/42/1086169742.db2.gz	UNRZOFUHJCAAJJ-NWDGAFQWSA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@H](N)c1cn(Cc2ccc(Br)c(F)c2F)nn1	ZINC000700999328	1086346419	/nfs/dbraw/zinc/34/64/19/1086346419.db2.gz	GKRQPJQDYDUTJY-LURJTMIESA-N	0	3	317.137	2.387	10	0		DEAEHN
COC[C@@H](C)OC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000704489271	1086583601	/nfs/dbraw/zinc/58/36/01/1086583601.db2.gz	NTTVFGMLKUSEAT-GDBMZVCRSA-N	0	3	306.406	2.364	10	0		DEAEHN
COc1ncccc1CNCC1CN(C(=O)OC(C)(C)C)C1	ZINC000710917255	1086690521	/nfs/dbraw/zinc/69/05/21/1086690521.db2.gz	MAMUTXMCMGUOCM-UHFFFAOYSA-N	0	3	307.394	2.047	10	0		DEAEHN
COC1(OC)CC[C@@H]1N[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000710908958	1086690755	/nfs/dbraw/zinc/69/07/55/1086690755.db2.gz	XUCCUGMXZZARSM-OLZOCXBDSA-N	0	3	314.426	2.127	10	0		DEAEHN
Cn1nc(Br)cc1CNC[C@H]1CCC2(CCC2)O1	ZINC000711437384	1087105275	/nfs/dbraw/zinc/10/52/75/1087105275.db2.gz	KQRIRYVDHAXYGC-LLVKDONJSA-N	0	3	314.227	2.374	10	0		DEAEHN
Cn1cc(CN[C@]23CCC[C@H]2N(C(=O)OC(C)(C)C)CC3)cn1	ZINC000711619342	1087176521	/nfs/dbraw/zinc/17/65/21/1087176521.db2.gz	ADXORLGWLCBGCV-PBHICJAKSA-N	0	3	320.437	2.442	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@@]2(NCc3c[nH]cn3)CCC[C@@H]12	ZINC000711623331	1087177594	/nfs/dbraw/zinc/17/75/94/1087177594.db2.gz	LFPQGIXHSPHABV-CJNGLKHVSA-N	0	3	306.410	2.431	10	0		DEAEHN
COc1ccccc1[C@H](N)CSc1nnc(N(C)C)s1	ZINC000081769297	192323508	/nfs/dbraw/zinc/32/35/08/192323508.db2.gz	HXUGOVYMODVZHR-SNVBAGLBSA-N	0	3	310.448	2.405	10	0		DEAEHN
CCN[C@H]1c2ccccc2C[C@H]1Sc1nnnn1C1CC1	ZINC000081867479	192332908	/nfs/dbraw/zinc/33/29/08/192332908.db2.gz	LTVWNGOHKDGIMG-KGLIPLIRSA-N	0	3	301.419	2.376	10	0		DEAEHN
N[C@@H](CSc1ccncn1)c1ccc2c(c1)OCCCO2	ZINC000081886662	192334752	/nfs/dbraw/zinc/33/47/52/192334752.db2.gz	LYABJRQKXKSIED-LBPRGKRZSA-N	0	3	303.387	2.430	10	0		DEAEHN
CS[C@@H](C)CNCc1cnc2cnc(Br)cn12	ZINC000162597204	197578015	/nfs/dbraw/zinc/57/80/15/197578015.db2.gz	AQHWZRZMARLOPZ-QMMMGPOBSA-N	0	3	315.240	2.333	10	0		DEAEHN
N[C@@H]1CCC[C@@H]1S(=O)(=O)c1ccc(Br)cc1	ZINC000081934020	192342547	/nfs/dbraw/zinc/34/25/47/192342547.db2.gz	XIXAFHJXBRVKNB-MNOVXSKESA-N	0	3	304.209	2.103	10	0		DEAEHN
Cc1ncc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c(C(C)C)n1	ZINC000172622407	282141803	/nfs/dbraw/zinc/14/18/03/282141803.db2.gz	ZXEJPKATRHPJLS-OCCSQVGLSA-N	0	3	304.438	2.463	10	0		DEAEHN
O=C(CN(C[C@H]1CCCO1)C1CCCC1)NCc1ccco1	ZINC000152920167	282157607	/nfs/dbraw/zinc/15/76/07/282157607.db2.gz	DHNHSRXVAGIBNC-MRXNPFEDSA-N	0	3	306.406	2.319	10	0		DEAEHN
CCC[C@H]1CCCN(S(=O)(=O)C[C@@H]2CCCCN2)CC1	ZINC000079358297	185166896	/nfs/dbraw/zinc/16/68/96/185166896.db2.gz	BHSWKZHEKQXTLQ-GJZGRUSLSA-N	0	3	302.484	2.361	10	0		DEAEHN
CC(C)COC1CCN(C[C@H](O)COCc2ccco2)CC1	ZINC000079391442	185168234	/nfs/dbraw/zinc/16/82/34/185168234.db2.gz	NFNKTXHZLSCOAO-HNNXBMFYSA-N	0	3	311.422	2.294	10	0		DEAEHN
COCc1ccc(CN(CC2CC2)C[C@@H]2CN(C)CCO2)cc1	ZINC000328656738	231292189	/nfs/dbraw/zinc/29/21/89/231292189.db2.gz	ZQJAGQPFOHOYME-IBGZPJMESA-N	0	3	318.461	2.376	10	0		DEAEHN
Cc1cc([C@@H]2CCCN(C(=O)[C@@H](C3CC3)N3CCCC3)C2)[nH]n1	ZINC000328704821	231315287	/nfs/dbraw/zinc/31/52/87/231315287.db2.gz	YKQOQANOLRQFQT-NVXWUHKLSA-N	0	3	316.449	2.299	10	0		DEAEHN
CC(C)(C)c1nnsc1C(=O)NC[C@H](N)c1ccccc1	ZINC000087455612	185225584	/nfs/dbraw/zinc/22/55/84/185225584.db2.gz	GSRVJVRKNGGXCU-NSHDSACASA-N	0	3	304.419	2.265	10	0		DEAEHN
C[C@](N)(C(=O)NCc1sccc1Br)C1CC1	ZINC000087575720	185228716	/nfs/dbraw/zinc/22/87/16/185228716.db2.gz	DYFUEJKBEUQPQJ-LLVKDONJSA-N	0	3	303.225	2.254	10	0		DEAEHN
CS(=O)(=O)[C@H]1CCC[C@@]1(CN)Nc1ccc(Cl)cc1	ZINC000087914283	185237296	/nfs/dbraw/zinc/23/72/96/185237296.db2.gz	KSFCWLZBWULAKX-STQMWFEESA-N	0	3	302.827	2.047	10	0		DEAEHN
Cc1ccc([N-]S(=O)(=O)[C@@H]2CC[NH2+]C2)cc1C(F)(F)F	ZINC000088056591	185238457	/nfs/dbraw/zinc/23/84/57/185238457.db2.gz	FGLHQCRMHFMRNZ-SNVBAGLBSA-N	0	3	308.325	2.117	10	0		DEAEHN
NN=c1nccc(NCc2cc(Br)cs2)[nH]1	ZINC000087880238	185234401	/nfs/dbraw/zinc/23/44/01/185234401.db2.gz	KVSFGNCEQLCFIR-UHFFFAOYSA-N	0	3	300.185	2.198	10	0		DEAEHN
O=C(CN[C@H]1CCC(=O)N[C@@H]1C1CC1)Nc1ccc(F)cc1	ZINC000328929027	231390311	/nfs/dbraw/zinc/39/03/11/231390311.db2.gz	YGVSQGAIJZBDDE-XJKSGUPXSA-N	0	3	305.353	2.251	10	0		DEAEHN
CC[C@@H](CN)S(=O)(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000088472146	185252136	/nfs/dbraw/zinc/25/21/36/185252136.db2.gz	UKMNLTZYMQYUJQ-JTQLQIEISA-N	0	3	312.313	2.064	10	0		DEAEHN
O=c1oc2cccnc2n1CCNCc1ccc(Cl)s1	ZINC000088397151	185248342	/nfs/dbraw/zinc/24/83/42/185248342.db2.gz	MKUSEOJGECJXTQ-UHFFFAOYSA-N	0	3	309.778	2.494	10	0		DEAEHN
Nc1ccc(=O)n(CCCN2CCC(C(F)(F)F)CC2)c1	ZINC000088417285	185249201	/nfs/dbraw/zinc/24/92/01/185249201.db2.gz	ACKXAWZUJNXOQP-UHFFFAOYSA-N	0	3	303.328	2.095	10	0		DEAEHN
NCc1cccc(S(=O)(=O)N2CCC(C(F)(F)F)CC2)c1	ZINC000088419207	185249463	/nfs/dbraw/zinc/24/94/63/185249463.db2.gz	PSOALBUXTRULEJ-UHFFFAOYSA-N	0	3	322.352	2.108	10	0		DEAEHN
CN(CCNC(=O)c1sc2ccc(F)cc2c1N)C1CC1	ZINC000088643310	185261195	/nfs/dbraw/zinc/26/11/95/185261195.db2.gz	WHXVSDFNOIDDGC-UHFFFAOYSA-N	0	3	307.394	2.447	10	0		DEAEHN
O=C(CCC(F)(F)F)Nc1ccc(N2CCNCC2)cc1	ZINC000088832851	185266703	/nfs/dbraw/zinc/26/67/03/185266703.db2.gz	JVEZWURQUNWQNF-UHFFFAOYSA-N	0	3	301.312	2.377	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000090293267	185290004	/nfs/dbraw/zinc/29/00/04/185290004.db2.gz	CASAQCHVMVDUSR-UHFFFAOYSA-N	0	3	323.245	2.366	10	0		DEAEHN
N[C@H]1COC[C@H]1C(=O)Nc1c(Cl)cccc1C(F)(F)F	ZINC000090379132	185293408	/nfs/dbraw/zinc/29/34/08/185293408.db2.gz	VIFNGSBSLBGZCI-MUWHJKNJSA-N	0	3	308.687	2.271	10	0		DEAEHN
CN[C@@H]1COC[C@H]1c1nc(-c2ccccc2Br)no1	ZINC000090423586	185295324	/nfs/dbraw/zinc/29/53/24/185295324.db2.gz	YPNHTPBCOZIYFH-MWLCHTKSSA-N	0	3	324.178	2.201	10	0		DEAEHN
C[C@@]1(C(=O)Nc2c3ncsc3ccc2Cl)COC[C@@H]1N	ZINC000090585547	185305090	/nfs/dbraw/zinc/30/50/90/185305090.db2.gz	FYFJPIUUMPLDIJ-TVQRCGJNSA-N	0	3	311.794	2.252	10	0		DEAEHN
Cc1ccc(Br)cc1NC(=O)[C@]1(C)COC[C@H]1N	ZINC000090588843	185305360	/nfs/dbraw/zinc/30/53/60/185305360.db2.gz	WTVOATUVHSNKHZ-DGCLKSJQSA-N	0	3	313.195	2.060	10	0		DEAEHN
CN(Cc1cccc(Cl)c1Cl)C(=O)[C@@]1(C)COC[C@@H]1N	ZINC000090590395	185305473	/nfs/dbraw/zinc/30/54/73/185305473.db2.gz	PZBWAJLGHVLQKU-FZMZJTMJSA-N	0	3	317.216	2.316	10	0		DEAEHN
C[C@@]1(C(=O)Nc2cccc(-c3nccs3)c2)COC[C@H]1N	ZINC000090589997	185305534	/nfs/dbraw/zinc/30/55/34/185305534.db2.gz	GNVZRIPFQMFDHV-IUODEOHRSA-N	0	3	303.387	2.112	10	0		DEAEHN
CN(C)[C@H]1CCCN(c2cc3c(cc2Cl)C(=O)C(=O)N3)C1	ZINC000092772769	185339820	/nfs/dbraw/zinc/33/98/20/185339820.db2.gz	GADWQVICJGJQRH-VIFPVBQESA-N	0	3	307.781	2.005	10	0		DEAEHN
Cc1ccc(CN)cc1S(=O)(=O)NCC1C(C)(C)C1(C)C	ZINC000092817185	185343803	/nfs/dbraw/zinc/34/38/03/185343803.db2.gz	JKJYSPCFKBJSAW-UHFFFAOYSA-N	0	3	310.463	2.414	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@H]1CCN(Cc2cncn2C)C1	ZINC000190470206	282321482	/nfs/dbraw/zinc/32/14/82/282321482.db2.gz	JNQOIGMOXYCQEW-CQSZACIVSA-N	0	3	319.478	2.139	10	0		DEAEHN
CC(C)OC[C@H](O)CNCc1sccc1Br	ZINC000087575535	539407460	/nfs/dbraw/zinc/40/74/60/539407460.db2.gz	WGARKGOPKSRUPA-SECBINFHSA-N	0	3	308.241	2.386	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NC[C@]1(C)CCCO1)c1ccccc1	ZINC000153839192	539547244	/nfs/dbraw/zinc/54/72/44/539547244.db2.gz	SOUYNRJZKXFAOH-WBVHZDCISA-N	0	3	305.422	2.158	10	0		DEAEHN
c1cc(N2CCN(Cc3nc(C4CCCC4)no3)CC2)ccn1	ZINC000155615697	539560070	/nfs/dbraw/zinc/56/00/70/539560070.db2.gz	GONQEGXKXOATCC-UHFFFAOYSA-N	0	3	313.405	2.444	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)[C@H](C)N[C@H](C)[C@H]1CCCO1	ZINC000183226063	539660399	/nfs/dbraw/zinc/66/03/99/539660399.db2.gz	SPIBJLYAJNUMLC-BFQNTYOBSA-N	0	3	304.390	2.373	10	0		DEAEHN
CN1C(=O)CC[C@H](N)[C@@H]1c1ccc(F)c(Br)c1	ZINC000070985146	190929145	/nfs/dbraw/zinc/92/91/45/190929145.db2.gz	ZWXZSZLWJYXCCT-JQWIXIFHSA-N	0	3	301.159	2.209	10	0		DEAEHN
CC[C@@H]1CN(c2ncnc3c(C)csc32)CCN1C[C@@H](C)O	ZINC000189979917	539692015	/nfs/dbraw/zinc/69/20/15/539692015.db2.gz	MJMFWNKVHRGPKV-CHWSQXEVSA-N	0	3	320.462	2.281	10	0		DEAEHN
O=C(N[C@@H]1CCO[C@H]1c1ccccc1)N1CCN2CCC[C@H]2C1	ZINC000245472002	539756398	/nfs/dbraw/zinc/75/63/98/539756398.db2.gz	OMFALWYKUBSDJX-BBWFWOEESA-N	0	3	315.417	2.006	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccccc1-n1ccnc1)N(C)C	ZINC000138492826	186017011	/nfs/dbraw/zinc/01/70/11/186017011.db2.gz	NREUIOZBGBBKOS-INIZCTEOSA-N	0	3	300.406	2.219	10	0		DEAEHN
CCC[C@@H]1N[C@H](c2cccs2)N(C2CCN(C)CC2)C1=O	ZINC000141177064	186029342	/nfs/dbraw/zinc/02/93/42/186029342.db2.gz	RVLGCZMRKVNYLT-ZFWWWQNUSA-N	0	3	307.463	2.441	10	0		DEAEHN
COCCN(CCOC)Cc1cc(N)cc(Br)c1	ZINC000147959022	186042324	/nfs/dbraw/zinc/04/23/24/186042324.db2.gz	QQBABIGCFHEFDD-UHFFFAOYSA-N	0	3	317.227	2.126	10	0		DEAEHN
CCNCc1sc(S(=O)(=O)N(C)C2CCC2)cc1C	ZINC000144637829	186035606	/nfs/dbraw/zinc/03/56/06/186035606.db2.gz	IJWUBVUZPAWORR-UHFFFAOYSA-N	0	3	302.465	2.339	10	0		DEAEHN
C[C@H](O)C(C)(C)NCC(=O)Nc1ccc(Br)cc1	ZINC000144927519	186035913	/nfs/dbraw/zinc/03/59/13/186035913.db2.gz	SPNYNXIELCSDMK-VIFPVBQESA-N	0	3	315.211	2.137	10	0		DEAEHN
C[C@@H](O)C(C)(C)NCC(=O)Nc1ccccc1Br	ZINC000145021779	186036513	/nfs/dbraw/zinc/03/65/13/186036513.db2.gz	FFFCUNGIDBKSFG-SECBINFHSA-N	0	3	315.211	2.137	10	0		DEAEHN
CC(C)C[C@@H]1N[C@H](c2ccsc2)N([C@@H]2CCN(C)C2)C1=O	ZINC000145224462	186036548	/nfs/dbraw/zinc/03/65/48/186036548.db2.gz	UNZQVGSQWDRZLW-ILXRZTDVSA-N	0	3	307.463	2.297	10	0		DEAEHN
C[C@H](CN1C(=O)[C@H](C)N[C@H]1c1cccs1)N1CCCCC1	ZINC000145703411	186038149	/nfs/dbraw/zinc/03/81/49/186038149.db2.gz	OAVADUPRFAYWHP-VNHYZAJKSA-N	0	3	307.463	2.441	10	0		DEAEHN
CN[C@@H](C[C@H]1CN(C)CCN1C)c1cc(Cl)ccc1OC	ZINC000149595274	186052130	/nfs/dbraw/zinc/05/21/30/186052130.db2.gz	YFIUIWAFSIIQHH-ZFWWWQNUSA-N	0	3	311.857	2.245	10	0		DEAEHN
CNCc1sc([C@H]2CCS(=O)(=O)C2)nc1-c1ccccc1	ZINC000150327298	186056654	/nfs/dbraw/zinc/05/66/54/186056654.db2.gz	LHPXTLKLYDROCT-LBPRGKRZSA-N	0	3	322.455	2.432	10	0		DEAEHN
c1cc(CN[C@H]2CCCSC2)c(OC[C@@H]2CCOC2)cn1	ZINC000287133998	219335954	/nfs/dbraw/zinc/33/59/54/219335954.db2.gz	AICOBCSAGXPZFK-HIFRSBDPSA-N	0	3	308.447	2.482	10	0		DEAEHN
CCn1ncc(Br)c1[C@](C)(F)C[C@H]1COCCN1	ZINC000164056035	186147058	/nfs/dbraw/zinc/14/70/58/186147058.db2.gz	SJWIZJQLLMYXHX-JOYOIKCWSA-N	0	3	320.206	2.229	10	0		DEAEHN
CC(C(=O)Nc1cc(Br)ccc1N(C)C)=C1CNC1	ZINC000164064516	186147704	/nfs/dbraw/zinc/14/77/04/186147704.db2.gz	WCRWNNCYKQTHCP-UHFFFAOYSA-N	0	3	324.222	2.373	10	0		DEAEHN
CCOc1cccnc1C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000164108012	186148785	/nfs/dbraw/zinc/14/87/85/186148785.db2.gz	DOHPOZZNTVFXNK-KBPBESRZSA-N	0	3	303.406	2.037	10	0		DEAEHN
C[NH2+]Cc1cc(=O)[n-]c(-c2cc(F)ccc2C(F)(F)F)n1	ZINC000164271384	186154787	/nfs/dbraw/zinc/15/47/87/186154787.db2.gz	UQHPTBDDMZEDRX-UHFFFAOYSA-N	0	3	301.243	2.314	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCc2ccc(OC(C)(C)C)nc2)C1	ZINC000183883898	186227531	/nfs/dbraw/zinc/22/75/31/186227531.db2.gz	FTHHNFXOHSYUBJ-CQSZACIVSA-N	0	3	320.437	2.104	10	0		DEAEHN
O=C(Nc1cc2c(cc1Cl)OCO2)N1CCN2CCC[C@H]2C1	ZINC000171887832	198002008	/nfs/dbraw/zinc/00/20/08/198002008.db2.gz	XGKRGFFNBUUTRB-JTQLQIEISA-N	0	3	323.780	2.381	10	0		DEAEHN
CSc1ccc(CNC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000171904361	198005437	/nfs/dbraw/zinc/00/54/37/198005437.db2.gz	KXDSEESCPLOETI-CQSZACIVSA-N	0	3	305.447	2.398	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)C[C@@H]2CCCc3ccccc32)CCO1	ZINC000172306676	198075674	/nfs/dbraw/zinc/07/56/74/198075674.db2.gz	NKXWYICRLONDDZ-DLBZAZTESA-N	0	3	316.445	2.286	10	0		DEAEHN
O=C(Nc1ccccc1)c1ccc(N2CCN3CCC[C@@H]3C2)nn1	ZINC000172364427	198086306	/nfs/dbraw/zinc/08/63/06/198086306.db2.gz	ZHCFIAZCXBDCAC-OAHLLOKOSA-N	0	3	323.400	2.013	10	0		DEAEHN
Cc1nn(-c2nc3ccccc3[nH]2)c(C)c1C(=O)CCN(C)C	ZINC000072416286	191155926	/nfs/dbraw/zinc/15/59/26/191155926.db2.gz	ROSPYKGCHJLITR-UHFFFAOYSA-N	0	3	311.389	2.500	10	0		DEAEHN
CN1CCO[C@@H](CN[C@H]2CCCOc3c(Cl)cccc32)C1	ZINC000246584329	282988113	/nfs/dbraw/zinc/98/81/13/282988113.db2.gz	YXKDMAKHPKXQCT-WFASDCNBSA-N	0	3	310.825	2.474	10	0		DEAEHN
CCOc1ccccc1CNC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000174250907	198311333	/nfs/dbraw/zinc/31/13/33/198311333.db2.gz	UIHVOVOXVZAWGU-MRXNPFEDSA-N	0	3	315.417	2.241	10	0		DEAEHN
COc1cc(CNC(=O)N2CC[C@@H](N3CC=CC3)C2)ccc1C	ZINC000174269182	198312981	/nfs/dbraw/zinc/31/29/81/198312981.db2.gz	PSJYSLUDNDJYFM-MRXNPFEDSA-N	0	3	315.417	2.159	10	0		DEAEHN
COc1cccc(N2CC[C@@H](CNCc3ccc(CO)o3)C2)c1	ZINC000174336599	198320682	/nfs/dbraw/zinc/32/06/82/198320682.db2.gz	KSMHEVKPWBQBOD-AWEZNQCLSA-N	0	3	316.401	2.397	10	0		DEAEHN
COC[C@H](NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1)c1ccccc1	ZINC000174628139	198361802	/nfs/dbraw/zinc/36/18/02/198361802.db2.gz	DIXIQVKSMDXJOT-XIRDDKMYSA-N	0	3	319.449	2.498	10	0		DEAEHN
O[C@@H](CNc1nnc(-c2ccccc2)s1)CN1CCCCC1	ZINC000174684587	198370380	/nfs/dbraw/zinc/37/03/80/198370380.db2.gz	XLMPYJZVVANISQ-AWEZNQCLSA-N	0	3	318.446	2.464	10	0		DEAEHN
Cc1ccc([C@@H](O)CN2CCCN(c3cccnn3)CC2)cc1	ZINC000174780902	198384860	/nfs/dbraw/zinc/38/48/60/198384860.db2.gz	IXFJVRRAEIYGKC-KRWDZBQOSA-N	0	3	312.417	2.031	10	0		DEAEHN
CCCOc1ccc(C(=O)CCC(=O)N[C@@H](CN)C2CC2)cc1	ZINC000236787715	202007688	/nfs/dbraw/zinc/00/76/88/202007688.db2.gz	DTTOIOWUYRDXJQ-INIZCTEOSA-N	0	3	318.417	2.292	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)C(=O)Nc2ccccc2Cl)C1	ZINC000246407267	535257530	/nfs/dbraw/zinc/25/75/30/535257530.db2.gz	LTKDGQBBOFVCKP-BXUZGUMPSA-N	0	3	323.824	2.123	10	0		DEAEHN
CN(C)CCN(Cc1ccccc1)C(=O)NCc1cscn1	ZINC000051749856	354388657	/nfs/dbraw/zinc/38/86/57/354388657.db2.gz	LWCVJPJZZIPWDL-UHFFFAOYSA-N	0	3	318.446	2.417	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NCc1cccc(O)c1)c1ccccc1	ZINC000057183555	354560588	/nfs/dbraw/zinc/56/05/88/354560588.db2.gz	LCGDADQZDWNKEM-QGZVFWFLSA-N	0	3	313.401	2.494	10	0		DEAEHN
Cc1c(C(=O)N2CCC(N(C)C)CC2)oc2c1C(=O)CCC2	ZINC000068079654	354794540	/nfs/dbraw/zinc/79/45/40/354794540.db2.gz	IEFYIQMCTGMTST-UHFFFAOYSA-N	0	3	304.390	2.273	10	0		DEAEHN
O=C(CCCCO)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000379607418	540121449	/nfs/dbraw/zinc/12/14/49/540121449.db2.gz	DZIDVLXVGIODPO-QGZVFWFLSA-N	0	3	304.434	2.320	10	0		DEAEHN
C[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](CN)C(F)(F)F	ZINC000401705864	540141631	/nfs/dbraw/zinc/14/16/31/540141631.db2.gz	DNOWNKJARZZPHR-XCBNKYQSSA-N	0	3	310.703	2.113	10	0		DEAEHN
CN1CC[C@H](NC(=O)NC2(CO)CCCC2)[C@H]1c1ccccc1	ZINC000248057053	283125071	/nfs/dbraw/zinc/12/50/71/283125071.db2.gz	ONQFJPXQUSTUTO-JKSUJKDBSA-N	0	3	317.433	2.036	10	0		DEAEHN
Cc1cccc(CNC(=O)NC[C@@H](c2ccccc2)N(C)C)n1	ZINC000123793627	355806984	/nfs/dbraw/zinc/80/69/84/355806984.db2.gz	SENCNUGWIKFKQI-KRWDZBQOSA-N	0	3	312.417	2.492	10	0		DEAEHN
COc1ccc([C@H](C)NC(=O)NC[C@@H]2CCCN2C)cc1OC	ZINC000139681560	355878899	/nfs/dbraw/zinc/87/88/99/355878899.db2.gz	JIVQUUWISMBGOD-JSGCOSHPSA-N	0	3	321.421	2.158	10	0		DEAEHN
Cc1cc(CNC(=O)N[C@@H](CN(C)C)c2ccccc2)on1	ZINC000140238424	355883852	/nfs/dbraw/zinc/88/38/52/355883852.db2.gz	OERQHROBQKLKNW-HNNXBMFYSA-N	0	3	302.378	2.085	10	0		DEAEHN
Cc1cnn(CCC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c1	ZINC000180168143	356044288	/nfs/dbraw/zinc/04/42/88/356044288.db2.gz	PFXFXOWFZRSZGE-FUHWJXTLSA-N	0	3	312.417	2.143	10	0		DEAEHN
CCc1cnc(CCN[C@@H]2CCCC[C@H]2S(C)(=O)=O)s1	ZINC000183046498	356157923	/nfs/dbraw/zinc/15/79/23/356157923.db2.gz	NFAURWGSFHMRJY-CHWSQXEVSA-N	0	3	316.492	2.193	10	0		DEAEHN
CCS(=O)(=O)C[C@@H](C)NCCc1ccc(OC)cc1Cl	ZINC000183123202	356160530	/nfs/dbraw/zinc/16/05/30/356160530.db2.gz	WFSLVHNSVVADQR-LLVKDONJSA-N	0	3	319.854	2.304	10	0		DEAEHN
CC1(OCc2ccc(I)cc2)CNC1	ZINC000214837449	356271559	/nfs/dbraw/zinc/27/15/59/356271559.db2.gz	VJWUGEFESFOHFQ-UHFFFAOYSA-N	0	3	303.143	2.170	10	0		DEAEHN
COc1ccc([C@](C)(O)[C@@H]2CCCN2Cc2ccnn2C)cc1	ZINC000225546020	356276348	/nfs/dbraw/zinc/27/63/48/356276348.db2.gz	JXTZPCVZWCWXAV-ROUUACIJSA-N	0	3	315.417	2.301	10	0		DEAEHN
CCN(Cc1ccccc1)[C@@H](CN)CNC(=O)OC(C)(C)C	ZINC000226184775	356278156	/nfs/dbraw/zinc/27/81/56/356278156.db2.gz	BYAKMJGLGHPATI-HNNXBMFYSA-N	0	3	307.438	2.361	10	0		DEAEHN
CC[C@](C)(CO)NCc1cccc(NC(=O)C(F)(F)F)c1	ZINC000080886584	192199619	/nfs/dbraw/zinc/19/96/19/192199619.db2.gz	RDAZRZJIFIIZHF-CYBMUJFWSA-N	0	3	304.312	2.438	10	0		DEAEHN
NCc1ncc(I)cc1C(F)(F)F	ZINC000306978408	356406224	/nfs/dbraw/zinc/40/62/24/356406224.db2.gz	BDAHYLZEJBLTII-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
CCOC(=O)CCCN[C@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000081544643	192287836	/nfs/dbraw/zinc/28/78/36/192287836.db2.gz	COGWPUUCOXAXDG-GFCCVEGCSA-N	0	3	313.419	2.084	10	0		DEAEHN
c1cnn(-c2cccnc2-c2noc(C34CCCN3CCC4)n2)c1	ZINC000351234231	356637488	/nfs/dbraw/zinc/63/74/88/356637488.db2.gz	XXLADERNRIOZCK-UHFFFAOYSA-N	0	3	322.372	2.402	10	0		DEAEHN
COc1c(Br)cc(Cl)cc1NC(=O)[C@H]1CCN1	ZINC000384809419	356685051	/nfs/dbraw/zinc/68/50/51/356685051.db2.gz	FQNARQKQCDUWLK-MRVPVSSYSA-N	0	3	319.586	2.412	10	0		DEAEHN
Brc1ccc(CN2CC[C@H]3OCCN[C@H]3C2)cc1	ZINC000404064904	356731849	/nfs/dbraw/zinc/73/18/49/356731849.db2.gz	JKBOJESEVASRLX-UONOGXRCSA-N	0	3	311.223	2.012	10	0		DEAEHN
COC(=O)COC[C@H](N)c1cc(C)c(Br)s1	ZINC000087019504	192612058	/nfs/dbraw/zinc/61/20/58/192612058.db2.gz	WRWZLFGHRSTDFC-ZETCQYMHSA-N	0	3	308.197	2.008	10	0		DEAEHN
CC/C=C\CCN1CCN(C[C@H]2CN(C(C)C)CCO2)CC1	ZINC000588475927	540258262	/nfs/dbraw/zinc/25/82/62/540258262.db2.gz	DKKXSNZCFMFZBB-XFHJGTJQSA-N	0	3	309.498	2.070	10	0		DEAEHN
c1cn(-c2csc(CN3CCC[C@@H](n4ccnn4)C3)c2)cn1	ZINC000579829919	357038106	/nfs/dbraw/zinc/03/81/06/357038106.db2.gz	XXGMRRAATHZXMP-CYBMUJFWSA-N	0	3	314.418	2.362	10	0		DEAEHN
CC[C@@H]1CCCCN1S(=O)(=O)c1ccsc1CNC	ZINC000088942619	192663101	/nfs/dbraw/zinc/66/31/01/192663101.db2.gz	OMPIDSBQAXREES-LLVKDONJSA-N	0	3	302.465	2.421	10	0		DEAEHN
CC[C@H]1CCCN(S(=O)(=O)c2cc(CN)n(C3CC3)c2)C1	ZINC000088968765	192672236	/nfs/dbraw/zinc/67/22/36/192672236.db2.gz	ZZLUEANBSWOXOT-LBPRGKRZSA-N	0	3	311.451	2.092	10	0		DEAEHN
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)N1CCC12CCC2	ZINC000441514479	283265481	/nfs/dbraw/zinc/26/54/81/283265481.db2.gz	SRPVECGNWKAXLV-UHFFFAOYSA-N	0	3	315.417	2.150	10	0		DEAEHN
Cc1ccc(C)c(N2CCN(CCC(=O)NC(C)C)CC2)c1	ZINC000178785186	198930715	/nfs/dbraw/zinc/93/07/15/198930715.db2.gz	NJPJBMQBKLIRMI-UHFFFAOYSA-N	0	3	303.450	2.340	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H](C)Cc1ccc(OC)c(OC)c1)N(C)C	ZINC000179233828	199002409	/nfs/dbraw/zinc/00/24/09/199002409.db2.gz	YGIYTCWVKZBNAE-UKRRQHHQSA-N	0	3	322.449	2.481	10	0		DEAEHN
CCn1cc(S(=O)(=O)N(C)[C@H](C)CC(C)C)cc1CNC	ZINC000089004821	192691536	/nfs/dbraw/zinc/69/15/36/192691536.db2.gz	BVOYUYWMMNSSFB-CYBMUJFWSA-N	0	3	315.483	2.283	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1c(C)nn(CC)c1C	ZINC000179548887	199052901	/nfs/dbraw/zinc/05/29/01/199052901.db2.gz	WGVRZSCCJQXSRU-AWEZNQCLSA-N	0	3	307.442	2.468	10	0		DEAEHN
Cn1cc(-c2cc(CN[C@@H](CCO)C3CCCCC3)on2)cn1	ZINC000185057127	199803587	/nfs/dbraw/zinc/80/35/87/199803587.db2.gz	RGOZFPLTLINCGY-INIZCTEOSA-N	0	3	318.421	2.496	10	0		DEAEHN
COCCN1CCN(C[C@@H](C)c2ccc(OC)cc2)C[C@@H]1C	ZINC000180086188	199115727	/nfs/dbraw/zinc/11/57/27/199115727.db2.gz	HHKKTGWKZJRMAV-CVEARBPZSA-N	0	3	306.450	2.451	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000180148504	199123276	/nfs/dbraw/zinc/12/32/76/199123276.db2.gz	CYDGGGTXMQTSBC-KZNAEPCWSA-N	0	3	315.461	2.422	10	0		DEAEHN
CCOc1cccc(CN2C[C@H](C)[C@H](N3CCOCC3)C2)c1	ZINC000180224191	199133471	/nfs/dbraw/zinc/13/34/71/199133471.db2.gz	JNHMWCJMKMMUBZ-MAUKXSAKSA-N	0	3	304.434	2.238	10	0		DEAEHN
Cc1nccn1-c1ccc([C@@H](C)N[C@@H]2CCc3ncnn3C2)cc1	ZINC000180589342	199180622	/nfs/dbraw/zinc/18/06/22/199180622.db2.gz	WKOHCONEJQIXMF-CZUORRHYSA-N	0	3	322.416	2.438	10	0		DEAEHN
CCN(CC)C(=O)CN[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000180676316	199195152	/nfs/dbraw/zinc/19/51/52/199195152.db2.gz	FZRUCXHIBIYFOG-CQSZACIVSA-N	0	3	300.406	2.391	10	0		DEAEHN
CCN(CC)C(=O)CN[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000180676299	199195320	/nfs/dbraw/zinc/19/53/20/199195320.db2.gz	FZRUCXHIBIYFOG-AWEZNQCLSA-N	0	3	300.406	2.391	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)NCc2ccc(Cl)cn2)CN1C1CC1	ZINC000180916957	199227336	/nfs/dbraw/zinc/22/73/36/199227336.db2.gz	JYWJESMDMSIBLQ-GWCFXTLKSA-N	0	3	308.813	2.159	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)NCc2ccc(Cl)cn2)CN1C1CC1	ZINC000180916989	199227914	/nfs/dbraw/zinc/22/79/14/199227914.db2.gz	JYWJESMDMSIBLQ-GXFFZTMASA-N	0	3	308.813	2.159	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@H](Cc2ccccc2)C1)N(C)C	ZINC000181181694	199261780	/nfs/dbraw/zinc/26/17/80/199261780.db2.gz	UJAUVSMJVBNHCZ-SJORKVTESA-N	0	3	304.434	2.187	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@@H](Cc2ccccc2)C1)N(C)C	ZINC000181181731	199261981	/nfs/dbraw/zinc/26/19/81/199261981.db2.gz	UJAUVSMJVBNHCZ-IRXDYDNUSA-N	0	3	304.434	2.187	10	0		DEAEHN
CCNC(=O)c1ccc(NC(=O)[C@H]2NCCCC2(C)C)cc1	ZINC000262560699	535432718	/nfs/dbraw/zinc/43/27/18/535432718.db2.gz	VJLLSQFFOVHCLS-CQSZACIVSA-N	0	3	303.406	2.153	10	0		DEAEHN
CN(C[C@@H](O)COc1cccc2ccccc21)CC1(CO)CC1	ZINC000186793174	200012434	/nfs/dbraw/zinc/01/24/34/200012434.db2.gz	LSUOPSUTROLUKW-MRXNPFEDSA-N	0	3	315.413	2.284	10	0		DEAEHN
CO[C@H](C)[C@H](C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000188412850	200242410	/nfs/dbraw/zinc/24/24/10/200242410.db2.gz	YHDMYIIVLVFHGJ-LQKXBSAESA-N	0	3	305.422	2.154	10	0		DEAEHN
Cc1ccc(-c2cc(C(=O)N3CCN4CCC3CC4)n[nH]2)cc1	ZINC000188605352	200274223	/nfs/dbraw/zinc/27/42/23/200274223.db2.gz	HZROFGOFALCHGE-UHFFFAOYSA-N	0	3	310.401	2.305	10	0		DEAEHN
CC(C)n1cc(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)cn1	ZINC000190172789	200497654	/nfs/dbraw/zinc/49/76/54/200497654.db2.gz	BXZPBLZUNHLRGI-KRWDZBQOSA-N	0	3	314.433	2.367	10	0		DEAEHN
CS[C@H](C(=O)Nc1cnn(CCN(C)C)c1)c1ccccc1	ZINC000610044036	361354752	/nfs/dbraw/zinc/35/47/52/361354752.db2.gz	KUJSZQWVIMRJEL-HNNXBMFYSA-N	0	3	318.446	2.488	10	0		DEAEHN
Cc1noc(NC(=O)CSCCN(C)Cc2ccccc2)n1	ZINC000193615106	201086986	/nfs/dbraw/zinc/08/69/86/201086986.db2.gz	ZHZLXZYYYDBJHI-UHFFFAOYSA-N	0	3	320.418	2.182	10	0		DEAEHN
C=Cn1cc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)cn1	ZINC000194783581	201288477	/nfs/dbraw/zinc/28/84/77/201288477.db2.gz	NRJDBBVXRNFFCJ-QGZVFWFLSA-N	0	3	311.433	2.333	10	0		DEAEHN
Cc1nc(C[C@H]2CCCN(C[C@H](O)Cc3ccccc3)C2)no1	ZINC000195518141	201397338	/nfs/dbraw/zinc/39/73/38/201397338.db2.gz	UXSSVIUJYFLMBV-IAGOWNOFSA-N	0	3	315.417	2.236	10	0		DEAEHN
C=Cn1cc(CN2CCC(CC)(N3CCOCC3)CC2)cn1	ZINC000628476116	366861648	/nfs/dbraw/zinc/86/16/48/366861648.db2.gz	FBDMOUYHTFACDI-UHFFFAOYSA-N	0	3	304.438	2.060	10	0		DEAEHN
COc1cc(C)c(NC(=O)C[C@H]2CSCCN2)cc1OC	ZINC000091135045	193000606	/nfs/dbraw/zinc/00/06/06/193000606.db2.gz	QZMIGWBRAGDMNE-NSHDSACASA-N	0	3	310.419	2.046	10	0		DEAEHN
O[C@H]1COCC[C@@H]1NCc1ccc(Br)c(Cl)c1	ZINC000623767229	365167684	/nfs/dbraw/zinc/16/76/84/365167684.db2.gz	SHTHVXJDZYQGFQ-RYUDHWBXSA-N	0	3	320.614	2.342	10	0		DEAEHN
CC(C)(C)NCc1cnn([C@@H]2CCS(=O)(=O)C2)c1C1CC1	ZINC000091336163	193044102	/nfs/dbraw/zinc/04/41/02/193044102.db2.gz	KHTXPLZWGVJRIZ-CYBMUJFWSA-N	0	3	311.451	2.008	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000091480037	193062270	/nfs/dbraw/zinc/06/22/70/193062270.db2.gz	JBXZCGVLMJQBPQ-JQWIXIFHSA-N	0	3	302.296	2.187	10	0		DEAEHN
CN(C[C@@H]1CCN(C)C1)c1nc(Cl)ncc1Br	ZINC000091659109	193085783	/nfs/dbraw/zinc/08/57/83/193085783.db2.gz	BFRKAIQALJKNPT-MRVPVSSYSA-N	0	3	319.634	2.280	10	0		DEAEHN
C[C@@H]1[NH2+]CC[C@H]1[N-]S(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000624415342	365416061	/nfs/dbraw/zinc/41/60/61/365416061.db2.gz	CTAQKDZGVMBJOP-WRWORJQWSA-N	0	3	309.218	2.022	10	0		DEAEHN
C[C@@H]1CC[C@H]([N-]S(=O)(=O)c2cccc(Cl)c2Cl)C[NH2+]1	ZINC000624407145	365413545	/nfs/dbraw/zinc/41/35/45/365413545.db2.gz	UMMXBSQABVRHKL-BDAKNGLRSA-N	0	3	323.245	2.412	10	0		DEAEHN
O=C(c1ccsc1Br)N1CCN2CCC[C@H]2C1	ZINC000449825704	241133510	/nfs/dbraw/zinc/13/35/10/241133510.db2.gz	CVRGJILIZVLZRI-VIFPVBQESA-N	0	3	315.236	2.431	10	0		DEAEHN
CS[C@@H]1CN(Cc2nnc(C(C)C)s2)C[C@@H]1N(C)C	ZINC000450636355	242050908	/nfs/dbraw/zinc/05/09/08/242050908.db2.gz	MPKQHKBNTIKDGH-WDEREUQCSA-N	0	3	300.497	2.139	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2ccc(CNC3CC3)cc2)C[C@@H]1C	ZINC000092091458	193155899	/nfs/dbraw/zinc/15/58/99/193155899.db2.gz	DRHNXUBHWAZTJK-STQMWFEESA-N	0	3	308.447	2.215	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)c(C)s1	ZINC000092113859	193161169	/nfs/dbraw/zinc/16/11/69/193161169.db2.gz	VPBZPRKJHFPIKJ-AOOOYVTPSA-N	0	3	302.465	2.052	10	0		DEAEHN
CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115596	193163608	/nfs/dbraw/zinc/16/36/08/193163608.db2.gz	RGHVKHMBPRLSRK-GFCCVEGCSA-N	0	3	300.399	2.238	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)c(F)c1	ZINC000092116292	193164101	/nfs/dbraw/zinc/16/41/01/193164101.db2.gz	XBARQPMVDFEAMN-VXGBXAGGSA-N	0	3	314.426	2.212	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2C[C@H](C)CC[C@@H]2C)c(F)c1	ZINC000092116275	193164167	/nfs/dbraw/zinc/16/41/67/193164167.db2.gz	NAXUBEGZKSGONN-NEPJUHHUSA-N	0	3	314.426	2.354	10	0		DEAEHN
c1c(CN[C@@H]2CCC[C@H](C3CC3)C2)nnn1C[C@@H]1CCOC1	ZINC000631164234	368055476	/nfs/dbraw/zinc/05/54/76/368055476.db2.gz	OWDGOLMHGWJFTA-CWRNSKLLSA-N	0	3	304.438	2.373	10	0		DEAEHN
c1c(CN[C@@H]2CC[C@@H]3CCC[C@@H]3C2)nnn1C[C@@H]1CCOC1	ZINC000631080222	368006470	/nfs/dbraw/zinc/00/64/70/368006470.db2.gz	XXFASAQEVWGJGI-CAOSSQGBSA-N	0	3	304.438	2.373	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)CSCc1ccccn1	ZINC000252443779	202835187	/nfs/dbraw/zinc/83/51/87/202835187.db2.gz	OYYNWSDIDCNWNO-ZFWWWQNUSA-N	0	3	305.447	2.010	10	0		DEAEHN
COCC[C@@H](NC[C@@H](O)COC)c1cccc(C(F)(F)F)c1	ZINC000451695500	243316724	/nfs/dbraw/zinc/31/67/24/243316724.db2.gz	QGCDZGRMIQWRKK-ZIAGYGMSSA-N	0	3	321.339	2.380	10	0		DEAEHN
COCCCN(CCOC)[C@H](CN)c1cc(Cl)cs1	ZINC000093095574	193203582	/nfs/dbraw/zinc/20/35/82/193203582.db2.gz	SAEKNCCTKUSJOL-GFCCVEGCSA-N	0	3	306.859	2.386	10	0		DEAEHN
CN1CCC2(CC1)CC(=O)NC(=O)[C@H]2c1ccc(Cl)cc1	ZINC000093161615	193209118	/nfs/dbraw/zinc/20/91/18/193209118.db2.gz	IOLDMYPQZAKVTE-CQSZACIVSA-N	0	3	306.793	2.182	10	0		DEAEHN
Cc1cc2ncc([C@H](C)NCCCN3CCCC3=O)c(C)n2n1	ZINC000093370054	193239161	/nfs/dbraw/zinc/23/91/61/193239161.db2.gz	ZQLWQCGKTLYQCQ-ZDUSSCGKSA-N	0	3	315.421	2.009	10	0		DEAEHN
CN[C@@H](Cc1ccc(F)cc1Br)C(OC)OC	ZINC000093304907	193227255	/nfs/dbraw/zinc/22/72/55/193227255.db2.gz	PDWBAJMPCNCWOS-NSHDSACASA-N	0	3	306.175	2.338	10	0		DEAEHN
CCN1CCC(N(C)c2ncc(N)cc2Br)CC1	ZINC000093432947	193250704	/nfs/dbraw/zinc/25/07/04/193250704.db2.gz	WHPBFVUDKHERJG-UHFFFAOYSA-N	0	3	313.243	2.347	10	0		DEAEHN
NC(=O)[C@]1(N)CCC[C@@H]1CCSc1nc2ccccc2o1	ZINC000093629331	193276208	/nfs/dbraw/zinc/27/62/08/193276208.db2.gz	SATWOYNDDGBRAF-BMIGLBTASA-N	0	3	305.403	2.293	10	0		DEAEHN
CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cnc[nH]2)C1	ZINC000093685006	193288734	/nfs/dbraw/zinc/28/87/34/193288734.db2.gz	DJPBSGIGQVHQFQ-NSHDSACASA-N	0	3	318.343	2.033	10	0		DEAEHN
CCC[NH2+][C@]1(C(=O)[O-])CCC[C@H](N(CC)CCOCC)C1	ZINC000093755072	193299301	/nfs/dbraw/zinc/29/93/01/193299301.db2.gz	HVZBWJRDHFOUOS-GOEBONIOSA-N	0	3	300.443	2.110	10	0		DEAEHN
COC(=O)[C@]1(N)CCC[C@H](N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000093756632	193301594	/nfs/dbraw/zinc/30/15/94/193301594.db2.gz	UZILLEWMBMZCBN-GVXVVHGQSA-N	0	3	308.344	2.074	10	0		DEAEHN
CCCN[C@H]1CCCc2sc([C@H]3CN(C)CCN3C)nc21	ZINC000093896272	193325702	/nfs/dbraw/zinc/32/57/02/193325702.db2.gz	PRMZQGUWIPVGMH-QWHCGFSZSA-N	0	3	308.495	2.438	10	0		DEAEHN
CC(C)(C)NCc1cnn([C@H]2CCC[C@@H](S(C)(=O)=O)C2)c1	ZINC000094644012	193389882	/nfs/dbraw/zinc/38/98/82/193389882.db2.gz	ILHXQKOQNVHOER-UONOGXRCSA-N	0	3	313.467	2.300	10	0		DEAEHN
CCC[C@@H]1CN(CCCS(C)(=O)=O)c2ccccc2CN1	ZINC000094421008	193368581	/nfs/dbraw/zinc/36/85/81/193368581.db2.gz	LAOHKMAKFZCCGX-OAHLLOKOSA-N	0	3	310.463	2.200	10	0		DEAEHN
CCCN[C@H](c1cc(Cl)cnc1N)[C@@H]1CSCCO1	ZINC000094504390	193374819	/nfs/dbraw/zinc/37/48/19/193374819.db2.gz	XTMWSOBOLCJZQG-NWDGAFQWSA-N	0	3	301.843	2.490	10	0		DEAEHN
COc1ncnc2c1[nH]c(=S)n2[C@@H](CC(C)C)CN(C)C	ZINC000094738890	193394740	/nfs/dbraw/zinc/39/47/40/193394740.db2.gz	QIZMBNJQBKKKRK-JTQLQIEISA-N	0	3	309.439	2.272	10	0		DEAEHN
COc1ccc(C[C@H](C)N[C@@H]2C[C@@H]3CCCCN3C2=O)cc1	ZINC000453429536	245135013	/nfs/dbraw/zinc/13/50/13/245135013.db2.gz	IKAPJWWRKGZZNX-JLJPHGGASA-N	0	3	302.418	2.369	10	0		DEAEHN
Cn1ncc(Br)c1CNC[C@H]1CCOC(C)(C)C1	ZINC000453577279	245193260	/nfs/dbraw/zinc/19/32/60/245193260.db2.gz	HIZYHSKWJVWUAB-JTQLQIEISA-N	0	3	316.243	2.477	10	0		DEAEHN
Cc1c(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)[nH]c2c1C(=O)CCC2	ZINC000266103255	205099029	/nfs/dbraw/zinc/09/90/29/205099029.db2.gz	SITOPOPQRDDRKT-AAEUAGOBSA-N	0	3	317.433	2.397	10	0		DEAEHN
CC(C)C[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)Nc1ccccc1	ZINC000022067442	182307663	/nfs/dbraw/zinc/30/76/63/182307663.db2.gz	LODYUHYUFPJMPF-GJZGRUSLSA-N	0	3	305.422	2.139	10	0	in-vitro	DEAEHN
CC(=O)c1cccc(O[C@@H](C)C(=O)N2CCC[C@H]2CN(C)C)c1	ZINC000267504773	206110746	/nfs/dbraw/zinc/11/07/46/206110746.db2.gz	HCJCQKBRHCQDTJ-HOCLYGCPSA-N	0	3	318.417	2.209	10	0		DEAEHN
C[C@H](CNCc1ccc(F)c(Br)c1)[S@](C)=O	ZINC000159809468	197366576	/nfs/dbraw/zinc/36/65/76/197366576.db2.gz	MXCUFABDGUYPCP-VPTHRUTESA-N	0	3	308.216	2.445	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2cc(Cl)cc3cccnc32)C1	ZINC000040632681	183111588	/nfs/dbraw/zinc/11/15/88/183111588.db2.gz	WLPWKEAWFCZMEH-DGCLKSJQSA-N	0	3	305.765	2.204	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)[C@@H]1CCCO1)c1ccc(OC)cc1	ZINC000040614858	183108642	/nfs/dbraw/zinc/10/86/42/183108642.db2.gz	VKPGRWIDFKDRPM-SJORKVTESA-N	0	3	320.433	2.373	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2ccc(C)cc2Br)C1	ZINC000040629741	183110928	/nfs/dbraw/zinc/11/09/28/183110928.db2.gz	KLWSIRSZASJVAD-CABZTGNLSA-N	0	3	313.195	2.073	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)CCNC(C)=O)c1ccc(C)cc1	ZINC000041309226	183185210	/nfs/dbraw/zinc/18/52/10/183185210.db2.gz	IKXJEMPAQLNOAY-QGZVFWFLSA-N	0	3	319.449	2.020	10	0		DEAEHN
COc1ccc2c(c1)nc(C)cc2N(C)[C@@H]1CCS(=O)(=O)C1	ZINC000041478767	183193811	/nfs/dbraw/zinc/19/38/11/183193811.db2.gz	CAZZPXPNCTYIBD-GFCCVEGCSA-N	0	3	320.414	2.175	10	0		DEAEHN
COC[C@@H](Cc1ccccc1)NCCNC(=O)c1ccccc1	ZINC000162531241	291682647	/nfs/dbraw/zinc/68/26/47/291682647.db2.gz	ZSOBGHFFTUGFEM-GOSISDBHSA-N	0	3	312.413	2.264	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)C(=O)NCCN1CCCC[C@@H]1C	ZINC000041664545	183213320	/nfs/dbraw/zinc/21/33/20/183213320.db2.gz	DQCVTIXVRFQLML-HNNXBMFYSA-N	0	3	317.433	2.233	10	0		DEAEHN
CCc1ccccc1NC(=O)C(=O)NCCN1CCCC[C@@H]1C	ZINC000041665290	183213992	/nfs/dbraw/zinc/21/39/92/183213992.db2.gz	VDVPDLLEEGDXJE-AWEZNQCLSA-N	0	3	317.433	2.178	10	0		DEAEHN
CC(C)NCc1cccc(Br)c1OCCC(N)=O	ZINC000042411865	183265840	/nfs/dbraw/zinc/26/58/40/183265840.db2.gz	VYLJSJMDQCOOBT-UHFFFAOYSA-N	0	3	315.211	2.201	10	0		DEAEHN
CCNCc1c(N(CCO)C(CC)CC)nc2sccn12	ZINC000042511978	183278684	/nfs/dbraw/zinc/27/86/84/183278684.db2.gz	VLBSNVZTPCKNSY-UHFFFAOYSA-N	0	3	310.467	2.493	10	0		DEAEHN
CCNCc1c(N(CCO)C2CCCC2)nc2sccn12	ZINC000042512202	183278777	/nfs/dbraw/zinc/27/87/77/183278777.db2.gz	HBGADGCYGZJJLV-UHFFFAOYSA-N	0	3	308.451	2.247	10	0		DEAEHN
COC[C@@H](O)CN(C)Cc1ccc(F)c(Br)c1	ZINC000042514072	183278832	/nfs/dbraw/zinc/27/88/32/183278832.db2.gz	BWBZLJRZLOAUQT-JTQLQIEISA-N	0	3	306.175	2.027	10	0		DEAEHN
CC(C)N(CC(F)(F)F)S(=O)(=O)c1cccc(CN)c1	ZINC000042768657	183306841	/nfs/dbraw/zinc/30/68/41/183306841.db2.gz	KHTZRPGZSORQJY-UHFFFAOYSA-N	0	3	310.341	2.107	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1N(C)S(=O)(=O)Cc1ccccc1CN	ZINC000042609408	183290323	/nfs/dbraw/zinc/29/03/23/183290323.db2.gz	RXQDASQPQYSKKO-CJNGLKHVSA-N	0	3	310.463	2.486	10	0		DEAEHN
CS(=O)(=O)c1ccc(O[C@@H](CN)c2ccc(F)cc2)cc1	ZINC000042942552	183319876	/nfs/dbraw/zinc/31/98/76/183319876.db2.gz	ZXHIKFDSZQOEPE-HNNXBMFYSA-N	0	3	309.362	2.308	10	0		DEAEHN
NC[C@@H](c1ccc(Br)cc1)N1CCC[C@H](CO)C1	ZINC000042953784	183322453	/nfs/dbraw/zinc/32/24/53/183322453.db2.gz	HZJMHROQHYBUFP-FZMZJTMJSA-N	0	3	313.239	2.153	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccccc1Cl)N(CC(N)=O)C1CCCC1	ZINC000043052479	183332767	/nfs/dbraw/zinc/33/27/67/183332767.db2.gz	YCULDEVESYUEIE-ZBEGNZNMSA-N	0	3	309.841	2.458	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccccc1Cl)N(C)CC(=O)N1CCCC1	ZINC000043052102	183333043	/nfs/dbraw/zinc/33/30/43/183333043.db2.gz	DPXIIRZEMCRZRG-WBMJQRKESA-N	0	3	309.841	2.283	10	0		DEAEHN
C[C@H](N)[C@H](c1ccc(Cl)s1)N(C)CC(=O)N1CCCC1	ZINC000043253441	183347883	/nfs/dbraw/zinc/34/78/83/183347883.db2.gz	WCGXNWCUWRRZIW-IINYFYTJSA-N	0	3	315.870	2.344	10	0		DEAEHN
NC[C@H](Sc1nc[nH]n1)c1cc(Br)cs1	ZINC000043290307	183351580	/nfs/dbraw/zinc/35/15/80/183351580.db2.gz	UUCQELIUVZEODN-ZETCQYMHSA-N	0	3	305.226	2.421	10	0		DEAEHN
CN[C@H](c1ccccc1Br)[C@H]1CCS(=O)(=O)C1	ZINC000043300421	183352634	/nfs/dbraw/zinc/35/26/34/183352634.db2.gz	MMIPAHJMZRJOBK-CABZTGNLSA-N	0	3	318.236	2.144	10	0		DEAEHN
CCOC(=O)[C@@H](NCCN(C)C)c1ccc(Cl)c(F)c1	ZINC000043391163	183358763	/nfs/dbraw/zinc/35/87/63/183358763.db2.gz	ZJVNGXZZTDTQGC-ZDUSSCGKSA-N	0	3	302.777	2.235	10	0		DEAEHN
NC[C@H](c1ccccc1Br)N1CCC(CO)CC1	ZINC000043091148	183335954	/nfs/dbraw/zinc/33/59/54/183335954.db2.gz	LHIYLZYBDXJNTF-CQSZACIVSA-N	0	3	313.239	2.153	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCCc2nc(C(C)(C)C)cs2)C1	ZINC000105295537	194094909	/nfs/dbraw/zinc/09/49/09/194094909.db2.gz	QIMCYUJOLZDCRA-GFCCVEGCSA-N	0	3	324.494	2.329	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)c2ccccc2)C[C@@H]1CC	ZINC000105838019	194144091	/nfs/dbraw/zinc/14/40/91/194144091.db2.gz	SBFHFYLWMGJQGZ-ROUUACIJSA-N	0	3	306.450	2.153	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)NC[C@H](C)c2ccccc2)c1	ZINC000105881300	194155121	/nfs/dbraw/zinc/15/51/21/194155121.db2.gz	RKYRUBKPDPYUDK-HOTGVXAUSA-N	0	3	314.433	2.090	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN([C@@H](C)C(=O)N(CC)CC)C1	ZINC000105897334	194162551	/nfs/dbraw/zinc/16/25/51/194162551.db2.gz	HCIABRFJAJXSDY-GJZGRUSLSA-N	0	3	306.454	2.339	10	0		DEAEHN
Cc1cccc(C)c1OCCN1CCN(C[C@@H](C)O)[C@H](C)C1	ZINC000105912461	194169871	/nfs/dbraw/zinc/16/98/71/194169871.db2.gz	BLZVRLCKASVIPK-IAGOWNOFSA-N	0	3	306.450	2.069	10	0		DEAEHN
COCCN1CCN(Cc2ccc(-n3ccnc3)cc2)C[C@@H]1C	ZINC000106108898	194188516	/nfs/dbraw/zinc/18/85/16/194188516.db2.gz	GRUDXUVGYUVTCX-INIZCTEOSA-N	0	3	314.433	2.025	10	0		DEAEHN
CN(C[C@@H]1CCCO1)[C@@H](CN)c1cc2c(c(Cl)c1)OCO2	ZINC000048947272	183698667	/nfs/dbraw/zinc/69/86/67/183698667.db2.gz	GOLXZBZNQPAXQE-AAEUAGOBSA-N	0	3	312.797	2.179	10	0		DEAEHN
COC[C@H](N)Cc1nc(-c2ccc(Br)cc2)no1	ZINC000109503318	194270081	/nfs/dbraw/zinc/27/00/81/194270081.db2.gz	JEGHOIQHDPJINC-SNVBAGLBSA-N	0	3	312.167	2.015	10	0		DEAEHN
COCCN(C)c1ncc(Br)cc1CNC1CC1	ZINC000051519610	183828088	/nfs/dbraw/zinc/82/80/88/183828088.db2.gz	BHAWTZLDVQKGOO-UHFFFAOYSA-N	0	3	314.227	2.179	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)s1)N1CCNC(=O)[C@@H]1C	ZINC000110655166	194347083	/nfs/dbraw/zinc/34/70/83/194347083.db2.gz	UVHKUFTZCGEXFG-AUTRQRHGSA-N	0	3	301.843	2.000	10	0		DEAEHN
CC[C@@H]1CNCCN1c1ccccc1S(=O)(=O)C(F)(F)F	ZINC000110678167	194349371	/nfs/dbraw/zinc/34/93/71/194349371.db2.gz	SYKUNTCAZOENRT-SNVBAGLBSA-N	0	3	322.352	2.168	10	0		DEAEHN
CNc1ccc(C(=O)N(C)CCN(C)C)cc1C(F)(F)F	ZINC000111151611	194396852	/nfs/dbraw/zinc/39/68/52/194396852.db2.gz	XLAIQPYKLMVZDG-UHFFFAOYSA-N	0	3	303.328	2.381	10	0		DEAEHN
C[C@@H](c1cccc(F)c1)N1CCC[C@H](C(=O)N2CCOCC2)C1	ZINC000056492091	184013773	/nfs/dbraw/zinc/01/37/73/184013773.db2.gz	CTEFURTWYWHNGK-HOCLYGCPSA-N	0	3	320.408	2.458	10	0		DEAEHN
Cc1cc(NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)no1	ZINC000056347302	184011271	/nfs/dbraw/zinc/01/12/71/184011271.db2.gz	JHFQDEQRDMJBLY-AWEZNQCLSA-N	0	3	302.378	2.277	10	0		DEAEHN
COCCN(C)CCNc1ccc(Br)cc1N	ZINC000061378017	184169346	/nfs/dbraw/zinc/16/93/46/184169346.db2.gz	QKHMDLVPEOINLJ-UHFFFAOYSA-N	0	3	302.216	2.021	10	0		DEAEHN
CCCC(CCC)(C(N)=S)C(=O)N1CCC[C@@H]1CN(C)C	ZINC000061646163	184181028	/nfs/dbraw/zinc/18/10/28/184181028.db2.gz	IEDWNPNKPLGAOF-CYBMUJFWSA-N	0	3	313.511	2.412	10	0		DEAEHN
CN[C@H]1CCN(c2cc(Br)ccc2Cl)C1=O	ZINC000061691688	184183086	/nfs/dbraw/zinc/18/30/86/184183086.db2.gz	MISLSECCKGPAGK-VIFPVBQESA-N	0	3	303.587	2.427	10	0		DEAEHN
C[C@H](CC(N)=O)C[C@H](N)c1cc2c(cc1Cl)OCCCO2	ZINC000061830311	184188955	/nfs/dbraw/zinc/18/89/55/184188955.db2.gz	LXGLRGVYGQQIFM-CABZTGNLSA-N	0	3	312.797	2.403	10	0		DEAEHN
Cc1ccc(F)c(S(=O)(=O)[N-]Cc2ccccc2C[NH3+])c1	ZINC000061841304	184189400	/nfs/dbraw/zinc/18/94/00/184189400.db2.gz	JCBAHDYNSJRXSZ-UHFFFAOYSA-N	0	3	308.378	2.071	10	0		DEAEHN
Cn1cc(Br)cc1C(=O)NCc1ccccc1CN	ZINC000061840960	184189502	/nfs/dbraw/zinc/18/95/02/184189502.db2.gz	BSNZEPBVUZEWLC-UHFFFAOYSA-N	0	3	322.206	2.176	10	0		DEAEHN
C[C@@H]([C@H](N)c1ccccc1)N1CCN(CC(F)(F)F)CC1	ZINC000061941119	184197339	/nfs/dbraw/zinc/19/73/39/184197339.db2.gz	XZULCUSBCSEWFZ-JSGCOSHPSA-N	0	3	301.356	2.255	10	0		DEAEHN
COCCN1C(=O)C[C@@H](N)[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000062210258	184220704	/nfs/dbraw/zinc/22/07/04/184220704.db2.gz	RIBLIBKEOYYMCA-YPMHNXCESA-N	0	3	303.189	2.241	10	0		DEAEHN
CC(C)N1C(=O)CC[C@@H](N)[C@@H]1c1ccc(Br)o1	ZINC000062211598	184221753	/nfs/dbraw/zinc/22/17/53/184221753.db2.gz	LXJQOPFMWPHTAJ-PRHODGIISA-N	0	3	301.184	2.441	10	0		DEAEHN
CC(C)CNCc1c(Cl)cccc1N1CCNC(=O)CC1	ZINC000062738459	184251793	/nfs/dbraw/zinc/25/17/93/184251793.db2.gz	GKXVHOCKXMUWNC-UHFFFAOYSA-N	0	3	309.841	2.412	10	0		DEAEHN
CCN[C@@H](C)c1ccc(F)cc1OCCS(=O)(=O)CC	ZINC000062746904	184251948	/nfs/dbraw/zinc/25/19/48/184251948.db2.gz	FKKNUUQMTFNOQB-NSHDSACASA-N	0	3	303.399	2.310	10	0		DEAEHN
CS(=O)(=O)c1ccc(N2CCNCc3ccccc32)cc1	ZINC000062819156	184254189	/nfs/dbraw/zinc/25/41/89/184254189.db2.gz	ZMRSDPCLMZHTMV-UHFFFAOYSA-N	0	3	302.399	2.331	10	0		DEAEHN
Cn1cc(Br)cc1C(=O)NC[C@@H](N)c1ccccc1	ZINC000062837842	184255788	/nfs/dbraw/zinc/25/57/88/184255788.db2.gz	HRIYTFSTZAMVKP-GFCCVEGCSA-N	0	3	322.206	2.217	10	0		DEAEHN
CCCNc1ncc(C(=O)N2CC[C@@H](N(C)C)C2)cc1Cl	ZINC000062984787	184264904	/nfs/dbraw/zinc/26/49/04/184264904.db2.gz	HKFLLRJGYHAPBV-GFCCVEGCSA-N	0	3	310.829	2.333	10	0		DEAEHN
CC(C)NCC(=O)Nc1cccc(NC(=O)c2ccco2)c1	ZINC000066215593	184397085	/nfs/dbraw/zinc/39/70/85/184397085.db2.gz	SFCWNOYMHKENDD-UHFFFAOYSA-N	0	3	301.346	2.468	10	0		DEAEHN
CCCCNCC(=O)Nc1ccc(C(=O)N(CC)CC)cc1	ZINC000066213909	184397115	/nfs/dbraw/zinc/39/71/15/184397115.db2.gz	AUMHKZANDLUNLF-UHFFFAOYSA-N	0	3	305.422	2.497	10	0		DEAEHN
CNCC(=O)Nc1ccc(NC(=O)CCc2ccccc2)cc1	ZINC000066225857	184398104	/nfs/dbraw/zinc/39/81/04/184398104.db2.gz	YONIZYDAVLPGQM-UHFFFAOYSA-N	0	3	311.385	2.416	10	0		DEAEHN
CN1c2ccc(CN3CCCN(C4CC4)CC3)cc2CCC1=O	ZINC000186921625	207368564	/nfs/dbraw/zinc/36/85/64/207368564.db2.gz	VMGFEGXZFWINLJ-UHFFFAOYSA-N	0	3	313.445	2.266	10	0		DEAEHN
c1nc(N2CCCC2)ncc1CN1CCC[C@@]2(CCCOC2)C1	ZINC000537635068	285008995	/nfs/dbraw/zinc/00/89/95/285008995.db2.gz	PUFNLMCUWUJIKB-GOSISDBHSA-N	0	3	316.449	2.469	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(C(=O)[C@@H]3CCCCN3)C2)c1	ZINC000119788877	195036819	/nfs/dbraw/zinc/03/68/19/195036819.db2.gz	OZSDTCAOZVYYKJ-GUYCJALGSA-N	0	3	318.417	2.162	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCO[C@H](c3ccsc3)C2)C1	ZINC000119733371	195027472	/nfs/dbraw/zinc/02/74/72/195027472.db2.gz	OIPGEKAFAWMPRD-CABCVRRESA-N	0	3	323.462	2.315	10	0		DEAEHN
COCOc1ccc(OC)cc1CN[C@H]1CCCC[C@H]1CO	ZINC000120010169	195080733	/nfs/dbraw/zinc/08/07/33/195080733.db2.gz	NZNQCEZKNRSUMP-BBRMVZONSA-N	0	3	309.406	2.319	10	0		DEAEHN
C[C@H]1CN[C@](C)(c2ccccc2)CN1C1CCS(=O)CC1	ZINC000159207483	197336494	/nfs/dbraw/zinc/33/64/94/197336494.db2.gz	HEJJNXQGGIEEJR-GGXMVYKUSA-N	0	3	306.475	2.107	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000159110167	197328459	/nfs/dbraw/zinc/32/84/59/197328459.db2.gz	ADAKGVOFVKZMRP-LLVKDONJSA-N	0	3	306.284	2.278	10	0		DEAEHN
COc1cc2c(cc1[C@@H](CN)NCC(F)(F)F)O[C@@H](C)C2	ZINC000159065787	197323317	/nfs/dbraw/zinc/32/33/17/197323317.db2.gz	DMRIWGWPBVMTNT-GZMMTYOYSA-N	0	3	304.312	2.170	10	0		DEAEHN
CCN[C@@H](CS(=O)(=O)c1cccc(Cl)c1)[C@@H]1CCOC1	ZINC000158836963	197305263	/nfs/dbraw/zinc/30/52/63/197305263.db2.gz	AMDSBSAHSVKGOZ-RISCZKNCSA-N	0	3	317.838	2.128	10	0		DEAEHN
CCCN[C@H](CS(=O)(=O)c1ccccc1C)[C@@H]1CCOC1	ZINC000158829239	197304784	/nfs/dbraw/zinc/30/47/84/197304784.db2.gz	WCKVQINBLONLTJ-HUUCEWRRSA-N	0	3	311.447	2.173	10	0		DEAEHN
COc1ccsc1[C@H](O)c1c(Cl)cnn1CCN(C)C	ZINC000158678263	197294256	/nfs/dbraw/zinc/29/42/56/197294256.db2.gz	PSTXPDJZCLEUQJ-GFCCVEGCSA-N	0	3	315.826	2.250	10	0		DEAEHN
O=S1CCC(NC2=N[C@@H](Cc3ccccc3)CS2)CC1	ZINC000158576546	197284556	/nfs/dbraw/zinc/28/45/56/197284556.db2.gz	SMTJFWSTQDTTII-DMAKZNTKSA-N	0	3	308.472	2.201	10	0		DEAEHN
CCc1nn(C)c(C[C@H](N)c2cscn2)c1Br	ZINC000158539124	197282021	/nfs/dbraw/zinc/28/20/21/197282021.db2.gz	SDSWOFMUJHZALK-ZETCQYMHSA-N	0	3	315.240	2.444	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccc(OC)c(OCC)c1)N(C)C	ZINC000158438765	197272431	/nfs/dbraw/zinc/27/24/31/197272431.db2.gz	RFJAHNREVXJRTO-AWEZNQCLSA-N	0	3	308.422	2.440	10	0		DEAEHN
COC(=O)[C@](C)(C[C@@H](C)N(C)CCOC(C)C)NC(C)C	ZINC000157499764	197192359	/nfs/dbraw/zinc/19/23/59/197192359.db2.gz	UVXJJCLCFKCVPW-ZBFHGGJFSA-N	0	3	302.459	2.052	10	0		DEAEHN
CCc1nn(C)c(C[C@@](C)(F)C[C@@H]2COCCN2)c1Cl	ZINC000157546079	197196127	/nfs/dbraw/zinc/19/61/27/197196127.db2.gz	CETXVUHYOSOKHD-YGRLFVJLSA-N	0	3	303.809	2.285	10	0		DEAEHN
C[C@@](O)(Cc1ccc(Br)cc1)C[C@@H]1COCCN1	ZINC000156909263	197149286	/nfs/dbraw/zinc/14/92/86/197149286.db2.gz	ZHXGFDPHHCLFOX-ZIAGYGMSSA-N	0	3	314.223	2.121	10	0		DEAEHN
O=c1[nH]c2ccccc2n1C1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000028234728	285200824	/nfs/dbraw/zinc/20/08/24/285200824.db2.gz	QJCCAWADLGRXFF-SJORKVTESA-N	0	3	315.417	2.270	10	0		DEAEHN
C[C@@H](N)c1cccc(S(=O)(=O)NC[C@@H]2CCCCS2)c1	ZINC000156468742	197115331	/nfs/dbraw/zinc/11/53/31/197115331.db2.gz	PVKLESURKRKQIB-YPMHNXCESA-N	0	3	314.476	2.270	10	0		DEAEHN
C[C@H]1CNC[C@H](C)N1C(=O)c1cccc(F)c1Br	ZINC000155994732	197079221	/nfs/dbraw/zinc/07/92/21/197079221.db2.gz	UCWTWZDYGUWZMX-IUCAKERBSA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@H](C(=O)Nc1cccc(CN)c1)[S@@](=O)c1cccs1	ZINC000155970550	197078363	/nfs/dbraw/zinc/07/83/63/197078363.db2.gz	DJOVQBNJWNYJCZ-SBKAZYGRSA-N	0	3	308.428	2.342	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cc(-c3ccncc3)on2)C1	ZINC000155650625	197075386	/nfs/dbraw/zinc/07/53/86/197075386.db2.gz	DQQZYWCEVRYIIM-DOMZBBRYSA-N	0	3	314.389	2.195	10	0		DEAEHN
C[C@H]1CCC[C@@]2(CSC(NC[C@@H]3CCCS3(=O)=O)=N2)C1	ZINC000155416980	197053373	/nfs/dbraw/zinc/05/33/73/197053373.db2.gz	DGVPEWQYSCBBCN-OBJOEFQTSA-N	0	3	316.492	2.205	10	0		DEAEHN
COc1ccccc1CN1CCOC[C@@H](CC(=O)N(C)C)[C@@H]1C	ZINC000248042121	257110474	/nfs/dbraw/zinc/11/04/74/257110474.db2.gz	VTIIJACDXXHLBN-GOEBONIOSA-N	0	3	320.433	2.010	10	0		DEAEHN
O=C(C[C@@H]1OC[C@@H]2CN(Cc3ccsc3)CC[C@H]12)NC1CC1	ZINC000247801193	257117182	/nfs/dbraw/zinc/11/71/82/257117182.db2.gz	VWPRVUCMBKGICY-BPUTZDHNSA-N	0	3	320.458	2.254	10	0		DEAEHN
O=C(NC1CC1)[C@]12CCO[C@H]1CCN(Cc1ccsc1)C2	ZINC000247722599	257118992	/nfs/dbraw/zinc/11/89/92/257118992.db2.gz	BOTVVWOAUHAVII-HOCLYGCPSA-N	0	3	306.431	2.008	10	0		DEAEHN
CN(CC(=O)NCc1ccc2c(c1)OCO2)C[C@H]1CC=CCC1	ZINC000544114495	285332512	/nfs/dbraw/zinc/33/25/12/285332512.db2.gz	IDUOJUASOOEGKZ-AWEZNQCLSA-N	0	3	316.401	2.320	10	0		DEAEHN
COc1ccc(C(=O)CCCC(=O)N(C)CCCN(C)C)cc1	ZINC000561310740	291959647	/nfs/dbraw/zinc/95/96/47/291959647.db2.gz	NJGABOXVLXTXGF-UHFFFAOYSA-N	0	3	320.433	2.458	10	0		DEAEHN
COc1ccc(Cn2cc([C@H](C)N)nn2)cc1Br	ZINC000124335638	195629736	/nfs/dbraw/zinc/62/97/36/195629736.db2.gz	ZFPNUIFKTKVYAY-QMMMGPOBSA-N	0	3	311.183	2.117	10	0		DEAEHN
C[C@H](NCCc1cn(C)cn1)c1ccc(Br)cn1	ZINC000562738389	292007500	/nfs/dbraw/zinc/00/75/00/292007500.db2.gz	VVSUYDGPWZQYLI-JTQLQIEISA-N	0	3	309.211	2.471	10	0		DEAEHN
O=C(C[C@H]1CSCCN1)N1CCC(Oc2ccccc2)CC1	ZINC000238081150	132561810	/nfs/dbraw/zinc/56/18/10/132561810.db2.gz	QAYTVTUENWAQFY-AWEZNQCLSA-N	0	3	320.458	2.152	10	0		DEAEHN
COC(=O)c1ccc(C(=O)N[C@H](CC(C)C)CN(C)C)s1	ZINC000078614993	292008641	/nfs/dbraw/zinc/00/86/41/292008641.db2.gz	RLQXWYPDTVABJN-LLVKDONJSA-N	0	3	312.435	2.241	10	0		DEAEHN
c1ccc2c(c1)OCC[C@@H]2CN1CCN(c2cccnn2)CC1	ZINC000372409480	285519939	/nfs/dbraw/zinc/51/99/39/285519939.db2.gz	GEGLEOZLIVGBOO-OAHLLOKOSA-N	0	3	310.401	2.165	10	0		DEAEHN
Cc1ccc([C@H](C)N[C@@H]2CCN(C3CCOCC3)C2=O)cc1	ZINC000358182583	133126533	/nfs/dbraw/zinc/12/65/33/133126533.db2.gz	CSXIIHJSWCEAPA-WMLDXEAASA-N	0	3	302.418	2.426	10	0		DEAEHN
O=C1[C@H](N[C@@H]2CCc3ccccc32)CCN1C1CCOCC1	ZINC000358201218	133128308	/nfs/dbraw/zinc/12/83/08/133128308.db2.gz	JKTWXPCNBJDWBP-IAGOWNOFSA-N	0	3	300.402	2.043	10	0		DEAEHN
C[C@H](C(=O)N1C[C@]2(CCOC2)OC(C)(C)C1)N1[C@H](C)CC[C@@H]1C	ZINC000358234729	133130508	/nfs/dbraw/zinc/13/05/08/133130508.db2.gz	JCLJQADGTSZIBN-FSZRXZPDSA-N	0	3	324.465	2.044	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CC[C@H](OCc2ccncc2)C1	ZINC000360185997	133167742	/nfs/dbraw/zinc/16/77/42/133167742.db2.gz	YGSUJENHOMSRBV-DLBZAZTESA-N	0	3	317.433	2.074	10	0		DEAEHN
Cc1cc(CCN[C@@H](C)CC(=O)NCCc2ccccc2)on1	ZINC000563331467	292046569	/nfs/dbraw/zinc/04/65/69/292046569.db2.gz	ANOLBVVGRKZFRB-AWEZNQCLSA-N	0	3	315.417	2.253	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N1CCCN(C2CC2)CC1	ZINC000187501113	145000452	/nfs/dbraw/zinc/00/04/52/145000452.db2.gz	PMMBNRVHPHKDPT-ZDUSSCGKSA-N	0	3	318.421	2.031	10	0		DEAEHN
Cc1ccc(C)c(OC[C@H](O)CN(C)C[C@@H]2CCCO2)c1C	ZINC000187814681	145003611	/nfs/dbraw/zinc/00/36/11/145003611.db2.gz	GIEWGXRZTXDKOS-SJORKVTESA-N	0	3	307.434	2.462	10	0		DEAEHN
O=C([C@@H]1C[C@@H]1c1cccc(F)c1F)N1CCN2CCC1CC2	ZINC000188668635	145015682	/nfs/dbraw/zinc/01/56/82/145015682.db2.gz	YUTSRXMUGPZWHW-ZIAGYGMSSA-N	0	3	306.356	2.375	10	0		DEAEHN
COCOc1ccc(OC)cc1CN[C@@H]1C[C@H]2OCCC[C@H]12	ZINC000190337443	145041143	/nfs/dbraw/zinc/04/11/43/145041143.db2.gz	ICIOWKRMVOHLQE-BFYDXBDKSA-N	0	3	307.390	2.335	10	0		DEAEHN
c1cc(OCC2CC2)ccc1CNC[C@@H]1CN(C2CC2)CCO1	ZINC000190978830	145051416	/nfs/dbraw/zinc/05/14/16/145051416.db2.gz	VPDMGDIQMSIESJ-LJQANCHMSA-N	0	3	316.445	2.428	10	0		DEAEHN
CC[C@H](C)CC(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000191810197	145064916	/nfs/dbraw/zinc/06/49/16/145064916.db2.gz	NUHKDLXOORKMLK-HNNXBMFYSA-N	0	3	318.465	2.228	10	0		DEAEHN
COc1ccc(OC)c(NC(=O)[C@H](C)N[C@@H](C)[C@H]2CCCO2)c1	ZINC000193129087	145082856	/nfs/dbraw/zinc/08/28/56/145082856.db2.gz	CNRFZADPMDQVDP-SLEUVZQESA-N	0	3	322.405	2.188	10	0		DEAEHN
COc1ccc(F)cc1C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000246226149	145095516	/nfs/dbraw/zinc/09/55/16/145095516.db2.gz	HGCZVRYVSYVNPQ-SWLSCSKDSA-N	0	3	306.381	2.391	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2OCCc3ccccc32)CCN1C	ZINC000246231301	145095936	/nfs/dbraw/zinc/09/59/36/145095936.db2.gz	GFNAUWFFWIGXFB-FRFSOERESA-N	0	3	302.418	2.242	10	0		DEAEHN
O=C(CN1CCN2CCC[C@H]2C1)Nc1cc(Cl)ccc1F	ZINC000246240711	145096040	/nfs/dbraw/zinc/09/60/40/145096040.db2.gz	DEBIOYOIAWGRGL-LBPRGKRZSA-N	0	3	311.788	2.198	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)C1	ZINC000246608734	145107935	/nfs/dbraw/zinc/10/79/35/145107935.db2.gz	DKIWPBKJMFYHKN-OWLYRPNTSA-N	0	3	313.445	2.356	10	0		DEAEHN
C[C@H](C(=O)NC[C@@H]1CCCO1)N1CCC[C@]2(CC=CCC2)C1	ZINC000246676063	145110237	/nfs/dbraw/zinc/11/02/37/145110237.db2.gz	GMZJRYXFCJZVBJ-SOLBZPMBSA-N	0	3	306.450	2.492	10	0		DEAEHN
C[C@H](CNC(=O)N1CC[C@H]2OCCC[C@@H]2C1)N1CCC[C@@H](C)C1	ZINC000246695402	145110543	/nfs/dbraw/zinc/11/05/43/145110543.db2.gz	NBDQDRDSMDRZEY-QBPKDAKJSA-N	0	3	323.481	2.317	10	0		DEAEHN
COc1ccc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cc1OC	ZINC000246770732	145113707	/nfs/dbraw/zinc/11/37/07/145113707.db2.gz	QKPGGFLCNILJBB-LSDHHAIUSA-N	0	3	318.417	2.260	10	0		DEAEHN
CC(C)[N@@H+]1C[C@H](C)[C@H](NC(=O)NCc2ccc([O-])c(F)c2)C1	ZINC000246997617	145122434	/nfs/dbraw/zinc/12/24/34/145122434.db2.gz	GTMIFVMGOFQKEA-SMDDNHRTSA-N	0	3	309.385	2.059	10	0		DEAEHN
CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)NCc2ccc([O-])c(F)c2)C1	ZINC000246997617	145122436	/nfs/dbraw/zinc/12/24/36/145122436.db2.gz	GTMIFVMGOFQKEA-SMDDNHRTSA-N	0	3	309.385	2.059	10	0		DEAEHN
COc1cccc([C@H](C)CC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000247016787	145123969	/nfs/dbraw/zinc/12/39/69/145123969.db2.gz	SGFUXVNEYHYBBO-ZBFHGGJFSA-N	0	3	302.418	2.495	10	0		DEAEHN
CN(C[C@@H]1CCCN(C)C1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000247067643	145124834	/nfs/dbraw/zinc/12/48/34/145124834.db2.gz	CBJCUPALWWXZRL-ZBFHGGJFSA-N	0	3	317.433	2.493	10	0		DEAEHN
c1c(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)nc2ncccn12	ZINC000247056625	145124937	/nfs/dbraw/zinc/12/49/37/145124937.db2.gz	ZMYFPNMAZGZBDN-YOEHRIQHSA-N	0	3	311.433	2.178	10	0		DEAEHN
Cc1cccc(C)c1OCCCN1CCN(C[C@@H](C)O)[C@@H](C)C1	ZINC000247102207	145126243	/nfs/dbraw/zinc/12/62/43/145126243.db2.gz	VAPAZGQYKDLBOZ-ZWKOTPCHSA-N	0	3	320.477	2.459	10	0		DEAEHN
COCCOc1ccc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1	ZINC000247371480	145135355	/nfs/dbraw/zinc/13/53/55/145135355.db2.gz	PEFKZBGMILZTSB-WMLDXEAASA-N	0	3	320.433	2.170	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)[C@H]1C[C@@H]1C1CCCCC1	ZINC000247429346	145136579	/nfs/dbraw/zinc/13/65/79/145136579.db2.gz	ONCUQGKHJPJGTA-ZACQAIPSSA-N	0	3	308.466	2.430	10	0		DEAEHN
CCOc1ccccc1OCC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000247412748	145136745	/nfs/dbraw/zinc/13/67/45/145136745.db2.gz	NJAMYNDNTHNMDQ-GJZGRUSLSA-N	0	3	320.433	2.405	10	0		DEAEHN
C[C@H](C(=O)N1CCCCC1)N1CC[C@@H](CNc2ccccn2)C1	ZINC000247445164	145137247	/nfs/dbraw/zinc/13/72/47/145137247.db2.gz	YHUOMRNCSORCFK-CVEARBPZSA-N	0	3	316.449	2.216	10	0		DEAEHN
CC[C@@H]1CN(CCCCCn2cc(C)cn2)CCN1C[C@H](C)O	ZINC000247591387	145142110	/nfs/dbraw/zinc/14/21/10/145142110.db2.gz	NIMXNHQSLZNIIX-ZWKOTPCHSA-N	0	3	322.497	2.139	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000248449981	145155518	/nfs/dbraw/zinc/15/55/18/145155518.db2.gz	OWVPIHHAWMTOKQ-WMLDXEAASA-N	0	3	319.449	2.097	10	0		DEAEHN
CC[C@H](C)[C@H](C)C(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000248574211	145159221	/nfs/dbraw/zinc/15/92/21/145159221.db2.gz	OXGIXCLCXXXGMG-YESZJQIVSA-N	0	3	309.498	2.297	10	0		DEAEHN
Cc1cn(-c2ccccc2)nc1C(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000248590297	145159813	/nfs/dbraw/zinc/15/98/13/145159813.db2.gz	YCQFKYQMPXVFHS-WBVHZDCISA-N	0	3	324.428	2.489	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCC[C@H]1c1c(C)nn(C)c1C	ZINC000248641112	145162808	/nfs/dbraw/zinc/16/28/08/145162808.db2.gz	CIXMKQYUSZUPNQ-HOTGVXAUSA-N	0	3	309.454	2.351	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)C1	ZINC000248651138	145163337	/nfs/dbraw/zinc/16/33/37/145163337.db2.gz	SNNYFJPHLWEOKD-GRYCIOLGSA-N	0	3	312.335	2.370	10	0		DEAEHN
CN(Cc1ccc2c(c1)sc(=O)n2C)C[C@H]1CCC[C@H]1O	ZINC000248720127	145165054	/nfs/dbraw/zinc/16/50/54/145165054.db2.gz	GKAVVVXHXXNKOV-TZMCWYRMSA-N	0	3	306.431	2.193	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)C1	ZINC000248824367	145168685	/nfs/dbraw/zinc/16/86/85/145168685.db2.gz	LRHFIUSCLKTVSK-BRWVUGGUSA-N	0	3	317.433	2.252	10	0		DEAEHN
O=C(Nc1ccccc1)[C@H]1CCCN([C@H]2CCCCNC2=O)C1	ZINC000249098801	145178250	/nfs/dbraw/zinc/17/82/50/145178250.db2.gz	AUUMVKPVEAHHES-HOCLYGCPSA-N	0	3	315.417	2.006	10	0		DEAEHN
CN(Cc1cccc(F)c1)C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C	ZINC000261611791	145210406	/nfs/dbraw/zinc/21/04/06/145210406.db2.gz	BGFZMOGVKSKMJW-HDMKZQKVSA-N	0	3	320.408	2.317	10	0		DEAEHN
CC(C)CC(=O)Nc1ccc(NC(=O)C2(N)CCOCC2)cc1	ZINC000261655552	145214327	/nfs/dbraw/zinc/21/43/27/145214327.db2.gz	FTVQAUKPMJAQMV-UHFFFAOYSA-N	0	3	319.405	2.118	10	0		DEAEHN
CC(=O)Nc1ccc(CN2CCNC[C@@H]2c2cccnc2)cc1	ZINC000261656242	145214523	/nfs/dbraw/zinc/21/45/23/145214523.db2.gz	HSPGYJBFRDKNQW-GOSISDBHSA-N	0	3	310.401	2.187	10	0		DEAEHN
Cc1coc(-c2cccc(NC(=O)C3(N)CCOCC3)c2)n1	ZINC000261670921	145214925	/nfs/dbraw/zinc/21/49/25/145214925.db2.gz	BWZOPVYJEBWHHR-UHFFFAOYSA-N	0	3	301.346	2.096	10	0		DEAEHN
Cc1ccccc1C1CCN(C(=O)C2(N)CCOCC2)CC1	ZINC000261753253	145222788	/nfs/dbraw/zinc/22/27/88/145222788.db2.gz	FLLWTMDIHZTILU-UHFFFAOYSA-N	0	3	302.418	2.209	10	0		DEAEHN
c1cnn(-c2cccc(CN3CCNC[C@@H]3c3cccnc3)c2)c1	ZINC000261813034	145228901	/nfs/dbraw/zinc/22/89/01/145228901.db2.gz	WZNZLLFNYMLWIL-LJQANCHMSA-N	0	3	319.412	2.414	10	0		DEAEHN
CCOC(=O)C[C@@H]1C[C@H](OC)CN1Cc1cccc2c1NCC2	ZINC000261928384	145243602	/nfs/dbraw/zinc/24/36/02/145243602.db2.gz	LFPSXPZQGRSACG-HOTGVXAUSA-N	0	3	318.417	2.197	10	0		DEAEHN
Nc1ncc(CN2CCC(c3nnc4ccccn43)CC2)s1	ZINC000261957038	145247281	/nfs/dbraw/zinc/24/72/81/145247281.db2.gz	GTNZACHBQMHHAI-UHFFFAOYSA-N	0	3	314.418	2.148	10	0		DEAEHN
Cc1coc(-c2cccc(NC(=O)[C@@H](N)C3CCOCC3)c2)n1	ZINC000262046445	145256651	/nfs/dbraw/zinc/25/66/51/145256651.db2.gz	QPSCZNZYLNBESN-HNNXBMFYSA-N	0	3	315.373	2.342	10	0		DEAEHN
C[C@H](C[C@@H]1COCCN1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000262101508	145261713	/nfs/dbraw/zinc/26/17/13/145261713.db2.gz	IUQPGCCULMRHDF-MLGOLLRUSA-N	0	3	303.406	2.214	10	0		DEAEHN
CNCCC(=O)/N=c1/sccn1Cc1ccccc1Cl	ZINC000262301786	145275102	/nfs/dbraw/zinc/27/51/02/145275102.db2.gz	BPYIGASPLGYCOK-SAPNQHFASA-N	0	3	309.822	2.288	10	0		DEAEHN
Cc1csc([C@H](C)NC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)n1	ZINC000262430868	145283662	/nfs/dbraw/zinc/28/36/62/145283662.db2.gz	FVFSPKVCQPMUNZ-PVTKRXDGSA-N	0	3	323.462	2.161	10	0		DEAEHN
C[C@@H](NC(=O)[C@H]1NCCCC1(C)C)c1ccc2c(c1)OCO2	ZINC000262550205	145291965	/nfs/dbraw/zinc/29/19/65/145291965.db2.gz	SGPHYRYDJDPCEB-IAQYHMDHSA-N	0	3	304.390	2.371	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(COc2cccc3ccccc32)n1	ZINC000263155834	145330462	/nfs/dbraw/zinc/33/04/62/145330462.db2.gz	DMJVATRLLDNXSY-HNNXBMFYSA-N	0	3	324.384	2.378	10	0		DEAEHN
C[C@@H]1CCc2sc(-c3nc([C@H]4CNCCN4C)no3)cc2C1	ZINC000263200642	145335740	/nfs/dbraw/zinc/33/57/40/145335740.db2.gz	JAIRNQIPVDRXMR-ZYHUDNBSSA-N	0	3	318.446	2.499	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2cc(-c3cccs3)on2)n1	ZINC000263205808	145336063	/nfs/dbraw/zinc/33/60/63/145336063.db2.gz	JRVIFEPZQKKKCO-SNVBAGLBSA-N	0	3	317.374	2.029	10	0		DEAEHN
Cc1nc(C(C)(C)C)sc1-c1nc([C@H]2CNCCN2C)no1	ZINC000263204752	145336262	/nfs/dbraw/zinc/33/62/62/145336262.db2.gz	JOHBSEFPSLPNJA-SNVBAGLBSA-N	0	3	321.450	2.375	10	0		DEAEHN
C[C@H](Cc1nc([C@@H]2CNCCN2C)no1)c1ccc(F)cc1	ZINC000263222205	145338165	/nfs/dbraw/zinc/33/81/65/145338165.db2.gz	MCHSZQIDWKMCDH-RISCZKNCSA-N	0	3	304.369	2.131	10	0		DEAEHN
O[C@H](CCNCc1cncc(Br)c1)C(F)(F)F	ZINC000349333427	146369507	/nfs/dbraw/zinc/36/95/07/146369507.db2.gz	QHMSUOXASLQAQL-SECBINFHSA-N	0	3	313.117	2.247	10	0		DEAEHN
COCCn1c(SC[C@H](C)N(C)C)nnc1-c1ccncc1	ZINC000358853976	147219557	/nfs/dbraw/zinc/21/95/57/147219557.db2.gz	NNEWDGOSKPKMNR-LBPRGKRZSA-N	0	3	321.450	2.029	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@@H]2N(C)CCCC2(C)C)C1	ZINC000359040731	147251772	/nfs/dbraw/zinc/25/17/72/147251772.db2.gz	JKNRAHUXWIHIGX-AWEZNQCLSA-N	0	3	311.470	2.175	10	0		DEAEHN
COc1cccc(CNC[C@@H]2CCC3(CCOCC3)[C@@H]2O)c1F	ZINC000374719586	148282555	/nfs/dbraw/zinc/28/25/55/148282555.db2.gz	VVTZXGZMVXYHOM-WMLDXEAASA-N	0	3	323.408	2.492	10	0		DEAEHN
CC(C)c1ccc(CN(C)C[C@H](O)CN2CCCC2=O)cc1	ZINC000111683133	401720721	/nfs/dbraw/zinc/72/07/21/401720721.db2.gz	SCTCKOPYHSVTJX-KRWDZBQOSA-N	0	3	304.434	2.225	10	0		DEAEHN
COCCN(C)CCNC(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000127198112	401724024	/nfs/dbraw/zinc/72/40/24/401724024.db2.gz	KHHPCHINUNMGBE-MRXNPFEDSA-N	0	3	323.412	2.081	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H](C)c1ccc(C)o1	ZINC000111804103	401724362	/nfs/dbraw/zinc/72/43/62/401724362.db2.gz	VGTQOOZKAFPRIM-UONOGXRCSA-N	0	3	309.410	2.059	10	0		DEAEHN
COc1cc([C@@H](C)NCCC[S@@](C)=O)cc(OC)c1OC	ZINC000126829387	401710105	/nfs/dbraw/zinc/71/01/05/401710105.db2.gz	HHFBFRMVMXDABK-FIKIJFGZSA-N	0	3	315.435	2.132	10	0		DEAEHN
C[C@@H](C(=O)N1CCO[C@H](c2nccs2)C1)N1[C@H](C)CC[C@@H]1C	ZINC000111620532	401718285	/nfs/dbraw/zinc/71/82/85/401718285.db2.gz	MGIFJCTVNMEKDW-CRWXNKLISA-N	0	3	323.462	2.304	10	0		DEAEHN
CCC(CC)[C@@H](O)CNC(=O)c1ccccc1OCCN(C)C	ZINC000111655461	401719678	/nfs/dbraw/zinc/71/96/78/401719678.db2.gz	QOTXGYCJKGQVSY-INIZCTEOSA-N	0	3	322.449	2.154	10	0		DEAEHN
CCOc1ccccc1OCCN1C[C@@H](C(N)=O)CC[C@@H]1C	ZINC000075714515	401767028	/nfs/dbraw/zinc/76/70/28/401767028.db2.gz	ZMQKLQVRFSNWED-KBPBESRZSA-N	0	3	306.406	2.050	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)CCC(=O)c1ccccc1	ZINC000113225181	401770696	/nfs/dbraw/zinc/77/06/96/401770696.db2.gz	FVNOZAMDVZOSLW-GOEBONIOSA-N	0	3	300.402	2.345	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000113225533	401770920	/nfs/dbraw/zinc/77/09/20/401770920.db2.gz	OSGGYDRUBCVPIQ-SMDDNHRTSA-N	0	3	319.380	2.093	10	0		DEAEHN
CCc1ccccc1OCC(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000113230955	401771386	/nfs/dbraw/zinc/77/13/86/401771386.db2.gz	AWBKNCXGQBZLEJ-HOCLYGCPSA-N	0	3	302.418	2.323	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1c(Cl)nc2ccccn21	ZINC000113227322	401771528	/nfs/dbraw/zinc/77/15/28/401771528.db2.gz	OFLKTOZYRCDGJK-NWDGAFQWSA-N	0	3	318.808	2.296	10	0		DEAEHN
CC(C)CC[C@@](C)(O)CNC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000077776963	401830663	/nfs/dbraw/zinc/83/06/63/401830663.db2.gz	NTAIVTVQHJLVRP-NVXWUHKLSA-N	0	3	315.502	2.449	10	0		DEAEHN
N=C1c2[nH]cnc2N(Cc2ccc(Cl)cc2)C2=NCCN21	ZINC000028222055	401850707	/nfs/dbraw/zinc/85/07/07/401850707.db2.gz	MFUSRNVIDOJLCR-UHFFFAOYSA-N	0	3	300.753	2.080	10	0		DEAEHN
CN1CCC(NC(=O)CSc2ccc(F)c(F)c2)CC1	ZINC000078473380	401852766	/nfs/dbraw/zinc/85/27/66/401852766.db2.gz	WGJSXWPTHLULTO-UHFFFAOYSA-N	0	3	300.374	2.267	10	0		DEAEHN
C[C@@H](CC(=O)N1CCO[C@@H](CN(C)C)C1)c1ccccc1F	ZINC000116787503	401858970	/nfs/dbraw/zinc/85/89/70/401858970.db2.gz	FIVDOWPCXMHNQD-KBPBESRZSA-N	0	3	308.397	2.108	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2cc(Cl)sc2Cl)CCO1	ZINC000116796150	401859060	/nfs/dbraw/zinc/85/90/60/401859060.db2.gz	SOQZYKQTZVHWFU-QMMMGPOBSA-N	0	3	323.245	2.458	10	0		DEAEHN
Cc1[nH]c2c(cccc2C(=O)N2CCO[C@H](CN(C)C)C2)c1C	ZINC000116793548	401859354	/nfs/dbraw/zinc/85/93/54/401859354.db2.gz	HLSSPXYHEJRPNS-CQSZACIVSA-N	0	3	315.417	2.187	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)[C@]2(C)CCCc3ccccc32)CCO1	ZINC000116791033	401859454	/nfs/dbraw/zinc/85/94/54/401859454.db2.gz	OOHHVUSGVQLVSS-QFBILLFUSA-N	0	3	316.445	2.070	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1ccccc1Cl	ZINC000032072820	401875976	/nfs/dbraw/zinc/87/59/76/401875976.db2.gz	PEZAAIYTCZAMCT-NSHDSACASA-N	0	3	304.843	2.349	10	0		DEAEHN
CCOC(=O)CCCCN(C)[C@H]1CCN(c2ccccc2)C1=O	ZINC000133046383	401878406	/nfs/dbraw/zinc/87/84/06/401878406.db2.gz	LNUJAYURUXOEFN-INIZCTEOSA-N	0	3	318.417	2.457	10	0		DEAEHN
CC(C)Oc1cncc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000133381314	401883711	/nfs/dbraw/zinc/88/37/11/401883711.db2.gz	WEEGYBLPZHYTPB-UKRRQHHQSA-N	0	3	303.406	2.178	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NCc1nccs1	ZINC000080354110	401889922	/nfs/dbraw/zinc/88/99/22/401889922.db2.gz	LVGVWVALQFBGRI-UHFFFAOYSA-N	0	3	305.403	2.014	10	0		DEAEHN
CCc1cnc(CCNC(=O)NCCN2CCCCC2)s1	ZINC000080623208	401891000	/nfs/dbraw/zinc/89/10/00/401891000.db2.gz	DADHJMWNLLXUNY-UHFFFAOYSA-N	0	3	310.467	2.033	10	0		DEAEHN
CC(C)(C)OC[C@@H](O)CN1CCC(O)(c2ccccc2)CC1	ZINC000034255407	401892715	/nfs/dbraw/zinc/89/27/15/401892715.db2.gz	BOJOZWKSQMAMSF-INIZCTEOSA-N	0	3	307.434	2.146	10	0		DEAEHN
C[C@H](NC(=O)CC1(N2CCOCC2)CCCC1)c1ccncc1	ZINC000118754831	401906838	/nfs/dbraw/zinc/90/68/38/401906838.db2.gz	QYKQQXRSGODOCZ-HNNXBMFYSA-N	0	3	317.433	2.294	10	0		DEAEHN
CC[C@@H](O)CN1CCN(CCCOc2ccccc2C)CC1	ZINC000118858182	401912886	/nfs/dbraw/zinc/91/28/86/401912886.db2.gz	GVIVZOYEALQDDZ-QGZVFWFLSA-N	0	3	306.450	2.152	10	0		DEAEHN
CCN(CC)C(=O)[C@H]1CCCN1CCN(C)c1ccccc1	ZINC000085797147	401918969	/nfs/dbraw/zinc/91/89/69/401918969.db2.gz	MORATNYPIIPVMJ-QGZVFWFLSA-N	0	3	303.450	2.456	10	0		DEAEHN
COCCOc1ccc(CN2CCC[C@H](n3cncn3)C2)cc1	ZINC000119524406	401956575	/nfs/dbraw/zinc/95/65/75/401956575.db2.gz	SGHAEXVIDBNPBH-INIZCTEOSA-N	0	3	316.405	2.140	10	0		DEAEHN
C[C@@H](O)CCNC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000119626701	401962106	/nfs/dbraw/zinc/96/21/06/401962106.db2.gz	STHKCUBNMCDROV-QAPCUYQASA-N	0	3	319.449	2.111	10	0		DEAEHN
C[C@H]1Cc2ccccc2N1C(=O)CN1CCCN(C2CC2)CC1	ZINC000145759056	401991669	/nfs/dbraw/zinc/99/16/69/401991669.db2.gz	RVCBMGPBYFICHP-HNNXBMFYSA-N	0	3	313.445	2.134	10	0		DEAEHN
Cc1cccc([C@@H](C)CNC(=O)N2CCO[C@@H](CN(C)C)C2)c1	ZINC000121028909	402011355	/nfs/dbraw/zinc/01/13/55/402011355.db2.gz	HODNTLCQVDRJTE-RDJZCZTQSA-N	0	3	319.449	2.071	10	0		DEAEHN
COc1ccccc1/C=C/CN1CC[C@@H](CN2CCOCC2)C1	ZINC000093664726	402018699	/nfs/dbraw/zinc/01/86/99/402018699.db2.gz	ROUXVKOZFKLDMQ-UKINESCASA-N	0	3	316.445	2.363	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)CCc2ncc(C)s2)C1	ZINC000121262209	402024408	/nfs/dbraw/zinc/02/44/08/402024408.db2.gz	NPLSASGNEGKMEU-CYBMUJFWSA-N	0	3	310.467	2.120	10	0		DEAEHN
CSC[C@H]1CCCN1C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000121395138	402033298	/nfs/dbraw/zinc/03/32/98/402033298.db2.gz	FSYJKXJHGLNWND-UONOGXRCSA-N	0	3	301.500	2.500	10	0		DEAEHN
C[C@H](CNC(=O)NCc1ccn(C2CCCC2)n1)N(C)C1CC1	ZINC000151483922	402038838	/nfs/dbraw/zinc/03/88/38/402038838.db2.gz	OAILYJXNZYHCRO-CYBMUJFWSA-N	0	3	319.453	2.280	10	0		DEAEHN
CC(C)[C@@H](O)CNC(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000152767629	402107649	/nfs/dbraw/zinc/10/76/49/402107649.db2.gz	BRXRBFNWLAHYAD-IRXDYDNUSA-N	0	3	319.449	2.140	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@@H](C)OC[C@@H]1CCCCO1	ZINC000066338118	402131182	/nfs/dbraw/zinc/13/11/82/402131182.db2.gz	HFRLDXHXHXIIFG-OAGGEKHMSA-N	0	3	314.470	2.053	10	0		DEAEHN
CCOc1ccc(OCC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1	ZINC000123681128	402141382	/nfs/dbraw/zinc/14/13/82/402141382.db2.gz	YTQOCHDSQPPNFH-HUUCEWRRSA-N	0	3	320.433	2.405	10	0		DEAEHN
COC(=O)c1ccccc1NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000153406151	402143439	/nfs/dbraw/zinc/14/34/39/402143439.db2.gz	XFAWPCIPQBIJHW-STQMWFEESA-N	0	3	319.405	2.420	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCC(n2ccnc2)CC1	ZINC000103307203	402184605	/nfs/dbraw/zinc/18/46/05/402184605.db2.gz	YPPYBDZCORBIQF-OAHLLOKOSA-N	0	3	321.469	2.206	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cccc(-c3nc[nH]n3)c2)CCN1C	ZINC000154016757	402187174	/nfs/dbraw/zinc/18/71/74/402187174.db2.gz	DWRGAVAFALARLN-DOMZBBRYSA-N	0	3	313.405	2.026	10	0		DEAEHN
CN(CC1CCN(C)CC1)C(=O)CCc1nc(C(C)(C)C)no1	ZINC000103451720	402189096	/nfs/dbraw/zinc/18/90/96/402189096.db2.gz	ODEGOSDIAMJPPT-UHFFFAOYSA-N	0	3	322.453	2.100	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ccc2nccn2c1	ZINC000068291963	402191484	/nfs/dbraw/zinc/19/14/84/402191484.db2.gz	JGSVYAUYXMDMJF-QGZVFWFLSA-N	0	3	322.412	2.237	10	0		DEAEHN
CCn1cc(C2CCN(C(=O)[C@H]3CCCCN3CC)CC2)cn1	ZINC000124045158	402161364	/nfs/dbraw/zinc/16/13/64/402161364.db2.gz	BCMYZXOAFJUKDJ-QGZVFWFLSA-N	0	3	318.465	2.483	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN(CC(=O)NCC3CCC3)C2)n1	ZINC000108858400	402263310	/nfs/dbraw/zinc/26/33/10/402263310.db2.gz	OAIYFADRJDIXQW-INIZCTEOSA-N	0	3	316.449	2.040	10	0		DEAEHN
CSCCC(=O)NCc1ccccc1CN1CCC[C@@H]1CO	ZINC000125115166	402213791	/nfs/dbraw/zinc/21/37/91/402213791.db2.gz	MSKNMAPTJVUSGH-MRXNPFEDSA-N	0	3	322.474	2.013	10	0		DEAEHN
COc1cccc2c1CC[C@@H]2NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000154794520	402232461	/nfs/dbraw/zinc/23/24/61/402232461.db2.gz	NRQRLUQWBOVESR-DOMZBBRYSA-N	0	3	303.406	2.028	10	0		DEAEHN
COc1ccc(OC)c([C@@H](C)NC[C@]2(CCO)CCOC2)c1	ZINC000125480580	402234888	/nfs/dbraw/zinc/23/48/88/402234888.db2.gz	LRWXQPSYGHFMOI-DYVFJYSZSA-N	0	3	309.406	2.144	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H](C)N(C)Cc1ccccc1)N(C)C	ZINC000154878445	402237113	/nfs/dbraw/zinc/23/71/13/402237113.db2.gz	CRTALKUFTSYMPK-DOTOQJQBSA-N	0	3	305.466	2.353	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H]2CCOc3ccccc32)C1	ZINC000108929173	402264548	/nfs/dbraw/zinc/26/45/48/402264548.db2.gz	MOBDYGSZNUYEGJ-GJZGRUSLSA-N	0	3	317.433	2.336	10	0		DEAEHN
COc1ccc([C@H](C)NC[C@]2(CCO)CCOC2)c(OC)c1	ZINC000125744178	402248269	/nfs/dbraw/zinc/24/82/69/402248269.db2.gz	QZWWYKYEMFTUQK-GUYCJALGSA-N	0	3	309.406	2.144	10	0		DEAEHN
CC(C)[C@H](O)CC(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000155400004	402255845	/nfs/dbraw/zinc/25/58/45/402255845.db2.gz	TXPURNLBYRCFSY-DLBZAZTESA-N	0	3	304.434	2.347	10	0		DEAEHN
CCc1ccc(OCC(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc1	ZINC000155540647	402259816	/nfs/dbraw/zinc/25/98/16/402259816.db2.gz	PYVOIPRJEGPQIN-YOEHRIQHSA-N	0	3	304.434	2.473	10	0		DEAEHN
Cc1cc(S(=O)(=O)NCCN(C)C(C)C)c(Cl)cc1F	ZINC000155604934	402262271	/nfs/dbraw/zinc/26/22/71/402262271.db2.gz	NJBHPMZPKNPCET-UHFFFAOYSA-N	0	3	322.833	2.406	10	0		DEAEHN
CC[C@H](C(=O)NCCc1coc(-c2ccc(F)cc2)n1)N(C)C	ZINC000125058345	402211039	/nfs/dbraw/zinc/21/10/39/402211039.db2.gz	RSRMKIRDYRHBKG-OAHLLOKOSA-N	0	3	319.380	2.480	10	0		DEAEHN
CCn1nccc1CCN1C[C@H](O)C[C@@H]1c1cccc(OC)c1	ZINC000225787207	402323745	/nfs/dbraw/zinc/32/37/45/402323745.db2.gz	YRPGMLGYUMTPSX-SJLPKXTDSA-N	0	3	315.417	2.262	10	0		DEAEHN
CN(C[C@H]1CCN(C)C1)C(=O)c1nc(Cl)ccc1Cl	ZINC000071189311	402270732	/nfs/dbraw/zinc/27/07/32/402270732.db2.gz	RZFYUYONTSIVDA-VIFPVBQESA-N	0	3	302.205	2.412	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)NCc1nccn1CC(C)C	ZINC000176625047	402324259	/nfs/dbraw/zinc/32/42/59/402324259.db2.gz	AZHNEJURRXVPPH-OAHLLOKOSA-N	0	3	321.469	2.213	10	0		DEAEHN
CCOc1ncccc1NC(=O)N(C)C[C@@H]1CCCN1CC	ZINC000176301230	402297885	/nfs/dbraw/zinc/29/78/85/402297885.db2.gz	CABUXWXEUCJDHX-ZDUSSCGKSA-N	0	3	306.410	2.428	10	0		DEAEHN
Cn1cc(CCC(=O)N2CCN3CCC[C@@H]3C2)c2ccccc21	ZINC000176298937	402298171	/nfs/dbraw/zinc/29/81/71/402298171.db2.gz	ALDTUPILFPILJF-MRXNPFEDSA-N	0	3	311.429	2.418	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1ccc(F)c(C)c1	ZINC000176904580	402348685	/nfs/dbraw/zinc/34/86/85/402348685.db2.gz	USZNOKFYPNMUSD-AWEZNQCLSA-N	0	3	321.396	2.015	10	0		DEAEHN
C[C@H](CCN1CCN(C)CC1)NC(=O)NC1CCC(C)(C)CC1	ZINC000185453855	402353999	/nfs/dbraw/zinc/35/39/99/402353999.db2.gz	CZPGQMVVQWZXJK-OAHLLOKOSA-N	0	3	324.513	2.280	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(=O)[nH]c2ccccc21	ZINC000176974690	402355990	/nfs/dbraw/zinc/35/59/90/402355990.db2.gz	TUSKASDXCFMXHK-CYBMUJFWSA-N	0	3	313.401	2.497	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Cn1c(C)nc2ccccc21	ZINC000176975149	402356010	/nfs/dbraw/zinc/35/60/10/402356010.db2.gz	ICDGWXOCLLAEGL-HNNXBMFYSA-N	0	3	314.433	2.287	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc2c(C)nn(C)c2s1	ZINC000177008509	402358620	/nfs/dbraw/zinc/35/86/20/402358620.db2.gz	AOLFUGVNYADNTD-LBPRGKRZSA-N	0	3	320.462	2.500	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1ccccc1OC	ZINC000177025525	402360865	/nfs/dbraw/zinc/36/08/65/402360865.db2.gz	XPTZFCXPWPOIPV-HNNXBMFYSA-N	0	3	305.422	2.321	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc(OC)cc1OC	ZINC000177035544	402362278	/nfs/dbraw/zinc/36/22/78/402362278.db2.gz	HEXFDVMFJIDGEA-ZDUSSCGKSA-N	0	3	306.406	2.260	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCOc1ccccc1	ZINC000177296334	402388522	/nfs/dbraw/zinc/38/85/22/402388522.db2.gz	XOHIAYXIDANESF-OAHLLOKOSA-N	0	3	305.422	2.191	10	0		DEAEHN
CCCNC(=O)[C@H](C)N[C@H](C)c1ccccc1-n1cccn1	ZINC000177185636	402379619	/nfs/dbraw/zinc/37/96/19/402379619.db2.gz	MVCZPPDYYAXJKZ-KGLIPLIRSA-N	0	3	300.406	2.438	10	0		DEAEHN
CN(C)c1cc(C(=O)N2CC[C@H](N(C)C)C2)c2ccccc2n1	ZINC000185820492	402380262	/nfs/dbraw/zinc/38/02/62/402380262.db2.gz	KEKNTMXQAKJZPQ-ZDUSSCGKSA-N	0	3	312.417	2.077	10	0		DEAEHN
COc1ccc(C[C@H](C)CN2CCO[C@H](CN(C)C)C2)cc1F	ZINC000185233025	402337385	/nfs/dbraw/zinc/33/73/85/402337385.db2.gz	LAWNXUJGOYIKTD-GOEBONIOSA-N	0	3	324.440	2.275	10	0		DEAEHN
C[C@@H](NC(=O)[C@H](N)Cc1ccccc1)c1ccc2c(c1)OCO2	ZINC000237420092	402407462	/nfs/dbraw/zinc/40/74/62/402407462.db2.gz	IAYQATGLJLFUJW-IUODEOHRSA-N	0	3	312.369	2.163	10	0		DEAEHN
CCOc1cccnc1C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000186290486	402418315	/nfs/dbraw/zinc/41/83/15/402418315.db2.gz	WMCKFPGHHPZAPA-AWEZNQCLSA-N	0	3	305.422	2.475	10	0		DEAEHN
CCOC(=O)c1nn(C)cc1CNC[C@H]1C[C@@H]1c1ccccc1	ZINC000186349133	402423997	/nfs/dbraw/zinc/42/39/97/402423997.db2.gz	BQSWDSNCSYKYCW-GDBMZVCRSA-N	0	3	313.401	2.490	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)NCc1cccs1	ZINC000177695986	402427034	/nfs/dbraw/zinc/42/70/34/402427034.db2.gz	PKUKICRGUIFFKW-UONOGXRCSA-N	0	3	309.479	2.169	10	0		DEAEHN
Cc1cccc(C)c1OC[C@@H](O)CN1CCN2CCCC[C@@H]2C1	ZINC000177754404	402432795	/nfs/dbraw/zinc/43/27/95/402432795.db2.gz	XILKERCIDTVUQE-MSOLQXFVSA-N	0	3	318.461	2.213	10	0		DEAEHN
CCN(C(C)=O)c1nc(CN2CCN3CCCC[C@@H]3C2)cs1	ZINC000177767382	402433816	/nfs/dbraw/zinc/43/38/16/402433816.db2.gz	ROCLYQRGKANYGQ-OAHLLOKOSA-N	0	3	322.478	2.186	10	0		DEAEHN
Cc1nn(CC(C)C)c(C)c1CC(=O)N(C)CCN(C)C1CC1	ZINC000186722216	402459875	/nfs/dbraw/zinc/45/98/75/402459875.db2.gz	JMOUDCZUESPVMZ-UHFFFAOYSA-N	0	3	320.481	2.251	10	0		DEAEHN
Cc1ccccc1O[C@H](C)CNC(=O)N1CCN2CCC[C@H]2C1	ZINC000245496490	402465968	/nfs/dbraw/zinc/46/59/68/402465968.db2.gz	RMORKUUJKDPKNQ-CVEARBPZSA-N	0	3	317.433	2.252	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1cnc(Cl)cn1)c1ccccc1	ZINC000178161972	402466591	/nfs/dbraw/zinc/46/65/91/402466591.db2.gz	VKLXODWTKFUEPY-CYBMUJFWSA-N	0	3	304.781	2.163	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CC[C@@H](Nc2ccccc2)C1	ZINC000245590113	402473157	/nfs/dbraw/zinc/47/31/57/402473157.db2.gz	AXWQXGQJYFMSJS-SJORKVTESA-N	0	3	316.449	2.367	10	0		DEAEHN
CC(C)(C)OC(=O)[C@@H]1CCN([C@@H]2Cc3ccccc3[C@H]2O)C1	ZINC000245610204	402474085	/nfs/dbraw/zinc/47/40/85/402474085.db2.gz	AVBKIMVEKOCUMN-FVQBIDKESA-N	0	3	303.402	2.308	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCCCCCCO)[C@H]1c1ccccc1	ZINC000245640059	402475725	/nfs/dbraw/zinc/47/57/25/402475725.db2.gz	DCQSMHCGTTXXJV-IAGOWNOFSA-N	0	3	319.449	2.284	10	0		DEAEHN
Cc1cccc(C)c1CCNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000178264752	402477517	/nfs/dbraw/zinc/47/75/17/402477517.db2.gz	GPGWTNXNWBBBHY-MRXNPFEDSA-N	0	3	301.434	2.336	10	0		DEAEHN
COc1ccccc1/C=C/CN1C[C@H](C)[C@H](N2CCOCC2)C1	ZINC000245722188	402482170	/nfs/dbraw/zinc/48/21/70/402482170.db2.gz	IBXSGTSOJOZRRD-QXZUDOESSA-N	0	3	316.445	2.361	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@@H](C)C(=O)N1CCC(C)CC1	ZINC000178333384	402486045	/nfs/dbraw/zinc/48/60/45/402486045.db2.gz	GFDAEFRMWICRJD-RDJZCZTQSA-N	0	3	318.465	2.303	10	0		DEAEHN
CNC(=O)c1cccc(CN2CCC[C@@H]2Cn2ccnc2C)c1	ZINC000178336166	402486238	/nfs/dbraw/zinc/48/62/38/402486238.db2.gz	NKMXUPLOTWSIBY-QGZVFWFLSA-N	0	3	312.417	2.216	10	0		DEAEHN
CC(C)CCNC(=O)[C@@H](C)N1CCC[C@@H](Cc2nccn2C)C1	ZINC000245859847	402492154	/nfs/dbraw/zinc/49/21/54/402492154.db2.gz	KOUPXTWVSDHLJM-CVEARBPZSA-N	0	3	320.481	2.225	10	0		DEAEHN
CNC(=O)c1cccc(CN[C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)c1	ZINC000245956927	402500078	/nfs/dbraw/zinc/50/00/78/402500078.db2.gz	XKONNVWLDOUZDJ-ARFHVFGLSA-N	0	3	302.418	2.339	10	0		DEAEHN
CC(C)[C@H](O)CC(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1	ZINC000187455980	402501800	/nfs/dbraw/zinc/50/18/00/402501800.db2.gz	YWQKCQGQRAXPOT-ZWKOTPCHSA-N	0	3	318.461	2.420	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)N1CC[C@H](C)[C@H](OC)C1	ZINC000187529341	402503552	/nfs/dbraw/zinc/50/35/52/402503552.db2.gz	ZYKBTBBSEZUACJ-ARFHVFGLSA-N	0	3	311.470	2.317	10	0		DEAEHN
COc1ccc(O)cc1C(=O)NCc1cccc(CN(C)C)c1	ZINC000187565114	402505029	/nfs/dbraw/zinc/50/50/29/402505029.db2.gz	PJOPNLDQRWRACI-UHFFFAOYSA-N	0	3	314.385	2.392	10	0		DEAEHN
Cc1cccc(CS(=O)(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000246041963	402505383	/nfs/dbraw/zinc/50/53/83/402505383.db2.gz	BHWGYCJRQUISCR-HOCLYGCPSA-N	0	3	310.463	2.239	10	0		DEAEHN
CCC[C@H](C)CS(=O)(=O)N1C[C@H]2CCCN2C[C@@H]1CC	ZINC000246051389	402505775	/nfs/dbraw/zinc/50/57/75/402505775.db2.gz	CIJCTMGIJARYBS-SOUVJXGZSA-N	0	3	302.484	2.311	10	0		DEAEHN
Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)C(C)S(C)(=O)=O)o1	ZINC000246791211	402545281	/nfs/dbraw/zinc/54/52/81/402545281.db2.gz	JAORZPGFVRGSLD-WXHSDQCUSA-N	0	3	313.419	2.321	10	0		DEAEHN
O[C@@H](CNC1(c2ccc(Cl)cc2)CCC1)CN1CCOCC1	ZINC000178839754	402545727	/nfs/dbraw/zinc/54/57/27/402545727.db2.gz	YMLHCVIZGHERRT-INIZCTEOSA-N	0	3	324.852	2.002	10	0		DEAEHN
CCCC[C@@H]1CCC[C@@H]1NC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000246934063	402549799	/nfs/dbraw/zinc/54/97/99/402549799.db2.gz	BUHFJIVSUCRZKQ-PMPSAXMXSA-N	0	3	311.470	2.317	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)[C@H](Cc1ccccc1)N(C)C	ZINC000246961040	402550953	/nfs/dbraw/zinc/55/09/53/402550953.db2.gz	BQVHZRMLNLMZTC-AEFFLSMTSA-N	0	3	317.477	2.150	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)N[C@H]2CCOc3ccccc32)CN1C1CC1	ZINC000246972053	402551828	/nfs/dbraw/zinc/55/18/28/402551828.db2.gz	PGZDBZXFYFXRKM-WWGRRREGSA-N	0	3	315.417	2.435	10	0		DEAEHN
CCCCCc1nnc(NC(=O)N2CC[C@@H](N(C)C)C2)s1	ZINC000171071420	402554729	/nfs/dbraw/zinc/55/47/29/402554729.db2.gz	IQAYSXBPPIENCW-LLVKDONJSA-N	0	3	311.455	2.439	10	0		DEAEHN
COC(=O)Nc1cc(NC(=O)N2CC[C@@H](N(C)C)C2)ccc1F	ZINC000171084563	402555864	/nfs/dbraw/zinc/55/58/64/402555864.db2.gz	IUSPZEZZBJGSKS-LLVKDONJSA-N	0	3	324.356	2.172	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)N2CCc3ccccc3C2)C1	ZINC000247383406	402565549	/nfs/dbraw/zinc/56/55/49/402565549.db2.gz	PXJDAQNNWVUWTP-WMLDXEAASA-N	0	3	301.434	2.483	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N[C@@H]1CCC[C@@H]2OCC[C@H]21	ZINC000247471005	402567923	/nfs/dbraw/zinc/56/79/23/402567923.db2.gz	QGPVCBUCEBXUBM-QXSJWSMHSA-N	0	3	311.470	2.220	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N[C@H](C)CN1CCCCC1	ZINC000189955824	402567987	/nfs/dbraw/zinc/56/79/87/402567987.db2.gz	OLTCHFJNTVHJSS-KGLIPLIRSA-N	0	3	320.437	2.325	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NC2CCC(O)CC2)[C@@H]1c1ccccc1	ZINC000179093413	402572345	/nfs/dbraw/zinc/57/23/45/402572345.db2.gz	OZXHLKWIQKYJKB-BACDZXNISA-N	0	3	317.433	2.035	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)N2CC(C)(C)OC(C)(C)C2)[C@@H](C)C1	ZINC000188199219	402516800	/nfs/dbraw/zinc/51/68/00/402516800.db2.gz	XIMMHVPPPPOPTN-KBPBESRZSA-N	0	3	311.470	2.314	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@@H](Oc2cccnc2)C1)N1[C@H](C)CC[C@@H]1C	ZINC000246195658	402517294	/nfs/dbraw/zinc/51/72/94/402517294.db2.gz	BYTLBUJNFZEGFE-JYYAWHABSA-N	0	3	317.433	2.323	10	0		DEAEHN
O=C(CN1CC[C@@H](N2CCCC2)C1)Nc1cc(F)cc(F)c1	ZINC000170744212	402519257	/nfs/dbraw/zinc/51/92/57/402519257.db2.gz	AGPHQKWXKDUPGY-OAHLLOKOSA-N	0	3	309.360	2.073	10	0		DEAEHN
CCc1ccc(NC(=O)[C@@H](C)N2CCN3CCC[C@@H]3C2)cc1	ZINC000178639579	402520808	/nfs/dbraw/zinc/52/08/08/402520808.db2.gz	IGHYDONQACXFEJ-RHSMWYFYSA-N	0	3	301.434	2.356	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000246341491	402526010	/nfs/dbraw/zinc/52/60/10/402526010.db2.gz	OUVPKARKLAMVEP-WBVHZDCISA-N	0	3	319.449	2.375	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)C1CCN(C[C@@H](O)CC(F)(F)F)CC1	ZINC000188964261	402529185	/nfs/dbraw/zinc/52/91/85/402529185.db2.gz	FVLBGTDRBHWQJR-AAEUAGOBSA-N	0	3	324.387	2.172	10	0		DEAEHN
CCOC[C@H](O)CN[C@H](C)c1cnn(-c2ccc(F)cc2)c1C	ZINC000178710132	402529237	/nfs/dbraw/zinc/52/92/37/402529237.db2.gz	ILDWKTFKSMHFAI-MLGOLLRUSA-N	0	3	321.396	2.368	10	0		DEAEHN
CCOc1ccccc1OCCCC(=O)N1CC[C@H](N(C)C)C1	ZINC000170859404	402533552	/nfs/dbraw/zinc/53/35/52/402533552.db2.gz	NXTFJMRLUJPOSI-HNNXBMFYSA-N	0	3	320.433	2.407	10	0		DEAEHN
Cc1nn(-c2ccccc2)c(C)c1C(=O)N1CC[C@H](N(C)C)C1	ZINC000170859112	402533668	/nfs/dbraw/zinc/53/36/68/402533668.db2.gz	KAELMGYPICNWHQ-INIZCTEOSA-N	0	3	312.417	2.265	10	0		DEAEHN
C[C@H](C(=O)N1CCCN(C2CC2)CC1)[C@@H](N)c1ccccc1	ZINC000178747371	402533825	/nfs/dbraw/zinc/53/38/25/402533825.db2.gz	FWBYSMQQGPQLAA-WMLDXEAASA-N	0	3	301.434	2.019	10	0		DEAEHN
CCN(CC)C(=O)[C@H]1CCCN1CCC(=O)Nc1ccccc1	ZINC000171344031	402579195	/nfs/dbraw/zinc/57/91/95/402579195.db2.gz	HTTNMDNIJBQDEA-MRXNPFEDSA-N	0	3	317.433	2.348	10	0		DEAEHN
O=C(c1sccc1OC(F)F)N1CCN2CCC[C@@H]2C1	ZINC000171587181	402597849	/nfs/dbraw/zinc/59/78/49/402597849.db2.gz	QYELBIJWINPEKA-SECBINFHSA-N	0	3	302.346	2.270	10	0		DEAEHN
O=C(C[C@H](O)c1ccc(Cl)cc1)N1CCCN(C2CC2)CC1	ZINC000179763974	402599654	/nfs/dbraw/zinc/59/96/54/402599654.db2.gz	LMJKNQDYRZWJGY-INIZCTEOSA-N	0	3	322.836	2.460	10	0		DEAEHN
O=C(N[C@H]1CCCOC1)N1CCN(CC2CCCCC2)CC1	ZINC000171614142	402601546	/nfs/dbraw/zinc/60/15/46/402601546.db2.gz	SNTUBFNMZCEWQI-INIZCTEOSA-N	0	3	309.454	2.073	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000248834862	402610355	/nfs/dbraw/zinc/61/03/55/402610355.db2.gz	CNMQMUXIIDIKCN-BPQIPLTHSA-N	0	3	316.445	2.440	10	0		DEAEHN
C[C@@H](CC(=O)Nc1ccc(F)cc1)NCC1(C)OCCCO1	ZINC000190660688	402616459	/nfs/dbraw/zinc/61/64/59/402616459.db2.gz	MQYUSFGNZZJMDM-LBPRGKRZSA-N	0	3	310.369	2.286	10	0		DEAEHN
C[C@H](OCc1ccccc1)C(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000249056361	402618985	/nfs/dbraw/zinc/61/89/85/402618985.db2.gz	XRMVYFMNERKIHI-VYDXJSESSA-N	0	3	302.418	2.287	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)[C@H]1C[C@@H](C(C)=O)C1(C)C	ZINC000249092463	402619979	/nfs/dbraw/zinc/61/99/79/402619979.db2.gz	WNXYTNDKKBEJSD-FXUDXRNXSA-N	0	3	306.450	2.323	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H]1COC2(CCCCCC2)O1)N(C)C	ZINC000180874329	402628619	/nfs/dbraw/zinc/62/86/19/402628619.db2.gz	JGGMEZOBCUFNRE-GJZGRUSLSA-N	0	3	312.454	2.299	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@@H](C)N[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000249243310	402623669	/nfs/dbraw/zinc/62/36/69/402623669.db2.gz	SEVUWSVEUUVOKI-BFHYXJOUSA-N	0	3	315.421	2.221	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NCCCC1CCCC1	ZINC000171901307	402632511	/nfs/dbraw/zinc/63/25/11/402632511.db2.gz	OFWJCZHNEUFXAQ-MRXNPFEDSA-N	0	3	311.470	2.367	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@H](C)c1cccs1	ZINC000171898133	402632528	/nfs/dbraw/zinc/63/25/28/402632528.db2.gz	KSLZLSGVLSSPQS-OLZOCXBDSA-N	0	3	311.451	2.219	10	0		DEAEHN
C[C@H](C1CC1)N(C(=O)CN(C)[C@@]1(CO)CC[C@@H](C)C1)C1CC1	ZINC000249600174	402636326	/nfs/dbraw/zinc/63/63/26/402636326.db2.gz	XXUSTPCPXUGXMY-LBTNJELSSA-N	0	3	308.466	2.259	10	0		DEAEHN
CC(C)C[C@@H](CO)NC(=O)N[C@@H](C)CN(C)Cc1ccccc1	ZINC000181068189	402634607	/nfs/dbraw/zinc/63/46/07/402634607.db2.gz	BNLPGOOHCDGDSB-RDJZCZTQSA-N	0	3	321.465	2.213	10	0		DEAEHN
C[C@H](c1cccc(F)c1)N1CCC[C@@H](C(=O)N2CCOCC2)C1	ZINC000249684091	402638187	/nfs/dbraw/zinc/63/81/87/402638187.db2.gz	CTEFURTWYWHNGK-GDBMZVCRSA-N	0	3	320.408	2.458	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)NCc1cscn1	ZINC000181329313	402641439	/nfs/dbraw/zinc/64/14/39/402641439.db2.gz	ZTEOBJDEHFMGQA-CYBMUJFWSA-N	0	3	318.446	2.463	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)NCc1cccc(OCCN(C)C)c1	ZINC000191140232	402644882	/nfs/dbraw/zinc/64/48/82/402644882.db2.gz	DZNYVETZJSEGQG-YOEHRIQHSA-N	0	3	320.433	2.058	10	0		DEAEHN
Cc1cccc(C)c1OC[C@H](O)CN1[C@@H](C)CC(O)C[C@@H]1C	ZINC000191152508	402645915	/nfs/dbraw/zinc/64/59/15/402645915.db2.gz	JMXOSSFRTCNOQU-YQQAZPJKSA-N	0	3	307.434	2.277	10	0		DEAEHN
CCO[C@H]1C[C@H](NCc2cccnc2-n2cncn2)C12CCC2	ZINC000181504887	402647698	/nfs/dbraw/zinc/64/76/98/402647698.db2.gz	OZSASDDBKIFKJE-GJZGRUSLSA-N	0	3	313.405	2.100	10	0		DEAEHN
O=C(NC1CC1)[C@H](c1ccccc1)N1CCCN(C2CC2)CC1	ZINC000172346841	402651636	/nfs/dbraw/zinc/65/16/36/402651636.db2.gz	UPJBELIGYOLJBS-SFHVURJKSA-N	0	3	313.445	2.176	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccc(F)c(F)c1)N1CCCN(C2CC2)CC1	ZINC000172347942	402651865	/nfs/dbraw/zinc/65/18/65/402651865.db2.gz	HLPMCZUWQILETR-LBPRGKRZSA-N	0	3	323.387	2.462	10	0		DEAEHN
Oc1cccc(N2CCN(C[C@H](O)C3CCCCC3)CC2)c1	ZINC000191270951	402656050	/nfs/dbraw/zinc/65/60/50/402656050.db2.gz	DYCFNPFEJCXOHP-SFHVURJKSA-N	0	3	304.434	2.455	10	0		DEAEHN
CO[C@H](C)CCC(=O)Nc1ccc(OC2CCN(C)CC2)nc1	ZINC000181781821	402656947	/nfs/dbraw/zinc/65/69/47/402656947.db2.gz	VVEMGQROWRMFGG-CYBMUJFWSA-N	0	3	321.421	2.308	10	0		DEAEHN
CN(C)c1cc(C(=O)NC[C@@H]2CCCN2C)c2ccccc2n1	ZINC000182743082	402713414	/nfs/dbraw/zinc/71/34/14/402713414.db2.gz	AFVRYLFSBYWISO-ZDUSSCGKSA-N	0	3	312.417	2.125	10	0		DEAEHN
N[C@H](C(=O)N1CCSC2(CCCCC2)C1)C1CCOCC1	ZINC000262077007	402721918	/nfs/dbraw/zinc/72/19/18/402721918.db2.gz	SVMMCQRBFSFKJX-AWEZNQCLSA-N	0	3	312.479	2.019	10	0		DEAEHN
Cc1cc(N2CC[C@H](N3CC[C@H](CC(C)C)C3)C2=O)n(C)n1	ZINC000173910110	402718691	/nfs/dbraw/zinc/71/86/91/402718691.db2.gz	GQCYNGBPMCCPCP-CABCVRRESA-N	0	3	304.438	2.202	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cccc(Br)n1	ZINC000252736574	402660794	/nfs/dbraw/zinc/66/07/94/402660794.db2.gz	XEGWPBNZYPIHHV-MNOVXSKESA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@H](Cn1c(=O)[nH]c2ccccc2c1=O)N1CCC[C@@H](C)C1	ZINC000253609673	402670076	/nfs/dbraw/zinc/67/00/76/402670076.db2.gz	NTFMRPTWFVUGNN-CHWSQXEVSA-N	0	3	301.390	2.223	10	0		DEAEHN
CN(C)CCn1ccc(NC(=O)NC/C=C\c2ccccc2)n1	ZINC000254952531	402672947	/nfs/dbraw/zinc/67/29/47/402672947.db2.gz	LVPJOGXJIDXXOS-TWGQIWQCSA-N	0	3	313.405	2.280	10	0		DEAEHN
O=C(NC1CCN(C2CC2)CC1)N1CCCC[C@H]1c1cn[nH]c1	ZINC000182274827	402678451	/nfs/dbraw/zinc/67/84/51/402678451.db2.gz	WEVTVQVNWZQAIJ-INIZCTEOSA-N	0	3	317.437	2.273	10	0		DEAEHN
CCCC[C@H](COC)N[C@@H]1CCCN(c2cc(C)nn2C)C1=O	ZINC000182352491	402682888	/nfs/dbraw/zinc/68/28/88/402682888.db2.gz	YFPDIUCHTSEGOU-HUUCEWRRSA-N	0	3	322.453	2.019	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cnn(CCC(F)(F)F)c2)C1	ZINC000182367495	402684290	/nfs/dbraw/zinc/68/42/90/402684290.db2.gz	YKAZBHAEQBGHPE-GFCCVEGCSA-N	0	3	318.343	2.050	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1C(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000182430612	402689533	/nfs/dbraw/zinc/68/95/33/402689533.db2.gz	AWUQPXFBLTYZLQ-GXTWGEPZSA-N	0	3	304.438	2.255	10	0		DEAEHN
Cc1ccccc1C(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000173272534	402690046	/nfs/dbraw/zinc/69/00/46/402690046.db2.gz	DQXMXMQKGOSGRR-KRWDZBQOSA-N	0	3	315.461	2.237	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)S(=O)(=O)CC2CCCCC2)CCN1C	ZINC000173276777	402690772	/nfs/dbraw/zinc/69/07/72/402690772.db2.gz	KTICVGNZJXQAOL-UKRRQHHQSA-N	0	3	302.484	2.311	10	0		DEAEHN
CN(C)CCn1ccc(NC(=O)NC/C=C/c2ccccc2)n1	ZINC000173939968	402720767	/nfs/dbraw/zinc/72/07/67/402720767.db2.gz	LVPJOGXJIDXXOS-RMKNXTFCSA-N	0	3	313.405	2.280	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(C(C)C)nn1C	ZINC000173493077	402700257	/nfs/dbraw/zinc/70/02/57/402700257.db2.gz	DNFBFPVLJQOERT-ZIAGYGMSSA-N	0	3	304.438	2.242	10	0		DEAEHN
CCN(C)C(=O)CCN1CCC(Oc2ccc(C)cn2)CC1	ZINC000182842930	402720933	/nfs/dbraw/zinc/72/09/33/402720933.db2.gz	IEYXLAMJAPKQCI-UHFFFAOYSA-N	0	3	305.422	2.102	10	0		DEAEHN
CNC(=O)NC(=O)CCN1CC[C@H](C)[C@H]1c1cccc(F)c1	ZINC000175146377	402782944	/nfs/dbraw/zinc/78/29/44/402782944.db2.gz	CMILKCKWHBIZKQ-NHYWBVRUSA-N	0	3	307.369	2.054	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)NC[C@H](C)COc1ccccc1OC	ZINC000262576221	402727350	/nfs/dbraw/zinc/72/73/50/402727350.db2.gz	ONZWJDQJJNUYFE-HEHGZKQESA-N	0	3	308.422	2.200	10	0		DEAEHN
CC[C@H](C)NC(=O)CN[C@@H](C)c1ccccc1-n1cccn1	ZINC000183156355	402743445	/nfs/dbraw/zinc/74/34/45/402743445.db2.gz	NVDPPLCQFRBJNJ-KBPBESRZSA-N	0	3	300.406	2.438	10	0		DEAEHN
C[C@@H](c1nc([C@H]2CNCCN2C)no1)c1cccc(Cl)c1	ZINC000263303495	402756312	/nfs/dbraw/zinc/75/63/12/402756312.db2.gz	XLNLRHZZWFEXQJ-ZWNOBZJWSA-N	0	3	306.797	2.451	10	0		DEAEHN
C[C@H](c1nc([C@@H]2CNCCN2C)no1)c1cccc(Cl)c1	ZINC000263303492	402756434	/nfs/dbraw/zinc/75/64/34/402756434.db2.gz	XLNLRHZZWFEXQJ-GWCFXTLKSA-N	0	3	306.797	2.451	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cnn(C(C)(C)C)c1	ZINC000175013233	402771574	/nfs/dbraw/zinc/77/15/74/402771574.db2.gz	CASOFIADTFVKAN-LSDHHAIUSA-N	0	3	304.438	2.337	10	0		DEAEHN
Cc1nc(C(F)(F)F)c(CN2CCO[C@@H](CN(C)C)C2)s1	ZINC000183582088	402778321	/nfs/dbraw/zinc/77/83/21/402778321.db2.gz	YSPNIYBJRBHBKX-JTQLQIEISA-N	0	3	323.384	2.233	10	0		DEAEHN
COC(=O)c1coc(C(=O)NC[C@H](c2ccccc2)N(C)C)c1	ZINC000183717783	402791442	/nfs/dbraw/zinc/79/14/42/402791442.db2.gz	URRZSONJRJVNCH-CQSZACIVSA-N	0	3	316.357	2.099	10	0		DEAEHN
CCC(CC)[C@@H]1C[C@@H](NC(=O)N2CCN3CCC[C@@H]3C2)CCO1	ZINC000183745623	402794296	/nfs/dbraw/zinc/79/42/96/402794296.db2.gz	XAWPCHHSLIJACJ-BBWFWOEESA-N	0	3	323.481	2.460	10	0		DEAEHN
O=C(/C=C/c1cnc2ccccc2n1)N1CCCN(C2CC2)CC1	ZINC000194508153	402800931	/nfs/dbraw/zinc/80/09/31/402800931.db2.gz	ZIKLMBSUXVSGFP-RMKNXTFCSA-N	0	3	322.412	2.340	10	0		DEAEHN
O=C(CCCc1nc2ccccc2[nH]1)N1CCN2CCC[C@H]2C1	ZINC000195330815	402842535	/nfs/dbraw/zinc/84/25/35/402842535.db2.gz	WENITQWRAXJZLK-AWEZNQCLSA-N	0	3	312.417	2.192	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)S(=O)(=O)Cc1cccc(C)c1	ZINC000175393440	402802677	/nfs/dbraw/zinc/80/26/77/402802677.db2.gz	YADVIXQLNKTBSM-INIZCTEOSA-N	0	3	310.463	2.241	10	0		DEAEHN
CN(C)[C@@H]1Cc2ccccc2N(C(=O)/C=C/c2ccncn2)C1	ZINC000183874792	402803153	/nfs/dbraw/zinc/80/31/53/402803153.db2.gz	BEFPAPNJJMYZSP-KXPUMZMLSA-N	0	3	308.385	2.009	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)S(=O)(=O)c1cc(C)ccc1C	ZINC000175399515	402803157	/nfs/dbraw/zinc/80/31/57/402803157.db2.gz	NGNQKFOFKMZNIA-HNNXBMFYSA-N	0	3	310.463	2.408	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cccn1Cc1cccs1	ZINC000194690773	402810327	/nfs/dbraw/zinc/81/03/27/402810327.db2.gz	DTCRBBIMFMZIOD-ZDUSSCGKSA-N	0	3	303.431	2.422	10	0		DEAEHN
CCOc1ccc(CN2C[C@H](C)[C@H](N3CCOCC3)C2)cc1	ZINC000175587165	402819518	/nfs/dbraw/zinc/81/95/18/402819518.db2.gz	HWTLZPIRDKAXNH-MAUKXSAKSA-N	0	3	304.434	2.238	10	0		DEAEHN
CCN1CCN(C[C@H](C)CNC(=O)Nc2ccc(C)s2)CC1	ZINC000175782853	402832171	/nfs/dbraw/zinc/83/21/71/402832171.db2.gz	BPYHGNIDGVCTRJ-CYBMUJFWSA-N	0	3	324.494	2.452	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)N3CCC[C@H]3C)cc2)CC1	ZINC000175832864	402836931	/nfs/dbraw/zinc/83/69/31/402836931.db2.gz	RHXKUXDDMUMWDC-OAHLLOKOSA-N	0	3	301.434	2.453	10	0		DEAEHN
Cc1cc(C)n(-c2ccc(C(=O)N3CCN4CCC[C@H]4C3)cc2)n1	ZINC000195313406	402841769	/nfs/dbraw/zinc/84/17/69/402841769.db2.gz	XYZCBWCTVPXARY-SFHVURJKSA-N	0	3	324.428	2.409	10	0		DEAEHN
COC(=O)c1coc(C(=O)N(CCN(C)C)c2ccccc2)c1	ZINC000184453551	402844693	/nfs/dbraw/zinc/84/46/93/402844693.db2.gz	SGVIGNOBQWAVDF-UHFFFAOYSA-N	0	3	316.357	2.275	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)N1CCC(c2ccc(O)cc2)CC1	ZINC000299243331	403553999	/nfs/dbraw/zinc/55/39/99/403553999.db2.gz	KURMTMSZUIDLNS-INIZCTEOSA-N	0	3	317.433	2.375	10	0		DEAEHN
CN1CCO[C@H]2CN(c3ccnc4ccc(Cl)cc43)C[C@H]21	ZINC000301628862	403656785	/nfs/dbraw/zinc/65/67/85/403656785.db2.gz	BUFOYLRWCHLRBA-CVEARBPZSA-N	0	3	303.793	2.407	10	0		DEAEHN
O=C(CN1CCCC[C@@H]1[C@@H]1CCC[C@H]1O)NCc1ccccc1	ZINC000303678955	403756479	/nfs/dbraw/zinc/75/64/79/403756479.db2.gz	RGZFSBJEOYKMJH-RCCFBDPRSA-N	0	3	316.445	2.318	10	0		DEAEHN
CO[C@H]1C[C@@H](CO)N(Cc2ccc(OCC(F)(F)F)cc2)C1	ZINC000343977766	403819718	/nfs/dbraw/zinc/81/97/18/403819718.db2.gz	KBNIXYCUFIPYKG-JSGCOSHPSA-N	0	3	319.323	2.209	10	0		DEAEHN
COc1ccccc1[C@H]1[C@@H](N)CCCN1C(=O)[C@H]1CCCCO1	ZINC000333630432	403797569	/nfs/dbraw/zinc/79/75/69/403797569.db2.gz	ARBQZZULUUTLSD-UAGQMJEPSA-N	0	3	318.417	2.255	10	0		DEAEHN
COc1ccc(CNCC2CC(O)C2)c(Br)c1	ZINC000310448864	403966334	/nfs/dbraw/zinc/96/63/34/403966334.db2.gz	ZMYABJBDORVSLZ-UHFFFAOYSA-N	0	3	300.196	2.318	10	0		DEAEHN
Cc1cc(C[C@H](C)NC(=O)c2ccccc2CN(C)C)[nH]n1	ZINC000362941561	404016768	/nfs/dbraw/zinc/01/67/68/404016768.db2.gz	DGSCCFOIIJUOCB-LBPRGKRZSA-N	0	3	300.406	2.141	10	0		DEAEHN
c1ccc(CN2CCCO[C@H](CN3C[C@H]4CC[C@@H](C3)O4)C2)cc1	ZINC000341890562	404238233	/nfs/dbraw/zinc/23/82/33/404238233.db2.gz	ALHPISGLJIUWOK-OTWHNJEPSA-N	0	3	316.445	2.141	10	0		DEAEHN
O=C1NCC[C@H]1N1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1	ZINC000329129792	404239255	/nfs/dbraw/zinc/23/92/55/404239255.db2.gz	NYQJXPWVKYBNOV-PBFPGSCMSA-N	0	3	316.405	2.104	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@H]1NCc1cccc(Br)c1F	ZINC000296862859	404347113	/nfs/dbraw/zinc/34/71/13/404347113.db2.gz	PCCVWDNHHQRZOU-GZMMTYOYSA-N	0	3	315.186	2.345	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN([C@H](C)CN1CCOCC1)CC2	ZINC000364907453	404543492	/nfs/dbraw/zinc/54/34/92/404543492.db2.gz	XZEWOYVRAYWMJN-OAHLLOKOSA-N	0	3	316.445	2.011	10	0		DEAEHN
CN1CCC[C@@H](N2CCN(C(=O)[C@@H]3CCCCC3(C)C)CC2)C1	ZINC000366059256	404749071	/nfs/dbraw/zinc/74/90/71/404749071.db2.gz	WLQLFTYSUNOTRZ-SJORKVTESA-N	0	3	321.509	2.441	10	0		DEAEHN
c1cc(-c2ccc(CNC3CCN(c4cccnn4)CC3)o2)n[nH]1	ZINC000366844414	404856930	/nfs/dbraw/zinc/85/69/30/404856930.db2.gz	QIGYTORLBANGFK-UHFFFAOYSA-N	0	3	324.388	2.218	10	0		DEAEHN
C[C@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21	ZINC000361124569	404932409	/nfs/dbraw/zinc/93/24/09/404932409.db2.gz	QFFNKMQPMXNTKR-UKPHBRMFSA-N	0	3	317.433	2.059	10	0		DEAEHN
CC(C)c1ccc(CCN2CCC[C@]3(C2)NC(=O)NC3=O)cc1	ZINC000435026747	404951196	/nfs/dbraw/zinc/95/11/96/404951196.db2.gz	BPEOALTXUFZGPA-GOSISDBHSA-N	0	3	315.417	2.027	10	0		DEAEHN
CC(C)OCCOC1CCN(C[C@@H](O)CC(F)(F)F)CC1	ZINC000451952266	405107006	/nfs/dbraw/zinc/10/70/06/405107006.db2.gz	OOWQRKXPRVRNNB-LBPRGKRZSA-N	0	3	313.360	2.206	10	0		DEAEHN
C[C@@H]1CN(c2ncnc3c2CCCCC3)CCN1CC(C)(C)O	ZINC000408436873	405207024	/nfs/dbraw/zinc/20/70/24/405207024.db2.gz	KUPWSVCHHDQLOK-CQSZACIVSA-N	0	3	318.465	2.027	10	0		DEAEHN
CCN1C[C@@H](C)N(C(=O)c2cc3[nH]cnc3cc2F)C[C@@H]1C	ZINC000408471572	405214452	/nfs/dbraw/zinc/21/44/52/405214452.db2.gz	STFQBDMHEBCHFB-WDEREUQCSA-N	0	3	304.369	2.257	10	0		DEAEHN
CS[C@@H]1CN(C(=O)CCOCC(C)C)C[C@@H]1N1CCCC1	ZINC000361632696	405172884	/nfs/dbraw/zinc/17/28/84/405172884.db2.gz	UJVIGRPSEGOOAG-LSDHHAIUSA-N	0	3	314.495	2.087	10	0		DEAEHN
C[C@@H](CCc1cccc(F)c1)C(=O)NCCNc1ccncc1	ZINC000439042369	405263812	/nfs/dbraw/zinc/26/38/12/405263812.db2.gz	UDBPMQPTTZOOEJ-AWEZNQCLSA-N	0	3	315.392	2.440	10	0		DEAEHN
O=C(NCCNc1ccncc1)Nc1ccc(-c2ncco2)cc1	ZINC000439064382	405264388	/nfs/dbraw/zinc/26/43/88/405264388.db2.gz	OXQXBYFOBAPOKS-UHFFFAOYSA-N	0	3	323.356	2.392	10	0		DEAEHN
COCCOc1ccccc1CN[C@H](C)C1(OC)CCOCC1	ZINC000453069411	405281172	/nfs/dbraw/zinc/28/11/72/405281172.db2.gz	NZKIYVAPVGQLGS-OAHLLOKOSA-N	0	3	323.433	2.386	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N[C@@H](CC)COCC(F)(F)F	ZINC000452745961	405237109	/nfs/dbraw/zinc/23/71/09/405237109.db2.gz	ONWHFAUWROCZHQ-RYUDHWBXSA-N	0	3	310.360	2.335	10	0		DEAEHN
CC[C@@H](COCC(F)(F)F)NC(=O)CC1CCN(C)CC1	ZINC000452747600	405237912	/nfs/dbraw/zinc/23/79/12/405237912.db2.gz	RGICVKSCKLATAJ-LBPRGKRZSA-N	0	3	310.360	2.192	10	0		DEAEHN
c1cc(CN2CCOCC2)cc(CN2CCCSCC2)c1	ZINC000420955562	405414688	/nfs/dbraw/zinc/41/46/88/405414688.db2.gz	XYMRYDNUAUPSGP-UHFFFAOYSA-N	0	3	306.475	2.458	10	0		DEAEHN
CN(C)CCn1nccc1NC(=O)N1C[C@@H]2CCCC[C@H]2C1	ZINC000455653811	405440113	/nfs/dbraw/zinc/44/01/13/405440113.db2.gz	FKQBFEJHYHFGJE-KBPBESRZSA-N	0	3	305.426	2.099	10	0		DEAEHN
Cc1ccc2c(c1)[C@H](N[C@H](C)CN1CCN(C)CC1)CCCO2	ZINC000155014097	292369182	/nfs/dbraw/zinc/36/91/82/292369182.db2.gz	RJODDYCCWQMVLD-SJLPKXTDSA-N	0	3	317.477	2.434	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCC(c2c[nH]nc2C)CC1	ZINC000560813263	405869556	/nfs/dbraw/zinc/86/95/56/405869556.db2.gz	JERKDYYXYSKVFP-INIZCTEOSA-N	0	3	304.438	2.299	10	0		DEAEHN
CC(=O)[C@](C)(O)CN1CC[C@@H](OCCCc2ccccc2)C1	ZINC000450477064	405919634	/nfs/dbraw/zinc/91/96/34/405919634.db2.gz	UMSBMELCRXGHNY-QZTJIDSGSA-N	0	3	305.418	2.050	10	0		DEAEHN
CC(=O)[C@](C)(O)CN[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1	ZINC000451042816	406027410	/nfs/dbraw/zinc/02/74/10/406027410.db2.gz	DXOUHZZPFNVWGU-ARFHVFGLSA-N	0	3	310.825	2.015	10	0		DEAEHN
c1nc2n(n1)[C@@H](CN1CCC(OCc3ccccc3)CC1)CC2	ZINC000639432620	406085577	/nfs/dbraw/zinc/08/55/77/406085577.db2.gz	FSBJAKRYYOEQLX-MRXNPFEDSA-N	0	3	312.417	2.447	10	0		DEAEHN
CN(CC1CC1)C(=O)CNC1(c2ccccc2)CCOCC1	ZINC000533059782	406117169	/nfs/dbraw/zinc/11/71/69/406117169.db2.gz	KDLQTCKSOUZSIK-UHFFFAOYSA-N	0	3	302.418	2.150	10	0		DEAEHN
c1nc2n(n1)[C@H](CN1CC=C(c3c[nH]c4ncccc34)CC1)CC2	ZINC000639521560	406127705	/nfs/dbraw/zinc/12/77/05/406127705.db2.gz	FOUOVWRBJLBJRR-AWEZNQCLSA-N	0	3	320.400	2.431	10	0		DEAEHN
C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000471902389	406127812	/nfs/dbraw/zinc/12/78/12/406127812.db2.gz	YUHDLSACIYXIJP-FOGDFJRCSA-N	0	3	305.344	2.205	10	0		DEAEHN
C(c1noc(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)n1)C1CC1	ZINC000639543744	406138279	/nfs/dbraw/zinc/13/82/79/406138279.db2.gz	OUOFUCJGWRDUKS-GOEBONIOSA-N	0	3	316.449	2.471	10	0		DEAEHN
Cc1cc(C)c([C@@H](C)[N@@H+]2CCC[C@]3(C2)NC(=O)[N-]C3=O)c(C)c1	ZINC000568160817	406199826	/nfs/dbraw/zinc/19/98/26/406199826.db2.gz	SOHSLSNPXMAYFD-RDTXWAMCSA-N	0	3	315.417	2.347	10	0		DEAEHN
Cc1cc(C)c([C@@H](C)[N@H+]2CCC[C@]3(C2)NC(=O)[N-]C3=O)c(C)c1	ZINC000568160817	406199830	/nfs/dbraw/zinc/19/98/30/406199830.db2.gz	SOHSLSNPXMAYFD-RDTXWAMCSA-N	0	3	315.417	2.347	10	0		DEAEHN
CCOCCC1(CNCc2c(Br)cnn2C)CC1	ZINC000487556539	406246614	/nfs/dbraw/zinc/24/66/14/406246614.db2.gz	VNUHBTRHKJSKKG-UHFFFAOYSA-N	0	3	316.243	2.479	10	0		DEAEHN
C[C@@H]1C[C@H](CCNCc2c(Br)cnn2C)CCO1	ZINC000487567791	406247280	/nfs/dbraw/zinc/24/72/80/406247280.db2.gz	BFZBDXKKLWYRFI-GHMZBOCLSA-N	0	3	316.243	2.477	10	0		DEAEHN
C[C@@H]1[C@@H](CO)CCN1CC(=O)N(C)[C@@H]1CCCc2ccccc21	ZINC000488731365	406340782	/nfs/dbraw/zinc/34/07/82/406340782.db2.gz	JKKOTMDAEWWFQU-QGPMSJSTSA-N	0	3	316.445	2.225	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCc1ccccc1NC(C)=O	ZINC000524648566	406452281	/nfs/dbraw/zinc/45/22/81/406452281.db2.gz	DBBFYZBGFDOBEJ-MRXNPFEDSA-N	0	3	303.406	2.136	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NCC1CCCCC1	ZINC000637870684	406455273	/nfs/dbraw/zinc/45/52/73/406455273.db2.gz	VEQGOPBYFUBVOL-QGZVFWFLSA-N	0	3	303.450	2.142	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CCCc2ccccc21	ZINC000637869389	406455712	/nfs/dbraw/zinc/45/57/12/406455712.db2.gz	VCPANHUINLAINY-SFHVURJKSA-N	0	3	323.440	2.425	10	0		DEAEHN
c1ccc(N2CC[C@H](CN3CCO[C@H]([C@H]4CCCO4)C3)C2)cc1	ZINC000638172370	406605111	/nfs/dbraw/zinc/60/51/11/406605111.db2.gz	ZWIFFFWYBWCQNY-QRQLOZEOSA-N	0	3	316.445	2.393	10	0		DEAEHN
c1nc(C2OCCO2)sc1CNC[C@H]1CCN1C1CCCC1	ZINC000527809837	406758957	/nfs/dbraw/zinc/75/89/57/406758957.db2.gz	NXKZPEFKCLCCMT-CYBMUJFWSA-N	0	3	323.462	2.295	10	0		DEAEHN
O=C(C1CCN(C[C@@H]2CCCO2)CC1)N1CCc2ccccc21	ZINC000129388826	196043675	/nfs/dbraw/zinc/04/36/75/196043675.db2.gz	SMOIILYUIMABAX-KRWDZBQOSA-N	0	3	314.429	2.467	10	0		DEAEHN
O=S1(=O)CC[C@@H](CN[C@H]2CCc3sc(Cl)cc32)C1	ZINC000129594620	196060352	/nfs/dbraw/zinc/06/03/52/196060352.db2.gz	SQPNIPBJEZZGPX-WPRPVWTQSA-N	0	3	305.852	2.413	10	0		DEAEHN
CCCN[C@@H](C)c1c(OC)cccc1N1CCS(=O)CC1	ZINC000129715052	196069844	/nfs/dbraw/zinc/06/98/44/196069844.db2.gz	OHWHMNHVJYPCMD-ZDUSSCGKSA-N	0	3	310.463	2.325	10	0		DEAEHN
CSCC[C@H](C)NS(=O)(=O)c1cccc([C@H](C)N)c1	ZINC000131234283	196152056	/nfs/dbraw/zinc/15/20/56/196152056.db2.gz	NDKKMWSMANDMEF-QWRGUYRKSA-N	0	3	302.465	2.126	10	0		DEAEHN
CNCc1ccccc1S(=O)(=O)NCCCCC(F)(F)F	ZINC000131249481	196152937	/nfs/dbraw/zinc/15/29/37/196152937.db2.gz	SNVLUTBUNXWRIF-UHFFFAOYSA-N	0	3	324.368	2.417	10	0		DEAEHN
CCNc1nc(NCc2nccs2)nc(N(CC)CC)n1	ZINC000131507743	196175072	/nfs/dbraw/zinc/17/50/72/196175072.db2.gz	FEDNJIIXABSVEZ-UHFFFAOYSA-N	0	3	307.427	2.218	10	0		DEAEHN
CC(C)n1cc(S(=O)(=O)N2CC[C@@H](C)[C@@H](C)C2)cc1CN	ZINC000131749639	196196053	/nfs/dbraw/zinc/19/60/53/196196053.db2.gz	PAZWBKDZDVOTHU-OLZOCXBDSA-N	0	3	313.467	2.194	10	0		DEAEHN
C[C@@H]1CCN(S(=O)(=O)c2ccc(Cl)c(CN)c2)C[C@@H]1C	ZINC000131785632	196199404	/nfs/dbraw/zinc/19/94/04/196199404.db2.gz	MHBJTZJMCPTSME-MNOVXSKESA-N	0	3	316.854	2.465	10	0		DEAEHN
CCN[C@@H](C)c1ccc(OCCS(=O)(=O)CC)c(F)c1	ZINC000131792439	196199496	/nfs/dbraw/zinc/19/94/96/196199496.db2.gz	PVNKQYXUERIMLW-NSHDSACASA-N	0	3	303.399	2.310	10	0		DEAEHN
COc1cc(Br)ccc1[C@H](N)Cc1cnn(C)c1	ZINC000131804324	196200096	/nfs/dbraw/zinc/20/00/96/196200096.db2.gz	GUVIMJPIETUYAN-GFCCVEGCSA-N	0	3	310.195	2.434	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)[C@@H]1CCCc2n[nH]cc21)c1ccccc1	ZINC000131937343	196211979	/nfs/dbraw/zinc/21/19/79/196211979.db2.gz	XAPYAXPQEQQBBH-RHSMWYFYSA-N	0	3	312.417	2.249	10	0		DEAEHN
C[C@H](CN1CCCC1)NC(=O)c1sc2cccnc2c1N	ZINC000132212890	196236362	/nfs/dbraw/zinc/23/63/62/196236362.db2.gz	WKIKZVAXNLXFIF-SNVBAGLBSA-N	0	3	304.419	2.093	10	0		DEAEHN
C[C@@H](CO)N(C)C[C@H](O)COc1c(Cl)cccc1Cl	ZINC000132241174	196238367	/nfs/dbraw/zinc/23/83/67/196238367.db2.gz	PPPOZEVNNTZJCG-UWVGGRQHSA-N	0	3	308.205	2.046	10	0		DEAEHN
Cc1ccc(C(F)(F)F)cc1NC(=O)C1(N)CCOCC1	ZINC000132277786	196241474	/nfs/dbraw/zinc/24/14/74/196241474.db2.gz	SNGILYSEBBFUOQ-UHFFFAOYSA-N	0	3	302.296	2.460	10	0		DEAEHN
CN(C)[C@H]1CCCN(C(=O)c2sc3cccnc3c2N)C1	ZINC000132312298	196244553	/nfs/dbraw/zinc/24/45/53/196244553.db2.gz	XXYDOWVUEJNIGK-JTQLQIEISA-N	0	3	304.419	2.045	10	0		DEAEHN
CCC[C@@H](C(=O)NCCCc1cc(OC)ccc1OC)N(C)C	ZINC000132482515	196258626	/nfs/dbraw/zinc/25/86/26/196258626.db2.gz	HTOLHJXLCJRIHR-INIZCTEOSA-N	0	3	322.449	2.483	10	0		DEAEHN
C[C@@H]1CNC[C@@H](COCc2ccc(Br)cc2)O1	ZINC000132683024	196275661	/nfs/dbraw/zinc/27/56/61/196275661.db2.gz	OFZMUOSBSLYQQL-MFKMUULPSA-N	0	3	300.196	2.343	10	0		DEAEHN
COCc1nc(NN)cc(Nc2ccc(OC)c(Cl)c2)n1	ZINC000133077635	196309764	/nfs/dbraw/zinc/30/97/64/196309764.db2.gz	ZYASLTCKVFPBIB-UHFFFAOYSA-N	0	3	309.757	2.314	10	0		DEAEHN
COc1cccc(C2CC(NC[C@@H]3CCCS3(=O)=O)C2)c1	ZINC000133915032	196345671	/nfs/dbraw/zinc/34/56/71/196345671.db2.gz	RLWKBLPZTOQUPI-XUJLQICISA-N	0	3	309.431	2.108	10	0		DEAEHN
C1COC2(CCCN([C@H]3CCOC4(CCSCC4)C3)C2)O1	ZINC000134026675	196355048	/nfs/dbraw/zinc/35/50/48/196355048.db2.gz	TWSDSMZMVFCTSH-AWEZNQCLSA-N	0	3	313.463	2.270	10	0		DEAEHN
NC1CN(C(=O)c2ccc3cc(Br)ccc3c2)C1	ZINC000134985475	196436984	/nfs/dbraw/zinc/43/69/84/196436984.db2.gz	VDUKXTQPXIXRCS-UHFFFAOYSA-N	0	3	305.175	2.385	10	0		DEAEHN
O=C(c1cc(Br)cs1)N1CCN2CCC[C@H]2C1	ZINC000195338947	225203384	/nfs/dbraw/zinc/20/33/84/225203384.db2.gz	QOGDQIQSBQNSLK-JTQLQIEISA-N	0	3	315.236	2.431	10	0		DEAEHN
O[C@H](CN1CCC[C@H]1C[C@H](O)c1ccco1)CC(F)(F)F	ZINC000248934798	225241395	/nfs/dbraw/zinc/24/13/95/225241395.db2.gz	BTZSAGAUJGQRGL-SRVKXCTJSA-N	0	3	307.312	2.481	10	0		DEAEHN
CCC(C)(C)NC(=O)[C@@H](C)N1CCC(Cc2nccn2C)CC1	ZINC000105876289	424849364	/nfs/dbraw/zinc/84/93/64/424849364.db2.gz	INKUUWJZDKZIQQ-CQSZACIVSA-N	0	3	320.481	2.368	10	0		DEAEHN
CCc1ccc(NC(=O)[C@@H](C)NCCn2cc(C)cn2)cc1	ZINC000105881265	424849514	/nfs/dbraw/zinc/84/95/14/424849514.db2.gz	PJJRFXOZFRWZFT-CQSZACIVSA-N	0	3	300.406	2.371	10	0		DEAEHN
Nc1cc(CN2CC[C@@](O)(Cc3cccc(Cl)c3)C2)ccn1	ZINC000365493966	424860989	/nfs/dbraw/zinc/86/09/89/424860989.db2.gz	VNVVRERLNJTVIU-QGZVFWFLSA-N	0	3	317.820	2.497	10	0		DEAEHN
O[C@]1(CCNCc2cccc(Br)c2F)CCOC1	ZINC000404154374	424925032	/nfs/dbraw/zinc/92/50/32/424925032.db2.gz	RWKFCZQIFNYJTE-CYBMUJFWSA-N	0	3	318.186	2.219	10	0		DEAEHN
[NH3+]CC1(CC[N-]S(=O)(=O)c2c(Cl)cccc2Cl)CC1	ZINC000404640106	424927744	/nfs/dbraw/zinc/92/77/44/424927744.db2.gz	LBUNRBQVKVWRIC-UHFFFAOYSA-N	0	3	323.245	2.401	10	0		DEAEHN
c1cc(CNCCN2CCN(Cc3ccccc3)CC2)sn1	ZINC000404474243	424927949	/nfs/dbraw/zinc/92/79/49/424927949.db2.gz	OXGUBJUHCZECRK-UHFFFAOYSA-N	0	3	316.474	2.051	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)c2nscc2Br)CCN1C	ZINC000404942004	424930638	/nfs/dbraw/zinc/93/06/38/424930638.db2.gz	MILOHDNXHOXTQR-YUMQZZPRSA-N	0	3	318.240	2.118	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)Nc2cc(C3(C)CCCC3)on2)C1	ZINC000559502198	424887385	/nfs/dbraw/zinc/88/73/85/424887385.db2.gz	OFTDLJFEBRHPID-CYBMUJFWSA-N	0	3	320.437	2.970	10	0		DEAEHN
CCCc1occc1C(=O)Nc1ccn(C2CCN(C)CC2)n1	ZINC000374194376	424889350	/nfs/dbraw/zinc/88/93/50/424889350.db2.gz	OTSUOVLNCSQHJA-UHFFFAOYSA-N	0	3	316.405	2.948	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC[C@H](c2ccnc(N)c2)C1	ZINC000616620680	425098225	/nfs/dbraw/zinc/09/82/25/425098225.db2.gz	KGPULXUDULEGHZ-AWEZNQCLSA-N	0	3	320.437	2.368	10	0		DEAEHN
N[C@@H](CNS(=O)(=O)c1cccc(Cl)c1)c1ccccc1	ZINC000036297617	267365874	/nfs/dbraw/zinc/36/58/74/267365874.db2.gz	OHFHLAQTFQEADE-AWEZNQCLSA-N	0	3	310.806	2.318	10	0		DEAEHN
C[C@H](COCc1ccccc1)NC(=O)C1(N)CC2(CCC2)C1	ZINC000659271985	425564451	/nfs/dbraw/zinc/56/44/51/425564451.db2.gz	XVVVBOOVQVJWKK-CQSZACIVSA-N	0	3	302.418	2.370	10	0		DEAEHN
NCc1cccnc1N1CCN(c2ccc(F)c(F)c2)CC1	ZINC000665887182	425665493	/nfs/dbraw/zinc/66/54/93/425665493.db2.gz	SUAFVAXJLDUOHC-UHFFFAOYSA-N	0	3	304.344	2.145	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)c2coc(Br)c2)CCN1C	ZINC000393539873	269100140	/nfs/dbraw/zinc/10/01/40/269100140.db2.gz	XJYQPCSLSRDAMQ-WPRPVWTQSA-N	0	3	301.184	2.255	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)c2cc(Br)oc2C)C1	ZINC000396670363	269103819	/nfs/dbraw/zinc/10/38/19/269103819.db2.gz	FVAXLISWIUEXIZ-SECBINFHSA-N	0	3	301.184	2.175	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2cccnc2Br)C1	ZINC000120455800	273807927	/nfs/dbraw/zinc/80/79/27/273807927.db2.gz	VTHFMXSTHNNOJT-SECBINFHSA-N	0	3	313.199	2.012	10	0		DEAEHN
COc1cccc2c1CCN(C[C@](C)(O)C(F)(F)F)CC2	ZINC000369714594	274151345	/nfs/dbraw/zinc/15/13/45/274151345.db2.gz	JSQPLMAPMMIGML-AWEZNQCLSA-N	0	3	303.324	2.409	10	0		DEAEHN
O=C([C@@H]1CCCn2ccnc21)N1CCCN(C2CCCC2)CC1	ZINC000081795640	275005409	/nfs/dbraw/zinc/00/54/09/275005409.db2.gz	LUDPEEUTIXHMMS-MRXNPFEDSA-N	0	3	316.449	2.237	10	0		DEAEHN
O=c1cc(N2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)nc2ccccn12	ZINC000246720663	275043837	/nfs/dbraw/zinc/04/38/37/275043837.db2.gz	VANDJNBHSXHEMF-GOEBONIOSA-N	0	3	324.428	2.148	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)[C@@H](Cc1ccccc1)N(C)C	ZINC000111635974	276156955	/nfs/dbraw/zinc/15/69/55/276156955.db2.gz	XMYSAZBASYVXIJ-QZTJIDSGSA-N	0	3	317.477	2.150	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@@H]1CCO[C@]2(CCSC2)C1	ZINC000495135828	276259044	/nfs/dbraw/zinc/25/90/44/276259044.db2.gz	BSOYWKLNAMEAFK-IIAWOOMASA-N	0	3	312.479	2.032	10	0		DEAEHN
CCOC(=O)c1csc(C2CCN(C[C@@H](O)CC)CC2)n1	ZINC000191568945	276303536	/nfs/dbraw/zinc/30/35/36/276303536.db2.gz	ZZISAKDPWKPMLV-LBPRGKRZSA-N	0	3	312.435	2.270	10	0		DEAEHN
CCN(Cc1ccccc1)[C@H](C)C(=O)N1CCN(CC)CC1	ZINC000120046636	276354675	/nfs/dbraw/zinc/35/46/75/276354675.db2.gz	RVLKAUQGQLBITO-MRXNPFEDSA-N	0	3	303.450	2.061	10	0		DEAEHN
CCOc1ccccc1CN1C[C@H](N2CCOCC2)[C@@H](C)C1	ZINC000246455454	276382886	/nfs/dbraw/zinc/38/28/86/276382886.db2.gz	MZDSQLKZVZMPBN-RDJZCZTQSA-N	0	3	304.434	2.238	10	0		DEAEHN
CN1CCO[C@H](CN[C@H]2CCCOc3cc4c(cc32)CCC4)C1	ZINC000246527372	276940423	/nfs/dbraw/zinc/94/04/23/276940423.db2.gz	VBIXOPLPPBTYAT-AEFFLSMTSA-N	0	3	316.445	2.309	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCCc3cccnc32)CCN1C	ZINC000248890625	278014342	/nfs/dbraw/zinc/01/43/42/278014342.db2.gz	WDAUDRHNOZRJGQ-BMFZPTHFSA-N	0	3	301.434	2.443	10	0		DEAEHN
C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000471971393	278075827	/nfs/dbraw/zinc/07/58/27/278075827.db2.gz	AHDFOSLNRZJTPH-KKOKHZNYSA-N	0	3	307.360	2.451	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1	ZINC000177169859	278109156	/nfs/dbraw/zinc/10/91/56/278109156.db2.gz	GDSVKPBFHRSSQV-LKQDWFRTSA-N	0	3	300.402	2.293	10	0		DEAEHN
C[C@@H]1NC(=S)N(C[C@]2(C)CCCN2Cc2ccccc2)C1=O	ZINC000189417898	279029932	/nfs/dbraw/zinc/02/99/32/279029932.db2.gz	WQQUWHKRHHQRBI-GUYCJALGSA-N	0	3	317.458	2.146	10	0		DEAEHN
CC(C)C[C@H](C)S(=O)(=O)N1CC[C@@H]2[C@@H](CCCN2C)C1	ZINC000246844991	279118154	/nfs/dbraw/zinc/11/81/54/279118154.db2.gz	CIIKSKWOEMYWTR-SOUVJXGZSA-N	0	3	302.484	2.167	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000245424175	279297285	/nfs/dbraw/zinc/29/72/85/279297285.db2.gz	CBVCGPSCFAJGSK-VFSICIBPSA-N	0	3	306.450	2.325	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)N1CC[C@@H]2OCCC[C@@H]2C1	ZINC000246630754	280250727	/nfs/dbraw/zinc/25/07/27/280250727.db2.gz	KHXFRERIJPUGPQ-ZACQAIPSSA-N	0	3	323.481	2.461	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)c1cnccc1N(C)C	ZINC000183571100	280254312	/nfs/dbraw/zinc/25/43/12/280254312.db2.gz	WLSHOFFGUQHZET-CQSZACIVSA-N	0	3	304.438	2.142	10	0		DEAEHN
CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1cccc(OC)c1[O-]	ZINC000175436426	281193307	/nfs/dbraw/zinc/19/33/07/281193307.db2.gz	PZFHDFORRJFSSI-QWHCGFSZSA-N	0	3	304.390	2.100	10	0		DEAEHN
CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cccc(OC)c1[O-]	ZINC000175436426	281193308	/nfs/dbraw/zinc/19/33/08/281193308.db2.gz	PZFHDFORRJFSSI-QWHCGFSZSA-N	0	3	304.390	2.100	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccccc1F	ZINC000173828570	281195412	/nfs/dbraw/zinc/19/54/12/281195412.db2.gz	FRLIHXSSWMKRSI-QWHCGFSZSA-N	0	3	312.410	2.073	10	0		DEAEHN
Cc1ccccc1NC(=O)CCN1CCCC[C@@]1(C)C(N)=O	ZINC000185928918	281349258	/nfs/dbraw/zinc/34/92/58/281349258.db2.gz	JCFJGSMDMKTKQP-KRWDZBQOSA-N	0	3	303.406	2.054	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2cccc(O)c2)c2ccccc2O1	ZINC000368009878	289201054	/nfs/dbraw/zinc/20/10/54/289201054.db2.gz	XYWLQUFADUZYER-OAHLLOKOSA-N	0	3	312.369	2.362	10	0		DEAEHN
c1c[nH]c(-c2noc(C3CCN([C@@H]4CCSC4)CC3)n2)n1	ZINC000572542115	325947515	/nfs/dbraw/zinc/94/75/15/325947515.db2.gz	TZZUMQJNYNVVBU-LLVKDONJSA-N	0	3	305.407	2.145	10	0		DEAEHN
c1nn(-c2ccccc2)c2ncnc(N3C[C@H]4CCC[C@@H](C3)N4)c12	ZINC000573467622	326061165	/nfs/dbraw/zinc/06/11/65/326061165.db2.gz	MKGBFEQSDIVEBQ-OKILXGFUSA-N	0	3	320.400	2.146	10	0		DEAEHN
COC[C@H](C)CN1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000189639932	333190456	/nfs/dbraw/zinc/19/04/56/333190456.db2.gz	MTDZEKGAEDVSRW-CQSZACIVSA-N	0	3	308.397	2.256	10	0		DEAEHN
CCOC(=O)C(C(=O)OCC)[C@H](c1ccc(F)cc1)N(C)C	ZINC000584651320	337380896	/nfs/dbraw/zinc/38/08/96/337380896.db2.gz	VMYKQAQMUMMBTQ-AWEZNQCLSA-N	0	3	311.353	2.171	10	0		DEAEHN
Cc1cc(CCNC(=O)N2CCN3CCC[C@@H]3C2)cc(C)c1O	ZINC000190929164	534156797	/nfs/dbraw/zinc/15/67/97/534156797.db2.gz	QWZOAURWUZYWMM-MRXNPFEDSA-N	0	3	317.433	2.041	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CC[C@H](CNc2ccccn2)C1	ZINC000130551903	518829656	/nfs/dbraw/zinc/82/96/56/518829656.db2.gz	FKTOVUZRPDWYNV-CQSZACIVSA-N	0	3	320.437	2.340	10	0		DEAEHN
CC(C)c1ccccc1OC[C@H](O)CN1CC[C@H](O)[C@@H](C)C1	ZINC000249596695	519847950	/nfs/dbraw/zinc/84/79/50/519847950.db2.gz	WZNVDNAYTPCQEH-UXLLHSPISA-N	0	3	307.434	2.252	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)N1CCC(c2cc[nH]n2)CC1	ZINC000156372352	524602830	/nfs/dbraw/zinc/60/28/30/524602830.db2.gz	QFISGGIGIZCQCQ-AWEZNQCLSA-N	0	3	319.453	2.173	10	0		DEAEHN
Cc1ccc(F)c(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000249234317	524813555	/nfs/dbraw/zinc/81/35/55/524813555.db2.gz	VXEPFJCUYXJBHO-STQMWFEESA-N	0	3	321.396	2.014	10	0		DEAEHN
Cc1ccccc1OCCCNC(=O)N1CC[C@@H](N(C)C)C1	ZINC000105284983	525289417	/nfs/dbraw/zinc/28/94/17/525289417.db2.gz	MIIRBVYHMXAYLM-OAHLLOKOSA-N	0	3	305.422	2.109	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)OC(C)C	ZINC000358268243	534900185	/nfs/dbraw/zinc/90/01/85/534900185.db2.gz	XHRGRHYUJROJDP-GJZGRUSLSA-N	0	3	312.454	2.343	10	0		DEAEHN
C[C@H](c1cnn(C)c1)N(C)C(=O)NC[C@H](C)N1CCC[C@@H](C)C1	ZINC000245920169	526164610	/nfs/dbraw/zinc/16/46/10/526164610.db2.gz	QKDIZYGRUNDJLW-QLFBSQMISA-N	0	3	321.469	2.243	10	0		DEAEHN
O=C(C[C@@H](O)c1ccc(Cl)cc1)N1CCN2CCC1CC2	ZINC000188844247	527096535	/nfs/dbraw/zinc/09/65/35/527096535.db2.gz	FWTJCSRGAPEMCY-OAHLLOKOSA-N	0	3	308.809	2.070	10	0		DEAEHN
Cn1cc([C@H]2CCN(Cc3cn(C)nc3-c3cccnc3)C2)cn1	ZINC000128417934	527319494	/nfs/dbraw/zinc/31/94/94/527319494.db2.gz	XPSUZADJROTJHH-HNNXBMFYSA-N	0	3	322.416	2.205	10	0		DEAEHN
CC1=CCN(CCNC(=O)NC[C@H]2N(C)CCCC2(C)C)CC1	ZINC000447990179	528117535	/nfs/dbraw/zinc/11/75/35/528117535.db2.gz	RAMZBQOJUJKFLD-MRXNPFEDSA-N	0	3	322.497	2.058	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC000194917079	529088841	/nfs/dbraw/zinc/08/88/41/529088841.db2.gz	WHGPLWRIDPTADI-HRCADAONSA-N	0	3	305.397	2.465	10	0		DEAEHN
CC(C)[C@H](NC(=O)CC1CCN(C)CC1)C(=O)OC(C)(C)C	ZINC000362881878	535077090	/nfs/dbraw/zinc/07/70/90/535077090.db2.gz	BZFCIYUQUSHMBW-HNNXBMFYSA-N	0	3	312.454	2.201	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)C(=O)c2ccc(Cl)cc2)C1	ZINC000246212038	535256146	/nfs/dbraw/zinc/25/61/46/535256146.db2.gz	KIRZFUGQQBFIPC-BXUZGUMPSA-N	0	3	308.809	2.368	10	0		DEAEHN
CCn1nnc(C)c1CN[C@H](C)Cc1ccc(OC)c(OC)c1	ZINC000449132028	535918789	/nfs/dbraw/zinc/91/87/89/535918789.db2.gz	RGDYCGTYZBEFDU-GFCCVEGCSA-N	0	3	318.421	2.344	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc(N(C)CC)nc2)CCN1CCOC	ZINC000191337514	536154499	/nfs/dbraw/zinc/15/44/99/536154499.db2.gz	NCDZFTXTZOFYIH-KRWDZBQOSA-N	0	3	320.481	2.080	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(CC(=O)N2CCC[C@@H](C)C2)C1	ZINC000247394218	536173666	/nfs/dbraw/zinc/17/36/66/536173666.db2.gz	XOBWFMNUWIAWJA-HZPDHXFCSA-N	0	3	318.465	2.341	10	0		DEAEHN
COc1ccc(Br)c(CN[C@@H]2CN(C)C[C@H]2C)c1	ZINC000358086100	536628378	/nfs/dbraw/zinc/62/83/78/536628378.db2.gz	WLFDAGVAEUNFBM-QMTHXVAHSA-N	0	3	313.239	2.497	10	0		DEAEHN
COC[C@](C)(CCO)NCCOc1ccc(Cl)c(F)c1	ZINC000192066379	536630071	/nfs/dbraw/zinc/63/00/71/536630071.db2.gz	JKYRMPNBWVFSQX-AWEZNQCLSA-N	0	3	305.777	2.235	10	0		DEAEHN
COc1ccccc1OCC(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000246669507	537089156	/nfs/dbraw/zinc/08/91/56/537089156.db2.gz	MAIDJYNNMBSVCN-LSDHHAIUSA-N	0	3	318.417	2.017	10	0		DEAEHN
Nc1nc(NC2CCN(Cc3ccccc3)CC2)nc(C2CC2)n1	ZINC000310114194	625639078	/nfs/dbraw/zinc/63/90/78/625639078.db2.gz	RJTXLPLHZGDLHL-UHFFFAOYSA-N	0	3	324.432	2.408	10	0		DEAEHN
Cc1nonc1C(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1	ZINC000741606491	637996745	/nfs/dbraw/zinc/99/67/45/637996745.db2.gz	QFUCXPOOSLOFHC-RISCZKNCSA-N	0	3	320.418	2.252	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cccc(Br)n2)C1	ZINC000182596651	648945412	/nfs/dbraw/zinc/94/54/12/648945412.db2.gz	YQTDJHGJCVZEMS-JTQLQIEISA-N	0	3	312.211	2.058	10	0		DEAEHN
Cn1ccc(CC(=O)O[C@@H]2CCCN(Cc3ccccc3)C2)n1	ZINC000183199510	649046752	/nfs/dbraw/zinc/04/67/52/649046752.db2.gz	YXJZYSHNXAZHCP-QGZVFWFLSA-N	0	3	313.401	2.170	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccccc2NC(=O)OC)C1	ZINC000112905169	651606983	/nfs/dbraw/zinc/60/69/83/651606983.db2.gz	UKQKWZRKOIGIAH-GFCCVEGCSA-N	0	3	305.378	2.079	10	0		DEAEHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1cn(C)cn1	ZINC000389805954	685435997	/nfs/dbraw/zinc/43/59/97/685435997.db2.gz	BMMFJJJOGFXARF-OCCSQVGLSA-N	0	3	308.426	2.155	10	0		DEAEHN
COCCc1nc(C)c([C@H](C)NCC2(C)OCCCO2)s1	ZINC000190662327	684411584	/nfs/dbraw/zinc/41/15/84/684411584.db2.gz	ZHTHXLDEWKXYFD-NSHDSACASA-N	0	3	314.451	2.444	10	0		DEAEHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@@H]1CCOC[C@H]1C	ZINC000192515057	684451213	/nfs/dbraw/zinc/45/12/13/684451213.db2.gz	CQIAIUTUGVHSAU-JHJVBQTASA-N	0	3	316.357	2.015	10	0		DEAEHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCOC[C@H]2C)cc1	ZINC000192518174	684451433	/nfs/dbraw/zinc/45/14/33/684451433.db2.gz	RQXRJRHXXIYLQV-BYCMXARLSA-N	0	3	316.357	2.015	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)c2ccc(C)cc2)C[C@H]1C	ZINC000246730249	685135222	/nfs/dbraw/zinc/13/52/22/685135222.db2.gz	MWOGXXPZIXOUJJ-AEFFLSMTSA-N	0	3	306.450	2.071	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](C)C[C@@H](O)c2ccccc2)C1	ZINC000246817989	685137210	/nfs/dbraw/zinc/13/72/10/685137210.db2.gz	YXWQRFDHEHWJDV-HYVNUMGLSA-N	0	3	319.449	2.282	10	0		DEAEHN
C[C@@H]1CC[C@H](C(N)=O)CN1C[C@@H](O)c1ccc(F)cc1Cl	ZINC000248589998	685162603	/nfs/dbraw/zinc/16/26/03/685162603.db2.gz	ZDDXCSDIRRMEOC-ISTVAULSSA-N	0	3	314.788	2.098	10	0		DEAEHN
CN(C)Cc1cc(O[C@H]2CCN(Cc3cccn3C)C2)ccn1	ZINC000886041384	691990467	/nfs/dbraw/zinc/99/04/67/691990467.db2.gz	PKTPNNNGNVYMIQ-SFHVURJKSA-N	0	3	314.433	2.135	10	0		DEAEHN
C[C@@](O)(CN1CCC[C@@H](CO)CC1)C(F)(F)C(F)(F)F	ZINC000724041291	777228825	/nfs/dbraw/zinc/22/88/25/777228825.db2.gz	NGCWVMDLZJTNAO-NXEZZACHSA-N	0	3	305.287	2.029	10	0		DEAEHN
Cc1csc(C)c1S(=O)(=O)N1CCNCCC12CCC2	ZINC000725080325	777578433	/nfs/dbraw/zinc/57/84/33/777578433.db2.gz	JGTPCKWVNPJFIC-UHFFFAOYSA-N	0	3	314.476	2.272	10	0		DEAEHN
CCc1ccc([C@H](C)NC[C@]2(OC)CCS(=O)(=O)C2)s1	ZINC000721262338	781074732	/nfs/dbraw/zinc/07/47/32/781074732.db2.gz	TUKCETQQPZUGRQ-SMDDNHRTSA-N	0	3	317.476	2.165	10	0		DEAEHN
CCc1ccc([C@H](C)NC[C@@]2(OC)CCS(=O)(=O)C2)s1	ZINC000721262334	781075157	/nfs/dbraw/zinc/07/51/57/781075157.db2.gz	TUKCETQQPZUGRQ-FZMZJTMJSA-N	0	3	317.476	2.165	10	0		DEAEHN
Cn1cc(CNC[C@H]2CCCSC2)c(Br)n1	ZINC000712471711	792190034	/nfs/dbraw/zinc/19/00/34/792190034.db2.gz	WAUMZGDUTRWIIK-SECBINFHSA-N	0	3	304.257	2.415	10	0		DEAEHN
C[C@H](N[C@@H]1CCC[C@H]1CNC(=O)OC(C)(C)C)c1cn(C)nn1	ZINC000715858045	792527222	/nfs/dbraw/zinc/52/72/22/792527222.db2.gz	VQGZSZCLYBTAGN-RWMBFGLXSA-N	0	3	323.441	2.159	10	0		DEAEHN
C[C@H]([N-]S(=O)(=O)c1ccc(Cl)s1)C1CC[NH2+]CC1	ZINC000716544664	792978247	/nfs/dbraw/zinc/97/82/47/792978247.db2.gz	JAEGTZKHTCEFOP-QMMMGPOBSA-N	0	3	308.856	2.068	10	0		DEAEHN
c1cc2c(c(CNCCc3nnc4n3CCCCC4)c1)OCO2	ZINC000067698176	794679975	/nfs/dbraw/zinc/67/99/75/794679975.db2.gz	TYDOVKBUOIMNAF-UHFFFAOYSA-N	0	3	314.389	2.066	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](NCc2cnccn2)C12CCC2	ZINC000404771851	802031513	/nfs/dbraw/zinc/03/15/13/802031513.db2.gz	ZQPPVODVYYSMOD-ZIAGYGMSSA-N	0	3	318.421	2.402	10	0		DEAEHN
c1cn(-c2ccc(CNCc3ccc4c(c3)CCO4)cn2)cn1	ZINC000077326572	1080462708	/nfs/dbraw/zinc/46/27/08/1080462708.db2.gz	CYLXZAVVDCWFTC-UHFFFAOYSA-N	0	3	306.369	2.492	10	0		DEAEHN
CN[C@@H](CSc1cnn(C)c1)c1ccc2c(c1)OCCO2	ZINC000081897429	192335613	/nfs/dbraw/zinc/33/56/13/192335613.db2.gz	QGLCHFZDXUMNMN-ZDUSSCGKSA-N	0	3	305.403	2.244	10	0		DEAEHN
CCCN[C@H]1CCOC[C@@H]1S(=O)(=O)c1ccc(Cl)cc1	ZINC000081920244	192338354	/nfs/dbraw/zinc/33/83/54/192338354.db2.gz	USNOKJSILKTHLW-KBPBESRZSA-N	0	3	317.838	2.271	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)C2(Cc3ccccc3)CCC2)CCO1	ZINC000134365473	282122481	/nfs/dbraw/zinc/12/24/81/282122481.db2.gz	KDCZVUCYEZBYEP-QGZVFWFLSA-N	0	3	316.445	2.188	10	0		DEAEHN
C(CN1CCN(CC2CCCCC2)CC1)OC1CCOCC1	ZINC000625107839	365645580	/nfs/dbraw/zinc/64/55/80/365645580.db2.gz	LUMQKLBBKYAJLX-UHFFFAOYSA-N	0	3	310.482	2.380	10	0		DEAEHN
CN[C@H](C)[C@H](C)S(=O)(=O)c1ccc(Br)cc1	ZINC000081933465	192340954	/nfs/dbraw/zinc/34/09/54/192340954.db2.gz	QMWDEENYHGCFGF-BDAKNGLRSA-N	0	3	306.225	2.219	10	0		DEAEHN
N[C@H]1CCCC[C@H]1S(=O)(=O)c1ccc(Br)cc1	ZINC000081933816	192341875	/nfs/dbraw/zinc/34/18/75/192341875.db2.gz	DEQFBIQIBIFBGC-NWDGAFQWSA-N	0	3	318.236	2.493	10	0		DEAEHN
CC[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2CN)CC1	ZINC000079308559	185164367	/nfs/dbraw/zinc/16/43/67/185164367.db2.gz	KMWFSEQKVLJDAW-CQSZACIVSA-N	0	3	310.463	2.487	10	0		DEAEHN
COCc1nc(Cc2ccc(OC)c(OC)c2)sc1CN	ZINC000082445225	185183559	/nfs/dbraw/zinc/18/35/59/185183559.db2.gz	DINZUJUPWCNBHK-UHFFFAOYSA-N	0	3	308.403	2.356	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000170826749	282180649	/nfs/dbraw/zinc/18/06/49/282180649.db2.gz	VCMGRPNZBSMJFR-QWHCGFSZSA-N	0	3	321.421	2.110	10	0		DEAEHN
CC[C@@H](NC(=O)N1CC[C@H](N(C)C)C1)c1ccc(OC)cc1	ZINC000170826282	282180727	/nfs/dbraw/zinc/18/07/27/282180727.db2.gz	HKHMJPCZIRWQJJ-GOEBONIOSA-N	0	3	305.422	2.492	10	0		DEAEHN
CCC[C@@H](C[NH3+])[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000087403816	185223830	/nfs/dbraw/zinc/22/38/30/185223830.db2.gz	FGRVNNFFIAHVCO-VIFPVBQESA-N	0	3	311.234	2.399	10	0		DEAEHN
CC(=O)c1csc(NC(=O)[C@@H]2CNCc3ccccc32)n1	ZINC000087619949	185229240	/nfs/dbraw/zinc/22/92/40/185229240.db2.gz	VJYHNHPKVRFMPX-GFCCVEGCSA-N	0	3	301.371	2.171	10	0		DEAEHN
CNC(C)(C)C(=O)Nc1ccc(OC)c(Br)c1	ZINC000088321796	185245796	/nfs/dbraw/zinc/24/57/96/185245796.db2.gz	FHYSDVVTMXYQSG-UHFFFAOYSA-N	0	3	301.184	2.394	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@H]2CCCOc3cc(F)ccc32)C1	ZINC000180595552	282198489	/nfs/dbraw/zinc/19/84/89/282198489.db2.gz	RIFMXUQFWBROQZ-HIFRSBDPSA-N	0	3	321.396	2.385	10	0		DEAEHN
COC(=O)[C@](C)(CCCN(C)CCC(F)(F)F)NC1CC1	ZINC000088434662	185250086	/nfs/dbraw/zinc/25/00/86/185250086.db2.gz	BTFCHJXKJPAHJO-ZDUSSCGKSA-N	0	3	310.360	2.335	10	0		DEAEHN
CC[C@H](C)C[C@H](C)NCc1ccc(S(=O)(=O)N(C)C)o1	ZINC000088541004	185255695	/nfs/dbraw/zinc/25/56/95/185255695.db2.gz	KQHJLMZWLLCKLE-RYUDHWBXSA-N	0	3	302.440	2.444	10	0		DEAEHN
CC[C@@H](C)N(C)S(=O)(=O)c1ccc(CNCC(C)C)o1	ZINC000088543716	185256569	/nfs/dbraw/zinc/25/65/69/185256569.db2.gz	YRPNWLTWNVPCAE-GFCCVEGCSA-N	0	3	302.440	2.444	10	0		DEAEHN
CCN[C@@H](c1ccc(C)cc1)[C@H](C)S(=O)(=O)CCCOC	ZINC000081986152	192348844	/nfs/dbraw/zinc/34/88/44/192348844.db2.gz	NKAXFHLFHCLJNL-GOEBONIOSA-N	0	3	313.463	2.485	10	0		DEAEHN
CCCN[C@H](c1ccccc1COC)[C@H]1CCS(=O)(=O)C1	ZINC000088556547	185258031	/nfs/dbraw/zinc/25/80/31/185258031.db2.gz	STBYYLSAGZKCHY-HOCLYGCPSA-N	0	3	311.447	2.308	10	0		DEAEHN
C[C@H](N)c1cc(Br)ccc1OCc1ncnn1C	ZINC000088571758	185258174	/nfs/dbraw/zinc/25/81/74/185258174.db2.gz	FNYNOVXKWLMSOM-QMMMGPOBSA-N	0	3	311.183	2.176	10	0		DEAEHN
C[C@H](NC(=O)[C@H]1COC[C@@H]1N)c1ccc(Cl)c(Cl)c1	ZINC000090383680	185293822	/nfs/dbraw/zinc/29/38/22/185293822.db2.gz	XHWVUVWNIMSSPX-DXBFQKDVSA-N	0	3	303.189	2.144	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)N(Cc1cccc(Cl)c1)C(C)C	ZINC000090435001	185296233	/nfs/dbraw/zinc/29/62/33/185296233.db2.gz	QKZPMXMQCMRHLV-CABCVRRESA-N	0	3	310.825	2.311	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1ccc2nc(SC)sc2c1	ZINC000090433006	185296296	/nfs/dbraw/zinc/29/62/96/185296296.db2.gz	YXPFUKYYRIFPKT-GXSJLCMTSA-N	0	3	323.443	2.191	10	0		DEAEHN
CC(C)Oc1ccc(NC(=O)[C@@]2(C)COC[C@H]2N)cc1Cl	ZINC000090588732	185305506	/nfs/dbraw/zinc/30/55/06/185305506.db2.gz	RGKOLTABLDODMJ-HIFRSBDPSA-N	0	3	312.797	2.430	10	0		DEAEHN
C[C@]1(c2nnc3c(Cl)cc(C(F)(F)F)cn32)COC[C@@H]1N	ZINC000090573051	185304438	/nfs/dbraw/zinc/30/44/38/185304438.db2.gz	SXZCFRIPFSVOCX-KWQFWETISA-N	0	3	320.702	2.017	10	0		DEAEHN
Cc1cc(C(=O)N2CCCSC[C@@H]2CN2CCCC2)no1	ZINC000090700852	185310609	/nfs/dbraw/zinc/31/06/09/185310609.db2.gz	RTCLLVDFFGSVQD-ZDUSSCGKSA-N	0	3	309.435	2.027	10	0		DEAEHN
Brc1cncnc1N1CCNCc2ccccc21	ZINC000090781649	185311781	/nfs/dbraw/zinc/31/17/81/185311781.db2.gz	PQBYKAOOOZUDSZ-UHFFFAOYSA-N	0	3	305.179	2.480	10	0		DEAEHN
CCCN[C@H]1c2cc(OC)ccc2CC[C@H]1S(=O)(=O)CC	ZINC000092388571	185315225	/nfs/dbraw/zinc/31/52/25/185315225.db2.gz	JDSMTJLKZFMYEB-CVEARBPZSA-N	0	3	311.447	2.485	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N)[C@@H](Sc1nnc(C)n1C)CC2	ZINC000092389963	185315704	/nfs/dbraw/zinc/31/57/04/185315704.db2.gz	MNMVNYMVEUWXGV-UONOGXRCSA-N	0	3	304.419	2.239	10	0		DEAEHN
CCNc1ccnc(CN2CCN(c3nccs3)CC2)c1	ZINC000092418006	185317000	/nfs/dbraw/zinc/31/70/00/185317000.db2.gz	IWKBDTCLSDMMQN-UHFFFAOYSA-N	0	3	303.435	2.292	10	0		DEAEHN
CCNc1ncc(C(=O)N(C)C[C@H]2CCCN2C)cc1Cl	ZINC000092674189	185332875	/nfs/dbraw/zinc/33/28/75/185332875.db2.gz	QECIJVXFOFXBEQ-GFCCVEGCSA-N	0	3	310.829	2.333	10	0		DEAEHN
CN(C)[C@@H]1CCCN(c2cc3c(cc2Cl)C(=O)C(=O)N3)C1	ZINC000092772767	185339807	/nfs/dbraw/zinc/33/98/07/185339807.db2.gz	GADWQVICJGJQRH-SECBINFHSA-N	0	3	307.781	2.005	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)NC2C(C)(C)C2(C)C)s1	ZINC000092833224	185344841	/nfs/dbraw/zinc/34/48/41/185344841.db2.gz	VGNJNLZPLNHQGM-UHFFFAOYSA-N	0	3	302.465	2.180	10	0		DEAEHN
CCc1ccc(CN)cc1S(=O)(=O)NC1C(C)(C)C1(C)C	ZINC000092833325	185345038	/nfs/dbraw/zinc/34/50/38/185345038.db2.gz	UGVCDPFQGKIFMG-UHFFFAOYSA-N	0	3	310.463	2.421	10	0		DEAEHN
COC[C@@H](O)CN[C@@H](C)c1ccc(Br)cc1OC	ZINC000190435090	282320407	/nfs/dbraw/zinc/32/04/07/282320407.db2.gz	QNVZBYMRZGXJKE-ONGXEEELSA-N	0	3	318.211	2.116	10	0		DEAEHN
COc1cc(F)c(NC(=O)N2CC[C@@H](N(C)C)C2)cc1OC	ZINC000107379672	185479305	/nfs/dbraw/zinc/47/93/05/185479305.db2.gz	VFGMKCYUFPLBMX-SNVBAGLBSA-N	0	3	311.357	2.011	10	0		DEAEHN
OC1CC(CNCc2cc(Br)cc3c2OCC3)C1	ZINC000228477456	282370876	/nfs/dbraw/zinc/37/08/76/282370876.db2.gz	CSOXGRSZRYWQRS-UHFFFAOYSA-N	0	3	312.207	2.245	10	0		DEAEHN
Cc1ccc(NC(=O)COC2(C)CNC2)cc1Br	ZINC000098060720	539435955	/nfs/dbraw/zinc/43/59/55/539435955.db2.gz	FCKVUYOJQGGZRP-UHFFFAOYSA-N	0	3	313.195	2.075	10	0		DEAEHN
CNc1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000286772982	219158891	/nfs/dbraw/zinc/15/88/91/219158891.db2.gz	NRFRZTVQMYGHMK-KRWDZBQOSA-N	0	3	324.428	2.470	10	0		DEAEHN
CCC(C)(CC)C(=O)NC[C@H](O)CN1CCc2ccccc2C1	ZINC000134902250	539512104	/nfs/dbraw/zinc/51/21/04/539512104.db2.gz	GSRAKZMIJQOBMR-KRWDZBQOSA-N	0	3	318.461	2.348	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)CCc2nc(C3CCCC3)no2)C1	ZINC000136743036	539518471	/nfs/dbraw/zinc/51/84/71/539518471.db2.gz	WQELVCJRNVJPPZ-CQSZACIVSA-N	0	3	320.437	2.260	10	0		DEAEHN
Cc1cncc(CNC(=O)N[C@@H](CN(C)C)c2ccccc2)c1	ZINC000153215541	539543452	/nfs/dbraw/zinc/54/34/52/539543452.db2.gz	JISWHRCMIGBKKB-KRWDZBQOSA-N	0	3	312.417	2.492	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCCC[C@@H](n2cccn2)C1	ZINC000616628394	362900648	/nfs/dbraw/zinc/90/06/48/362900648.db2.gz	KOENEXANBUNERA-CQSZACIVSA-N	0	3	308.426	2.435	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC[C@@H](n2ccnc2)CC1	ZINC000616626597	362900721	/nfs/dbraw/zinc/90/07/21/362900721.db2.gz	ATLYWKDHZVUDTP-CQSZACIVSA-N	0	3	308.426	2.435	10	0		DEAEHN
CCc1nn(C)cc1CN1CCC(C(=O)N[C@@H](C)C(C)C)CC1	ZINC000179945256	539643188	/nfs/dbraw/zinc/64/31/88/539643188.db2.gz	ROXUELFFWBLZLN-AWEZNQCLSA-N	0	3	320.481	2.355	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)[C@H](C)N[C@@H](C)[C@H]1CCCO1	ZINC000183226047	539660547	/nfs/dbraw/zinc/66/05/47/539660547.db2.gz	SPIBJLYAJNUMLC-MQIPJXDCSA-N	0	3	304.390	2.373	10	0		DEAEHN
c1cc2cnccc2c(CN2CCN(C[C@@H]3CCOC3)CC2)c1	ZINC000183380406	539662312	/nfs/dbraw/zinc/66/23/12/539662312.db2.gz	JYSPSSWCSOJEOJ-INIZCTEOSA-N	0	3	311.429	2.389	10	0		DEAEHN
CN[C@H](c1cc(Br)sc1C)[C@@H]1COCCO1	ZINC000084006521	192395255	/nfs/dbraw/zinc/39/52/55/192395255.db2.gz	MGYPHJPEAQOCON-GXSJLCMTSA-N	0	3	306.225	2.495	10	0		DEAEHN
CN[C@@H](C[S@](=O)C1CCCC1)c1ccc2c(c1)OCCO2	ZINC000084052359	192398367	/nfs/dbraw/zinc/39/83/67/192398367.db2.gz	PBHXRHTVWKUVEY-LHSJRXKWSA-N	0	3	309.431	2.410	10	0		DEAEHN
C=Cn1cc(CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cn1	ZINC000219395938	539727492	/nfs/dbraw/zinc/72/74/92/539727492.db2.gz	GQNRHZNSSWCAKD-CYBMUJFWSA-N	0	3	306.410	2.330	10	0		DEAEHN
C[C@@H](C[C@@H]1COCCN1)Nc1cc2c(cc1Cl)NC(=O)C2	ZINC000133616696	186000040	/nfs/dbraw/zinc/00/00/40/186000040.db2.gz	FERRJWXCPXRHJJ-GXSJLCMTSA-N	0	3	309.797	2.014	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CC[C@@H](OCCC(C)C)C2)C1	ZINC000246153885	539761585	/nfs/dbraw/zinc/76/15/85/539761585.db2.gz	PPNLPXFPNDDDJN-JKSUJKDBSA-N	0	3	311.470	2.317	10	0		DEAEHN
CCCN(C)S(=O)(=O)c1cc(CNC(C)C)cc(F)c1F	ZINC000138453534	186017264	/nfs/dbraw/zinc/01/72/64/186017264.db2.gz	QIQBDFRJWQWCLU-UHFFFAOYSA-N	0	3	320.405	2.493	10	0		DEAEHN
CCCN(CC)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138447407	186017307	/nfs/dbraw/zinc/01/73/07/186017307.db2.gz	XGFURCXTPVKTJW-UHFFFAOYSA-N	0	3	306.378	2.105	10	0		DEAEHN
CCC1CCN(S(=O)(=O)c2cc(CN)cc(F)c2F)CC1	ZINC000138696223	186018175	/nfs/dbraw/zinc/01/81/75/186018175.db2.gz	QTBSCTYWNWGMOU-UHFFFAOYSA-N	0	3	318.389	2.234	10	0		DEAEHN
CCc1cc(C[C@@H](N)c2ncccc2Br)n(C)n1	ZINC000140322358	186025980	/nfs/dbraw/zinc/02/59/80/186025980.db2.gz	HHBMFRHJFQDFNH-GFCCVEGCSA-N	0	3	309.211	2.383	10	0		DEAEHN
CCC[C@H]1N[C@@H](c2cccs2)N(C2CCN(C)CC2)C1=O	ZINC000141176601	186029189	/nfs/dbraw/zinc/02/91/89/186029189.db2.gz	RVLGCZMRKVNYLT-UKRRQHHQSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCC(CC)N(C)[C@]1(CN)CCS(=O)(=O)c2ccccc21	ZINC000147646318	186040603	/nfs/dbraw/zinc/04/06/03/186040603.db2.gz	APAZCQRZVFGQNG-INIZCTEOSA-N	0	3	310.463	2.138	10	0		DEAEHN
CCN[C@H](c1cncs1)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000147685218	186041396	/nfs/dbraw/zinc/04/13/96/186041396.db2.gz	FUTORUNVHWNQSQ-GVXVVHGQSA-N	0	3	302.465	2.397	10	0		DEAEHN
Cc1c(CN)cc(Cl)cc1S(=O)(=O)N(C)C1CCC1	ZINC000144663651	186035843	/nfs/dbraw/zinc/03/58/43/186035843.db2.gz	CPPYUTNSJUVPGB-UHFFFAOYSA-N	0	3	302.827	2.280	10	0		DEAEHN
C[C@H](CN1C(=O)[C@H](C)N[C@@H]1c1cccs1)N1CCCCC1	ZINC000145703847	186037621	/nfs/dbraw/zinc/03/76/21/186037621.db2.gz	OAVADUPRFAYWHP-IPYPFGDCSA-N	0	3	307.463	2.441	10	0		DEAEHN
CN[C@@H](C)c1cccc(S(=O)(=O)NC[C@H]2CCCS2)c1	ZINC000150028431	186054211	/nfs/dbraw/zinc/05/42/11/186054211.db2.gz	OSKXHAVNBKHPPC-WCQYABFASA-N	0	3	314.476	2.141	10	0		DEAEHN
CCN[C@@H](c1ccc(Cl)c(OC)c1)[C@H]1CCS(=O)(=O)C1	ZINC000150147611	186054932	/nfs/dbraw/zinc/05/49/32/186054932.db2.gz	FIDPZPIVEIPWIZ-FZMZJTMJSA-N	0	3	317.838	2.434	10	0		DEAEHN
NCc1nc([C@H]2CCS(=O)(=O)C2)sc1-c1ccccc1	ZINC000150325504	186056470	/nfs/dbraw/zinc/05/64/70/186056470.db2.gz	HZSOQBUHYJXGNY-NSHDSACASA-N	0	3	308.428	2.171	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@H](C)C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000155704204	186104837	/nfs/dbraw/zinc/10/48/37/186104837.db2.gz	UUNBJHLDKNLTNT-GDZNZVCISA-N	0	3	320.481	2.060	10	0		DEAEHN
CC(C)NCc1cc(S(=O)(=O)NC2CC(C)C2)ccc1F	ZINC000163992238	186145232	/nfs/dbraw/zinc/14/52/32/186145232.db2.gz	ROYXYHPSNAYBOO-UHFFFAOYSA-N	0	3	314.426	2.401	10	0		DEAEHN
CCS(=O)(=O)C[C@H](C)N[C@@H](C)Cc1c(F)cccc1F	ZINC000164006244	186145296	/nfs/dbraw/zinc/14/52/96/186145296.db2.gz	NIPMQKFKPVZVHW-QWRGUYRKSA-N	0	3	305.390	2.309	10	0		DEAEHN
Nc1nc(NCc2ccc(Cl)s2)nc(N2CCCC2)n1	ZINC000155976401	186124968	/nfs/dbraw/zinc/12/49/68/186124968.db2.gz	SCEWUVOPFCNVCX-UHFFFAOYSA-N	0	3	310.814	2.381	10	0		DEAEHN
COc1ccc(CNC[C@H](C)[S@](C)=O)cc1OC(F)F	ZINC000159644548	186132393	/nfs/dbraw/zinc/13/23/93/186132393.db2.gz	XYTHRWYYNHRCEQ-GWNMQOMSSA-N	0	3	307.362	2.153	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Cc2ccccc2Br)C1	ZINC000171508454	186170569	/nfs/dbraw/zinc/17/05/69/186170569.db2.gz	MNOPJNOSLVGJDA-LBPRGKRZSA-N	0	3	311.223	2.154	10	0		DEAEHN
COC[C@H](C)C(=O)NCC(C)(C)N1CCc2ccccc2C1	ZINC000171443636	186161107	/nfs/dbraw/zinc/16/11/07/186161107.db2.gz	VBPAUZIPHFWEKE-AWEZNQCLSA-N	0	3	304.434	2.222	10	0		DEAEHN
Cc1cccc(CNC(=O)CN(C)[C@@]2(CO)CC[C@H](C)C2)c1	ZINC000188020790	186244916	/nfs/dbraw/zinc/24/49/16/186244916.db2.gz	YAOUZNVINIJVRE-YJBOKZPZSA-N	0	3	304.434	2.094	10	0		DEAEHN
CN(C)c1cc(C(=O)N2CCN3CCC[C@@H]3C2)c2ccccc2n1	ZINC000186052741	186235726	/nfs/dbraw/zinc/23/57/26/186235726.db2.gz	DPJBYKIZAPEMPF-CQSZACIVSA-N	0	3	324.428	2.221	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)CN(C)[C@@]1(CO)CC[C@H](C)C1	ZINC000187987351	186240147	/nfs/dbraw/zinc/24/01/47/186240147.db2.gz	OTZWXAGASLCMRX-KXBFYZLASA-N	0	3	318.461	2.436	10	0		DEAEHN
CCn1nccc1CCN1C[C@H](O)C[C@H]1c1cccc(F)c1	ZINC000253396357	186304998	/nfs/dbraw/zinc/30/49/98/186304998.db2.gz	NWPKKTRWXIBBBQ-SJORKVTESA-N	0	3	303.381	2.393	10	0		DEAEHN
CN1CCC(N2CCOC[C@H]2c2nc(C(C)(C)C)co2)CC1	ZINC000072322163	191122379	/nfs/dbraw/zinc/12/23/79/191122379.db2.gz	NQYXEVJYUXEVHN-AWEZNQCLSA-N	0	3	307.438	2.440	10	0		DEAEHN
CN(Cc1cc(F)cc(Br)c1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000626038227	366017610	/nfs/dbraw/zinc/01/76/10/366017610.db2.gz	YSPRYNNNSBKHMO-WVSHTKLVSA-N	0	3	315.186	2.284	10	0		DEAEHN
COC(=O)c1ccc(NC(=O)N2CCN3CCC[C@@H]3C2)cc1C	ZINC000171893956	198002708	/nfs/dbraw/zinc/00/27/08/198002708.db2.gz	UFGIOOJMFUESCY-CQSZACIVSA-N	0	3	317.389	2.094	10	0		DEAEHN
COc1ccc(C)cc1CCNC(=O)N1CCN2CCC[C@H]2C1	ZINC000171899154	198004398	/nfs/dbraw/zinc/00/43/98/198004398.db2.gz	GCYZWDPAMRDIBH-INIZCTEOSA-N	0	3	317.433	2.036	10	0		DEAEHN
O=C(NCCc1c[nH]c2ccccc12)N1CCN2CCC[C@H]2C1	ZINC000171897336	198004502	/nfs/dbraw/zinc/00/45/02/198004502.db2.gz	RANWZDHZKDSNCI-HNNXBMFYSA-N	0	3	312.417	2.200	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1cc(F)ccc1F	ZINC000171908410	198006423	/nfs/dbraw/zinc/00/64/23/198006423.db2.gz	SREGDUIGBZVEDH-GFCCVEGCSA-N	0	3	313.348	2.197	10	0		DEAEHN
O=C(N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)N1CC[C@@H](N2CC=CC2)C1	ZINC000246322352	295827844	/nfs/dbraw/zinc/82/78/44/295827844.db2.gz	KPSZDBNTWLLIFP-OQIJWPOYSA-N	0	3	323.440	2.371	10	0		DEAEHN
C[C@H]1CSCCN1C(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000172559247	198114864	/nfs/dbraw/zinc/11/48/64/198114864.db2.gz	ZOFUZSKOKOWVDJ-HOCLYGCPSA-N	0	3	321.490	2.306	10	0		DEAEHN
Cc1nc2ccccc2n1CC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000172620394	198126010	/nfs/dbraw/zinc/12/60/10/198126010.db2.gz	ZOKHPRNALUXJGG-UKRRQHHQSA-N	0	3	314.433	2.286	10	0		DEAEHN
O=C(CCN1CCN2CCCC[C@@H]2C1)N1CCc2ccccc21	ZINC000172800766	198151506	/nfs/dbraw/zinc/15/15/06/198151506.db2.gz	KOIRPDBTHZWHDF-QGZVFWFLSA-N	0	3	313.445	2.136	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cccc(C[S@](C)=O)c2)CCN1C	ZINC000172994291	198174671	/nfs/dbraw/zinc/17/46/71/198174671.db2.gz	NZZCBILOMCYMSD-XNVILDLWSA-N	0	3	322.474	2.120	10	0		DEAEHN
CC(C)Nc1ncccc1C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000173180434	198192791	/nfs/dbraw/zinc/19/27/91/198192791.db2.gz	OHZZJEYZEXWZDT-KBPBESRZSA-N	0	3	304.438	2.457	10	0		DEAEHN
CCc1cnc(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)s1	ZINC000173398796	198209618	/nfs/dbraw/zinc/20/96/18/198209618.db2.gz	SPWKBRVQBLVLBX-NEPJUHHUSA-N	0	3	310.467	2.330	10	0		DEAEHN
Cc1nc(CNC(=O)c2oc3ccccc3c2CN(C)C)no1	ZINC000173624385	198233881	/nfs/dbraw/zinc/23/38/81/198233881.db2.gz	KOTXDESDOPXTDQ-UHFFFAOYSA-N	0	3	314.345	2.116	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)[C@H](O)c1ccccc1	ZINC000073010080	191268186	/nfs/dbraw/zinc/26/81/86/191268186.db2.gz	XAYTZGYVRJWYHM-QZTJIDSGSA-N	0	3	312.413	2.009	10	0		DEAEHN
Cc1csc([C@H](NC(=O)N2CC[C@@H](N(C)C)C2)C2CC2)n1	ZINC000173914436	198268305	/nfs/dbraw/zinc/26/83/05/198268305.db2.gz	IOOWLHVFDRZKBR-CHWSQXEVSA-N	0	3	308.451	2.248	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N(C(=O)C(=O)Nc2cccc(CN(C)C)c2)C1	ZINC000173826786	198257308	/nfs/dbraw/zinc/25/73/08/198257308.db2.gz	COPGRAYMOZGOCO-KGLIPLIRSA-N	0	3	317.433	2.334	10	0		DEAEHN
CCc1nc(CCNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cs1	ZINC000174602180	198357526	/nfs/dbraw/zinc/35/75/26/198357526.db2.gz	DITBKFKNAIMNAR-OCCSQVGLSA-N	0	3	324.494	2.372	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCOC[C@@H]1CC(C)C	ZINC000073203325	191291605	/nfs/dbraw/zinc/29/16/05/191291605.db2.gz	RNXFTCPGLMTBHC-HOTGVXAUSA-N	0	3	313.486	2.419	10	0		DEAEHN
COc1ccccc1[C@H]1[C@@H](N)CCCN1C(=O)[C@H]1CCCOC1	ZINC000333964428	282999471	/nfs/dbraw/zinc/99/94/71/282999471.db2.gz	PAFXPDKTADDTPJ-QRTARXTBSA-N	0	3	318.417	2.113	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NC[C@@H]1CCCOC1)c1ccccc1	ZINC000057162123	354559111	/nfs/dbraw/zinc/55/91/11/354559111.db2.gz	DACZVJQWGRBFKM-HOCLYGCPSA-N	0	3	305.422	2.015	10	0		DEAEHN
C[C@@H]1CC[C@H](C)CN1CC(=O)NCCCN1CCCCCC1=O	ZINC000076150157	355130049	/nfs/dbraw/zinc/13/00/49/355130049.db2.gz	RUUJALDWOTUIMR-JKSUJKDBSA-N	0	3	323.481	2.016	10	0		DEAEHN
NC[C@H](NC(=O)c1sccc1Br)C(F)(F)F	ZINC000401715027	540142595	/nfs/dbraw/zinc/14/25/95/540142595.db2.gz	AIMJQVAHPAVKJN-YFKPBYRVSA-N	0	3	317.130	2.130	10	0		DEAEHN
CCN(CC)C[C@@H](C)NS(=O)(=O)c1ccc(F)cc1C	ZINC000440071403	540181031	/nfs/dbraw/zinc/18/10/31/540181031.db2.gz	BNHJXNKDYAPDFE-GFCCVEGCSA-N	0	3	302.415	2.143	10	0		DEAEHN
CCN1CCN(CCCCNC(=O)N[C@H](C)C(C)(C)C)CC1	ZINC000112439846	355752759	/nfs/dbraw/zinc/75/27/59/355752759.db2.gz	SFJUORIXQXFNGW-OAHLLOKOSA-N	0	3	312.502	2.138	10	0		DEAEHN
CCCN(CCN(C)C)C(=O)c1coc(Br)c1	ZINC000123737246	355805823	/nfs/dbraw/zinc/80/58/23/355805823.db2.gz	XVXNBNDRHYOHIU-UHFFFAOYSA-N	0	3	303.200	2.456	10	0		DEAEHN
C[C@H](CCC(C)(C)C)NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000153841353	355938400	/nfs/dbraw/zinc/93/84/00/355938400.db2.gz	KUVRVJOWHVRCNK-HUUCEWRRSA-N	0	3	313.486	2.347	10	0		DEAEHN
CN(C)CCN(CC1CCCCC1)C(=O)NCc1ccnn1C	ZINC000156622739	355952614	/nfs/dbraw/zinc/95/26/14/355952614.db2.gz	HMMBKNPEPMVROU-UHFFFAOYSA-N	0	3	321.469	2.074	10	0		DEAEHN
CCCCN(CCCO)CC(=O)N1CCC[C@@H](C(F)(F)F)C1	ZINC000182155814	356111598	/nfs/dbraw/zinc/11/15/98/356111598.db2.gz	XLTYOECOHFBFMP-CYBMUJFWSA-N	0	3	324.387	2.272	10	0		DEAEHN
COc1cc(C[NH2+][C@H](C)CCO)cc(Br)c1[O-]	ZINC000080203868	192012904	/nfs/dbraw/zinc/01/29/04/192012904.db2.gz	RTZLNUBNKHOXOT-MRVPVSSYSA-N	0	3	304.184	2.024	10	0		DEAEHN
CN1CCN(C(=O)CN[C@@H]2c3ccccc3CCC2(C)C)CC1	ZINC000183201886	356163230	/nfs/dbraw/zinc/16/32/30/356163230.db2.gz	QAXXXWVUBWXMBA-GOSISDBHSA-N	0	3	315.461	2.064	10	0		DEAEHN
C[C@@H]1CCC[C@](N)(C(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1	ZINC000080915105	192200587	/nfs/dbraw/zinc/20/05/87/192200587.db2.gz	CBSNSEAGIMGTKE-RFAUZJTJSA-N	0	3	309.797	2.285	10	0		DEAEHN
COC[C@H]1CCN([C@@H](CN)c2cccc(Br)c2)C1	ZINC000081041968	192219147	/nfs/dbraw/zinc/21/91/47/192219147.db2.gz	PMKVVTBNDVIVLH-FZMZJTMJSA-N	0	3	313.239	2.417	10	0		DEAEHN
COC[C@H]1CCN([C@@H](CN)c2ccccc2OC(F)F)C1	ZINC000081049460	192219327	/nfs/dbraw/zinc/21/93/27/192219327.db2.gz	RVFSKRPKQKHZGU-AAEUAGOBSA-N	0	3	300.349	2.256	10	0		DEAEHN
COC[C@H]1CCN([C@@H](CN)c2cc(Br)cs2)C1	ZINC000081041556	192219880	/nfs/dbraw/zinc/21/98/80/192219880.db2.gz	ASJOMXQCUAEZKK-ONGXEEELSA-N	0	3	319.268	2.479	10	0		DEAEHN
Cc1ccc(C(=O)N2CCO[C@H](CN(C)CC3CC3)C2)c(F)c1	ZINC000328639034	356465613	/nfs/dbraw/zinc/46/56/13/356465613.db2.gz	PITQMBQTOMYLNI-OAHLLOKOSA-N	0	3	320.408	2.317	10	0		DEAEHN
CCC[C@@H](N)C(=O)N1CCC[C@H]1c1ccc(OC)cc1OC	ZINC000236907821	202064624	/nfs/dbraw/zinc/06/46/24/202064624.db2.gz	ZZZWFAFWBZRVET-CABCVRRESA-N	0	3	306.406	2.495	10	0		DEAEHN
CNCc1sccc1S(=O)(=O)N(C)C1CCCCC1	ZINC000088916697	192656078	/nfs/dbraw/zinc/65/60/78/192656078.db2.gz	ZPXKAIDGONHQPN-UHFFFAOYSA-N	0	3	302.465	2.421	10	0		DEAEHN
CN(CC1CC1)C(=O)CNC1(Cc2ccccc2)CCOCC1	ZINC000451943247	283283001	/nfs/dbraw/zinc/28/30/01/283283001.db2.gz	VNZTUKDNDWOIFG-UHFFFAOYSA-N	0	3	316.445	2.236	10	0		DEAEHN
Cc1cccc(Cl)c1NC(=O)CN1CCN2CCC[C@@H]2C1	ZINC000179424965	199032622	/nfs/dbraw/zinc/03/26/22/199032622.db2.gz	JTXVESDZPHXNDN-CYBMUJFWSA-N	0	3	307.825	2.367	10	0		DEAEHN
C[C@H]1C[C@H](CCN2CCC[C@H]2CS(N)(=O)=O)C[C@@H](C)C1	ZINC000408245659	291120419	/nfs/dbraw/zinc/12/04/19/291120419.db2.gz	HURSBFPHAIJYDK-YJNKXOJESA-N	0	3	302.484	2.202	10	0		DEAEHN
CC(C)CN(C1CC1)S(=O)(=O)c1cc(CN)ccc1F	ZINC000089004391	192691658	/nfs/dbraw/zinc/69/16/58/192691658.db2.gz	YZQMMWIRDHVZGA-UHFFFAOYSA-N	0	3	300.399	2.094	10	0		DEAEHN
CC[C@H](N[C@@H]1CCc2nnc(C(C)C)n2C1)c1cnn(C)c1	ZINC000180508174	199169166	/nfs/dbraw/zinc/16/91/66/199169166.db2.gz	MLFOWRQBKFPXIR-KGLIPLIRSA-N	0	3	302.426	2.191	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCC2(C)Cc3ccccc3C2)C1	ZINC000180580790	199179285	/nfs/dbraw/zinc/17/92/85/199179285.db2.gz	VCWVEZLZZVYVBQ-MRXNPFEDSA-N	0	3	301.434	2.137	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@@H]1[C@@H]2CCO[C@H]2C12CCC2	ZINC000291663593	404469467	/nfs/dbraw/zinc/46/94/67/404469467.db2.gz	FKSLWNBMVIKCFF-RCCFBDPRSA-N	0	3	324.428	2.374	10	0		DEAEHN
CCCCN([C@@H](C)CC)S(=O)(=O)c1n[nH]c(C)c1CNC	ZINC000089006035	192694120	/nfs/dbraw/zinc/69/41/20/192694120.db2.gz	ZNAAZDVZABDOTQ-NSHDSACASA-N	0	3	316.471	2.027	10	0		DEAEHN
CC(=O)[C@](C)(O)CN1CCC(CCC(=O)OC(C)(C)C)CC1	ZINC000595719415	358532189	/nfs/dbraw/zinc/53/21/89/358532189.db2.gz	UGUKMQIQSWFYHP-QGZVFWFLSA-N	0	3	313.438	2.160	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCC[C@@H](C)[C@@H]2C)nc1	ZINC000089022144	192700972	/nfs/dbraw/zinc/70/09/72/192700972.db2.gz	YDBDGOARKDFTCM-OLZOCXBDSA-N	0	3	311.451	2.000	10	0		DEAEHN
CN(CC1CCC1)S(=O)(=O)c1cc(Cl)cc(CN)c1F	ZINC000089026820	192706367	/nfs/dbraw/zinc/70/63/67/192706367.db2.gz	JRTLQRIQWBOFKA-UHFFFAOYSA-N	0	3	320.817	2.358	10	0		DEAEHN
CCN[C@H](Cc1c(Br)c(C)nn1C)c1ccncn1	ZINC000089251753	192751369	/nfs/dbraw/zinc/75/13/69/192751369.db2.gz	IAPLOXHWAROGLT-LLVKDONJSA-N	0	3	324.226	2.174	10	0		DEAEHN
C[C@@H](NC(=O)[C@H](C)N(C)CCN(C)C1CC1)c1ccccc1	ZINC000186788442	200011187	/nfs/dbraw/zinc/01/11/87/200011187.db2.gz	NGAQYVRAENAMQA-CABCVRRESA-N	0	3	303.450	2.278	10	0		DEAEHN
CCC[C@@H](C)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000187684674	200143915	/nfs/dbraw/zinc/14/39/15/200143915.db2.gz	SJWOLEOBRYCLLJ-SJORKVTESA-N	0	3	306.450	2.233	10	0		DEAEHN
CC(=O)C(C)(C)CCC(=O)N1CCC(N2CCCOCC2)CC1	ZINC000627740514	366606715	/nfs/dbraw/zinc/60/67/15/366606715.db2.gz	SSYDWJIYKHEFGQ-UHFFFAOYSA-N	0	3	324.465	2.095	10	0		DEAEHN
O=C1[C@@H](N[C@@H]2CCCSC2)CCN1Cc1ccc(F)cc1	ZINC000189055748	200342495	/nfs/dbraw/zinc/34/24/95/200342495.db2.gz	YYHPNUSGVXVGTF-CABCVRRESA-N	0	3	308.422	2.412	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)N3CCC[C@H](N(C)C)C3)cc2c1	ZINC000189231094	200367080	/nfs/dbraw/zinc/36/70/80/200367080.db2.gz	FMIUJJFJKBZFJG-ZDUSSCGKSA-N	0	3	301.390	2.343	10	0		DEAEHN
Cc1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cnn1	ZINC000276008294	212627914	/nfs/dbraw/zinc/62/79/14/212627914.db2.gz	AAXOHGIJLAQTCP-UHFFFAOYSA-N	0	3	314.389	2.115	10	0		DEAEHN
CCCCOC[C@@H](O)CN[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000193358454	201038145	/nfs/dbraw/zinc/03/81/45/201038145.db2.gz	DNMSSPMNJXRDKV-PBHICJAKSA-N	0	3	318.421	2.096	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H]2CCC[NH2+][C@H]2C)c(Cl)cc1F	ZINC000193450374	201053110	/nfs/dbraw/zinc/05/31/10/201053110.db2.gz	DNZQIKVWQJWLBI-JOYOIKCWSA-N	0	3	320.817	2.206	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@H]2CCC[NH2+][C@H]2C)c(Cl)cc1F	ZINC000193450390	201053422	/nfs/dbraw/zinc/05/34/22/201053422.db2.gz	DNZQIKVWQJWLBI-CABZTGNLSA-N	0	3	320.817	2.206	10	0		DEAEHN
Cn1ncc(Cl)c1C1=C[C@H](N)CN(C(=O)OC(C)(C)C)C1	ZINC000675078121	541286237	/nfs/dbraw/zinc/28/62/37/541286237.db2.gz	MQSRABKKLWNXTC-JTQLQIEISA-N	0	3	312.801	2.035	10	0		DEAEHN
Cn1c(Cl)ncc1C1=C[C@@H](N)CN(C(=O)OC(C)(C)C)C1	ZINC000675077533	541286347	/nfs/dbraw/zinc/28/63/47/541286347.db2.gz	GABHKQSIJUBDGL-SNVBAGLBSA-N	0	3	312.801	2.035	10	0		DEAEHN
CC(=O)N1CC[C@H](NCCO[C@H]2CC2(F)F)c2ccccc21	ZINC000621765392	364539532	/nfs/dbraw/zinc/53/95/32/364539532.db2.gz	XUEQFXPSFKTGKG-ZFWWWQNUSA-N	0	3	310.344	2.498	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2cc(C)ccc2OC)CC12COC2	ZINC000449360220	240391957	/nfs/dbraw/zinc/39/19/57/240391957.db2.gz	HONQMTWHGREAOO-HNNXBMFYSA-N	0	3	319.401	2.015	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2ccc(C)c(OC)c2)CC12COC2	ZINC000449356932	240392854	/nfs/dbraw/zinc/39/28/54/240392854.db2.gz	CVTXRAVPDYQHOU-HNNXBMFYSA-N	0	3	319.401	2.015	10	0		DEAEHN
c1csc(CNC[C@H]2CN(Cc3ccncc3)CCO2)c1	ZINC000623780517	365172483	/nfs/dbraw/zinc/17/24/83/365172483.db2.gz	NPNIWQVBYMFQIL-HNNXBMFYSA-N	0	3	303.431	2.134	10	0		DEAEHN
CC(C)c1c(CNC(C)(C)C)cnn1[C@@H]1CCS(=O)(=O)C1	ZINC000091336282	193043123	/nfs/dbraw/zinc/04/31/23/193043123.db2.gz	XALWZJKFODZRPK-CYBMUJFWSA-N	0	3	313.467	2.254	10	0		DEAEHN
CN[C@H](c1ccc(F)c(F)c1F)C(C)(C)N1CCOCC1	ZINC000091566670	193073436	/nfs/dbraw/zinc/07/34/36/193073436.db2.gz	FVBYDBKMYKUXRY-CQSZACIVSA-N	0	3	302.340	2.475	10	0		DEAEHN
Cc1cc([C@H](CN)N2CCCOCC2)ccc1Br	ZINC000091471078	193060724	/nfs/dbraw/zinc/06/07/24/193060724.db2.gz	RYKMSLQMKVNHIX-AWEZNQCLSA-N	0	3	313.239	2.480	10	0		DEAEHN
CCS(=O)(=O)CCC[C@H](O)C1(N(C)C)CCCCCC1	ZINC000091653977	193085171	/nfs/dbraw/zinc/08/51/71/193085171.db2.gz	SZMVKLHBOFIWCY-AWEZNQCLSA-N	0	3	305.484	2.217	10	0		DEAEHN
C[C@H](NC[C@H]1CN(C)CCO1)c1ccccc1OC(F)F	ZINC000091667762	193087655	/nfs/dbraw/zinc/08/76/55/193087655.db2.gz	YQTQZUHQCYFOMT-RYUDHWBXSA-N	0	3	300.349	2.269	10	0		DEAEHN
COc1nsc(CNC[C@H]2C[C@@H](OC)C2)c1Br	ZINC000630075208	367458636	/nfs/dbraw/zinc/45/86/36/367458636.db2.gz	VUJCURQBVBFPBF-OCAPTIKFSA-N	0	3	321.240	2.429	10	0		DEAEHN
CCOc1ccccc1CN1CCN(CC[C@@H](C)O)[C@@H](C)C1	ZINC000450907599	242384635	/nfs/dbraw/zinc/38/46/35/242384635.db2.gz	KXLDGVNTXNUGIN-JKSUJKDBSA-N	0	3	306.450	2.362	10	0		DEAEHN
CCC1CCN(S(=O)(=O)c2ccc(CNC)cc2F)CC1	ZINC000092115873	193163995	/nfs/dbraw/zinc/16/39/95/193163995.db2.gz	DMWWMSARLNHJFO-UHFFFAOYSA-N	0	3	314.426	2.356	10	0		DEAEHN
CCC1(C)CCN(S(=O)(=O)c2ccc(CN)cc2F)CC1	ZINC000092116142	193164484	/nfs/dbraw/zinc/16/44/84/193164484.db2.gz	UAAXAJKYJTXZMN-UHFFFAOYSA-N	0	3	314.426	2.485	10	0		DEAEHN
C/C(=C\c1cccc(C(F)(F)F)c1)CN[C@@H]1COC[C@@H]1O	ZINC000631200526	368073817	/nfs/dbraw/zinc/07/38/17/368073817.db2.gz	LFMFUDUSEWLOLJ-RMULCIKWSA-N	0	3	301.308	2.458	10	0		DEAEHN
O[C@@H](CCNCc1cc(Cl)c2c(c1)OCCO2)C(F)F	ZINC000631219444	368086602	/nfs/dbraw/zinc/08/66/02/368086602.db2.gz	NSGAOJMOLFRLQM-JTQLQIEISA-N	0	3	307.724	2.217	10	0		DEAEHN
Cc1csc(NC(=O)CN[C@@H](C(C)C)[C@@H](CO)C(C)C)n1	ZINC000451600539	243182538	/nfs/dbraw/zinc/18/25/38/243182538.db2.gz	SDMUHQRJEZMXLA-JSGCOSHPSA-N	0	3	313.467	2.269	10	0		DEAEHN
CCN(CC(C)(C)O)[C@H](C)C(=O)Nc1cc(Cl)ccc1N	ZINC000092964990	193189844	/nfs/dbraw/zinc/18/98/44/193189844.db2.gz	BHRKEKWZTXRMOA-SNVBAGLBSA-N	0	3	313.829	2.342	10	0		DEAEHN
COC(=O)[C@@H](C)Oc1ccc(CN2CCC([C@H](C)O)CC2)cc1	ZINC000092970850	193191052	/nfs/dbraw/zinc/19/10/52/193191052.db2.gz	HBEGWPGRHCNLIW-UONOGXRCSA-N	0	3	321.417	2.220	10	0		DEAEHN
CNCc1sc(N(CCOC)[C@@H](C)COC)nc1C(C)C	ZINC000093000058	193192424	/nfs/dbraw/zinc/19/24/24/193192424.db2.gz	HGEDRCUESJYGRO-LBPRGKRZSA-N	0	3	315.483	2.474	10	0		DEAEHN
CO[C@H](c1ccccc1F)[C@H](C)NC(=O)[C@H](N)CCSC	ZINC000262125842	203206225	/nfs/dbraw/zinc/20/62/25/203206225.db2.gz	LJQWSGZKHLTNTA-GDLCADMTSA-N	0	3	314.426	2.098	10	0		DEAEHN
O=C(Nc1cccc(COC2CCCCC2)c1)[C@@H]1C[C@H](O)CN1	ZINC000262490292	203306309	/nfs/dbraw/zinc/30/63/09/203306309.db2.gz	ZJCAHBHUOHBJTJ-RDJZCZTQSA-N	0	3	318.417	2.197	10	0		DEAEHN
CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)[C@@H](N)CCSC	ZINC000262533778	203321779	/nfs/dbraw/zinc/32/17/79/203321779.db2.gz	IZEMRRYVZWDNCW-SWHYSGLUSA-N	0	3	314.426	2.098	10	0		DEAEHN
COc1cc(CN2CC[C@@H]3OCCC[C@@H]3C2)cc2c1OCCO2	ZINC000093505733	193262380	/nfs/dbraw/zinc/26/23/80/193262380.db2.gz	RUFLZGPBMMQVPR-CABCVRRESA-N	0	3	319.401	2.467	10	0		DEAEHN
NC(=O)[C@]1(N)CCC[C@@H]1CCSc1nc2ccccc2[nH]1	ZINC000093629107	193276867	/nfs/dbraw/zinc/27/68/67/193276867.db2.gz	OIQQIDYNYNVXHO-BMIGLBTASA-N	0	3	304.419	2.028	10	0		DEAEHN
NC(=O)[C@]1(N)CCC[C@H](Sc2ccc(C(F)(F)F)cn2)C1	ZINC000093777635	193304460	/nfs/dbraw/zinc/30/44/60/193304460.db2.gz	XXJHPCPYGRAJQC-CABZTGNLSA-N	0	3	319.352	2.318	10	0		DEAEHN
C[NH2+][C@H](C)c1ccccc1[N-]S(=O)(=O)CCOC(C)C	ZINC000093665849	193287828	/nfs/dbraw/zinc/28/78/28/193287828.db2.gz	GFWUUPPLOMFHGK-GFCCVEGCSA-N	0	3	300.424	2.134	10	0		DEAEHN
CCN[C@]1(C(N)=O)CC[C@@H](Sc2nc3ccccc3[nH]2)C1	ZINC000093850323	193317236	/nfs/dbraw/zinc/31/72/36/193317236.db2.gz	HJLHYROCIYZNQX-MEBBXXQBSA-N	0	3	304.419	2.041	10	0		DEAEHN
NC(=O)[C@]1(N)CC[C@@H](Sc2cccc(Br)c2)C1	ZINC000093852771	193318478	/nfs/dbraw/zinc/31/84/78/193318478.db2.gz	KAHMPLRQHCQHFP-PWSUYJOCSA-N	0	3	315.236	2.277	10	0		DEAEHN
CCN[C@@]1(C(N)=O)CC[C@@H](Sc2cc(F)ccc2F)C1	ZINC000093851296	193319162	/nfs/dbraw/zinc/31/91/62/193319162.db2.gz	SDTMABATPDVCQK-YGRLFVJLSA-N	0	3	300.374	2.443	10	0		DEAEHN
CCCN[C@H](c1cc(Cl)cnc1N)[C@@H]1CN(CC)CCO1	ZINC000093915258	193328128	/nfs/dbraw/zinc/32/81/28/193328128.db2.gz	XJACFGXMCJZDGD-UONOGXRCSA-N	0	3	312.845	2.079	10	0		DEAEHN
NCc1ccc(C(F)(F)F)nc1Sc1nnnn1C1CC1	ZINC000094337258	193361271	/nfs/dbraw/zinc/36/12/71/193361271.db2.gz	VKWBLJZKEVICJX-UHFFFAOYSA-N	0	3	316.312	2.032	10	0		DEAEHN
CCCNC(=O)[C@H](C)Oc1c(F)cc(CNCC)cc1F	ZINC000094346786	193363590	/nfs/dbraw/zinc/36/35/90/193363590.db2.gz	CCOMNAVSVWNZJQ-JTQLQIEISA-N	0	3	300.349	2.368	10	0		DEAEHN
CN[C@@H](c1ccc(F)c(Br)c1)[C@@H]1COCCO1	ZINC000094096374	193344855	/nfs/dbraw/zinc/34/48/55/193344855.db2.gz	NPZDHTVEPPURPK-RYUDHWBXSA-N	0	3	304.159	2.264	10	0		DEAEHN
CC[C@@](C)(N)C(=O)NCc1ccc(OCC(F)(F)F)cc1	ZINC000094237052	193353543	/nfs/dbraw/zinc/35/35/43/193353543.db2.gz	WNNVLTZXJNEYFW-CYBMUJFWSA-N	0	3	304.312	2.371	10	0		DEAEHN
CN[C@H](c1ccc(F)cn1)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094643096	193388611	/nfs/dbraw/zinc/38/86/11/193388611.db2.gz	FAJXCVCMRZKXKF-OSMZGAPFSA-N	0	3	300.399	2.085	10	0		DEAEHN
Cc1nn([C@H]2CCC[C@@H](S(C)(=O)=O)C2)cc1CNC(C)C	ZINC000094644434	193389580	/nfs/dbraw/zinc/38/95/80/193389580.db2.gz	FGXDWRAABQBJPV-LSDHHAIUSA-N	0	3	313.467	2.218	10	0		DEAEHN
Cc1nn([C@@H]2CCC[C@@H](S(C)(=O)=O)C2)cc1CNC(C)C	ZINC000094644433	193390121	/nfs/dbraw/zinc/39/01/21/193390121.db2.gz	FGXDWRAABQBJPV-HUUCEWRRSA-N	0	3	313.467	2.218	10	0		DEAEHN
CC(C)CNCc1ncnn1[C@@H]1CCO[C@@]2(CCSC2)C1	ZINC000094412858	193368826	/nfs/dbraw/zinc/36/88/26/193368826.db2.gz	UKNGFLRGWCTHFT-HIFRSBDPSA-N	0	3	310.467	2.251	10	0		DEAEHN
CN1CCC[C@@H](CNc2nc3c(Br)cccn3n2)C1	ZINC000094604860	193383956	/nfs/dbraw/zinc/38/39/56/193383956.db2.gz	YZOBYUXAFQHYQV-JTQLQIEISA-N	0	3	324.226	2.246	10	0		DEAEHN
C[C@@H](N)[C@H](c1cccc(Cl)c1)N1CCN(C)C(=O)C1(C)C	ZINC000094865576	193403537	/nfs/dbraw/zinc/40/35/37/193403537.db2.gz	YUXXWXSTVYAPOE-BXUZGUMPSA-N	0	3	309.841	2.281	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2ccc3c(c2)OC(F)(F)O3)C1	ZINC000264043290	203690427	/nfs/dbraw/zinc/69/04/27/203690427.db2.gz	SPOJTSCKMHQUBE-JTQLQIEISA-N	0	3	313.304	2.176	10	0		DEAEHN
CO[C@@H]1CCN(c2ccc(NC(=O)C3CCN(C)CC3)cc2)C1	ZINC000096381505	193617774	/nfs/dbraw/zinc/61/77/74/193617774.db2.gz	DHYKXRCDHOLMGI-QGZVFWFLSA-N	0	3	317.433	2.192	10	0		DEAEHN
CCS(=O)(=O)CCC[C@H](NC)c1cccc(OC)c1OC	ZINC000097217896	193693846	/nfs/dbraw/zinc/69/38/46/193693846.db2.gz	MWMMJKTXMHGZOH-ZDUSSCGKSA-N	0	3	315.435	2.179	10	0		DEAEHN
c1ccc(CN2CC[C@@H](Sc3nnnn3C3CC3)C2)cc1	ZINC000282881620	217297546	/nfs/dbraw/zinc/29/75/46/217297546.db2.gz	CUNGIUOPFWUYJQ-CQSZACIVSA-N	0	3	301.419	2.375	10	0		DEAEHN
CCN(CC)C(=O)c1ccc(NC(=O)CNC(C)(C)C)cc1	ZINC000016473410	182045955	/nfs/dbraw/zinc/04/59/55/182045955.db2.gz	PWRGIVVPMIRFIW-UHFFFAOYSA-N	0	3	305.422	2.495	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2ccc(F)c(Br)c2)CCO1	ZINC000019257465	182111674	/nfs/dbraw/zinc/11/16/74/182111674.db2.gz	YQWSZJTWXHRNSZ-RNCFNFMXSA-N	0	3	317.202	2.309	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2ccccc2OC(F)F)C[C@@H](C)O1	ZINC000019803235	182151551	/nfs/dbraw/zinc/15/15/51/182151551.db2.gz	YTYCUDHPYYWDSF-WZRBSPASSA-N	0	3	300.349	2.397	10	0		DEAEHN
CCCNC(=O)[C@@H](C)Oc1ccc(Br)cc1CN	ZINC000020483376	182223135	/nfs/dbraw/zinc/22/31/35/182223135.db2.gz	WYYQURSXMAAQFB-SECBINFHSA-N	0	3	315.211	2.201	10	0		DEAEHN
CC[C@@H](CO)NCc1cc(Br)cc(OC)c1OC	ZINC000020933686	182255268	/nfs/dbraw/zinc/25/52/68/182255268.db2.gz	KXFRKJOYVTYGHP-NSHDSACASA-N	0	3	318.211	2.327	10	0		DEAEHN
CN(C)CC(C)(C)NC(=O)NCc1ccccc1-n1cccn1	ZINC000458086089	248140795	/nfs/dbraw/zinc/14/07/95/248140795.db2.gz	WLOPKOSGBWKRGU-UHFFFAOYSA-N	0	3	315.421	2.012	10	0		DEAEHN
COC(=O)c1c(NC(=O)[C@](C)(N)C2CC2)sc2c1CCC2	ZINC000040858904	183142780	/nfs/dbraw/zinc/14/27/80/183142780.db2.gz	ZFZDAGZXDBCSCX-OAHLLOKOSA-N	0	3	308.403	2.089	10	0		DEAEHN
CC(C)[C@H](N)C(=O)NCc1cc(Br)ccc1F	ZINC000041069501	183162336	/nfs/dbraw/zinc/16/23/36/183162336.db2.gz	VIQFOKAMOMTGMW-NSHDSACASA-N	0	3	303.175	2.188	10	0		DEAEHN
COc1ccc2c(c1)nc(C)cc2NCCN1CCOCC1	ZINC000041474090	183193958	/nfs/dbraw/zinc/19/39/58/183193958.db2.gz	IQSJEIJUCPOQLV-UHFFFAOYSA-N	0	3	301.390	2.296	10	0		DEAEHN
CC(C)NC(=O)[C@H](C)Oc1c(Br)cccc1CN	ZINC000042411325	183265184	/nfs/dbraw/zinc/26/51/84/183265184.db2.gz	QCCBUXPWBUZIFG-VIFPVBQESA-N	0	3	315.211	2.200	10	0		DEAEHN
CCCNCc1c(Cl)cccc1N(C)C[C@H](O)COC	ZINC000042511607	183278645	/nfs/dbraw/zinc/27/86/45/183278645.db2.gz	KGCBKCIETUEFJZ-LBPRGKRZSA-N	0	3	300.830	2.283	10	0		DEAEHN
CCN([C@H](C)COC)[C@@H](CN)c1cc2c(c(Cl)c1)OCO2	ZINC000042743070	183304225	/nfs/dbraw/zinc/30/42/25/183304225.db2.gz	VIUMHEQWSDOOLR-MFKMUULPSA-N	0	3	314.813	2.425	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1cccc(Cl)c1)N1CCCC[C@@H]1C(N)=O	ZINC000043015843	183327860	/nfs/dbraw/zinc/32/78/60/183327860.db2.gz	RVYCIOCETNYYOA-RBSFLKMASA-N	0	3	309.841	2.458	10	0		DEAEHN
CCCN(CCO)[C@H](CN)c1cc(Br)cs1	ZINC000043286606	183350696	/nfs/dbraw/zinc/35/06/96/183350696.db2.gz	JKCQUFIBVJBYDE-SNVBAGLBSA-N	0	3	307.257	2.215	10	0		DEAEHN
C[C@@H](N)[C@H](c1cc(Br)cs1)N1CCN(C)CC1	ZINC000043284399	183350850	/nfs/dbraw/zinc/35/08/50/183350850.db2.gz	UVZPUVAQXAQHLZ-BXKDBHETSA-N	0	3	318.284	2.146	10	0		DEAEHN
CN[C@H](c1ccc(OC(F)(F)F)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000043300613	183352069	/nfs/dbraw/zinc/35/20/69/183352069.db2.gz	XKYIMTOWHQBLNW-CMPLNLGQSA-N	0	3	323.336	2.280	10	0		DEAEHN
CN[C@H](c1ccccc1Br)[C@@H]1CCS(=O)(=O)C1	ZINC000043300417	183352728	/nfs/dbraw/zinc/35/27/28/183352728.db2.gz	MMIPAHJMZRJOBK-SKDRFNHKSA-N	0	3	318.236	2.144	10	0		DEAEHN
C[C@@H]1CC(=O)N(C[C@@H](N)c2cccc(C(F)(F)F)c2)C1=O	ZINC000043513044	183369363	/nfs/dbraw/zinc/36/93/63/183369363.db2.gz	AYWWYLZGZHJAAV-LDYMZIIASA-N	0	3	300.280	2.100	10	0		DEAEHN
Cn1nccc1[C@H]1[C@H](NC2CC(c3ccccc3)C2)CC(=O)N1C	ZINC000284480995	218045673	/nfs/dbraw/zinc/04/56/73/218045673.db2.gz	ATSQSEKAWRBPEK-YBSITQRDSA-N	0	3	324.428	2.228	10	0		DEAEHN
Cc1ccc(-n2c(O)c3onc(-c4ccccc4)c3c2O)cc1	ZINC000105592275	194113134	/nfs/dbraw/zinc/11/31/34/194113134.db2.gz	DUSCDCLNXOSETO-ZBFHGGJFSA-N	0	3	306.321	2.288	10	0		DEAEHN
CC[C@@H](c1ccccc1)N1CCN(c2ccc3nncn3n2)CC1	ZINC000105817415	194135572	/nfs/dbraw/zinc/13/55/72/194135572.db2.gz	BAHHISKJDXACKQ-INIZCTEOSA-N	0	3	322.416	2.398	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@@H](C)NCCn2cc(C)cn2)c1	ZINC000105881257	194156014	/nfs/dbraw/zinc/15/60/14/194156014.db2.gz	VQNQYLVNUUVWKS-CYBMUJFWSA-N	0	3	314.389	2.011	10	0		DEAEHN
CC[C@@H]1CN(Cc2cc(-c3ccco3)on2)CCN1C[C@@H](C)O	ZINC000105912974	194169296	/nfs/dbraw/zinc/16/92/96/194169296.db2.gz	BWHHUNPDIYSXRN-UKRRQHHQSA-N	0	3	319.405	2.212	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@@H]1CCc2ccc(F)cc21	ZINC000533812684	284807675	/nfs/dbraw/zinc/80/76/75/284807675.db2.gz	KRXBANQYLSTWDU-MRXNPFEDSA-N	0	3	314.364	2.041	10	0		DEAEHN
C[C@H](C(N)=S)N1CCN(c2ccc3ccccc3n2)CC1	ZINC000109471119	194266556	/nfs/dbraw/zinc/26/65/56/194266556.db2.gz	PRORYEFZHFUCML-GFCCVEGCSA-N	0	3	300.431	2.031	10	0		DEAEHN
C[C@@H](C(N)=S)N1CCN(c2ccnc3ccccc32)CC1	ZINC000109471379	194267116	/nfs/dbraw/zinc/26/71/16/194267116.db2.gz	KEDNIHGRBDHUJR-LBPRGKRZSA-N	0	3	300.431	2.031	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](C)c1ccccc1)N1CCC[C@H](N(C)C)C1	ZINC000109808555	194288696	/nfs/dbraw/zinc/28/86/96/194288696.db2.gz	DPTSQMFSZHHHBW-UXLLHSPISA-N	0	3	303.450	2.278	10	0		DEAEHN
C[C@H]1CN(C)CC[C@@H]1NC(=O)c1nc(Cl)ccc1Cl	ZINC000052195603	183854048	/nfs/dbraw/zinc/85/40/48/183854048.db2.gz	FIRHBEGZDQHQSL-WPRPVWTQSA-N	0	3	302.205	2.458	10	0		DEAEHN
CC[C@@H](N)[C@H](c1cccc(Cl)c1)N1CCNC(=O)C1(C)C	ZINC000110653680	194347575	/nfs/dbraw/zinc/34/75/75/194347575.db2.gz	AYHPTHQIWDEKKI-KGLIPLIRSA-N	0	3	309.841	2.329	10	0		DEAEHN
COc1ccc([C@@H](CN)N2CCCOCC2)c(Cl)c1OC	ZINC000110829615	194362106	/nfs/dbraw/zinc/36/21/06/194362106.db2.gz	UZPQUNBSIUKXKT-GFCCVEGCSA-N	0	3	314.813	2.079	10	0		DEAEHN
CCCN([C@H]1CCCNC1)S(=O)(=O)c1cc(C)ccc1F	ZINC000110942522	194372601	/nfs/dbraw/zinc/37/26/01/194372601.db2.gz	IRKVFCQAUBPGEC-ZDUSSCGKSA-N	0	3	314.426	2.287	10	0		DEAEHN
CCO[C@@H]1C[C@@](N)(C(=O)N(C)[C@@H](C)CCSC)C1(C)C	ZINC000157701319	197208444	/nfs/dbraw/zinc/20/84/44/197208444.db2.gz	XFEDPNUVXCDLLN-YWPYICTPSA-N	0	3	302.484	2.119	10	0		DEAEHN
CN(C)C(=O)c1cccc(CN2CCCN(C3CC3)CC2)c1	ZINC000061040742	184160410	/nfs/dbraw/zinc/16/04/10/184160410.db2.gz	HSHZWWJBPLZDKV-UHFFFAOYSA-N	0	3	301.434	2.059	10	0		DEAEHN
O=S(=O)(CCC1CC[NH2+]CC1)[N-]c1cc(F)c(F)cc1F	ZINC000061094605	184162148	/nfs/dbraw/zinc/16/21/48/184162148.db2.gz	ZRZLPGKQWHXGOJ-UHFFFAOYSA-N	0	3	322.352	2.235	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(N[C@@H](C)CN2CCCC2)n1	ZINC000061539163	184172784	/nfs/dbraw/zinc/17/27/84/184172784.db2.gz	XVFXWHWAJSDKTM-NSHDSACASA-N	0	3	312.849	2.267	10	0		DEAEHN
O=C(/C=C/c1ccc2c(c1)CCO2)N1CCCN(C2CC2)CC1	ZINC000061604940	184177609	/nfs/dbraw/zinc/17/76/09/184177609.db2.gz	HKCCHFYCVDQFIB-XVNBXDOJSA-N	0	3	312.413	2.331	10	0		DEAEHN
CCNCc1cc(Br)cnc1N(C)CCCOC	ZINC000062035886	184202676	/nfs/dbraw/zinc/20/26/76/184202676.db2.gz	PJVNJYXFWBVTBY-UHFFFAOYSA-N	0	3	316.243	2.426	10	0		DEAEHN
CC(C)N1C(=O)CC[C@H](N)[C@H]1c1ccc(Br)o1	ZINC000062211599	184221517	/nfs/dbraw/zinc/22/15/17/184221517.db2.gz	LXJQOPFMWPHTAJ-UFBFGSQYSA-N	0	3	301.184	2.441	10	0		DEAEHN
CS(=O)(=O)c1cccc([C@H](N)c2ccc3c(c2)COC3)c1	ZINC000062332379	184230992	/nfs/dbraw/zinc/23/09/92/184230992.db2.gz	FBXGAVMNZYJGRI-INIZCTEOSA-N	0	3	303.383	2.168	10	0		DEAEHN
Brc1ccc(-c2cc(N3CCNCC3)n[nH]2)cc1	ZINC000062669862	184247383	/nfs/dbraw/zinc/24/73/83/184247383.db2.gz	CVTPQVPMWINKCZ-UHFFFAOYSA-N	0	3	307.195	2.249	10	0		DEAEHN
CN[C@H](C)c1cc(Cl)ccc1OCCCS(C)(=O)=O	ZINC000063014450	184266678	/nfs/dbraw/zinc/26/66/78/184266678.db2.gz	ARWMYWNVZYJPSB-SNVBAGLBSA-N	0	3	305.827	2.434	10	0		DEAEHN
CCc1ncc(CNC[C@@H]2CCC3(CCOCC3)[C@H]2O)s1	ZINC000554936452	291783978	/nfs/dbraw/zinc/78/39/78/291783978.db2.gz	QRODCIMKHDZVMR-WFASDCNBSA-N	0	3	310.463	2.363	10	0		DEAEHN
CCS(=O)(=O)Oc1ccc(OCCN2CCCCC2)cc1	ZINC000064951152	184306671	/nfs/dbraw/zinc/30/66/71/184306671.db2.gz	RPIUINDNEKLSDN-UHFFFAOYSA-N	0	3	313.419	2.280	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)c1cc2c(s1)CN(C1CC1)C2	ZINC000065238844	184317030	/nfs/dbraw/zinc/31/70/30/184317030.db2.gz	IMBABAIXUPGHJC-AWEZNQCLSA-N	0	3	319.474	2.440	10	0		DEAEHN
COc1ccc([C@H]2NCCc3nc[nH]c32)cc1CN1CCCC1	ZINC000065408283	184339584	/nfs/dbraw/zinc/33/95/84/184339584.db2.gz	UXTZQWBOZSHQKE-QGZVFWFLSA-N	0	3	312.417	2.249	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@H]1C(=O)N(C)CC1(N(C)C)CCC1	ZINC000188003053	207369765	/nfs/dbraw/zinc/36/97/65/207369765.db2.gz	VVKIHWQIBZVLET-CZUORRHYSA-N	0	3	302.418	2.494	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)CN[C@H]2CCCC[C@@H]2n2cccn2)C1	ZINC000127868086	296369495	/nfs/dbraw/zinc/36/94/95/296369495.db2.gz	XQFQYOZWZRTGJZ-PMPSAXMXSA-N	0	3	304.438	2.215	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000159110039	197328823	/nfs/dbraw/zinc/32/88/23/197328823.db2.gz	ADAKGVOFVKZMRP-NSHDSACASA-N	0	3	306.284	2.278	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N[C@H]2CC2(C)C)cc(C)c1F	ZINC000159103769	197327643	/nfs/dbraw/zinc/32/76/43/197327643.db2.gz	WPRHTRNOJRTPCU-ZDUSSCGKSA-N	0	3	314.426	2.320	10	0		DEAEHN
COc1cc2c(cc1[C@@H](CN)NCC(F)(F)F)O[C@H](C)C2	ZINC000159065641	197323893	/nfs/dbraw/zinc/32/38/93/197323893.db2.gz	DMRIWGWPBVMTNT-LDYMZIIASA-N	0	3	304.312	2.170	10	0		DEAEHN
COc1cc2c(cc1[C@H](CN)NCC(F)(F)F)O[C@H](C)C2	ZINC000159065931	197323698	/nfs/dbraw/zinc/32/36/98/197323698.db2.gz	DMRIWGWPBVMTNT-KCJUWKMLSA-N	0	3	304.312	2.170	10	0		DEAEHN
O=C1[C@@H](NC2CC2)CCN1c1c(F)c(F)c(F)c(F)c1F	ZINC000159002730	197317978	/nfs/dbraw/zinc/31/79/78/197317978.db2.gz	PZWGNDBVOIHIAE-LURJTMIESA-N	0	3	306.234	2.239	10	0		DEAEHN
CC(C)N[C@@H]1CCN(c2c(F)c(F)c(F)c(F)c2F)C1=O	ZINC000159003016	197317816	/nfs/dbraw/zinc/31/78/16/197317816.db2.gz	KBNCOJXENMBLSK-ZCFIWIBFSA-N	0	3	308.250	2.485	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cccc(-n3cccn3)c2)C1	ZINC000158908252	197310823	/nfs/dbraw/zinc/31/08/23/197310823.db2.gz	ZMWRGCTVBQWAMJ-PBHICJAKSA-N	0	3	312.417	2.331	10	0		DEAEHN
CC1(C)CN([C@@H](CN)c2ccc3c(c2)OCCO3)CCS1	ZINC000158669419	197292507	/nfs/dbraw/zinc/29/25/07/197292507.db2.gz	QRCXUBUIRJWZMK-ZDUSSCGKSA-N	0	3	308.447	2.285	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)c(C)s1	ZINC000158775439	197300417	/nfs/dbraw/zinc/30/04/17/197300417.db2.gz	XKGXRZHMQMPTDT-TXEJJXNPSA-N	0	3	314.476	2.197	10	0		DEAEHN
Cc1c(F)cc(CN)cc1S(=O)(=O)N1C[C@@H]2CCC[C@@H]2C1	ZINC000158767385	197300249	/nfs/dbraw/zinc/30/02/49/197300249.db2.gz	RZQHMLIQEXUZMY-BETUJISGSA-N	0	3	312.410	2.013	10	0		DEAEHN
Cc1c(F)cc(CN)cc1S(=O)(=O)N1C[C@H]2CCC[C@@H]2C1	ZINC000158767540	197299897	/nfs/dbraw/zinc/29/98/97/197299897.db2.gz	RZQHMLIQEXUZMY-CHWSQXEVSA-N	0	3	312.410	2.013	10	0		DEAEHN
CCNCc1csc(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)c1	ZINC000158746326	197298200	/nfs/dbraw/zinc/29/82/00/197298200.db2.gz	RMGKYODMWKLMFG-BETUJISGSA-N	0	3	314.476	2.278	10	0		DEAEHN
COC[C@@H](O)CN1CCC(C(=O)c2ccc(C)cc2C)CC1	ZINC000540822528	285128745	/nfs/dbraw/zinc/12/87/45/285128745.db2.gz	HUDZPAVBGCJWBH-INIZCTEOSA-N	0	3	305.418	2.205	10	0		DEAEHN
C[C@H](NC(=O)NC[C@](C)(O)CN(C)C)c1cccc(Cl)c1	ZINC000120252286	195128411	/nfs/dbraw/zinc/12/84/11/195128411.db2.gz	YUGICVBVFJEFON-NHYWBVRUSA-N	0	3	313.829	2.013	10	0		DEAEHN
CCN[C@H](c1cscn1)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000158593606	197286928	/nfs/dbraw/zinc/28/69/28/197286928.db2.gz	SRCAAKTVDJEEHX-MDZLAQPJSA-N	0	3	302.465	2.397	10	0		DEAEHN
CCCN[C@@H](Cc1ccc(OC)c(F)c1)[C@@H](C)S(C)(=O)=O	ZINC000157283714	197176064	/nfs/dbraw/zinc/17/60/64/197176064.db2.gz	GVYJRDSVVTZKHW-RISCZKNCSA-N	0	3	317.426	2.178	10	0		DEAEHN
CCCNc1nc(N(C)C)nc(N2CCS[C@H](C)[C@@H]2C)n1	ZINC000157111503	197162870	/nfs/dbraw/zinc/16/28/70/197162870.db2.gz	TXONLLDLLZMYDF-WDEREUQCSA-N	0	3	310.471	2.090	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1nc(SC)ns1	ZINC000156812385	197142397	/nfs/dbraw/zinc/14/23/97/197142397.db2.gz	UCCJNDFIPOLOOP-VIFPVBQESA-N	0	3	315.468	2.208	10	0		DEAEHN
CCc1nn(C)c(C[C@@H](N)c2ccnc(C)n2)c1Br	ZINC000156519954	197120103	/nfs/dbraw/zinc/12/01/03/197120103.db2.gz	RDPSRJUWDTYPAF-SECBINFHSA-N	0	3	324.226	2.086	10	0		DEAEHN
CCC[C@H](C(=O)NCc1nc2cccc(C)c2n1C)N(C)C	ZINC000155417587	197053552	/nfs/dbraw/zinc/05/35/52/197053552.db2.gz	BXDGMECMUHXWDI-CQSZACIVSA-N	0	3	302.422	2.228	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(=O)NC[C@@H]2CCCN2Cc2ccccc2)O1	ZINC000154982202	197010360	/nfs/dbraw/zinc/01/03/60/197010360.db2.gz	HGNQPLKVTSARRR-PVAVHDDUSA-N	0	3	302.418	2.335	10	0		DEAEHN
CCc1ccccc1NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000120725258	195224334	/nfs/dbraw/zinc/22/43/34/195224334.db2.gz	HBLLJAVERXQYLL-HIFRSBDPSA-N	0	3	317.433	2.129	10	0		DEAEHN
Cc1ccc(CN2CC[C@@H]3[C@H]2CCC(=O)N3c2cnn(C)c2)cc1	ZINC000248160495	257107377	/nfs/dbraw/zinc/10/73/77/257107377.db2.gz	XJASBCVDUUXGRL-QZTJIDSGSA-N	0	3	324.428	2.498	10	0		DEAEHN
CC[C@@H]1N(Cc2ccc3c(c2)OCO3)CCC[C@@]12CCC(=O)N2	ZINC000248156296	257108027	/nfs/dbraw/zinc/10/80/27/257108027.db2.gz	IRCZAABQTLDAET-FUHWJXTLSA-N	0	3	316.401	2.439	10	0		DEAEHN
Cc1cccc(CN2C[C@@H]3OC[C@@H](CNc4ccccn4)[C@@H]3C2)n1	ZINC000247873092	257114868	/nfs/dbraw/zinc/11/48/68/257114868.db2.gz	MJNPRSZRHIDFND-NJAFHUGGSA-N	0	3	324.428	2.344	10	0		DEAEHN
COc1ncccc1CN1CC[C@@H]2[C@@H]1CCN2Cc1cccnc1	ZINC000247825398	257117317	/nfs/dbraw/zinc/11/73/17/257117317.db2.gz	FOAZDOHDTZOKCR-MSOLQXFVSA-N	0	3	324.428	2.334	10	0		DEAEHN
COCCN1CCO[C@@H]2CCN(Cc3ccc(F)cc3C)C[C@H]21	ZINC000247847249	257117443	/nfs/dbraw/zinc/11/74/43/257117443.db2.gz	SRCWWBGJGSHORH-QZTJIDSGSA-N	0	3	322.424	2.056	10	0		DEAEHN
Cc1cccc(C)c1CN1CCN(c2cncc3ncnn32)CC1	ZINC000275607165	257257551	/nfs/dbraw/zinc/25/75/51/257257551.db2.gz	IOUHUQPCJPOCQT-UHFFFAOYSA-N	0	3	322.416	2.063	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N(C[C@@H]1CCOC1)C1CC1	ZINC000121641379	195321525	/nfs/dbraw/zinc/32/15/25/195321525.db2.gz	GQLUEDDTYQSCSQ-LSDHHAIUSA-N	0	3	311.470	2.173	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C)c1C	ZINC000121813887	195353078	/nfs/dbraw/zinc/35/30/78/195353078.db2.gz	OEQGGPGWUBNWEY-OAHLLOKOSA-N	0	3	319.449	2.334	10	0		DEAEHN
CC[C@@H]1N[C@H](c2ccsc2)N([C@@H](C)CN2CCCC2)C1=O	ZINC000121957861	195380733	/nfs/dbraw/zinc/38/07/33/195380733.db2.gz	VCQLWEQCKZRVJS-QEJZJMRPSA-N	0	3	307.463	2.441	10	0		DEAEHN
CC[C@@H]1N[C@H](c2ccsc2)N(CC2CCN(C)CC2)C1=O	ZINC000122021750	195389965	/nfs/dbraw/zinc/38/99/65/195389965.db2.gz	JECWMPIWDILXGM-GJZGRUSLSA-N	0	3	307.463	2.299	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)NCc1ccc(Cl)cn1	ZINC000245847176	132572205	/nfs/dbraw/zinc/57/22/05/132572205.db2.gz	FTQPJPJIODYUCY-BXUZGUMPSA-N	0	3	310.829	2.217	10	0		DEAEHN
COc1cc2c(cc1CNCCN1CC=C(C)CC1)OCO2	ZINC000358129753	133123089	/nfs/dbraw/zinc/12/30/89/133123089.db2.gz	DTUPVUNGBPGCEY-UHFFFAOYSA-N	0	3	304.390	2.166	10	0		DEAEHN
O=C(NC[C@H](CO)C1CC1)c1ccc(CN2CCCCC2)cc1	ZINC000359823400	133147157	/nfs/dbraw/zinc/14/71/57/133147157.db2.gz	PBNDOTFVGXYXKX-GOSISDBHSA-N	0	3	316.445	2.421	10	0		DEAEHN
COc1ccc2c(c1)[C@@](O)(CNCc1n[nH]cc1C)CCC2	ZINC000368082580	133259458	/nfs/dbraw/zinc/25/94/58/133259458.db2.gz	WZHWKSJRJABZOS-KRWDZBQOSA-N	0	3	301.390	2.040	10	0		DEAEHN
C[C@H](N[C@H]1CCC(=O)N[C@H]1C)c1cncc(Br)c1	ZINC000563446684	292057813	/nfs/dbraw/zinc/05/78/13/292057813.db2.gz	XGCPCGTZNATJPS-AUTRQRHGSA-N	0	3	312.211	2.162	10	0		DEAEHN
CC[C@H](NC[C@@H]1CCC2(CCOCC2)[C@@H]1O)c1ccn(C)n1	ZINC000549625108	285850782	/nfs/dbraw/zinc/85/07/82/285850782.db2.gz	HKEFNZFSDBIYIZ-OFQRWUPVSA-N	0	3	307.438	2.029	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1cccc(-n2cccn2)c1	ZINC000188685384	145015320	/nfs/dbraw/zinc/01/53/20/145015320.db2.gz	FPQYCCJCVZQAHG-UHFFFAOYSA-N	0	3	318.380	2.406	10	0		DEAEHN
Oc1cccc(CN2CCN(C[C@H](O)C3CCCCC3)CC2)c1	ZINC000190882647	145049965	/nfs/dbraw/zinc/04/99/65/145049965.db2.gz	GENCHXAOGWNQFB-IBGZPJMESA-N	0	3	318.461	2.451	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCCN(c2ccccc2)CC1	ZINC000193373742	145084968	/nfs/dbraw/zinc/08/49/68/145084968.db2.gz	BZTMZFGANUZYTG-GOSISDBHSA-N	0	3	306.450	2.376	10	0		DEAEHN
CC(C)C[C@H](C)S(=O)(=O)N1CC[C@@H](CN2CCCC2)C1	ZINC000246235608	145095779	/nfs/dbraw/zinc/09/57/79/145095779.db2.gz	TTXIDHDZRGPQRI-GJZGRUSLSA-N	0	3	302.484	2.169	10	0		DEAEHN
Cc1ccccc1OCCCN1CCN(C[C@H](C)O)[C@@H](C)C1	ZINC000246310309	145097691	/nfs/dbraw/zinc/09/76/91/145097691.db2.gz	AJAKBBGYLCOBEQ-IRXDYDNUSA-N	0	3	306.450	2.151	10	0		DEAEHN
CC(C)N1CCCC[C@@H]1C(=O)N1CC[C@@H](Oc2cccnc2)C1	ZINC000246304611	145097817	/nfs/dbraw/zinc/09/78/17/145097817.db2.gz	YJQGLOJFVLIYOR-IAGOWNOFSA-N	0	3	317.433	2.324	10	0		DEAEHN
Cn1cc([C@@H]2CCN(C[C@@H](O)c3ccc(F)cc3F)C2)cn1	ZINC000247024977	145124065	/nfs/dbraw/zinc/12/40/65/145124065.db2.gz	NDJKUWFJEGMBAQ-BDJLRTHQSA-N	0	3	307.344	2.221	10	0		DEAEHN
COC[C@@H](NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1)C(C)C	ZINC000247049193	145125071	/nfs/dbraw/zinc/12/50/71/145125071.db2.gz	NCXKSLUVZQXAKU-HLLBOEOZSA-N	0	3	321.465	2.456	10	0		DEAEHN
Cc1ccc(F)cc1NC(=O)[C@@H](C)N1CCN2CCC[C@H]2C1	ZINC000247050329	145125392	/nfs/dbraw/zinc/12/53/92/145125392.db2.gz	FGNWZSDOQKKGPE-HIFRSBDPSA-N	0	3	305.397	2.241	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(-n2ccnc2)cc1	ZINC000247174253	145128086	/nfs/dbraw/zinc/12/80/86/145128086.db2.gz	KVBYBKMAWIVXNS-YOEHRIQHSA-N	0	3	310.401	2.181	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2ccc(N3CCCC3)nc2)C1	ZINC000247499324	145138938	/nfs/dbraw/zinc/13/89/38/145138938.db2.gz	XLQGQMGZQVFWCU-GOEBONIOSA-N	0	3	316.449	2.140	10	0		DEAEHN
CCOc1ccccc1CN1CCN(C[C@H](C)O)[C@@H](CC)C1	ZINC000247543414	145141164	/nfs/dbraw/zinc/14/11/64/145141164.db2.gz	DEYLVEJEMGSQSN-RDJZCZTQSA-N	0	3	306.450	2.362	10	0		DEAEHN
CN1CC[C@H](NC(=O)COCC(F)(F)F)[C@H]1c1ccccc1	ZINC000248062592	145147485	/nfs/dbraw/zinc/14/74/85/145147485.db2.gz	PHYXNWUAXOBZEK-GXTWGEPZSA-N	0	3	316.323	2.127	10	0		DEAEHN
C[C@@H](C(=O)N1CCC(C)CC1)N1CC[C@]2(O)CCCC[C@H]2C1	ZINC000248162049	145149052	/nfs/dbraw/zinc/14/90/52/145149052.db2.gz	SHWCIHJTAOYMBF-XYJFISCASA-N	0	3	308.466	2.260	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)N(C)CCN(C)C2CC2)c1	ZINC000248558781	145158548	/nfs/dbraw/zinc/15/85/48/145158548.db2.gz	DOOGIKLTQZKMJB-IRXDYDNUSA-N	0	3	302.418	2.351	10	0		DEAEHN
COc1ccccc1[C@H](C)NC(=O)CN[C@H](C)[C@H]1CCCO1	ZINC000248634278	145162026	/nfs/dbraw/zinc/16/20/26/145162026.db2.gz	XHSYFUJWTXUWHP-GZBFAFLISA-N	0	3	306.406	2.030	10	0		DEAEHN
COC(=O)c1coc(C(=O)N[C@@H](C)CN2C[C@H](C)C[C@H](C)C2)c1	ZINC000248716233	145165017	/nfs/dbraw/zinc/16/50/17/145165017.db2.gz	FZNQTRHVDSHFKI-XQQFMLRXSA-N	0	3	322.405	2.162	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2ccc(OCC3CC3)cc2)C[C@@H]1C	ZINC000248912732	145173936	/nfs/dbraw/zinc/17/39/36/145173936.db2.gz	YPYOGQMKOYNXBH-HOTGVXAUSA-N	0	3	318.461	2.362	10	0		DEAEHN
O=C(Nc1ccccc1)[C@@H]1CCCN([C@H]2CCCCNC2=O)C1	ZINC000249098806	145178773	/nfs/dbraw/zinc/17/87/73/145178773.db2.gz	AUUMVKPVEAHHES-ZBFHGGJFSA-N	0	3	315.417	2.006	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC([C@H]3CCCO3)CC2)C1	ZINC000251542688	145194770	/nfs/dbraw/zinc/19/47/70/145194770.db2.gz	DSSZDLPLVPSTNJ-JKSUJKDBSA-N	0	3	309.454	2.071	10	0		DEAEHN
CO[C@@H]1CN(CCCN2C(=O)c3ccccc3C2=O)CC[C@H]1C	ZINC000251913611	145197728	/nfs/dbraw/zinc/19/77/28/145197728.db2.gz	RXOABZFIGBJNNS-CZUORRHYSA-N	0	3	316.401	2.030	10	0		DEAEHN
Cc1cccc(NC(=O)CN2CCNC[C@@H]2c2cccnc2)c1C	ZINC000261683456	145216348	/nfs/dbraw/zinc/21/63/48/145216348.db2.gz	IMCBEDMRDFTHPJ-GOSISDBHSA-N	0	3	324.428	2.283	10	0		DEAEHN
COc1ccc(CN2CCNC[C@@H]2c2cccnc2)c(OC)c1	ZINC000261732778	145221683	/nfs/dbraw/zinc/22/16/83/145221683.db2.gz	OKMCVRSRHFMMEB-QGZVFWFLSA-N	0	3	313.401	2.245	10	0		DEAEHN
COc1ccccc1[C@H]1CNCCN1Cc1ccn(C(F)F)n1	ZINC000261769453	145224003	/nfs/dbraw/zinc/22/40/03/145224003.db2.gz	RZITWPBQHOWIPI-CQSZACIVSA-N	0	3	322.359	2.433	10	0		DEAEHN
N[C@@H](C(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1)C1CCOCC1	ZINC000261794972	145227255	/nfs/dbraw/zinc/22/72/55/145227255.db2.gz	NUFVTUVMGZLURI-GDBMZVCRSA-N	0	3	322.836	2.410	10	0		DEAEHN
Cc1cccc(CCNC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)c1	ZINC000261839520	145232321	/nfs/dbraw/zinc/23/23/21/145232321.db2.gz	IQVPMAKNELEVIG-GPMSIDNRSA-N	0	3	316.445	2.186	10	0		DEAEHN
Cc1cccc(CCNC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)c1	ZINC000261839511	145232398	/nfs/dbraw/zinc/23/23/98/145232398.db2.gz	IQVPMAKNELEVIG-FRQCXROJSA-N	0	3	316.445	2.186	10	0		DEAEHN
c1cc(N2CCCC2)ncc1N[C@@H]1CCC[C@H]1[C@H]1COCCN1	ZINC000261887947	145237923	/nfs/dbraw/zinc/23/79/23/145237923.db2.gz	GAZIXYUDMGELFW-BRWVUGGUSA-N	0	3	316.449	2.251	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)Nc1ccc2n[nH]cc2c1	ZINC000261953549	145245990	/nfs/dbraw/zinc/24/59/90/145245990.db2.gz	WSOLYNDXLLKOIC-SUYBPPKGSA-N	0	3	314.389	2.034	10	0		DEAEHN
CC(=O)Nc1cccc(N[C@@H]2CCC[C@H]2[C@@H]2COCCN2)c1	ZINC000261952219	145246034	/nfs/dbraw/zinc/24/60/34/145246034.db2.gz	OLOHDWZWYPDLIA-ZACQAIPSSA-N	0	3	303.406	2.214	10	0		DEAEHN
CN(C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C)c1ccc(F)cc1	ZINC000262468415	145285846	/nfs/dbraw/zinc/28/58/46/145285846.db2.gz	JBDZXNWZGVPNCI-JJRVBVJISA-N	0	3	306.381	2.321	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)C[C@@H](C)C1	ZINC000262505533	145289082	/nfs/dbraw/zinc/28/90/82/145289082.db2.gz	MJPZHEXSLXUCCA-VWVXXCMISA-N	0	3	308.466	2.460	10	0		DEAEHN
CNC(=O)c1cc(NC(=O)[C@H]2NCCCC2(C)C)ccc1Cl	ZINC000262554348	145292833	/nfs/dbraw/zinc/29/28/33/145292833.db2.gz	TUUMNQCMUROVKB-CYBMUJFWSA-N	0	3	323.824	2.416	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(C2(c3cccc(Cl)c3)CC2)n1	ZINC000263110277	145326063	/nfs/dbraw/zinc/32/60/63/145326063.db2.gz	AFEXXSYOLFQQCK-CYBMUJFWSA-N	0	3	318.808	2.379	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(Cc2cccc3ccccc32)n1	ZINC000263182097	145333652	/nfs/dbraw/zinc/33/36/52/145333652.db2.gz	GWVUARBGIWFZKZ-MRXNPFEDSA-N	0	3	308.385	2.390	10	0		DEAEHN
Cc1cc(Cl)ccc1OCc1nc([C@H]2CNCCN2C)no1	ZINC000263228967	145338525	/nfs/dbraw/zinc/33/85/25/145338525.db2.gz	NDBLOUJATSJYMZ-GFCCVEGCSA-N	0	3	322.796	2.187	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC[C@@H](c3cc(C)n[nH]3)C2)C1	ZINC000332743470	145386807	/nfs/dbraw/zinc/38/68/07/145386807.db2.gz	PDQBNERLFQUIMV-HUUCEWRRSA-N	0	3	319.453	2.091	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC[C@@H](c3cc(C)[nH]n3)C2)C1	ZINC000332743470	145386809	/nfs/dbraw/zinc/38/68/09/145386809.db2.gz	PDQBNERLFQUIMV-HUUCEWRRSA-N	0	3	319.453	2.091	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)C1	ZINC000358603420	147164515	/nfs/dbraw/zinc/16/45/15/147164515.db2.gz	KAHVULVVURLCFE-HUUCEWRRSA-N	0	3	311.470	2.175	10	0		DEAEHN
CCN(CCNC(=O)N1CCOc2cccc(F)c2C1)C1CC1	ZINC000370287408	148002456	/nfs/dbraw/zinc/00/24/56/148002456.db2.gz	FZOZDUFXUJZOJL-UHFFFAOYSA-N	0	3	321.396	2.214	10	0		DEAEHN
O=C(CCN1CC[C@@H](c2nc(C3CC3)no2)C1)NC1CCCC1	ZINC000375446573	148373349	/nfs/dbraw/zinc/37/33/49/148373349.db2.gz	XOQKAMYPUGAQBX-CYBMUJFWSA-N	0	3	318.421	2.185	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)N2CCO[C@H](c3ccsc3)C2)C1	ZINC000127116601	401721102	/nfs/dbraw/zinc/72/11/02/401721102.db2.gz	SDHLQWQQPZKRIB-HIFRSBDPSA-N	0	3	323.462	2.173	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NCCC1=CCCCC1	ZINC000111785522	401723222	/nfs/dbraw/zinc/72/32/22/401723222.db2.gz	HTTUYWGXWMOGKR-MRXNPFEDSA-N	0	3	309.454	2.287	10	0		DEAEHN
Cc1ccc([C@H](C)NC(=O)NCC2CCN(CCO)CC2)cc1	ZINC000111833648	401725140	/nfs/dbraw/zinc/72/51/40/401725140.db2.gz	IUQFQRSTAMKYOK-HNNXBMFYSA-N	0	3	319.449	2.060	10	0		DEAEHN
O=C(c1cnn2c1CCCC2)N1CCC[C@@H]1CN1CCCCC1	ZINC000127256883	401726182	/nfs/dbraw/zinc/72/61/82/401726182.db2.gz	KIYUJIIRMUXPNB-OAHLLOKOSA-N	0	3	316.449	2.310	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CC[C@@H](CC(C)C)C1	ZINC000074167509	401731905	/nfs/dbraw/zinc/73/19/05/401731905.db2.gz	FCJFADNQCOKPOX-HOTGVXAUSA-N	0	3	311.470	2.175	10	0		DEAEHN
COc1cc([C@H](C)NCCC[S@@](C)=O)cc(OC)c1OC	ZINC000126829130	401709754	/nfs/dbraw/zinc/70/97/54/401709754.db2.gz	HHFBFRMVMXDABK-MQJDWESPSA-N	0	3	315.435	2.132	10	0		DEAEHN
C[C@H](CNC(=O)c1cnn2c1CCCC2)N1CCC(C)CC1	ZINC000127053034	401718626	/nfs/dbraw/zinc/71/86/26/401718626.db2.gz	AZZSGYCXCAWNQW-CQSZACIVSA-N	0	3	304.438	2.070	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)[C@@H](Cc1ccccc1)N(C)C	ZINC000111635976	401719184	/nfs/dbraw/zinc/71/91/84/401719184.db2.gz	XMYSAZBASYVXIJ-ZWKOTPCHSA-N	0	3	317.477	2.150	10	0		DEAEHN
O=C(CN[C@H]1CCCC[C@H]1n1cccn1)Nc1nccs1	ZINC000128040665	401760149	/nfs/dbraw/zinc/76/01/49/401760149.db2.gz	IEUVRKQSUAYHAK-NWDGAFQWSA-N	0	3	305.407	2.052	10	0		DEAEHN
COc1ccc(C)nc1NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000128063560	401761386	/nfs/dbraw/zinc/76/13/86/401761386.db2.gz	GZNZCHMZZRSZFT-OLZOCXBDSA-N	0	3	306.410	2.345	10	0		DEAEHN
CCCNC(=O)C1CCN(C[C@](C)(O)c2ccccc2)CC1	ZINC000075826745	401769994	/nfs/dbraw/zinc/76/99/94/401769994.db2.gz	XXEFPNXRSVRPEG-SFHVURJKSA-N	0	3	304.434	2.132	10	0		DEAEHN
CCC(=O)Nc1cccc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000113224345	401770563	/nfs/dbraw/zinc/77/05/63/401770563.db2.gz	JIZWZPMIFIBIIH-BBRMVZONSA-N	0	3	315.417	2.344	10	0		DEAEHN
Cc1nn(C)c2sc(C(=O)N3C[C@H]4CCCN4C[C@@H]3C)cc12	ZINC000113224855	401770904	/nfs/dbraw/zinc/77/09/04/401770904.db2.gz	PHNJGBGYHJETCL-CMPLNLGQSA-N	0	3	318.446	2.252	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)CSCc1cccnc1	ZINC000113227043	401771290	/nfs/dbraw/zinc/77/12/90/401771290.db2.gz	HJIZBYVEFKWPQJ-DZGCQCFKSA-N	0	3	305.447	2.010	10	0		DEAEHN
COc1ccc(OC)c(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000113233820	401772277	/nfs/dbraw/zinc/77/22/77/401772277.db2.gz	MNLQKGUHHIFNOB-QWHCGFSZSA-N	0	3	304.390	2.013	10	0		DEAEHN
CN(Cc1ccccc1)C(=O)CN1CC[C@@]2(O)CCCC[C@@H]2C1	ZINC000128413822	401775809	/nfs/dbraw/zinc/77/58/09/401775809.db2.gz	UVXOYTYXLDMHJK-MJGOQNOKSA-N	0	3	316.445	2.272	10	0		DEAEHN
C[C@H]1C[C@@H]1NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000075977733	401775949	/nfs/dbraw/zinc/77/59/49/401775949.db2.gz	JCZGTTGCONOIKO-YOEHRIQHSA-N	0	3	301.434	2.401	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)/C=C/c1ccccc1	ZINC000113306079	401776293	/nfs/dbraw/zinc/77/62/93/401776293.db2.gz	OSVVPTLARKRONN-AVWWHXKWSA-N	0	3	306.431	2.156	10	0		DEAEHN
Cn1cc([C@H]2CCN(Cc3ccc(N4CCCC4)nc3)C2)cn1	ZINC000128428184	401776676	/nfs/dbraw/zinc/77/66/76/401776676.db2.gz	KPTWWHGLRXXBTM-INIZCTEOSA-N	0	3	311.433	2.405	10	0		DEAEHN
Cc1ccn2ncc(C(=O)N[C@@H](CN(C)C)c3ccccc3)c2n1	ZINC000114227404	401794781	/nfs/dbraw/zinc/79/47/81/401794781.db2.gz	FIPTZUAKZWMTTQ-INIZCTEOSA-N	0	3	323.400	2.070	10	0		DEAEHN
COc1ccc(OCCN2CC[C@H](c3cnn(C)c3)C2)cc1	ZINC000116324201	401850253	/nfs/dbraw/zinc/85/02/53/401850253.db2.gz	AQRQOBVHCPQXJF-AWEZNQCLSA-N	0	3	301.390	2.297	10	0		DEAEHN
CCOC(=O)CCCCN1CCC[C@@H](c2nncn2CC)C1	ZINC000132715637	401872231	/nfs/dbraw/zinc/87/22/31/401872231.db2.gz	QRISGYDFLDWNNQ-CQSZACIVSA-N	0	3	308.426	2.211	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1cccc(C[S@](C)=O)c1	ZINC000078614819	401858366	/nfs/dbraw/zinc/85/83/66/401858366.db2.gz	IQWLWFQBHDTECD-OPAMFIHVSA-N	0	3	324.490	2.271	10	0		DEAEHN
Cc1ccccc1[C@H](C)CC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000116785127	401858524	/nfs/dbraw/zinc/85/85/24/401858524.db2.gz	KTKCLUZYBVIHNY-HZPDHXFCSA-N	0	3	304.434	2.278	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2cc(Cl)sc2Cl)CCO1	ZINC000116796148	401859082	/nfs/dbraw/zinc/85/90/82/401859082.db2.gz	SOQZYKQTZVHWFU-MRVPVSSYSA-N	0	3	323.245	2.458	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2cc3ccc(Cl)cc3[nH]2)CCO1	ZINC000116791513	401859216	/nfs/dbraw/zinc/85/92/16/401859216.db2.gz	HBQXNALZORKIHA-CYBMUJFWSA-N	0	3	321.808	2.224	10	0		DEAEHN
CCc1cc(C)c(C(=O)NC[C@@H](C)CN2CCN(CC)CC2)o1	ZINC000132122324	401862446	/nfs/dbraw/zinc/86/24/46/401862446.db2.gz	LUJCVMFBGGEXJA-CQSZACIVSA-N	0	3	321.465	2.154	10	0		DEAEHN
Cc1cc(C)n2c(CN(C[C@H]3CCOC3)C3CC3)cnc2n1	ZINC000129978781	401813726	/nfs/dbraw/zinc/81/37/26/401813726.db2.gz	VRHORQDWRCZTQN-CQSZACIVSA-N	0	3	300.406	2.347	10	0		DEAEHN
Cc1ccc(OCCN(C)C(=O)NC2CCN(C)CC2)cc1	ZINC000043180341	401937411	/nfs/dbraw/zinc/93/74/11/401937411.db2.gz	VPZYINIAEOOZBF-UHFFFAOYSA-N	0	3	305.422	2.109	10	0		DEAEHN
CCc1ncc(NC(=O)N[C@H](CN(C)C)c2ccccc2)cn1	ZINC000119168810	401930634	/nfs/dbraw/zinc/93/06/34/401930634.db2.gz	QFDWUVMBNIUKTG-OAHLLOKOSA-N	0	3	313.405	2.463	10	0		DEAEHN
CCOC(=O)CCCCN1CCC(Nc2cccnn2)CC1	ZINC000132948216	401877035	/nfs/dbraw/zinc/87/70/35/401877035.db2.gz	GIDLZKMCXOBJFK-UHFFFAOYSA-N	0	3	306.410	2.086	10	0		DEAEHN
O=C(C[C@H]1CSCCN1)NCc1ccccc1OC1CCC1	ZINC000133015151	401878243	/nfs/dbraw/zinc/87/82/43/401878243.db2.gz	VMJCHQJWGYFLTN-AWEZNQCLSA-N	0	3	320.458	2.329	10	0		DEAEHN
C[C@H](CCC(=O)N1CCO[C@H](CN(C)C)C1)c1ccccc1	ZINC000133316826	401882116	/nfs/dbraw/zinc/88/21/16/401882116.db2.gz	JHKYUFGXXWPIJT-NVXWUHKLSA-N	0	3	304.434	2.359	10	0		DEAEHN
COC[C@](C)(CCO)NCc1cc(=O)oc2c(C)c(C)ccc12	ZINC000079921406	401883665	/nfs/dbraw/zinc/88/36/65/401883665.db2.gz	BNEUHXWNYFHVHM-SFHVURJKSA-N	0	3	319.401	2.287	10	0		DEAEHN
C[C@H](Cc1ccc(O)cc1)NCC(=O)c1cc(O)cc(O)c1	ZINC000033505757	401891227	/nfs/dbraw/zinc/89/12/27/401891227.db2.gz	IFNGKZSCMSNIPZ-LLVKDONJSA-N	0	3	301.342	2.207	10	0		DEAEHN
CC(C)Oc1ccc(NC(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000118804913	401909042	/nfs/dbraw/zinc/90/90/42/401909042.db2.gz	ZDRNCVFCJAYBIM-INIZCTEOSA-N	0	3	321.421	2.268	10	0		DEAEHN
O=C(c1cccc(Br)c1)N1CCN2CCC[C@@H]2C1	ZINC000037503244	401914560	/nfs/dbraw/zinc/91/45/60/401914560.db2.gz	PEUOYHUIIAYRNL-CYBMUJFWSA-N	0	3	309.207	2.369	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N(C)[C@H]1CCN(C)C[C@H]1C	ZINC000085407871	401915940	/nfs/dbraw/zinc/91/59/40/401915940.db2.gz	GIFGDSNGSOYUPV-CABCVRRESA-N	0	3	321.469	2.021	10	0		DEAEHN
COCCOc1cccc(CN2CCC[C@H](n3cncn3)C2)c1	ZINC000119487013	401953581	/nfs/dbraw/zinc/95/35/81/401953581.db2.gz	NAPPZOMHZQSDBC-INIZCTEOSA-N	0	3	316.405	2.140	10	0		DEAEHN
CCOc1cccc(CCNC(=O)NC[C@@H]2CCCN2C)c1	ZINC000136520408	401968854	/nfs/dbraw/zinc/96/88/54/401968854.db2.gz	FEWFUWUAJDJYQT-HNNXBMFYSA-N	0	3	305.422	2.021	10	0		DEAEHN
CCn1cc(C2CCN(C(=O)CN3CCC(C)CC3)CC2)cn1	ZINC000119943508	401971831	/nfs/dbraw/zinc/97/18/31/401971831.db2.gz	HMPYQDFWKNPRCW-UHFFFAOYSA-N	0	3	318.465	2.341	10	0		DEAEHN
CCC(CC)CNC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000091856299	401998686	/nfs/dbraw/zinc/99/86/86/401998686.db2.gz	RZMWVKKKCMUUST-QGZVFWFLSA-N	0	3	324.513	2.234	10	0		DEAEHN
COc1cccc(C(C)(C)CNC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000120203083	401982642	/nfs/dbraw/zinc/98/26/42/401982642.db2.gz	IUFKIDZUBOUQEJ-HNNXBMFYSA-N	0	3	319.449	2.318	10	0		DEAEHN
NC(=O)c1ccc([C@@H]2COCCN(Cc3ccccc3)C2)cc1	ZINC000141251292	401989995	/nfs/dbraw/zinc/98/99/95/401989995.db2.gz	XOKQKFUAUVSXMA-SFHVURJKSA-N	0	3	310.397	2.402	10	0		DEAEHN
COCCN1CCC[C@@H]1CN[C@@H](C)c1nc2ccccc2n1C	ZINC000091318958	401996279	/nfs/dbraw/zinc/99/62/79/401996279.db2.gz	MVIZEKFTCVPOCF-LSDHHAIUSA-N	0	3	316.449	2.335	10	0		DEAEHN
CC(C)(C)[C@H](N)C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1	ZINC000119347698	401943653	/nfs/dbraw/zinc/94/36/53/401943653.db2.gz	WNTDMOQMSKLYDL-QMTHXVAHSA-N	0	3	311.376	2.033	10	0		DEAEHN
CN1CCN(C(=O)CC2CCN(Cc3ccsc3)CC2)CC1	ZINC000093143057	402012363	/nfs/dbraw/zinc/01/23/63/402012363.db2.gz	YWMHZUFYPLBHEL-UHFFFAOYSA-N	0	3	321.490	2.124	10	0		DEAEHN
Cn1c(Cl)c(Cl)cc1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000049516001	402018447	/nfs/dbraw/zinc/01/84/47/402018447.db2.gz	AHBVYWCCXLDFER-SECBINFHSA-N	0	3	302.205	2.252	10	0		DEAEHN
CC(C)Oc1cncc(C(=O)NCCN2CCCC[C@H]2C)c1	ZINC000151295469	402027883	/nfs/dbraw/zinc/02/78/83/402027883.db2.gz	JLDPUELMOVDCES-CQSZACIVSA-N	0	3	305.422	2.473	10	0		DEAEHN
COC(=O)c1ccc(CN2CC[C@H](c3cnn(C)c3)C2)cc1F	ZINC000151539633	402042244	/nfs/dbraw/zinc/04/22/44/402042244.db2.gz	MYRCJMZMGJOAFE-ZDUSSCGKSA-N	0	3	317.364	2.335	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)CCOc2ccc(C)cc2)C1	ZINC000052593546	402044174	/nfs/dbraw/zinc/04/41/74/402044174.db2.gz	ZOBNMWXTFSITJA-INIZCTEOSA-N	0	3	319.449	2.500	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(CCOC)Cc2ccccc2)C1	ZINC000052592799	402044453	/nfs/dbraw/zinc/04/44/53/402044453.db2.gz	LKSDXDCQAFODEZ-KRWDZBQOSA-N	0	3	319.449	2.329	10	0		DEAEHN
CCCn1cc(CN2CCCN(Cc3c[nH]nc3C)CC2)cn1	ZINC000121687459	402048914	/nfs/dbraw/zinc/04/89/14/402048914.db2.gz	HSCMEFFQEGWXFX-UHFFFAOYSA-N	0	3	316.453	2.033	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)C(=O)c2ccc(Cl)cc2)C1	ZINC000150851304	402000092	/nfs/dbraw/zinc/00/00/92/402000092.db2.gz	KIRZFUGQQBFIPC-RISCZKNCSA-N	0	3	308.809	2.368	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2cnn(-c3ccccc3F)c2)C1	ZINC000152128989	402077044	/nfs/dbraw/zinc/07/70/44/402077044.db2.gz	YCCBSXILVQMBRT-ZDUSSCGKSA-N	0	3	317.368	2.179	10	0		DEAEHN
COc1ccc(O[C@H](C)C(=O)NC[C@@H](N)c2ccccc2)cc1	ZINC000152167299	402079237	/nfs/dbraw/zinc/07/92/37/402079237.db2.gz	IFHXQBCHQPTNAB-CXAGYDPISA-N	0	3	314.385	2.279	10	0		DEAEHN
COc1ccc(C(=O)CCC(=O)N2CCC(N(C)C)CC2)cc1	ZINC000061621055	402107993	/nfs/dbraw/zinc/10/79/93/402107993.db2.gz	GESCDJIGXZZLFU-UHFFFAOYSA-N	0	3	318.417	2.211	10	0		DEAEHN
CC(=O)c1cccc(OCC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000123131455	402112234	/nfs/dbraw/zinc/11/22/34/402112234.db2.gz	ZUGDTIGDQPWBFP-CZUORRHYSA-N	0	3	318.417	2.209	10	0		DEAEHN
COc1ccccc1OCCC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000123144118	402112521	/nfs/dbraw/zinc/11/25/21/402112521.db2.gz	FPGWNHCAFYSTPK-CABCVRRESA-N	0	3	320.433	2.405	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2cccc(N(C)C)n2)CCN1C	ZINC000152961134	402119423	/nfs/dbraw/zinc/11/94/23/402119423.db2.gz	WXEWYOMYPVDOFZ-CHWSQXEVSA-N	0	3	305.426	2.094	10	0		DEAEHN
C[C@@H](CO)[C@H](C)NC(=O)c1oc2ccccc2c1CN(C)C	ZINC000151903043	402064865	/nfs/dbraw/zinc/06/48/65/402064865.db2.gz	OYESNKMWNJKCAV-RYUDHWBXSA-N	0	3	304.390	2.241	10	0		DEAEHN
Cc1ccc(NC(=O)NCCN2CCCC[C@H]2C)cc1C(N)=O	ZINC000067311106	402156209	/nfs/dbraw/zinc/15/62/09/402156209.db2.gz	ZMZTYBSIENYJQT-CYBMUJFWSA-N	0	3	318.421	2.090	10	0		DEAEHN
COC(=O)c1ccc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000123922724	402154251	/nfs/dbraw/zinc/15/42/51/402154251.db2.gz	IWAXWXATJQYUBL-WFASDCNBSA-N	0	3	304.390	2.028	10	0		DEAEHN
COC(=O)c1ccc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000123922238	402154270	/nfs/dbraw/zinc/15/42/70/402154270.db2.gz	IWAXWXATJQYUBL-SWLSCSKDSA-N	0	3	304.390	2.028	10	0		DEAEHN
CCOC[C@H]1CCCN(C(=O)N[C@H](CC(C)C)CN(C)C)C1	ZINC000073203348	286178847	/nfs/dbraw/zinc/17/88/47/286178847.db2.gz	ALICMFHHAIKYAD-JKSUJKDBSA-N	0	3	313.486	2.421	10	0		DEAEHN
Cc1ccc(NC(=O)CCc2ccnn2C)c(CN(C)C)c1	ZINC000124522440	402183706	/nfs/dbraw/zinc/18/37/06/402183706.db2.gz	XDIKDJFXBJNOLK-UHFFFAOYSA-N	0	3	300.406	2.361	10	0		DEAEHN
COC[C@@H](C)C(=O)Nc1ccc(N(C)C2CCN(C)CC2)cc1	ZINC000103383379	402186250	/nfs/dbraw/zinc/18/62/50/402186250.db2.gz	LSJMITDTNCMEOX-CQSZACIVSA-N	0	3	319.449	2.438	10	0		DEAEHN
CCc1nn(C)c(Cl)c1C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000154015789	402186984	/nfs/dbraw/zinc/18/69/84/402186984.db2.gz	QLWQSCXSEYHOMN-GHMZBOCLSA-N	0	3	312.845	2.191	10	0		DEAEHN
CCN1CCN(Cc2ccc(NC(=O)[C@@H](C)COC)cc2)CC1	ZINC000103430401	402187391	/nfs/dbraw/zinc/18/73/91/402187391.db2.gz	PPKJDHUTJNSAPM-HNNXBMFYSA-N	0	3	319.449	2.045	10	0		DEAEHN
O=C(c1cccc(CN2CCCC2)c1)N1CCN(C2CC2)CC1	ZINC000124686163	402191853	/nfs/dbraw/zinc/19/18/53/402191853.db2.gz	LTYJLINSZWOSKF-UHFFFAOYSA-N	0	3	313.445	2.203	10	0		DEAEHN
CCOC(=O)CCCN1CCC(C(=O)N[C@@H](C)C(C)C)CC1	ZINC000102400187	402167213	/nfs/dbraw/zinc/16/72/13/402167213.db2.gz	ORUKYPSOERSBPQ-AWEZNQCLSA-N	0	3	312.454	2.202	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Cc1c(OC)cccc1OC	ZINC000125548663	402238146	/nfs/dbraw/zinc/23/81/46/402238146.db2.gz	JYMMWTGQKSKATK-CQSZACIVSA-N	0	3	320.433	2.189	10	0		DEAEHN
COc1ccccc1C[C@@H]1CCCN1CCN1CCCC1=O	ZINC000069683221	402238502	/nfs/dbraw/zinc/23/85/02/402238502.db2.gz	NVXRDVXQZIRFGQ-INIZCTEOSA-N	0	3	302.418	2.325	10	0		DEAEHN
CCc1nc(CNC(=O)N[C@@H](CC(C)C)CN(C)C)cs1	ZINC000107835488	402241434	/nfs/dbraw/zinc/24/14/34/402241434.db2.gz	OQJFBWZHFBRLLL-LBPRGKRZSA-N	0	3	312.483	2.481	10	0		DEAEHN
C[C@H](c1nnc(-c2ccccc2)o1)N1CCO[C@H](CN(C)C)C1	ZINC000105926818	402211262	/nfs/dbraw/zinc/21/12/62/402211262.db2.gz	BXTDLSHCCGDIOU-UKRRQHHQSA-N	0	3	316.405	2.060	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cc(F)ccc2Br)C1	ZINC000071139976	402270080	/nfs/dbraw/zinc/27/00/80/402270080.db2.gz	NEMVDPFAZLBBHK-JTQLQIEISA-N	0	3	315.186	2.364	10	0		DEAEHN
CCc1ccc(NC(=O)NC[C@H]2CCCN2CCOC)cc1	ZINC000110085410	402281316	/nfs/dbraw/zinc/28/13/16/402281316.db2.gz	LWKCFXKMLGBARX-MRXNPFEDSA-N	0	3	305.422	2.481	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Cc2c(Cl)cccc2OC)C1	ZINC000184764158	402298274	/nfs/dbraw/zinc/29/82/74/402298274.db2.gz	ZFGJKCXFLKQSIG-LBPRGKRZSA-N	0	3	310.825	2.492	10	0		DEAEHN
CC(C)OCCN1CCC(NC(=O)NC[C@H](C)C(C)C)CC1	ZINC000176392175	402305513	/nfs/dbraw/zinc/30/55/13/402305513.db2.gz	PVWWJUQSYXVELG-HNNXBMFYSA-N	0	3	313.486	2.467	10	0		DEAEHN
CCOC(=O)CN(CCN(C)Cc1ccc(F)cc1)C1CC1	ZINC000159169420	402318249	/nfs/dbraw/zinc/31/82/49/402318249.db2.gz	YTFOQGNXJNIUBP-UHFFFAOYSA-N	0	3	308.397	2.285	10	0		DEAEHN
CCN(CCc1nccs1)Cc1cc(=O)n2ccccc2n1	ZINC000159191607	402318995	/nfs/dbraw/zinc/31/89/95/402318995.db2.gz	HDHPVASFASSABF-UHFFFAOYSA-N	0	3	314.414	2.216	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)N2CCOC3(CCCCC3)C2)[C@@H](C)C1	ZINC000176838681	402342118	/nfs/dbraw/zinc/34/21/18/402342118.db2.gz	UVUHOSAREOMBQS-HOTGVXAUSA-N	0	3	323.481	2.460	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1ccccc1Cl	ZINC000176903026	402347966	/nfs/dbraw/zinc/34/79/66/402347966.db2.gz	MTQLXCFJIRBEEE-LBPRGKRZSA-N	0	3	323.824	2.221	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1cccc(Cl)c1	ZINC000176900609	402347980	/nfs/dbraw/zinc/34/79/80/402347980.db2.gz	QTYSCWBLEDMJRX-AWEZNQCLSA-N	0	3	323.824	2.221	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(F)c(Br)c2)C1	ZINC000231291765	402354060	/nfs/dbraw/zinc/35/40/60/402354060.db2.gz	UBGFGLLIUIRMOT-JTQLQIEISA-N	0	3	315.186	2.364	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(C(C)(C)C)nn1C	ZINC000176976893	402355918	/nfs/dbraw/zinc/35/59/18/402355918.db2.gz	LGMVGNVAVKBDPE-CYBMUJFWSA-N	0	3	306.454	2.274	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccccc1OCCOC	ZINC000177016277	402359899	/nfs/dbraw/zinc/35/98/99/402359899.db2.gz	JNNSMMKBLVJXJJ-HNNXBMFYSA-N	0	3	320.433	2.268	10	0		DEAEHN
O=C1[C@@H](N2CCN3CCC[C@@H]3C2)CCN1c1cccc(Cl)c1	ZINC000177143785	402374983	/nfs/dbraw/zinc/37/49/83/402374983.db2.gz	CPWXJBAJDZLONJ-CVEARBPZSA-N	0	3	319.836	2.225	10	0		DEAEHN
C[C@@]1(CNC(=O)N[C@H]2CCOC2)CCCN1Cc1ccccc1	ZINC000344996475	404491345	/nfs/dbraw/zinc/49/13/45/404491345.db2.gz	CIEZBZLJQBEWNR-WMZOPIPTSA-N	0	3	317.433	2.129	10	0		DEAEHN
CC[C@H]1CN(Cc2csc(C3CC3)n2)CCN1C[C@@H](C)O	ZINC000161671482	402395276	/nfs/dbraw/zinc/39/52/76/402395276.db2.gz	FMRYXCGASYQHNT-DOMZBBRYSA-N	0	3	309.479	2.298	10	0		DEAEHN
O[C@@H](COC1CCOCC1)CN1Cc2ccccc2C2(CC2)C1	ZINC000186152908	402405967	/nfs/dbraw/zinc/40/59/67/402405967.db2.gz	FJEYARDVRGABEF-MRXNPFEDSA-N	0	3	317.429	2.090	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)N1C[C@H](C)C[C@H](C)C1	ZINC000177707232	402429033	/nfs/dbraw/zinc/42/90/33/402429033.db2.gz	UILNYGISCDVHAH-VVLHAWIVSA-N	0	3	309.498	2.296	10	0		DEAEHN
CCOC(=O)[C@@H](c1ccccc1)N1CCN2CCCC[C@@H]2C1	ZINC000177756043	402432688	/nfs/dbraw/zinc/43/26/88/402432688.db2.gz	QHRZDQKNJVLVBK-IAGOWNOFSA-N	0	3	302.418	2.461	10	0		DEAEHN
c1ccc(-c2noc(CCN3CCN4CCCC[C@@H]4C3)n2)cc1	ZINC000177769249	402434774	/nfs/dbraw/zinc/43/47/74/402434774.db2.gz	LPEGRMYXURNBCI-MRXNPFEDSA-N	0	3	312.417	2.449	10	0		DEAEHN
COC(=O)[C@H](c1ccccc1C)N1CCN2CCCC[C@@H]2C1	ZINC000163165636	402443221	/nfs/dbraw/zinc/44/32/21/402443221.db2.gz	DXUIIMQOBCAUQK-WBVHZDCISA-N	0	3	302.418	2.379	10	0		DEAEHN
Cc1ccc([C@H](CNC(=O)NCC2(CCO)CC2)N(C)C)cc1	ZINC000186618060	402448049	/nfs/dbraw/zinc/44/80/49/402448049.db2.gz	RUDJVXQJZYHPQQ-INIZCTEOSA-N	0	3	319.449	2.060	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)C[C@H](C)NC(=O)C2CCCCC2)C1	ZINC000245401515	402456392	/nfs/dbraw/zinc/45/63/92/402456392.db2.gz	DVOXMFMKDZMUAE-GOEBONIOSA-N	0	3	323.481	2.062	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)C[C@H](C)NC(=O)C2CCCCC2)C1	ZINC000245401516	402456458	/nfs/dbraw/zinc/45/64/58/402456458.db2.gz	DVOXMFMKDZMUAE-HOCLYGCPSA-N	0	3	323.481	2.062	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)NCc1ccc(F)cc1	ZINC000245465957	402463435	/nfs/dbraw/zinc/46/34/35/402463435.db2.gz	IZKXGJIXFOCQEA-RHSMWYFYSA-N	0	3	321.440	2.247	10	0		DEAEHN
Cc1ccc(N2CC[C@@H](N(C)C[C@H]3CCCOC3)C2=O)cc1	ZINC000245499091	402465829	/nfs/dbraw/zinc/46/58/29/402465829.db2.gz	XLJUOKUFFWUIRW-NVXWUHKLSA-N	0	3	302.418	2.459	10	0		DEAEHN
COc1ccc2[nH]cc(C3CCN([C@@H]4CCNC4=O)CC3)c2c1	ZINC000178193095	402469596	/nfs/dbraw/zinc/46/95/96/402469596.db2.gz	NIROCYDLGIWUDX-QGZVFWFLSA-N	0	3	313.401	2.244	10	0		DEAEHN
CO[C@@H]1CC[C@@H]2OCCN(CCCCn3ccnc3C)[C@@H]2C1	ZINC000245570522	402471485	/nfs/dbraw/zinc/47/14/85/402471485.db2.gz	GMFCJUCUVAVCGH-ZACQAIPSSA-N	0	3	307.438	2.240	10	0		DEAEHN
CSC[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245608309	402473753	/nfs/dbraw/zinc/47/37/53/402473753.db2.gz	AVJREGNFIHESFG-CFVMTHIKSA-N	0	3	307.463	2.483	10	0		DEAEHN
CCC[C@@H](C(=O)NCCN1c2ccccc2C[C@H]1C)N(C)C	ZINC000245642005	402475824	/nfs/dbraw/zinc/47/58/24/402475824.db2.gz	SNAFZYAKDNWSFO-PBHICJAKSA-N	0	3	303.450	2.284	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc(Br)s1	ZINC000165448970	402476203	/nfs/dbraw/zinc/47/62/03/402476203.db2.gz	GRGHUXJWLUZZJK-LLVKDONJSA-N	0	3	308.241	2.388	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@H](C)Cc2ccc(OC)cc2)C1	ZINC000245655365	402477432	/nfs/dbraw/zinc/47/74/32/402477432.db2.gz	OBDRMUXVRWXRMF-ZBFHGGJFSA-N	0	3	304.434	2.474	10	0		DEAEHN
C[C@@H]1CN([C@H](CNCC2=CCCOC2)c2cccs2)CCO1	ZINC000245679223	402478641	/nfs/dbraw/zinc/47/86/41/402478641.db2.gz	JFYNOZHSMFBJKC-GDBMZVCRSA-N	0	3	322.474	2.446	10	0		DEAEHN
C[C@@H](CO)N(C)C[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000245685684	402479060	/nfs/dbraw/zinc/47/90/60/402479060.db2.gz	PPPOZEVNNTZJCG-VHSXEESVSA-N	0	3	308.205	2.046	10	0		DEAEHN
C[C@H](CNC(=O)NC[C@@H]1CCC(C)(C)O1)N1CCC(C)CC1	ZINC000187076990	402481545	/nfs/dbraw/zinc/48/15/45/402481545.db2.gz	QJYPABCUEMTJAR-CABCVRRESA-N	0	3	311.470	2.364	10	0		DEAEHN
CCCCCCNC(=O)CN1CCC[C@@H]1Cn1ccnc1C	ZINC000178312913	402484229	/nfs/dbraw/zinc/48/42/29/402484229.db2.gz	ULKLXVSRNHIQRP-MRXNPFEDSA-N	0	3	306.454	2.352	10	0		DEAEHN
CCOc1cccc(CCNC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000178460941	402501074	/nfs/dbraw/zinc/50/10/74/402501074.db2.gz	SNJGDKGBZHSKHB-INIZCTEOSA-N	0	3	317.433	2.117	10	0		DEAEHN
C[C@H]1CN(CCCSCc2ccccc2)CCN1CCO	ZINC000187695264	402508534	/nfs/dbraw/zinc/50/85/34/402508534.db2.gz	IOQCISHLFXFFRQ-INIZCTEOSA-N	0	3	308.491	2.308	10	0		DEAEHN
O=C(N[C@@H]1CCCOC1)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000170934244	402543167	/nfs/dbraw/zinc/54/31/67/402543167.db2.gz	UBFVVLWCFGPREC-NVXWUHKLSA-N	0	3	320.408	2.333	10	0		DEAEHN
CN(C)[C@H](CNC(=O)CSC1CCOCC1)c1ccccc1	ZINC000178881588	402550449	/nfs/dbraw/zinc/55/04/49/402550449.db2.gz	CVVULCUAGMMHFG-MRXNPFEDSA-N	0	3	322.474	2.318	10	0		DEAEHN
O=C(CN1CCN(CC2CCCCC2)CC1)Nc1ccncc1	ZINC000171054461	402552550	/nfs/dbraw/zinc/55/25/50/402552550.db2.gz	VPAVMSJDCYZBQU-UHFFFAOYSA-N	0	3	316.449	2.218	10	0		DEAEHN
COC(=O)N(C)c1ccc(NC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000171081650	402556045	/nfs/dbraw/zinc/55/60/45/402556045.db2.gz	PIBRPSPSKFRJKR-AWEZNQCLSA-N	0	3	320.393	2.057	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC[C@@H]1CCCC[C@H]1C	ZINC000247222038	402560664	/nfs/dbraw/zinc/56/06/64/402560664.db2.gz	BYZUXKDTTXIOHA-OWCLPIDISA-N	0	3	311.470	2.223	10	0		DEAEHN
CC[C@H]1CN(Cc2ccccc2N(C)C)CCN1C[C@H](C)O	ZINC000247495950	402569597	/nfs/dbraw/zinc/56/95/97/402569597.db2.gz	LHGNNMACVCARJM-RDJZCZTQSA-N	0	3	305.466	2.030	10	0		DEAEHN
C[C@H](N[C@H]1CCNC1=O)c1ccc(OCC(F)(F)F)cc1	ZINC000179065249	402569787	/nfs/dbraw/zinc/56/97/87/402569787.db2.gz	KEDOGCWISNZZHU-CABZTGNLSA-N	0	3	302.296	2.167	10	0		DEAEHN
COc1ccc(C2(CN[C@H]3CCNC3=O)CCCCC2)cc1	ZINC000179065218	402569978	/nfs/dbraw/zinc/56/99/78/402569978.db2.gz	AXDIFGAVKQDVEY-INIZCTEOSA-N	0	3	302.418	2.375	10	0		DEAEHN
C[C@@H](CN1CCC[C@H](C)C1)NC(=O)NCCCc1ccccn1	ZINC000246186078	402516527	/nfs/dbraw/zinc/51/65/27/402516527.db2.gz	KAGUVIIPBBFHAV-HOTGVXAUSA-N	0	3	318.465	2.434	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@H](Oc2cccnc2)C1)N1[C@H](C)CC[C@@H]1C	ZINC000246195642	402517611	/nfs/dbraw/zinc/51/76/11/402517611.db2.gz	BYTLBUJNFZEGFE-DLTWYDFYSA-N	0	3	317.433	2.323	10	0		DEAEHN
CC1CCN(c2ccc(C(=O)NC[C@@H]3CCCN3C)cn2)CC1	ZINC000170727511	402517903	/nfs/dbraw/zinc/51/79/03/402517903.db2.gz	GWCGOYOOZNWIKO-INIZCTEOSA-N	0	3	316.449	2.142	10	0		DEAEHN
O=C(Cc1cccc(Br)c1)N1CCN2CCC[C@H]2C1	ZINC000171279052	402573832	/nfs/dbraw/zinc/57/38/32/402573832.db2.gz	RTCRQQLUHVSCJK-AWEZNQCLSA-N	0	3	323.234	2.298	10	0		DEAEHN
CC(=O)Nc1cccc([C@@H](C)NC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000170828590	402530501	/nfs/dbraw/zinc/53/05/01/402530501.db2.gz	SZODTJVXMFHNGM-WBMJQRKESA-N	0	3	318.421	2.052	10	0		DEAEHN
CCOc1cccc([C@H](C)NC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000170835092	402531014	/nfs/dbraw/zinc/53/10/14/402531014.db2.gz	AHGXKQUHWBUKPX-DZGCQCFKSA-N	0	3	305.422	2.492	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)CC2(CC(=O)OC)CCCC2)C1	ZINC000189176987	402531752	/nfs/dbraw/zinc/53/17/52/402531752.db2.gz	GZFATOXMHWQIHN-CQSZACIVSA-N	0	3	310.438	2.101	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COc2c(C)cccc2C)CC[C@@H]1C	ZINC000189313606	402533938	/nfs/dbraw/zinc/53/39/38/402533938.db2.gz	QBEMHJPJZMDPEN-IAOVAPTHSA-N	0	3	307.434	2.400	10	0		DEAEHN
COc1ccc2c(CC(=O)N3CC[C@H](N(C)C)C3)coc2c1	ZINC000170861485	402534181	/nfs/dbraw/zinc/53/41/81/402534181.db2.gz	RHHYEEKUIIYBDS-ZDUSSCGKSA-N	0	3	302.374	2.146	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cc(F)cc3[nH]c(=S)[nH]c32)C1	ZINC000170864918	402535039	/nfs/dbraw/zinc/53/50/39/402535039.db2.gz	MKUNJTPWVKDYCE-SECBINFHSA-N	0	3	308.382	2.141	10	0		DEAEHN
CC1=NN(c2ccc(C(=O)N3CC[C@@H](N(C)C)C3)cc2)CC1	ZINC000170866299	402535276	/nfs/dbraw/zinc/53/52/76/402535276.db2.gz	ABQNNQPTDICGIU-MRXNPFEDSA-N	0	3	300.406	2.049	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)CCc2ccc(OC(F)F)cc2)C1	ZINC000170867652	402535956	/nfs/dbraw/zinc/53/59/56/402535956.db2.gz	ZFNWFCXMACMGSQ-CYBMUJFWSA-N	0	3	312.360	2.383	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cccc(NC(=O)OC)c2)C1	ZINC000171479466	402589353	/nfs/dbraw/zinc/58/93/53/402589353.db2.gz	CEJGJOPWGCAYPG-CQSZACIVSA-N	0	3	305.378	2.079	10	0		DEAEHN
CCOCc1cc(CN2C[C@H](C(N)=O)CC[C@@H]2C)ccc1OC	ZINC000179433940	402589789	/nfs/dbraw/zinc/58/97/89/402589789.db2.gz	YQWLDKVMEDIWEK-DZGCQCFKSA-N	0	3	320.433	2.318	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccc(C(=O)NC(C)C)cc2)C1	ZINC000179475847	402591395	/nfs/dbraw/zinc/59/13/95/402591395.db2.gz	ITXMCLBDGFVRFS-INIZCTEOSA-N	0	3	317.433	2.039	10	0		DEAEHN
O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@@H]1CCCOC1	ZINC000171589938	402598634	/nfs/dbraw/zinc/59/86/34/402598634.db2.gz	AUORJIKNWPUDEC-SJORKVTESA-N	0	3	317.433	2.302	10	0		DEAEHN
CN(Cc1cccnc1)C[C@H]1CCN(Cc2nccs2)C1	ZINC000190472719	402603509	/nfs/dbraw/zinc/60/35/09/402603509.db2.gz	HCZYKYIPXOQAKZ-OAHLLOKOSA-N	0	3	302.447	2.492	10	0		DEAEHN
O=C(CCN1CCC[C@@H](n2cncn2)C1)Nc1ccccc1F	ZINC000171701919	402612159	/nfs/dbraw/zinc/61/21/59/402612159.db2.gz	ZNKXTGVICNQUCR-CYBMUJFWSA-N	0	3	317.368	2.083	10	0		DEAEHN
CCc1cc(NC(=O)C(=O)N2CCC[C@@H](N(C)C)C2)ccc1C	ZINC000180614525	402621207	/nfs/dbraw/zinc/62/12/07/402621207.db2.gz	GIWILEJWSOMNEI-MRXNPFEDSA-N	0	3	317.433	2.049	10	0		DEAEHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NC[C@@H]1CCC(C)(C)O1	ZINC000249131228	402622028	/nfs/dbraw/zinc/62/20/28/402622028.db2.gz	DQWPMCVCUGXHMI-ILXRZTDVSA-N	0	3	311.470	2.364	10	0		DEAEHN
CCc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc3c(c1)OCO3)CC2	ZINC000180630898	402622003	/nfs/dbraw/zinc/62/20/03/402622003.db2.gz	HHTZGNZWDLINLF-WCQYABFASA-N	0	3	314.389	2.235	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1)N(C)C	ZINC000249341246	402626215	/nfs/dbraw/zinc/62/62/15/402626215.db2.gz	IXOMFWYCGWXBJE-BZPMIXESSA-N	0	3	324.387	2.317	10	0		DEAEHN
CCOCc1ccccc1CNC(=O)N1CCN2CCC[C@H]2C1	ZINC000171900752	402632575	/nfs/dbraw/zinc/63/25/75/402632575.db2.gz	DPVRCAQIHVCVHV-KRWDZBQOSA-N	0	3	317.433	2.213	10	0		DEAEHN
CCCc1ccc(NC(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000181130201	402635918	/nfs/dbraw/zinc/63/59/18/402635918.db2.gz	HJJZBGUHEJJMJM-MRXNPFEDSA-N	0	3	305.422	2.433	10	0		DEAEHN
C[C@H](NC(=O)N[C@H](Cc1ccccc1)CN(C)C)[C@H]1CCCO1	ZINC000249684287	402638215	/nfs/dbraw/zinc/63/82/15/402638215.db2.gz	DGYCHKRNQFTPTC-USXIJHARSA-N	0	3	319.449	2.026	10	0		DEAEHN
COC[C@H](C)CN(C)C[C@H](c1cccs1)N1CCOCC1	ZINC000249960667	402643882	/nfs/dbraw/zinc/64/38/82/402643882.db2.gz	WHOSAHQIXLZFFO-HUUCEWRRSA-N	0	3	312.479	2.336	10	0		DEAEHN
Cc1cccc2[nH]cc(CCN[C@@H]3CCCS(=O)(=O)C3)c21	ZINC000182807897	402718115	/nfs/dbraw/zinc/71/81/15/402718115.db2.gz	PBEYCGFEKFWEDE-CQSZACIVSA-N	0	3	306.431	2.186	10	0		DEAEHN
Cc1ccc(CNC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)s1	ZINC000253207730	402661910	/nfs/dbraw/zinc/66/19/10/402661910.db2.gz	HOOREDARYJELFV-XJKCOSOUSA-N	0	3	308.447	2.205	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CCCO[C@@H]1C	ZINC000253353935	402662617	/nfs/dbraw/zinc/66/26/17/402662617.db2.gz	XGKXYEMRBBIDPN-BFYDXBDKSA-N	0	3	304.434	2.438	10	0		DEAEHN
CCCOc1nc(C)ccc1C(=O)NC[C@@H]1CCCN(C)C1	ZINC000191482677	402672773	/nfs/dbraw/zinc/67/27/73/402672773.db2.gz	TZKGBUMFHDKLAA-AWEZNQCLSA-N	0	3	305.422	2.250	10	0		DEAEHN
Cc1ccc(Cl)c(OC[C@@H](O)CN(C)C[C@@H]2CCCO2)c1	ZINC000182247760	402676090	/nfs/dbraw/zinc/67/60/90/402676090.db2.gz	ZBAPCJWVYHNCLV-KBPBESRZSA-N	0	3	313.825	2.499	10	0		DEAEHN
COc1ccc2c(c1)[C@H](NC[C@@H]1CN(C)CCO1)CCS2	ZINC000191529292	402676215	/nfs/dbraw/zinc/67/62/15/402676215.db2.gz	AZMXPCDQMABJFZ-UKRRQHHQSA-N	0	3	308.447	2.152	10	0		DEAEHN
O=C1O[C@@H](CN2CCCN(C3CC3)CC2)CN1c1ccccc1	ZINC000172810826	402677536	/nfs/dbraw/zinc/67/75/36/402677536.db2.gz	DLZKFBDFXFAKQT-KRWDZBQOSA-N	0	3	315.417	2.182	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)c1ccc(F)cn1	ZINC000182304912	402679675	/nfs/dbraw/zinc/67/96/75/402679675.db2.gz	USFSVSZEAHMYHM-HNNXBMFYSA-N	0	3	301.365	2.123	10	0		DEAEHN
CC1CCN(CCNC(=O)N2CCCC[C@@H]2c2cn[nH]c2)CC1	ZINC000182334730	402681587	/nfs/dbraw/zinc/68/15/87/402681587.db2.gz	YZFABLMPHNBUED-MRXNPFEDSA-N	0	3	319.453	2.378	10	0		DEAEHN
COCCN1CCN(CCCOCc2ccccc2)C[C@H]1C	ZINC000182341565	402682575	/nfs/dbraw/zinc/68/25/75/402682575.db2.gz	QEZIJVSSMAZNMT-QGZVFWFLSA-N	0	3	306.450	2.246	10	0		DEAEHN
O=C(NCCc1c[nH]c2ccccc12)N1CC[C@@H](N2CC=CC2)C1	ZINC000173296061	402691088	/nfs/dbraw/zinc/69/10/88/402691088.db2.gz	WSVCIHMNXHGZQL-MRXNPFEDSA-N	0	3	324.428	2.366	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)N1CCc2ccccc21	ZINC000262392444	402725394	/nfs/dbraw/zinc/72/53/94/402725394.db2.gz	BKNFUKHTKYLXRP-SIIHOXLZSA-N	0	3	300.402	2.108	10	0		DEAEHN
CC[C@H](C)NC(=O)CN[C@H](C)c1ccccc1-n1cccn1	ZINC000183156391	402743382	/nfs/dbraw/zinc/74/33/82/402743382.db2.gz	NVDPPLCQFRBJNJ-UONOGXRCSA-N	0	3	300.406	2.438	10	0		DEAEHN
CC(C)N(CCN(C)C)C(=O)c1cnn(CCC(F)(F)F)c1	ZINC000183181715	402745082	/nfs/dbraw/zinc/74/50/82/402745082.db2.gz	CZFWWXCQKDPWII-UHFFFAOYSA-N	0	3	320.359	2.248	10	0		DEAEHN
Cc1csc([C@H](C)NC(=O)N2CC[C@H](N3CC=CC3)C2)n1	ZINC000174661792	402751207	/nfs/dbraw/zinc/75/12/07/402751207.db2.gz	RMUVPCALZSCOSU-STQMWFEESA-N	0	3	306.435	2.168	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(CC(C)(C)c2ccccc2)n1	ZINC000263260514	402751779	/nfs/dbraw/zinc/75/17/79/402751779.db2.gz	QVIAMERENTUFFJ-AWEZNQCLSA-N	0	3	300.406	2.166	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2cccc(Br)c2)n1	ZINC000263318002	402758011	/nfs/dbraw/zinc/75/80/11/402758011.db2.gz	ZUDZDEZGMBDKSG-LLVKDONJSA-N	0	3	323.194	2.075	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cccc(OC)c1OC	ZINC000175044720	402774413	/nfs/dbraw/zinc/77/44/13/402774413.db2.gz	ICCZUPFKQBWUHI-ZIAGYGMSSA-N	0	3	318.417	2.403	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N(CC(=O)N2CCN(Cc3ccco3)CC2)C1	ZINC000174013790	402723388	/nfs/dbraw/zinc/72/33/88/402723388.db2.gz	UQSFVIZOCHBGCN-HZPDHXFCSA-N	0	3	319.449	2.044	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@@H](C)c2ncc(C)s2)C1	ZINC000183688579	402789045	/nfs/dbraw/zinc/78/90/45/402789045.db2.gz	CHXBSWCAERPEIA-DGCLKSJQSA-N	0	3	310.467	2.339	10	0		DEAEHN
C[C@H](Oc1ccccc1Cl)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000195329334	402842324	/nfs/dbraw/zinc/84/23/24/402842324.db2.gz	RPSCJOGAGKTFPL-QWHCGFSZSA-N	0	3	308.809	2.414	10	0		DEAEHN
CCCO[C@H]1CCCN(C(=O)NC[C@H]2CCCN2CC)CC1	ZINC000175368457	402800932	/nfs/dbraw/zinc/80/09/32/402800932.db2.gz	BPCWJPTUDPLJTD-CVEARBPZSA-N	0	3	311.470	2.461	10	0		DEAEHN
Cc1cccc2nc(CCC(=O)N3CCN(C(C)C)CC3)[nH]c21	ZINC000175382560	402801704	/nfs/dbraw/zinc/80/17/04/402801704.db2.gz	GGUSVPXLBAXJBE-UHFFFAOYSA-N	0	3	314.433	2.357	10	0		DEAEHN
CC(C)NC(=O)CCN(C)[C@H](C)c1ccc([S@](C)=O)cc1	ZINC000175410972	402804151	/nfs/dbraw/zinc/80/41/51/402804151.db2.gz	WOQZPMLYUNKHTM-ASSNKEHSSA-N	0	3	310.463	2.332	10	0		DEAEHN
O[C@H](COc1ccccc1Cl)CN1CCCN(C2CC2)CC1	ZINC000195339250	402842950	/nfs/dbraw/zinc/84/29/50/402842950.db2.gz	JNQRLDDGLXDBCQ-HNNXBMFYSA-N	0	3	324.852	2.250	10	0		DEAEHN
CCN1CCN(c2cccc(NC(=O)[C@@H]3CC[C@H](C)O3)c2)CC1	ZINC000184258632	402830737	/nfs/dbraw/zinc/83/07/37/402830737.db2.gz	IOISASWDBOEKRO-YOEHRIQHSA-N	0	3	317.433	2.335	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)N[C@@H]2COc3ccccc32)C1	ZINC000195197577	402836016	/nfs/dbraw/zinc/83/60/16/402836016.db2.gz	YHZZNSJJJRNQTJ-UKRRQHHQSA-N	0	3	303.406	2.151	10	0		DEAEHN
CC(C)[C@@H](CNC(=O)N1CCN2CCC[C@@H]2C1)c1cccnc1	ZINC000175903705	402841451	/nfs/dbraw/zinc/84/14/51/402841451.db2.gz	QJGSFDIHYBPFGV-IAGOWNOFSA-N	0	3	316.449	2.311	10	0		DEAEHN
COCC[C@H](CO)NCc1ccc(Br)c(F)c1	ZINC000282265109	403137968	/nfs/dbraw/zinc/13/79/68/403137968.db2.gz	PNIJVMQSEIIJNY-SNVBAGLBSA-N	0	3	306.175	2.075	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@H](C)N[C@@H]2CCOC[C@H]2C)c1	ZINC000278046385	403282264	/nfs/dbraw/zinc/28/22/64/403282264.db2.gz	XURUPXNGVSGSIL-BFQNTYOBSA-N	0	3	304.390	2.231	10	0		DEAEHN
c1c(CNC[C@H]2CCCN2Cc2ccccc2)nc2ncccn12	ZINC000298530683	403405901	/nfs/dbraw/zinc/40/59/01/403405901.db2.gz	SCWWASUAOLULDW-GOSISDBHSA-N	0	3	321.428	2.484	10	0		DEAEHN
CCn1cc(CCN2C[C@@H](O)C[C@@H]2c2cccc(F)c2)cn1	ZINC000286380630	403512986	/nfs/dbraw/zinc/51/29/86/403512986.db2.gz	ZBZCBGAZMGWCCM-DLBZAZTESA-N	0	3	303.381	2.393	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)N[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000343512705	403617889	/nfs/dbraw/zinc/61/78/89/403617889.db2.gz	NEASBKMTLVPJDE-DOMZBBRYSA-N	0	3	318.421	2.274	10	0		DEAEHN
COc1cc(CN2CC[C@H](O)C23CCCC3)cc2c1OCCO2	ZINC000294063610	403637538	/nfs/dbraw/zinc/63/75/38/403637538.db2.gz	XZISAGBTFUUKMP-INIZCTEOSA-N	0	3	319.401	2.346	10	0		DEAEHN
CC1(C)Cc2ccc(C(=O)N[C@@H]3CCN(C4CC4)C3)c(O)c2O1	ZINC000333116718	403669218	/nfs/dbraw/zinc/66/92/18/403669218.db2.gz	YXYILYAYWXUHSC-GFCCVEGCSA-N	0	3	316.401	2.072	10	0		DEAEHN
C(CN1CCCCC1)O[C@H]1CCN(c2nc(C3CC3)ns2)C1	ZINC000301857938	403691487	/nfs/dbraw/zinc/69/14/87/403691487.db2.gz	SBMPSHMFOAAGCY-AWEZNQCLSA-N	0	3	322.478	2.497	10	0		DEAEHN
CC[C@@H]1CN(c2ncnc3c(F)cccc32)CCN1CCOC	ZINC000302660892	403712638	/nfs/dbraw/zinc/71/26/38/403712638.db2.gz	IHFJUFHIGZICFJ-CYBMUJFWSA-N	0	3	318.396	2.316	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN1CCC(CN2CCc3ccccc32)CC1	ZINC000347728922	403830198	/nfs/dbraw/zinc/83/01/98/403830198.db2.gz	BFMSOWBYIHDIJD-IBGZPJMESA-N	0	3	316.445	2.101	10	0		DEAEHN
c1cc(CCCN2CCO[C@@]3(CCCOC3)C2)cc2c1OCC2	ZINC000289340693	403916483	/nfs/dbraw/zinc/91/64/83/403916483.db2.gz	HVFJUAJNGZXSKU-IBGZPJMESA-N	0	3	317.429	2.436	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCC[C@@H]1C(C)(C)O	ZINC000305747917	403928297	/nfs/dbraw/zinc/92/82/97/403928297.db2.gz	QCAZVOVYUPFOIQ-MRXNPFEDSA-N	0	3	304.434	2.270	10	0		DEAEHN
CC(C)[C@@H](C(=O)N1CCC[C@H](c2nnc[n-]2)C1)[NH+]1CCCCC1	ZINC000364090272	404315730	/nfs/dbraw/zinc/31/57/30/404315730.db2.gz	QXGRTPPQLAWZIW-GJZGRUSLSA-N	0	3	319.453	2.021	10	0		DEAEHN
Cc1noc([C@H]2CCN(Cc3cn(C)nc3-c3cccnc3)C2)n1	ZINC000344850574	404405461	/nfs/dbraw/zinc/40/54/61/404405461.db2.gz	GFOYEHAGUZUNRF-AWEZNQCLSA-N	0	3	324.388	2.163	10	0		DEAEHN
Cc1noc([C@@H]2CCN(Cc3c[nH]nc3-c3cccnc3)C2)n1	ZINC000344860714	404410536	/nfs/dbraw/zinc/41/05/36/404410536.db2.gz	CYFMIFLPQQOCNL-CYBMUJFWSA-N	0	3	310.361	2.153	10	0		DEAEHN
CN(Cc1cnccn1)C(=O)[C@H]1CCCCN1C1CCCC1	ZINC000365442360	404661297	/nfs/dbraw/zinc/66/12/97/404661297.db2.gz	JOYQDTYBRXVSSC-MRXNPFEDSA-N	0	3	302.422	2.232	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1[C@H](N[C@@H]2C=CCCC2)CC(=O)N1C	ZINC000330346148	404632419	/nfs/dbraw/zinc/63/24/19/404632419.db2.gz	GCUOYDHGBAZMBY-CKEIUWERSA-N	0	3	302.422	2.007	10	0		DEAEHN
O=C(CN1CCCC[C@@H](CO)C1)NCc1ccc(Cl)cc1	ZINC000374053792	404681130	/nfs/dbraw/zinc/68/11/30/404681130.db2.gz	ZGGVLWYMCHPTRE-CQSZACIVSA-N	0	3	310.825	2.051	10	0		DEAEHN
CC(C)[C@@H](O)C(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1	ZINC000375841351	404758147	/nfs/dbraw/zinc/75/81/47/404758147.db2.gz	RSDLYCPZJAWQOU-VHDGCEQUSA-N	0	3	310.463	2.264	10	0		DEAEHN
CN1CCC[C@@H](N2CCN(C(=O)c3ccoc3C3CC3)CC2)C1	ZINC000366944268	404877960	/nfs/dbraw/zinc/87/79/60/404877960.db2.gz	CAUSEMCFGIAJAL-OAHLLOKOSA-N	0	3	317.433	2.009	10	0		DEAEHN
COc1cc2c(c(OC)c1OC)CCN(CCSC)CC2	ZINC000378191047	404887942	/nfs/dbraw/zinc/88/79/42/404887942.db2.gz	HKNVUQLMMLTLOE-UHFFFAOYSA-N	0	3	311.447	2.476	10	0		DEAEHN
CN(C)C(=O)CCNCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000360953545	404861038	/nfs/dbraw/zinc/86/10/38/404861038.db2.gz	HKLRYXITGJXQHW-UHFFFAOYSA-N	0	3	306.406	2.210	10	0		DEAEHN
CC(C)(C)OC(=O)c1ccc(CNC[C@@H](O)C(F)F)cc1	ZINC000360973618	404866705	/nfs/dbraw/zinc/86/67/05/404866705.db2.gz	DPHMAGMJBLFBIF-GFCCVEGCSA-N	0	3	301.333	2.358	10	0		DEAEHN
Cn1cnc(CCNCc2ccc(C(=O)OC(C)(C)C)cc2)n1	ZINC000360984540	404869734	/nfs/dbraw/zinc/86/97/34/404869734.db2.gz	DVXUHQFZAYZDDX-UHFFFAOYSA-N	0	3	316.405	2.103	10	0		DEAEHN
CC(C)n1ncnc1CNC[C@@H](C)N(C)Cc1ccccc1	ZINC000390709716	405047512	/nfs/dbraw/zinc/04/75/12/405047512.db2.gz	VRLQOQZYBWXOIE-OAHLLOKOSA-N	0	3	301.438	2.469	10	0		DEAEHN
Cc1cc(=O)[nH]c(C(=O)N2CCC[C@H]2CN2CCCCC2)c1	ZINC000408006284	405088272	/nfs/dbraw/zinc/08/82/72/405088272.db2.gz	XIUFCBHXQCKBGT-AWEZNQCLSA-N	0	3	303.406	2.186	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)CCN2CCOCC[C@H]2C)cc1	ZINC000367660568	405117257	/nfs/dbraw/zinc/11/72/57/405117257.db2.gz	IRDZYVNOBKIJNT-CYBMUJFWSA-N	0	3	304.390	2.329	10	0		DEAEHN
Cc1cccc2c1ncc(C)c2N[C@H]1CCCS(=O)(=O)C1	ZINC000408239174	405148540	/nfs/dbraw/zinc/14/85/40/405148540.db2.gz	VXLXCHLUCHITDU-ZDUSSCGKSA-N	0	3	304.415	2.263	10	0		DEAEHN
c1nc2c(c(N3CCN(C4CCOCC4)CC3)n1)CCCCC2	ZINC000439103055	405265986	/nfs/dbraw/zinc/26/59/86/405265986.db2.gz	VASABKNRNCGPKI-UHFFFAOYSA-N	0	3	316.449	2.047	10	0		DEAEHN
c1c2cccnc2oc1CN1CCC[C@@H]1CN1CCOCC1	ZINC000449013592	405497422	/nfs/dbraw/zinc/49/74/22/405497422.db2.gz	DISVHFABPPUWKX-OAHLLOKOSA-N	0	3	301.390	2.124	10	0		DEAEHN
O=C([C@H](C1CC1)N1CCCC1)N1CCCC[C@@H]1c1cn[nH]c1	ZINC000124173121	304408121	/nfs/dbraw/zinc/40/81/21/304408121.db2.gz	VQXOOLYMPPIDMK-CVEARBPZSA-N	0	3	302.422	2.338	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CC[C@@](C)(C(=O)OC(C)(C)C)C1	ZINC000457277207	405775972	/nfs/dbraw/zinc/77/59/72/405775972.db2.gz	YEDQILPVGMUXCK-RDTXWAMCSA-N	0	3	324.465	2.441	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)c1	ZINC000457639968	405929998	/nfs/dbraw/zinc/92/99/98/405929998.db2.gz	YXWZMOXIGSNNKF-IUODEOHRSA-N	0	3	316.401	2.137	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2ccccc2CC)CC12COC2	ZINC000451127682	406059053	/nfs/dbraw/zinc/05/90/53/406059053.db2.gz	AODUIFSUMXGPJS-INIZCTEOSA-N	0	3	303.402	2.261	10	0		DEAEHN
CC(=O)N1CCC[C@@H](CNCc2nc3cc(F)ccc3o2)C1	ZINC000634978639	406383924	/nfs/dbraw/zinc/38/39/24/406383924.db2.gz	IIMHTXVJQVINFF-LBPRGKRZSA-N	0	3	305.353	2.315	10	0		DEAEHN
c1c(CN2CCC[C@H]2C2CCCC2)nnn1C[C@@H]1CCOC1	ZINC000637966292	406500503	/nfs/dbraw/zinc/50/05/03/406500503.db2.gz	XDWKADJCVXUOIR-YOEHRIQHSA-N	0	3	304.438	2.469	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N(C)C1CCCCC1	ZINC000637869473	406454833	/nfs/dbraw/zinc/45/48/33/406454833.db2.gz	WHGXTTBQFFNVLV-QGZVFWFLSA-N	0	3	303.450	2.237	10	0		DEAEHN
CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)c1nnc([C@@H](C)CC)[n-]1	ZINC000490355864	406462884	/nfs/dbraw/zinc/46/28/84/406462884.db2.gz	WEGPIPHEDXZJJM-RWMBFGLXSA-N	0	3	307.442	2.370	10	0		DEAEHN
CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)c1nnc([C@@H](C)CC)[n-]1	ZINC000490355864	406462886	/nfs/dbraw/zinc/46/28/86/406462886.db2.gz	WEGPIPHEDXZJJM-RWMBFGLXSA-N	0	3	307.442	2.370	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@@H](C)c1nnc([C@@H](C)CC)[nH]1	ZINC000490355864	406462888	/nfs/dbraw/zinc/46/28/88/406462888.db2.gz	WEGPIPHEDXZJJM-RWMBFGLXSA-N	0	3	307.442	2.370	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CCC[C@@H]1C1CCC1	ZINC000637968963	406501254	/nfs/dbraw/zinc/50/12/54/406501254.db2.gz	CUMCNYZDJKZNHD-ZWKOTPCHSA-N	0	3	315.461	2.237	10	0		DEAEHN
c1nc(CN2CCC[C@@H]([C@H]3CCOC3)C2)cc2c1OCCO2	ZINC000638182209	406611696	/nfs/dbraw/zinc/61/16/96/406611696.db2.gz	RFENCKGYHPQVIF-KGLIPLIRSA-N	0	3	304.390	2.101	10	0		DEAEHN
CN(C)CCc1ccccc1NC(=O)c1cn2cccnc2n1	ZINC000527363599	406624948	/nfs/dbraw/zinc/62/49/48/406624948.db2.gz	NXZXENDYXAIQBS-UHFFFAOYSA-N	0	3	309.373	2.086	10	0		DEAEHN
C[C@@H]1CCCCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)C1	ZINC000638313508	406692500	/nfs/dbraw/zinc/69/25/00/406692500.db2.gz	XJGBCSKFEFTSTQ-NVXWUHKLSA-N	0	3	303.450	2.094	10	0		DEAEHN
CN(C)[C@H]1CCCN(C(=O)c2ncsc2Br)C1	ZINC000553096369	406735736	/nfs/dbraw/zinc/73/57/36/406735736.db2.gz	KYRLFQUJSFOWFR-QMMMGPOBSA-N	0	3	318.240	2.072	10	0		DEAEHN
c1cc(CNCCCN2CCN(c3ccccc3)CC2)sn1	ZINC000638336669	406709827	/nfs/dbraw/zinc/70/98/27/406709827.db2.gz	FIAZHXFOTYNXGO-UHFFFAOYSA-N	0	3	316.474	2.445	10	0		DEAEHN
C[C@H](NC(=O)[C@@H]1CNCCOC1)c1ccc(Cl)c(Cl)c1	ZINC000643619838	407018461	/nfs/dbraw/zinc/01/84/61/407018461.db2.gz	HRXVOBKNXBSCSB-GXSJLCMTSA-N	0	3	317.216	2.407	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(C(C)C)n(C)n1	ZINC000245407601	287229026	/nfs/dbraw/zinc/22/90/26/287229026.db2.gz	BWZGFEXRYJTKJZ-KGLIPLIRSA-N	0	3	304.438	2.242	10	0		DEAEHN
CN(CC[C@H]1COCCN1)Cc1cccc(Br)c1	ZINC000129402408	196044578	/nfs/dbraw/zinc/04/45/78/196044578.db2.gz	JVVXCUHLBKHVSJ-AWEZNQCLSA-N	0	3	313.239	2.259	10	0		DEAEHN
CN(CC[C@H]1COCCN1)Cc1cc(Br)cs1	ZINC000129419081	196046736	/nfs/dbraw/zinc/04/67/36/196046736.db2.gz	SGQDWYJCXAHSLP-NSHDSACASA-N	0	3	319.268	2.321	10	0		DEAEHN
C[C@H](NC(=O)C(C)(C)N1CCNCC1)c1ccc(Cl)cc1	ZINC000129696390	196068780	/nfs/dbraw/zinc/06/87/80/196068780.db2.gz	JHLTUGZPBHUKKK-LBPRGKRZSA-N	0	3	309.841	2.201	10	0		DEAEHN
CCn1ncnc1C[C@@H](N)c1sccc1Br	ZINC000130753309	196107600	/nfs/dbraw/zinc/10/76/00/196107600.db2.gz	HTOJHRHFCLHEQT-MRVPVSSYSA-N	0	3	301.213	2.365	10	0		DEAEHN
CCN[C@@H](Cc1ccn(C)n1)c1ccc(Br)cn1	ZINC000130897244	196120745	/nfs/dbraw/zinc/12/07/45/196120745.db2.gz	YAUQKPNZLDRXJY-ZDUSSCGKSA-N	0	3	309.211	2.471	10	0		DEAEHN
CN[C@H](C)c1cccc(S(=O)(=O)NCC[C@H](C)SC)c1	ZINC000130940258	196125302	/nfs/dbraw/zinc/12/53/02/196125302.db2.gz	YOIZZYMGZMGCDB-NWDGAFQWSA-N	0	3	316.492	2.387	10	0		DEAEHN
C[C@H](CNS(=O)(=O)c1ccccc1CN)c1ccccc1	ZINC000131161869	196145711	/nfs/dbraw/zinc/14/57/11/196145711.db2.gz	NEXDZLHWJAGCRF-CYBMUJFWSA-N	0	3	304.415	2.227	10	0		DEAEHN
CCCN[C@@H](C)c1c(CC)nn(CCS(C)(=O)=O)c1CC	ZINC000131173367	196146855	/nfs/dbraw/zinc/14/68/55/196146855.db2.gz	OTXBLSJPAKDUSS-LBPRGKRZSA-N	0	3	315.483	2.113	10	0		DEAEHN
CCNCc1ccccc1S(=O)(=O)NCCCC(F)(F)F	ZINC000131231460	196152355	/nfs/dbraw/zinc/15/23/55/196152355.db2.gz	DUENFRNRPRNEHJ-UHFFFAOYSA-N	0	3	324.368	2.417	10	0		DEAEHN
N[C@H]1COC[C@H]1C(=O)Nc1ccc(Cl)cc1Br	ZINC000131537989	196178117	/nfs/dbraw/zinc/17/81/17/196178117.db2.gz	PHBYXSCHOLJQNA-APPZFPTMSA-N	0	3	319.586	2.015	10	0		DEAEHN
COc1ccc(CN(C)[C@@H]2CCCC[C@@H]2O)cc1C(N)=S	ZINC000131717259	196193833	/nfs/dbraw/zinc/19/38/33/196193833.db2.gz	QMEOUEGXCLCECD-KGLIPLIRSA-N	0	3	308.447	2.065	10	0		DEAEHN
C[C@@H]1CNC[C@@H](COCc2ccc(F)c(Br)c2)O1	ZINC000132448600	196256629	/nfs/dbraw/zinc/25/66/29/196256629.db2.gz	CHWNLSVEDMSCJH-KOLCDFICSA-N	0	3	318.186	2.482	10	0		DEAEHN
CC[C@H](CSC)NCC(=O)Nc1ccc2c(c1)OCCO2	ZINC000132604014	196270035	/nfs/dbraw/zinc/27/00/35/196270035.db2.gz	ICLHNESHDGPIMP-LLVKDONJSA-N	0	3	310.419	2.128	10	0		DEAEHN
CCN[C@H](c1c(Br)cnn1C)[C@H]1CCO[C@@H]1C	ZINC000133863420	196341292	/nfs/dbraw/zinc/34/12/92/196341292.db2.gz	CSPIATZILCEYFZ-YWVKMMECSA-N	0	3	302.216	2.258	10	0		DEAEHN
CCC[C@@H]1CN=C(NCc2ccc(S(C)(=O)=O)cc2)S1	ZINC000134481263	196395410	/nfs/dbraw/zinc/39/54/10/196395410.db2.gz	UEFFMBCEOSRQSW-GFCCVEGCSA-N	0	3	312.460	2.451	10	0		DEAEHN
CCCNCc1cccc(S(=O)(=O)N(C)CC(F)F)c1	ZINC000137043540	196561954	/nfs/dbraw/zinc/56/19/54/196561954.db2.gz	FMKFKZYGHIQDBF-UHFFFAOYSA-N	0	3	306.378	2.072	10	0		DEAEHN
COc1ccc(C[C@@H](N)c2ccnnc2)cc1Br	ZINC000137153258	196567206	/nfs/dbraw/zinc/56/72/06/196567206.db2.gz	FZJNZGPTUFDWTC-GFCCVEGCSA-N	0	3	308.179	2.490	10	0		DEAEHN
COc1ccc([C@@H](C)NCC2(CCO)CC2)cc1NC(C)=O	ZINC000188076656	225007762	/nfs/dbraw/zinc/00/77/62/225007762.db2.gz	FCXDZWBKIZBIRQ-GFCCVEGCSA-N	0	3	306.406	2.467	10	0		DEAEHN
COCCN(C)CCCNC(=O)Nc1ccc2cc[nH]c2c1	ZINC000194314726	225178926	/nfs/dbraw/zinc/17/89/26/225178926.db2.gz	YZCKIFIQSKIKFC-UHFFFAOYSA-N	0	3	304.394	2.258	10	0		DEAEHN
O[C@H](C[C@H]1CCCN1C[C@@H](O)CC(F)(F)F)c1ccco1	ZINC000248934790	225241893	/nfs/dbraw/zinc/24/18/93/225241893.db2.gz	BTZSAGAUJGQRGL-GRYCIOLGSA-N	0	3	307.312	2.481	10	0		DEAEHN
C[C@H](CC(N)=O)N[C@@H]1CCOc2ccc(Br)cc21	ZINC000135720414	274474463	/nfs/dbraw/zinc/47/44/63/274474463.db2.gz	NRCUUTALIDQMPU-LDYMZIIASA-N	0	3	313.195	2.126	10	0		DEAEHN
O[C@@]1(CCNCc2cccc(Br)c2F)CCOC1	ZINC000404154377	424925507	/nfs/dbraw/zinc/92/55/07/424925507.db2.gz	RWKFCZQIFNYJTE-ZDUSSCGKSA-N	0	3	318.186	2.219	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)c2nscc2Br)C1	ZINC000404801442	424929577	/nfs/dbraw/zinc/92/95/77/424929577.db2.gz	KWUXFVWFFXYICL-MRVPVSSYSA-N	0	3	318.240	2.072	10	0		DEAEHN
CN1CCC(n2ccc(NC(=O)c3ccoc3C3CC3)n2)CC1	ZINC000374191341	424889324	/nfs/dbraw/zinc/88/93/24/424889324.db2.gz	ARJFFCJTANZNNI-UHFFFAOYSA-N	0	3	314.389	2.873	10	0		DEAEHN
Cc1cc(C)n([C@@H](C)C(=O)N(CCN(C)C)Cc2ccco2)n1	ZINC000088229331	267398340	/nfs/dbraw/zinc/39/83/40/267398340.db2.gz	NVVVVSYAYNAQJH-HNNXBMFYSA-N	0	3	318.421	2.244	10	0		DEAEHN
CC(C)c1ccc([C@@H](C)NC(=O)NC[C@@](C)(O)CN(C)C)cc1	ZINC000178920638	267590097	/nfs/dbraw/zinc/59/00/97/267590097.db2.gz	RIVMTPVXSKRFGZ-RDTXWAMCSA-N	0	3	321.465	2.483	10	0		DEAEHN
COC[C@@H](NC[C@@H](C)CS(C)(=O)=O)c1ccc(Cl)cc1	ZINC000193677676	267764154	/nfs/dbraw/zinc/76/41/54/267764154.db2.gz	OUBOCTUXUDMSDM-BXUZGUMPSA-N	0	3	319.854	2.298	10	0		DEAEHN
CN(C(=O)CSc1ccc(F)cc1)[C@H](CN)C(F)(F)F	ZINC000662977430	425770056	/nfs/dbraw/zinc/77/00/56/425770056.db2.gz	UAZZGNLBALEYPV-SNVBAGLBSA-N	0	3	310.316	2.266	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)Nc1cc(C(=O)NC2CC2)ccc1C	ZINC000237010055	268591391	/nfs/dbraw/zinc/59/13/91/268591391.db2.gz	MWFDXZLVRQWILR-MEBBXXQBSA-N	0	3	303.406	2.199	10	0		DEAEHN
CC[C@@H](C)C(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000397645423	269106654	/nfs/dbraw/zinc/10/66/54/269106654.db2.gz	UXIQVFXNRHKLRI-OAHLLOKOSA-N	0	3	304.434	2.176	10	0		DEAEHN
C[C@@H]1CN(C)CCN1C[C@@H](O)Cc1ccccc1C(F)(F)F	ZINC000443411974	269137366	/nfs/dbraw/zinc/13/73/66/269137366.db2.gz	HLFIVJDXOJNCCF-OCCSQVGLSA-N	0	3	316.367	2.245	10	0		DEAEHN
C[C@@H](CNC(=O)c1ncsc1Br)N(C)C1CC1	ZINC000516803615	269369492	/nfs/dbraw/zinc/36/94/92/269369492.db2.gz	HQKODYRJBUEGAU-ZETCQYMHSA-N	0	3	318.240	2.118	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)Nc1nc(-c2ccccn2)cs1	ZINC000238069516	274977259	/nfs/dbraw/zinc/97/72/59/274977259.db2.gz	NPZXQHUIFZNCKI-SNVBAGLBSA-N	0	3	320.443	2.239	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@@H]1CCCc2cccnc21	ZINC000194551977	276168973	/nfs/dbraw/zinc/16/89/73/276168973.db2.gz	XGTAZBUBTFITEE-HZPDHXFCSA-N	0	3	301.434	2.444	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCCC[C@H]1c1ncc[nH]1	ZINC000246418252	276171629	/nfs/dbraw/zinc/17/16/29/276171629.db2.gz	SIWJAESCNSNILD-KGLIPLIRSA-N	0	3	305.426	2.131	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(C)cc(OC)c1O	ZINC000177424563	276181712	/nfs/dbraw/zinc/18/17/12/276181712.db2.gz	OAXFNXHITVVRPE-ZDUSSCGKSA-N	0	3	306.406	2.266	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H](C)c1cn(-c2ccccc2)nn1)N(C)C	ZINC000155134178	276282173	/nfs/dbraw/zinc/28/21/73/276282173.db2.gz	ZHQQRNLRZKZYFG-XJKSGUPXSA-N	0	3	315.421	2.175	10	0		DEAEHN
CCOC(=O)[C@@H]1CCCCN1C(=O)CN[C@H](C)c1cccs1	ZINC000180928490	276435755	/nfs/dbraw/zinc/43/57/55/276435755.db2.gz	JWJJERDQRBLTPM-OLZOCXBDSA-N	0	3	324.446	2.343	10	0		DEAEHN
CC(C)C[C@@H](C)S(=O)(=O)N1CCC[C@@H]1CN1CCCC1	ZINC000074370041	277434933	/nfs/dbraw/zinc/43/49/33/277434933.db2.gz	FXLNARXQJUMJAH-HUUCEWRRSA-N	0	3	302.484	2.311	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)Nc1cccc(N(C)C)n1	ZINC000181931323	278332748	/nfs/dbraw/zinc/33/27/48/278332748.db2.gz	HVFNRSOJYZLYRW-ZDUSSCGKSA-N	0	3	305.426	2.144	10	0		DEAEHN
Cc1noc(C)c1[C@H](C)CC(=O)N1CCCN(C2CC2)CC1	ZINC000179193921	279251082	/nfs/dbraw/zinc/25/10/82/279251082.db2.gz	DLJPNTWLPPEXBF-GFCCVEGCSA-N	0	3	305.422	2.482	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NC[C@H](c1ccco1)N(C)C	ZINC000245457965	279298318	/nfs/dbraw/zinc/29/83/18/279298318.db2.gz	CJWTXBPYLPPEQW-HUUCEWRRSA-N	0	3	322.453	2.008	10	0		DEAEHN
C[C@H](CN[C@@H](C)c1ccccc1-n1cccn1)CS(C)(=O)=O	ZINC000183164911	279348519	/nfs/dbraw/zinc/34/85/19/279348519.db2.gz	SIACWIIYCNHBMW-KGLIPLIRSA-N	0	3	321.446	2.204	10	0		DEAEHN
Cc1c(C(=O)N2CCCC[C@H](N3CCCC3)C2)nnn1C(C)C	ZINC000328801628	280205087	/nfs/dbraw/zinc/20/50/87/280205087.db2.gz	AJIOGUBPGXOFRL-HNNXBMFYSA-N	0	3	319.453	2.258	10	0		DEAEHN
Cc1cc(C)c(N2CC[C@H](NC3CCOCC3)C2=O)c(C)c1	ZINC000189456163	280387821	/nfs/dbraw/zinc/38/78/21/280387821.db2.gz	BBPUDTCTRDQEIZ-INIZCTEOSA-N	0	3	302.418	2.486	10	0		DEAEHN
C[C@@H]1CN([C@@H]2CC[C@](C)(c3ccccc3)C2)C[C@@H](C(N)=O)O1	ZINC000249964815	288250280	/nfs/dbraw/zinc/25/02/80/288250280.db2.gz	WUTVGZFIVHTMPA-KBEGMRNHSA-N	0	3	302.418	2.071	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cccc(OC)c1OC	ZINC000175044740	288310318	/nfs/dbraw/zinc/31/03/18/288310318.db2.gz	ICCZUPFKQBWUHI-UONOGXRCSA-N	0	3	318.417	2.403	10	0		DEAEHN
Cc1ccccc1NC(=O)CCN1CCCC[C@]1(C)C(N)=O	ZINC000185928941	281349919	/nfs/dbraw/zinc/34/99/19/281349919.db2.gz	JCFJGSMDMKTKQP-QGZVFWFLSA-N	0	3	303.406	2.054	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)N1C[C@H](N(C)C)Cc2ccccc21	ZINC000194325659	288364966	/nfs/dbraw/zinc/36/49/66/288364966.db2.gz	ROZFCUWSINBCMK-FVQBIDKESA-N	0	3	302.418	2.179	10	0		DEAEHN
Cc1nc(C(F)(F)F)ccc1C(=O)N1CC[C@H](N(C)C)C1	ZINC000170867274	281852662	/nfs/dbraw/zinc/85/26/62/281852662.db2.gz	KVKPOFZZBQGVJF-JTQLQIEISA-N	0	3	301.312	2.185	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)NCCN1CCC(C)CC1	ZINC000117756263	289083718	/nfs/dbraw/zinc/08/37/18/289083718.db2.gz	IPJVTKWLKBRVMW-PBHICJAKSA-N	0	3	302.418	2.399	10	0		DEAEHN
CN1C(=O)C[C@H](N[C@H]2CCCOC2)[C@H]1c1ccc(Cl)cc1	ZINC000245594662	289842076	/nfs/dbraw/zinc/84/20/76/289842076.db2.gz	MPXIVSAOILZNAI-OFQRWUPVSA-N	0	3	308.809	2.380	10	0		DEAEHN
C[C@H](O)C[C@H](C)CNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248047685	290139334	/nfs/dbraw/zinc/13/93/34/290139334.db2.gz	NFXNBXDIESAEOB-DIECFANBSA-N	0	3	319.449	2.138	10	0		DEAEHN
C[C@H](CC(C)(C)c1ccccc1)NC(=O)C1(N)CCOCC1	ZINC000261874891	298326363	/nfs/dbraw/zinc/32/63/63/298326363.db2.gz	OPLVBYSLZMWQBL-CQSZACIVSA-N	0	3	304.434	2.367	10	0		DEAEHN
CN(Cc1cnn(C)c1)C(=O)CN1CCC(C(C)(C)C)CC1	ZINC000172032081	325726527	/nfs/dbraw/zinc/72/65/27/325726527.db2.gz	ZFMVUERHMNAOTL-UHFFFAOYSA-N	0	3	306.454	2.137	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1c[nH]c(=O)c2ccccc12	ZINC000188222669	333039563	/nfs/dbraw/zinc/03/95/63/333039563.db2.gz	ZZXRYSDGSMKKMF-ZDUSSCGKSA-N	0	3	313.401	2.084	10	0		DEAEHN
C[C@H]1CCCN(c2cc(NC[C@@H]3CCCN(C)C3)ncn2)C1	ZINC000302004845	534176682	/nfs/dbraw/zinc/17/66/82/534176682.db2.gz	ZNSPPTLSUMRVSV-GJZGRUSLSA-N	0	3	303.454	2.467	10	0		DEAEHN
CC(C)c1ccccc1OC[C@H](O)CN1CC[C@@H](O)[C@@H](C)C1	ZINC000249596696	519847540	/nfs/dbraw/zinc/84/75/40/519847540.db2.gz	WZNVDNAYTPCQEH-ZMSDIMECSA-N	0	3	307.434	2.252	10	0		DEAEHN
CCOCCN1CCN(CCCOc2ccccc2)C[C@@H]1C	ZINC000105834866	519920294	/nfs/dbraw/zinc/92/02/94/519920294.db2.gz	ZCDLTKOYHPPYSD-KRWDZBQOSA-N	0	3	306.450	2.498	10	0		DEAEHN
CCCOc1ccc(CNC(=O)N[C@@H]2CCCN(CC)C2)cn1	ZINC000107838136	520359985	/nfs/dbraw/zinc/35/99/85/520359985.db2.gz	SNPAVUMSVATOBX-OAHLLOKOSA-N	0	3	320.437	2.154	10	0		DEAEHN
CCOc1ncccc1NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000246750774	521622495	/nfs/dbraw/zinc/62/24/95/521622495.db2.gz	BSEHYMNDTZAWBN-QWHCGFSZSA-N	0	3	306.410	2.427	10	0		DEAEHN
CCN1CC[C@@H](CNC(=O)CCC(=O)c2ccc(F)c(F)c2)C1	ZINC000124714662	521709388	/nfs/dbraw/zinc/70/93/88/521709388.db2.gz	UUTKNICXRKTCMF-LBPRGKRZSA-N	0	3	324.371	2.386	10	0		DEAEHN
O=C(C[C@@H]1CCCCC(=O)N1)N1CC[C@@H](N2CCCCC2)C1	ZINC000328681156	534686957	/nfs/dbraw/zinc/68/69/57/534686957.db2.gz	UYIDTHSYOOMTHX-LSDHHAIUSA-N	0	3	307.438	2.362	10	0		DEAEHN
Cc1ccc(C)c(OC[C@H](O)CN2[C@H](C)C[C@@H](O)C[C@@H]2C)c1	ZINC000248841837	524181580	/nfs/dbraw/zinc/18/15/80/524181580.db2.gz	QBACXPRUQIYJII-YYIAUSFCSA-N	0	3	307.434	2.277	10	0		DEAEHN
C[C@@H](CNCc1cccc2c1OC(C)(C)C2)N1CCOCC1	ZINC000161583867	524744631	/nfs/dbraw/zinc/74/46/31/524744631.db2.gz	WJUDERRPCPRJAY-AWEZNQCLSA-N	0	3	304.434	2.210	10	0		DEAEHN
C[C@H](c1nnc(-c2ccccc2)o1)N1CCO[C@@H](CN(C)C)C1	ZINC000247007708	526186335	/nfs/dbraw/zinc/18/63/35/526186335.db2.gz	BXTDLSHCCGDIOU-HIFRSBDPSA-N	0	3	316.405	2.060	10	0		DEAEHN
C(c1noc(C2CCOCC2)n1)N1CC[C@@H](N2CCCCC2)C1	ZINC000328608981	527497035	/nfs/dbraw/zinc/49/70/35/527497035.db2.gz	MHWWYVZMGOJMTF-OAHLLOKOSA-N	0	3	320.437	2.024	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@H](C)NC(=O)C[C@H](N)c1ccccc1	ZINC000119274655	527643952	/nfs/dbraw/zinc/64/39/52/527643952.db2.gz	CSQILHOZAOSYBT-SJCJKPOMSA-N	0	3	314.433	2.174	10	0		DEAEHN
CC(C)N1C[C@H](N[C@H](C)CS(=O)(=O)c2ccccc2)[C@@H](C)C1	ZINC000245921907	535266733	/nfs/dbraw/zinc/26/67/33/535266733.db2.gz	YAMUUOOIEFKCSK-UXLLHSPISA-N	0	3	324.490	2.167	10	0		DEAEHN
CCS(=O)(=O)CCCCCN1CC[C@]2(O)CCCC[C@H]2C1	ZINC000249115892	535621120	/nfs/dbraw/zinc/62/11/20/535621120.db2.gz	RWFVFYUVDOCMRO-JKSUJKDBSA-N	0	3	317.495	2.218	10	0		DEAEHN
CCS(=O)(=O)CCCCCN1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000190723916	535621549	/nfs/dbraw/zinc/62/15/49/535621549.db2.gz	RWFVFYUVDOCMRO-HZPDHXFCSA-N	0	3	317.495	2.218	10	0		DEAEHN
CC[C@@H](Cc1ccccc1)NC(=O)N1CCN2CCC[C@H]2C1	ZINC000247656069	535774693	/nfs/dbraw/zinc/77/46/93/535774693.db2.gz	YJMXPTGXHSBZGK-IRXDYDNUSA-N	0	3	301.434	2.497	10	0		DEAEHN
CCc1oc2ccccc2c1CN(C)C(=O)C1(N)CCOCC1	ZINC000261744107	535926738	/nfs/dbraw/zinc/92/67/38/535926738.db2.gz	DWRIHSKHDSAOJX-UHFFFAOYSA-N	0	3	316.401	2.462	10	0		DEAEHN
CN1CCC(NC(=O)N2CCc3[nH]c4ccccc4c3C2)CC1	ZINC000193137612	536340620	/nfs/dbraw/zinc/34/06/20/536340620.db2.gz	SIOVMTIMDWXMTP-UHFFFAOYSA-N	0	3	312.417	2.330	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)c2cnc[nH]2)[C@@H]1c1cccs1	ZINC000357219379	536364418	/nfs/dbraw/zinc/36/44/18/536364418.db2.gz	KXDBYVNUSVDRMS-SMDDNHRTSA-N	0	3	304.419	2.284	10	0		DEAEHN
COc1ccc(F)cc1C(=O)NCc1ccc2c(c1)CNC2	ZINC000188761135	536617160	/nfs/dbraw/zinc/61/71/60/536617160.db2.gz	APVGQJHYKZQDNN-UHFFFAOYSA-N	0	3	300.333	2.368	10	0		DEAEHN
Cc1ccccc1[C@@H]1C[C@@H]1C(=O)N[C@H](CO)CN1CCCCC1	ZINC000288183210	625490812	/nfs/dbraw/zinc/49/08/12/625490812.db2.gz	FANINWZVQUEUHE-SZMVWBNQSA-N	0	3	316.445	2.062	10	0		DEAEHN
COCC[C@H](N)C(=O)N(C)Cc1cccc(Cl)c1Cl	ZINC000052808245	625105228	/nfs/dbraw/zinc/10/52/28/625105228.db2.gz	HGHWEGQGEAPQSD-NSHDSACASA-N	0	3	305.205	2.316	10	0		DEAEHN
CN1CCC(N(C[C@@H]2CCOC2)C(=O)c2ccccc2)CC1	ZINC000075876384	625188163	/nfs/dbraw/zinc/18/81/63/625188163.db2.gz	BLWXYBCTOUBQKD-HNNXBMFYSA-N	0	3	302.418	2.260	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCC1([C@@H](O)c2ccccc2)CC1	ZINC000752348995	639174619	/nfs/dbraw/zinc/17/46/19/639174619.db2.gz	RHXRDFSFXJPNNF-IRXDYDNUSA-N	0	3	316.445	2.491	10	0		DEAEHN
Cn1ccnc1CN[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1	ZINC000321858189	640531897	/nfs/dbraw/zinc/53/18/97/640531897.db2.gz	DWASJXXLNJSWJD-JOCQHMNTSA-N	0	3	308.426	2.346	10	0		DEAEHN
CCNC(=O)N1CC[C@H](N[C@@H]2CCc3nc(Cl)ccc32)C1	ZINC000806148925	645803116	/nfs/dbraw/zinc/80/31/16/645803116.db2.gz	ZPAYBDGIERNDBD-CMPLNLGQSA-N	0	3	308.813	2.116	10	0		DEAEHN
COCCN(CCN(C)C)C(=O)/C=C(/C)c1cccc(F)c1	ZINC000732074724	647539500	/nfs/dbraw/zinc/53/95/00/647539500.db2.gz	RZHXCDABWPNZIR-OWBHPGMISA-N	0	3	308.397	2.266	10	0		DEAEHN
CCCC(=O)NCC(=O)O[C@H]1CCCN(Cc2ccccc2)C1	ZINC000183201456	649047231	/nfs/dbraw/zinc/04/72/31/649047231.db2.gz	OHRJKGOAKMMXCO-INIZCTEOSA-N	0	3	318.417	2.111	10	0		DEAEHN
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CCCC1	ZINC000184919382	649408619	/nfs/dbraw/zinc/40/86/19/649408619.db2.gz	IQJIDAPJVLUIOK-SEYXRHQNSA-N	0	3	303.362	2.210	10	0		DEAEHN
CC/C=C(/C)C(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000114415137	651951541	/nfs/dbraw/zinc/95/15/41/651951541.db2.gz	AXLAGRBSORAFFZ-UUASQNMZSA-N	0	3	316.449	2.148	10	0		DEAEHN
[O-]c1ccc(Cl)c(F)c1C[NH2+]C[C@@H](O)CN1CCCCC1	ZINC000190855386	684415478	/nfs/dbraw/zinc/41/54/78/684415478.db2.gz	ZHAHNAFWGKCXAJ-LLVKDONJSA-N	0	3	316.804	2.121	10	0		DEAEHN
O[C@H]1CCCC[C@H]1N1CCN(c2ncnc3sccc32)CC1	ZINC000270621842	685204476	/nfs/dbraw/zinc/20/44/76/685204476.db2.gz	OYNCUIKIVZZUGJ-KGLIPLIRSA-N	0	3	318.446	2.117	10	0		DEAEHN
Cc1nocc1CN1CC[C@H](Oc2ccnc(CN(C)C)c2)C1	ZINC000886029119	691987372	/nfs/dbraw/zinc/98/73/72/691987372.db2.gz	QVJINKIKGRYHMO-KRWDZBQOSA-N	0	3	316.405	2.093	10	0		DEAEHN
CC(C)[C@@H](CNCc1cncnc1)ONC(=O)OC(C)(C)C	ZINC000398770240	790291520	/nfs/dbraw/zinc/29/15/20/790291520.db2.gz	CBYRQXKKOYQASO-CYBMUJFWSA-N	0	3	310.398	2.047	10	0		DEAEHN
C[C@@H]1CC(CNCc2cn(C)nc2Br)C[C@@H](C)O1	ZINC000724264454	777269308	/nfs/dbraw/zinc/26/93/08/777269308.db2.gz	JSPUOIVUZNBPQE-NXEZZACHSA-N	0	3	316.243	2.476	10	0		DEAEHN
C[C@@H]1C[NH2+]C[C@H]1C[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000723785367	787345092	/nfs/dbraw/zinc/34/50/92/787345092.db2.gz	KVAJTWRNZZRJSS-BDAKNGLRSA-N	0	3	323.245	2.127	10	0		DEAEHN
CC1(C)CCNCCN1S(=O)(=O)c1cccc(Cl)c1	ZINC000712508716	792192033	/nfs/dbraw/zinc/19/20/33/792192033.db2.gz	ZZINOLNBLCEOIF-UHFFFAOYSA-N	0	3	302.827	2.103	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H](C)C2CC[NH2+]CC2)sc1Cl	ZINC000716550911	792973206	/nfs/dbraw/zinc/97/32/06/792973206.db2.gz	BUFQWAKMSRWMTG-VIFPVBQESA-N	0	3	322.883	2.376	10	0		DEAEHN
CCn1cc(CN[C@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)nn1	ZINC000404432360	802020791	/nfs/dbraw/zinc/02/07/91/802020791.db2.gz	OECXKLZYSASEBW-JSGCOSHPSA-N	0	3	323.441	2.033	10	0		DEAEHN
c1ccc2c(c1)OC[C@H](CNCc1ccc3c(c1)OCCO3)O2	ZINC000078371782	1080608010	/nfs/dbraw/zinc/60/80/10/1080608010.db2.gz	OMVATYQYJKQSLT-AWEZNQCLSA-N	0	3	313.353	2.387	10	0		DEAEHN
CN1CCC[C@H]2[C@H]1CCN2C(=O)c1ccc(Br)nc1	ZINC000720831665	1086194844	/nfs/dbraw/zinc/19/48/44/1086194844.db2.gz	WMBJZICQTOLZGB-NEPJUHHUSA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@@H](CNCc1nccn1C1CC1)CNC(=O)OC(C)(C)C	ZINC000711753147	1087195109	/nfs/dbraw/zinc/19/51/09/1087195109.db2.gz	UIZREXHJTUWNLJ-LBPRGKRZSA-N	0	3	308.426	2.468	10	0		DEAEHN
C[C@@H]1[C@@H](NCc2cnc3n2CCC3)CCN1C(=O)OC(C)(C)C	ZINC000719167954	1088889893	/nfs/dbraw/zinc/88/98/93/1088889893.db2.gz	NHCCBKWQQQQKBH-OCCSQVGLSA-N	0	3	320.437	2.317	10	0		DEAEHN
CC(C)CC[C@H](N)C(=O)NCCOC(F)(F)C(F)(F)F	ZINC000720235417	1089536248	/nfs/dbraw/zinc/53/62/48/1089536248.db2.gz	PCLHFNAMLZWIPG-QMMMGPOBSA-N	0	3	306.275	2.038	10	0		DEAEHN
CC(C)[C@@H](SCCS(C)(=O)=O)[C@@H](N)c1ccccc1	ZINC000081768788	192322469	/nfs/dbraw/zinc/32/24/69/192322469.db2.gz	DHCAEKVXLDKFKO-UONOGXRCSA-N	0	3	301.477	2.489	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(F)cc1F	ZINC000076686557	185031344	/nfs/dbraw/zinc/03/13/44/185031344.db2.gz	LWLBLTVNDZZHFU-GFCCVEGCSA-N	0	3	313.348	2.197	10	0		DEAEHN
Cn1nnnc1SC[C@@H](N)c1cccc(C(F)(F)F)c1	ZINC000081845363	192331601	/nfs/dbraw/zinc/33/16/01/192331601.db2.gz	RJJGDXGTOTZIDE-SECBINFHSA-N	0	3	303.313	2.021	10	0		DEAEHN
CCN[C@@H]1c2ccccc2C[C@@H]1Sc1nnnn1C1CC1	ZINC000081867476	192333202	/nfs/dbraw/zinc/33/32/02/192333202.db2.gz	LTVWNGOHKDGIMG-UONOGXRCSA-N	0	3	301.419	2.376	10	0		DEAEHN
CN[C@@H](CS(=O)(=O)c1ccc(Br)cc1)C1CC1	ZINC000081933343	192341070	/nfs/dbraw/zinc/34/10/70/192341070.db2.gz	LKDUQMUKIITORP-LBPRGKRZSA-N	0	3	318.236	2.221	10	0		DEAEHN
CCN[C@@H](C)CS(=O)(=O)c1ccc(Br)cc1	ZINC000081933671	192341304	/nfs/dbraw/zinc/34/13/04/192341304.db2.gz	RBKRLKPZCPFYQX-VIFPVBQESA-N	0	3	306.225	2.221	10	0		DEAEHN
Ic1ccc(CNCC2CCOCC2)o1	ZINC000082544319	185190938	/nfs/dbraw/zinc/19/09/38/185190938.db2.gz	WRGAJQOZHVJDFS-UHFFFAOYSA-N	0	3	321.158	2.400	10	0		DEAEHN
CC[C@]1(CO)CCCN(C(=O)N[C@@H](CC(C)C)CN(C)C)C1	ZINC000190286439	529420388	/nfs/dbraw/zinc/42/03/88/529420388.db2.gz	IFNWKXOQZWJHCG-RDJZCZTQSA-N	0	3	313.486	2.157	10	0		DEAEHN
Cc1cccc(OCCNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000173190333	282188871	/nfs/dbraw/zinc/18/88/71/282188871.db2.gz	WRQPVGRPABDGLX-CVEARBPZSA-N	0	3	319.449	2.498	10	0		DEAEHN
CCOC(=O)COC[C@@H](N)c1sc(C)cc1Br	ZINC000087646366	185229670	/nfs/dbraw/zinc/22/96/70/185229670.db2.gz	CRYADHRKMSCJOW-SECBINFHSA-N	0	3	322.224	2.399	10	0		DEAEHN
CCOCOc1c(Cl)cc(CNCCOC)cc1OC	ZINC000087888640	185234749	/nfs/dbraw/zinc/23/47/49/185234749.db2.gz	XDSBSISRUXZFRS-UHFFFAOYSA-N	0	3	303.786	2.457	10	0		DEAEHN
CS(=O)(=O)[C@H]1CCC[C@]1(CN)Nc1ccccc1Cl	ZINC000087915972	185237337	/nfs/dbraw/zinc/23/73/37/185237337.db2.gz	DYQIUKZHOARAMY-QWHCGFSZSA-N	0	3	302.827	2.047	10	0		DEAEHN
COc1ccc([C@H](CN)NC[C@@H]2CCCO2)c(Cl)c1OC	ZINC000087928374	185237771	/nfs/dbraw/zinc/23/77/71/185237771.db2.gz	KLWSVUSCUNMGSP-JQWIXIFHSA-N	0	3	314.813	2.126	10	0		DEAEHN
Cc1ccc([N-]S(=O)(=O)[C@H]2CC[NH2+]C2)cc1C(F)(F)F	ZINC000088056592	185238482	/nfs/dbraw/zinc/23/84/82/185238482.db2.gz	FGLHQCRMHFMRNZ-JTQLQIEISA-N	0	3	308.325	2.117	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@H]2CCCOc3ccccc32)C1	ZINC000170836041	282198204	/nfs/dbraw/zinc/19/82/04/282198204.db2.gz	MIRNVLIHXIOIRF-HIFRSBDPSA-N	0	3	303.406	2.246	10	0		DEAEHN
CCn1ccnc1CN1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190471070	529569827	/nfs/dbraw/zinc/56/98/27/529569827.db2.gz	OCENMCMEKXKHBP-KRWDZBQOSA-N	0	3	313.449	2.252	10	0		DEAEHN
C[C@@H](CN)S(=O)(=O)NC(c1ccccc1)c1ccccc1	ZINC000088472428	185252381	/nfs/dbraw/zinc/25/23/81/185252381.db2.gz	HEQGFRLPRZRJQZ-ZDUSSCGKSA-N	0	3	304.415	2.043	10	0		DEAEHN
CS(=O)(=O)c1ccccc1N1CCNCC12CCCCC2	ZINC000088396665	185248533	/nfs/dbraw/zinc/24/85/33/185248533.db2.gz	GQMRVZNTQVAUSW-UHFFFAOYSA-N	0	3	308.447	2.203	10	0		DEAEHN
CN(C)S(=O)(=O)c1ccc(CNC2(C)CCCCC2)o1	ZINC000088540577	185255623	/nfs/dbraw/zinc/25/56/23/185255623.db2.gz	DTGJPQLOSRLMGC-UHFFFAOYSA-N	0	3	300.424	2.342	10	0		DEAEHN
CCCN[C@@H]1c2ccccc2C[C@H]1S(=O)(=O)CCCOC	ZINC000081985399	192348914	/nfs/dbraw/zinc/34/89/14/192348914.db2.gz	HTOVQRYAHNLWFC-HZPDHXFCSA-N	0	3	311.447	2.103	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N[C@@H](C)CCC(C)C)o1	ZINC000088551094	185257629	/nfs/dbraw/zinc/25/76/29/185257629.db2.gz	UUUHIGUPMRKYRP-LBPRGKRZSA-N	0	3	302.440	2.492	10	0		DEAEHN
CCn1nccc1CNC1CCN(C(=O)c2ccccc2)CC1	ZINC000179007762	282210193	/nfs/dbraw/zinc/21/01/93/282210193.db2.gz	ISMLGPYJPOTXTB-UHFFFAOYSA-N	0	3	312.417	2.297	10	0		DEAEHN
CCN[C@@H](C[S@@](=O)CCCOC)c1cc(C)ccc1OC	ZINC000081998318	192352045	/nfs/dbraw/zinc/35/20/45/192352045.db2.gz	XVQWVPBZOYTMTL-YCRPNKLZSA-N	0	3	313.463	2.439	10	0		DEAEHN
CN[C@H]1COC[C@@H]1c1nc(-c2ccccc2Br)no1	ZINC000090423583	185295453	/nfs/dbraw/zinc/29/54/53/185295453.db2.gz	YPNHTPBCOZIYFH-ONGXEEELSA-N	0	3	324.178	2.201	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1c1nc(-c2ccc(Br)cc2)no1	ZINC000090423223	185295455	/nfs/dbraw/zinc/29/54/55/185295455.db2.gz	DVNRYDISQNTSBQ-WDEREUQCSA-N	0	3	324.178	2.201	10	0		DEAEHN
CSc1nc2ccc(NC(=O)[C@]3(C)COC[C@H]3N)cc2s1	ZINC000090586072	185305029	/nfs/dbraw/zinc/30/50/29/185305029.db2.gz	ADNVPOAWGCJTJV-BXUZGUMPSA-N	0	3	323.443	2.321	10	0		DEAEHN
CCCOc1ccc(NC(=O)[C@@]2(C)COC[C@H]2N)cc1Cl	ZINC000090590090	185305386	/nfs/dbraw/zinc/30/53/86/185305386.db2.gz	GZGIEFHJYZSYQN-HIFRSBDPSA-N	0	3	312.797	2.431	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)C1CCC(C(=O)OC)CC1	ZINC000179502510	282227470	/nfs/dbraw/zinc/22/74/70/282227470.db2.gz	KCNWJRDAOXJHPI-UYSNPLJNSA-N	0	3	324.465	2.347	10	0		DEAEHN
C[NH2+][C@H](C)c1ccc(S(=O)(=O)[N-]c2ccnc(C)c2)cc1	ZINC000092364738	185314097	/nfs/dbraw/zinc/31/40/97/185314097.db2.gz	AVEVVPAEFCCAMR-GFCCVEGCSA-N	0	3	305.403	2.471	10	0		DEAEHN
COCCNCC(=O)N(Cc1c(F)cccc1Cl)C1CC1	ZINC000092495747	185322245	/nfs/dbraw/zinc/32/22/45/185322245.db2.gz	QNFSSBXTISZNKR-UHFFFAOYSA-N	0	3	314.788	2.206	10	0		DEAEHN
CCCN[C@@H]1C(=O)Nc2cc(OCCN(C)C)c(Cl)cc21	ZINC000092770033	185339496	/nfs/dbraw/zinc/33/94/96/185339496.db2.gz	QDVLEZYUPKBMQT-AWEZNQCLSA-N	0	3	311.813	2.273	10	0		DEAEHN
CCCn1cc(CN[C@H]2C[C@H](OCC)C23CCOCC3)cn1	ZINC000185669217	282264795	/nfs/dbraw/zinc/26/47/95/282264795.db2.gz	NJMHMZRKDXSNEY-HOTGVXAUSA-N	0	3	307.438	2.357	10	0		DEAEHN
COCCc1nc(C)c([C@H](C)NCCn2cc(C)cn2)s1	ZINC000181436991	199296991	/nfs/dbraw/zinc/29/69/91/199296991.db2.gz	WKNBIYNACKQYSF-LBPRGKRZSA-N	0	3	308.451	2.496	10	0		DEAEHN
CCc1nn(C)c(CC)c1CN[C@H](COC)C1CCOCC1	ZINC000188273625	529766836	/nfs/dbraw/zinc/76/68/36/529766836.db2.gz	VPIJXGTWKMQBTJ-MRXNPFEDSA-N	0	3	309.454	2.076	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1c(F)ccc(OC)c1OC	ZINC000188537936	282304501	/nfs/dbraw/zinc/30/45/01/282304501.db2.gz	VSXFJWAEBIGEMU-GFCCVEGCSA-N	0	3	324.396	2.399	10	0		DEAEHN
CCN[C@H](C[C@H]1CCS(=O)(=O)C1)c1cc(C)ccc1OC	ZINC000097127618	185413489	/nfs/dbraw/zinc/41/34/89/185413489.db2.gz	WHXMTGZIZZHGDY-UKRRQHHQSA-N	0	3	311.447	2.479	10	0		DEAEHN
CCN(Cc1ccc(Cl)s1)C(=O)COC1(C)CNC1	ZINC000098060520	539435827	/nfs/dbraw/zinc/43/58/27/539435827.db2.gz	OOIJIWUFNXOPHP-UHFFFAOYSA-N	0	3	302.827	2.129	10	0		DEAEHN
CC(C)(C)OC(=O)NCCNCc1cc2ccccc2[nH]c1=O	ZINC000083454473	192370503	/nfs/dbraw/zinc/37/05/03/192370503.db2.gz	LKGWZAHSCLOVFT-UHFFFAOYSA-N	0	3	317.389	2.142	10	0		DEAEHN
NC(=O)NC(=O)CN[C@@H](CC1CCCCC1)c1ccccc1	ZINC000181829115	199358595	/nfs/dbraw/zinc/35/85/95/199358595.db2.gz	IQRAICQBYLVXSI-HNNXBMFYSA-N	0	3	303.406	2.483	10	0		DEAEHN
OC1(CNCc2ccc(I)o2)CCCC1	ZINC000083464199	192371025	/nfs/dbraw/zinc/37/10/25/192371025.db2.gz	BBYHDYYHPDKUMA-UHFFFAOYSA-N	0	3	321.158	2.279	10	0		DEAEHN
COc1cc(N)ccc1NC(=O)CCN1CCSC[C@H]1C	ZINC000070219022	190872666	/nfs/dbraw/zinc/87/26/66/190872666.db2.gz	KXJCWYCSOGWSHA-LLVKDONJSA-N	0	3	309.435	2.043	10	0		DEAEHN
NC1(C(=O)N2CCC[C@H](C(F)(F)F)C2)Cc2ccccc2C1	ZINC000178330549	539636165	/nfs/dbraw/zinc/63/61/65/539636165.db2.gz	JOLFIKCBMXYLNW-ZDUSSCGKSA-N	0	3	312.335	2.284	10	0		DEAEHN
CC[C@H]1CN(c2ncnc3c(C)cccc32)CCN1C[C@@H](C)O	ZINC000177929647	539633234	/nfs/dbraw/zinc/63/32/34/539633234.db2.gz	BPRIPESMJMOFLS-CABCVRRESA-N	0	3	314.433	2.220	10	0		DEAEHN
O=C1[C@@H](NC2CC2)CCN1c1ccc(F)cc1Br	ZINC000071038904	190931745	/nfs/dbraw/zinc/93/17/45/190931745.db2.gz	TVVOTLUOUINTHE-NSHDSACASA-N	0	3	313.170	2.446	10	0		DEAEHN
CC[C@@H](C)N1CCN(Cc2ccc(F)cc2C(N)=S)CC1	ZINC000071266245	190949292	/nfs/dbraw/zinc/94/92/92/190949292.db2.gz	NGFLSHAZZKWNCD-GFCCVEGCSA-N	0	3	309.454	2.376	10	0		DEAEHN
N[C@@H](C[S@@](=O)c1ccccc1F)c1ccc2c(c1)OCO2	ZINC000084001287	192395574	/nfs/dbraw/zinc/39/55/74/192395574.db2.gz	BRLNHKWOLWZPJZ-QKVFXAPYSA-N	0	3	307.346	2.362	10	0		DEAEHN
CC(C)(C)c1ccc2c(c1)[C@H](CN)N(CCN1CCOCC1)C2	ZINC000071683788	191007466	/nfs/dbraw/zinc/00/74/66/191007466.db2.gz	ZJQJASSLAOUWFV-SFHVURJKSA-N	0	3	317.477	2.132	10	0		DEAEHN
COc1ccc(Cl)c2c1CN(C1CCC(O)CC1)[C@@H]2CN	ZINC000071684020	191008249	/nfs/dbraw/zinc/00/82/49/191008249.db2.gz	RLBOEZCIIQSDOY-QIMFLAQGSA-N	0	3	310.825	2.468	10	0		DEAEHN
Cn1ccnc1CN1Cc2ccc(C(F)(F)F)cc2[C@H]1CN	ZINC000071684069	191008864	/nfs/dbraw/zinc/00/88/64/191008864.db2.gz	WJZAVCDGMSAPKL-CYBMUJFWSA-N	0	3	310.323	2.455	10	0		DEAEHN
Nc1ncccc1C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000071700380	191010322	/nfs/dbraw/zinc/01/03/22/191010322.db2.gz	LLQUXNOBXXOGGU-UHFFFAOYSA-N	0	3	310.401	2.058	10	0		DEAEHN
CCCNCc1cc(F)c(F)c(S(=O)(=O)N(C)CCC)c1	ZINC000138454371	186017030	/nfs/dbraw/zinc/01/70/30/186017030.db2.gz	DJDXLZJSQNPZKH-UHFFFAOYSA-N	0	3	320.405	2.495	10	0		DEAEHN
C[C@H](N(C)S(=O)(=O)c1cc(CN)cc(F)c1F)C(C)(C)C	ZINC000138829121	186019004	/nfs/dbraw/zinc/01/90/04/186019004.db2.gz	KZFGYZXXDFNJES-VIFPVBQESA-N	0	3	320.405	2.479	10	0		DEAEHN
C[C@@H]1CCCN(S(=O)(=O)c2cc(CN)cc(F)c2F)CC1	ZINC000139068295	186019729	/nfs/dbraw/zinc/01/97/29/186019729.db2.gz	FSGIPWRJYYCHAY-SNVBAGLBSA-N	0	3	318.389	2.234	10	0		DEAEHN
C[C@@]1(c2nc(-c3ccc(Br)cn3)no2)CCCN1	ZINC000139790852	186024155	/nfs/dbraw/zinc/02/41/55/186024155.db2.gz	LTDQYNQBQGNSQR-LBPRGKRZSA-N	0	3	309.167	2.493	10	0		DEAEHN
CC(C)[C@H]1N[C@H](c2cccs2)N(C2CCN(C)CC2)C1=O	ZINC000141216422	186029488	/nfs/dbraw/zinc/02/94/88/186029488.db2.gz	MVJSHPJQUVDKGF-CABCVRRESA-N	0	3	307.463	2.297	10	0		DEAEHN
CCNc1ncc(Br)c(OC2CCN(C)CC2)n1	ZINC000148113289	186043225	/nfs/dbraw/zinc/04/32/25/186043225.db2.gz	ZTYVDTXOSFBLQJ-UHFFFAOYSA-N	0	3	315.215	2.144	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@@H](C)C(=O)N2C[C@@H]2CCCCN2C)s1	ZINC000144330271	186034935	/nfs/dbraw/zinc/03/49/35/186034935.db2.gz	FULWTAVEWPYHFZ-KCQAQPDRSA-N	0	3	307.463	2.360	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N(C)C2CCC2)cc(C)c1F	ZINC000144636532	186035766	/nfs/dbraw/zinc/03/57/66/186035766.db2.gz	WCLUIYUDPMEAAH-UHFFFAOYSA-N	0	3	314.426	2.417	10	0		DEAEHN
C[C@H](O)C(C)(C)NCC(=O)Nc1cccc(Br)c1	ZINC000145022424	186036450	/nfs/dbraw/zinc/03/64/50/186036450.db2.gz	SWZCBBYTDHMBHO-VIFPVBQESA-N	0	3	315.211	2.137	10	0		DEAEHN
CCN[C@H](c1ccc(Cl)c(OC)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000150147418	186054911	/nfs/dbraw/zinc/05/49/11/186054911.db2.gz	FIDPZPIVEIPWIZ-BXUZGUMPSA-N	0	3	317.838	2.434	10	0		DEAEHN
CN[C@H]1CC(C)(C)Cc2nc([C@H]3CCS(=O)(=O)C3)sc21	ZINC000150259389	186055976	/nfs/dbraw/zinc/05/59/76/186055976.db2.gz	DOVWKPQUHNUXDT-UWVGGRQHSA-N	0	3	314.476	2.278	10	0		DEAEHN
CC(C)Oc1ncccc1NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171890227	198002303	/nfs/dbraw/zinc/00/23/03/198002303.db2.gz	BYCFHFWTTCPHIB-CYBMUJFWSA-N	0	3	304.394	2.181	10	0		DEAEHN
COCCOc1ccc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1	ZINC000172058207	198032731	/nfs/dbraw/zinc/03/27/31/198032731.db2.gz	RPKSANWGWUISAN-GOEBONIOSA-N	0	3	318.417	2.021	10	0		DEAEHN
CN(C)Cc1csc(CN2CCC[C@@]3(CN(C)C(=O)O3)C2)c1	ZINC000072432372	191165003	/nfs/dbraw/zinc/16/50/03/191165003.db2.gz	YOUFHOOFGHZSLZ-MRXNPFEDSA-N	0	3	323.462	2.226	10	0		DEAEHN
CCc1ccc([C@@H]2CCCCN2CCC(=O)NC(=O)NC)o1	ZINC000172871225	198159879	/nfs/dbraw/zinc/15/98/79/198159879.db2.gz	FWVBKUYXSRCFSW-ZDUSSCGKSA-N	0	3	307.394	2.215	10	0		DEAEHN
COc1cccc(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000173188274	198193447	/nfs/dbraw/zinc/19/34/47/198193447.db2.gz	IBPFTBGWEVHBRF-HIFRSBDPSA-N	0	3	305.422	2.319	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)Nc2nc3c(s2)COCC3)CCN1C	ZINC000173241805	198199544	/nfs/dbraw/zinc/19/95/44/198199544.db2.gz	AIFWJLKJJIQWKO-QWRGUYRKSA-N	0	3	324.450	2.162	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCCCNc2ccccn2)CCN1C	ZINC000173955108	198272872	/nfs/dbraw/zinc/27/28/72/198272872.db2.gz	HHFWIJJOOFECOF-GJZGRUSLSA-N	0	3	319.453	2.008	10	0		DEAEHN
COCc1ccc(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1	ZINC000173810984	198255122	/nfs/dbraw/zinc/25/51/22/198255122.db2.gz	FULLKBGBODEYDT-PBHICJAKSA-N	0	3	319.449	2.457	10	0		DEAEHN
COCc1cccc(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000173813598	198255698	/nfs/dbraw/zinc/25/56/98/198255698.db2.gz	PJEGUFAZTABUIY-PBHICJAKSA-N	0	3	319.449	2.457	10	0		DEAEHN
COc1ccc(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1F	ZINC000174004249	198279412	/nfs/dbraw/zinc/27/94/12/198279412.db2.gz	IVLVLRWPPFJEIT-OCCSQVGLSA-N	0	3	323.412	2.458	10	0		DEAEHN
O=C(NCCc1c(F)cccc1F)N1CC[C@H](N2CC=CC2)C1	ZINC000174131650	198295783	/nfs/dbraw/zinc/29/57/83/198295783.db2.gz	KFUDXDRRZJQKGI-ZDUSSCGKSA-N	0	3	321.371	2.163	10	0		DEAEHN
C[C@@H](CC(=O)N1CC[C@@H](N(C)C)C1)C(=O)c1cccc(F)c1	ZINC000174584724	198355509	/nfs/dbraw/zinc/35/55/09/198355509.db2.gz	KJNVKYBEKMQTET-SWLSCSKDSA-N	0	3	306.381	2.197	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc(OC(F)F)c(OC)c1	ZINC000175850451	198516787	/nfs/dbraw/zinc/51/67/87/198516787.db2.gz	PKJWRNVXMQYCOW-OAHLLOKOSA-N	0	3	319.348	2.174	10	0		DEAEHN
CCCN(C)CC(=O)N[C@@H](C)Cc1ccc(OC)c(OC)c1	ZINC000359311831	535249691	/nfs/dbraw/zinc/24/96/91/535249691.db2.gz	NJVDIKDOTAZLMT-ZDUSSCGKSA-N	0	3	308.422	2.093	10	0		DEAEHN
COc1cc2c(cc1OC)[C@@H](CC(=O)NCC(C)C)NCC2	ZINC000041536464	354175396	/nfs/dbraw/zinc/17/53/96/354175396.db2.gz	KRHHHZOJKIVSRB-CQSZACIVSA-N	0	3	306.406	2.053	10	0		DEAEHN
CN1CCO[C@H](CN[C@@H]2CC3(CCC3)Oc3ccccc32)C1	ZINC000180501252	283024981	/nfs/dbraw/zinc/02/49/81/283024981.db2.gz	LGKLUTUVDXKYLE-GDBMZVCRSA-N	0	3	302.418	2.353	10	0		DEAEHN
CN1CCN(CCCNC(=O)c2cccc3ccccc32)CC1	ZINC000061523684	354627177	/nfs/dbraw/zinc/62/71/77/354627177.db2.gz	PDWIWMBXANQECR-UHFFFAOYSA-N	0	3	311.429	2.207	10	0		DEAEHN
CCN1C[C@@H](C)[C@@H](NCc2ncc(Br)s2)C1	ZINC000390481849	540133297	/nfs/dbraw/zinc/13/32/97/540133297.db2.gz	NDZZKMZJKKEINN-BDAKNGLRSA-N	0	3	304.257	2.335	10	0		DEAEHN
CCN1C[C@H](C)[C@H](NCc2ncc(Br)s2)C1	ZINC000390481850	540133407	/nfs/dbraw/zinc/13/34/07/540133407.db2.gz	NDZZKMZJKKEINN-DTWKUNHWSA-N	0	3	304.257	2.335	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)N[C@@H](C)[C@@H]2CCCO2)o1	ZINC000079620051	355322148	/nfs/dbraw/zinc/32/21/48/355322148.db2.gz	OUMGWUZITRMJJB-HOCLYGCPSA-N	0	3	323.437	2.229	10	0		DEAEHN
CC[C@H]1Nc2cc(OC)ccc2N(CCN2CCCC2)C1=O	ZINC000075274770	191454013	/nfs/dbraw/zinc/45/40/13/191454013.db2.gz	OUZOHFMNGXTGME-CQSZACIVSA-N	0	3	303.406	2.328	10	0		DEAEHN
Cc1nnc(NC(=O)c2ccccc2OCCN(C)C)s1	ZINC000080327574	355357095	/nfs/dbraw/zinc/35/70/95/355357095.db2.gz	MZPYCSMOSHAICM-UHFFFAOYSA-N	0	3	306.391	2.039	10	0		DEAEHN
NC[C@@H](NC(=O)c1csc(Br)c1)C(F)(F)F	ZINC000401750537	540142436	/nfs/dbraw/zinc/14/24/36/540142436.db2.gz	NJXXLTULYQTECU-RXMQYKEDSA-N	0	3	317.130	2.130	10	0		DEAEHN
C[C@H](CNC(=O)N[C@@H](C)c1ccc2c(c1)OCO2)N(C)C1CC1	ZINC000105100116	355719355	/nfs/dbraw/zinc/71/93/55/355719355.db2.gz	XBPZVQBMDBKGLK-NEPJUHHUSA-N	0	3	319.405	2.258	10	0		DEAEHN
CCN(CCNC(=O)N1CC[C@@H](N(C)C)C1)c1cccc(C)c1	ZINC000170863159	355994027	/nfs/dbraw/zinc/99/40/27/355994027.db2.gz	LHWUOOCGCUBCNE-QGZVFWFLSA-N	0	3	318.465	2.167	10	0		DEAEHN
CCCC1CCC(CN2CC[C@@H](NS(C)(=O)=O)C2)CC1	ZINC000180333150	356048157	/nfs/dbraw/zinc/04/81/57/356048157.db2.gz	WVFGDYAEEKKGOW-YMAMQOFZSA-N	0	3	302.484	2.216	10	0		DEAEHN
CNc1cc(N2CCC[C@@H]2CN[C@@H](C)c2ccoc2)ncn1	ZINC000180572814	356053251	/nfs/dbraw/zinc/05/32/51/356053251.db2.gz	OUEDEORRBBDWRD-GXTWGEPZSA-N	0	3	301.394	2.431	10	0		DEAEHN
CC1(C)CCc2ccccc2[C@H]1NCC(=O)NC(=O)NC1CC1	ZINC000183212111	356163155	/nfs/dbraw/zinc/16/31/55/356163155.db2.gz	DRASDFSYRLMVIF-MRXNPFEDSA-N	0	3	315.417	2.278	10	0		DEAEHN
C[C@H](CN[C@@H](C)c1cccc(-n2cccn2)c1)CS(C)(=O)=O	ZINC000183594661	356176755	/nfs/dbraw/zinc/17/67/55/356176755.db2.gz	JMCKXVNBCFJCCL-KGLIPLIRSA-N	0	3	321.446	2.204	10	0		DEAEHN
CC[C@@H](C)N1CCN(C[C@@H](C(N)=S)c2ccccc2)CC1	ZINC000080797690	192192060	/nfs/dbraw/zinc/19/20/60/192192060.db2.gz	FTZHULBHXQHDCN-GDBMZVCRSA-N	0	3	305.491	2.472	10	0		DEAEHN
NC[C@@H]1c2ccccc2CCN1C(=O)c1ccc(Cl)cn1	ZINC000227721236	356280470	/nfs/dbraw/zinc/28/04/70/356280470.db2.gz	YOTWINWLEJJGDF-OAHLLOKOSA-N	0	3	301.777	2.433	10	0		DEAEHN
COC[C@H]1CCN(c2nc3sccn3c2CNC2CC2)C1	ZINC000081072612	192222161	/nfs/dbraw/zinc/22/21/61/192222161.db2.gz	CICQGHNJNDQPHX-NSHDSACASA-N	0	3	306.435	2.121	10	0		DEAEHN
C[C@H](N[C@@H]1CC[C@H]1O)c1ccc(I)cc1	ZINC000382201768	356674670	/nfs/dbraw/zinc/67/46/70/356674670.db2.gz	FGFPNZAFRMAXDZ-XXILOJSOSA-N	0	3	317.170	2.465	10	0		DEAEHN
COCC[C@](C)(O)CNCc1ccsc1Br	ZINC000388728829	356706423	/nfs/dbraw/zinc/70/64/23/356706423.db2.gz	CLRKSMKZXUBRET-NSHDSACASA-N	0	3	308.241	2.388	10	0		DEAEHN
COC(=O)c1cnc(NC[C@@H](C)N(C)Cc2ccccc2)cn1	ZINC000390675742	356710071	/nfs/dbraw/zinc/71/00/71/356710071.db2.gz	XLOCMPLDGPGTGK-CYBMUJFWSA-N	0	3	314.389	2.196	10	0		DEAEHN
c1cn([C@@H]2CCCN(CCN3CCCc4ccccc43)C2)nn1	ZINC000578621059	356846042	/nfs/dbraw/zinc/84/60/42/356846042.db2.gz	HYMNXHSQPIZHJI-QGZVFWFLSA-N	0	3	311.433	2.368	10	0		DEAEHN
CNCc1ccccc1S(=O)(=O)N(C)Cc1ccc(C)o1	ZINC000088955563	192667118	/nfs/dbraw/zinc/66/71/18/192667118.db2.gz	BFDXFLUEUMIRQJ-UHFFFAOYSA-N	0	3	308.403	2.128	10	0		DEAEHN
COCc1cccc(CN2CCC[C@@H](Cn3cncn3)C2)c1	ZINC000179224986	199001205	/nfs/dbraw/zinc/00/12/05/199001205.db2.gz	WTMODYQTZRESRL-QGZVFWFLSA-N	0	3	300.406	2.337	10	0		DEAEHN
C[C@@H]1CN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CCCO1	ZINC000179462191	199040062	/nfs/dbraw/zinc/04/00/62/199040062.db2.gz	VREATRBVZSKXNX-DJIMGWMZSA-N	0	3	317.433	2.252	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(C(=O)OC(C)(C)C)cc2)C1	ZINC000180145397	199123293	/nfs/dbraw/zinc/12/32/93/199123293.db2.gz	RFJQTPMHXKZXIF-OAHLLOKOSA-N	0	3	318.417	2.418	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cc(CC(C)C)[nH]c(=O)c2)C1	ZINC000180278878	199140808	/nfs/dbraw/zinc/14/08/08/199140808.db2.gz	UBWVJOCSLDOZHF-AWEZNQCLSA-N	0	3	305.422	2.200	10	0		DEAEHN
C[C@@H](NCC(=O)NC(C)(C)C)c1cccc(-n2ccnc2)c1	ZINC000180677271	199195108	/nfs/dbraw/zinc/19/51/08/199195108.db2.gz	UEUDPYUMFCXOLJ-CYBMUJFWSA-N	0	3	300.406	2.438	10	0		DEAEHN
CCCCNC(=O)CN[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000180659342	199192347	/nfs/dbraw/zinc/19/23/47/199192347.db2.gz	GBIMTKFOAUNTEO-AWEZNQCLSA-N	0	3	300.406	2.439	10	0		DEAEHN
CN(C[C@@H](O)CO[C@@H]1CCCc2ccccc21)CC1(CO)CC1	ZINC000186806208	200013965	/nfs/dbraw/zinc/01/39/65/200013965.db2.gz	CQQWHJLLOODART-SJLPKXTDSA-N	0	3	319.445	2.146	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)NCc1cc(F)ccc1OC	ZINC000187259172	200085355	/nfs/dbraw/zinc/08/53/55/200085355.db2.gz	FNZWJRACTYGQHP-AWEZNQCLSA-N	0	3	309.385	2.118	10	0		DEAEHN
CN(C[C@@H](O)COCc1ccc(Cl)cc1)C[C@@H]1CCCO1	ZINC000187811634	200160918	/nfs/dbraw/zinc/16/09/18/200160918.db2.gz	QKWNDSAGQPDFLH-CVEARBPZSA-N	0	3	313.825	2.328	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000187889623	200172323	/nfs/dbraw/zinc/17/23/23/200172323.db2.gz	GAOGQMYHCVZMEZ-WFASDCNBSA-N	0	3	323.412	2.458	10	0		DEAEHN
C[C@H]1CC[C@@](CO)(N(C)CC(=O)N2CCc3ccccc3C2)C1	ZINC000187902927	200174138	/nfs/dbraw/zinc/17/41/38/200174138.db2.gz	HKSHTXJNCVOVGP-HNAYVOBHSA-N	0	3	316.445	2.054	10	0		DEAEHN
Cc1cc(C(F)(F)F)ccc1CN1CC[C@@H](NC(N)=O)C1	ZINC000443663787	238119915	/nfs/dbraw/zinc/11/99/15/238119915.db2.gz	YXXPCMGZISUGHP-GFCCVEGCSA-N	0	3	301.312	2.256	10	0		DEAEHN
O=C(Nc1ccc2nccn2c1)N1CC[C@@H](N2CCCCC2)C1	ZINC000606582646	361023565	/nfs/dbraw/zinc/02/35/65/361023565.db2.gz	YCFMNFAVJNDZKY-OAHLLOKOSA-N	0	3	313.405	2.426	10	0		DEAEHN
C[C@@H](C(=O)Nc1cnn(CCN(C)C)c1)c1cccc(F)c1	ZINC000607821311	361114084	/nfs/dbraw/zinc/11/40/84/361114084.db2.gz	SIOMIMJKSXHTSX-GFCCVEGCSA-N	0	3	304.369	2.326	10	0		DEAEHN
CN(C[C@H]1CCCN(C)C1)C(=O)Nc1ccc2nccn2c1	ZINC000608313839	361196350	/nfs/dbraw/zinc/19/63/50/361196350.db2.gz	OJTFLHIPVAKMFM-ZDUSSCGKSA-N	0	3	301.394	2.140	10	0		DEAEHN
C[C@H]1CCNC(=O)[C@H]1NCc1ccc(SC(=O)N(C)C)cc1	ZINC000193635539	201092530	/nfs/dbraw/zinc/09/25/30/201092530.db2.gz	LQSKTXNBPINNBC-FZMZJTMJSA-N	0	3	321.446	2.075	10	0		DEAEHN
COC(=O)CCCN[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000611405697	361593722	/nfs/dbraw/zinc/59/37/22/361593722.db2.gz	IDTAMELGFFCEMM-HNNXBMFYSA-N	0	3	307.390	2.470	10	0		DEAEHN
CCN(C)C(=O)CCN[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000611406207	361594011	/nfs/dbraw/zinc/59/40/11/361594011.db2.gz	VVKSDFGTOMRGRX-MRXNPFEDSA-N	0	3	320.433	2.385	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCC[C@H](C(C)(C)C(=O)OC)C1	ZINC000611311385	361578145	/nfs/dbraw/zinc/57/81/45/361578145.db2.gz	MBYAKEMCVACQFM-LSDHHAIUSA-N	0	3	324.465	2.299	10	0		DEAEHN
Cc1cccnc1C(F)(F)C(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000194607153	201262467	/nfs/dbraw/zinc/26/24/67/201262467.db2.gz	PIXJLJGPJXVFCF-STQMWFEESA-N	0	3	309.360	2.177	10	0		DEAEHN
CCCCOC[C@H](O)CN(CCO)[C@@H]1CCc2ccccc21	ZINC000195181450	201355650	/nfs/dbraw/zinc/35/56/50/201355650.db2.gz	ZYESPLNCWRWDIQ-SJLPKXTDSA-N	0	3	307.434	2.146	10	0		DEAEHN
O=C(C1CCN(C2CC2)CC1)N1CCC(=O)Nc2ccccc21	ZINC000192557425	283757350	/nfs/dbraw/zinc/75/73/50/283757350.db2.gz	TXSAMVPBFJZRDB-UHFFFAOYSA-N	0	3	313.401	2.236	10	0		DEAEHN
C[C@H](C1CC1)N(CC(F)(F)F)C(=O)C[C@@H]1CSCCN1	ZINC000091135895	193000535	/nfs/dbraw/zinc/00/05/35/193000535.db2.gz	TYSOLLSDLVNOCH-MWLCHTKSSA-N	0	3	310.385	2.271	10	0		DEAEHN
CN1CCOC[C@@H]1CNCc1cccc(Br)c1F	ZINC000623713241	365140878	/nfs/dbraw/zinc/14/08/78/365140878.db2.gz	WDESXWWUHDJDMX-NSHDSACASA-N	0	3	317.202	2.008	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1ccc(Br)nc1	ZINC000091448524	193057896	/nfs/dbraw/zinc/05/78/96/193057896.db2.gz	GWSUWMKCBTXXJD-NSHDSACASA-N	0	3	312.211	2.010	10	0		DEAEHN
CN(Cc1cccc(Br)c1)c1cncc(CN)n1	ZINC000091420511	193054431	/nfs/dbraw/zinc/05/44/31/193054431.db2.gz	YTSRNFCCEASSTI-UHFFFAOYSA-N	0	3	307.195	2.334	10	0		DEAEHN
C[C@@H](CN1CCOCC1)N1CCC(Nc2ccccc2F)CC1	ZINC000091514647	193067568	/nfs/dbraw/zinc/06/75/68/193067568.db2.gz	FAXZTAULZLHODW-HNNXBMFYSA-N	0	3	321.440	2.423	10	0		DEAEHN
COCCN(C)[C@@H](CN)c1ccc(Br)c(C)c1	ZINC000091470756	193059982	/nfs/dbraw/zinc/05/99/82/193059982.db2.gz	BMXAPCFILAQHFV-ZDUSSCGKSA-N	0	3	301.228	2.336	10	0		DEAEHN
Nc1nc2cccc(Cl)c2n1C[C@@H]1CN2CCC[C@@H]2CO1	ZINC000091675118	193089383	/nfs/dbraw/zinc/08/93/83/193089383.db2.gz	HQVBRXYZCCSKQJ-MNOVXSKESA-N	0	3	306.797	2.135	10	0		DEAEHN
O=C(NC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)N1CC[C@@H](N2CC=CC2)C1	ZINC000247410424	283987240	/nfs/dbraw/zinc/98/72/40/283987240.db2.gz	JJHSVJJJHATQKZ-LULLPPNCSA-N	0	3	323.440	2.228	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)s1	ZINC000092113935	193161064	/nfs/dbraw/zinc/16/10/64/193161064.db2.gz	GRIOHAXXWLTMNR-GHMZBOCLSA-N	0	3	302.465	2.134	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)c(C)s1	ZINC000092113750	193161289	/nfs/dbraw/zinc/16/12/89/193161289.db2.gz	MHSTZVIYQVEZGK-GHMZBOCLSA-N	0	3	316.492	2.443	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@@H](C)CC)c(F)c1	ZINC000092115796	193162922	/nfs/dbraw/zinc/16/29/22/193162922.db2.gz	VJELWCQPKSWSOQ-NSHDSACASA-N	0	3	302.415	2.402	10	0		DEAEHN
NCc1ccc(S(=O)(=O)N2CCc3ccccc32)c(F)c1	ZINC000092115530	193163102	/nfs/dbraw/zinc/16/31/02/193163102.db2.gz	IVAYZTQGZJCLBT-UHFFFAOYSA-N	0	3	306.362	2.036	10	0		DEAEHN
O=S(=O)(c1ccc(CNC2CC2)cc1F)N1CCCCC1	ZINC000092115542	193163508	/nfs/dbraw/zinc/16/35/08/193163508.db2.gz	DGXGGXQCVCPDAB-UHFFFAOYSA-N	0	3	312.410	2.252	10	0		DEAEHN
C[C@H]1CCC[C@@H](N(C)S(=O)(=O)c2ccc(CN)cc2F)C1	ZINC000092115915	193164635	/nfs/dbraw/zinc/16/46/35/193164635.db2.gz	CXZHYXCBNDTAMZ-WCQYABFASA-N	0	3	314.426	2.484	10	0		DEAEHN
O[C@H]1COCC[C@@H]1NCc1cccc(Br)c1Cl	ZINC000631182961	368067274	/nfs/dbraw/zinc/06/72/74/368067274.db2.gz	GPQZPKKOEZKMPE-QWRGUYRKSA-N	0	3	320.614	2.342	10	0		DEAEHN
c1c(CNC[C@@H]2CC3CCC2CC3)nnn1C[C@H]1CCOC1	ZINC000631166519	368057010	/nfs/dbraw/zinc/05/70/10/368057010.db2.gz	VGRKCDOTKWQUOB-KNIAUWFNSA-N	0	3	304.438	2.231	10	0		DEAEHN
COC(=O)[C@H](C)Oc1ccc(CN2CCC([C@H](C)O)CC2)cc1	ZINC000092970847	193190800	/nfs/dbraw/zinc/19/08/00/193190800.db2.gz	HBEGWPGRHCNLIW-KBPBESRZSA-N	0	3	321.417	2.220	10	0		DEAEHN
C[C@@H](NC[C@H](C)N1CCOCC1)c1ccc(F)cc1N(C)C	ZINC000123468733	296131261	/nfs/dbraw/zinc/13/12/61/296131261.db2.gz	YNSMASNFZLCMQJ-UONOGXRCSA-N	0	3	309.429	2.263	10	0		DEAEHN
CN[C@H](Cc1ccc(F)cc1Br)C(OC)OC	ZINC000093304908	193227775	/nfs/dbraw/zinc/22/77/75/193227775.db2.gz	PDWBAJMPCNCWOS-LLVKDONJSA-N	0	3	306.175	2.338	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2sc3cccc(F)c3c2N)C1	ZINC000093412227	193245512	/nfs/dbraw/zinc/24/55/12/193245512.db2.gz	MERAVZHLXNMENQ-VIFPVBQESA-N	0	3	307.394	2.399	10	0		DEAEHN
C[C@H](C[C@H]1CCC[NH2+]1)Nc1ccc(F)c([N-]S(C)(=O)=O)c1	ZINC000093464392	193255834	/nfs/dbraw/zinc/25/58/34/193255834.db2.gz	LILCWTLGWZGFQY-GHMZBOCLSA-N	0	3	315.414	2.140	10	0		DEAEHN
CC(C)c1ccc([C@@H](O)CNCC(C)(C)S(C)(=O)=O)cc1	ZINC000093519989	193263445	/nfs/dbraw/zinc/26/34/45/193263445.db2.gz	BDVKZIOIRRUTHJ-HNNXBMFYSA-N	0	3	313.463	2.256	10	0		DEAEHN
[NH3+][C@@]1(C(=O)[O-])CCC[C@@H]1CCN1CCC(C(F)(F)F)CC1	ZINC000093596143	193271920	/nfs/dbraw/zinc/27/19/20/193271920.db2.gz	SPRWFZKVWVBDTA-MFKMUULPSA-N	0	3	308.344	2.233	10	0		DEAEHN
C[C@H](NC[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1F	ZINC000093696617	193292021	/nfs/dbraw/zinc/29/20/21/193292021.db2.gz	XYYOYEPISARAOK-STQMWFEESA-N	0	3	314.426	2.148	10	0		DEAEHN
CC[C@H](CO)N1CCN(Cc2ccc(Cl)c(F)c2)CC1	ZINC000093740406	193298674	/nfs/dbraw/zinc/29/86/74/193298674.db2.gz	JWRASQPKOAJUCI-CYBMUJFWSA-N	0	3	300.805	2.368	10	0		DEAEHN
COC(=O)[C@@]1(N)CCC[C@@H](N2CCC(C(F)(F)F)CC2)C1	ZINC000093756683	193301053	/nfs/dbraw/zinc/30/10/53/193301053.db2.gz	IPISGOAFRIKOGT-DGCLKSJQSA-N	0	3	308.344	2.074	10	0		DEAEHN
COC(=O)[C@]1(N)CCC[C@@H](N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000093756640	193301291	/nfs/dbraw/zinc/30/12/91/193301291.db2.gz	UZILLEWMBMZCBN-LOWVWBTDSA-N	0	3	308.344	2.074	10	0		DEAEHN
CCCN[C@]1(C(=O)OC)CC[C@@H](N(C)CCC(F)(F)F)C1	ZINC000093831864	193314585	/nfs/dbraw/zinc/31/45/85/193314585.db2.gz	GOLDLXKAIDQKKJ-DGCLKSJQSA-N	0	3	310.360	2.335	10	0		DEAEHN
CN[C@@H](Cc1c(Cl)cccc1Cl)[C@H]1CN(C)CCN1C	ZINC000093894845	193325447	/nfs/dbraw/zinc/32/54/47/193325447.db2.gz	QOKTVIFXVJWRFI-LSDHHAIUSA-N	0	3	316.276	2.370	10	0		DEAEHN
CN[C@@H](c1ccccc1C(F)(F)F)[C@@H]1CN(C)CCN1C	ZINC000093894703	193325663	/nfs/dbraw/zinc/32/56/63/193325663.db2.gz	QACYFNSDJBGOEE-KBPBESRZSA-N	0	3	301.356	2.212	10	0		DEAEHN
CCNCc1cc(F)c(OCCCS(=O)(=O)CC)c(F)c1	ZINC000094346964	193363398	/nfs/dbraw/zinc/36/33/98/193363398.db2.gz	RJASWSQHFLTDOT-UHFFFAOYSA-N	0	3	321.389	2.278	10	0		DEAEHN
CNCc1cc(C)ccc1O[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094634523	193385829	/nfs/dbraw/zinc/38/58/29/193385829.db2.gz	VGEDMOJIUOFAKA-GJZGRUSLSA-N	0	3	311.447	2.449	10	0		DEAEHN
CC(C)(C)NCc1cnn([C@@H]2CCC[C@@H](S(C)(=O)=O)C2)c1	ZINC000094644011	193389728	/nfs/dbraw/zinc/38/97/28/193389728.db2.gz	ILHXQKOQNVHOER-ZIAGYGMSSA-N	0	3	313.467	2.300	10	0		DEAEHN
CN1CCCC[C@H]1CNc1nc2ccc(Br)cn2n1	ZINC000094604870	193383875	/nfs/dbraw/zinc/38/38/75/193383875.db2.gz	GORNUBLJCBWVMY-NSHDSACASA-N	0	3	324.226	2.388	10	0		DEAEHN
CNCc1ccccc1S(=O)(=O)NCc1cscc1C	ZINC000094887035	193405127	/nfs/dbraw/zinc/40/51/27/193405127.db2.gz	RGUGYEKRIVLRGS-UHFFFAOYSA-N	0	3	310.444	2.254	10	0		DEAEHN
CCN(CC)CCN[C@](C)(CO)c1cc(F)c(C)cc1F	ZINC000094738224	193394246	/nfs/dbraw/zinc/39/42/46/193394246.db2.gz	FKZOBZMWDWOXEB-MRXNPFEDSA-N	0	3	300.393	2.412	10	0		DEAEHN
O=[S@](C[C@H]1CCCCN1)c1cccc(Br)n1	ZINC000095092395	193423263	/nfs/dbraw/zinc/42/32/63/193423263.db2.gz	MMLIHXRXBDAPCP-ABKXIKBNSA-N	0	3	303.225	2.094	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@@H]1NCc1cc(Br)ccc1F	ZINC000282457151	217010514	/nfs/dbraw/zinc/01/05/14/217010514.db2.gz	STWUUPZVRRSFQH-UFBFGSQYSA-N	0	3	315.186	2.345	10	0		DEAEHN
O=C(Nc1nnc(-c2ccco2)s1)N1CCN2CCC[C@H]2C1	ZINC000264748542	204123860	/nfs/dbraw/zinc/12/38/60/204123860.db2.gz	RAVUMLANBGTNJR-JTQLQIEISA-N	0	3	319.390	2.110	10	0		DEAEHN
COc1cccc([C@H]2C[C@@H](O)CN2Cc2nc(C)ccc2O)c1	ZINC000282689015	217178160	/nfs/dbraw/zinc/17/81/60/217178160.db2.gz	IVMZNUVHMIMZEA-RHSMWYFYSA-N	0	3	314.385	2.412	10	0		DEAEHN
C[C@@]1(NC[C@@H](O)c2cccc(Br)c2)CCOC1	ZINC000161718577	197513363	/nfs/dbraw/zinc/51/33/63/197513363.db2.gz	TXUTUECJXJXZOP-CHWSQXEVSA-N	0	3	300.196	2.251	10	0		DEAEHN
CN(Cc1ccccc1)S(=O)(=O)c1cc(CN)ccc1F	ZINC000020188848	182195533	/nfs/dbraw/zinc/19/55/33/182195533.db2.gz	SUYPXVOKCQBFEI-UHFFFAOYSA-N	0	3	308.378	2.105	10	0		DEAEHN
[NH3+]Cc1cccc(S(=O)(=O)[N-]c2ccc(F)c(F)c2F)c1	ZINC000021516886	182277275	/nfs/dbraw/zinc/27/72/75/182277275.db2.gz	KZZSNBPDUOHMNM-UHFFFAOYSA-N	0	3	316.304	2.363	10	0		DEAEHN
Cc1cc(C)c(NC[C@H](O)CN(C)C)c(Br)c1	ZINC000159851019	197369337	/nfs/dbraw/zinc/36/93/37/197369337.db2.gz	PGSMCQCXLWNVIY-NSHDSACASA-N	0	3	301.228	2.400	10	0		DEAEHN
O=C(Nc1ccc(SC2CCCC2)cc1)[C@@H]1C[C@@H](O)CN1	ZINC000037033598	182862914	/nfs/dbraw/zinc/86/29/14/182862914.db2.gz	DWOSQUUYGCRDTN-DOMZBBRYSA-N	0	3	306.431	2.383	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2ccc(-c3nccs3)cc2)C1	ZINC000040634074	183111747	/nfs/dbraw/zinc/11/17/47/183111747.db2.gz	CXTIHTREPYZXBF-CHWSQXEVSA-N	0	3	303.387	2.126	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)NCCOC)c1ccc(C)cc1	ZINC000040654356	183114294	/nfs/dbraw/zinc/11/42/94/183114294.db2.gz	ZSXQGRGHIAVJOQ-MRXNPFEDSA-N	0	3	307.438	2.324	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2ccc(Br)cc2C)C1	ZINC000040629977	183111110	/nfs/dbraw/zinc/11/11/10/183111110.db2.gz	PRMDUFBJMLSABK-ZYHUDNBSSA-N	0	3	313.195	2.073	10	0		DEAEHN
COC(=O)c1c(NC(=O)[C@H](N)CC(C)C)sc2c1CCC2	ZINC000040858846	183143309	/nfs/dbraw/zinc/14/33/09/183143309.db2.gz	NXUIPUUQLBKEGD-SNVBAGLBSA-N	0	3	310.419	2.335	10	0		DEAEHN
O=C(NCc1cc(Br)ccc1F)[C@@H]1CCCCN1	ZINC000041069508	183162311	/nfs/dbraw/zinc/16/23/11/183162311.db2.gz	VXUOJKJJLCYFGL-LBPRGKRZSA-N	0	3	315.186	2.347	10	0		DEAEHN
CC[C@@H](CO)Nc1c2ccccc2nc(C)c1CC(=O)OC	ZINC000041473227	183193413	/nfs/dbraw/zinc/19/34/13/183193413.db2.gz	RVFYKUWRTJIYRH-LBPRGKRZSA-N	0	3	302.374	2.442	10	0		DEAEHN
COc1ccc2c(c1)nc(C)cc2N[C@@H]1CCS(=O)(=O)C1	ZINC000041474114	183194035	/nfs/dbraw/zinc/19/40/35/183194035.db2.gz	LRVVSIASKGQKOI-LLVKDONJSA-N	0	3	306.387	2.151	10	0		DEAEHN
CCCN(CCN(C)C)C(=O)C1(C(N)=S)CCCCCC1	ZINC000041680999	183215955	/nfs/dbraw/zinc/21/59/55/183215955.db2.gz	VQZLNMVDCHYLMC-UHFFFAOYSA-N	0	3	313.511	2.413	10	0		DEAEHN
COCCCN(CCOC)[C@@H](CN)c1c(F)cccc1Cl	ZINC000042421003	183267927	/nfs/dbraw/zinc/26/79/27/183267927.db2.gz	DXEHZPOVWSPIBF-AWEZNQCLSA-N	0	3	318.820	2.464	10	0		DEAEHN
CC(C)N(CCCO)[C@H](C)C(=O)Nc1ccc(N)cc1Cl	ZINC000042482889	183274995	/nfs/dbraw/zinc/27/49/95/183274995.db2.gz	WZUKOEOTFJZENC-LLVKDONJSA-N	0	3	313.829	2.342	10	0		DEAEHN
CCN(CCOC)[C@@H](CN)c1cc(Br)cs1	ZINC000042492681	183276223	/nfs/dbraw/zinc/27/62/23/183276223.db2.gz	LYHSTNRBOKFMPB-JTQLQIEISA-N	0	3	307.257	2.479	10	0		DEAEHN
COC[C@@H](O)CN(C)c1cccc(Cl)c1CNC(C)C	ZINC000042511612	183278661	/nfs/dbraw/zinc/27/86/61/183278661.db2.gz	IMMQKLBESXQFPX-LBPRGKRZSA-N	0	3	300.830	2.282	10	0		DEAEHN
NCc1cc2c(cc1OCCCOCC(F)(F)F)OCO2	ZINC000042873946	183316217	/nfs/dbraw/zinc/31/62/17/183316217.db2.gz	FNUQWFSPXYRLFT-UHFFFAOYSA-N	0	3	307.268	2.222	10	0		DEAEHN
C[C@H](N)[C@@H](c1cccc(Cl)c1)N(C)CC(=O)N1CCCC1	ZINC000043015466	183327394	/nfs/dbraw/zinc/32/73/94/183327394.db2.gz	AWHKBPKHLYISHS-LRDDRELGSA-N	0	3	309.841	2.283	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccccc1Cl)N(C)CC(=O)NC1CC1	ZINC000043051477	183332789	/nfs/dbraw/zinc/33/27/89/183332789.db2.gz	JWHIXGHNOKABNN-GDBMZVCRSA-N	0	3	309.841	2.329	10	0		DEAEHN
NCc1ccccc1CS(=O)(=O)N(CC(F)(F)F)C1CC1	ZINC000042768549	183307052	/nfs/dbraw/zinc/30/70/52/183307052.db2.gz	XBYVNNLMLFLBAW-UHFFFAOYSA-N	0	3	322.352	2.002	10	0		DEAEHN
CC(C)N(CCO)[C@H](CN)c1ccccc1Br	ZINC000043093284	183336920	/nfs/dbraw/zinc/33/69/20/183336920.db2.gz	PAQOGXAWLQCZNU-CYBMUJFWSA-N	0	3	301.228	2.152	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1sccc1C)N1CCCC[C@@H]1C(=O)NC	ZINC000043248709	183346491	/nfs/dbraw/zinc/34/64/91/183346491.db2.gz	XKHAEGZQYTWBNT-MCIONIFRSA-N	0	3	309.479	2.435	10	0		DEAEHN
NC[C@H](c1ccc(Cl)s1)N(CC(N)=O)C1CCCC1	ZINC000043253824	183348458	/nfs/dbraw/zinc/34/84/58/183348458.db2.gz	CUQCYNQNCGVAHJ-SNVBAGLBSA-N	0	3	301.843	2.131	10	0		DEAEHN
C[C@H](N)[C@H](c1ccc(Br)s1)N1CCC[C@@H]1CO	ZINC000043261351	183348676	/nfs/dbraw/zinc/34/86/76/183348676.db2.gz	XNMCCSBEQTVXFP-YGOYTEALSA-N	0	3	319.268	2.356	10	0		DEAEHN
CCCN(CCO)[C@H](CN)c1ccc(Br)s1	ZINC000043261591	183349124	/nfs/dbraw/zinc/34/91/24/183349124.db2.gz	AATUIJXUUQNLLT-SECBINFHSA-N	0	3	307.257	2.215	10	0		DEAEHN
COc1ccc(Cl)c([N-]S(=O)(=O)C[C@H]2CCC[NH2+]C2)c1	ZINC000043318852	183354591	/nfs/dbraw/zinc/35/45/91/183354591.db2.gz	XRMSHMUCGJFWLO-JTQLQIEISA-N	0	3	318.826	2.090	10	0		DEAEHN
NC[C@H](c1ccccc1Br)N1CCC[C@H](CO)C1	ZINC000043092156	183336057	/nfs/dbraw/zinc/33/60/57/183336057.db2.gz	MHWJPZDSPYCLJU-SMDDNHRTSA-N	0	3	313.239	2.153	10	0		DEAEHN
C[C@@H](CNCc1ccc(F)c(Br)c1)[S@@](C)=O	ZINC000159809570	197366214	/nfs/dbraw/zinc/36/62/14/197366214.db2.gz	MXCUFABDGUYPCP-PWJLMRLQSA-N	0	3	308.216	2.445	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(Cc2cccc(C(N)=O)c2)C1	ZINC000105897515	194162727	/nfs/dbraw/zinc/16/27/27/194162727.db2.gz	BHUNLIQZQINFGQ-INIZCTEOSA-N	0	3	312.417	2.382	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN([C@@H](C)C(=O)N2CCCCC2)C1	ZINC000105922627	194170880	/nfs/dbraw/zinc/17/08/80/194170880.db2.gz	RUEUPRMCKCYMDT-HOTGVXAUSA-N	0	3	318.465	2.483	10	0		DEAEHN
CC(C)Oc1ccccc1CNC[C@H]1CN(C2CC2)CCO1	ZINC000106379661	194203983	/nfs/dbraw/zinc/20/39/83/194203983.db2.gz	JPUJPCGIUQUJLP-KRWDZBQOSA-N	0	3	304.434	2.427	10	0		DEAEHN
CCN(CC)[C@H](C(=O)N1CC[C@@H](N(C)C)C1)c1ccccc1	ZINC000104898375	284786620	/nfs/dbraw/zinc/78/66/20/284786620.db2.gz	XZHYGNHESSDRKV-SJORKVTESA-N	0	3	303.450	2.232	10	0		DEAEHN
Cc1cc(C)c(CN2CCN([C@@H](C)C(N)=S)CC2)c(C)c1	ZINC000109468477	194266832	/nfs/dbraw/zinc/26/68/32/194266832.db2.gz	RBNCWIVTHHAVCF-HNNXBMFYSA-N	0	3	305.491	2.404	10	0		DEAEHN
CCC[C@H](C(N)=S)N1CCN(c2ccc(Cl)cn2)CC1	ZINC000109471630	194267606	/nfs/dbraw/zinc/26/76/06/194267606.db2.gz	DVZBJVUUYYCJJT-GFCCVEGCSA-N	0	3	312.870	2.312	10	0		DEAEHN
CNCc1cnc(-n2nnc(-c3ccccc3)n2)c(Cl)c1	ZINC000051488919	183828097	/nfs/dbraw/zinc/82/80/97/183828097.db2.gz	XNXDBZGDVQQFJQ-UHFFFAOYSA-N	0	3	300.753	2.097	10	0		DEAEHN
C[C@@H]1CN(c2nc(-c3ccccc3)c(CN)s2)CCN1C	ZINC000110760102	194356750	/nfs/dbraw/zinc/35/67/50/194356750.db2.gz	MVMLXNKJKFHOTM-GFCCVEGCSA-N	0	3	302.447	2.409	10	0		DEAEHN
CCCN([C@@H]1CCCNC1)S(=O)(=O)c1ccc(CC)cc1	ZINC000110942371	194371768	/nfs/dbraw/zinc/37/17/68/194371768.db2.gz	PXFMEOICRVCNJX-OAHLLOKOSA-N	0	3	310.463	2.402	10	0		DEAEHN
CCN([C@H]1CCCNC1)S(=O)(=O)c1cc(Cl)ccc1C	ZINC000110941363	194372043	/nfs/dbraw/zinc/37/20/43/194372043.db2.gz	VTLQBPGXZRHDOS-ZDUSSCGKSA-N	0	3	316.854	2.411	10	0		DEAEHN
O=S(=O)(CC[C@@H]1CCCC[NH2+]1)[N-]c1cc(F)c(F)cc1F	ZINC000061094603	184161745	/nfs/dbraw/zinc/16/17/45/184161745.db2.gz	QVKLJJZYJZSZNW-VIFPVBQESA-N	0	3	322.352	2.378	10	0		DEAEHN
O=S(=O)(CC[C@H]1CCCC[NH2+]1)[N-]c1cc(F)c(F)cc1F	ZINC000061094604	184161856	/nfs/dbraw/zinc/16/18/56/184161856.db2.gz	QVKLJJZYJZSZNW-SECBINFHSA-N	0	3	322.352	2.378	10	0		DEAEHN
O=S(=O)(CC[C@@H]1CCCC[NH2+]1)[N-]c1cc(F)cc(F)c1F	ZINC000061120347	184162273	/nfs/dbraw/zinc/16/22/73/184162273.db2.gz	GHXXJHVLNHVGBV-JTQLQIEISA-N	0	3	322.352	2.378	10	0		DEAEHN
CC(C)[NH2+]CCCS(=O)(=O)[N-]c1cc(F)cc(F)c1F	ZINC000061120932	184162683	/nfs/dbraw/zinc/16/26/83/184162683.db2.gz	OCEPBZASUXWPME-UHFFFAOYSA-N	0	3	310.341	2.234	10	0		DEAEHN
CC(C)Oc1nc(Cl)nc(N[C@@H](CN(C)C)C(C)C)n1	ZINC000061539288	184173666	/nfs/dbraw/zinc/17/36/66/184173666.db2.gz	IVOVGSGHQOQRPN-JTQLQIEISA-N	0	3	301.822	2.310	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccc(Br)cn2)C1	ZINC000061874295	184191108	/nfs/dbraw/zinc/19/11/08/184191108.db2.gz	GTCUCXIMHJGHOB-NSHDSACASA-N	0	3	312.211	2.058	10	0		DEAEHN
CCNc1cc(C(=O)N2CCC[C@@H]2CN(C)C)cc(Cl)n1	ZINC000061656051	184181362	/nfs/dbraw/zinc/18/13/62/184181362.db2.gz	CJUGZNSINQBDCV-GFCCVEGCSA-N	0	3	310.829	2.333	10	0		DEAEHN
C[C@H]1CN(CCC(=O)Nc2ccc(Cl)c(N)c2)CCCO1	ZINC000061912867	184195386	/nfs/dbraw/zinc/19/53/86/184195386.db2.gz	YXYCVLXXSDXXBC-NSHDSACASA-N	0	3	311.813	2.362	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccco1)N1CCN(CC(F)(F)F)CC1	ZINC000061940810	184197361	/nfs/dbraw/zinc/19/73/61/184197361.db2.gz	XIHDFPNLJCJDIR-AAEUAGOBSA-N	0	3	305.344	2.238	10	0		DEAEHN
C[C@@H](c1ccc(Cl)cc1)N(C)CC(=O)N1CCCNCC1	ZINC000062014403	184201289	/nfs/dbraw/zinc/20/12/89/184201289.db2.gz	FXQHRAWUVCPMFK-ZDUSSCGKSA-N	0	3	309.841	2.155	10	0		DEAEHN
CC(C)CN1C(=O)C[C@H](N)[C@@H]1c1ccc(Br)o1	ZINC000062209884	184220376	/nfs/dbraw/zinc/22/03/76/184220376.db2.gz	RAHUNXUMXRYVGE-QPUJVOFHSA-N	0	3	301.184	2.299	10	0		DEAEHN
CCN[C@H](c1cc(F)c(F)c(F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000062706589	184248819	/nfs/dbraw/zinc/24/88/19/184248819.db2.gz	JKSPIBOJCFZYAP-SDBXPKJASA-N	0	3	307.337	2.189	10	0		DEAEHN
COCCNCc1cc(Cl)c(OCCCCO)c(OC)c1	ZINC000062727899	184250486	/nfs/dbraw/zinc/25/04/86/184250486.db2.gz	AJLICHFIPZIHIQ-UHFFFAOYSA-N	0	3	317.813	2.236	10	0		DEAEHN
CCOC(=O)[C@@H](C)Oc1ccc(Cl)cc1CNCCOC	ZINC000062731120	184251237	/nfs/dbraw/zinc/25/12/37/184251237.db2.gz	BCIBVADGXANBRI-LLVKDONJSA-N	0	3	315.797	2.406	10	0		DEAEHN
CNc1ccc(Cl)c(C(=O)N2CC[C@@H](N3CCCC3)C2)n1	ZINC000062984931	184264761	/nfs/dbraw/zinc/26/47/61/184264761.db2.gz	SAYHTKHELVOFAD-LLVKDONJSA-N	0	3	308.813	2.087	10	0		DEAEHN
Nc1ccc(Cl)c(C(=O)N2CC[C@H](N3CCCCC3)C2)n1	ZINC000062984970	184265132	/nfs/dbraw/zinc/26/51/32/184265132.db2.gz	QONWCVYJYLRTML-NSHDSACASA-N	0	3	308.813	2.018	10	0		DEAEHN
CCNCc1cc(Cl)ccc1OCCCS(C)(=O)=O	ZINC000063014321	184266498	/nfs/dbraw/zinc/26/64/98/184266498.db2.gz	LEBCWDCTSQLAKU-UHFFFAOYSA-N	0	3	305.827	2.263	10	0		DEAEHN
CS(=O)(=O)CCCOc1c(Cl)cc(Cl)cc1CN	ZINC000063014406	184266587	/nfs/dbraw/zinc/26/65/87/184266587.db2.gz	BSTRZSXIPHCKKP-UHFFFAOYSA-N	0	3	312.218	2.266	10	0		DEAEHN
COc1cc([C@H](N)CCCS(C)(=O)=O)cc(Cl)c1OC	ZINC000063017046	184266866	/nfs/dbraw/zinc/26/68/66/184266866.db2.gz	YBVOBWRFZUHNHY-LLVKDONJSA-N	0	3	321.826	2.182	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC1[C@@H](C)CCC[C@@H]1C	ZINC000246277805	285023763	/nfs/dbraw/zinc/02/37/63/285023763.db2.gz	WNUXLICGJAWUCJ-SOUVJXGZSA-N	0	3	311.470	2.221	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)NCC3=CCN(C)CC3)cc2)c1	ZINC000538348650	285032619	/nfs/dbraw/zinc/03/26/19/285032619.db2.gz	CPECHLOQXAFSCS-UHFFFAOYSA-N	0	3	310.401	2.172	10	0		DEAEHN
CC(C)(C)[C@@H](NC(=O)NCCNc1ccncc1)C(F)(F)F	ZINC000556723549	291834313	/nfs/dbraw/zinc/83/43/13/291834313.db2.gz	VVYKNTLDZJSFFW-LLVKDONJSA-N	0	3	318.343	2.192	10	0		DEAEHN
C[C@H](CC(=O)N(C)CCCN(C)C)C(=O)c1cccc(F)c1	ZINC000539416504	285076861	/nfs/dbraw/zinc/07/68/61/285076861.db2.gz	RKNCHNRSFJPXHP-CYBMUJFWSA-N	0	3	308.397	2.445	10	0		DEAEHN
CCc1nn(C)c(Cl)c1C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000159219166	197337012	/nfs/dbraw/zinc/33/70/12/197337012.db2.gz	NCBQJQRQZCZWLB-NSHDSACASA-N	0	3	314.861	2.342	10	0		DEAEHN
CC(C)NS(=O)(=O)c1ccc(F)c(CNC(C)(C)C)c1	ZINC000159080452	197325611	/nfs/dbraw/zinc/32/56/11/197325611.db2.gz	FRTZHAUNSKJLEK-UHFFFAOYSA-N	0	3	302.415	2.401	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc(CN)c1F	ZINC000159055655	197323057	/nfs/dbraw/zinc/32/30/57/197323057.db2.gz	DPVOVKQQVMAVLZ-QWRGUYRKSA-N	0	3	314.426	2.259	10	0		DEAEHN
CC[S@@](=O)c1ccccc1C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000159002697	197317786	/nfs/dbraw/zinc/31/77/86/197317786.db2.gz	WFKLNDXCIIWQBO-IEROGBPDSA-N	0	3	322.474	2.273	10	0		DEAEHN
O[C@@H](CNc1c(F)c(F)c(F)c(F)c1F)CN1CCCC1	ZINC000158882484	197308002	/nfs/dbraw/zinc/30/80/02/197308002.db2.gz	MCUVQSFOXRGKEL-ZETCQYMHSA-N	0	3	310.266	2.251	10	0		DEAEHN
CCN[C@H](CS(=O)(=O)c1cc(C)ccc1C)[C@@H]1CCOC1	ZINC000158734149	197297012	/nfs/dbraw/zinc/29/70/12/197297012.db2.gz	BCPRLACFAZLSEP-HUUCEWRRSA-N	0	3	311.447	2.092	10	0		DEAEHN
CCNCc1cc(Br)cnc1N(C)CCOCC	ZINC000158338029	197263102	/nfs/dbraw/zinc/26/31/02/197263102.db2.gz	TXKCJSXVUBVTAG-UHFFFAOYSA-N	0	3	316.243	2.426	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1[C@H](O)C1(C)CC1	ZINC000157817761	197218029	/nfs/dbraw/zinc/21/80/29/197218029.db2.gz	XVTNYVXCHPYXMW-NSHDSACASA-N	0	3	302.216	2.041	10	0		DEAEHN
Cc1cnc(CCN(C)C[C@@H](O)COc2ccccc2)s1	ZINC000157495339	197192233	/nfs/dbraw/zinc/19/22/33/197192233.db2.gz	IMVQZVJPEMRXFF-CQSZACIVSA-N	0	3	306.431	2.366	10	0		DEAEHN
CCOCCN(C)S(=O)(=O)c1cccc([C@H](CC)NC)c1	ZINC000157292241	197177378	/nfs/dbraw/zinc/17/73/78/197177378.db2.gz	KXTDLVLCKDHENM-HNNXBMFYSA-N	0	3	314.451	2.014	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccccc1CN)[S@@](=O)CC1CCCC1	ZINC000156070504	197084217	/nfs/dbraw/zinc/08/42/17/197084217.db2.gz	BJIVVGBUJPHTCF-LAJNKCICSA-N	0	3	308.447	2.411	10	0		DEAEHN
COc1cc(C)c(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc1OC	ZINC000155630132	197074010	/nfs/dbraw/zinc/07/40/10/197074010.db2.gz	VGYGNBJJQPAJKG-ZFWWWQNUSA-N	0	3	320.433	2.471	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)c2cc(Br)c[nH]2)[C@@H](C)C1	ZINC000155404985	197051781	/nfs/dbraw/zinc/05/17/81/197051781.db2.gz	YDZNXITUJVPSNH-CABZTGNLSA-N	0	3	314.227	2.236	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)C1	ZINC000121261657	285268082	/nfs/dbraw/zinc/26/80/82/285268082.db2.gz	RKRRLUXILOPPRT-JONQDZQNSA-N	0	3	321.465	2.118	10	0		DEAEHN
c1nnc2ccc(N3CCN(CC4CCCCCC4)CC3)nn12	ZINC000120466781	195172860	/nfs/dbraw/zinc/17/28/60/195172860.db2.gz	UYFLMJODJZIDQT-UHFFFAOYSA-N	0	3	314.437	2.217	10	0		DEAEHN
Cc1ccc(F)c(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000120681199	195215905	/nfs/dbraw/zinc/21/59/05/195215905.db2.gz	VXEPFJCUYXJBHO-OLZOCXBDSA-N	0	3	321.396	2.014	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(CC[C@@H]3CCOC3=O)C2)c1	ZINC000120855733	195251172	/nfs/dbraw/zinc/25/11/72/195251172.db2.gz	BINZGKSOTUOFOR-KGLIPLIRSA-N	0	3	319.401	2.446	10	0		DEAEHN
CCCN1CC[C@@H]2C[C@@H](C(=O)Nc3cccnc3C)O[C@H]2C1	ZINC000247926775	257114618	/nfs/dbraw/zinc/11/46/18/257114618.db2.gz	BBHDABRIOAFCLM-KBMXLJTQSA-N	0	3	303.406	2.218	10	0		DEAEHN
CC[NH+](CC)[C@H](C)C[N-]S(=O)(=O)c1cc(F)c(C)cc1F	ZINC000121913697	195373348	/nfs/dbraw/zinc/37/33/48/195373348.db2.gz	ZGYQSRSWUJMVAS-LLVKDONJSA-N	0	3	320.405	2.282	10	0		DEAEHN
CC[C@H]1N[C@H](c2ccsc2)N(CC2CCN(C)CC2)C1=O	ZINC000122021555	195390967	/nfs/dbraw/zinc/39/09/67/195390967.db2.gz	JECWMPIWDILXGM-CABCVRRESA-N	0	3	307.463	2.299	10	0		DEAEHN
COC(=O)CCn1nc(C)c(CNC[C@H]2CCC(C)(C)O2)c1C	ZINC000190254556	533465484	/nfs/dbraw/zinc/46/54/84/533465484.db2.gz	PLSUYDVVOAELKH-CQSZACIVSA-N	0	3	323.437	2.110	10	0		DEAEHN
COC(=O)C1CCN(C(=O)CN2CCC3(C2)CCCCC3)CC1	ZINC000357779835	133099545	/nfs/dbraw/zinc/09/95/45/133099545.db2.gz	KYGIJCKUHPWDPE-UHFFFAOYSA-N	0	3	322.449	2.054	10	0		DEAEHN
c1nc2c([nH]1)C[C@H](NCc1cnc([C@H]3CCCO3)s1)CC2	ZINC000368258169	133266542	/nfs/dbraw/zinc/26/65/42/133266542.db2.gz	IYHMZRVRQWUCRA-QMTHXVAHSA-N	0	3	304.419	2.365	10	0		DEAEHN
NC1(C(=O)NCc2c(Cl)cccc2Cl)CCOCC1	ZINC000564320424	292091220	/nfs/dbraw/zinc/09/12/20/292091220.db2.gz	FBJSNZZMZFXYNF-UHFFFAOYSA-N	0	3	303.189	2.118	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccc(O[C@H]3CCOC3)cc2)C1	ZINC000329868641	404477829	/nfs/dbraw/zinc/47/78/29/404477829.db2.gz	XRKAIYGWIJVIAQ-RDJZCZTQSA-N	0	3	318.417	2.068	10	0		DEAEHN
O=C([C@@H]1C[C@H]1c1cccc(F)c1F)N1CCN2CCC1CC2	ZINC000188668616	145015686	/nfs/dbraw/zinc/01/56/86/145015686.db2.gz	YUTSRXMUGPZWHW-UONOGXRCSA-N	0	3	306.356	2.375	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1cnc2ccccc2n1	ZINC000188754816	145016868	/nfs/dbraw/zinc/01/68/68/145016868.db2.gz	WEFNEKMWEQMYSU-UHFFFAOYSA-N	0	3	304.353	2.163	10	0		DEAEHN
CC(C)Oc1ccc(CC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000189147381	145023472	/nfs/dbraw/zinc/02/34/72/145023472.db2.gz	KPQVFSJGIVSQSZ-INIZCTEOSA-N	0	3	302.418	2.323	10	0		DEAEHN
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1CCCCCn1cccn1	ZINC000191184080	145054339	/nfs/dbraw/zinc/05/43/39/145054339.db2.gz	COADSKAHJIZVCP-OAGGEKHMSA-N	0	3	305.422	2.327	10	0		DEAEHN
Cc1nc(CC2CC2)sc1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000191584457	145061012	/nfs/dbraw/zinc/06/10/12/145061012.db2.gz	SKPAQRWOYROPPW-CYBMUJFWSA-N	0	3	305.447	2.324	10	0		DEAEHN
Cc1csc2c1ncnc2N(C)CCCN1CCN(C)CC1	ZINC000192585283	145075941	/nfs/dbraw/zinc/07/59/41/145075941.db2.gz	BRDOZGSXFHZNBV-UHFFFAOYSA-N	0	3	319.478	2.073	10	0		DEAEHN
COc1ccc(OC)c(NC(=O)[C@H](C)N[C@H](C)[C@@H]2CCCO2)c1	ZINC000193129075	145083190	/nfs/dbraw/zinc/08/31/90/145083190.db2.gz	CNRFZADPMDQVDP-XUJVJEKNSA-N	0	3	322.405	2.188	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCC[C@H](n2ccnc2CC)C1	ZINC000193379790	145085692	/nfs/dbraw/zinc/08/56/92/145085692.db2.gz	YDGKGCBBKVBBHY-HOTGVXAUSA-N	0	3	309.454	2.260	10	0		DEAEHN
COc1ccc(F)cc1C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000246226152	145095319	/nfs/dbraw/zinc/09/53/19/145095319.db2.gz	HGCZVRYVSYVNPQ-WFASDCNBSA-N	0	3	306.381	2.391	10	0		DEAEHN
Cc1ccccc1CS(=O)(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000246272164	145096367	/nfs/dbraw/zinc/09/63/67/145096367.db2.gz	VALPADTZYZLVQD-ZBFHGGJFSA-N	0	3	310.463	2.143	10	0		DEAEHN
CCOc1ccc(CN2CCN(C[C@H](C)O)[C@@H](CC)C2)cc1	ZINC000246350645	145099831	/nfs/dbraw/zinc/09/98/31/145099831.db2.gz	MMZAVUVIBXSHLP-RDJZCZTQSA-N	0	3	306.450	2.362	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1C	ZINC000246409135	145101957	/nfs/dbraw/zinc/10/19/57/145101957.db2.gz	LVDNGDBLRHXQQI-ZBFHGGJFSA-N	0	3	317.433	2.087	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(C(=O)[C@H]3[C@@H]4CCCC[C@@H]43)C2)CC1	ZINC000246459416	145103790	/nfs/dbraw/zinc/10/37/90/145103790.db2.gz	JLFBFMHQXKHJAO-BDXSIMOUSA-N	0	3	319.493	2.051	10	0		DEAEHN
C[C@H](C(=O)NCCc1cccs1)N1CC[C@@H]2OCCC[C@@H]2C1	ZINC000246613061	145108749	/nfs/dbraw/zinc/10/87/49/145108749.db2.gz	JPDHYOAAVCWURF-FMKPAKJESA-N	0	3	322.474	2.296	10	0		DEAEHN
C[C@@H]1C[C@@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000246666414	145109826	/nfs/dbraw/zinc/10/98/26/145109826.db2.gz	BAHBDUDXUAGIBO-FHLIZLRMSA-N	0	3	316.445	2.204	10	0		DEAEHN
O[C@@H](CN1CCC[C@@H](Cn2cncn2)C1)c1cccc(Cl)c1	ZINC000246743737	145112635	/nfs/dbraw/zinc/11/26/35/145112635.db2.gz	OKPZJCNAAJDYBS-CJNGLKHVSA-N	0	3	320.824	2.377	10	0		DEAEHN
CN(C)c1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c(F)c1	ZINC000246785642	145114534	/nfs/dbraw/zinc/11/45/34/145114534.db2.gz	RYLDBHWVCRCVFI-OCCSQVGLSA-N	0	3	305.397	2.200	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N1C[C@H](C)C[C@@H](C)C1	ZINC000246864357	145117252	/nfs/dbraw/zinc/11/72/52/145117252.db2.gz	CTOTUSMAVXIXDS-INMHGKMJSA-N	0	3	318.465	2.160	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@H](C)C(=O)N1CCC(C)CC1	ZINC000246914585	145119118	/nfs/dbraw/zinc/11/91/18/145119118.db2.gz	GFDAEFRMWICRJD-NVXWUHKLSA-N	0	3	318.465	2.303	10	0		DEAEHN
CC[C@@H]1CCC[C@H](NC(=O)NC[C@H]2CCCN2CCOC)C1	ZINC000247027146	145123875	/nfs/dbraw/zinc/12/38/75/145123875.db2.gz	PBXQEAMIDZBNNR-OWCLPIDISA-N	0	3	311.470	2.365	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H](n2cc(C)cn2)C1	ZINC000247041802	145124107	/nfs/dbraw/zinc/12/41/07/145124107.db2.gz	DUXDQVLVGZNOHQ-HZPDHXFCSA-N	0	3	304.438	2.229	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1N[C@H]1CCCn2ncnc21	ZINC000247153879	145127740	/nfs/dbraw/zinc/12/77/40/145127740.db2.gz	RROUWWHHGHNCRJ-HYVNUMGLSA-N	0	3	311.433	2.223	10	0		DEAEHN
CC(C)Oc1cncc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000247141813	145127817	/nfs/dbraw/zinc/12/78/17/145127817.db2.gz	WEEGYBLPZHYTPB-HIFRSBDPSA-N	0	3	303.406	2.178	10	0		DEAEHN
Cc1cccc(NC(=O)[C@H](C)N2CCN3CCC[C@H]3C2)c1C	ZINC000247247841	145130855	/nfs/dbraw/zinc/13/08/55/145130855.db2.gz	SVTIBTMRZGRSNP-HOTGVXAUSA-N	0	3	301.434	2.410	10	0		DEAEHN
Cc1nn(CC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(C)c1Cl	ZINC000247433993	145137108	/nfs/dbraw/zinc/13/71/08/145137108.db2.gz	OWXXZVMGIKRTNI-GXFFZTMASA-N	0	3	312.845	2.094	10	0		DEAEHN
CC[C@H]1c2ccsc2CCN1C[C@@H](O)CN1CCCC1=O	ZINC000247495429	145139273	/nfs/dbraw/zinc/13/92/73/145139273.db2.gz	MNPXWTQCNWDQQA-OCCSQVGLSA-N	0	3	308.447	2.041	10	0		DEAEHN
CN1CC[C@H](NC(=O)CC[C@@H]2CCOC2)[C@H]1c1ccccc1	ZINC000247974356	145146530	/nfs/dbraw/zinc/14/65/30/145146530.db2.gz	GDVJKJBAPXNWAN-UWWQBHOKSA-N	0	3	302.418	2.365	10	0		DEAEHN
CC[C@H]1CN(CCCc2ccccc2OC)CCN1C[C@H](C)O	ZINC000248588786	145159991	/nfs/dbraw/zinc/15/99/91/145159991.db2.gz	RJNVQVSKRYUOEF-WMZOPIPTSA-N	0	3	320.477	2.405	10	0		DEAEHN
C[C@@H](N[C@@H](C)C(=O)NC[C@@H](C)c1ccccc1)[C@H]1CCCO1	ZINC000248862408	145170943	/nfs/dbraw/zinc/17/09/43/145170943.db2.gz	WHGWVCOTIXPIIR-PNBKFKSVSA-N	0	3	304.434	2.452	10	0		DEAEHN
COc1ccc(F)c(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1OC	ZINC000248998124	145174829	/nfs/dbraw/zinc/17/48/29/145174829.db2.gz	GYSDIVRZPHAUIU-NEPJUHHUSA-N	0	3	322.380	2.152	10	0		DEAEHN
CCC[C@@H]1CN(C[C@@H](O)C2CCCCC2)CCN1CCOC	ZINC000249067125	145177670	/nfs/dbraw/zinc/17/76/70/145177670.db2.gz	KHWBFZCBKJGSNT-QZTJIDSGSA-N	0	3	312.498	2.360	10	0		DEAEHN
CCn1cnnc1[C@@H]1CCCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000249894313	145191832	/nfs/dbraw/zinc/19/18/32/145191832.db2.gz	REXNIQCIEHZVOL-GDBMZVCRSA-N	0	3	318.396	2.350	10	0		DEAEHN
CO[C@@H]1CN([C@@H](C)C(=O)N2CCc3ccccc3C2)CC[C@@H]1C	ZINC000251525397	145194782	/nfs/dbraw/zinc/19/47/82/145194782.db2.gz	CXPRUWLDSXWYMT-RLFYNMQTSA-N	0	3	316.445	2.317	10	0		DEAEHN
COc1ccccc1/C=C\CN1CCN(C[C@H]2CCOC2)CC1	ZINC000255548486	145204582	/nfs/dbraw/zinc/20/45/82/145204582.db2.gz	VBZRDYKBDJPCEL-XQDHMALISA-N	0	3	316.445	2.363	10	0		DEAEHN
c1ccc(-c2noc(CN3CCNC[C@@H]3c3cccnc3)n2)cc1	ZINC000261614621	145210239	/nfs/dbraw/zinc/21/02/39/145210239.db2.gz	CHTWOMYEPXHGCY-MRXNPFEDSA-N	0	3	321.384	2.278	10	0		DEAEHN
CCc1ccc([C@H]2CNCCN2CCS(=O)(=O)C(C)C)cc1	ZINC000261647896	145212844	/nfs/dbraw/zinc/21/28/44/145212844.db2.gz	GDQKWJXNKALSMZ-QGZVFWFLSA-N	0	3	324.490	2.019	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H](N)C1CCOCC1)c1ccc2c(c1)CCCC2	ZINC000261796760	145227250	/nfs/dbraw/zinc/22/72/50/145227250.db2.gz	NWWDZHZUOWFTDL-ACJLOTCBSA-N	0	3	316.445	2.497	10	0		DEAEHN
N[C@@H](C(=O)N1CCC(Cc2ccccc2)CC1)C1CCOCC1	ZINC000261809460	145228683	/nfs/dbraw/zinc/22/86/83/145228683.db2.gz	OPHBPLZNXNMKTA-GOSISDBHSA-N	0	3	316.445	2.222	10	0		DEAEHN
c1cnn(-c2cccc(CN3CCNC[C@H]3c3cccnc3)c2)c1	ZINC000261813029	145229146	/nfs/dbraw/zinc/22/91/46/145229146.db2.gz	WZNZLLFNYMLWIL-IBGZPJMESA-N	0	3	319.412	2.414	10	0		DEAEHN
Cc1ccc2nc(CN3CCNC[C@H]3c3cccnc3)cn2c1	ZINC000261821693	145230679	/nfs/dbraw/zinc/23/06/79/145230679.db2.gz	SHAKYTRNEHNMMM-KRWDZBQOSA-N	0	3	307.401	2.184	10	0		DEAEHN
CCC(CC)c1nnc(NC(=O)[C@H](N)C2CCOCC2)s1	ZINC000261845435	145232740	/nfs/dbraw/zinc/23/27/40/145232740.db2.gz	QYWKGAWRYCVYAV-LLVKDONJSA-N	0	3	312.439	2.134	10	0		DEAEHN
NC1(C(=O)NCCc2cc(Cl)cc(Cl)c2)CCOCC1	ZINC000261942180	145244715	/nfs/dbraw/zinc/24/47/15/145244715.db2.gz	XQUBILWHRIXUGL-UHFFFAOYSA-N	0	3	317.216	2.160	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)Nc1ccc2n[nH]cc2c1	ZINC000261953547	145246266	/nfs/dbraw/zinc/24/62/66/145246266.db2.gz	WSOLYNDXLLKOIC-MRRJBJDNSA-N	0	3	314.389	2.034	10	0		DEAEHN
CCC[C@H]1CCc2nc(NC(=O)C3(N)CCOCC3)sc2C1	ZINC000261958022	145247050	/nfs/dbraw/zinc/24/70/50/145247050.db2.gz	ZYAMYYXJAPBCLC-NSHDSACASA-N	0	3	323.462	2.495	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)NCc1cnn(-c2ccccc2)c1	ZINC000261971139	145248695	/nfs/dbraw/zinc/24/86/95/145248695.db2.gz	ZATXHZOXKNQINM-INIZCTEOSA-N	0	3	312.417	2.267	10	0		DEAEHN
CC(C)Oc1cccc([C@H](C)NC(=O)C2(N)CCOCC2)c1	ZINC000262121220	145264059	/nfs/dbraw/zinc/26/40/59/145264059.db2.gz	KQXSCKQDXPFISN-ZDUSSCGKSA-N	0	3	306.406	2.159	10	0		DEAEHN
COCCNCC(=O)N[C@@H](C)c1cc(Cl)ccc1Cl	ZINC000262145666	145266370	/nfs/dbraw/zinc/26/63/70/145266370.db2.gz	YJTUGUJGBFADEL-VIFPVBQESA-N	0	3	305.205	2.407	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC(=O)[C@@H]2C[C@@H](C)CCN2)c1	ZINC000262490916	145287195	/nfs/dbraw/zinc/28/71/95/145287195.db2.gz	LAQFSFXDILFOAN-HUBLWGQQSA-N	0	3	306.406	2.269	10	0		DEAEHN
COc1ccc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)cc1	ZINC000262486952	145287665	/nfs/dbraw/zinc/28/76/65/145287665.db2.gz	KNNOQPOFKBTEGX-CKEIUWERSA-N	0	3	304.390	2.166	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)Nc1ccc(F)cc1F	ZINC000262498273	145287895	/nfs/dbraw/zinc/28/78/95/145287895.db2.gz	LSHAECINLLVCCZ-OWRWGESLSA-N	0	3	310.344	2.436	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)NCc1ccccc1Cl	ZINC000262495935	145288101	/nfs/dbraw/zinc/28/81/01/145288101.db2.gz	LJAUXGYBGFPTKF-MRRJBJDNSA-N	0	3	322.836	2.489	10	0		DEAEHN
Cc1ccccc1CNC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C	ZINC000262558323	145292981	/nfs/dbraw/zinc/29/29/81/145292981.db2.gz	USJKAXYOUUZJNS-IIDMSEBBSA-N	0	3	302.418	2.144	10	0		DEAEHN
CCc1cnc(N2CCN(C(=O)C3(N)CCCCC3)CC2)s1	ZINC000262678578	145299928	/nfs/dbraw/zinc/29/99/28/145299928.db2.gz	VBYJWEBWYWAFNR-UHFFFAOYSA-N	0	3	322.478	2.016	10	0		DEAEHN
Cc1cccc2[nH]c(CCC(=O)N3CCN[C@H](C)[C@H]3C)nc21	ZINC000262772905	145304063	/nfs/dbraw/zinc/30/40/63/145304063.db2.gz	LNIIDQFUSGBRBZ-CHWSQXEVSA-N	0	3	300.406	2.013	10	0		DEAEHN
Cc1cccc2nc(CCC(=O)N3CCN[C@H](C)[C@H]3C)[nH]c21	ZINC000262772905	145304065	/nfs/dbraw/zinc/30/40/65/145304065.db2.gz	LNIIDQFUSGBRBZ-CHWSQXEVSA-N	0	3	300.406	2.013	10	0		DEAEHN
Cc1[nH]c2ccc(CNC(=O)C[C@H]3CSCCN3)cc2c1C	ZINC000262808373	145305463	/nfs/dbraw/zinc/30/54/63/145305463.db2.gz	QPBZSYSLOCHIDG-AWEZNQCLSA-N	0	3	317.458	2.496	10	0		DEAEHN
CC(C)Oc1cccc(Cc2nc([C@H]3CNCCN3C)no2)c1	ZINC000263137334	145328971	/nfs/dbraw/zinc/32/89/71/145328971.db2.gz	CCQFUBYFJOBQES-OAHLLOKOSA-N	0	3	316.405	2.024	10	0		DEAEHN
C[C@H](O)C1CCN(C(=O)NCC(C)(C)N2CCCCC2)CC1	ZINC000304249043	145340001	/nfs/dbraw/zinc/34/00/01/145340001.db2.gz	BBGAHSOFWRBWIM-AWEZNQCLSA-N	0	3	311.470	2.053	10	0		DEAEHN
Cc1cn2c(n1)[C@@H](CNC(=O)[C@H](C)N1CCCCCC1)CCC2	ZINC000332679257	145386602	/nfs/dbraw/zinc/38/66/02/145386602.db2.gz	GGHDTVJJYCDFTD-JKSUJKDBSA-N	0	3	318.465	2.450	10	0		DEAEHN
C[C@H]1CC[C@H](C)N1CC(=O)NCc1ccnc(OC(F)F)c1	ZINC000356985311	147016209	/nfs/dbraw/zinc/01/62/09/147016209.db2.gz	NVYJEJUMYFUGSF-QWRGUYRKSA-N	0	3	313.348	2.172	10	0		DEAEHN
COCCC1(C)CN(C(=O)NCC(C)(C)N2CCCCC2)C1	ZINC000358481808	147142358	/nfs/dbraw/zinc/14/23/58/147142358.db2.gz	PWSVFFDWZUPEKS-UHFFFAOYSA-N	0	3	311.470	2.319	10	0		DEAEHN
C[C@H](CSc1n[nH]c(=O)n1CCc1ccccc1)N(C)C	ZINC000358850876	147218858	/nfs/dbraw/zinc/21/88/58/147218858.db2.gz	GYILAIOIVVRTLR-GFCCVEGCSA-N	0	3	306.435	2.269	10	0		DEAEHN
Cc1ccnc(NC[C@H]2CCN(Cc3cnc4cnccn34)C2)c1	ZINC000371374148	148094899	/nfs/dbraw/zinc/09/48/99/148094899.db2.gz	PQBRFYWQZBETMD-OAHLLOKOSA-N	0	3	322.416	2.367	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)[C@H](C)N1CCC[C@H](c2nc[nH]n2)C1	ZINC000374548280	148259572	/nfs/dbraw/zinc/25/95/72/148259572.db2.gz	JRXMAJWWZIESPQ-SOUVJXGZSA-N	0	3	319.453	2.164	10	0		DEAEHN
Cc1nn(C)c(C)c1CN1CC[C@H](c2nc(C3CC3)no2)C1	ZINC000375399213	148367097	/nfs/dbraw/zinc/36/70/97/148367097.db2.gz	ACTCGCKIUVOFAL-ZDUSSCGKSA-N	0	3	301.394	2.287	10	0		DEAEHN
CC(C)(C)OC(=O)CCN1CC[C@@H](c2nc(C3CC3)no2)C1	ZINC000375464416	148376243	/nfs/dbraw/zinc/37/62/43/148376243.db2.gz	CUHUSMSSUOQHOX-GFCCVEGCSA-N	0	3	307.394	2.468	10	0		DEAEHN
CC(C)c1ccccc1OC[C@H](O)CN(C)CCn1cccn1	ZINC000111695284	401721329	/nfs/dbraw/zinc/72/13/29/401721329.db2.gz	OVSBSVAJSDJCTN-MRXNPFEDSA-N	0	3	317.433	2.378	10	0		DEAEHN
C[C@@H]1CCCN(C(C)(C)CNC(=O)c2cnn3c2CCCC3)C1	ZINC000127206363	401724947	/nfs/dbraw/zinc/72/49/47/401724947.db2.gz	NVOJCEQNIBJFSN-CQSZACIVSA-N	0	3	318.465	2.460	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@H](C)c1ccc(C)cc1	ZINC000111833635	401725422	/nfs/dbraw/zinc/72/54/22/401725422.db2.gz	JMZFEBAAASMREB-WBVHZDCISA-N	0	3	319.449	2.466	10	0		DEAEHN
CCc1onc(C)c1C(=O)NCCN(C)Cc1ccccc1	ZINC000112085318	401730608	/nfs/dbraw/zinc/73/06/08/401730608.db2.gz	YQENTMDSMSWAQO-UHFFFAOYSA-N	0	3	301.390	2.407	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)NCc3cccnc3)cc2)CC1	ZINC000074165870	401731653	/nfs/dbraw/zinc/73/16/53/401731653.db2.gz	GJMBBMNGRIPUPF-UHFFFAOYSA-N	0	3	324.428	2.154	10	0		DEAEHN
C[C@@H](NCc1nnc2n1c1ccsc1c(=O)n2C)C(C)(C)C	ZINC000074317612	401734989	/nfs/dbraw/zinc/73/49/89/401734989.db2.gz	BIKBXEWSRQSYSO-SECBINFHSA-N	0	3	319.434	2.167	10	0		DEAEHN
CCCc1noc(CCCC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)n1	ZINC000127701902	401746197	/nfs/dbraw/zinc/74/61/97/401746197.db2.gz	XXHGZJUEKZMGFN-KGLIPLIRSA-N	0	3	322.453	2.286	10	0		DEAEHN
CCc1nnsc1C(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000114680764	401805992	/nfs/dbraw/zinc/80/59/92/401805992.db2.gz	RMBKFECYSRIYAY-CYBMUJFWSA-N	0	3	318.446	2.003	10	0		DEAEHN
CCN1CCN([C@H](C)CNC(=O)Nc2ccc(C)s2)CC1	ZINC000075409773	401759417	/nfs/dbraw/zinc/75/94/17/401759417.db2.gz	LYLXGIHOTBIKBA-GFCCVEGCSA-N	0	3	310.467	2.204	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N2CC[C@H]3OCCC[C@@H]3C2)c1	ZINC000128115299	401763269	/nfs/dbraw/zinc/76/32/69/401763269.db2.gz	GQOBSLZLOVUUFF-IAGOWNOFSA-N	0	3	302.418	2.389	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(-c2ccncc2)on1	ZINC000113222646	401770825	/nfs/dbraw/zinc/77/08/25/401770825.db2.gz	AVWHASIPSBEUDO-GXTWGEPZSA-N	0	3	312.373	2.045	10	0		DEAEHN
Cc1c(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cnn1C(C)(C)C	ZINC000113222731	401770924	/nfs/dbraw/zinc/77/09/24/401770924.db2.gz	FHVMOZDJMUTPOE-GXTWGEPZSA-N	0	3	304.438	2.255	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1c(Cl)nc2ccccn21	ZINC000113227320	401771743	/nfs/dbraw/zinc/77/17/43/401771743.db2.gz	OFLKTOZYRCDGJK-VXGBXAGGSA-N	0	3	318.808	2.296	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(-c2ccco2)on1	ZINC000113227747	401771877	/nfs/dbraw/zinc/77/18/77/401771877.db2.gz	QSXFJVITDHPGGU-NWDGAFQWSA-N	0	3	301.346	2.243	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1Cc1nc(Cc2ccccc2)no1	ZINC000113269698	401773908	/nfs/dbraw/zinc/77/39/08/401773908.db2.gz	UJEZQHMYKHKBIQ-GOEBONIOSA-N	0	3	312.417	2.329	10	0		DEAEHN
Cc1ccc(O)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000113343330	401776783	/nfs/dbraw/zinc/77/67/83/401776783.db2.gz	TUQDJFAJPBSJOM-GFCCVEGCSA-N	0	3	307.394	2.195	10	0		DEAEHN
Cc1ccc([O-])c(C[NH2+][C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000113343330	401776787	/nfs/dbraw/zinc/77/67/87/401776787.db2.gz	TUQDJFAJPBSJOM-GFCCVEGCSA-N	0	3	307.394	2.195	10	0		DEAEHN
CC1(C)NC(=N)NC(=N)N1c1cccc(Cc2ccccc2)c1	ZINC000017040337	401820302	/nfs/dbraw/zinc/82/03/02/401820302.db2.gz	BPXQNOJUJMPEEQ-UHFFFAOYSA-N	0	3	307.401	2.463	10	0		DEAEHN
CSC[C@H](C)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000077572370	401821166	/nfs/dbraw/zinc/82/11/66/401821166.db2.gz	ZPUSYXICWFKHGQ-ZFWWWQNUSA-N	0	3	309.479	2.210	10	0		DEAEHN
CCNC(=O)CCN1CCC[C@@H]1c1ccc2c(c1)OCCO2	ZINC000025922014	401837863	/nfs/dbraw/zinc/83/78/63/401837863.db2.gz	ABPORUPWIHDQSC-CQSZACIVSA-N	0	3	304.390	2.121	10	0		DEAEHN
COc1ccc(CC2CCN([C@H]3CCN(C)C3=O)CC2)cc1	ZINC000116275105	401848060	/nfs/dbraw/zinc/84/80/60/401848060.db2.gz	TUUNWZDEUNKWNR-KRWDZBQOSA-N	0	3	302.418	2.180	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc2c(c1)OCCO2	ZINC000078614376	401858680	/nfs/dbraw/zinc/85/86/80/401858680.db2.gz	OWPVMDNWROCACN-AWEZNQCLSA-N	0	3	306.406	2.164	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)C(C)(C)c2ccc(Cl)cc2)CCO1	ZINC000116795130	401859072	/nfs/dbraw/zinc/85/90/72/401859072.db2.gz	SUFMMYUZIIZHTG-HNNXBMFYSA-N	0	3	324.852	2.407	10	0		DEAEHN
Cc1c2ccccc2oc1C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000116790220	401859375	/nfs/dbraw/zinc/85/93/75/401859375.db2.gz	UGFAJPSSPKJTSV-CYBMUJFWSA-N	0	3	302.374	2.144	10	0		DEAEHN
Cc1cccc(CSCC(=O)N2CCO[C@@H](CN(C)C)C2)c1	ZINC000116796654	401860027	/nfs/dbraw/zinc/86/00/27/401860027.db2.gz	RGVWYABMLOIRKO-INIZCTEOSA-N	0	3	322.474	2.017	10	0		DEAEHN
CCOC[C@@H]1CCCN(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)C1	ZINC000132395124	401866089	/nfs/dbraw/zinc/86/60/89/401866089.db2.gz	WAGCIAIRZZOZBT-ARFHVFGLSA-N	0	3	311.470	2.173	10	0		DEAEHN
CCCC[C@@H]1CCC[C@H]1NC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000117044936	401867825	/nfs/dbraw/zinc/86/78/25/401867825.db2.gz	BUHFJIVSUCRZKQ-BZUAXINKSA-N	0	3	311.470	2.317	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCC[C@@H](c2cc[nH]n2)C1	ZINC000114933363	401815045	/nfs/dbraw/zinc/81/50/45/401815045.db2.gz	RISKXKWKOZBMPQ-HUUCEWRRSA-N	0	3	321.469	2.275	10	0		DEAEHN
CC(C)N1CCO[C@@H](CN2CCN(CCC3CCCC3)CC2)C1	ZINC000119180189	401931376	/nfs/dbraw/zinc/93/13/76/401931376.db2.gz	NEZSLQLMLJABJV-IBGZPJMESA-N	0	3	323.525	2.294	10	0		DEAEHN
C[C@@H](NC(=O)NCCN(C)C)c1ccccc1Br	ZINC000133342463	401882415	/nfs/dbraw/zinc/88/24/15/401882415.db2.gz	UFZDOLMWDHIIEZ-SNVBAGLBSA-N	0	3	314.227	2.371	10	0		DEAEHN
CN(C[C@H](O)COCc1ccc(Cl)cc1)C[C@@H]1CCCO1	ZINC000079901376	401883166	/nfs/dbraw/zinc/88/31/66/401883166.db2.gz	QKWNDSAGQPDFLH-HOTGVXAUSA-N	0	3	313.825	2.328	10	0		DEAEHN
O=C1CCCN1C[C@H](O)CNC(c1ccccc1)c1ccccc1	ZINC000033895812	401892766	/nfs/dbraw/zinc/89/27/66/401892766.db2.gz	NZWUBIVBYPPDDB-GOSISDBHSA-N	0	3	324.424	2.349	10	0		DEAEHN
C[C@@H](CCc1ccc(OC(F)F)cc1)NCCS(C)(=O)=O	ZINC000037740492	401917132	/nfs/dbraw/zinc/91/71/32/401917132.db2.gz	YSPZUYYOJFVPCK-NSHDSACASA-N	0	3	321.389	2.243	10	0		DEAEHN
O=S(=O)([C@H]1CCN(CCC2CCCC2)C1)N1CCCC1	ZINC000135737028	401952359	/nfs/dbraw/zinc/95/23/59/401952359.db2.gz	AVQAOXBYNVWPNU-HNNXBMFYSA-N	0	3	300.468	2.067	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cc(-c2ccc(F)cc2)on1	ZINC000137310816	401981899	/nfs/dbraw/zinc/98/18/99/401981899.db2.gz	HTMIHQKHANTLBS-ZDUSSCGKSA-N	0	3	303.337	2.305	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1cccc(F)n1	ZINC000137400823	401982973	/nfs/dbraw/zinc/98/29/73/401982973.db2.gz	ZQMUOTDFLDWZGG-CQSZACIVSA-N	0	3	301.365	2.123	10	0		DEAEHN
CNC(=O)C(C)(C)CNCc1ccc(Br)c(F)c1	ZINC000120311182	401986033	/nfs/dbraw/zinc/98/60/33/401986033.db2.gz	IMDRUALWUFFJIR-UHFFFAOYSA-N	0	3	317.202	2.450	10	0		DEAEHN
COC(=O)[C@@H]1C[C@H](c2ccccc2)CN(C[C@@H]2CCCO2)C1	ZINC000135459800	401940395	/nfs/dbraw/zinc/94/03/95/401940395.db2.gz	VNRCAVXMQWQXIN-BBWFWOEESA-N	0	3	303.402	2.444	10	0		DEAEHN
CCC[C@@H](C)NC(=O)C(C)S(=O)(=O)Cc1ccccc1F	ZINC000044640643	401946817	/nfs/dbraw/zinc/94/68/17/401946817.db2.gz	DPNYTWCPFBTFSY-NEPJUHHUSA-N	0	3	315.410	2.434	10	0		DEAEHN
CC(C)CCn1cccc1CN1CC[C@H](N2CCOCC2)C1	ZINC000121099927	402015074	/nfs/dbraw/zinc/01/50/74/402015074.db2.gz	YXAUXYITXARNBG-SFHVURJKSA-N	0	3	305.466	2.441	10	0		DEAEHN
Cc1ccc([C@@H]2CN(C(=O)NC[C@H](C)N(C)C3CC3)CCO2)o1	ZINC000121313580	402027740	/nfs/dbraw/zinc/02/77/40/402027740.db2.gz	ZTXNNRIVCYWSRI-LRDDRELGSA-N	0	3	321.421	2.154	10	0		DEAEHN
Fc1ccccc1CCN1CCCN(c2cccnn2)CC1	ZINC000121373750	402031578	/nfs/dbraw/zinc/03/15/78/402031578.db2.gz	HRMPXDDANPCWEQ-UHFFFAOYSA-N	0	3	300.381	2.371	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc(C(=O)OC)c(F)c2)C1	ZINC000121449330	402036817	/nfs/dbraw/zinc/03/68/17/402036817.db2.gz	GGYTVLKXIHILKB-GFCCVEGCSA-N	0	3	323.368	2.218	10	0		DEAEHN
C[C@@H](CNC(=O)NCc1ccn(C2CCCC2)n1)N(C)C1CC1	ZINC000151483838	402039260	/nfs/dbraw/zinc/03/92/60/402039260.db2.gz	OAILYJXNZYHCRO-ZDUSSCGKSA-N	0	3	319.453	2.280	10	0		DEAEHN
CC(C)C[C@@H](C)S(=O)(=O)N1CC[C@H](CN2CCCC2)C1	ZINC000151622224	402046887	/nfs/dbraw/zinc/04/68/87/402046887.db2.gz	TTXIDHDZRGPQRI-HUUCEWRRSA-N	0	3	302.484	2.169	10	0		DEAEHN
CCOc1ccccc1CNC(=O)N[C@H]1CCCN(CC)C1	ZINC000054581936	402069934	/nfs/dbraw/zinc/06/99/34/402069934.db2.gz	TYFAQKOGPJVWLA-HNNXBMFYSA-N	0	3	305.422	2.369	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cccc3c2OCCO3)CCN1C	ZINC000122732488	402091814	/nfs/dbraw/zinc/09/18/14/402091814.db2.gz	YPQWGYQVBPWVND-OLZOCXBDSA-N	0	3	304.390	2.013	10	0		DEAEHN
O=C(CN1CCC2(CCC2)C1)NCCN1CCc2ccccc21	ZINC000122928480	402102070	/nfs/dbraw/zinc/10/20/70/402102070.db2.gz	YWOXQPVKWKDATE-UHFFFAOYSA-N	0	3	313.445	2.041	10	0		DEAEHN
CC(C)N(C(=O)CN1CCC[C@@H](Cc2nccn2C)C1)C(C)C	ZINC000123625894	402138379	/nfs/dbraw/zinc/13/83/79/402138379.db2.gz	WWFGFNLFJSXKFO-INIZCTEOSA-N	0	3	320.481	2.320	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2ccn(-c3ccccc3)n2)CCN1C	ZINC000123823261	402148433	/nfs/dbraw/zinc/14/84/33/402148433.db2.gz	MHXYBPNWQSMXGX-GOEBONIOSA-N	0	3	312.417	2.427	10	0		DEAEHN
CC[NH+]1CCC(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)CC1	ZINC000103519915	402192183	/nfs/dbraw/zinc/19/21/83/402192183.db2.gz	SPNYVJTZZNLRCO-UHFFFAOYSA-N	0	3	318.417	2.320	10	0		DEAEHN
CCN(CCNC(=O)N(C)CCOc1ccc(C)cc1)C1CC1	ZINC000102069111	402162455	/nfs/dbraw/zinc/16/24/55/402162455.db2.gz	ZFWPLOLNGCIZPU-UHFFFAOYSA-N	0	3	319.449	2.500	10	0		DEAEHN
CN(C)CCOc1cc(CNC(=O)N2CCCC2(C)C)ccn1	ZINC000153686307	402163119	/nfs/dbraw/zinc/16/31/19/402163119.db2.gz	PSWHDBVDELEQSI-UHFFFAOYSA-N	0	3	320.437	2.106	10	0		DEAEHN
CC(C)c1noc(CCC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)n1	ZINC000124121103	402164875	/nfs/dbraw/zinc/16/48/75/402164875.db2.gz	PWAPHBOYEHDIJE-OLZOCXBDSA-N	0	3	308.426	2.067	10	0		DEAEHN
C[C@H](NC(=O)N1CCN(CC2CCCCC2)CC1)[C@H]1CCCO1	ZINC000067699397	402168581	/nfs/dbraw/zinc/16/85/81/402168581.db2.gz	WLUMEXBQPPPWBS-DOTOQJQBSA-N	0	3	323.481	2.461	10	0		DEAEHN
CC[C@H](CO)NC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000067734231	402170515	/nfs/dbraw/zinc/17/05/15/402170515.db2.gz	ZAUSCCODUSYPLG-IAGOWNOFSA-N	0	3	319.449	2.111	10	0		DEAEHN
C[C@]1(CNC(=O)c2csnn2)CCCN1Cc1ccccc1	ZINC000153797623	402171050	/nfs/dbraw/zinc/17/10/50/402171050.db2.gz	UYMKSOKDUUWIGJ-MRXNPFEDSA-N	0	3	316.430	2.323	10	0		DEAEHN
COC(=O)CC(C)(C)CC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000154798624	402233092	/nfs/dbraw/zinc/23/30/92/402233092.db2.gz	PRFQSHFQBLVIKM-OAHLLOKOSA-N	0	3	320.433	2.385	10	0		DEAEHN
COc1ccccc1C[C@H]1CCCN1CCN1CCCC1=O	ZINC000069683226	402238274	/nfs/dbraw/zinc/23/82/74/402238274.db2.gz	NVXRDVXQZIRFGQ-MRXNPFEDSA-N	0	3	302.418	2.325	10	0		DEAEHN
COc1ccccc1C[C@H]1CCCN1CC(=O)N(C)C1CC1	ZINC000069683133	402238674	/nfs/dbraw/zinc/23/86/74/402238674.db2.gz	UCNJVCDIROLOGN-MRXNPFEDSA-N	0	3	302.418	2.323	10	0		DEAEHN
O=S(=O)(c1ccccc1)N1CCCC[C@@H](N2CCCC2)C1	ZINC000107708041	402239259	/nfs/dbraw/zinc/23/92/59/402239259.db2.gz	LLDNTPRCTHZOKA-OAHLLOKOSA-N	0	3	308.447	2.326	10	0		DEAEHN
Cc1nn(C)cc1[C@H](C)NC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000069773788	402243679	/nfs/dbraw/zinc/24/36/79/402243679.db2.gz	IDKJTERATUXEEY-JSGCOSHPSA-N	0	3	309.458	2.065	10	0		DEAEHN
CN(C)C[C@H]1CN(CCOc2cccc3ccccc32)CCO1	ZINC000155268963	402250797	/nfs/dbraw/zinc/25/07/97/402250797.db2.gz	CVICZFBGBDLKIY-KRWDZBQOSA-N	0	3	314.429	2.481	10	0		DEAEHN
c1cnn(CCCCCN2CCCN(c3cccnn3)CC2)c1	ZINC000105800532	402209565	/nfs/dbraw/zinc/20/95/65/402209565.db2.gz	PHUHNAAEVTYOON-UHFFFAOYSA-N	0	3	314.437	2.056	10	0		DEAEHN
CNC(=O)c1ccc(CN2CCC(c3ccnn3C)CC2)cc1	ZINC000109004660	402266580	/nfs/dbraw/zinc/26/65/80/402266580.db2.gz	RWLXPNAHIUPNQZ-UHFFFAOYSA-N	0	3	312.417	2.159	10	0		DEAEHN
C[C@H](NCC(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CCCC1	ZINC000184659916	402289421	/nfs/dbraw/zinc/28/94/21/402289421.db2.gz	LLRWAUYJUHEIIM-LBPRGKRZSA-N	0	3	324.446	2.197	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@@H](CC(C)C)N2CCCCC2=O)C1	ZINC000176292136	402297468	/nfs/dbraw/zinc/29/74/68/402297468.db2.gz	VAXPXIFJQOAYQK-HZPDHXFCSA-N	0	3	323.481	2.014	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1ccc(C(N)=O)c(C)c1	ZINC000176347023	402301634	/nfs/dbraw/zinc/30/16/34/402301634.db2.gz	AOLNFCOWDOYJRO-AWEZNQCLSA-N	0	3	318.421	2.042	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1ccc(-c2nc[nH]n2)cc1	ZINC000184878582	402306173	/nfs/dbraw/zinc/30/61/73/402306173.db2.gz	UECUDUOTKHXUCI-OAHLLOKOSA-N	0	3	315.421	2.178	10	0		DEAEHN
Cc1cc(F)ccc1CCNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000176424272	402307922	/nfs/dbraw/zinc/30/79/22/402307922.db2.gz	GOZLDOYLPOSDGQ-MRXNPFEDSA-N	0	3	305.397	2.166	10	0		DEAEHN
Cc1nc([C@H](N[C@@H](C)CCn2cccn2)c2ccccc2)n[nH]1	ZINC000158809226	402311926	/nfs/dbraw/zinc/31/19/26/402311926.db2.gz	YDUVCUQLUWUEJV-XJKSGUPXSA-N	0	3	310.405	2.467	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)Nc2nc3c(s2)COCC3)[C@@H](C)C1	ZINC000176465683	402312141	/nfs/dbraw/zinc/31/21/41/402312141.db2.gz	BNCREFQBBWVKRM-JQWIXIFHSA-N	0	3	324.450	2.066	10	0		DEAEHN
Cc1c(CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cnn1C	ZINC000229809437	402345606	/nfs/dbraw/zinc/34/56/06/402345606.db2.gz	STZAGZOSGCAWPF-AWEZNQCLSA-N	0	3	322.453	2.465	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C[C@@H]1c2ccccc2NC1=O	ZINC000177000932	402358214	/nfs/dbraw/zinc/35/82/14/402358214.db2.gz	JOGVCEWJAIKGFZ-DZGCQCFKSA-N	0	3	315.417	2.055	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(OC)c(OC)c1	ZINC000177005305	402358715	/nfs/dbraw/zinc/35/87/15/402358715.db2.gz	RPJFNNJFYGICAJ-CQSZACIVSA-N	0	3	306.406	2.260	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CCOc1ccc(OC)cc1	ZINC000177017125	402359646	/nfs/dbraw/zinc/35/96/46/402359646.db2.gz	APZOOWMJDRHDCO-HNNXBMFYSA-N	0	3	320.433	2.407	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cccnc1NC(C)C	ZINC000177033685	402361877	/nfs/dbraw/zinc/36/18/77/402361877.db2.gz	AJUCFDSQMVJUKL-AWEZNQCLSA-N	0	3	304.438	2.458	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2ccc3c(c2)OCCCO3)C1	ZINC000177061469	402365362	/nfs/dbraw/zinc/36/53/62/402365362.db2.gz	DSGSXLXIXVRPMP-HIFRSBDPSA-N	0	3	318.417	2.306	10	0		DEAEHN
Cn1nccc1C1CCN(Cc2ccc(-n3ccnc3)nc2)CC1	ZINC000177091609	402368526	/nfs/dbraw/zinc/36/85/26/402368526.db2.gz	MKDSJYDVVGVQSX-UHFFFAOYSA-N	0	3	322.416	2.380	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)c2cccnc2N2CCCC2)[C@@H](C)C1	ZINC000177135539	402373702	/nfs/dbraw/zinc/37/37/02/402373702.db2.gz	DGANPHWAUVBQID-HOCLYGCPSA-N	0	3	316.449	2.140	10	0		DEAEHN
COc1cc(C[NH2+]C(C)(C)[C@@H](C)O)cc(Br)c1[O-]	ZINC000161134647	402374630	/nfs/dbraw/zinc/37/46/30/402374630.db2.gz	CXTXWBYPERGIOX-MRVPVSSYSA-N	0	3	318.211	2.412	10	0		DEAEHN
COCCCOc1cccc(NC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000177144348	402374960	/nfs/dbraw/zinc/37/49/60/402374960.db2.gz	ALAMHMLJFJPPAM-OAHLLOKOSA-N	0	3	321.421	2.270	10	0		DEAEHN
CN(C)Cc1ccccc1CNC(=O)[C@H]1CCCc2n[nH]cc21	ZINC000177274346	402386746	/nfs/dbraw/zinc/38/67/46/402386746.db2.gz	AUAKBADRYHHHTM-HNNXBMFYSA-N	0	3	312.417	2.208	10	0		DEAEHN
COC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(Br)cc1	ZINC000228641919	402339440	/nfs/dbraw/zinc/33/94/40/402339440.db2.gz	QIQFAJBSYNSQKS-TVQRCGJNSA-N	0	3	316.195	2.024	10	0		DEAEHN
COCCOc1ccc(CN2CCC(C(=O)N(C)C)CC2)cc1	ZINC000162622177	402426684	/nfs/dbraw/zinc/42/66/84/402426684.db2.gz	YGVZEBXLSBLPMM-UHFFFAOYSA-N	0	3	320.433	2.012	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H]1CCN(c2ccccc2)C1=O	ZINC000177702601	402428320	/nfs/dbraw/zinc/42/83/20/402428320.db2.gz	IZWRLFMJUKMWCV-IAGOWNOFSA-N	0	3	301.434	2.208	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCc1cccc(F)c1	ZINC000177315440	402390411	/nfs/dbraw/zinc/39/04/11/402390411.db2.gz	HCHOTSKTYPPXHS-INIZCTEOSA-N	0	3	307.413	2.494	10	0		DEAEHN
CCS(=O)(=O)C[C@@H](C)N[C@H](C)c1ccccc1-n1cccn1	ZINC000177332450	402391902	/nfs/dbraw/zinc/39/19/02/402391902.db2.gz	CNFDDSJXDLRMEA-ZIAGYGMSSA-N	0	3	321.446	2.346	10	0		DEAEHN
NC(=O)[C@H](Cc1ccc(Cl)cc1)NCCCc1ccccn1	ZINC000185953421	402392434	/nfs/dbraw/zinc/39/24/34/402392434.db2.gz	NAKSZXMMPUJIJY-INIZCTEOSA-N	0	3	317.820	2.354	10	0		DEAEHN
COC[C@H](C)CN[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000187795636	402511459	/nfs/dbraw/zinc/51/14/59/402511459.db2.gz	WOMGQSOTRNWMNF-NVXWUHKLSA-N	0	3	304.434	2.092	10	0		DEAEHN
COC[C@@H](NC(=O)NCCN1CCCC[C@H]1C)c1ccc(C)o1	ZINC000245424811	402459135	/nfs/dbraw/zinc/45/91/35/402459135.db2.gz	CZQIUUZIVFYAHZ-UKRRQHHQSA-N	0	3	323.437	2.449	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)N(C)CCN(C)C2CC2)s1	ZINC000186732390	402461010	/nfs/dbraw/zinc/46/10/10/402461010.db2.gz	NKBZQTFUUYKUAM-LLVKDONJSA-N	0	3	311.451	2.325	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)NCc1ccccc1	ZINC000245456703	402462814	/nfs/dbraw/zinc/46/28/14/402462814.db2.gz	BOAIQYAPXRYMEO-NVXWUHKLSA-N	0	3	303.450	2.107	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H]1CCN(c2ccccc2)C1=O	ZINC000245465975	402463320	/nfs/dbraw/zinc/46/33/20/402463320.db2.gz	IZWRLFMJUKMWCV-SJORKVTESA-N	0	3	301.434	2.208	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)C[C@H]1CCOc2ccccc21	ZINC000186804655	402465020	/nfs/dbraw/zinc/46/50/20/402465020.db2.gz	XYMYSRAYAOGFSW-CQSZACIVSA-N	0	3	302.418	2.495	10	0		DEAEHN
Cc1cccnc1CN1CCC[C@@H]1CN1C[C@H](C)O[C@@H](C)C1	ZINC000245535293	402468532	/nfs/dbraw/zinc/46/85/32/402468532.db2.gz	KPUPUJHFNWZMOI-YESZJQIVSA-N	0	3	303.450	2.464	10	0		DEAEHN
CCC[C@H](N)C(=O)Nc1ccc(-n2cnc3ccccc32)nc1	ZINC000164980903	402471401	/nfs/dbraw/zinc/47/14/01/402471401.db2.gz	DAGCSOWTWPHLIM-ZDUSSCGKSA-N	0	3	309.373	2.486	10	0		DEAEHN
Cn1cc(CN2CCN3CCCC[C@H]3C2)c(-c2cccnc2)n1	ZINC000245575087	402472177	/nfs/dbraw/zinc/47/21/77/402472177.db2.gz	ZUEDDKGJSMKJLE-KRWDZBQOSA-N	0	3	311.433	2.152	10	0		DEAEHN
O=C1NCCCC[C@@H]1N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000245589661	402473423	/nfs/dbraw/zinc/47/34/23/402473423.db2.gz	FUUCURVIZGMLFX-IXDOHACOSA-N	0	3	302.418	2.243	10	0		DEAEHN
COc1ccc(CNC(=O)N2CCN3CCC[C@@H]3C2)cc1Cl	ZINC000178262161	402476893	/nfs/dbraw/zinc/47/68/93/402476893.db2.gz	BDGFBMWUFKOQAQ-CYBMUJFWSA-N	0	3	323.824	2.338	10	0		DEAEHN
CN1CC[C@H](NC(=O)NC2CCC(O)CC2)[C@H]1c1ccccc1	ZINC000245658833	402476949	/nfs/dbraw/zinc/47/69/49/402476949.db2.gz	OZXHLKWIQKYJKB-SJJHQCBESA-N	0	3	317.433	2.035	10	0		DEAEHN
CCc1nc(CCNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cs1	ZINC000245662392	402478105	/nfs/dbraw/zinc/47/81/05/402478105.db2.gz	DITBKFKNAIMNAR-GXTWGEPZSA-N	0	3	324.494	2.372	10	0		DEAEHN
C[C@H]1Cc2ccccc2CN1C[C@H]1CCCN(S(C)(=O)=O)C1	ZINC000246153414	402513031	/nfs/dbraw/zinc/51/30/31/402513031.db2.gz	DFILTZIHZIUNKD-LSDHHAIUSA-N	0	3	322.474	2.105	10	0		DEAEHN
Cc1ccc(CN2CCCC[C@H]2CN2CCOCC2)c(C)n1	ZINC000187096165	402482523	/nfs/dbraw/zinc/48/25/23/402482523.db2.gz	BCJLJOIKNJEZEF-SFHVURJKSA-N	0	3	303.450	2.385	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1C[C@H](O)COc1ccccc1	ZINC000178312112	402483114	/nfs/dbraw/zinc/48/31/14/402483114.db2.gz	PQHHMPKESOHVEG-IRXDYDNUSA-N	0	3	315.417	2.096	10	0		DEAEHN
C[C@H](CCNCc1cncc(Br)c1)[S@](C)=O	ZINC000166506047	402485343	/nfs/dbraw/zinc/48/53/43/402485343.db2.gz	PLSSCEYHKHGREX-JDNHERCYSA-N	0	3	305.241	2.091	10	0		DEAEHN
CCCn1nc(C)c(CN2C[C@H](N3CCOCC3)[C@@H](C)C2)c1C	ZINC000245798112	402489093	/nfs/dbraw/zinc/48/90/93/402489093.db2.gz	XKAIBTCDGKHAIF-KSSFIOAISA-N	0	3	320.481	2.062	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N(C)CCc1ccncc1	ZINC000170682707	402513745	/nfs/dbraw/zinc/51/37/45/402513745.db2.gz	PJAGQBZDQWPCNA-MRXNPFEDSA-N	0	3	306.454	2.242	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)NOCc2ccccc2)C1	ZINC000245933320	402499051	/nfs/dbraw/zinc/49/90/51/402499051.db2.gz	IOCJQRBUSGCCBU-HOTGVXAUSA-N	0	3	303.406	2.244	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCc2ccc(F)cc2)C1	ZINC000245961452	402500779	/nfs/dbraw/zinc/50/07/79/402500779.db2.gz	UVTJEPAJZQSDCM-GOEBONIOSA-N	0	3	305.397	2.451	10	0		DEAEHN
C[C@H](NC(=O)[C@@]1(F)CCNC1)c1ccc(Br)cc1	ZINC000178462194	402501269	/nfs/dbraw/zinc/50/12/69/402501269.db2.gz	IHWCHHVHEBZHIZ-TVQRCGJNSA-N	0	3	315.186	2.328	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)N[C@H]2COc3ccccc32)C1	ZINC000245995333	402502555	/nfs/dbraw/zinc/50/25/55/402502555.db2.gz	RFUIITOZQHAUMI-VNQPRFMTSA-N	0	3	315.417	2.246	10	0		DEAEHN
CCOCCN1CCN(Cc2ncc(C)c(OC)c2C)C[C@H]1C	ZINC000246044259	402505528	/nfs/dbraw/zinc/50/55/28/402505528.db2.gz	AZDQDFDQSZKMIL-OAHLLOKOSA-N	0	3	321.465	2.250	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC1C[C@@H](C)C[C@H](C)C1	ZINC000246827923	402546209	/nfs/dbraw/zinc/54/62/09/402546209.db2.gz	GNLNNZYVYQDFDW-OFQRWUPVSA-N	0	3	311.470	2.221	10	0		DEAEHN
O=C(c1csc(-c2ccoc2)n1)N1CCN2CCC[C@@H]2C1	ZINC000170982697	402547091	/nfs/dbraw/zinc/54/70/91/402547091.db2.gz	WYRGYLKBHTXPKQ-GFCCVEGCSA-N	0	3	303.387	2.323	10	0		DEAEHN
C[C@@H](CNC(=O)OC(C)(C)C)N(C)C[C@H](O)COC(C)(C)C	ZINC000178862663	402547787	/nfs/dbraw/zinc/54/77/87/402547787.db2.gz	PBPSRHOFWXCKJH-STQMWFEESA-N	0	3	318.458	2.007	10	0		DEAEHN
Cc1nn(-c2ccccc2)cc1C(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000246957239	402551088	/nfs/dbraw/zinc/55/10/88/402551088.db2.gz	DHMFGRKHINCNFR-PBHICJAKSA-N	0	3	324.428	2.489	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc2c(s1)CCOC2	ZINC000247001027	402553101	/nfs/dbraw/zinc/55/31/01/402553101.db2.gz	FOFZDCFQSQQFFS-YPMHNXCESA-N	0	3	306.431	2.130	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)CCC(=O)c1ccccc1	ZINC000247012931	402553445	/nfs/dbraw/zinc/55/34/45/402553445.db2.gz	FVNOZAMDVZOSLW-HOCLYGCPSA-N	0	3	300.402	2.345	10	0		DEAEHN
CCC(C)(C)NC(=O)CN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1	ZINC000247057454	402555544	/nfs/dbraw/zinc/55/55/44/402555544.db2.gz	ZOTXLGHWNPFLES-GOEBONIOSA-N	0	3	307.482	2.240	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)NC[C@H]2CCCN(C)C2)c1	ZINC000247149226	402558867	/nfs/dbraw/zinc/55/88/67/402558867.db2.gz	NJERGMCQDWKLGM-COXVUDFISA-N	0	3	302.418	2.257	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc(-c3ncon3)cc2)C1	ZINC000171180232	402564229	/nfs/dbraw/zinc/56/42/29/402564229.db2.gz	PMFZLRWHZBBZJI-CQSZACIVSA-N	0	3	315.377	2.342	10	0		DEAEHN
C[C@H](Oc1cccc(F)c1)C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000247520378	402570864	/nfs/dbraw/zinc/57/08/64/402570864.db2.gz	WQQWLVYMBRPNJE-VNHYZAJKSA-N	0	3	306.381	2.288	10	0		DEAEHN
Cc1cc(CNC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)on1	ZINC000179143910	402575889	/nfs/dbraw/zinc/57/58/89/402575889.db2.gz	NPSLZBYYKYTGSV-JKSUJKDBSA-N	0	3	314.389	2.228	10	0		DEAEHN
COCCCCNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000179108911	402573087	/nfs/dbraw/zinc/57/30/87/402573087.db2.gz	FBVNBHSJKFPKBW-CVEARBPZSA-N	0	3	305.422	2.158	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)[C@@H](C)N1CCN2CCC[C@@H]2C1	ZINC000178628065	402519411	/nfs/dbraw/zinc/51/94/11/402519411.db2.gz	QSLRBYXBYYLVJM-SJLPKXTDSA-N	0	3	315.461	2.204	10	0		DEAEHN
CCN(C(=O)[C@@H](C)N1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000178631389	402519656	/nfs/dbraw/zinc/51/96/56/402519656.db2.gz	JJSPPBIOLGVUSG-NVXWUHKLSA-N	0	3	301.434	2.208	10	0		DEAEHN
CCc1ccc(NC(=O)[C@H](C)N2CCN3CCC[C@@H]3C2)cc1	ZINC000178639596	402520800	/nfs/dbraw/zinc/52/08/00/402520800.db2.gz	IGHYDONQACXFEJ-WMLDXEAASA-N	0	3	301.434	2.356	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@H](c2ccc(F)cc2)C1)N(C)C	ZINC000178645909	402521326	/nfs/dbraw/zinc/52/13/26/402521326.db2.gz	CQGPQALZTATGCC-HOTGVXAUSA-N	0	3	308.397	2.456	10	0		DEAEHN
CC[C@@H](Oc1ccccc1C)C(=O)N1CCN2CCC[C@H]2C1	ZINC000246397406	402529378	/nfs/dbraw/zinc/52/93/78/402529378.db2.gz	FCIZZGKHUHZTGH-JKSUJKDBSA-N	0	3	302.418	2.459	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@H](C)Oc2cccc(F)c2)C1	ZINC000246511082	402534760	/nfs/dbraw/zinc/53/47/60/402534760.db2.gz	WZUZOGPLPPIJDN-DZGCQCFKSA-N	0	3	323.412	2.377	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccn(-c3cccc(Cl)c3)n2)C1	ZINC000170864644	402535053	/nfs/dbraw/zinc/53/50/53/402535053.db2.gz	BIACITXNKFDLEL-AWEZNQCLSA-N	0	3	318.808	2.302	10	0		DEAEHN
CO[C@@H]1CC[C@H]2OCCN(CCCOCC(F)(F)F)[C@H]2C1	ZINC000246524124	402535554	/nfs/dbraw/zinc/53/55/54/402535554.db2.gz	KVCZXXMFGIOAQX-FRRDWIJNSA-N	0	3	311.344	2.224	10	0		DEAEHN
CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)N1CC[C@](C)(O)C1	ZINC000248342052	402586801	/nfs/dbraw/zinc/58/68/01/402586801.db2.gz	JHJOBOWAYHDRJL-QAPCUYQASA-N	0	3	304.434	2.269	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1C[C@H](C)[C@@H]2CCCC[C@H]21	ZINC000248409790	402589482	/nfs/dbraw/zinc/58/94/82/402589482.db2.gz	CVDKKDNGWHQUCH-VVLHAWIVSA-N	0	3	323.481	2.317	10	0		DEAEHN
CC[C@H](C)[C@@H](C)C(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000248574207	402596788	/nfs/dbraw/zinc/59/67/88/402596788.db2.gz	OXGIXCLCXXXGMG-GVDBMIGSSA-N	0	3	309.498	2.297	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000248581816	402597355	/nfs/dbraw/zinc/59/73/55/402597355.db2.gz	OWPZBEASMDLZDI-CAOSSQGBSA-N	0	3	311.470	2.221	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000248581825	402597412	/nfs/dbraw/zinc/59/74/12/402597412.db2.gz	OWPZBEASMDLZDI-QKPAOTATSA-N	0	3	311.470	2.221	10	0		DEAEHN
Cn1cc(CN2CCCN(C3CC3)CC2)c(-c2cccnc2)n1	ZINC000179729649	402599039	/nfs/dbraw/zinc/59/90/39/402599039.db2.gz	SIDKYSOKYUMRAA-UHFFFAOYSA-N	0	3	311.433	2.152	10	0		DEAEHN
CCCCOC[C@H](O)CN(CCO)[C@H]1CCc2ccccc21	ZINC000248663653	402602188	/nfs/dbraw/zinc/60/21/88/402602188.db2.gz	ZYESPLNCWRWDIQ-AEFFLSMTSA-N	0	3	307.434	2.146	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(Cc2ccnn2C)C1	ZINC000190458925	402602480	/nfs/dbraw/zinc/60/24/80/402602480.db2.gz	LGJQRXSLFVQDCG-AWEZNQCLSA-N	0	3	319.478	2.139	10	0		DEAEHN
C[C@@H](C(=O)Nc1cc(F)ccc1F)N1CCN2CCC[C@@H]2C1	ZINC000171639030	402604711	/nfs/dbraw/zinc/60/47/11/402604711.db2.gz	ICFUYSMVCGPDPR-WCQYABFASA-N	0	3	309.360	2.072	10	0		DEAEHN
CCCn1cc(CN(C)CC(C)(C)CN2CCOCC2)cn1	ZINC000180040766	402605450	/nfs/dbraw/zinc/60/54/50/402605450.db2.gz	FMQJTFJZWDQCDU-UHFFFAOYSA-N	0	3	308.470	2.083	10	0		DEAEHN
CCC[C@H](C)CN1CCN(C[C@H]2CN(C(C)C)CCO2)CC1	ZINC000180089915	402606969	/nfs/dbraw/zinc/60/69/69/402606969.db2.gz	WQMJBMTYURUQPX-ROUUACIJSA-N	0	3	311.514	2.149	10	0		DEAEHN
Cn1cc([C@H](NC[C@@H]2CCCN2C)c2cccc(F)c2)cn1	ZINC000180238781	402610791	/nfs/dbraw/zinc/61/07/91/402610791.db2.gz	VBZQYGSGJZRZJI-DLBZAZTESA-N	0	3	302.397	2.332	10	0		DEAEHN
O=C(Cc1coc(-c2cccs2)n1)N1CCN2CCC[C@@H]2C1	ZINC000171712646	402613142	/nfs/dbraw/zinc/61/31/42/402613142.db2.gz	JORXHMLJQQYACU-CYBMUJFWSA-N	0	3	317.414	2.252	10	0		DEAEHN
COc1ccc(NC(=O)C[C@H](C)NCC2(C)OCCCO2)cc1	ZINC000190645165	402615782	/nfs/dbraw/zinc/61/57/82/402615782.db2.gz	AAQPXYFMSGOGGI-ZDUSSCGKSA-N	0	3	322.405	2.155	10	0		DEAEHN
COc1ccc([C@@H](C)NCCn2cccn2)cc1NC(C)=O	ZINC000180432410	402616186	/nfs/dbraw/zinc/61/61/86/402616186.db2.gz	GALHOZANJBVKQF-GFCCVEGCSA-N	0	3	302.378	2.201	10	0		DEAEHN
CC(C)CNC(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190677163	402617690	/nfs/dbraw/zinc/61/76/90/402617690.db2.gz	IKZNJGIXPJILNZ-INIZCTEOSA-N	0	3	304.438	2.201	10	0		DEAEHN
CCn1cc([C@H](C)N[C@H]2CCc3nc(C(C)C)nn3C2)cn1	ZINC000180653716	402622402	/nfs/dbraw/zinc/62/24/02/402622402.db2.gz	CLPTVXYYTRXSKJ-JSGCOSHPSA-N	0	3	302.426	2.284	10	0		DEAEHN
O=C(Nc1nc2c(s1)CCCC2)N1CCN2CCC[C@H]2C1	ZINC000171806935	402623929	/nfs/dbraw/zinc/62/39/29/402623929.db2.gz	CFBLEGXZIIUQET-NSHDSACASA-N	0	3	306.435	2.334	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(CCC(C)C)C1CC1	ZINC000171908310	402633005	/nfs/dbraw/zinc/63/30/05/402633005.db2.gz	PYTWMVNZNOKXLZ-INIZCTEOSA-N	0	3	311.470	2.317	10	0		DEAEHN
O=C(NCCCc1cccc(F)c1)N1CCN2CCC[C@H]2C1	ZINC000171908220	402633066	/nfs/dbraw/zinc/63/30/66/402633066.db2.gz	PKXVJUQOSURAAR-INIZCTEOSA-N	0	3	305.397	2.248	10	0		DEAEHN
Cc1c([C@H](C)NC[C@@H](C)N2CCOCC2)cnn1C(C)(C)C	ZINC000191145239	402645437	/nfs/dbraw/zinc/64/54/37/402645437.db2.gz	XFTBMIROGLKBQX-KGLIPLIRSA-N	0	3	308.470	2.318	10	0		DEAEHN
C[C@@H](C(=O)N1CCc2ccccc21)N1CCCN(C2CC2)CC1	ZINC000172346493	402651267	/nfs/dbraw/zinc/65/12/67/402651267.db2.gz	ZZTZZICEESEVSM-HNNXBMFYSA-N	0	3	313.445	2.134	10	0		DEAEHN
Cc1nc(NC(=O)[C@H](C)N2CCCN(C3CC3)CC2)sc1C	ZINC000172348061	402651614	/nfs/dbraw/zinc/65/16/14/402651614.db2.gz	KMXXPOQWDNEAGI-LBPRGKRZSA-N	0	3	322.478	2.257	10	0		DEAEHN
CCN(CC)C(=O)[C@@H]1CCCN1C(=O)[C@@H](C)N1CCCCCC1	ZINC000172365023	402652806	/nfs/dbraw/zinc/65/28/06/402652806.db2.gz	CDDJPIILEBYDDA-CVEARBPZSA-N	0	3	323.481	2.110	10	0		DEAEHN
Cc1cc(C)cc(OC[C@H](O)CN2[C@@H](C)CC(O)C[C@@H]2C)c1	ZINC000191266126	402655568	/nfs/dbraw/zinc/65/55/68/402655568.db2.gz	XDPNGICWRDXHHY-YQQAZPJKSA-N	0	3	307.434	2.277	10	0		DEAEHN
Cc1ncsc1CCN1CCC(N2CCO[C@H](C)C2)CC1	ZINC000172536969	402661704	/nfs/dbraw/zinc/66/17/04/402661704.db2.gz	ZGPUIQFPMJNUSV-CYBMUJFWSA-N	0	3	309.479	2.179	10	0		DEAEHN
C[C@H](C(=O)NCC1CCCCC1)N1CCCN(C2CC2)CC1	ZINC000172541839	402661815	/nfs/dbraw/zinc/66/18/15/402661815.db2.gz	KEVYPTRYNIEBFL-OAHLLOKOSA-N	0	3	307.482	2.242	10	0		DEAEHN
Cc1ncsc1CCN1CCC(N2CCO[C@@H](C)C2)CC1	ZINC000172536973	402661850	/nfs/dbraw/zinc/66/18/50/402661850.db2.gz	ZGPUIQFPMJNUSV-ZDUSSCGKSA-N	0	3	309.479	2.179	10	0		DEAEHN
CN(C)[C@@H](CNC(=O)c1ccc2nnn(C)c2c1)c1ccccc1	ZINC000182253292	402676443	/nfs/dbraw/zinc/67/64/43/402676443.db2.gz	CYMJVZDORNAFCG-KRWDZBQOSA-N	0	3	323.400	2.001	10	0		DEAEHN
COc1ccc2c(c1)[C@H](NC[C@H]1CN(C)CCO1)CCS2	ZINC000191529313	402676615	/nfs/dbraw/zinc/67/66/15/402676615.db2.gz	AZMXPCDQMABJFZ-DZGCQCFKSA-N	0	3	308.447	2.152	10	0		DEAEHN
CCOc1cc(/C=C/C(=O)N2CCN3CCC[C@@H]3C2)ccc1O	ZINC000182391051	402686301	/nfs/dbraw/zinc/68/63/01/402686301.db2.gz	LEFQQOKKIRKCQL-PMGBHYCQSA-N	0	3	316.401	2.111	10	0		DEAEHN
CN(CCN1CCC(n2cncn2)CC1)Cc1ccc(F)cc1	ZINC000173206540	402688416	/nfs/dbraw/zinc/68/84/16/402688416.db2.gz	BPKHLQKXWGEIBG-UHFFFAOYSA-N	0	3	317.412	2.186	10	0		DEAEHN
Cc1ccccc1CS(=O)(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000173276701	402690537	/nfs/dbraw/zinc/69/05/37/402690537.db2.gz	FSTRGRURAJIGMD-ZBFHGGJFSA-N	0	3	310.463	2.239	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(C(=O)c3ccc(F)cc3)C2)CC1	ZINC000173292018	402691053	/nfs/dbraw/zinc/69/10/53/402691053.db2.gz	SQALXNPANKQNBI-KRWDZBQOSA-N	0	3	319.424	2.068	10	0		DEAEHN
Fc1ccc(SCCN2CC[C@H](N3CCOCC3)C2)cc1	ZINC000173938465	402720561	/nfs/dbraw/zinc/72/05/61/402720561.db2.gz	IWKMJUZSTMHXAU-HNNXBMFYSA-N	0	3	310.438	2.324	10	0		DEAEHN
COc1cccc(F)c1[C@H](C)NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000173509296	402700568	/nfs/dbraw/zinc/70/05/68/402700568.db2.gz	GWDOQBHASYPTCD-QWHCGFSZSA-N	0	3	321.396	2.385	10	0		DEAEHN
CC(C)[C@@H](C(=O)N1CCO[C@H](CN(C)C)C1)c1ccccc1	ZINC000173522186	402700749	/nfs/dbraw/zinc/70/07/49/402700749.db2.gz	YLJWCLAGVLEHFV-IAGOWNOFSA-N	0	3	304.434	2.215	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(Cc3cccc(Cl)n3)C2)CC1	ZINC000182909666	402726136	/nfs/dbraw/zinc/72/61/36/402726136.db2.gz	ZPDORLPDECUTIJ-MRXNPFEDSA-N	0	3	322.884	2.337	10	0		DEAEHN
CC(C)c1cnc(NC(=O)N2CCO[C@H](CN(C)C)C2)s1	ZINC000192395223	402727117	/nfs/dbraw/zinc/72/71/17/402727117.db2.gz	PLXXRZRUVXSWPP-LLVKDONJSA-N	0	3	312.439	2.061	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H](C)Oc2ccc(F)cc2)C1	ZINC000174233892	402732645	/nfs/dbraw/zinc/73/26/45/402732645.db2.gz	NMXBPVRJAKDTCG-HIFRSBDPSA-N	0	3	323.412	2.377	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC(C(F)(F)F)CC2)C1	ZINC000174232483	402732716	/nfs/dbraw/zinc/73/27/16/402732716.db2.gz	JXCOYTXSZOQQOF-LBPRGKRZSA-N	0	3	307.360	2.455	10	0		DEAEHN
C[C@H](NCC(=O)N(Cc1ccccc1)C1CC1)[C@@H]1CCCO1	ZINC000183174728	402744221	/nfs/dbraw/zinc/74/42/21/402744221.db2.gz	IUTBZZXTCBNGIT-YOEHRIQHSA-N	0	3	302.418	2.335	10	0		DEAEHN
C[C@H](C(=O)OC(C)(C)C)N(C)C(=O)C1CCN(C2CC2)CC1	ZINC000192715777	402745795	/nfs/dbraw/zinc/74/57/95/402745795.db2.gz	MMEPCXNATLOULO-GFCCVEGCSA-N	0	3	310.438	2.049	10	0		DEAEHN
Cc1cnc([C@@H](C)CNC(=O)N2CC[C@@H](N3CC=CC3)C2)s1	ZINC000183193020	402746344	/nfs/dbraw/zinc/74/63/44/402746344.db2.gz	NPUIRPNOXRHMJG-GXTWGEPZSA-N	0	3	320.462	2.211	10	0		DEAEHN
CC[C@@H](Oc1ccccc1F)c1nc([C@@H]2CNCCN2C)no1	ZINC000263238965	402748920	/nfs/dbraw/zinc/74/89/20/402748920.db2.gz	OJQWUHFVGFPGBE-QWHCGFSZSA-N	0	3	320.368	2.315	10	0		DEAEHN
COCCN(C)CCNC(=O)N1CCCC[C@H]1c1ccc(C)o1	ZINC000174622967	402748958	/nfs/dbraw/zinc/74/89/58/402748958.db2.gz	AQJOOTMVSNETJI-HNNXBMFYSA-N	0	3	323.437	2.403	10	0		DEAEHN
Cc1ccc(SCCc2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263245757	402749680	/nfs/dbraw/zinc/74/96/80/402749680.db2.gz	PGHJUNJIZZFAKE-CQSZACIVSA-N	0	3	318.446	2.289	10	0		DEAEHN
CC(C)OCc1ccc(-c2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263256307	402751177	/nfs/dbraw/zinc/75/11/77/402751177.db2.gz	QNOOCQOMGSUFRE-HNNXBMFYSA-N	0	3	316.405	2.238	10	0		DEAEHN
Cc1csc([C@H](C)NC(=O)N2CC[C@@H](N3CC=CC3)C2)n1	ZINC000174661822	402751301	/nfs/dbraw/zinc/75/13/01/402751301.db2.gz	RMUVPCALZSCOSU-QWHCGFSZSA-N	0	3	306.435	2.168	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2ccc(OCC3CC3)cc2)n1	ZINC000263276845	402753305	/nfs/dbraw/zinc/75/33/05/402753305.db2.gz	SYHZFMJDWPKRBS-OAHLLOKOSA-N	0	3	314.389	2.102	10	0		DEAEHN
COc1ccc([C@H](C)Cc2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263295425	402755284	/nfs/dbraw/zinc/75/52/84/402755284.db2.gz	WEVIMTQTYOYURA-DOMZBBRYSA-N	0	3	316.405	2.001	10	0		DEAEHN
c1coc(-c2ncc(CN[C@@H]3CCc4ncnn4C3)s2)c1	ZINC000193092024	402764142	/nfs/dbraw/zinc/76/41/42/402764142.db2.gz	DGGQTVQAKLLMLA-SNVBAGLBSA-N	0	3	301.375	2.099	10	0		DEAEHN
COc1ncc(C)cc1NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000174964642	402767261	/nfs/dbraw/zinc/76/72/61/402767261.db2.gz	QFBILLIQMZHTAG-OLZOCXBDSA-N	0	3	306.410	2.345	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)CSCc1ccccn1	ZINC000174972172	402768098	/nfs/dbraw/zinc/76/80/98/402768098.db2.gz	OLNWBQPRWQKNRO-JKSUJKDBSA-N	0	3	319.474	2.400	10	0		DEAEHN
CCc1ccc(CCNC(=O)N2CC[C@H](N3CC=CC3)C2)cc1	ZINC000175071017	402776394	/nfs/dbraw/zinc/77/63/94/402776394.db2.gz	YQXANLUZFOCTQJ-SFHVURJKSA-N	0	3	313.445	2.447	10	0		DEAEHN
CCc1nc2n(n1)C[C@@H](NCc1ccc(C)c(OC)c1)CC2	ZINC000194298462	402790862	/nfs/dbraw/zinc/79/08/62/402790862.db2.gz	OAPDLAOHTCZZPV-AWEZNQCLSA-N	0	3	300.406	2.262	10	0		DEAEHN
CC(C)(C)n1nc(C(=O)N2CCN3CCC[C@@H]3C2)cc1C1CC1	ZINC000195334113	402842525	/nfs/dbraw/zinc/84/25/25/402842525.db2.gz	FIBHAXPBTCAFKI-CQSZACIVSA-N	0	3	316.449	2.436	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@@H](C)OCc2cccc(OC)c2)C1	ZINC000194659263	402808815	/nfs/dbraw/zinc/80/88/15/402808815.db2.gz	LHJOURDINSRPDE-GDBMZVCRSA-N	0	3	320.433	2.201	10	0		DEAEHN
CC[C@H](C)[C@H](C)C(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000184061201	402815285	/nfs/dbraw/zinc/81/52/85/402815285.db2.gz	OXGIXCLCXXXGMG-ULQDDVLXSA-N	0	3	309.498	2.297	10	0		DEAEHN
CO[C@@H](C)c1nc(C)c(C(=O)N(C)C2CCN(C)CC2)s1	ZINC000175567171	402817814	/nfs/dbraw/zinc/81/78/14/402817814.db2.gz	WJXGCLBZJNCZTN-NSHDSACASA-N	0	3	311.451	2.325	10	0		DEAEHN
Cc1ccccc1OCCN1C[C@H](C)[C@H](N2CCOCC2)C1	ZINC000175587026	402819576	/nfs/dbraw/zinc/81/95/76/402819576.db2.gz	HPBUVYSSYQHUKU-DLBZAZTESA-N	0	3	304.434	2.026	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1cccc(NC(=O)C2CC2)c1	ZINC000263926771	402821376	/nfs/dbraw/zinc/82/13/76/402821376.db2.gz	SBNBWZGJOOMNPL-MRXNPFEDSA-N	0	3	315.417	2.201	10	0		DEAEHN
CN(C)c1ccncc1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000184205506	402826480	/nfs/dbraw/zinc/82/64/80/402826480.db2.gz	YAJXNHXTJXCUFB-AEFFLSMTSA-N	0	3	324.428	2.323	10	0		DEAEHN
Cn1c2ccc(CN(CCCCO)C3CC3)cc2sc1=O	ZINC000195020762	402827630	/nfs/dbraw/zinc/82/76/30/402827630.db2.gz	HLNMKTPLXCDOKM-UHFFFAOYSA-N	0	3	306.431	2.337	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC[C@H](c2nncn2C(C)C)C1	ZINC000195195439	402835931	/nfs/dbraw/zinc/83/59/31/402835931.db2.gz	VGJJLYZQHQHSJQ-JKSUJKDBSA-N	0	3	324.469	2.216	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)N[C@H]1COc2ccccc21	ZINC000195197682	402836580	/nfs/dbraw/zinc/83/65/80/402836580.db2.gz	VTTKNWVBJXOQLR-HIFRSBDPSA-N	0	3	303.406	2.294	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NC[C@H](CO)c1ccccc1	ZINC000175865452	402838993	/nfs/dbraw/zinc/83/89/93/402838993.db2.gz	DMSRKDHDCPPPRO-SJORKVTESA-N	0	3	321.465	2.038	10	0		DEAEHN
Cc1nn(-c2ccccc2)c(C)c1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000195311127	402841393	/nfs/dbraw/zinc/84/13/93/402841393.db2.gz	IJGWZOSWEFLLQD-QGZVFWFLSA-N	0	3	324.428	2.409	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)[C@@H](C)N1CCN2CCC[C@@H]2C1	ZINC000175206884	402788197	/nfs/dbraw/zinc/78/81/97/402788197.db2.gz	ZLANQJROUSNXFN-SJLPKXTDSA-N	0	3	315.461	2.122	10	0		DEAEHN
O=C(Cc1ccc(-n2cccn2)cc1)N1CCCN(C2CC2)CC1	ZINC000195411323	402844739	/nfs/dbraw/zinc/84/47/39/402844739.db2.gz	SDRMICNCINDHHK-UHFFFAOYSA-N	0	3	324.428	2.112	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NC1CCSCC1)c1ccccc1	ZINC000195469932	402846785	/nfs/dbraw/zinc/84/67/85/402846785.db2.gz	BZSHNPPBBVCRIN-HNNXBMFYSA-N	0	3	307.463	2.484	10	0		DEAEHN
O=C(CN1CCC(c2ccn[nH]2)CC1)NCc1ccccc1F	ZINC000195505828	402848186	/nfs/dbraw/zinc/84/81/86/402848186.db2.gz	IEGCBVPASWPRHJ-UHFFFAOYSA-N	0	3	316.380	2.045	10	0		DEAEHN
COc1ccccc1NC(=O)CN1CCC(c2ccn[nH]2)CC1	ZINC000195506808	402848426	/nfs/dbraw/zinc/84/84/26/402848426.db2.gz	BZYQLRUPOCZPOQ-UHFFFAOYSA-N	0	3	314.389	2.236	10	0		DEAEHN
CN(Cc1cccs1)C(=O)CN1CCC(c2ccn[nH]2)CC1	ZINC000195513441	402848628	/nfs/dbraw/zinc/84/86/28/402848628.db2.gz	IGDMMEYZQLPCQT-UHFFFAOYSA-N	0	3	318.446	2.309	10	0		DEAEHN
c1cn(Cc2ccccc2)c(CN[C@H]2CCc3nc[nH]c3C2)n1	ZINC000566590954	292254094	/nfs/dbraw/zinc/25/40/94/292254094.db2.gz	NSVDJOFGPJBZKB-HNNXBMFYSA-N	0	3	307.401	2.302	10	0		DEAEHN
c1cn(Cc2ccccc2)c(CN[C@H]2CCc3[nH]cnc3C2)n1	ZINC000566590954	292254095	/nfs/dbraw/zinc/25/40/95/292254095.db2.gz	NSVDJOFGPJBZKB-HNNXBMFYSA-N	0	3	307.401	2.302	10	0		DEAEHN
C/C(=C/c1ccc(F)cc1)C(=O)NCCCN1CCC(O)CC1	ZINC000267290410	403033232	/nfs/dbraw/zinc/03/32/32/403033232.db2.gz	ZPKAQURTDZHVHG-YPKPFQOOSA-N	0	3	320.408	2.192	10	0		DEAEHN
CC(C)N(CCOCCO)Cc1ccc(Br)cn1	ZINC000283800965	403224967	/nfs/dbraw/zinc/22/49/67/403224967.db2.gz	VRSIRYVAAIRHMU-UHFFFAOYSA-N	0	3	317.227	2.063	10	0		DEAEHN
CN1CC[C@H]2OCCN(c3ncnc4c5ccccc5oc43)[C@@H]2C1	ZINC000284426370	403267731	/nfs/dbraw/zinc/26/77/31/403267731.db2.gz	AEXRXYFGGRFKCH-UKRRQHHQSA-N	0	3	324.384	2.285	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CCO1	ZINC000271266512	403283787	/nfs/dbraw/zinc/28/37/87/403283787.db2.gz	NMMIMCIDCPRUIW-MXASKKJJSA-N	0	3	317.433	2.299	10	0		DEAEHN
Cc1oncc1CN(C)C[C@@H]1CCCN(C)[C@H]1c1ccnn1C	ZINC000346927332	403607211	/nfs/dbraw/zinc/60/72/11/403607211.db2.gz	NEFWLVJTOWPQKX-WMLDXEAASA-N	0	3	317.437	2.231	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)NCCN2CCCC[C@H]2C)nc1	ZINC000347325637	403664548	/nfs/dbraw/zinc/66/45/48/403664548.db2.gz	HIYTVDHWQHUDCK-GFCCVEGCSA-N	0	3	304.394	2.280	10	0		DEAEHN
CN1CCC[C@]2(CCN(C(=O)c3csc(NC4CC4)n3)C2)C1	ZINC000294369574	403715599	/nfs/dbraw/zinc/71/55/99/403715599.db2.gz	ZIAFBPDXXHCAMN-INIZCTEOSA-N	0	3	320.462	2.275	10	0		DEAEHN
CCN(C)[C@H]1CCN(c2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000302755829	403722444	/nfs/dbraw/zinc/72/24/44/403722444.db2.gz	IQIDPCCHYDEVJM-LBPRGKRZSA-N	0	3	318.389	2.213	10	0		DEAEHN
C[C@@H](N[C@@H]1CCc2nnnn2CC1)c1nc2c(s1)CCCC2	ZINC000333681687	403813879	/nfs/dbraw/zinc/81/38/79/403813879.db2.gz	FGNZGXYUKUVHEV-GHMZBOCLSA-N	0	3	318.450	2.064	10	0		DEAEHN
COc1ccc2c(c1)C(C)(C)C[C@H]2N[C@@H]1CCC(=O)N(C)C1=O	ZINC000333560683	403780434	/nfs/dbraw/zinc/78/04/34/403780434.db2.gz	KWLPZUMQBYMECA-HUUCEWRRSA-N	0	3	316.401	2.155	10	0		DEAEHN
C/C(=C\c1ccc(F)cc1)C(=O)N[C@@H]1CCCN(CCCO)C1	ZINC000296356835	404211225	/nfs/dbraw/zinc/21/12/25/404211225.db2.gz	FMUYKBOZOMTCMY-ABDJAZHISA-N	0	3	320.408	2.192	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@@H]1NCc1cccc(Br)c1F	ZINC000296862866	404346815	/nfs/dbraw/zinc/34/68/15/404346815.db2.gz	PCCVWDNHHQRZOU-KCJUWKMLSA-N	0	3	315.186	2.345	10	0		DEAEHN
Cc1ccc([C@@H](C)NCCCS(=O)(=O)N(C)C)cc1F	ZINC000342250103	404466913	/nfs/dbraw/zinc/46/69/13/404466913.db2.gz	YZTMPERWTNVMRV-GFCCVEGCSA-N	0	3	302.415	2.066	10	0		DEAEHN
Cc1cc(CN[C@H]2[C@@H]3CCO[C@@H]3C2(C)C)nc(N2CCCC2)n1	ZINC000330210121	404587895	/nfs/dbraw/zinc/58/78/95/404587895.db2.gz	CEPHBMSPWONYKS-JYJNAYRXSA-N	0	3	316.449	2.288	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@@H]1COc2ccccc2C1	ZINC000291994553	404617482	/nfs/dbraw/zinc/61/74/82/404617482.db2.gz	UGVSXDHFRWFOPX-KRWDZBQOSA-N	0	3	320.396	2.420	10	0		DEAEHN
Cn1ccnc1[C@@H](N[C@H]1CC[C@@H](C(=O)N2CCCC2)C1)C1CC1	ZINC000373894671	404629775	/nfs/dbraw/zinc/62/97/75/404629775.db2.gz	XYBNDQZLCLTYHD-PMPSAXMXSA-N	0	3	316.449	2.252	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(CCCc2cccc(F)c2)CC12COC2	ZINC000451132987	404874728	/nfs/dbraw/zinc/87/47/28/404874728.db2.gz	JKOJTQYPAZNBBX-INIZCTEOSA-N	0	3	321.392	2.270	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)N(C)CCCO)CCN1Cc1ccccc1	ZINC000367009406	404896714	/nfs/dbraw/zinc/89/67/14/404896714.db2.gz	GMKOPSNTZTWFGZ-RDJZCZTQSA-N	0	3	319.449	2.063	10	0		DEAEHN
CC(C)(O)[C@H]1CCCN1CC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000408032450	405094027	/nfs/dbraw/zinc/09/40/27/405094027.db2.gz	XDSFVSPIXYUAIU-LZUXJJCOSA-N	0	3	320.477	2.307	10	0		DEAEHN
CN(CC1CC1)C(=O)CN1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000361379330	405046631	/nfs/dbraw/zinc/04/66/31/405046631.db2.gz	USFOEQNRRUFAOF-ZACQAIPSSA-N	0	3	308.466	2.260	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CC[C@@H]3[C@H](CCCN3C3CC3)C2)o1	ZINC000408097822	405111127	/nfs/dbraw/zinc/11/11/27/405111127.db2.gz	NYOVWBJERWLAPF-UKRRQHHQSA-N	0	3	324.446	2.225	10	0		DEAEHN
CCc1nc(C(=O)N2CCCN(CC3CCCCC3)CC2)no1	ZINC000408331032	405175068	/nfs/dbraw/zinc/17/50/68/405175068.db2.gz	VMQVQJLVGHFNRS-UHFFFAOYSA-N	0	3	320.437	2.360	10	0		DEAEHN
CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)NCCNc1ccncc1	ZINC000439041321	405263633	/nfs/dbraw/zinc/26/36/33/405263633.db2.gz	QGXAEWOIAAVKIC-OIISXLGYSA-N	0	3	319.449	2.406	10	0		DEAEHN
CC[NH+](CC)CC1CCN(C(=O)c2ccc(O)cc2[O-])CC1	ZINC000439061168	405264357	/nfs/dbraw/zinc/26/43/57/405264357.db2.gz	RIRBWYUGMWYSJG-UHFFFAOYSA-N	0	3	306.406	2.292	10	0		DEAEHN
c1cncc(CNCCCNc2cc(N3CCCC3)ncn2)c1	ZINC000420177731	405292133	/nfs/dbraw/zinc/29/21/33/405292133.db2.gz	CPEKALNYBHBVNL-UHFFFAOYSA-N	0	3	312.421	2.064	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2ccc(OCC)cc2)CC12COC2	ZINC000449367338	405527202	/nfs/dbraw/zinc/52/72/02/405527202.db2.gz	VJFBAWSJTANSAA-INIZCTEOSA-N	0	3	319.401	2.097	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2cc(C)sc2C)CC12COC2	ZINC000449367470	405529436	/nfs/dbraw/zinc/52/94/36/405529436.db2.gz	WMVUBOHTOVVOJC-AWEZNQCLSA-N	0	3	309.431	2.376	10	0		DEAEHN
Cc1ccncc1CNCCn1cc(Br)ccc1=O	ZINC000449381424	405530877	/nfs/dbraw/zinc/53/08/77/405530877.db2.gz	YTQMPRUGZODWGO-UHFFFAOYSA-N	0	3	322.206	2.104	10	0		DEAEHN
CCc1nc2cc(CNC(=O)CNC3CC3)ccc2n1C1CC1	ZINC000580433950	405614025	/nfs/dbraw/zinc/61/40/25/405614025.db2.gz	GXEDODRWFSQWMW-UHFFFAOYSA-N	0	3	312.417	2.302	10	0		DEAEHN
COC(=O)CC1(CC(=O)N(C)[C@@H]2CCN(C(C)C)C2)CCCC1	ZINC000457085420	405688269	/nfs/dbraw/zinc/68/82/69/405688269.db2.gz	HFLPEUVWJFJYJO-OAHLLOKOSA-N	0	3	324.465	2.441	10	0		DEAEHN
CS(=O)(=O)NC[C@H]1CCCN(Cc2ccc(C3CC3)cc2)C1	ZINC000459286690	405836813	/nfs/dbraw/zinc/83/68/13/405836813.db2.gz	XETUFKOERAMCPU-OAHLLOKOSA-N	0	3	322.474	2.325	10	0		DEAEHN
CN(C)CCN(CCN(C)C)C(=O)CC/C=C\c1ccccc1	ZINC000530641392	405837645	/nfs/dbraw/zinc/83/76/45/405837645.db2.gz	HOTNSFVPFSYHFV-WQLSENKSSA-N	0	3	317.477	2.432	10	0		DEAEHN
c1nc2n(n1)[C@@H](CN1CCC[C@H]1c1ccc3c(c1)OCO3)CC2	ZINC000639473998	406105513	/nfs/dbraw/zinc/10/55/13/406105513.db2.gz	QVKILVXEUOGHGC-KGLIPLIRSA-N	0	3	312.373	2.331	10	0		DEAEHN
CC[C@H](C[C@H](C)CO)NCc1c(Br)cnn1C	ZINC000487302734	406222175	/nfs/dbraw/zinc/22/21/75/406222175.db2.gz	RFJQCTQAPDGNFK-VHSXEESVSA-N	0	3	304.232	2.069	10	0		DEAEHN
CC[C@@H](NCc1c(Br)cnn1C)C1CCOCC1	ZINC000487306337	406222622	/nfs/dbraw/zinc/22/26/22/406222622.db2.gz	WUFVAYUBISOHAM-GFCCVEGCSA-N	0	3	316.243	2.477	10	0		DEAEHN
CC(C)[C@H]1C[C@@H](NCc2c(Br)cnn2C)CCO1	ZINC000487579350	406249786	/nfs/dbraw/zinc/24/97/86/406249786.db2.gz	VMOFSYDREUDFKM-GXFFZTMASA-N	0	3	316.243	2.476	10	0		DEAEHN
Cc1cc(C[C@H](C)NC(=O)NC[C@@H](C)N2CCCC[C@@H]2C)[nH]n1	ZINC000487549250	406244791	/nfs/dbraw/zinc/24/47/91/406244791.db2.gz	HJAXNIBVERYZHM-AEGPPILISA-N	0	3	321.469	2.211	10	0		DEAEHN
CCc1ccc([C@H](C)NC(=O)CN2CC[C@@H](CO)[C@H]2C)cc1	ZINC000488806591	406349730	/nfs/dbraw/zinc/34/97/30/406349730.db2.gz	VFEXURUWGSXIAX-VBQJREDUSA-N	0	3	304.434	2.129	10	0		DEAEHN
C[C@H](c1ccc(F)cc1)N(C)C(=O)CN1CC[C@@H](CO)[C@H]1C	ZINC000488808744	406350030	/nfs/dbraw/zinc/35/00/30/406350030.db2.gz	ROLSYBNTZPGCBF-NFAWXSAZSA-N	0	3	308.397	2.048	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CCC[C@H]2CCC[C@H]21	ZINC000637954257	406494353	/nfs/dbraw/zinc/49/43/53/406494353.db2.gz	UZQKAZKHHCXHPE-FGTMMUONSA-N	0	3	315.461	2.237	10	0		DEAEHN
COc1cccc(NC(=O)[C@H](N)CN(C)Cc2ccccc2)c1	ZINC000637870346	406454794	/nfs/dbraw/zinc/45/47/94/406454794.db2.gz	YUMDMSCOTZYFFC-QGZVFWFLSA-N	0	3	313.401	2.093	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N(C)C1CCCCC1	ZINC000637869461	406455635	/nfs/dbraw/zinc/45/56/35/406455635.db2.gz	WHGXTTBQFFNVLV-KRWDZBQOSA-N	0	3	303.450	2.237	10	0		DEAEHN
C[C@H](N(C)C(=O)[C@H](N)CN(C)Cc1ccccc1)C1(C)CC1	ZINC000638042281	406539252	/nfs/dbraw/zinc/53/92/52/406539252.db2.gz	QFBXULHXCZBLAX-GOEBONIOSA-N	0	3	303.450	2.093	10	0		DEAEHN
Cc1cc(C)n(CCN2CC[C@@H](c3nc(C4CC4)no3)C2)n1	ZINC000551944838	406657828	/nfs/dbraw/zinc/65/78/28/406657828.db2.gz	BYUOEDBGDBFANZ-CQSZACIVSA-N	0	3	301.394	2.250	10	0		DEAEHN
CCN1CCN(C(=O)[C@H]2CCc3nc(C(C)C)[nH]c3C2)[C@H](C)C1	ZINC000553329397	406751146	/nfs/dbraw/zinc/75/11/46/406751146.db2.gz	HERAPKWRKANTGY-KGLIPLIRSA-N	0	3	318.465	2.191	10	0		DEAEHN
CCN1CCN(C(=O)[C@H]2CCc3[nH]c(C(C)C)nc3C2)[C@H](C)C1	ZINC000553329397	406751150	/nfs/dbraw/zinc/75/11/50/406751150.db2.gz	HERAPKWRKANTGY-KGLIPLIRSA-N	0	3	318.465	2.191	10	0		DEAEHN
c1nc(N2CCCC2)ncc1CNC[C@H]1CCN1C1CCCC1	ZINC000527807040	406759245	/nfs/dbraw/zinc/75/92/45/406759245.db2.gz	LOOOMOCXIMZATM-QGZVFWFLSA-N	0	3	315.465	2.183	10	0		DEAEHN
c1cc(CNCCN2CCN(c3ccccc3)CC2)sn1	ZINC000638339154	406710930	/nfs/dbraw/zinc/71/09/30/406710930.db2.gz	KHSLSUNGANWTGM-UHFFFAOYSA-N	0	3	302.447	2.055	10	0		DEAEHN
CN(Cc1cccc(Cl)c1Cl)C(=O)[C@@H]1CNCCOC1	ZINC000643618634	407018276	/nfs/dbraw/zinc/01/82/76/407018276.db2.gz	WXBFQBBOPASNLL-LLVKDONJSA-N	0	3	317.216	2.188	10	0		DEAEHN
CC[C@@H]1CCc2nc(NC(=O)C3(N)CCOCC3)sc2C1	ZINC000261909389	287121198	/nfs/dbraw/zinc/12/11/98/287121198.db2.gz	SVJQNTIYBQZCOD-SNVBAGLBSA-N	0	3	309.435	2.104	10	0		DEAEHN
C[C@H]1CN(C)CC[C@@H]1NC(=O)c1cc(Cl)ncc1Cl	ZINC000129436630	196048592	/nfs/dbraw/zinc/04/85/92/196048592.db2.gz	KIYSAHKBTITVTD-KWQFWETISA-N	0	3	302.205	2.458	10	0		DEAEHN
CCc1cc(C[C@H](N)c2ccc(Br)cn2)n(C)n1	ZINC000130765112	196108459	/nfs/dbraw/zinc/10/84/59/196108459.db2.gz	AZPGUMPIVLXPKZ-LBPRGKRZSA-N	0	3	309.211	2.383	10	0		DEAEHN
Cn1cc(CN)c(NC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)n1	ZINC000131860097	196204385	/nfs/dbraw/zinc/20/43/85/196204385.db2.gz	FPJMBCLSXAJIQE-WPRPVWTQSA-N	0	3	304.316	2.186	10	0		DEAEHN
CCN[C@H](C[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccoc1C	ZINC000132754193	196280829	/nfs/dbraw/zinc/28/08/29/196280829.db2.gz	JUOKRHYEFQHLPI-DZGCQCFKSA-N	0	3	314.451	2.300	10	0		DEAEHN
C[S@@](=O)CCN[C@H]1CCc2cc(Br)ccc21	ZINC000133789256	196335896	/nfs/dbraw/zinc/33/58/96/196335896.db2.gz	FZNLYBSYMCUOGT-LRDDRELGSA-N	0	3	302.237	2.405	10	0		DEAEHN
CCN[C@H]1CCCc2nc([C@H]3CCS(=O)(=O)C3)sc21	ZINC000134590507	196405239	/nfs/dbraw/zinc/40/52/39/196405239.db2.gz	DYWGAZXDRYTQAA-UWVGGRQHSA-N	0	3	300.449	2.032	10	0		DEAEHN
C[C@@H](O)CCN(C)[C@@H](CN)c1ccccc1Br	ZINC000135524792	196482835	/nfs/dbraw/zinc/48/28/35/196482835.db2.gz	KGTOZJMIRJSLEF-MFKMUULPSA-N	0	3	301.228	2.152	10	0		DEAEHN
O=C1C[C@@H](NC2CCSCC2)C(=O)N1C1CCCCCC1	ZINC000136365858	196534057	/nfs/dbraw/zinc/53/40/57/196534057.db2.gz	GWEKILTVOZBGRQ-CQSZACIVSA-N	0	3	310.463	2.322	10	0		DEAEHN
Cc1csc2c1ncnc2N1CCN(CC(C)(C)O)[C@H](C)C1	ZINC000192844657	225143575	/nfs/dbraw/zinc/14/35/75/225143575.db2.gz	IPDHYLPWRKJNEO-GFCCVEGCSA-N	0	3	320.462	2.281	10	0		DEAEHN
Cc1csc2c1ncnc2N1CCN(CC(C)(C)O)C[C@@H]1C	ZINC000192843277	225144629	/nfs/dbraw/zinc/14/46/29/225144629.db2.gz	SQJQQFJCHHZWOL-LBPRGKRZSA-N	0	3	320.462	2.281	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)NC[C@@H]1Cc2ccccc21	ZINC000193696266	424870432	/nfs/dbraw/zinc/87/04/32/424870432.db2.gz	IKBFJBSECKREKX-ZBFHGGJFSA-N	0	3	301.434	2.500	10	0		DEAEHN
Cn1c(CN2CCN(CCC(C)(C)C)CC2)nnc1C1CC1	ZINC000195101866	424880516	/nfs/dbraw/zinc/88/05/16/424880516.db2.gz	SRKFJKOVZQZQSG-UHFFFAOYSA-N	0	3	305.470	2.246	10	0		DEAEHN
Nc1ccc(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)cn1	ZINC000379685645	424907482	/nfs/dbraw/zinc/90/74/82/424907482.db2.gz	KZVAXYUXPHZUMI-KRWDZBQOSA-N	0	3	324.428	2.279	10	0		DEAEHN
Cc1nnc(NC[C@]2(C)CCCN2Cc2ccccc2)nc1C	ZINC000397936915	424921830	/nfs/dbraw/zinc/92/18/30/424921830.db2.gz	XVHWKMQYQYLWHL-SFHVURJKSA-N	0	3	311.433	2.955	10	0		DEAEHN
CN1CCC(n2ccc(NC(=O)N3CCCC34CCC4)n2)CC1	ZINC000563852338	424901128	/nfs/dbraw/zinc/90/11/28/424901128.db2.gz	IMXCQYYANCGUBL-UHFFFAOYSA-N	0	3	317.437	2.700	10	0		DEAEHN
c1c(C2CCCC2)nc2sc(NCCN3CCCC3)nn12	ZINC000436183690	425030931	/nfs/dbraw/zinc/03/09/31/425030931.db2.gz	JONLXKMQYZWFLV-UHFFFAOYSA-N	0	3	305.451	2.956	10	0		DEAEHN
COCCN(C)CCNC(=O)N[C@H](C)c1ccc(C)c(F)c1	ZINC000087087021	267392260	/nfs/dbraw/zinc/39/22/60/267392260.db2.gz	DVYDXSCSKKEHLD-CYBMUJFWSA-N	0	3	311.401	2.073	10	0		DEAEHN
COc1ccc(Br)cc1CNC1CC(CO)C1	ZINC000657809309	425403716	/nfs/dbraw/zinc/40/37/16/425403716.db2.gz	VWWSGLJCVQFTMI-UHFFFAOYSA-N	0	3	300.196	2.318	10	0		DEAEHN
O=C(NCC1(O)CCN(Cc2ccccc2)CC1)c1ccoc1	ZINC000397646066	269106950	/nfs/dbraw/zinc/10/69/50/269106950.db2.gz	VCCFALUSMHMURR-UHFFFAOYSA-N	0	3	314.385	2.037	10	0		DEAEHN
CC(=O)c1cccc(OC[C@H](O)CNCCOC(C)(C)C)c1	ZINC000515637224	269352489	/nfs/dbraw/zinc/35/24/89/269352489.db2.gz	ICFCOGFNFDLOBK-OAHLLOKOSA-N	0	3	309.406	2.034	10	0		DEAEHN
CCOc1ccc2c(c1)[C@H](N[C@@H]1CCC(=O)N(C)C1)CCO2	ZINC000152387191	273708400	/nfs/dbraw/zinc/70/84/00/273708400.db2.gz	LUAJGWNRDNFAJY-IUODEOHRSA-N	0	3	304.390	2.119	10	0		DEAEHN
O=C1NCCCC[C@H]1N1CCC([C@H](O)c2ccc(F)cc2)CC1	ZINC000120325754	275022482	/nfs/dbraw/zinc/02/24/82/275022482.db2.gz	RDUQQWPQFYOMSP-IAGOWNOFSA-N	0	3	320.408	2.240	10	0		DEAEHN
O[C@H]1c2ccccc2C[C@H]1N1CCC(Nc2cccnn2)CC1	ZINC000182753399	275059787	/nfs/dbraw/zinc/05/97/87/275059787.db2.gz	TVGVXLCCLRANMQ-AEFFLSMTSA-N	0	3	310.401	2.011	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@H]2CCO[C@@H]2C)c2ccc(F)cc2C1	ZINC000248689159	275469481	/nfs/dbraw/zinc/46/94/81/275469481.db2.gz	AEVRSZWYXBKLKU-NVGVWMPQSA-N	0	3	306.381	2.386	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1ccc(Cl)cc1	ZINC000032073288	276112834	/nfs/dbraw/zinc/11/28/34/276112834.db2.gz	GKPKDMYNHHZYFE-NSHDSACASA-N	0	3	304.843	2.349	10	0		DEAEHN
CCOC(=O)[C@H]1CN([C@H]2CCc3ccc(F)cc32)CC12COC2	ZINC000451137798	276294678	/nfs/dbraw/zinc/29/46/78/276294678.db2.gz	PNVCFBRZUUPKMW-CVEARBPZSA-N	0	3	319.376	2.325	10	0		DEAEHN
CC[C@@](C)(CCO)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000153803453	276533726	/nfs/dbraw/zinc/53/37/26/276533726.db2.gz	NMNJYGBKNRFROA-AEFFLSMTSA-N	0	3	321.465	2.010	10	0		DEAEHN
CC[C@](C)(CCO)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000153803569	276648027	/nfs/dbraw/zinc/64/80/27/276648027.db2.gz	NMNJYGBKNRFROA-SJLPKXTDSA-N	0	3	321.465	2.010	10	0		DEAEHN
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1CCCOCC(F)(F)F	ZINC000248792088	277110890	/nfs/dbraw/zinc/11/08/90/277110890.db2.gz	DNRMXQIAUOTHKM-TUAOUCFPSA-N	0	3	309.328	2.229	10	0		DEAEHN
COC(=O)c1ccc(C(=O)N[C@@H](CC(C)C)CN(C)C)cc1	ZINC000068222971	277156669	/nfs/dbraw/zinc/15/66/69/277156669.db2.gz	UTFBXBTUPNMGEK-HNNXBMFYSA-N	0	3	306.406	2.179	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)[C@H](CN)C1	ZINC000079061920	277188239	/nfs/dbraw/zinc/18/82/39/277188239.db2.gz	XTHMJGXGVURWCJ-OAHLLOKOSA-N	0	3	305.422	2.067	10	0		DEAEHN
C[C@@H](NC1CCC2(CC1)OCCO2)c1nnc2n1CCCCC2	ZINC000319683735	277614883	/nfs/dbraw/zinc/61/48/83/277614883.db2.gz	JWSZKRQLAHKRSD-CYBMUJFWSA-N	0	3	320.437	2.341	10	0		DEAEHN
C[C@@H]1C[C@@H](C(=O)NC[C@H](O)CN2CCCCC2)CC(C)(C)C1	ZINC000182841921	277961125	/nfs/dbraw/zinc/96/11/25/277961125.db2.gz	GFQMFTQJKJKHEG-OAGGEKHMSA-N	0	3	310.482	2.412	10	0		DEAEHN
CC(=O)NC1(C(=O)N[C@H](C)CN2CCCCCC2)CCCCC1	ZINC000186308865	278085132	/nfs/dbraw/zinc/08/51/32/278085132.db2.gz	QWNMSZGOABWQRT-OAHLLOKOSA-N	0	3	323.481	2.206	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)N[C@@H]1COc2ccccc21	ZINC000195197667	278186365	/nfs/dbraw/zinc/18/63/65/278186365.db2.gz	VTTKNWVBJXOQLR-UKRRQHHQSA-N	0	3	303.406	2.294	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1C	ZINC000113223526	278240924	/nfs/dbraw/zinc/24/09/24/278240924.db2.gz	ALTVEQVMPLTLHN-IINYFYTJSA-N	0	3	303.406	2.143	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000085387143	288073650	/nfs/dbraw/zinc/07/36/50/288073650.db2.gz	NEONIFQZFMDFSN-BMFZPTHFSA-N	0	3	317.433	2.492	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@]2(CCc3ccccc32)C1)N(C)C	ZINC000121536746	278919410	/nfs/dbraw/zinc/91/94/10/278919410.db2.gz	BILUSEWYCGTCQD-IEBWSBKVSA-N	0	3	316.445	2.417	10	0		DEAEHN
CC(C)C[C@H](C)S(=O)(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000247511424	279117617	/nfs/dbraw/zinc/11/76/17/279117617.db2.gz	NEIVGWWJBARJSH-SOUVJXGZSA-N	0	3	302.484	2.167	10	0		DEAEHN
Cc1nc2n(n1)CCC[C@@H]2N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2	ZINC000245972362	279135571	/nfs/dbraw/zinc/13/55/71/279135571.db2.gz	ZZDWNYZLTYTCLZ-BARDWOONSA-N	0	3	302.422	2.359	10	0		DEAEHN
C[C@H](C(=O)N1c2ccccc2C[C@H]1C)N1CCN2CCC[C@@H]2C1	ZINC000178631822	279215545	/nfs/dbraw/zinc/21/55/45/279215545.db2.gz	SYNKJSKGNXGTAR-BFYDXBDKSA-N	0	3	313.445	2.133	10	0		DEAEHN
C[C@H](C(=O)NC[C@@H]1CCCO1)N1CCC[C@@]2(CC=CCC2)C1	ZINC000114563968	279225004	/nfs/dbraw/zinc/22/50/04/279225004.db2.gz	GMZJRYXFCJZVBJ-RYRKJORJSA-N	0	3	306.450	2.492	10	0		DEAEHN
C[C@H](NC[C@@H](O)Cn1ccnn1)c1ccccc1C(F)(F)F	ZINC000459710805	279474680	/nfs/dbraw/zinc/47/46/80/279474680.db2.gz	ZPPRNYFULFFNFD-WDEREUQCSA-N	0	3	314.311	2.009	10	0		DEAEHN
C[C@@H]1CN(CCC2CC[NH+](CCCC(=O)[O-])CC2)C[C@H](C)O1	ZINC000175797152	288156829	/nfs/dbraw/zinc/15/68/29/288156829.db2.gz	BOKZWCGLGKNVQX-GASCZTMLSA-N	0	3	312.454	2.063	10	0		DEAEHN
Cc1cc(C)c(N2CC[C@@H](NC3CCOCC3)C2=O)c(C)c1	ZINC000189456182	280386855	/nfs/dbraw/zinc/38/68/55/280386855.db2.gz	BBPUDTCTRDQEIZ-MRXNPFEDSA-N	0	3	302.418	2.486	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000246532664	288308402	/nfs/dbraw/zinc/30/84/02/288308402.db2.gz	IXMPLQNRYLZPJO-BFZKSOEOSA-N	0	3	318.461	2.467	10	0		DEAEHN
Cc1cccc2c1ncc(C)c2N1CCS(=O)(=O)[C@@H](C)C1	ZINC000185517763	281308555	/nfs/dbraw/zinc/30/85/55/281308555.db2.gz	KEHHJWKZTWYNKO-ZDUSSCGKSA-N	0	3	304.415	2.475	10	0		DEAEHN
C[C@H](C1CC1)N(C(=O)CN1CC[C@@H]2OCCC[C@@H]2C1)C1CC1	ZINC000246565103	289398085	/nfs/dbraw/zinc/39/80/85/289398085.db2.gz	HKHJPBFVELLBBH-UNEWFSDZSA-N	0	3	306.450	2.277	10	0		DEAEHN
C[C@H](NC(=O)N[C@H](CN(C)C)c1ccccc1)[C@H]1CCCO1	ZINC000255070090	289883973	/nfs/dbraw/zinc/88/39/73/289883973.db2.gz	RULWYCXZOKAJQD-NUEKZKHPSA-N	0	3	305.422	2.156	10	0		DEAEHN
C[C@@H]1CN(CCN2CCC[C@H]2c2ccc3c(c2)OCO3)CCO1	ZINC000249020482	297002606	/nfs/dbraw/zinc/00/26/06/297002606.db2.gz	KAWCXMUBMRNNQT-ZBFHGGJFSA-N	0	3	318.417	2.273	10	0		DEAEHN
C[C@H](NC(=O)Nc1nncs1)[C@H](c1ccccc1)N(C)C	ZINC000185941372	332275061	/nfs/dbraw/zinc/27/50/61/332275061.db2.gz	BNKOWGYJZCOASR-CMPLNLGQSA-N	0	3	305.407	2.351	10	0		DEAEHN
COC[C@@H](C)CN[C@@H](CO)c1cccc(Br)c1	ZINC000188104663	333031783	/nfs/dbraw/zinc/03/17/83/333031783.db2.gz	UQDATDOPQPJJDJ-GWCFXTLKSA-N	0	3	302.212	2.355	10	0		DEAEHN
COc1ccccc1-n1nccc1CNCC1(N(C)C)CC1	ZINC000418113327	533934495	/nfs/dbraw/zinc/93/44/95/533934495.db2.gz	IWFMDORBVHZPES-UHFFFAOYSA-N	0	3	300.406	2.065	10	0		DEAEHN
CCc1cnc(CNC(=O)N(C)C[C@@H]2CCCN2CC)s1	ZINC000177556710	517860360	/nfs/dbraw/zinc/86/03/60/517860360.db2.gz	CJORLFBGZNTNHX-LBPRGKRZSA-N	0	3	310.467	2.331	10	0		DEAEHN
CC(C)N(C(=O)[C@@H](C)N1CCC[C@H](Cn2cncn2)C1)C(C)C	ZINC000105883714	519567369	/nfs/dbraw/zinc/56/73/69/519567369.db2.gz	HOYLVLUKJFJZBJ-CVEARBPZSA-N	0	3	321.469	2.024	10	0		DEAEHN
CCN(CC)C(=O)[C@H]1CCCN1CCCCCn1cccn1	ZINC000104948651	520540184	/nfs/dbraw/zinc/54/01/84/520540184.db2.gz	HHFPFKMDVJQIHP-MRXNPFEDSA-N	0	3	306.454	2.386	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)Cc1ccccc1F	ZINC000111864461	523825496	/nfs/dbraw/zinc/82/54/96/523825496.db2.gz	CODFRMUZIITNLL-OAHLLOKOSA-N	0	3	323.412	2.078	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)[C@@H]1CCCN1c1nccs1	ZINC000110628056	524331732	/nfs/dbraw/zinc/33/17/32/524331732.db2.gz	MNVCSJNRHRHMOA-KGLIPLIRSA-N	0	3	322.478	2.103	10	0		DEAEHN
C[C@@H](O)CN1CCN(CCOc2ccccc2Cl)C[C@H]1C	ZINC000105821070	525796862	/nfs/dbraw/zinc/79/68/62/525796862.db2.gz	YGPBEDOPPVYSSS-ZIAGYGMSSA-N	0	3	312.841	2.106	10	0		DEAEHN
Cc1ccc([C@H](C)NC(=O)Nc2ccn(CCN(C)C)n2)o1	ZINC000156216943	525904230	/nfs/dbraw/zinc/90/42/30/525904230.db2.gz	NXWLRXGQUPSFHT-LBPRGKRZSA-N	0	3	305.382	2.229	10	0		DEAEHN
CC(C)CC(C)(C)CNC(=O)NC[C@H](O)CN1CCCCC1	ZINC000175917058	527679165	/nfs/dbraw/zinc/67/91/65/527679165.db2.gz	YFRZPZIDNLAAEI-HNNXBMFYSA-N	0	3	313.486	2.205	10	0		DEAEHN
CCOC(=O)C1CCC(NC(=O)[C@H]2NCCCC2(C)C)CC1	ZINC000262534240	535592534	/nfs/dbraw/zinc/59/25/34/535592534.db2.gz	QAJRVGVWZFESGF-JXQTWKCFSA-N	0	3	310.438	2.003	10	0		DEAEHN
CCc1cccc(C)c1NC(=O)CN1CCN2CCC[C@H]2C1	ZINC000247392690	535864143	/nfs/dbraw/zinc/86/41/43/535864143.db2.gz	XIEBASVXRFKUJQ-INIZCTEOSA-N	0	3	301.434	2.276	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)CSCc1ccncc1	ZINC000246969627	536165567	/nfs/dbraw/zinc/16/55/67/536165567.db2.gz	NLQXNEHEVKVIIQ-HOTGVXAUSA-N	0	3	319.474	2.400	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(OC)ccc1OC	ZINC000246906823	536167892	/nfs/dbraw/zinc/16/78/92/536167892.db2.gz	HZVYPYZVDJMFKQ-KBPBESRZSA-N	0	3	318.417	2.403	10	0		DEAEHN
CN1CCC(CC(=O)N2CCN(Cc3cccs3)CC2)CC1	ZINC000362444692	536335599	/nfs/dbraw/zinc/33/55/99/536335599.db2.gz	IABHOENWOKNLQG-UHFFFAOYSA-N	0	3	321.490	2.124	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COc2ccccc2Cl)CC[C@@H]1C	ZINC000251903578	536730437	/nfs/dbraw/zinc/73/04/37/536730437.db2.gz	RDSQIJBDQLDGSU-HEHGZKQESA-N	0	3	313.825	2.437	10	0		DEAEHN
COc1ccc(C)nc1NC(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000248763158	536817089	/nfs/dbraw/zinc/81/70/89/536817089.db2.gz	GSRAYOIPJDMMNK-YPMHNXCESA-N	0	3	306.410	2.249	10	0		DEAEHN
COC[C@H](C)NC(=S)N[C@@H](C)CN(C)Cc1ccccc1	ZINC000309907777	625367644	/nfs/dbraw/zinc/36/76/44/625367644.db2.gz	QZYBHASBFBAYKC-KBPBESRZSA-N	0	3	309.479	2.006	10	0		DEAEHN
CNC(=O)[C@@H](NCc1ccc2c(c1)COC(C)(C)O2)C(C)C	ZINC000186399601	625396870	/nfs/dbraw/zinc/39/68/70/625396870.db2.gz	GXBOESIZEOZAMR-HNNXBMFYSA-N	0	3	306.406	2.192	10	0		DEAEHN
COc1ccc(CNC/C=C\CNC(=O)OC(C)(C)C)cn1	ZINC000309670438	625560559	/nfs/dbraw/zinc/56/05/59/625560559.db2.gz	GEOSBZHAHPOHLA-WAYWQWQTSA-N	0	3	307.394	2.261	10	0		DEAEHN
CCc1ccccc1-c1noc(CN2CCCC[C@@H](N)C2=O)n1	ZINC000888078470	625059150	/nfs/dbraw/zinc/05/91/50/625059150.db2.gz	UXMCOLZYDJQPJC-CQSZACIVSA-N	0	3	314.389	2.139	10	0		DEAEHN
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccncc1	ZINC000180528665	625188484	/nfs/dbraw/zinc/18/84/84/625188484.db2.gz	QBMXBOMVEXWWTN-YPMHNXCESA-N	0	3	322.409	2.464	10	0		DEAEHN
C[C@@H](CNCc1nc(Br)c[nH]1)N1CCCCC1	ZINC000310418734	637346722	/nfs/dbraw/zinc/34/67/22/637346722.db2.gz	KLJWUSWOBBTIEW-JTQLQIEISA-N	0	3	301.232	2.136	10	0		DEAEHN
CCCCNC(=O)[C@@H]1CC[C@H](C)N(C/C=C(/C)C(=O)OC)C1	ZINC000746503941	638350723	/nfs/dbraw/zinc/35/07/23/638350723.db2.gz	QEJLPONOQLJZBM-PONMJGQJSA-N	0	3	310.438	2.123	10	0		DEAEHN
CCN1CCN(CCNC(=O)C=C2CCC(C)(C)CC2)CC1	ZINC000751962501	639140812	/nfs/dbraw/zinc/14/08/12/639140812.db2.gz	CBNKWEZLTLWHDL-UHFFFAOYSA-N	0	3	307.482	2.267	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCC1([C@@H](O)c2ccccc2)CC1	ZINC000752348996	639174596	/nfs/dbraw/zinc/17/45/96/639174596.db2.gz	RHXRDFSFXJPNNF-SJORKVTESA-N	0	3	316.445	2.491	10	0		DEAEHN
CCOC(=O)[C@H](CC1CC1)NC(=O)c1cccc(CN(C)C)c1	ZINC000752727276	639211864	/nfs/dbraw/zinc/21/18/64/639211864.db2.gz	WJTMPRUNASIZDP-INIZCTEOSA-N	0	3	318.417	2.210	10	0		DEAEHN
CCOC(=O)[C@@H](CC1CC1)NC(=O)c1cccc(CN(C)C)c1	ZINC000752727281	639212023	/nfs/dbraw/zinc/21/20/23/639212023.db2.gz	WJTMPRUNASIZDP-MRXNPFEDSA-N	0	3	318.417	2.210	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@@H](C)[C@H](O)c1ccc(C)cc1	ZINC000804483120	645779685	/nfs/dbraw/zinc/77/96/85/645779685.db2.gz	BMCRYDYJIKRZBB-UAGQMJEPSA-N	0	3	304.434	2.408	10	0		DEAEHN
CC(C)(C)C1CCN(CC(=O)N2CCC3(CC2)OCCO3)CC1	ZINC000172031103	646719288	/nfs/dbraw/zinc/71/92/88/646719288.db2.gz	NXDDKUZOLNKHJP-UHFFFAOYSA-N	0	3	324.465	2.110	10	0		DEAEHN
CCOCCN1CCN(Cn2cccnc2=S)C[C@@H]1CC	ZINC000172498089	646739630	/nfs/dbraw/zinc/73/96/30/646739630.db2.gz	FZCCSLOCRJSYPV-AWEZNQCLSA-N	0	3	310.467	2.003	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)c1cc(Cl)nc(N(C)C)c1	ZINC000733131978	647891018	/nfs/dbraw/zinc/89/10/18/647891018.db2.gz	WEYVHVXUTLURIU-LBPRGKRZSA-N	0	3	324.856	2.405	10	0		DEAEHN
Cn1cc([C@@H]2CCN(C[C@H](O)c3ccc(F)c(F)c3)C2)cn1	ZINC000116322901	684065083	/nfs/dbraw/zinc/06/50/83/684065083.db2.gz	XRUGIPKYSCIPFQ-WBMJQRKESA-N	0	3	307.344	2.221	10	0		DEAEHN
COc1ccc([C@H](NC[C@@H]2CCCS2(=O)=O)C2CC2)cc1	ZINC000126844389	684157596	/nfs/dbraw/zinc/15/75/96/684157596.db2.gz	JOCDWQPGYIVUEW-JKSUJKDBSA-N	0	3	309.431	2.313	10	0		DEAEHN
O=C(CCOCC(F)F)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000192229325	684445389	/nfs/dbraw/zinc/44/53/89/684445389.db2.gz	RXHFFSXXQVJJFN-CQSZACIVSA-N	0	3	313.344	2.476	10	0		DEAEHN
O=S(=O)(/C=C\c1ccccc1)NCCCN1CCCCC1	ZINC000211142369	685102906	/nfs/dbraw/zinc/10/29/06/685102906.db2.gz	MGXVQVPEYCRZKK-GDNBJRDFSA-N	0	3	308.447	2.453	10	0		DEAEHN
CCC[C@@H]1CC(=O)N(CN2CCC[C@H]2Cn2ccnc2C)C1	ZINC000246155573	685124390	/nfs/dbraw/zinc/12/43/90/685124390.db2.gz	IBYGZNRGQYFWGE-CVEARBPZSA-N	0	3	304.438	2.262	10	0		DEAEHN
O[C@@H](CN1CCC(OC[C@@H]2CCCCO2)CC1)c1cccnc1	ZINC000878173175	690335127	/nfs/dbraw/zinc/33/51/27/690335127.db2.gz	PUHFKSNOFDLRFT-ROUUACIJSA-N	0	3	320.433	2.165	10	0		DEAEHN
CC(=O)N1C[C@@H](NCc2cccnc2)CC[C@H]1C(F)(F)F	ZINC000886038220	691989954	/nfs/dbraw/zinc/98/99/54/691989954.db2.gz	SITLTIFDKCFRQS-STQMWFEESA-N	0	3	301.312	2.113	10	0		DEAEHN
CN1C[C@H](CCNCc2sccc2Br)CC1=O	ZINC000723553271	777121418	/nfs/dbraw/zinc/12/14/18/777121418.db2.gz	RQKBYGZBFOUGMZ-SECBINFHSA-N	0	3	317.252	2.469	10	0		DEAEHN
C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CNCc1cn(C)cn1	ZINC000723825058	777175863	/nfs/dbraw/zinc/17/58/63/777175863.db2.gz	WXXCEGQTTMUPPJ-CHWSQXEVSA-N	0	3	308.426	2.013	10	0		DEAEHN
C[C@](O)(CN1CCC(CCO)CC1)C(F)(F)C(F)(F)F	ZINC000724056179	777231352	/nfs/dbraw/zinc/23/13/52/777231352.db2.gz	DCLGIXWSZWLNCG-JTQLQIEISA-N	0	3	305.287	2.029	10	0		DEAEHN
CO[C@@]1(CN[C@H](C)c2cc(C)sc2C)CCS(=O)(=O)C1	ZINC000721258026	781016695	/nfs/dbraw/zinc/01/66/95/781016695.db2.gz	GGGSCMBVTQUCQV-BXUZGUMPSA-N	0	3	317.476	2.219	10	0		DEAEHN
Cn1cncc1CN[C@@H]1CN(C(=O)OC(C)(C)C)CC1(C)C	ZINC000721845482	787323070	/nfs/dbraw/zinc/32/30/70/787323070.db2.gz	GGORZXFDICPUMQ-CYBMUJFWSA-N	0	3	308.426	2.155	10	0		DEAEHN
CC[C@H](NCc1cn(C)nc1Br)[C@H]1CCCOC1	ZINC000723959420	787346123	/nfs/dbraw/zinc/34/61/23/787346123.db2.gz	QYGPCPUAVZCUSE-JQWIXIFHSA-N	0	3	316.243	2.477	10	0		DEAEHN
CC/C=C(\C)C(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000397658885	790209020	/nfs/dbraw/zinc/20/90/20/790209020.db2.gz	ZKOHMYYQDJHQHE-FRKPEAEDSA-N	0	3	316.445	2.486	10	0		DEAEHN
Cn1cc(CNC[C@H]2CCN2C(C)(C)C)c(Br)n1	ZINC000712460394	792188888	/nfs/dbraw/zinc/18/88/88/792188888.db2.gz	UATAXCPAHVKLES-LLVKDONJSA-N	0	3	315.259	2.145	10	0		DEAEHN
Cn1cc(CNCC2CCSCC2)c(Br)n1	ZINC000712444652	792188953	/nfs/dbraw/zinc/18/89/53/792188953.db2.gz	MYAPJZHUMNNRSR-UHFFFAOYSA-N	0	3	304.257	2.415	10	0		DEAEHN
COc1ccc([C@@H](C)NC2CC(S(C)(=O)=O)C2)cc1F	ZINC000716141090	792555961	/nfs/dbraw/zinc/55/59/61/792555961.db2.gz	ZPEMFJXONRROHV-OIKLOGQESA-N	0	3	301.383	2.061	10	0		DEAEHN
C[C@@H]([N-]S(=O)(=O)c1cccc(Cl)c1F)C1CC[NH2+]CC1	ZINC000716564541	792973779	/nfs/dbraw/zinc/97/37/79/792973779.db2.gz	HGTMUUIUTSHGMQ-SECBINFHSA-N	0	3	320.817	2.146	10	0		DEAEHN
c1nn(-c2ccccc2)cc1CNCCOC[C@@H]1CCOC1	ZINC000068993835	795088082	/nfs/dbraw/zinc/08/80/82/795088082.db2.gz	RMLQWCHPFJEXHA-OAHLLOKOSA-N	0	3	301.390	2.015	10	0		DEAEHN
Cn1ccnc1CNCCC1(CNC(=O)OC(C)(C)C)CC1	ZINC000404634565	802026404	/nfs/dbraw/zinc/02/64/04/802026404.db2.gz	IEVCSCIZMKCCMK-UHFFFAOYSA-N	0	3	308.426	2.205	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@@H]1C[C@H](NCc2cnccn2)C12CCC2	ZINC000404771847	802031460	/nfs/dbraw/zinc/03/14/60/802031460.db2.gz	ZQPPVODVYYSMOD-UONOGXRCSA-N	0	3	318.421	2.402	10	0		DEAEHN
Cc1nn(C)c(CN[C@H]2CCCN3CCSC[C@H]23)c1Cl	ZINC000720510353	1085268539	/nfs/dbraw/zinc/26/85/39/1085268539.db2.gz	KGLZVZNSZIWCMA-WCQYABFASA-N	0	3	314.886	2.051	10	0		DEAEHN
C[C@H](C[C@H]1CCOC1)NCc1cn(C)nc1Br	ZINC000720668135	1085836998	/nfs/dbraw/zinc/83/69/98/1085836998.db2.gz	AGRNURYHRWGNPL-NXEZZACHSA-N	0	3	302.216	2.087	10	0		DEAEHN
COC[C@@H](C)OC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000704489282	1086582596	/nfs/dbraw/zinc/58/25/96/1086582596.db2.gz	NTTVFGMLKUSEAT-ZBFHGGJFSA-N	0	3	306.406	2.364	10	0		DEAEHN
CC(C)(CNS(C)(=O)=O)NCc1ccc(C(F)F)cc1	ZINC000708372408	1086677895	/nfs/dbraw/zinc/67/78/95/1086677895.db2.gz	LBQKKPBBENTMTP-UHFFFAOYSA-N	0	3	306.378	2.042	10	0		DEAEHN
COC1(OC)CC[C@@H]1NCCN(C(=O)OC(C)(C)C)C1CC1	ZINC000710948531	1086691758	/nfs/dbraw/zinc/69/17/58/1086691758.db2.gz	SNDRAXBIFHZBNR-ZDUSSCGKSA-N	0	3	314.426	2.127	10	0		DEAEHN
CCN(C(=O)OC(C)(C)C)[C@H](C)CN[C@@H]1CCC1(OC)OC	ZINC000710998136	1086692517	/nfs/dbraw/zinc/69/25/17/1086692517.db2.gz	TZDMSDOVZKMYTD-CHWSQXEVSA-N	0	3	316.442	2.373	10	0		DEAEHN
O=S(=O)([N-][C@@]12CCC[C@@H]1[NH2+]CC2)c1cccc(Cl)c1F	ZINC000711639997	1087175983	/nfs/dbraw/zinc/17/59/83/1087175983.db2.gz	LHBRCCJAHSWESE-WCQYABFASA-N	0	3	318.801	2.042	10	0		DEAEHN
Cn1cncc1CN[C@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000711640748	1087184630	/nfs/dbraw/zinc/18/46/30/1087184630.db2.gz	QHTOWTHFHGBVQK-PBHICJAKSA-N	0	3	320.437	2.442	10	0		DEAEHN
CCOC(=O)CSC[C@@H](NC)c1ccc(OC)cc1OC	ZINC000081794980	192323969	/nfs/dbraw/zinc/32/39/69/192323969.db2.gz	PSXATTNOJSBAFI-CYBMUJFWSA-N	0	3	313.419	2.261	10	0		DEAEHN
Cc1cc(C(=O)N(C)CCN(C)C)sc1Br	ZINC000081804622	192326990	/nfs/dbraw/zinc/32/69/90/192326990.db2.gz	JFPOMRACNMEJDX-UHFFFAOYSA-N	0	3	305.241	2.453	10	0		DEAEHN
CCN[C@@H](c1ccc(OC)cc1)[C@H](C)Sc1nnnn1C	ZINC000081843729	192330716	/nfs/dbraw/zinc/33/07/16/192330716.db2.gz	NSSTYHNPVLNVFN-GXFFZTMASA-N	0	3	307.423	2.050	10	0		DEAEHN
CN[C@H]1CCOC[C@H]1S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000081922750	192339672	/nfs/dbraw/zinc/33/96/72/192339672.db2.gz	OJORPOJAXLUTJS-CMPLNLGQSA-N	0	3	324.229	2.144	10	0		DEAEHN
CN[C@@H]1CCOC[C@H]1S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000081922749	192340081	/nfs/dbraw/zinc/34/00/81/192340081.db2.gz	OJORPOJAXLUTJS-ZYHUDNBSSA-N	0	3	324.229	2.144	10	0		DEAEHN
c1ccc(N2CCCN(CCOC3CCOCC3)CC2)cc1	ZINC000625101438	365644088	/nfs/dbraw/zinc/64/40/88/365644088.db2.gz	UACXEWDLMCAKLE-UHFFFAOYSA-N	0	3	304.434	2.394	10	0		DEAEHN
CNCc1cccc(S(=O)(=O)N2CC[C@@H]3CCCC[C@@H]32)c1	ZINC000163533486	197636798	/nfs/dbraw/zinc/63/67/98/197636798.db2.gz	NAUMEFLSNQUUPP-HOCLYGCPSA-N	0	3	308.447	2.359	10	0		DEAEHN
CC(C)NCCS(=O)(=O)c1ccccc1Br	ZINC000081932054	192341577	/nfs/dbraw/zinc/34/15/77/192341577.db2.gz	QBMXVTKWROVUSF-UHFFFAOYSA-N	0	3	306.225	2.221	10	0		DEAEHN
CC[C@H](NC)[C@H](C)S(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000081936072	192342840	/nfs/dbraw/zinc/34/28/40/192342840.db2.gz	CTNATFLGWRTPKR-AAEUAGOBSA-N	0	3	313.419	2.008	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2cccc(O)c2)c2ccccc2O1	ZINC000368009877	282139916	/nfs/dbraw/zinc/13/99/16/282139916.db2.gz	XYWLQUFADUZYER-HNNXBMFYSA-N	0	3	312.369	2.362	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2cccc3c2OC(C)(C)C3)CCO1	ZINC000128157683	282140998	/nfs/dbraw/zinc/14/09/98/282140998.db2.gz	ACMPAYGTFAOSMZ-INIZCTEOSA-N	0	3	304.434	2.163	10	0		DEAEHN
CCCN[C@H](c1ccc(C)cc1)[C@H](C)S(=O)(=O)CCOC	ZINC000081961901	192346085	/nfs/dbraw/zinc/34/60/85/192346085.db2.gz	PQFPZAQXYZUZSW-HOCLYGCPSA-N	0	3	313.463	2.485	10	0		DEAEHN
C[C@@H]1CN(c2ccnc3cc(F)cnc32)CCN1CC(C)(C)O	ZINC000286575534	219062073	/nfs/dbraw/zinc/06/20/73/219062073.db2.gz	GMMIOFQFPGBQGY-GFCCVEGCSA-N	0	3	318.396	2.050	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCC[C@@H](C(F)(F)F)C1)N(C)C1CC1	ZINC000171696893	282181127	/nfs/dbraw/zinc/18/11/27/282181127.db2.gz	YNPUFKWUQYKNFF-WDEREUQCSA-N	0	3	307.360	2.453	10	0		DEAEHN
CCN[C@@H](CC(N)=O)c1ccc(OC(F)F)c(OCC)c1	ZINC000087549604	185228005	/nfs/dbraw/zinc/22/80/05/185228005.db2.gz	VREQQJNMPHNRPL-JTQLQIEISA-N	0	3	302.321	2.213	10	0		DEAEHN
CC(C)[C@H](N)CS(=O)(=O)c1ccc(Br)cc1	ZINC000087539925	185228156	/nfs/dbraw/zinc/22/81/56/185228156.db2.gz	UGVBRVXFKGVGEE-LLVKDONJSA-N	0	3	306.225	2.206	10	0		DEAEHN
CC[C@@H](N)CS(=O)(=O)Cc1ccc(Br)s1	ZINC000088075083	185238990	/nfs/dbraw/zinc/23/89/90/185238990.db2.gz	RLCFJGRSQFFRRX-SSDOTTSWSA-N	0	3	312.254	2.163	10	0		DEAEHN
CCN(C)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000173498940	282190876	/nfs/dbraw/zinc/19/08/76/282190876.db2.gz	VZYISIAJMMTZBG-KRWDZBQOSA-N	0	3	319.449	2.093	10	0		DEAEHN
CC(C)N[C@H]1CCN(c2c3nsnc3ccc2Cl)C1=O	ZINC000088128057	185240440	/nfs/dbraw/zinc/24/04/40/185240440.db2.gz	IFGJDSIGHCNGRU-JTQLQIEISA-N	0	3	310.810	2.448	10	0		DEAEHN
NC(=S)CC1(CN2CCN(Cc3ccccc3)CC2)CC1	ZINC000088256859	185244066	/nfs/dbraw/zinc/24/40/66/185244066.db2.gz	IRVBCVKBEHWTPJ-UHFFFAOYSA-N	0	3	303.475	2.261	10	0		DEAEHN
COc1ccc(Br)c(-n2cc(C(C)(C)N)nn2)c1	ZINC000088322014	185245636	/nfs/dbraw/zinc/24/56/36/185245636.db2.gz	AGQFRBFPHQXPQP-UHFFFAOYSA-N	0	3	311.183	2.232	10	0		DEAEHN
CC[C@H](C)Oc1cccc(NS(=O)(=O)[C@@H](CC)CN)c1	ZINC000088473796	185252143	/nfs/dbraw/zinc/25/21/43/185252143.db2.gz	NMJPYDVJVFBFSN-FZMZJTMJSA-N	0	3	300.424	2.343	10	0		DEAEHN
CCOc1ccccc1CN1C[C@@H](C)[C@H](N2CCOCC2)C1	ZINC000177249680	282201719	/nfs/dbraw/zinc/20/17/19/282201719.db2.gz	MZDSQLKZVZMPBN-NVXWUHKLSA-N	0	3	304.434	2.238	10	0		DEAEHN
C[C@H](N)c1cccc(S(=O)(=O)N(C)CCC(F)(F)F)c1	ZINC000088432906	185249723	/nfs/dbraw/zinc/24/97/23/185249723.db2.gz	YQBRUDTTZKGQFD-VIFPVBQESA-N	0	3	310.341	2.279	10	0		DEAEHN
CN[C@](C)(CCCN1CCC[C@H](C(F)(F)F)C1)C(=O)OC	ZINC000088435225	185249914	/nfs/dbraw/zinc/24/99/14/185249914.db2.gz	DBYSJMHAZLFTPH-WCQYABFASA-N	0	3	310.360	2.192	10	0		DEAEHN
NC[C@](O)(CN1CCC(C(F)(F)F)CC1)c1ccccc1	ZINC000088439789	185250813	/nfs/dbraw/zinc/25/08/13/185250813.db2.gz	LXRSRPLSAMJSJW-AWEZNQCLSA-N	0	3	302.340	2.107	10	0		DEAEHN
CCN[C@@H](Cc1nc2ccccc2o1)C(C)(C)S(C)(=O)=O	ZINC000088518436	185254583	/nfs/dbraw/zinc/25/45/83/185254583.db2.gz	CEBHDWWHACUQPJ-ZDUSSCGKSA-N	0	3	310.419	2.172	10	0		DEAEHN
CC(C)C[NH2+]Cc1ccc(S(=O)(=O)[N-][C@H](C)C(C)C)o1	ZINC000088541824	185255581	/nfs/dbraw/zinc/25/55/81/185255581.db2.gz	NITOUYMDEPSYEX-GFCCVEGCSA-N	0	3	302.440	2.348	10	0		DEAEHN
CC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(S(=O)(=O)[N-]C)o1	ZINC000088540204	185255867	/nfs/dbraw/zinc/25/58/67/185255867.db2.gz	NJCSLEOPHBJAAP-AAEUAGOBSA-N	0	3	300.424	2.246	10	0		DEAEHN
CCCN[C@H](c1ccccc1COC)[C@@H]1CCS(=O)(=O)C1	ZINC000088556545	185258044	/nfs/dbraw/zinc/25/80/44/185258044.db2.gz	STBYYLSAGZKCHY-ZBFHGGJFSA-N	0	3	311.447	2.308	10	0		DEAEHN
CC(C)[C@H]1CCCN1S(=O)(=O)c1ccc(F)c(CN)c1	ZINC000088836768	185266738	/nfs/dbraw/zinc/26/67/38/185266738.db2.gz	DEAODQJHHJCSMO-CQSZACIVSA-N	0	3	300.399	2.094	10	0		DEAEHN
CN[C@H]1CCC[C@@H]1S(=O)(=O)c1cccc(Br)c1	ZINC000081982648	192349942	/nfs/dbraw/zinc/34/99/42/192349942.db2.gz	LDKJXTCJKQPJJX-RYUDHWBXSA-N	0	3	318.236	2.363	10	0		DEAEHN
CC(C)(C)[C@@H]1CC[C@H](N)[C@H](S(=O)(=O)C2CCOCC2)C1	ZINC000081989749	192351159	/nfs/dbraw/zinc/35/11/59/192351159.db2.gz	DVGSZUNWQQVWMD-KWCYVHTRSA-N	0	3	303.468	2.122	10	0		DEAEHN
N[C@H]1COC[C@H]1c1nc(Cc2c(Cl)cccc2Cl)no1	ZINC000090364593	185292823	/nfs/dbraw/zinc/29/28/23/185292823.db2.gz	QGDSQTQMWZTUSS-KCJUWKMLSA-N	0	3	314.172	2.408	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)CSCC(F)(F)F	ZINC000090420373	185295490	/nfs/dbraw/zinc/29/54/90/185295490.db2.gz	BQHGZIZTWSBPQQ-JTQLQIEISA-N	0	3	300.390	2.374	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1c(Cl)ccc(C)c1Cl	ZINC000090431445	185295965	/nfs/dbraw/zinc/29/59/65/185295965.db2.gz	GATUYKIZHZQVSK-WPRPVWTQSA-N	0	3	303.189	2.475	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1ccc(SC(F)F)cc1	ZINC000090432827	185296031	/nfs/dbraw/zinc/29/60/31/185296031.db2.gz	BSUFMSHNAATDRM-QWRGUYRKSA-N	0	3	302.346	2.174	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1ccc(OC(C)C)c(Cl)c1	ZINC000090433701	185296130	/nfs/dbraw/zinc/29/61/30/185296130.db2.gz	XIMDZKXHXLGCAQ-AAEUAGOBSA-N	0	3	312.797	2.300	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)N(Cc1ccc(Cl)cc1)C1CC1	ZINC000090434941	185296362	/nfs/dbraw/zinc/29/63/62/185296362.db2.gz	BCLISUWPEZZWAG-LSDHHAIUSA-N	0	3	308.809	2.065	10	0		DEAEHN
C[C@]1(C(=O)Nc2ccc(Cl)c3cccnc23)COC[C@@H]1N	ZINC000090589699	185305572	/nfs/dbraw/zinc/30/55/72/185305572.db2.gz	MTZFWSUPRIBARV-WFASDCNBSA-N	0	3	305.765	2.191	10	0		DEAEHN
C[C@@]1(C(=O)Nc2cc(C(F)(F)F)ccc2F)COC[C@H]1N	ZINC000090603854	185306150	/nfs/dbraw/zinc/30/61/50/185306150.db2.gz	CCIWZXJILSMFFM-ZYHUDNBSSA-N	0	3	306.259	2.147	10	0		DEAEHN
CN(C)C[C@H]1CSCCCN1C(=O)c1c(F)cccc1F	ZINC000090699865	185310333	/nfs/dbraw/zinc/31/03/33/185310333.db2.gz	USDOWVJHASMWLF-NSHDSACASA-N	0	3	314.401	2.474	10	0		DEAEHN
Cc1cc(C(=O)N2CCCSC[C@H]2CN2CCCC2)no1	ZINC000090700853	185310617	/nfs/dbraw/zinc/31/06/17/185310617.db2.gz	RTCLLVDFFGSVQD-CYBMUJFWSA-N	0	3	309.435	2.027	10	0		DEAEHN
CC(C)[C@H](CO)NCc1cccc(NC(=O)C(F)(F)F)c1	ZINC000092393004	185315660	/nfs/dbraw/zinc/31/56/60/185315660.db2.gz	GLWMQSJELVFWBW-LBPRGKRZSA-N	0	3	304.312	2.294	10	0		DEAEHN
CCCN(CCN(C)C)c1cc2c(cc1Cl)C(=O)C(=O)N2	ZINC000092772580	185339791	/nfs/dbraw/zinc/33/97/91/185339791.db2.gz	HNKLPHWLWGGGQC-UHFFFAOYSA-N	0	3	309.797	2.253	10	0		DEAEHN
CN(C)[C@H]1CCCN(C(=O)c2ccc3c(c2)NC(=O)C3(C)C)C1	ZINC000293033337	282255590	/nfs/dbraw/zinc/25/55/90/282255590.db2.gz	GKCZHESJHZFNPJ-ZDUSSCGKSA-N	0	3	315.417	2.083	10	0		DEAEHN
CCN[C@H]1c2cc(OC)ccc2C[C@@H]1Sc1nncn1C	ZINC000092860533	185347270	/nfs/dbraw/zinc/34/72/70/185347270.db2.gz	YRZXHKKBFXQRQU-KBPBESRZSA-N	0	3	304.419	2.191	10	0		DEAEHN
CCCN[C@H](Cc1ccn(C(C)C)n1)C(C)(C)S(C)(=O)=O	ZINC000168531567	197724549	/nfs/dbraw/zinc/72/45/49/197724549.db2.gz	YYCZBRFZZFLGCT-CQSZACIVSA-N	0	3	315.483	2.198	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)CCc1ccccc1F	ZINC000036191031	539333843	/nfs/dbraw/zinc/33/38/43/539333843.db2.gz	PSLDUWJZYDUJBT-ZDUSSCGKSA-N	0	3	316.442	2.018	10	0		DEAEHN
CC1(C)CC[C@@H](CNCc2cnc(N3CCOCC3)s2)O1	ZINC000189725339	282316764	/nfs/dbraw/zinc/31/67/64/282316764.db2.gz	OLPAIRAPEWTDHM-LBPRGKRZSA-N	0	3	311.451	2.027	10	0		DEAEHN
COc1ccc(C[C@@H]2[C@@H](O)C3CCN2CC3)cc1OC(C)C	ZINC000169966658	197762532	/nfs/dbraw/zinc/76/25/32/197762532.db2.gz	HJVZMJRHWBATRZ-QAPCUYQASA-N	0	3	305.418	2.480	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCC(C)(C)c2ccncc2)CCN1C	ZINC000092362426	539424944	/nfs/dbraw/zinc/42/49/44/539424944.db2.gz	YJFFYYZXIORQFD-GOEBONIOSA-N	0	3	318.465	2.483	10	0		DEAEHN
Cc1ccc(Br)cc1NC(=O)COC1(C)CNC1	ZINC000098060742	539435814	/nfs/dbraw/zinc/43/58/14/539435814.db2.gz	XXUAILIDRPUONS-UHFFFAOYSA-N	0	3	313.195	2.075	10	0		DEAEHN
CC1(OCC(=O)Nc2cc(C(F)(F)F)ccc2F)CNC1	ZINC000098060731	539435990	/nfs/dbraw/zinc/43/59/90/539435990.db2.gz	RYLXGEVQHULRGC-UHFFFAOYSA-N	0	3	306.259	2.162	10	0		DEAEHN
COC(=O)[C@@H]1CCC[C@@H](C(=O)N[C@@H](CC(C)C)CN(C)C)C1	ZINC000245452575	282389534	/nfs/dbraw/zinc/38/95/34/282389534.db2.gz	DRBPXTJZDFDKSM-KFWWJZLASA-N	0	3	312.454	2.058	10	0		DEAEHN
COC(=O)CC1(CC(=O)N[C@@H]2CCN(CC3CC3)C2)CCCC1	ZINC000615565842	362642075	/nfs/dbraw/zinc/64/20/75/362642075.db2.gz	FLDAJPHXWRLRSQ-OAHLLOKOSA-N	0	3	322.449	2.101	10	0		DEAEHN
C/C(=C\c1ccc(C)cc1)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000181977367	199369563	/nfs/dbraw/zinc/36/95/63/199369563.db2.gz	YEURYDLGNDYPMT-JMPLCFMRSA-N	0	3	302.418	2.187	10	0		DEAEHN
C[C@@H](NCc1nccn1C)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000279659954	215039629	/nfs/dbraw/zinc/03/96/29/215039629.db2.gz	DBGYAVRWKHUZAG-OLZOCXBDSA-N	0	3	308.426	2.155	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2CCC[C@@H](C(F)(F)F)C2)n1	ZINC000263169309	282974322	/nfs/dbraw/zinc/97/43/22/282974322.db2.gz	FOIVYOOQUYHTKR-HBNTYKKESA-N	0	3	318.343	2.482	10	0		DEAEHN
CCCc1cc(C(=O)N2CCC[C@H]2Cn2ccnc2C)n[nH]1	ZINC000177153635	539629450	/nfs/dbraw/zinc/62/94/50/539629450.db2.gz	ODYQYUGWSHDXCZ-AWEZNQCLSA-N	0	3	301.394	2.172	10	0		DEAEHN
CCN1CCC[C@@H](Nc2ncc(Br)c(OC)n2)C1	ZINC000180423223	539645008	/nfs/dbraw/zinc/64/50/08/539645008.db2.gz	AVCQDJWTZSABQD-SECBINFHSA-N	0	3	315.215	2.144	10	0		DEAEHN
CCCN(CCN(C)Cc1ccc(F)cc1)CC(=O)N(C)C	ZINC000181652333	539652627	/nfs/dbraw/zinc/65/26/27/539652627.db2.gz	RDKAVSRBQNPXKP-UHFFFAOYSA-N	0	3	309.429	2.058	10	0		DEAEHN
COc1ccc([C@@H](C)NCC2(CO)CCC2)cc1NC(C)=O	ZINC000184536014	539668629	/nfs/dbraw/zinc/66/86/29/539668629.db2.gz	JTHCJAWULZDOFX-GFCCVEGCSA-N	0	3	306.406	2.467	10	0		DEAEHN
CN[C@H](c1sc(C)cc1Br)[C@@H]1COCCO1	ZINC000083678377	192377721	/nfs/dbraw/zinc/37/77/21/192377721.db2.gz	ZRCSAXKMQLGOEB-UWVGGRQHSA-N	0	3	306.225	2.495	10	0		DEAEHN
NCc1cc(S(=O)(=O)N2CCCCCCC2)ccc1F	ZINC000071239463	190947585	/nfs/dbraw/zinc/94/75/85/190947585.db2.gz	VNUXQNNFEPGXNB-UHFFFAOYSA-N	0	3	300.399	2.239	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cccc(N3CCCC3=O)c2)C1	ZINC000194640214	539718837	/nfs/dbraw/zinc/71/88/37/539718837.db2.gz	OSWGGZPCQQLPGX-HNNXBMFYSA-N	0	3	315.417	2.028	10	0		DEAEHN
COc1ccc2c(c1)[C@H](CN)N(CCc1c(C)nn(C)c1C)C2	ZINC000071683129	191006833	/nfs/dbraw/zinc/00/68/33/191006833.db2.gz	GOTPHJGFRXPXPC-SFHVURJKSA-N	0	3	314.433	2.104	10	0		DEAEHN
Cn1ccnc1CN1Cc2c(cccc2C(F)(F)F)[C@H]1CN	ZINC000071684182	191008426	/nfs/dbraw/zinc/00/84/26/191008426.db2.gz	WSLVQNMESSRFHG-CYBMUJFWSA-N	0	3	310.323	2.455	10	0		DEAEHN
CC[C@@H]1CCN(S(=O)(=O)c2cc(CNC)cc(F)c2F)C1	ZINC000139293882	186021689	/nfs/dbraw/zinc/02/16/89/186021689.db2.gz	YMYIQOIRJCPWDF-SNVBAGLBSA-N	0	3	318.389	2.105	10	0		DEAEHN
CCC[C@@H]1N[C@@H](c2ccsc2)N(C2CCN(C)CC2)C1=O	ZINC000141186459	186029051	/nfs/dbraw/zinc/02/90/51/186029051.db2.gz	OAFJHUQGLUQZHS-LSDHHAIUSA-N	0	3	307.463	2.441	10	0		DEAEHN
CC(C)CCCCNS(=O)(=O)c1ccc(F)c(CN)c1	ZINC000147412754	186039457	/nfs/dbraw/zinc/03/94/57/186039457.db2.gz	VSUFDOHKEXTGPX-UHFFFAOYSA-N	0	3	302.415	2.389	10	0		DEAEHN
CCCNCc1cc(S(=O)(=O)NCC(F)F)cc(C)c1F	ZINC000148174384	186043310	/nfs/dbraw/zinc/04/33/10/186043310.db2.gz	HDCPVMLWEACKOE-UHFFFAOYSA-N	0	3	324.368	2.177	10	0		DEAEHN
CC(C)NCc1cc(S(=O)(=O)NCC(F)F)cn1C(C)C	ZINC000148173176	186043336	/nfs/dbraw/zinc/04/33/36/186043336.db2.gz	ZUUQUTYCGVEPBA-UHFFFAOYSA-N	0	3	323.409	2.110	10	0		DEAEHN
CCO[C@@H]1C[C@](N)(C(=O)NC[C@@H]2C[C@H]2c2ccccc2)C1(C)C	ZINC000249087937	539778378	/nfs/dbraw/zinc/77/83/78/539778378.db2.gz	UILNGEWAHBEZDD-GGXPGOJBSA-N	0	3	316.445	2.439	10	0		DEAEHN
CCCN[C@@H](c1cc(F)cc(F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000150179026	186055584	/nfs/dbraw/zinc/05/55/84/186055584.db2.gz	UBHUJNFKCPZDSS-QMTHXVAHSA-N	0	3	303.374	2.440	10	0		DEAEHN
NCc1sc([C@@H]2CCS(=O)(=O)C2)nc1-c1ccccc1	ZINC000150326642	186056866	/nfs/dbraw/zinc/05/68/66/186056866.db2.gz	CGHKDBJGWYKXEL-LLVKDONJSA-N	0	3	308.428	2.171	10	0		DEAEHN
CCNc1nc(NC[C@@H](C)CSC)nc(N2CCCC2)n1	ZINC000155815917	186115151	/nfs/dbraw/zinc/11/51/51/186115151.db2.gz	ZPMIBESUGLLEHX-LLVKDONJSA-N	0	3	310.471	2.315	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000164135579	186149738	/nfs/dbraw/zinc/14/97/38/186149738.db2.gz	LJIJUGNQBBDCNE-HUUCEWRRSA-N	0	3	317.433	2.425	10	0		DEAEHN
COc1ccc(CNC[C@H](C)[S@@](C)=O)cc1OC(F)F	ZINC000159644792	186132452	/nfs/dbraw/zinc/13/24/52/186132452.db2.gz	XYTHRWYYNHRCEQ-LXGOIASLSA-N	0	3	307.362	2.153	10	0		DEAEHN
O=S1(=O)CCC[C@H](NCc2c[nH]c3cc(Cl)ccc23)C1	ZINC000163880788	186141096	/nfs/dbraw/zinc/14/10/96/186141096.db2.gz	OQZAWJNFDUFMNT-LBPRGKRZSA-N	0	3	312.822	2.488	10	0		DEAEHN
O=C(c1coc(Br)c1)N1CC[C@@H](N2CCCC2)C1	ZINC000171442169	186161006	/nfs/dbraw/zinc/16/10/06/186161006.db2.gz	BMRKFEDVYUWDOV-LLVKDONJSA-N	0	3	313.195	2.352	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2nnc(C(F)F)s2)CCN1C	ZINC000175647350	186184865	/nfs/dbraw/zinc/18/48/65/186184865.db2.gz	ZPLMLOVFXCYJGJ-HTQZYQBOSA-N	0	3	319.381	2.422	10	0		DEAEHN
C[C@H]1CC[C@@](CO)(N(C)Cc2cccc(C(=O)N(C)C)c2)C1	ZINC000187991236	186240521	/nfs/dbraw/zinc/24/05/21/186240521.db2.gz	INEVCNNMIGWWKB-KBXCAEBGSA-N	0	3	304.434	2.371	10	0		DEAEHN
Cc1ccsc1CNC(=O)CN(C)[C@@]1(CO)CC[C@H](C)C1	ZINC000188008883	186242722	/nfs/dbraw/zinc/24/27/22/186242722.db2.gz	MSGDHNHHYRWZFN-LRDDRELGSA-N	0	3	310.463	2.156	10	0		DEAEHN
O=C(NCCc1ccc(Cl)s1)N1CCN2CCC[C@H]2C1	ZINC000171902594	198005020	/nfs/dbraw/zinc/00/50/20/198005020.db2.gz	XORXYLFQFJLKPS-NSHDSACASA-N	0	3	313.854	2.434	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NC[C@@H](O)CC(C)(C)C	ZINC000172296781	198072661	/nfs/dbraw/zinc/07/26/61/198072661.db2.gz	AHDIWOXZFROVFJ-AWEZNQCLSA-N	0	3	322.449	2.154	10	0		DEAEHN
O=C(N[C@@H](Cc1ccccc1)C1CC1)N1CCN2CCC[C@@H]2C1	ZINC000172495035	198105828	/nfs/dbraw/zinc/10/58/28/198105828.db2.gz	ZVXZVIRHZQNKKU-MSOLQXFVSA-N	0	3	313.445	2.497	10	0		DEAEHN
CCN(C(=O)c1ccncc1Br)[C@H]1CCN(C)C1	ZINC000617553697	363180168	/nfs/dbraw/zinc/18/01/68/363180168.db2.gz	OECRHPQPQUSTRT-JTQLQIEISA-N	0	3	312.211	2.010	10	0		DEAEHN
Cc1nc(C)c(CN2CCCN(Cc3cnn(C)c3)CC2)s1	ZINC000172792821	198150151	/nfs/dbraw/zinc/15/01/51/198150151.db2.gz	QGPSLRBDCFYYEL-UHFFFAOYSA-N	0	3	319.478	2.201	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)CCCS(=O)(=O)c2ccccc2)CCN1C	ZINC000172846469	198157118	/nfs/dbraw/zinc/15/71/18/198157118.db2.gz	NQTFLDASUJODRU-HOTGVXAUSA-N	0	3	324.490	2.265	10	0		DEAEHN
COc1cccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000173188259	198194033	/nfs/dbraw/zinc/19/40/33/198194033.db2.gz	IBPFTBGWEVHBRF-DZGCQCFKSA-N	0	3	305.422	2.319	10	0		DEAEHN
Cc1csc([C@@H](NC(=O)N2CCN3CCC[C@@H]3C2)C2CC2)n1	ZINC000173506458	198221468	/nfs/dbraw/zinc/22/14/68/198221468.db2.gz	WYPNCUUZALVOQQ-KGLIPLIRSA-N	0	3	320.462	2.392	10	0		DEAEHN
C[C@@H](CCc1cccc(F)c1)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000173522655	198223982	/nfs/dbraw/zinc/22/39/82/198223982.db2.gz	WSGJWZNLOFVSJF-YOEHRIQHSA-N	0	3	322.424	2.183	10	0		DEAEHN
COCc1ccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000173810969	198254557	/nfs/dbraw/zinc/25/45/57/198254557.db2.gz	FULLKBGBODEYDT-WMLDXEAASA-N	0	3	319.449	2.457	10	0		DEAEHN
CC(C)N(C)CC(=O)N[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000173920119	198270037	/nfs/dbraw/zinc/27/00/37/198270037.db2.gz	HEMLEEYPVRFBFD-AWEZNQCLSA-N	0	3	300.406	2.390	10	0		DEAEHN
O[C@H](CNc1cncc(Br)c1)CN1CCCCC1	ZINC000174684445	198370314	/nfs/dbraw/zinc/37/03/14/198370314.db2.gz	FROOVRIICIYKTK-CYBMUJFWSA-N	0	3	314.227	2.103	10	0		DEAEHN
CC(C)[C@H]1C[C@@H](NCc2cccc(S(C)(=O)=O)c2)CCO1	ZINC000449251210	535249799	/nfs/dbraw/zinc/24/97/99/535249799.db2.gz	NWKWUYGHPLIQHE-GOEBONIOSA-N	0	3	311.447	2.383	10	0		DEAEHN
COc1ccc([C@H](O)CN(C)Cc2ccccc2N)cc1OC	ZINC000039375014	354168478	/nfs/dbraw/zinc/16/84/78/354168478.db2.gz	XOJFVTPWEZEOND-MRXNPFEDSA-N	0	3	316.401	2.451	10	0		DEAEHN
COc1ccc([C@@H](CNc2ncnc3nc[nH]c32)N(C)C)cc1	ZINC000032828989	354154768	/nfs/dbraw/zinc/15/47/68/354154768.db2.gz	AOMMPYRHUYRAHQ-CYBMUJFWSA-N	0	3	312.377	2.076	10	0		DEAEHN
CCCOc1ccc(C(=O)CCC(=O)N[C@H](CN)C2CC2)cc1	ZINC000236787937	202008493	/nfs/dbraw/zinc/00/84/93/202008493.db2.gz	DTTOIOWUYRDXJQ-MRXNPFEDSA-N	0	3	318.417	2.292	10	0		DEAEHN
Cc1ccccc1CN(C)CC(=O)NC1CCN(C2CC2)CC1	ZINC000042299638	354192097	/nfs/dbraw/zinc/19/20/97/354192097.db2.gz	PVMBUUSTGZTOMR-UHFFFAOYSA-N	0	3	315.461	2.170	10	0		DEAEHN
CN1CCO[C@H](CN[C@@H]2CCCOc3c(Cl)cccc32)C1	ZINC000180492367	283024686	/nfs/dbraw/zinc/02/46/86/283024686.db2.gz	YXKDMAKHPKXQCT-IUODEOHRSA-N	0	3	310.825	2.474	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NCc1cccc(O)c1)c1ccccc1	ZINC000057183552	354561024	/nfs/dbraw/zinc/56/10/24/354561024.db2.gz	LCGDADQZDWNKEM-KRWDZBQOSA-N	0	3	313.401	2.494	10	0		DEAEHN
CNS(=O)(=O)CCCN1CCCCC[C@H]1c1ccco1	ZINC000076804911	355169008	/nfs/dbraw/zinc/16/90/08/355169008.db2.gz	DLYBSDULKFKZMV-ZDUSSCGKSA-N	0	3	300.424	2.136	10	0		DEAEHN
CCc1cnc(CNC(=O)N[C@H](CC(C)C)CN(C)C)s1	ZINC000073722688	191348112	/nfs/dbraw/zinc/34/81/12/191348112.db2.gz	JXFYZEXONQJXFG-GFCCVEGCSA-N	0	3	312.483	2.481	10	0		DEAEHN
O[C@@H](Cc1ccccc1C(F)(F)F)CN1CCCOCC1	ZINC000443624029	540184660	/nfs/dbraw/zinc/18/46/60/540184660.db2.gz	HUDMEDHNKRPFRH-ZDUSSCGKSA-N	0	3	303.324	2.331	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)[C@H]1CCCN1c1nccs1	ZINC000110628058	295906574	/nfs/dbraw/zinc/90/65/74/295906574.db2.gz	MNVCSJNRHRHMOA-UONOGXRCSA-N	0	3	322.478	2.103	10	0		DEAEHN
CN(C)[C@@H]1CN(Cc2cccnc2)CC[C@]1(O)c1ccccc1	ZINC000097942725	355706860	/nfs/dbraw/zinc/70/68/60/355706860.db2.gz	XITFNFPXXDDQCD-MOPGFXCFSA-N	0	3	311.429	2.105	10	0		DEAEHN
C[C@H](NC(=O)[C@H]1CCOC[C@H]1C)[C@@H](c1ccccc1)N(C)C	ZINC000194906785	299234733	/nfs/dbraw/zinc/23/47/33/299234733.db2.gz	FNVPUIMISCJKLL-OHFALNGGSA-N	0	3	304.434	2.467	10	0		DEAEHN
C[C@H](NCC(=O)N(C)CC1CC1)c1ccccc1-n1cccn1	ZINC000183137218	356161572	/nfs/dbraw/zinc/16/15/72/356161572.db2.gz	XDBCMMQLLAZLEA-AWEZNQCLSA-N	0	3	312.417	2.391	10	0		DEAEHN
CC1(C)CCc2ccccc2[C@@H]1NCC(=O)NC(=O)NC1CC1	ZINC000183212083	356163963	/nfs/dbraw/zinc/16/39/63/356163963.db2.gz	DRASDFSYRLMVIF-INIZCTEOSA-N	0	3	315.417	2.278	10	0		DEAEHN
NC(=S)CN(CC(=O)Nc1ccc(F)cc1)C1CCCC1	ZINC000080222207	192013476	/nfs/dbraw/zinc/01/34/76/192013476.db2.gz	KMQOJLUYLJHNKH-UHFFFAOYSA-N	0	3	309.410	2.295	10	0		DEAEHN
COc1cc([C@H](C)NC[C@H]2CC[C@H](C(=O)N(C)C)O2)ccc1F	ZINC000183464292	356172721	/nfs/dbraw/zinc/17/27/21/356172721.db2.gz	PINBEBPELUNHSZ-NJZAAPMLSA-N	0	3	324.396	2.121	10	0		DEAEHN
NC(=S)[C@H](CN1CCN(CC2CC2)CC1)c1ccccc1	ZINC000080797182	192192254	/nfs/dbraw/zinc/19/22/54/192192254.db2.gz	DCOQTMQAEJYGNB-MRXNPFEDSA-N	0	3	303.475	2.084	10	0		DEAEHN
CN[C@@H](c1cnn(C)c1I)C1CCC1	ZINC000306604259	356404666	/nfs/dbraw/zinc/40/46/66/356404666.db2.gz	YQFYDGMNSCUDRZ-SECBINFHSA-N	0	3	305.163	2.085	10	0		DEAEHN
Cn1ncc([C@@H]2CCCCCN2)c1I	ZINC000306795079	356405497	/nfs/dbraw/zinc/40/54/97/356405497.db2.gz	GHAMAKFVYDKYPZ-VIFPVBQESA-N	0	3	305.163	2.229	10	0		DEAEHN
CN(CC1CC1)C[C@H]1CN(C(=O)c2cccn2C2CC2)CCO1	ZINC000328647597	356466081	/nfs/dbraw/zinc/46/60/81/356466081.db2.gz	UCHGFVSJPWGZQO-INIZCTEOSA-N	0	3	317.433	2.006	10	0		DEAEHN
NC[C@@H](c1cc(Cl)cc(Cl)c1)N1CCn2cnnc2C1	ZINC000081532998	192284753	/nfs/dbraw/zinc/28/47/53/192284753.db2.gz	PJMBTTFSPBQACI-LBPRGKRZSA-N	0	3	312.204	2.101	10	0		DEAEHN
CC(C)C(=O)Nc1ccc(NC(=O)C[C@H]2CSCCN2)cc1	ZINC000236826013	202028740	/nfs/dbraw/zinc/02/87/40/202028740.db2.gz	DKNNXIREGGDJQZ-AWEZNQCLSA-N	0	3	321.446	2.315	10	0		DEAEHN
OCCN1CCC(NCc2ccsc2Br)CC1	ZINC000399231407	356721729	/nfs/dbraw/zinc/72/17/29/356721729.db2.gz	GPDQJOFSTZAAEI-UHFFFAOYSA-N	0	3	319.268	2.057	10	0		DEAEHN
Brc1cccc(CN2CC[C@H]3OCCN[C@H]3C2)c1	ZINC000404040300	356730949	/nfs/dbraw/zinc/73/09/49/356730949.db2.gz	AUGHSUDASURWLE-UONOGXRCSA-N	0	3	311.223	2.012	10	0		DEAEHN
Brc1csc(CN2CC[C@H]3OCCN[C@H]3C2)c1	ZINC000404186540	356732798	/nfs/dbraw/zinc/73/27/98/356732798.db2.gz	FAMIMYLZSCWIFY-NWDGAFQWSA-N	0	3	317.252	2.073	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCN[C@@H]2[C@@H](N3CCCC3)CCC[C@@H]21	ZINC000498035874	356740981	/nfs/dbraw/zinc/74/09/81/356740981.db2.gz	QMXGOZSIEVKADG-SOUVJXGZSA-N	0	3	309.454	2.212	10	0		DEAEHN
CCCN(C)S(=O)(=O)c1ccc(Cl)c(CN)c1Cl	ZINC000088947390	192665091	/nfs/dbraw/zinc/66/50/91/192665091.db2.gz	XHOHOYSXQSJNGW-UHFFFAOYSA-N	0	3	311.234	2.483	10	0		DEAEHN
Cc1n[nH]c(C)c1CC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179454401	199038345	/nfs/dbraw/zinc/03/83/45/199038345.db2.gz	REJHLSDBVVVYJV-FUHWJXTLSA-N	0	3	312.417	2.131	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cccc(C(=O)OC(C)(C)C)c2)C1	ZINC000179494262	199045256	/nfs/dbraw/zinc/04/52/56/199045256.db2.gz	NFDBOOAFALNWAX-OAHLLOKOSA-N	0	3	318.417	2.418	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cn(C)nc2C(C)(C)C)CCN1C	ZINC000092814748	291125222	/nfs/dbraw/zinc/12/52/22/291125222.db2.gz	MEUGAMFJJKKYQF-QWHCGFSZSA-N	0	3	306.454	2.272	10	0		DEAEHN
CCCc1ccccc1NC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000181150123	199257907	/nfs/dbraw/zinc/25/79/07/199257907.db2.gz	LJVWVWNQGIHUSS-HNNXBMFYSA-N	0	3	305.422	2.433	10	0		DEAEHN
C[C@@H](O)C1CCN(Cc2ccc3c(c2)CCC(=O)N3C)CC1	ZINC000186930517	200033582	/nfs/dbraw/zinc/03/35/82/200033582.db2.gz	FXRMMDJRNABDDE-CYBMUJFWSA-N	0	3	302.418	2.188	10	0		DEAEHN
O[C@@H](CN1CC[C@H](CNc2ccccn2)C1)CC(F)(F)F	ZINC000189366894	200388478	/nfs/dbraw/zinc/38/84/78/200388478.db2.gz	ATRQTRLDHZSMAM-VXGBXAGGSA-N	0	3	303.328	2.129	10	0		DEAEHN
CN(C)S(=O)(=O)c1ccc(CN2CCCC23CCC3)cc1	ZINC000444779718	238319817	/nfs/dbraw/zinc/31/98/17/238319817.db2.gz	LEWJXBKJWCKGRM-UHFFFAOYSA-N	0	3	308.447	2.455	10	0		DEAEHN
Cc1cc(CN(C)C[C@@H]2CCCN(C)[C@H]2c2cncn2C)no1	ZINC000671563862	540988451	/nfs/dbraw/zinc/98/84/51/540988451.db2.gz	KXCTVAUDACQCCG-WMLDXEAASA-N	0	3	317.437	2.231	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCC[C@@H](CCC(=O)OCC)C1	ZINC000611043611	361518322	/nfs/dbraw/zinc/51/83/22/361518322.db2.gz	RMAWHQZMZGPDFI-JKSUJKDBSA-N	0	3	324.465	2.443	10	0		DEAEHN
c1nc(C2OCCO2)sc1CNC[C@@H]1CCN1C1CCCC1	ZINC000527809838	283716023	/nfs/dbraw/zinc/71/60/23/283716023.db2.gz	NXKZPEFKCLCCMT-ZDUSSCGKSA-N	0	3	323.462	2.295	10	0		DEAEHN
C[C@@H](CN1CCOCC1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000091511777	193067246	/nfs/dbraw/zinc/06/72/46/193067246.db2.gz	JMURDQWOHGQZAJ-HNNXBMFYSA-N	0	3	322.424	2.390	10	0		DEAEHN
C[C@H](N[C@@H]1CCOC[C@@H]1O)c1cc(Br)cs1	ZINC000624238179	365346441	/nfs/dbraw/zinc/34/64/41/365346441.db2.gz	LWEYOMCZQINJLP-SFGNSQDASA-N	0	3	306.225	2.311	10	0		DEAEHN
O=C1[C@H](NC2CC(OCc3ccccc3)C2)CCN1C1CCC1	ZINC000624344335	365388343	/nfs/dbraw/zinc/38/83/43/365388343.db2.gz	IZOAMYRRMMRIQR-VMWRSERWSA-N	0	3	314.429	2.477	10	0		DEAEHN
Cc1nn(C)cc1CC(=O)Nc1ccc(C)cc1CN(C)C	ZINC000449860830	241177329	/nfs/dbraw/zinc/17/73/29/241177329.db2.gz	LEOLBKOPANERJJ-UHFFFAOYSA-N	0	3	300.406	2.280	10	0		DEAEHN
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(-n2ccnc2C)cc1	ZINC000450677481	242091710	/nfs/dbraw/zinc/09/17/10/242091710.db2.gz	GNXKDXNTANDOHB-SJKOYZFVSA-N	0	3	301.390	2.171	10	0		DEAEHN
CCNCc1sccc1S(=O)(=O)N1C[C@H](C)[C@@H](C)C1	ZINC000092113804	193161212	/nfs/dbraw/zinc/16/12/12/193161212.db2.gz	IKQHRAUSIIHKPF-QWRGUYRKSA-N	0	3	302.465	2.134	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)s1	ZINC000092113934	193161396	/nfs/dbraw/zinc/16/13/96/193161396.db2.gz	GRIOHAXXWLTMNR-PHIMTYICSA-N	0	3	302.465	2.134	10	0		DEAEHN
CCNCc1sc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)cc1C	ZINC000092113399	193161607	/nfs/dbraw/zinc/16/16/07/193161607.db2.gz	HKTMERJABUGVOL-RYUDHWBXSA-N	0	3	316.492	2.443	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)c(F)c1	ZINC000092115474	193163685	/nfs/dbraw/zinc/16/36/85/193163685.db2.gz	QVRMKHHPLHSTGU-LBPRGKRZSA-N	0	3	314.426	2.498	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCC[C@H]2CC)c(F)c1	ZINC000092115744	193163705	/nfs/dbraw/zinc/16/37/05/193163705.db2.gz	TYKMQVXOBNJYKF-CYBMUJFWSA-N	0	3	314.426	2.498	10	0		DEAEHN
CC(C)[NH2+]Cc1ccc(S(=O)(=O)[N-][C@H]2C[C@@H]2C)c(F)c1	ZINC000092116072	193164328	/nfs/dbraw/zinc/16/43/28/193164328.db2.gz	LHDXKYQOLRIVLY-GWCFXTLKSA-N	0	3	300.399	2.010	10	0		DEAEHN
c1ccc(-c2nc3c(c(N4CC(N5CCCC5)C4)n2)CCC3)nc1	ZINC000631353611	368171079	/nfs/dbraw/zinc/17/10/79/368171079.db2.gz	PHTARANWHHOJRX-UHFFFAOYSA-N	0	3	321.428	2.312	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)NC[C@H](c1ccco1)N1CCCCC1	ZINC000262234273	203237371	/nfs/dbraw/zinc/23/73/71/203237371.db2.gz	PKKXRFZEJRHVPU-LZWOXQAQSA-N	0	3	307.438	2.296	10	0		DEAEHN
CN[C@@H](Cc1cc(F)ccc1Br)C(OC)OC	ZINC000093304833	193228190	/nfs/dbraw/zinc/22/81/90/193228190.db2.gz	JJWLVFLLCQETON-NSHDSACASA-N	0	3	306.175	2.338	10	0		DEAEHN
COc1cc(OC)c(OC)cc1CN1C[C@H]2CCC[C@@H](C1)C2O	ZINC000093479791	193257603	/nfs/dbraw/zinc/25/76/03/193257603.db2.gz	HNAIEGFFALOFDW-NCNPBXTDSA-N	0	3	321.417	2.305	10	0		DEAEHN
Cc1cc(CNCC(C)(C)S(C)(=O)=O)c2ccccc2n1	ZINC000093519850	193263013	/nfs/dbraw/zinc/26/30/13/193263013.db2.gz	AWZCTDNFHISICP-UHFFFAOYSA-N	0	3	306.431	2.456	10	0		DEAEHN
COCCNCc1nc2cc(Br)c(F)cc2[nH]1	ZINC000093728746	193298059	/nfs/dbraw/zinc/29/80/59/193298059.db2.gz	PCVJTLLNLWDZAA-UHFFFAOYSA-N	0	3	302.147	2.201	10	0		DEAEHN
CCN[C@]1(C(N)=O)CCC[C@H](N(CC(F)(F)F)C(C)C)C1	ZINC000093751257	193299906	/nfs/dbraw/zinc/29/99/06/193299906.db2.gz	RZWJRVIPBHTFBH-WCQYABFASA-N	0	3	309.376	2.035	10	0		DEAEHN
Cc1csc(S[C@H]2CCC[C@@](NC3CC3)(C(N)=O)C2)n1	ZINC000093778067	193304793	/nfs/dbraw/zinc/30/47/93/193304793.db2.gz	ZMGDBJDEGUPTAV-FZMZJTMJSA-N	0	3	311.476	2.462	10	0		DEAEHN
Cc1csc(S[C@H]2CCC[C@](NC3CC3)(C(N)=O)C2)n1	ZINC000093778065	193305357	/nfs/dbraw/zinc/30/53/57/193305357.db2.gz	ZMGDBJDEGUPTAV-SMDDNHRTSA-N	0	3	311.476	2.462	10	0		DEAEHN
COC(=O)[C@]1(NC(C)C)CC[C@@H](N(C)CCC(F)(F)F)C1	ZINC000093831811	193314272	/nfs/dbraw/zinc/31/42/72/193314272.db2.gz	JVGFNFGBFGPPJK-YPMHNXCESA-N	0	3	310.360	2.333	10	0		DEAEHN
CCN[C@]1(C(N)=O)CC[C@H](Sc2cc(F)ccc2F)C1	ZINC000093851293	193318290	/nfs/dbraw/zinc/31/82/90/193318290.db2.gz	SDTMABATPDVCQK-IINYFYTJSA-N	0	3	300.374	2.443	10	0		DEAEHN
CC(C)(C)c1csc(C[C@H](N)[C@@H]2CN3CCC[C@@H]3CO2)n1	ZINC000094256926	193355684	/nfs/dbraw/zinc/35/56/84/193355684.db2.gz	SFEZDEXUHQRZQA-AGIUHOORSA-N	0	3	309.479	2.174	10	0		DEAEHN
CN(CC1CCOCC1)c1nc(C(F)(F)F)ccc1CN	ZINC000094334312	193360120	/nfs/dbraw/zinc/36/01/20/193360120.db2.gz	CYMBCZRFODRJLB-UHFFFAOYSA-N	0	3	303.328	2.422	10	0		DEAEHN
CC(C)NCc1cc(F)c(OCCCS(C)(=O)=O)c(F)c1	ZINC000094347458	193363747	/nfs/dbraw/zinc/36/37/47/193363747.db2.gz	BCEDAVLREYCFSB-UHFFFAOYSA-N	0	3	321.389	2.276	10	0		DEAEHN
COCCNC[C@](C)(O)c1cc(Br)ccc1F	ZINC000094109316	193345541	/nfs/dbraw/zinc/34/55/41/193345541.db2.gz	QQVSCTYWVCCLLW-LBPRGKRZSA-N	0	3	306.175	2.032	10	0		DEAEHN
CC1(C)CCN(S(=O)(=O)c2ccc(CNC3CC3)cc2)C1	ZINC000094805665	193399430	/nfs/dbraw/zinc/39/94/30/193399430.db2.gz	QCWLRWJJYFBDEH-UHFFFAOYSA-N	0	3	308.447	2.359	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@@H]1NCc1ccc(Br)c(F)c1	ZINC000282480412	217027157	/nfs/dbraw/zinc/02/71/57/217027157.db2.gz	VHRXSVSMGZTDGJ-UFBFGSQYSA-N	0	3	315.186	2.345	10	0		DEAEHN
C[C@H](O)[C@@H]1CCN([C@@H](CN)c2ccc(Br)cc2)C1	ZINC000161647722	197509516	/nfs/dbraw/zinc/50/95/16/197509516.db2.gz	PKTOXDQYYKNBDO-SUHUHFCYSA-N	0	3	313.239	2.152	10	0		DEAEHN
CO[C@@H]1CC[C@@H](NC(=O)N[C@@H](CC(C)C)CN2CCCC2)C1	ZINC000454838627	246188942	/nfs/dbraw/zinc/18/89/42/246188942.db2.gz	BKPMMKIACQMIEL-OWCLPIDISA-N	0	3	311.470	2.364	10	0		DEAEHN
Cc1c(C(=O)N2CCC[C@@H]2CN(C)C)oc2c1C(=O)CCC2	ZINC000267510965	206115721	/nfs/dbraw/zinc/11/57/21/206115721.db2.gz	IPFSNQXPYFPRMC-GFCCVEGCSA-N	0	3	304.390	2.273	10	0		DEAEHN
COC(=O)c1c(NC(=O)CNC2CC2)sc2c1CCCC2	ZINC000040415412	183063432	/nfs/dbraw/zinc/06/34/32/183063432.db2.gz	KXQDGQBWWJDQMR-UHFFFAOYSA-N	0	3	308.403	2.104	10	0		DEAEHN
Cc1ccc([C@@H](C)N2CCC[C@@H]2C(=O)N2CCNCC2)s1	ZINC000040508131	183085145	/nfs/dbraw/zinc/08/51/45/183085145.db2.gz	CLJKQGIHZHGMPA-ZIAGYGMSSA-N	0	3	307.463	2.014	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2cccc(-c3nccs3)c2)C1	ZINC000040634294	183111937	/nfs/dbraw/zinc/11/19/37/183111937.db2.gz	DKNVUZNPSABYCJ-CHWSQXEVSA-N	0	3	303.387	2.126	10	0		DEAEHN
CCCOc1ccc(NC(=O)[C@H]2C[C@@H](OC)CN2)cc1Cl	ZINC000040634369	183112565	/nfs/dbraw/zinc/11/25/65/183112565.db2.gz	ZHYLAWNVIVMZSW-DGCLKSJQSA-N	0	3	312.797	2.444	10	0		DEAEHN
CN1CCC(Oc2c(C(N)=S)cnc3ccccc32)CC1	ZINC000041018945	183157042	/nfs/dbraw/zinc/15/70/42/183157042.db2.gz	ZSYBCNQCDDNAHW-UHFFFAOYSA-N	0	3	301.415	2.342	10	0		DEAEHN
CN(C(=O)Cc1cn2cc(Cl)ccc2n1)C1CCN(C)CC1	ZINC000041291710	183183607	/nfs/dbraw/zinc/18/36/07/183183607.db2.gz	IGGJMQHCXQTOGD-UHFFFAOYSA-N	0	3	320.824	2.083	10	0		DEAEHN
CN(C[C@@H]1CCCO1)[C@@H](CN)c1ccc(Br)o1	ZINC000042463563	183273773	/nfs/dbraw/zinc/27/37/73/183273773.db2.gz	VDYZZKLCUJXYKK-UWVGGRQHSA-N	0	3	303.200	2.153	10	0		DEAEHN
CC(C)N(CCCO)[C@@H](C)C(=O)Nc1cc(Cl)ccc1N	ZINC000042482941	183275331	/nfs/dbraw/zinc/27/53/31/183275331.db2.gz	HHBOLOIKNCAKTC-NSHDSACASA-N	0	3	313.829	2.342	10	0		DEAEHN
COc1ccc(NC(=O)CN(CCC(N)=S)C(C)C)cc1	ZINC000042529232	183280864	/nfs/dbraw/zinc/28/08/64/183280864.db2.gz	LTCAPYBVWKPJHM-UHFFFAOYSA-N	0	3	309.435	2.020	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccccc1Cl)N1CCCC[C@@H]1C(N)=O	ZINC000043052360	183332505	/nfs/dbraw/zinc/33/25/05/183332505.db2.gz	ZCALABZPAGXTBD-RBSFLKMASA-N	0	3	309.841	2.458	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccccc1Cl)N(CC(N)=O)C1CCCC1	ZINC000043052486	183332979	/nfs/dbraw/zinc/33/29/79/183332979.db2.gz	YCULDEVESYUEIE-BDJLRTHQSA-N	0	3	309.841	2.458	10	0		DEAEHN
CCN(CC(=O)NC(C)C)[C@@H](CN)c1ccc(Cl)s1	ZINC000043253639	183347601	/nfs/dbraw/zinc/34/76/01/183347601.db2.gz	NJQNCUQVEBDDMY-JTQLQIEISA-N	0	3	303.859	2.248	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccc(Cl)s1)N1CCC(CC(N)=O)CC1	ZINC000043253808	183347745	/nfs/dbraw/zinc/34/77/45/183347745.db2.gz	JGILHOOHGFCPBL-YMTOWFKASA-N	0	3	315.870	2.377	10	0		DEAEHN
C[C@H](N)[C@H](c1ccc(Cl)s1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043252786	183348134	/nfs/dbraw/zinc/34/81/34/183348134.db2.gz	JIQRBIHCLCHNPY-OPQQBVKSSA-N	0	3	315.870	2.342	10	0		DEAEHN
CCNC(=O)CN(C)[C@@H](c1ccc(Cl)s1)[C@@H](N)CC	ZINC000043253585	183348368	/nfs/dbraw/zinc/34/83/68/183348368.db2.gz	PRTYSPCWNVIKEY-TVQRCGJNSA-N	0	3	303.859	2.248	10	0		DEAEHN
N[C@@H](c1ccc(Br)cc1F)[C@H]1CCS(=O)(=O)C1	ZINC000043299835	183351200	/nfs/dbraw/zinc/35/12/00/183351200.db2.gz	XABPTPWGEBQVHZ-WRWORJQWSA-N	0	3	322.199	2.023	10	0		DEAEHN
Cc1nc(C)n([C@@H](CN)c2cc(Br)cs2)n1	ZINC000043288134	183351553	/nfs/dbraw/zinc/35/15/53/183351553.db2.gz	KLADZDQRRFODSE-VIFPVBQESA-N	0	3	301.213	2.267	10	0		DEAEHN
CN[C@H](c1cccc(C(F)(F)F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000043300562	183352040	/nfs/dbraw/zinc/35/20/40/183352040.db2.gz	DQYYQVDHDFCBBO-ZYHUDNBSSA-N	0	3	307.337	2.401	10	0		DEAEHN
CC(C)CN(CCC(N)=S)CC(=O)Nc1ccc(F)cc1	ZINC000043418597	183361035	/nfs/dbraw/zinc/36/10/35/183361035.db2.gz	HQVOSPSXPYMGKI-UHFFFAOYSA-N	0	3	311.426	2.398	10	0		DEAEHN
O=C1C[C@@H](NCCc2ccsc2)C(=O)N1c1ccccc1	ZINC000105034504	194065836	/nfs/dbraw/zinc/06/58/36/194065836.db2.gz	ULINODTXHZLSCO-CQSZACIVSA-N	0	3	300.383	2.212	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCc2nc(C(C)(C)C)cs2)C1	ZINC000105296587	194094384	/nfs/dbraw/zinc/09/43/84/194094384.db2.gz	MYEGUDGSUOZNTI-LLVKDONJSA-N	0	3	310.467	2.286	10	0		DEAEHN
O[C@H](CN1CCC(Nc2cccnn2)CC1)c1ccc(F)cc1	ZINC000105805290	194133607	/nfs/dbraw/zinc/13/36/07/194133607.db2.gz	MZGVJVOSRZUFMR-MRXNPFEDSA-N	0	3	316.380	2.226	10	0		DEAEHN
CCc1ccc2c(CN[C@H]3CCc4ncnn4C3)cc(=O)oc2c1	ZINC000105870787	194152096	/nfs/dbraw/zinc/15/20/96/194152096.db2.gz	FFVHJFYUKZZYIP-AWEZNQCLSA-N	0	3	324.384	2.052	10	0		DEAEHN
O[C@@H](CN1CCC(Cn2cccn2)CC1)c1ccc(F)cc1	ZINC000105886796	194157409	/nfs/dbraw/zinc/15/74/09/194157409.db2.gz	ZKGCPNUOSLGERE-KRWDZBQOSA-N	0	3	303.381	2.468	10	0		DEAEHN
CCn1cnnc1C1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000105904700	194166033	/nfs/dbraw/zinc/16/60/33/194166033.db2.gz	CTIYTAXTASFJGW-INIZCTEOSA-N	0	3	300.406	2.211	10	0		DEAEHN
CO[C@H]1C[C@@H](CN(C)C(=O)c2cncc3ccccc32)N(C)C1	ZINC000285028905	218261680	/nfs/dbraw/zinc/26/16/80/218261680.db2.gz	HYUASPCPKXDWMK-GJZGRUSLSA-N	0	3	313.401	2.026	10	0		DEAEHN
CC[NH2+]CCS(=O)(=O)[N-]c1cccc(O[C@@H](C)CC)c1	ZINC000051781607	183836927	/nfs/dbraw/zinc/83/69/27/183836927.db2.gz	OAECHSHPRHWRTC-LBPRGKRZSA-N	0	3	300.424	2.215	10	0		DEAEHN
CCC[C@@H](C(N)=S)N1CCN(Cc2cccc(F)c2)CC1	ZINC000110513992	194336026	/nfs/dbraw/zinc/33/60/26/194336026.db2.gz	LBUHDDOJBBXENE-HNNXBMFYSA-N	0	3	309.454	2.398	10	0		DEAEHN
COc1ccc([C@@H](CN)N2CCSCC2)c(Cl)c1OC	ZINC000110827613	194362449	/nfs/dbraw/zinc/36/24/49/194362449.db2.gz	RMISUKOKQSTFEB-LLVKDONJSA-N	0	3	316.854	2.406	10	0		DEAEHN
CN([C@@H]1CCCNC1)S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000110927852	194369635	/nfs/dbraw/zinc/36/96/35/194369635.db2.gz	LFXKBFJNFLRRJV-SECBINFHSA-N	0	3	323.245	2.366	10	0		DEAEHN
O=C1NCCC[C@@H]1N[C@H]1CCc2ccc(Br)cc21	ZINC000336785206	284881755	/nfs/dbraw/zinc/88/17/55/284881755.db2.gz	BVGATEDQXDNQQI-STQMWFEESA-N	0	3	309.207	2.305	10	0		DEAEHN
C[C@H]1C[C@H]1NC(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000112217106	194441922	/nfs/dbraw/zinc/44/19/22/194441922.db2.gz	CCZGEOXNFGLLIF-UONOGXRCSA-N	0	3	311.495	2.446	10	0		DEAEHN
CC(C)([C@@H](N)Cc1cccc(C(F)(F)F)c1)S(C)(=O)=O	ZINC000157675612	197207032	/nfs/dbraw/zinc/20/70/32/197207032.db2.gz	BZZDRPVQVLHTEX-NSHDSACASA-N	0	3	309.353	2.398	10	0		DEAEHN
COC(=O)CSc1nc2ccccc2n1CN1CCCC1	ZINC000059506658	184138825	/nfs/dbraw/zinc/13/88/25/184138825.db2.gz	FMYHVQRREHPTLW-UHFFFAOYSA-N	0	3	305.403	2.355	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(N[C@@H]2CCCN(CC)C2)n1	ZINC000061539222	184173098	/nfs/dbraw/zinc/17/30/98/184173098.db2.gz	FFLUJTOIAQMDCF-LLVKDONJSA-N	0	3	312.849	2.267	10	0		DEAEHN
Cc1nc2ccccc2nc1CN1CCC(C(=O)N(C)C)CC1	ZINC000061761360	184186930	/nfs/dbraw/zinc/18/69/30/184186930.db2.gz	LPNTZZLRPVPTDG-UHFFFAOYSA-N	0	3	312.417	2.238	10	0		DEAEHN
NC[C@@H](c1ccc(OC(F)(F)F)cc1)N1CCCOCC1	ZINC000061916561	184195100	/nfs/dbraw/zinc/19/51/00/184195100.db2.gz	OIPBNDAHPTVTFW-ZDUSSCGKSA-N	0	3	304.312	2.307	10	0		DEAEHN
CC(C)(C)N1C(=O)C[C@@H](N)[C@H]1c1ccc(Br)o1	ZINC000062210193	184221131	/nfs/dbraw/zinc/22/11/31/184221131.db2.gz	NDBAJMCSMUVBKY-HQJQHLMTSA-N	0	3	301.184	2.441	10	0		DEAEHN
CCCNc1snnc1CN1CC[C@@H](N2CCCCC2)C1	ZINC000062969562	184263458	/nfs/dbraw/zinc/26/34/58/184263458.db2.gz	KCNDNZPQAGTFGN-CYBMUJFWSA-N	0	3	309.483	2.420	10	0		DEAEHN
Clc1ccc(NCCN2CC[C@@H](N3CCOCC3)C2)cc1	ZINC000062974832	184263832	/nfs/dbraw/zinc/26/38/32/184263832.db2.gz	JXQMLKHAJVNZRA-MRXNPFEDSA-N	0	3	309.841	2.158	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N[C@@H](C)CC)cc(C)c1F	ZINC000159081785	197325169	/nfs/dbraw/zinc/32/51/69/197325169.db2.gz	ZRMUAFFQACWLKY-NSHDSACASA-N	0	3	302.415	2.320	10	0		DEAEHN
CC(=O)N1C[C@@H]2CCC[C@H](N[C@H](C)c3cnc(C)cn3)[C@H]2C1	ZINC000555625265	291800650	/nfs/dbraw/zinc/80/06/50/291800650.db2.gz	DJHMVUCRBCMMCQ-OEAJRASXSA-N	0	3	302.422	2.083	10	0		DEAEHN
C[C@@H]1OCC[C@@H]1N[C@H](CO)c1ccc(Br)cc1	ZINC000536831855	284978054	/nfs/dbraw/zinc/97/80/54/284978054.db2.gz	ISTOYRDBEQRAIS-TVYUQYBPSA-N	0	3	300.196	2.250	10	0		DEAEHN
C[C@@H](NC[C@H](O)COC[C@@H]1CCCO1)c1ccc(F)cc1F	ZINC000538187404	285027396	/nfs/dbraw/zinc/02/73/96/285027396.db2.gz	GEVBQHHQHHLHFH-XBFCOCLRSA-N	0	3	315.360	2.172	10	0		DEAEHN
COCOc1ccc(OC)cc1CNC[C@H]1CCCC[C@H]1O	ZINC000120070808	195091367	/nfs/dbraw/zinc/09/13/67/195091367.db2.gz	IQXGIIKXPPRHPU-CZUORRHYSA-N	0	3	309.406	2.319	10	0		DEAEHN
C[C@H]1CN[C@@](C)(c2ccccc2)CN1C1CCS(=O)CC1	ZINC000159207218	197336712	/nfs/dbraw/zinc/33/67/12/197336712.db2.gz	HEJJNXQGGIEEJR-XXGLHCKMSA-N	0	3	306.475	2.107	10	0		DEAEHN
CCN[C@@H](Cc1cccnc1)c1c(Br)cnn1C	ZINC000159208156	197336469	/nfs/dbraw/zinc/33/64/69/197336469.db2.gz	RGKJNPLOKBVLKR-LBPRGKRZSA-N	0	3	309.211	2.471	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCC[C@H](C)[C@@H]2C)cc(CN)c1F	ZINC000159104482	197327883	/nfs/dbraw/zinc/32/78/83/197327883.db2.gz	KYCBQTNBQYECIF-JQWIXIFHSA-N	0	3	314.426	2.402	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2CC[C@@H](C)C2)cc(C)c1F	ZINC000159094147	197326534	/nfs/dbraw/zinc/32/65/34/197326534.db2.gz	JBEWULGNVOJYAS-LLVKDONJSA-N	0	3	314.426	2.274	10	0		DEAEHN
CCCNc1nc(SCCN(C)C)nc(N(CC)CC)n1	ZINC000159065544	197323342	/nfs/dbraw/zinc/32/33/42/197323342.db2.gz	TZWVHQSTAYPCSV-UHFFFAOYSA-N	0	3	312.487	2.193	10	0		DEAEHN
COc1ccc(CC(=O)N[C@@H](CC(C)C)CN(C)C)cc1F	ZINC000120234311	195124073	/nfs/dbraw/zinc/12/40/73/195124073.db2.gz	ZAZHWOPHOXIKNO-AWEZNQCLSA-N	0	3	310.413	2.469	10	0		DEAEHN
Cc1cc(CN)cc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)c1C	ZINC000158765103	197299782	/nfs/dbraw/zinc/29/97/82/197299782.db2.gz	ZWTMZIFYIQXWCH-HUUCEWRRSA-N	0	3	308.447	2.183	10	0		DEAEHN
COc1cccc(CNC2CCS(=O)CC2)c1OC(F)F	ZINC000157922275	197227216	/nfs/dbraw/zinc/22/72/16/197227216.db2.gz	OZCKSTNJOQBIEQ-UHFFFAOYSA-N	0	3	319.373	2.297	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1[C@H](O)CC1CC1	ZINC000157818511	197217699	/nfs/dbraw/zinc/21/76/99/197217699.db2.gz	IVYHVBJGGZCTIW-LLVKDONJSA-N	0	3	302.216	2.041	10	0		DEAEHN
CCO[C@@H]1C[C@](N)(C(=O)N(C)[C@@H](C)CCSC)C1(C)C	ZINC000157701048	197208952	/nfs/dbraw/zinc/20/89/52/197208952.db2.gz	XFEDPNUVXCDLLN-ZOWXZIJZSA-N	0	3	302.484	2.119	10	0		DEAEHN
NCc1cc(S(=O)(=O)NCCC2CCC2)cc(F)c1Cl	ZINC000157491886	197190982	/nfs/dbraw/zinc/19/09/82/197190982.db2.gz	JRUZKOIIDZFDRT-UHFFFAOYSA-N	0	3	320.817	2.406	10	0		DEAEHN
CCN[C@H](Cc1ccc(OC)c(F)c1)C(C)(C)S(C)(=O)=O	ZINC000157290815	197177713	/nfs/dbraw/zinc/17/77/13/197177713.db2.gz	MUSFHJCZPJHEBJ-CQSZACIVSA-N	0	3	317.426	2.178	10	0		DEAEHN
CCNc1cc(-n2nc(C)c(Br)c2C)nc(N)n1	ZINC000157282668	197176295	/nfs/dbraw/zinc/17/62/95/197176295.db2.gz	UFKPTDRTEKQDOW-UHFFFAOYSA-N	0	3	311.187	2.056	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1nnc(Cl)s1)c1ccccc1	ZINC000157246028	197173344	/nfs/dbraw/zinc/17/33/44/197173344.db2.gz	UXMOYQLDVFIZJY-JTQLQIEISA-N	0	3	310.810	2.224	10	0		DEAEHN
Cn1nc(-c2ccccc2)c(CN2CC[C@@H](C(N)=O)C2)c1Cl	ZINC000157203775	197169776	/nfs/dbraw/zinc/16/97/76/197169776.db2.gz	FGACYCLNYFMOAU-GFCCVEGCSA-N	0	3	318.808	2.048	10	0		DEAEHN
CCO[C@@H]1C[C@](N)(C(=O)N(CC(F)(F)F)C2CC2)C1(C)C	ZINC000157137457	197164662	/nfs/dbraw/zinc/16/46/62/197164662.db2.gz	KWEXSKVLRJAIFF-MFKMUULPSA-N	0	3	308.344	2.072	10	0		DEAEHN
O=C1C[C@H](NC[C@H]2CCCCS2)C(=O)N1C1CCCCC1	ZINC000156412028	197111290	/nfs/dbraw/zinc/11/12/90/197111290.db2.gz	QYGHIWDWUMLNBT-KGLIPLIRSA-N	0	3	310.463	2.322	10	0		DEAEHN
NCc1cccc(NC(=O)CC[S@@](=O)c2cccs2)c1	ZINC000155969363	197077591	/nfs/dbraw/zinc/07/75/91/197077591.db2.gz	XFGFVWMSGOGQLU-FQEVSTJZSA-N	0	3	308.428	2.343	10	0		DEAEHN
CCc1ccccc1NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000120725116	195223633	/nfs/dbraw/zinc/22/36/33/195223633.db2.gz	HBLLJAVERXQYLL-UKRRQHHQSA-N	0	3	317.433	2.129	10	0		DEAEHN
Cc1cc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)nn1-c1ccccc1	ZINC000073995221	184948577	/nfs/dbraw/zinc/94/85/77/184948577.db2.gz	LPQYSAIGTIBTSM-WBVHZDCISA-N	0	3	324.428	2.489	10	0		DEAEHN
CN(Cc1ccccc1)CC(C)(C)NC[C@@H](O)C(F)(F)F	ZINC000121814982	195353811	/nfs/dbraw/zinc/35/38/11/195353811.db2.gz	FFTUXMNUICFVKD-CYBMUJFWSA-N	0	3	304.356	2.410	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000121822513	195355825	/nfs/dbraw/zinc/35/58/25/195355825.db2.gz	JKSKAVRRJRMWDJ-INIZCTEOSA-N	0	3	319.449	2.334	10	0		DEAEHN
COc1c(CN2CCN(C3CCCCC3)CC2)c(C)nn1C	ZINC000126493962	195844979	/nfs/dbraw/zinc/84/49/79/195844979.db2.gz	SEPYOVTWXLHNKO-UHFFFAOYSA-N	0	3	306.454	2.187	10	0		DEAEHN
Cn1cnc2c1[C@]1(CCCN(C(=O)OC(C)(C)C)CC1)NCC2	ZINC000725242545	542769984	/nfs/dbraw/zinc/76/99/84/542769984.db2.gz	DMZOMMDUQQZNPZ-QGZVFWFLSA-N	0	3	320.437	2.182	10	0		DEAEHN
CC1=CCN(CCNCc2ccc(N3CCCC3)nc2)CC1	ZINC000358147073	133123824	/nfs/dbraw/zinc/12/38/24/133123824.db2.gz	XFYJLKJDFRAOPC-UHFFFAOYSA-N	0	3	300.450	2.423	10	0		DEAEHN
Cc1ccc2c(c1)[C@H](N[C@H]1CCN(C3CCOCC3)C1=O)CC2	ZINC000358185231	133126629	/nfs/dbraw/zinc/12/66/29/133126629.db2.gz	XZPOZMJPOOOSNO-MSOLQXFVSA-N	0	3	314.429	2.352	10	0		DEAEHN
COCCCN(C(=O)CCOCC(C)C)C1CCN(C)CC1	ZINC000358230985	133129836	/nfs/dbraw/zinc/12/98/36/133129836.db2.gz	SZFPSYHILMNPMN-UHFFFAOYSA-N	0	3	314.470	2.008	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CC[C@@H](OCc2ccncc2)C1	ZINC000360185998	133167858	/nfs/dbraw/zinc/16/78/58/133167858.db2.gz	YGSUJENHOMSRBV-IAGOWNOFSA-N	0	3	317.433	2.074	10	0		DEAEHN
CN(CCN(C)c1ccccc1)C(=O)CC1CCN(C)CC1	ZINC000362758191	133249725	/nfs/dbraw/zinc/24/97/25/133249725.db2.gz	INZOYOQRXZPGEM-UHFFFAOYSA-N	0	3	303.450	2.313	10	0		DEAEHN
O=C(Cc1ccc(Br)s1)NCCN1CCCC1	ZINC000172051468	144815490	/nfs/dbraw/zinc/81/54/90/144815490.db2.gz	PKCJRQQOICFXNQ-UHFFFAOYSA-N	0	3	317.252	2.265	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N1CCCN(C2CC2)CC1	ZINC000187892589	145004194	/nfs/dbraw/zinc/00/41/94/145004194.db2.gz	DWUTYYZICMDDQX-UHFFFAOYSA-N	0	3	321.396	2.214	10	0		DEAEHN
C[C@H]1CC[C@](CO)(N(C)Cc2ccc(-n3ccnc3)nc2)C1	ZINC000187908384	145004921	/nfs/dbraw/zinc/00/49/21/145004921.db2.gz	VSALUCWHQQWYTF-YOEHRIQHSA-N	0	3	300.406	2.250	10	0		DEAEHN
O=C(NCCc1ccc(F)c(F)c1)N1CCCN(C2CC2)CC1	ZINC000190316618	145040686	/nfs/dbraw/zinc/04/06/86/145040686.db2.gz	OFOITOMBUBQEKF-UHFFFAOYSA-N	0	3	323.387	2.387	10	0		DEAEHN
CO[C@H](C)[C@H](C)NC(=O)N1CCN(CC2CCCCC2)CC1	ZINC000190655963	145045522	/nfs/dbraw/zinc/04/55/22/145045522.db2.gz	FFDAYZGGRGWPDN-LSDHHAIUSA-N	0	3	311.470	2.317	10	0		DEAEHN
CCn1cnnc1C1CCN(C[C@@H](O)CC2CCCC2)CC1	ZINC000191343006	145056851	/nfs/dbraw/zinc/05/68/51/145056851.db2.gz	LBXJJJLABOPERS-INIZCTEOSA-N	0	3	306.454	2.419	10	0		DEAEHN
CN(C)C[C@@H]1CN(CCOc2ccc(Cl)c(F)c2)CCO1	ZINC000192010236	145068569	/nfs/dbraw/zinc/06/85/69/145068569.db2.gz	CXTIVFGMJVDHBR-CYBMUJFWSA-N	0	3	316.804	2.120	10	0		DEAEHN
Cc1cc(=O)[nH]c([C@H](C)N2CCC(Cc3nccn3C)CC2)n1	ZINC000192576852	145074966	/nfs/dbraw/zinc/07/49/66/145074966.db2.gz	SURPQNGIYDFFJF-ZDUSSCGKSA-N	0	3	315.421	2.240	10	0		DEAEHN
Cc1csc(C2CCN(CCN3CCO[C@H](C)C3)CC2)n1	ZINC000192729187	145078269	/nfs/dbraw/zinc/07/82/69/145078269.db2.gz	ZBJZFXSONPMIEE-CQSZACIVSA-N	0	3	309.479	2.352	10	0		DEAEHN
NC(=O)c1coc(CNCCCc2ccc3c(c2)CCO3)c1	ZINC000193318215	145084144	/nfs/dbraw/zinc/08/41/44/145084144.db2.gz	CCROWMVKZBDDTD-UHFFFAOYSA-N	0	3	300.358	2.036	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)[C@H]1Cc2ccccc2O1	ZINC000193402119	145085619	/nfs/dbraw/zinc/08/56/19/145085619.db2.gz	YYUNMDBVFVWXRP-PKOBYXMFSA-N	0	3	324.424	2.279	10	0		DEAEHN
C[C@@H]1CN(Cc2ccc3c(c2)CCC3)C[C@H]1N1CCOCC1	ZINC000246374406	145101113	/nfs/dbraw/zinc/10/11/13/145101113.db2.gz	HQRCLTBFXOGQGH-DNVCBOLYSA-N	0	3	300.446	2.328	10	0		DEAEHN
C[C@@H]1CN(CCOc2ccccc2Cl)C[C@H]1N1CCOCC1	ZINC000246406390	145102057	/nfs/dbraw/zinc/10/20/57/145102057.db2.gz	JSSNYZPTBKKBDB-GDBMZVCRSA-N	0	3	324.852	2.371	10	0		DEAEHN
COCCOCCN1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1	ZINC000246420285	145102494	/nfs/dbraw/zinc/10/24/94/145102494.db2.gz	BZPONMPEZZTJDT-DLBZAZTESA-N	0	3	311.397	2.377	10	0		DEAEHN
CN(C(=O)CN1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1)C1CC1	ZINC000246444133	145103032	/nfs/dbraw/zinc/10/30/32/145103032.db2.gz	DJOXVHTUCJPZKZ-DLBZAZTESA-N	0	3	320.408	2.334	10	0		DEAEHN
Cc1cc(CN2CCN(C[C@@H](C)O)[C@@H](C)C2)c2ccccc2n1	ZINC000246587866	145107270	/nfs/dbraw/zinc/10/72/70/145107270.db2.gz	BPFWJYSJJZAXTK-JKSUJKDBSA-N	0	3	313.445	2.430	10	0		DEAEHN
COc1cccc(CCCN2CCN(C[C@H](C)O)[C@@H](C)C2)c1	ZINC000246620776	145108974	/nfs/dbraw/zinc/10/89/74/145108974.db2.gz	HCWGASYMENBYFI-HOTGVXAUSA-N	0	3	306.450	2.015	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@H]1C(=O)N(C)C[C@H]1CCCN(C)C1	ZINC000246661473	145109735	/nfs/dbraw/zinc/10/97/35/145109735.db2.gz	GYDDULAJABNCQX-JKIFEVAISA-N	0	3	302.418	2.351	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@H](C)n2cnc3ccccc32)C1	ZINC000246761984	145113420	/nfs/dbraw/zinc/11/34/20/145113420.db2.gz	BVIGFALPPIBTKJ-YCPHGPKFSA-N	0	3	314.433	2.442	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N1[C@@H](C)CCC[C@@H]1C	ZINC000246881201	145117645	/nfs/dbraw/zinc/11/76/45/145117645.db2.gz	DPLLVNGNUNEISV-ZOBUZTSGSA-N	0	3	318.465	2.445	10	0		DEAEHN
COC(=O)c1cccc(OCCN2CC[C@@H]3OCCC[C@H]3C2)c1	ZINC000246925924	145119893	/nfs/dbraw/zinc/11/98/93/145119893.db2.gz	WJIOOXPBMBJDBE-RDJZCZTQSA-N	0	3	319.401	2.353	10	0		DEAEHN
C[C@@H]1CCN(C(=O)[C@H]2CCCc3[nH]ncc32)C[C@H]1n1ccnc1	ZINC000247380444	145135175	/nfs/dbraw/zinc/13/51/75/145135175.db2.gz	IAFKVIBSFORLFK-DVOMOZLQSA-N	0	3	313.405	2.136	10	0		DEAEHN
COc1cc(CN2C[C@@H](C)[C@@H](N3CCOCC3)C2)ccc1C	ZINC000248991749	145175120	/nfs/dbraw/zinc/17/51/20/145175120.db2.gz	NRTZRIPKAAOPHV-WBVHZDCISA-N	0	3	304.434	2.156	10	0		DEAEHN
COCc1cccc(CC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1	ZINC000249121778	145179685	/nfs/dbraw/zinc/17/96/85/145179685.db2.gz	AFUTYIRCJPNHCA-ROUUACIJSA-N	0	3	316.445	2.318	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN(C[C@@H](O)CC(F)(F)F)C2)n1	ZINC000249291208	145182302	/nfs/dbraw/zinc/18/23/02/145182302.db2.gz	MKTBBXLYOJNYQH-OLZOCXBDSA-N	0	3	317.355	2.437	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC[C@H]2c2ccncc2)C1	ZINC000249808875	145191271	/nfs/dbraw/zinc/19/12/71/145191271.db2.gz	XVOPTNGZAKRZRH-CVEARBPZSA-N	0	3	302.422	2.412	10	0		DEAEHN
Cc1[nH]c(=O)ccc1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000252801521	145200645	/nfs/dbraw/zinc/20/06/45/145200645.db2.gz	TZUPXXILWHAOHC-WBVHZDCISA-N	0	3	311.385	2.271	10	0		DEAEHN
CO[C@](C)(C(=O)N1C[C@H]2CCCN2C[C@@H]1C)c1ccccc1F	ZINC000253335842	145201642	/nfs/dbraw/zinc/20/16/42/145201642.db2.gz	ASTYJHGGRBGPJB-IYOUNJFTSA-N	0	3	320.408	2.382	10	0		DEAEHN
C/C=C\c1ccc(OCC(=O)N2CCNC(C)(C)C2)c(OC)c1	ZINC000255682742	145204543	/nfs/dbraw/zinc/20/45/43/145204543.db2.gz	LLYHSSZFPVCLQF-WAYWQWQTSA-N	0	3	318.417	2.318	10	0		DEAEHN
Cc1cnc(-c2cccc(NC(=O)[C@H](N)C3CCOCC3)c2)o1	ZINC000261627031	145211898	/nfs/dbraw/zinc/21/18/98/145211898.db2.gz	CQAUBAYTFREOCT-OAHLLOKOSA-N	0	3	315.373	2.342	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)Nc1ccc2c(c1)CCO2	ZINC000261640003	145212244	/nfs/dbraw/zinc/21/22/44/145212244.db2.gz	DSYFXQHANLLIRE-DDUZABMNSA-N	0	3	316.401	2.093	10	0		DEAEHN
COc1cc(NC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)ccc1F	ZINC000261632084	145212680	/nfs/dbraw/zinc/21/26/80/145212680.db2.gz	DDJHQDNEQXSTFF-FABXCBLPSA-N	0	3	322.380	2.305	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H](N)C1CCOCC1)c1ccc(Cl)s1	ZINC000261851921	145233685	/nfs/dbraw/zinc/23/36/85/145233685.db2.gz	RPXFYKAJZCKQMZ-PELKAZGASA-N	0	3	302.827	2.333	10	0		DEAEHN
Cc1nc(-c2cccc(NC(=O)[C@@H]3NCCCC3(C)C)c2)n[nH]1	ZINC000261881008	145237105	/nfs/dbraw/zinc/23/71/05/145237105.db2.gz	MMZYBKKWRAOTGU-AWEZNQCLSA-N	0	3	313.405	2.497	10	0		DEAEHN
Cc1ccn2c(CN3CCNC[C@@H]3c3ccncc3)cnc2c1	ZINC000262115673	145263120	/nfs/dbraw/zinc/26/31/20/145263120.db2.gz	WVWUBIDNXSSSFX-QGZVFWFLSA-N	0	3	307.401	2.184	10	0		DEAEHN
CS(=O)(=O)C1(CN[C@H](C[C@@H]2CCOC2)c2ccccc2)CC1	ZINC000359029502	147249353	/nfs/dbraw/zinc/24/93/53/147249353.db2.gz	LHYUSQLGPRTLID-GOEBONIOSA-N	0	3	323.458	2.321	10	0		DEAEHN
CC(C)N1CCCN(C(=O)NCc2ccc3cc[nH]c3n2)CC1	ZINC000360703206	147370551	/nfs/dbraw/zinc/37/05/51/147370551.db2.gz	YUAKZTNRHCEIBZ-UHFFFAOYSA-N	0	3	315.421	2.189	10	0		DEAEHN
Fc1ccc(OCCN2CCOC3(CCOCC3)CC2)cc1	ZINC000372203588	148180887	/nfs/dbraw/zinc/18/08/87/148180887.db2.gz	GPTUFPNDPDFLDW-UHFFFAOYSA-N	0	3	309.381	2.476	10	0		DEAEHN
C[C@H]1CCOCCN1CCC(=O)N1CCc2sccc2C1	ZINC000374991786	148314002	/nfs/dbraw/zinc/31/40/02/148314002.db2.gz	ZFVLAVAPPKBXEG-ZDUSSCGKSA-N	0	3	308.447	2.134	10	0		DEAEHN
CC(C)CC[C@@H](NC(=O)NC[C@@](C)(O)CN(C)C)C(C)(C)C	ZINC000127132922	401721566	/nfs/dbraw/zinc/72/15/66/401721566.db2.gz	YZVYENJQUSOWRT-RHSMWYFYSA-N	0	3	315.502	2.449	10	0		DEAEHN
CC1(C)NC(=N)NC(=N)N1OCc1ccc(Cl)c(Cl)c1	ZINC000000001180	401687436	/nfs/dbraw/zinc/68/74/36/401687436.db2.gz	XDTNOYLBDDCJSK-UHFFFAOYSA-N	0	3	316.192	2.106	10	0	in-man	DEAEHN
COC(=O)[C@@H](c1ccccc1F)N1CCCN(C2CC2)CC1	ZINC000072635994	401711198	/nfs/dbraw/zinc/71/11/98/401711198.db2.gz	OTNHRIZGGQMRTL-MRXNPFEDSA-N	0	3	306.381	2.210	10	0		DEAEHN
C[C@@H](CNC(=O)c1cnn2c1CCCC2)N1CCC(C)CC1	ZINC000127052825	401718463	/nfs/dbraw/zinc/71/84/63/401718463.db2.gz	AZZSGYCXCAWNQW-AWEZNQCLSA-N	0	3	304.438	2.070	10	0		DEAEHN
CN(CC(=O)NC(C)(C)C)C1CCN(Cc2ccccc2)CC1	ZINC000114480906	401801646	/nfs/dbraw/zinc/80/16/46/401801646.db2.gz	UWJLDCVSOFVEHG-UHFFFAOYSA-N	0	3	317.477	2.498	10	0		DEAEHN
Cc1ccc([C@@H](CNC(=O)N(C)C[C@@H]2CCCO2)N(C)C)cc1	ZINC000077007206	401802888	/nfs/dbraw/zinc/80/28/88/401802888.db2.gz	CVHHUGVHLIOKLV-DLBZAZTESA-N	0	3	319.449	2.418	10	0		DEAEHN
COc1cc(C[NH2+]C[C@H]2CCCO2)cc(Br)c1[O-]	ZINC000008206669	401749824	/nfs/dbraw/zinc/74/98/24/401749824.db2.gz	JTDPHLIRMMKZEM-SNVBAGLBSA-N	0	3	316.195	2.432	10	0		DEAEHN
Cc1cccc(C)c1OCC(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000113226824	401770750	/nfs/dbraw/zinc/77/07/50/401770750.db2.gz	GNACIOYMXGURHW-JKSUJKDBSA-N	0	3	302.418	2.377	10	0		DEAEHN
Cc1ccccc1-n1cc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cn1	ZINC000113227190	401771625	/nfs/dbraw/zinc/77/16/25/401771625.db2.gz	XEZOJLXPZONCST-DOTOQJQBSA-N	0	3	324.428	2.489	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)C(=O)c1ccc(Cl)cc1	ZINC000113228286	401771926	/nfs/dbraw/zinc/77/19/26/401771926.db2.gz	HJHKSJOVUYHZJI-SMDDNHRTSA-N	0	3	306.793	2.218	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)N3C[C@@H]4CCCN4C[C@@H]3C)cc2)c1	ZINC000113228686	401772017	/nfs/dbraw/zinc/77/20/17/401772017.db2.gz	HKUKQUPTAHLDAL-YJBOKZPZSA-N	0	3	324.428	2.489	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N[C@@H](CO)CC(C)(C)C	ZINC000128435935	401776403	/nfs/dbraw/zinc/77/64/03/401776403.db2.gz	IQMIJVCEZBNOGK-ZIAGYGMSSA-N	0	3	301.475	2.059	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)NCC[C@@H](C)O)c1ccsc1	ZINC000114822363	401811120	/nfs/dbraw/zinc/81/11/20/401811120.db2.gz	MTKRABVNRVSQAA-TZMCWYRMSA-N	0	3	313.467	2.201	10	0		DEAEHN
O=C(NCc1ccccc1)C1CCN(C[C@@H]2CCCO2)CC1	ZINC000013047772	401795830	/nfs/dbraw/zinc/79/58/30/401795830.db2.gz	HCOOZEHUCYSGST-KRWDZBQOSA-N	0	3	302.418	2.194	10	0		DEAEHN
CCC(C)(C)NC(=O)CN1CCN(C2CCC(C)CC2)CC1	ZINC000115568264	401831970	/nfs/dbraw/zinc/83/19/70/401831970.db2.gz	GEUWJBJFEDJHJF-UHFFFAOYSA-N	0	3	309.498	2.488	10	0		DEAEHN
CCc1ccc(CN2CCN(CCn3ccnc3)CC2)s1	ZINC000131416969	401849702	/nfs/dbraw/zinc/84/97/02/401849702.db2.gz	MSJUAEHFDDLLON-UHFFFAOYSA-N	0	3	304.463	2.325	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)CC(C)(C)c2ccccc2)CCO1	ZINC000116785314	401858413	/nfs/dbraw/zinc/85/84/13/401858413.db2.gz	VGRRPSFRUNFVJO-MRXNPFEDSA-N	0	3	304.434	2.143	10	0		DEAEHN
Cc1cc2[nH]c(C(=O)N3CCO[C@@H](CN(C)C)C3)cc2c(C)c1	ZINC000116784071	401858847	/nfs/dbraw/zinc/85/88/47/401858847.db2.gz	GQNABUQYKMVJCV-AWEZNQCLSA-N	0	3	315.417	2.187	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)C2(c3cccc(F)c3)CCC2)CCO1	ZINC000116787859	401859138	/nfs/dbraw/zinc/85/91/38/401859138.db2.gz	HKLBRYQFIIAGHL-INIZCTEOSA-N	0	3	320.408	2.036	10	0		DEAEHN
Cc1[nH]c2ccc(C(=O)N3CCO[C@@H](CN(C)C)C3)cc2c1C	ZINC000116788134	401859273	/nfs/dbraw/zinc/85/92/73/401859273.db2.gz	RRSRHOOGDAGXOW-HNNXBMFYSA-N	0	3	315.417	2.187	10	0		DEAEHN
CCCCOc1ccc(C(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000116788494	401859286	/nfs/dbraw/zinc/85/92/86/401859286.db2.gz	JHJWABUXVYBMJE-QGZVFWFLSA-N	0	3	320.433	2.268	10	0		DEAEHN
Cc1ccc(CC(=O)N[C@@H](Cc2ccccc2)CN(C)C)cn1	ZINC000132244401	401864451	/nfs/dbraw/zinc/86/44/51/401864451.db2.gz	JVODIUNHMJKODF-SFHVURJKSA-N	0	3	311.429	2.222	10	0		DEAEHN
CCN(CCC(=O)NC(C)C)Cc1ccc(C(=O)N(C)C)cc1	ZINC000077383333	401813613	/nfs/dbraw/zinc/81/36/13/401813613.db2.gz	CJVVVUWXZPYBTC-UHFFFAOYSA-N	0	3	319.449	2.125	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1)N(C)C	ZINC000119171508	401930766	/nfs/dbraw/zinc/93/07/66/401930766.db2.gz	QXNJLLKCGOOPQN-RHSMWYFYSA-N	0	3	321.440	2.499	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N1CC[C@@H](N2CCCC2)C1	ZINC000079540476	401875642	/nfs/dbraw/zinc/87/56/42/401875642.db2.gz	QGDDSZJDJNMQAS-CQSZACIVSA-N	0	3	303.406	2.179	10	0		DEAEHN
CN(CCOCC1CC1)C[C@H](c1cccs1)N1CCOCC1	ZINC000119231778	401934760	/nfs/dbraw/zinc/93/47/60/401934760.db2.gz	GBIAZNOSAYMTGH-MRXNPFEDSA-N	0	3	324.490	2.480	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)[C@@H]1CSc2ccccc21	ZINC000118332597	401895910	/nfs/dbraw/zinc/89/59/10/401895910.db2.gz	JXHNVNBOTWQZEC-UKRRQHHQSA-N	0	3	320.458	2.103	10	0		DEAEHN
CCC[C@H](O)CN(CCN1CCOCC1)Cc1ccccc1C	ZINC000036104375	401902789	/nfs/dbraw/zinc/90/27/89/401902789.db2.gz	NQGLFDSJGWASPX-IBGZPJMESA-N	0	3	320.477	2.290	10	0		DEAEHN
CCn1c(C)nnc1CN1CC[C@@H]2[C@H](CCCN2C2CC2)C1	ZINC000134915979	401919753	/nfs/dbraw/zinc/91/97/53/401919753.db2.gz	DXNMMQQJNVZPBV-GDBMZVCRSA-N	0	3	303.454	2.055	10	0		DEAEHN
CC[C@H]1CCCCCN1C(=O)NC1CCN(CCOC)CC1	ZINC000119745183	401964759	/nfs/dbraw/zinc/96/47/59/401964759.db2.gz	QAEXJOYERBCTEF-INIZCTEOSA-N	0	3	311.470	2.461	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1ccc2c(c1)CC(C)(C)O2	ZINC000136381147	401966896	/nfs/dbraw/zinc/96/68/96/401966896.db2.gz	BGHXTLRGSHJEEH-TZMCWYRMSA-N	0	3	302.418	2.486	10	0		DEAEHN
CCCCCCC(=O)NC[C@H](O)CN1CCc2ccccc2C1	ZINC000119919807	401971330	/nfs/dbraw/zinc/97/13/30/401971330.db2.gz	WEHGNGXKIHNTTL-SFHVURJKSA-N	0	3	318.461	2.492	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@@H](c1ccccc1)N(C)C	ZINC000137111419	401979074	/nfs/dbraw/zinc/97/90/74/401979074.db2.gz	LBCIXODEBOHKAJ-IAGOWNOFSA-N	0	3	305.466	2.382	10	0		DEAEHN
Cc1nn(C)c(N2CCOCC2)c1CNCCC1=CCCC1	ZINC000120134941	401979768	/nfs/dbraw/zinc/97/97/68/401979768.db2.gz	BBXGVZOTDZZCGZ-UHFFFAOYSA-N	0	3	304.438	2.155	10	0		DEAEHN
CCCC(=O)N[C@H]1CCCN(CCCCn2ccnc2C)C1	ZINC000120405020	401989548	/nfs/dbraw/zinc/98/95/48/401989548.db2.gz	FUZRPZHGULVKQK-INIZCTEOSA-N	0	3	306.454	2.352	10	0		DEAEHN
C[C@H](NC(=O)[C@]1(F)CCNC1)c1ccccc1Br	ZINC000150721716	401993679	/nfs/dbraw/zinc/99/36/79/401993679.db2.gz	AHLLNNYFQWRKOW-ZANVPECISA-N	0	3	315.186	2.328	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1C	ZINC000150775496	401995112	/nfs/dbraw/zinc/99/51/12/401995112.db2.gz	YWPFYJWYMDAAGJ-XJKSGUPXSA-N	0	3	317.433	2.087	10	0		DEAEHN
CC[C@@H](CCO)[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000135562115	401945409	/nfs/dbraw/zinc/94/54/09/401945409.db2.gz	JLMFNBKCZASQDS-JTQLQIEISA-N	0	3	318.211	2.414	10	0		DEAEHN
COCCCNC(=O)CN1C[C@H](c2ccc(OC)cc2)C[C@H]1C	ZINC000151046764	402012654	/nfs/dbraw/zinc/01/26/54/402012654.db2.gz	VFHAGDNUCTUJFZ-GDBMZVCRSA-N	0	3	320.433	2.026	10	0		DEAEHN
CC(C)Cc1ncc(CN2CC[C@@H](CN3CCOCC3)C2)s1	ZINC000093665550	402018670	/nfs/dbraw/zinc/01/86/70/402018670.db2.gz	QAECTSHGZAQCCA-HNNXBMFYSA-N	0	3	323.506	2.496	10	0		DEAEHN
CN1CCC(C(=O)N[C@H]2CCN(c3c(F)cccc3F)C2)CC1	ZINC000121194653	402019757	/nfs/dbraw/zinc/01/97/57/402019757.db2.gz	CPEBJVOYDKLTJW-ZDUSSCGKSA-N	0	3	323.387	2.002	10	0		DEAEHN
Cc1ccn(-c2ccccc2NC(=O)N2CC[C@@H](N(C)C)C2)n1	ZINC000151228541	402024873	/nfs/dbraw/zinc/02/48/73/402024873.db2.gz	OZHMAVWRSAZZLG-CQSZACIVSA-N	0	3	313.405	2.349	10	0		DEAEHN
Cc1ccc(CN2CCCN(Cc3cnn(C)c3)CC2)s1	ZINC000121555353	402043741	/nfs/dbraw/zinc/04/37/41/402043741.db2.gz	DNEHCZVUPZISGG-UHFFFAOYSA-N	0	3	304.463	2.498	10	0		DEAEHN
CCCn1nc(C)c(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1C	ZINC000151619407	402047167	/nfs/dbraw/zinc/04/71/67/402047167.db2.gz	JXYNLWSDKMIEIA-WFASDCNBSA-N	0	3	306.454	2.368	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@H]2OCCc3ccccc32)CCN1C	ZINC000122642376	402088992	/nfs/dbraw/zinc/08/89/92/402088992.db2.gz	GFNAUWFFWIGXFB-KMFMINBZSA-N	0	3	302.418	2.242	10	0		DEAEHN
Cc1cc(C(=O)NC[C@H](O)CN2CCCCC2)cc(C)c1F	ZINC000122822060	402096440	/nfs/dbraw/zinc/09/64/40/402096440.db2.gz	PSPLHEUFHVJQDG-HNNXBMFYSA-N	0	3	308.397	2.019	10	0		DEAEHN
C[C@@H](N[C@@H]1CCC(=O)N(C)C1)c1cnn(Cc2ccccc2)c1	ZINC000152464951	402097030	/nfs/dbraw/zinc/09/70/30/402097030.db2.gz	LGZFTFVWHVRBKL-RHSMWYFYSA-N	0	3	312.417	2.203	10	0		DEAEHN
CN(C)[C@H](CNC(=O)NC[C@@H]1CCCC[C@@H]1O)c1ccccc1	ZINC000152833748	402111355	/nfs/dbraw/zinc/11/13/55/402111355.db2.gz	TTZVAZSYLMUUII-BBWFWOEESA-N	0	3	319.449	2.140	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC[C@@H](C)N2CCOCC2)c1	ZINC000123252925	402117922	/nfs/dbraw/zinc/11/79/22/402117922.db2.gz	MGELOZXIYQVUKJ-KGLIPLIRSA-N	0	3	308.422	2.075	10	0		DEAEHN
COc1ccc(CNC(=O)CN(C)C(C2CC2)C2CC2)cc1	ZINC000065243548	402123367	/nfs/dbraw/zinc/12/33/67/402123367.db2.gz	NGQCNWGQEAFJFU-UHFFFAOYSA-N	0	3	302.418	2.432	10	0		DEAEHN
CN1CCC(NC(=O)NCCCCOCc2ccccc2)CC1	ZINC000065386164	402123800	/nfs/dbraw/zinc/12/38/00/402123800.db2.gz	ZEUFREGZHUJRGK-UHFFFAOYSA-N	0	3	319.449	2.377	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccc(C)cc1OCCOC)N(C)C	ZINC000153565540	402153185	/nfs/dbraw/zinc/15/31/85/402153185.db2.gz	SSFXNOUUNIXTED-MRXNPFEDSA-N	0	3	322.449	2.367	10	0		DEAEHN
CC(C)CCOc1ccc([C@@H](C)N[C@H](C)C(=O)NC(N)=O)cc1	ZINC000101583034	402150122	/nfs/dbraw/zinc/15/01/22/402150122.db2.gz	QDJPQSCTPWAKDG-CHWSQXEVSA-N	0	3	321.421	2.346	10	0		DEAEHN
CC(=O)CCN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000103469139	402190477	/nfs/dbraw/zinc/19/04/77/402190477.db2.gz	YEONKBZKHKJYTI-LBPRGKRZSA-N	0	3	309.797	2.365	10	0		DEAEHN
O=c1[nH]c(CCN2CCC(c3cc[nH]n3)CC2)nc2ccccc21	ZINC000103473437	402190529	/nfs/dbraw/zinc/19/05/29/402190529.db2.gz	SLJCSEOKORPAGH-UHFFFAOYSA-N	0	3	323.400	2.068	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)C(=O)c2ccc3c(c2)CCC3)CCN1C	ZINC000124082763	402163245	/nfs/dbraw/zinc/16/32/45/402163245.db2.gz	GDDLQCZIXPJGOA-DYVFJYSZSA-N	0	3	314.429	2.299	10	0		DEAEHN
COC(=O)c1cccc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000124094893	402163663	/nfs/dbraw/zinc/16/36/63/402163663.db2.gz	PXWWMSXSSXOLRH-SWLSCSKDSA-N	0	3	304.390	2.028	10	0		DEAEHN
Cc1c([C@H](C)NC[C@@H]2CCCN2C)nnn1-c1ccc(F)cc1	ZINC000154588699	402220109	/nfs/dbraw/zinc/22/01/09/402220109.db2.gz	BXNCYWXPWYBYRH-LRDDRELGSA-N	0	3	317.412	2.460	10	0		DEAEHN
COc1ccc([C@H](C)NC[C@H]2CCCN2C)cc1NC(C)=O	ZINC000154609267	402221370	/nfs/dbraw/zinc/22/13/70/402221370.db2.gz	AFBONLIWTZTVDP-SWLSCSKDSA-N	0	3	305.422	2.398	10	0		DEAEHN
CC(C)Oc1cncc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000154653053	402224269	/nfs/dbraw/zinc/22/42/69/402224269.db2.gz	UWTNUNSTZNETPL-BBRMVZONSA-N	0	3	305.422	2.327	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)c1ccc(-c2ncon2)cc1	ZINC000107218396	402227966	/nfs/dbraw/zinc/22/79/66/402227966.db2.gz	WJOYORODXCRFRZ-ZDUSSCGKSA-N	0	3	314.389	2.341	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)c2coc(Br)c2)C1	ZINC000108334280	402250438	/nfs/dbraw/zinc/25/04/38/402250438.db2.gz	IIBYOSRXWLQAMW-VIFPVBQESA-N	0	3	301.184	2.114	10	0		DEAEHN
C[C@@H](C(=O)N1CCCCCC1)N1CCC(Cn2cccn2)CC1	ZINC000105886639	402210328	/nfs/dbraw/zinc/21/03/28/402210328.db2.gz	HSNIDKZRTQIZFT-INIZCTEOSA-N	0	3	318.465	2.386	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)CCC(=O)c2ccccc2)C1	ZINC000155798435	402267716	/nfs/dbraw/zinc/26/77/16/402267716.db2.gz	PBJGEKYDPFBUJU-ZBFHGGJFSA-N	0	3	302.418	2.494	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1ccc2[nH]ccc2c1	ZINC000110091837	402281362	/nfs/dbraw/zinc/28/13/62/402281362.db2.gz	JRLNTHLLTMOSJB-OAHLLOKOSA-N	0	3	316.405	2.400	10	0		DEAEHN
C[C@@H]1CCCN(c2cc(N3CCN(CC4CC4)CC3)ncn2)C1	ZINC000110246837	402284069	/nfs/dbraw/zinc/28/40/69/402284069.db2.gz	FWTRVWWCKKWUJI-OAHLLOKOSA-N	0	3	315.465	2.245	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cnc(C(F)(F)F)nc2)CCN1C	ZINC000157555089	402296044	/nfs/dbraw/zinc/29/60/44/402296044.db2.gz	NDTTZYQAIGFJDM-ONGXEEELSA-N	0	3	316.327	2.050	10	0		DEAEHN
COC(=O)c1coc(C(=O)N2CCCC[C@@H](N3CCCC3)C2)c1	ZINC000184766738	402298186	/nfs/dbraw/zinc/29/81/86/402298186.db2.gz	DLROCZIIIXTHQV-CQSZACIVSA-N	0	3	320.389	2.157	10	0		DEAEHN
COCCN(C)CCCNC(=O)c1c(C)oc2ccccc21	ZINC000185113272	402325345	/nfs/dbraw/zinc/32/53/45/402325345.db2.gz	WSDAFZRMWPOUGM-UHFFFAOYSA-N	0	3	304.390	2.439	10	0		DEAEHN
CC(C)(C)OC(=O)NCC(C)(C)NCc1ccc(C(N)=O)cc1	ZINC000221046388	402302565	/nfs/dbraw/zinc/30/25/65/402302565.db2.gz	UMNMEYWLKSFLRX-UHFFFAOYSA-N	0	3	321.421	2.178	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCCOCc2ccccc2)CCN1C	ZINC000176443486	402310258	/nfs/dbraw/zinc/31/02/58/402310258.db2.gz	JLTOWBBTBVLBSZ-DOTOQJQBSA-N	0	3	319.449	2.327	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)C1	ZINC000184949753	402312030	/nfs/dbraw/zinc/31/20/30/402312030.db2.gz	SNNYFJPHLWEOKD-IJLUTSLNSA-N	0	3	312.335	2.370	10	0		DEAEHN
C[C@@H]1CN(C2CCN(CCN(C)c3ccccc3)CC2)CCO1	ZINC000177280039	402387300	/nfs/dbraw/zinc/38/73/00/402387300.db2.gz	BJCMUPHGXDTYFI-QGZVFWFLSA-N	0	3	317.477	2.308	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1[nH]c(C)c(C(C)=O)c1C	ZINC000176963858	402354938	/nfs/dbraw/zinc/35/49/38/402354938.db2.gz	MQGHRRIYXBQNOH-CQSZACIVSA-N	0	3	305.422	2.390	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(C(=O)OC)cc1	ZINC000176995349	402357756	/nfs/dbraw/zinc/35/77/56/402357756.db2.gz	QRACNOCZJNWVQD-OAHLLOKOSA-N	0	3	304.390	2.030	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@@H]1CCOc2ccccc21	ZINC000177003724	402358254	/nfs/dbraw/zinc/35/82/54/402358254.db2.gz	INMBNWOTYLCQHK-GOEBONIOSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CSCc1ccncc1	ZINC000177021719	402360427	/nfs/dbraw/zinc/36/04/27/402360427.db2.gz	KNMLQFUSKOJUPP-HNNXBMFYSA-N	0	3	307.463	2.258	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CSC[C@@H]1CCCCO1	ZINC000177033601	402361651	/nfs/dbraw/zinc/36/16/51/402361651.db2.gz	DKPBRKHZHTXXSO-CABCVRRESA-N	0	3	314.495	2.231	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cccnc1NC(C)C	ZINC000177033668	402361857	/nfs/dbraw/zinc/36/18/57/402361857.db2.gz	AJUCFDSQMVJUKL-CQSZACIVSA-N	0	3	304.438	2.458	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)COCCOc1ccccc1	ZINC000177040427	402362946	/nfs/dbraw/zinc/36/29/46/402362946.db2.gz	FRDVADUBNCRROD-INIZCTEOSA-N	0	3	320.433	2.025	10	0		DEAEHN
CC(C)C[C@H](N)C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1	ZINC000236724154	402378402	/nfs/dbraw/zinc/37/84/02/402378402.db2.gz	SAYILPXTOMTZKK-RISCZKNCSA-N	0	3	311.376	2.033	10	0		DEAEHN
C[C@H]1CN(Cc2ccc3c(c2)CCC3)C[C@@H]1N1CCOCC1	ZINC000177251053	402385491	/nfs/dbraw/zinc/38/54/91/402385491.db2.gz	HQRCLTBFXOGQGH-KXBFYZLASA-N	0	3	300.446	2.328	10	0		DEAEHN
CCOc1ccccc1CN1C[C@H](C)[C@H](N2CCOCC2)C1	ZINC000177249663	402385503	/nfs/dbraw/zinc/38/55/03/402385503.db2.gz	MZDSQLKZVZMPBN-DOTOQJQBSA-N	0	3	304.434	2.238	10	0		DEAEHN
C[C@@H]1CN(Cc2ccc3c(c2)CCC3)C[C@@H]1N1CCOCC1	ZINC000177251039	402385671	/nfs/dbraw/zinc/38/56/71/402385671.db2.gz	HQRCLTBFXOGQGH-BEFAXECRSA-N	0	3	300.446	2.328	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)CCc1nnc(C(C)C)o1	ZINC000176656319	402326714	/nfs/dbraw/zinc/32/67/14/402326714.db2.gz	NVRCHCWJBPOSNA-ZDUSSCGKSA-N	0	3	310.442	2.218	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCOc1cccc(F)c1	ZINC000177362960	402394824	/nfs/dbraw/zinc/39/48/24/402394824.db2.gz	HRKLLNCTFPYQFK-OAHLLOKOSA-N	0	3	323.412	2.330	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCc1cccc(OC)c1	ZINC000177369323	402395340	/nfs/dbraw/zinc/39/53/40/402395340.db2.gz	QRFRKEVNYDFHAB-INIZCTEOSA-N	0	3	319.449	2.363	10	0		DEAEHN
O=C(CN1C[C@@H]2CCCC[C@@H]2C1)N1CCO[C@H]2CCCC[C@@H]21	ZINC000177513467	402411164	/nfs/dbraw/zinc/41/11/64/402411164.db2.gz	JNVRRYVTVVYKAP-YVSFHVDLSA-N	0	3	306.450	2.278	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H](C)Oc1ccccc1OC)N(C)C	ZINC000162332547	402416662	/nfs/dbraw/zinc/41/66/62/402416662.db2.gz	KCLCTFDTRKUUKZ-KGLIPLIRSA-N	0	3	308.422	2.309	10	0		DEAEHN
CCC[C@@H](C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)N(C)C	ZINC000162377069	402418374	/nfs/dbraw/zinc/41/83/74/402418374.db2.gz	YLPNFTNTBZMAMD-LBPRGKRZSA-N	0	3	315.458	2.136	10	0		DEAEHN
N[C@@H](CC(=O)NC[C@H]1COc2ccccc2O1)c1ccccc1	ZINC000237890823	402425347	/nfs/dbraw/zinc/42/53/47/402425347.db2.gz	MBEQPOALTHHUBO-GJZGRUSLSA-N	0	3	312.369	2.033	10	0		DEAEHN
CCOc1cc(CN2CCC(C(=O)N(C)C)CC2)ccc1OC	ZINC000162598697	402425402	/nfs/dbraw/zinc/42/54/02/402425402.db2.gz	ITWSLBGICXILTN-UHFFFAOYSA-N	0	3	320.433	2.394	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)CSc2nccc3ccccc32)C1	ZINC000162600272	402425616	/nfs/dbraw/zinc/42/56/16/402425616.db2.gz	DEEMEZUDXBEXQC-AWEZNQCLSA-N	0	3	315.442	2.489	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)NCc1ccccc1	ZINC000177709754	402428755	/nfs/dbraw/zinc/42/87/55/402428755.db2.gz	BOAIQYAPXRYMEO-DOTOQJQBSA-N	0	3	303.450	2.107	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)[C@@H](O)c2cc(Cl)cc(Cl)c2)C1	ZINC000163127200	402442223	/nfs/dbraw/zinc/44/22/23/402442223.db2.gz	BOYVIRLOTCBGOW-STQMWFEESA-N	0	3	317.216	2.189	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@@H]1Oc2ccccc2O[C@H]1C	ZINC000245431828	402460262	/nfs/dbraw/zinc/46/02/62/402460262.db2.gz	NLQPXEOICMMPSY-JJRVBVJISA-N	0	3	318.417	2.158	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C)C(=O)NCc1ccccc1F	ZINC000245471606	402464115	/nfs/dbraw/zinc/46/41/15/402464115.db2.gz	OCTOAVGJXSAKDF-ZBFHGGJFSA-N	0	3	321.440	2.247	10	0		DEAEHN
CCO[C@@H](CCNC(=O)N1CCN2CCC[C@H]2C1)C1CCCC1	ZINC000245480828	402464482	/nfs/dbraw/zinc/46/44/82/402464482.db2.gz	XPUHWEUUVQUSSR-IRXDYDNUSA-N	0	3	323.481	2.461	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C)C(=O)NC1CCC(C)CC1	ZINC000245476904	402464772	/nfs/dbraw/zinc/46/47/72/402464772.db2.gz	TZVDNPOFRZGYBC-MYBQVCMBSA-N	0	3	309.498	2.486	10	0		DEAEHN
COc1ccc(O)cc1C(=O)N(CCN(C)C)C1CCCC1	ZINC000186907442	402471350	/nfs/dbraw/zinc/47/13/50/402471350.db2.gz	ZUQBYEDAMBLPKQ-UHFFFAOYSA-N	0	3	306.406	2.347	10	0		DEAEHN
CCCn1cc(CN2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)cn1	ZINC000245569184	402471600	/nfs/dbraw/zinc/47/16/00/402471600.db2.gz	VYUBBKUTYFNHMX-JFIYKMOQSA-N	0	3	320.481	2.367	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccnc(OC2CCC2)c1	ZINC000245628910	402475033	/nfs/dbraw/zinc/47/50/33/402475033.db2.gz	RXIIDKWWGSBZOB-HIFRSBDPSA-N	0	3	315.417	2.322	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1cc(Br)cs1	ZINC000165448705	402476180	/nfs/dbraw/zinc/47/61/80/402476180.db2.gz	WVSSFWJEGFPWDS-LLVKDONJSA-N	0	3	308.241	2.388	10	0		DEAEHN
CN(C)C1(CN(C)C(=O)[C@@H]2CCCN2c2nccs2)CCC1	ZINC000187010152	402477589	/nfs/dbraw/zinc/47/75/89/402477589.db2.gz	LLRAJFQOGLHPDE-ZDUSSCGKSA-N	0	3	322.478	2.055	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCCc2cccnc2)[C@H]1c1ccccc1	ZINC000245663902	402478026	/nfs/dbraw/zinc/47/80/26/402478026.db2.gz	QJDNTCJRCIPASE-QZTJIDSGSA-N	0	3	324.428	2.369	10	0		DEAEHN
C[C@@H]1CN(C[C@H]2CCCN(S(C)(=O)=O)C2)[C@@H]1c1ccccc1	ZINC000246154901	402513412	/nfs/dbraw/zinc/51/34/12/402513412.db2.gz	DHVZQEXMQKEUKB-INMHGKMJSA-N	0	3	322.474	2.351	10	0		DEAEHN
C[C@H]1CC(CCN2CC[C@@H](NS(C)(=O)=O)C2)C[C@H](C)C1	ZINC000246151792	402513418	/nfs/dbraw/zinc/51/34/18/402513418.db2.gz	CFDFVZWUYLKQIA-UMVBOHGHSA-N	0	3	302.484	2.072	10	0		DEAEHN
CCCn1nc(C)c(CN2CCN(C[C@H](C)O)[C@@H](CC)C2)c1C	ZINC000245781259	402487495	/nfs/dbraw/zinc/48/74/95/402487495.db2.gz	UHHJMFYPAGPBQK-YOEHRIQHSA-N	0	3	322.497	2.187	10	0		DEAEHN
COc1cc(CN(C[C@H](O)COC(C)C)C2CC2)cc(OC)c1	ZINC000036095103	286217960	/nfs/dbraw/zinc/21/79/60/286217960.db2.gz	VZKKAWLPQUUXBJ-INIZCTEOSA-N	0	3	323.433	2.454	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCc1nccn1C(F)F	ZINC000170682714	402513481	/nfs/dbraw/zinc/51/34/81/402513481.db2.gz	OUGZZJWSLMYXEE-NSHDSACASA-N	0	3	317.384	2.054	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCCC[C@H]2c2cn[nH]c2)C1	ZINC000245971324	402501423	/nfs/dbraw/zinc/50/14/23/402501423.db2.gz	OCAOAXQXMCVXPW-CABCVRRESA-N	0	3	305.426	2.131	10	0		DEAEHN
COC[C@H](C)CNc1cccc(CN2CCC(C(N)=O)CC2)c1	ZINC000187495636	402502784	/nfs/dbraw/zinc/50/27/84/402502784.db2.gz	HDSXFJKFUJWAFB-CQSZACIVSA-N	0	3	319.449	2.078	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@@H](C)N1CCC[C@@H](Cc2nccn2C)C1	ZINC000246013582	402503957	/nfs/dbraw/zinc/50/39/57/402503957.db2.gz	ZVHDNHWBENUSQJ-XHSDSOJGSA-N	0	3	320.481	2.368	10	0		DEAEHN
C[C@H](N[C@@H]1CCN(Cc2ccccn2)C[C@@H]1C)c1nccn1C	ZINC000246078902	402508197	/nfs/dbraw/zinc/50/81/97/402508197.db2.gz	UQEYEYZFTTVHQV-YQQAZPJKSA-N	0	3	313.449	2.376	10	0		DEAEHN
O=C(N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)N1CCN2CCC[C@H]2C1	ZINC000246721259	402542136	/nfs/dbraw/zinc/54/21/36/402542136.db2.gz	VDMFLRWSAPNSRG-XOYOTBSWSA-N	0	3	311.429	2.204	10	0		DEAEHN
COc1cccc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1OC	ZINC000246774180	402544171	/nfs/dbraw/zinc/54/41/71/402544171.db2.gz	AYKGCWKLOQRWSC-OLZOCXBDSA-N	0	3	304.390	2.013	10	0		DEAEHN
C[C@@H]1CCC[C@H](C(=O)N2CCCC[C@@H](N3CCN(C)CC3)C2)C1	ZINC000246804162	402545467	/nfs/dbraw/zinc/54/54/67/402545467.db2.gz	JWWSWOHHAIITGT-FGTMMUONSA-N	0	3	321.509	2.441	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cnc2onc(C)c2c1	ZINC000246954639	402551136	/nfs/dbraw/zinc/55/11/36/402551136.db2.gz	MCRAFMGVPCHSBB-KGLIPLIRSA-N	0	3	314.389	2.230	10	0		DEAEHN
Cc1cc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)nn1-c1ccccc1	ZINC000247026339	402553984	/nfs/dbraw/zinc/55/39/84/402553984.db2.gz	GFKBTVVWXFKVNK-NVXWUHKLSA-N	0	3	324.428	2.489	10	0		DEAEHN
COC[C@H](NC(=O)N1CCCN(C2CC2)CC1)c1ccccc1	ZINC000171068320	402554248	/nfs/dbraw/zinc/55/42/48/402554248.db2.gz	XJVKJGQBYIJQPL-KRWDZBQOSA-N	0	3	317.433	2.254	10	0		DEAEHN
C[C@@H](C(=O)N1CC[C@@H](C(=O)OC(C)(C)C)C1)N1[C@H](C)CC[C@@H]1C	ZINC000247129880	402558311	/nfs/dbraw/zinc/55/83/11/402558311.db2.gz	SFHIFSFJJRUMMK-LJISPDSOSA-N	0	3	324.465	2.438	10	0		DEAEHN
COC(=O)CCNC(=O)CN[C@@H](C)c1ccc(C(C)C)cc1	ZINC000171108851	402558568	/nfs/dbraw/zinc/55/85/68/402558568.db2.gz	GLTGECWQDPBNFF-ZDUSSCGKSA-N	0	3	306.406	2.140	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000247322347	402563570	/nfs/dbraw/zinc/56/35/70/402563570.db2.gz	OSGGYDRUBCVPIQ-RISCZKNCSA-N	0	3	319.380	2.093	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc(-c3ncon3)cc2)C1	ZINC000171180226	402563947	/nfs/dbraw/zinc/56/39/47/402563947.db2.gz	PMFZLRWHZBBZJI-AWEZNQCLSA-N	0	3	315.377	2.342	10	0		DEAEHN
COc1ccc(C(C)(C)CNC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000171190655	402564940	/nfs/dbraw/zinc/56/49/40/402564940.db2.gz	KNLILHOGVFTVBS-HNNXBMFYSA-N	0	3	319.449	2.366	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)NC[C@@H]1CCCN1C)c1ccco1	ZINC000171192946	402565132	/nfs/dbraw/zinc/56/51/32/402565132.db2.gz	URNRDFNZJOIGCO-GJZGRUSLSA-N	0	3	322.453	2.056	10	0		DEAEHN
COCCN1CCC(NC(=O)N[C@@H](C)c2cc(C)oc2C)CC1	ZINC000171194905	402565991	/nfs/dbraw/zinc/56/59/91/402565991.db2.gz	LKVNQANMLDBQIM-ZDUSSCGKSA-N	0	3	323.437	2.367	10	0		DEAEHN
C[C@H](CN[C@@H](C)c1cccc(-n2ccnc2)c1)CS(C)(=O)=O	ZINC000189914515	402567035	/nfs/dbraw/zinc/56/70/35/402567035.db2.gz	PYGWVYFCSWMAGP-KGLIPLIRSA-N	0	3	321.446	2.204	10	0		DEAEHN
CC[C@@H]1c2ccsc2CCN1C[C@@H](O)CN1CCCC1=O	ZINC000247495435	402569741	/nfs/dbraw/zinc/56/97/41/402569741.db2.gz	MNPXWTQCNWDQQA-TZMCWYRMSA-N	0	3	308.447	2.041	10	0		DEAEHN
O=C(CN1CCN2CCC[C@H]2C1)Nc1nc2ccccc2s1	ZINC000247504779	402570224	/nfs/dbraw/zinc/57/02/24/402570224.db2.gz	IRKBTBYTNANLHG-LBPRGKRZSA-N	0	3	316.430	2.015	10	0		DEAEHN
COc1ccc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1OC	ZINC000247520561	402570752	/nfs/dbraw/zinc/57/07/52/402570752.db2.gz	WQZZDLXSTARDIC-JSGCOSHPSA-N	0	3	304.390	2.013	10	0		DEAEHN
CN(C)Cc1ccccc1CNC(=O)c1cn2ccnc2s1	ZINC000188228083	402517562	/nfs/dbraw/zinc/51/75/62/402517562.db2.gz	UOXFTRYQIVDJTD-UHFFFAOYSA-N	0	3	314.414	2.387	10	0		DEAEHN
Cc1ccccc1OCCNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000246196406	402517966	/nfs/dbraw/zinc/51/79/66/402517966.db2.gz	MTNAXBYKSPAJII-HOTGVXAUSA-N	0	3	319.449	2.498	10	0		DEAEHN
Cc1ccccc1NC(=O)C(=O)NC[C@H]1CCCN1CC(C)C	ZINC000178626031	402518881	/nfs/dbraw/zinc/51/88/81/402518881.db2.gz	UIECWVBZXLDAPX-OAHLLOKOSA-N	0	3	317.433	2.170	10	0		DEAEHN
C[C@@H]1CN(C[C@H](O)COCc2ccc(Cl)cc2)CCCO1	ZINC000170764451	402522000	/nfs/dbraw/zinc/52/20/00/402522000.db2.gz	WAHOWBXKZSCTSJ-CJNGLKHVSA-N	0	3	313.825	2.328	10	0		DEAEHN
COC(=O)Cc1cccc(C(=O)N[C@H](CC(C)C)CN(C)C)c1	ZINC000188619333	402522330	/nfs/dbraw/zinc/52/23/30/402522330.db2.gz	DDKYPSMDDGHZMD-MRXNPFEDSA-N	0	3	320.433	2.108	10	0		DEAEHN
C[C@@H]1CN([C@@H]2CCc3ccc(F)cc32)C[C@H]1N1CCOCC1	ZINC000246308398	402523844	/nfs/dbraw/zinc/52/38/44/402523844.db2.gz	CHFDVNBGGVMPGG-FSPWUOQZSA-N	0	3	304.409	2.466	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCc2ccccc2OC(F)F)C1	ZINC000170827855	402529682	/nfs/dbraw/zinc/52/96/82/402529682.db2.gz	MOOUWRCBMSZWIM-LBPRGKRZSA-N	0	3	313.348	2.134	10	0		DEAEHN
COc1ccc([C@H](NC(=O)N2CC[C@H](N(C)C)C2)C2CC2)cc1	ZINC000170827495	402529868	/nfs/dbraw/zinc/52/98/68/402529868.db2.gz	HIIWSQQHYPUSJR-DOTOQJQBSA-N	0	3	317.433	2.492	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)N1CC[C@@H](N(C)C)C1)c1ccco1	ZINC000170834783	402530744	/nfs/dbraw/zinc/53/07/44/402530744.db2.gz	PTDQJDRBOBWUHJ-HUUCEWRRSA-N	0	3	322.453	2.008	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCc2cc(-c3ccccc3)on2)C1	ZINC000170836698	402531340	/nfs/dbraw/zinc/53/13/40/402531340.db2.gz	NUXZLCODKHEMMC-HNNXBMFYSA-N	0	3	314.389	2.187	10	0		DEAEHN
Cc1nc(C)c(CCNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)s1	ZINC000246483477	402533069	/nfs/dbraw/zinc/53/30/69/402533069.db2.gz	VWLFWBRBHMTZPZ-SMDDNHRTSA-N	0	3	324.494	2.427	10	0		DEAEHN
C[C@H](C(=O)N1CCCN(C2CC2)CC1)[C@H](N)c1ccccc1	ZINC000178747354	402533752	/nfs/dbraw/zinc/53/37/52/402533752.db2.gz	FWBYSMQQGPQLAA-YOEHRIQHSA-N	0	3	301.434	2.019	10	0		DEAEHN
CC(=O)c1cccc(OCCCC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000170864214	402535188	/nfs/dbraw/zinc/53/51/88/402535188.db2.gz	XEFQJIRRZPCBKA-INIZCTEOSA-N	0	3	318.417	2.211	10	0		DEAEHN
CO[C@@H]1CC[C@@H]2OCCN(CCCOCC(F)(F)F)[C@H]2C1	ZINC000246524101	402535462	/nfs/dbraw/zinc/53/54/62/402535462.db2.gz	KVCZXXMFGIOAQX-AGIUHOORSA-N	0	3	311.344	2.224	10	0		DEAEHN
COC(=O)[C@@H](c1ccccc1F)N1CCN2CCCC[C@H]2C1	ZINC000248345036	402586722	/nfs/dbraw/zinc/58/67/22/402586722.db2.gz	MHKDBKKQTNZPRR-XJKSGUPXSA-N	0	3	306.381	2.210	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2cc(F)cc(OC)c2)C1	ZINC000179463484	402590491	/nfs/dbraw/zinc/59/04/91/402590491.db2.gz	ULOSHCAPXLCTFE-CQSZACIVSA-N	0	3	309.385	2.118	10	0		DEAEHN
CO[C@H](C)CNC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000190407746	402598642	/nfs/dbraw/zinc/59/86/42/402598642.db2.gz	XXXVGZXLSCWGHE-NVXWUHKLSA-N	0	3	319.449	2.375	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@H]1CCN(Cc2csnn2)C1	ZINC000190468451	402603654	/nfs/dbraw/zinc/60/36/54/402603654.db2.gz	URNSRIBZJXYHIE-GFCCVEGCSA-N	0	3	323.491	2.257	10	0		DEAEHN
CCc1ccccc1NC(=O)[C@@H](C)N1CCN2CCC[C@@H]2C1	ZINC000171640439	402605094	/nfs/dbraw/zinc/60/50/94/402605094.db2.gz	CJQYGLCHHPZPTL-GDBMZVCRSA-N	0	3	301.434	2.356	10	0		DEAEHN
CN(Cc1cccnc1)C[C@H]1CCN(Cc2cncs2)C1	ZINC000190488598	402605414	/nfs/dbraw/zinc/60/54/14/402605414.db2.gz	NLELJTMFBQHGDJ-OAHLLOKOSA-N	0	3	302.447	2.492	10	0		DEAEHN
COc1cc(CN2CCCC[C@H]2CN2CCOCC2)ccc1O	ZINC000180075797	402607157	/nfs/dbraw/zinc/60/71/57/402607157.db2.gz	UDIDSEHFGDEEAN-INIZCTEOSA-N	0	3	320.433	2.088	10	0		DEAEHN
C[C@H]1CN(CCC(=O)N2CCc3sccc3C2)CCS1	ZINC000171688090	402610178	/nfs/dbraw/zinc/61/01/78/402610178.db2.gz	JIVSDKZQOAOQFP-LBPRGKRZSA-N	0	3	310.488	2.460	10	0		DEAEHN
CCCn1nc(C)c(CN2C[C@H](C)[C@H](N3CCOCC3)C2)c1C	ZINC000180224842	402610253	/nfs/dbraw/zinc/61/02/53/402610253.db2.gz	XKAIBTCDGKHAIF-KBXCAEBGSA-N	0	3	320.481	2.062	10	0		DEAEHN
C[C@H]1OCCC[C@@H]1C(=O)NCc1ccccc1OCCN(C)C	ZINC000190701238	402619391	/nfs/dbraw/zinc/61/93/91/402619391.db2.gz	GABQBQMKBZGCSG-ZBFHGGJFSA-N	0	3	320.433	2.058	10	0		DEAEHN
CCc1cc(NC(=O)C(=O)NC[C@@H]2CCCN2CC)ccc1C	ZINC000180598320	402620639	/nfs/dbraw/zinc/62/06/39/402620639.db2.gz	LGRWLSHMRNKKMM-INIZCTEOSA-N	0	3	317.433	2.096	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000249107907	402620657	/nfs/dbraw/zinc/62/06/57/402620657.db2.gz	AEKJYGVIOXBOPD-HOCLYGCPSA-N	0	3	317.433	2.183	10	0		DEAEHN
Cc1nn(C)cc1[C@@H](C)N[C@@H]1CCc2nc(C(C)C)nn2C1	ZINC000180636735	402622251	/nfs/dbraw/zinc/62/22/51/402622251.db2.gz	LQJXCWCDELLZMY-DGCLKSJQSA-N	0	3	302.426	2.109	10	0		DEAEHN
CCc1cccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000249218340	402623491	/nfs/dbraw/zinc/62/34/91/402623491.db2.gz	UBCMZBQFAKSPMN-BBRMVZONSA-N	0	3	317.433	2.129	10	0		DEAEHN
O=C(NCCOc1cccc(Cl)c1)N1CCN2CCC[C@H]2C1	ZINC000171902509	402632478	/nfs/dbraw/zinc/63/24/78/402632478.db2.gz	YINGEXHETYQCAI-AWEZNQCLSA-N	0	3	323.824	2.208	10	0		DEAEHN
Cc1cccc(CNC(=O)CN(C)[C@]2(CO)CC[C@@H](C)C2)c1	ZINC000249600499	402636332	/nfs/dbraw/zinc/63/63/32/402636332.db2.gz	YAOUZNVINIJVRE-CRAIPNDOSA-N	0	3	304.434	2.094	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000249635462	402637595	/nfs/dbraw/zinc/63/75/95/402637595.db2.gz	RXKPUXGJDSXTSA-QSPRXWTASA-N	0	3	302.418	2.363	10	0		DEAEHN
CCOC(=O)N[C@H]1CCCN(C[C@@](C)(O)c2ccccc2)C1	ZINC000249723050	402638895	/nfs/dbraw/zinc/63/88/95/402638895.db2.gz	CQAINOUJVZXEQV-DOTOQJQBSA-N	0	3	306.406	2.105	10	0		DEAEHN
CC(C)(C)OC(=O)CCCN1CCC[C@@H](Cn2cncn2)C1	ZINC000181885583	402659792	/nfs/dbraw/zinc/65/97/92/402659792.db2.gz	MMMUDSSQGUDMRV-CQSZACIVSA-N	0	3	308.426	2.112	10	0		DEAEHN
C[C@@H](C(=O)Nc1cccc(F)c1)N1CCCN(C2CC2)CC1	ZINC000172347010	402651760	/nfs/dbraw/zinc/65/17/60/402651760.db2.gz	IMQQMMIBOUNQCR-ZDUSSCGKSA-N	0	3	305.397	2.323	10	0		DEAEHN
C[C@@H]1CC(O)C[C@@H](C)N1Cc1cc(=O)n2cc(Cl)ccc2n1	ZINC000191285953	402657436	/nfs/dbraw/zinc/65/74/36/402657436.db2.gz	QJWIGPLBNUGTGG-GHMZBOCLSA-N	0	3	321.808	2.082	10	0		DEAEHN
c1cc([C@@H]2CCCN2CCCN2CCOCC2)cc2c1OCO2	ZINC000173642011	402706188	/nfs/dbraw/zinc/70/61/88/402706188.db2.gz	NRJZCYIHNGULKJ-INIZCTEOSA-N	0	3	318.417	2.275	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)NCCC1CCCCC1	ZINC000172540056	402661378	/nfs/dbraw/zinc/66/13/78/402661378.db2.gz	CXMPONNTLCDOBW-UHFFFAOYSA-N	0	3	307.482	2.243	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)N[C@H]1CCc2ccccc21	ZINC000261943395	402719893	/nfs/dbraw/zinc/71/98/93/402719893.db2.gz	VBSRCXMVMSTWHT-YIOZNXECSA-N	0	3	314.429	2.323	10	0		DEAEHN
C[C@@H](CNC(=O)c1cnn(CCC(F)(F)F)c1)N(C)C1CC1	ZINC000182384111	402685800	/nfs/dbraw/zinc/68/58/00/402685800.db2.gz	PVQAJOJHUSJAJB-JTQLQIEISA-N	0	3	318.343	2.048	10	0		DEAEHN
O=C(NCCc1c[nH]c2ccccc12)N1CC[C@H](N2CC=CC2)C1	ZINC000173296044	402691210	/nfs/dbraw/zinc/69/12/10/402691210.db2.gz	WSVCIHMNXHGZQL-INIZCTEOSA-N	0	3	324.428	2.366	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NC[C@@H](c2ccco2)N(C)C)CCN1C	ZINC000173355398	402694040	/nfs/dbraw/zinc/69/40/40/402694040.db2.gz	BWXKWESOHQCYLS-KFWWJZLASA-N	0	3	322.453	2.006	10	0		DEAEHN
Cc1csc([C@H]2CCCN(C(=O)NC3CCN(C)CC3)C2)n1	ZINC000173389877	402695394	/nfs/dbraw/zinc/69/53/94/402695394.db2.gz	AFMBUQWXFQDPIT-ZDUSSCGKSA-N	0	3	322.478	2.435	10	0		DEAEHN
CCc1nnc(CN[C@H]2CCC[C@H]2CNC(=O)OC(C)(C)C)[nH]1	ZINC000191916325	402698620	/nfs/dbraw/zinc/69/86/20/402698620.db2.gz	MXECWJSHIWHUSC-RYUDHWBXSA-N	0	3	323.441	2.150	10	0		DEAEHN
CCc1nnc(C[NH2+][C@H]2CCC[C@H]2CNC(=O)OC(C)(C)C)[n-]1	ZINC000191916325	402698621	/nfs/dbraw/zinc/69/86/21/402698621.db2.gz	MXECWJSHIWHUSC-RYUDHWBXSA-N	0	3	323.441	2.150	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)C[C@@H](C)C1	ZINC000262505526	402726719	/nfs/dbraw/zinc/72/67/19/402726719.db2.gz	MJPZHEXSLXUCCA-OXAFQIDNSA-N	0	3	308.466	2.460	10	0		DEAEHN
C[C@@H]1CCC[C@H](NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)[C@@H]1C	ZINC000262534890	402726870	/nfs/dbraw/zinc/72/68/70/402726870.db2.gz	QFDVHGYPMUONGC-MQUBADLTSA-N	0	3	308.466	2.460	10	0		DEAEHN
C[C@H](C(=O)N1CCCC[C@@H]1c1nc[nH]n1)[C@@H](N)c1ccccc1	ZINC000183003026	402732207	/nfs/dbraw/zinc/73/22/07/402732207.db2.gz	YFYSXOINBMRISR-NWANDNLSSA-N	0	3	313.405	2.194	10	0		DEAEHN
CN(CCCN1CCN(C)CC1)C(=O)NC1CCC(C)(C)CC1	ZINC000183072781	402736625	/nfs/dbraw/zinc/73/66/25/402736625.db2.gz	REOPCDCKWJBRFE-UHFFFAOYSA-N	0	3	324.513	2.234	10	0		DEAEHN
C[C@H](NCC(=O)N[C@@H](c1ccccc1)C1CC1)[C@@H]1CCCO1	ZINC000183114533	402739899	/nfs/dbraw/zinc/73/98/99/402739899.db2.gz	MTHKOMXLSMRGMF-OWQGQXMQSA-N	0	3	302.418	2.411	10	0		DEAEHN
CC(C)OC[C@@H](O)CN[C@@H](C)c1ccccc1-n1cccn1	ZINC000183143739	402742909	/nfs/dbraw/zinc/74/29/09/402742909.db2.gz	XNXLOJTVXLMKPQ-GJZGRUSLSA-N	0	3	303.406	2.309	10	0		DEAEHN
CNC(=O)C(C)(C)CN[C@H](C)c1ccc(OC)c(NC(C)=O)c1	ZINC000183215938	402747890	/nfs/dbraw/zinc/74/78/90/402747890.db2.gz	WGHSAGDXMPHRRL-LLVKDONJSA-N	0	3	321.421	2.076	10	0		DEAEHN
CC[C@H](OC1CCCCC1)c1nc([C@H]2CNCCN2C)no1	ZINC000263249299	402750180	/nfs/dbraw/zinc/75/01/80/402750180.db2.gz	PPXCJQSHASLFEK-KGLIPLIRSA-N	0	3	308.426	2.446	10	0		DEAEHN
Cc1cc(-c2nc([C@H]3CNCCN3C)no2)nc2ccccc12	ZINC000263286113	402754252	/nfs/dbraw/zinc/75/42/52/402754252.db2.gz	UZRGDDYRBWAERZ-OAHLLOKOSA-N	0	3	309.373	2.169	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)NCCN2CCCCC2)c1	ZINC000174966839	402767156	/nfs/dbraw/zinc/76/71/56/402767156.db2.gz	OFCBQLDNZSXHAC-UHFFFAOYSA-N	0	3	318.421	2.277	10	0		DEAEHN
CC[C@H](C)c1ccc(S(=O)(=O)N[C@@H]2CNCC[C@@H]2C)cc1	ZINC000193415193	402770804	/nfs/dbraw/zinc/77/08/04/402770804.db2.gz	AFOPAZWEKMJYQP-HEHGZKQESA-N	0	3	310.463	2.476	10	0		DEAEHN
Cc1cc(C)cc([C@@H]2CCN(C(=O)C(C)S(C)(=O)=O)C2)c1	ZINC000183778318	402797209	/nfs/dbraw/zinc/79/72/09/402797209.db2.gz	YUJGBHJKABJRHC-UONOGXRCSA-N	0	3	309.431	2.052	10	0		DEAEHN
O=C(CCCOc1cccc(F)c1)N1CCN2CCC[C@@H]2C1	ZINC000195336644	402842469	/nfs/dbraw/zinc/84/24/69/402842469.db2.gz	ABTKKSZMISXPMR-OAHLLOKOSA-N	0	3	306.381	2.291	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccc(NC(=O)C(C)C)cc2)C1	ZINC000194656419	402808145	/nfs/dbraw/zinc/80/81/45/402808145.db2.gz	SGVAJZMRUVKVHJ-MRXNPFEDSA-N	0	3	317.433	2.495	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)NC[C@@H](C)N2CCC[C@H](C)C2)n1	ZINC000194676062	402810002	/nfs/dbraw/zinc/81/00/02/402810002.db2.gz	YGESPAHMCHODJY-APHBMKBZSA-N	0	3	306.454	2.298	10	0		DEAEHN
Cc1oc(-c2cccs2)nc1CC(=O)NC[C@@H]1CCCN1C	ZINC000194712673	402811596	/nfs/dbraw/zinc/81/15/96/402811596.db2.gz	VRQCIHPNDCNLOG-LBPRGKRZSA-N	0	3	319.430	2.464	10	0		DEAEHN
C[C@@H](CNc1ncnc2cc(Cl)ccc21)N1CCN(C)CC1	ZINC000263911469	402819210	/nfs/dbraw/zinc/81/92/10/402819210.db2.gz	JYXMHPIHCKVWLK-LBPRGKRZSA-N	0	3	319.840	2.331	10	0		DEAEHN
COc1cccc([C@@H](C)N2CCC(N3CCNC3=O)CC2)c1	ZINC000175587285	402819468	/nfs/dbraw/zinc/81/94/68/402819468.db2.gz	BKLVZWUMGSNJAS-CYBMUJFWSA-N	0	3	303.406	2.246	10	0		DEAEHN
COC[C@H](NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)c1ccco1	ZINC000175742577	402828494	/nfs/dbraw/zinc/82/84/94/402828494.db2.gz	AUHWZAKUUYQNSA-MCIONIFRSA-N	0	3	309.410	2.091	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC[C@@H](CC(=O)OC(C)C)C1)N(C)C	ZINC000184283654	402832631	/nfs/dbraw/zinc/83/26/31/402832631.db2.gz	DNUDAGWIHZYYLC-LSDHHAIUSA-N	0	3	312.454	2.297	10	0		DEAEHN
C[C@@H](C(=O)N1CCC[C@H]1c1cnn(C)c1)N1CCCCCC1	ZINC000176000491	402847233	/nfs/dbraw/zinc/84/72/33/402847233.db2.gz	KHKXUTSPUROVSJ-HOCLYGCPSA-N	0	3	304.438	2.348	10	0		DEAEHN
CC(C)N(C(=O)CN1CC[C@@H](CNc2ccccn2)C1)C(C)C	ZINC000195515672	402848645	/nfs/dbraw/zinc/84/86/45/402848645.db2.gz	CPFZRFHXDZLEKP-INIZCTEOSA-N	0	3	318.465	2.461	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1occc1Br	ZINC000268155130	403055352	/nfs/dbraw/zinc/05/53/52/403055352.db2.gz	PJOMZOPMUYRMTJ-VIFPVBQESA-N	0	3	301.184	2.208	10	0		DEAEHN
CC(=O)N(C[C@@H]1CCCN1C[C@H](O)c1ccc(F)cc1)C1CC1	ZINC000276339556	403165625	/nfs/dbraw/zinc/16/56/25/403165625.db2.gz	HBVVFFODJDKDDQ-ROUUACIJSA-N	0	3	320.408	2.334	10	0		DEAEHN
CN(Cc1ccccn1)[C@H]1CCCN(Cc2csnn2)CC1	ZINC000275862202	403129239	/nfs/dbraw/zinc/12/92/39/403129239.db2.gz	XOWQMXMEULCBRZ-INIZCTEOSA-N	0	3	317.462	2.420	10	0		DEAEHN
Cc1nc2cccc(C(=O)N(C)[C@@H]3CCN(C)[C@H](C)C3)c2[nH]1	ZINC000283824724	403226306	/nfs/dbraw/zinc/22/63/06/403226306.db2.gz	FMVHJQXYOAHWLN-DGCLKSJQSA-N	0	3	300.406	2.426	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@H](C)N[C@H]2CCOC[C@H]2C)c1	ZINC000278046411	403282374	/nfs/dbraw/zinc/28/23/74/403282374.db2.gz	XURUPXNGVSGSIL-WQGACYEGSA-N	0	3	304.390	2.231	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN(C)CCc1ccc(Br)cc1	ZINC000347739189	403836169	/nfs/dbraw/zinc/83/61/69/403836169.db2.gz	PIYYAVWNKJGGFH-AWEZNQCLSA-N	0	3	314.223	2.263	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@@H](CCO)c2ccco2)C12CCOCC2	ZINC000186556960	286396498	/nfs/dbraw/zinc/39/64/98/286396498.db2.gz	XBPXTALGBPITMZ-CWRNSKLLSA-N	0	3	309.406	2.267	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@@H](C)N[C@@H]2CCOC2(C)C)c1	ZINC000295372415	403887749	/nfs/dbraw/zinc/88/77/49/403887749.db2.gz	ZZHKMUOPYSMVGD-IAQYHMDHSA-N	0	3	304.390	2.373	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@H](C)N[C@@H]2CCOC2(C)C)c1	ZINC000295372418	403888113	/nfs/dbraw/zinc/88/81/13/403888113.db2.gz	ZZHKMUOPYSMVGD-XHDPSFHLSA-N	0	3	304.390	2.373	10	0		DEAEHN
c1ccc2c(c1)CO[C@@]21CCCN(CCCN2CCOCC2)C1	ZINC000369011529	403938010	/nfs/dbraw/zinc/93/80/10/403938010.db2.gz	ULUKZKJBQGSMDH-LJQANCHMSA-N	0	3	316.445	2.230	10	0		DEAEHN
CC(C)[C@@H](N)c1cn(Cc2ccc(Br)cn2)nn1	ZINC000305908286	403950657	/nfs/dbraw/zinc/95/06/57/403950657.db2.gz	GVHDOVORPQQNET-GFCCVEGCSA-N	0	3	310.199	2.140	10	0		DEAEHN
Cn1ccc(N2CC[C@H](NCc3cc4ccccc4[nH]c3=O)C2)n1	ZINC000363182843	404107857	/nfs/dbraw/zinc/10/78/57/404107857.db2.gz	HWQFHPXDICCVTR-HNNXBMFYSA-N	0	3	323.400	2.042	10	0		DEAEHN
CN(C(=O)c1cc2ccccc2c(=O)[nH]1)[C@H]1CN2CCC1CC2	ZINC000329454686	404340643	/nfs/dbraw/zinc/34/06/43/404340643.db2.gz	MIVHGJRBFAMTHV-INIZCTEOSA-N	0	3	311.385	2.107	10	0		DEAEHN
CC(C)N1CC[C@H](N2CCC(COc3ccccn3)CC2)C1=O	ZINC000370167464	404357066	/nfs/dbraw/zinc/35/70/66/404357066.db2.gz	PARAHVQTHZEGEA-INIZCTEOSA-N	0	3	317.433	2.182	10	0		DEAEHN
CC1(C)CCC(=CC(=O)NC[C@H]2CN3CCC[C@@H]3CO2)CC1	ZINC000370964551	404430151	/nfs/dbraw/zinc/43/01/51/404430151.db2.gz	DHZANKFZZZMZNT-CVEARBPZSA-N	0	3	306.450	2.492	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)Nc2cn(C)nc2C2CC2)CCN1C	ZINC000292018771	404630022	/nfs/dbraw/zinc/63/00/22/404630022.db2.gz	JMJRKMYSSBWNSP-AAEUAGOBSA-N	0	3	305.426	2.244	10	0		DEAEHN
CN(C)Cc1ccccc1C(=O)N1CCC[C@H](n2cccn2)C1	ZINC000365897502	404740941	/nfs/dbraw/zinc/74/09/41/404740941.db2.gz	XXMXWVUBYYQGNR-INIZCTEOSA-N	0	3	312.417	2.422	10	0		DEAEHN
CC[C@H](NC1CCN(c2nnnn2C)CC1)c1ccccc1F	ZINC000376177785	404814472	/nfs/dbraw/zinc/81/44/72/404814472.db2.gz	KZXKDXIHQMBGRB-HNNXBMFYSA-N	0	3	318.400	2.059	10	0		DEAEHN
CC(=O)NCC1CCN(Cc2ccc(-c3cc[nH]n3)o2)CC1	ZINC000435126144	404958062	/nfs/dbraw/zinc/95/80/62/404958062.db2.gz	JLTCSKGPUFYRAF-UHFFFAOYSA-N	0	3	302.378	2.018	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)[C@@H](C)N[C@H]2CCOC2(C)C)cc1	ZINC000451238815	404914585	/nfs/dbraw/zinc/91/45/85/404914585.db2.gz	FAQGVOQRLFCCMM-ABAIWWIYSA-N	0	3	304.390	2.373	10	0		DEAEHN
CC(=O)N1CC[C@@H](CN(C)Cc2cncc(C(F)(F)F)c2)C1	ZINC000361322870	405023081	/nfs/dbraw/zinc/02/30/81/405023081.db2.gz	ASETUMVGLOVMFB-LBPRGKRZSA-N	0	3	315.339	2.401	10	0		DEAEHN
CCn1cc(Br)cc1C(=O)N[C@@H]1CCN(CC)C1	ZINC000389976077	405042626	/nfs/dbraw/zinc/04/26/26/405042626.db2.gz	IZSAHGPBNLFJEA-LLVKDONJSA-N	0	3	314.227	2.095	10	0		DEAEHN
Nc1cccnc1C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000390766593	405047611	/nfs/dbraw/zinc/04/76/11/405047611.db2.gz	FRTFUNFLQZYSKN-HNNXBMFYSA-N	0	3	310.401	2.058	10	0		DEAEHN
C[C@]1(NC(=O)c2ncccc2N)CCN(Cc2ccccc2)C1	ZINC000405980872	405072064	/nfs/dbraw/zinc/07/20/64/405072064.db2.gz	DLRVAPPCNDNWSK-SFHVURJKSA-N	0	3	310.401	2.058	10	0		DEAEHN
OC1(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)CCC1	ZINC000408257275	405154966	/nfs/dbraw/zinc/15/49/66/405154966.db2.gz	RUTUELSEHNOUDR-AWEZNQCLSA-N	0	3	304.438	2.099	10	0		DEAEHN
CC[C@H](COCC(F)(F)F)NC(=O)CC1CCN(C)CC1	ZINC000452747598	405237692	/nfs/dbraw/zinc/23/76/92/405237692.db2.gz	RGICVKSCKLATAJ-GFCCVEGCSA-N	0	3	310.360	2.192	10	0		DEAEHN
CC(C)(C)OC(=O)c1ccc(CN[C@@]2(CCO)CCOC2)cc1	ZINC000447090838	405402175	/nfs/dbraw/zinc/40/21/75/405402175.db2.gz	MQVNCDSWTGONES-SFHVURJKSA-N	0	3	321.417	2.273	10	0		DEAEHN
CS(=O)(=O)c1cccc(CN2CCC[C@@H](N3CCCC3)C2)c1	ZINC000449019467	405501629	/nfs/dbraw/zinc/50/16/29/405501629.db2.gz	WQGZQNWSJGXFOK-MRXNPFEDSA-N	0	3	322.474	2.150	10	0		DEAEHN
c1c2cccnc2oc1CN1CCN(C2CCOCC2)CC1	ZINC000449025022	405503330	/nfs/dbraw/zinc/50/33/30/405503330.db2.gz	ACJRENVVXOCOSO-UHFFFAOYSA-N	0	3	301.390	2.124	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCOc2ccc(OC)cc2C1	ZINC000456159953	405522234	/nfs/dbraw/zinc/52/22/34/405522234.db2.gz	OQPMQRGXRFVLLR-MRXNPFEDSA-N	0	3	318.417	2.291	10	0		DEAEHN
Cc1c(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)nnn1C(C)C	ZINC000557837388	405631410	/nfs/dbraw/zinc/63/14/10/405631410.db2.gz	SBZSAOXEJIOMDY-CYBMUJFWSA-N	0	3	319.453	2.114	10	0		DEAEHN
O=C(NC[C@@H](O)C1CCC1)c1cccc(CN2CCCC2)c1	ZINC000456865057	405596887	/nfs/dbraw/zinc/59/68/87/405596887.db2.gz	HHKWVPSFLGHAKY-QGZVFWFLSA-N	0	3	302.418	2.173	10	0		DEAEHN
O=C(NCCNc1ccncc1)NCC[C@@H]1CCc2ccccc21	ZINC000458922006	405655254	/nfs/dbraw/zinc/65/52/54/405655254.db2.gz	NLJZKFDONYCWPF-INIZCTEOSA-N	0	3	324.428	2.335	10	0		DEAEHN
Cc1nn(C)cc1CC(=O)Nc1cc(CN(C)C)ccc1C	ZINC000450107109	405743162	/nfs/dbraw/zinc/74/31/62/405743162.db2.gz	VXQKRWGAFUTULG-UHFFFAOYSA-N	0	3	300.406	2.280	10	0		DEAEHN
COc1ccc([C@](C)(O)[C@H]2CCCN2Cc2cncn2C)cc1	ZINC000583615576	405775216	/nfs/dbraw/zinc/77/52/16/405775216.db2.gz	MGQURCSLMMMTBD-MSOLQXFVSA-N	0	3	315.417	2.301	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N(CCN(C)C)C(C)C)c1	ZINC000457661045	405940457	/nfs/dbraw/zinc/94/04/57/405940457.db2.gz	MGIVOCWIKNLQPL-UHFFFAOYSA-N	0	3	306.406	2.194	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCC([C@@H](O)C(F)(F)F)CC1	ZINC000532533255	406083586	/nfs/dbraw/zinc/08/35/86/406083586.db2.gz	RPEQGJCPFDOXDL-CHWSQXEVSA-N	0	3	322.371	2.023	10	0		DEAEHN
COc1ccc(OC)c(CNC[C@@H](CO)Cc2ccco2)c1	ZINC000532675240	406092872	/nfs/dbraw/zinc/09/28/72/406092872.db2.gz	CFTYVMCJLJFIPQ-ZDUSSCGKSA-N	0	3	305.374	2.238	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)Nc2cccc3c2OCCC3)C1	ZINC000532133480	406049584	/nfs/dbraw/zinc/04/95/84/406049584.db2.gz	WNBNAGXKMSZLDH-ZDUSSCGKSA-N	0	3	303.406	2.475	10	0		DEAEHN
c1nc2n(n1)[C@@H](CN1CCC[C@@H]1c1ccc3c(c1)OCO3)CC2	ZINC000639474000	406105559	/nfs/dbraw/zinc/10/55/59/406105559.db2.gz	QVKILVXEUOGHGC-ZIAGYGMSSA-N	0	3	312.373	2.331	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N[C@@H](COC)Cc1ccccc1	ZINC000471696714	406110161	/nfs/dbraw/zinc/11/01/61/406110161.db2.gz	JJLYFOCVPICICW-SJORKVTESA-N	0	3	304.434	2.235	10	0		DEAEHN
O=C(CN1C[C@@H]2CCCC[C@H]2C1)NC[C@@H]1Cc2ccccc2O1	ZINC000476589712	406150582	/nfs/dbraw/zinc/15/05/82/406150582.db2.gz	WDLNTTAHXNHHGI-ULQDDVLXSA-N	0	3	314.429	2.228	10	0		DEAEHN
C[C@@H]1CCCN(CCNCc2c(Br)cnn2C)C1	ZINC000486972441	406195290	/nfs/dbraw/zinc/19/52/90/406195290.db2.gz	PMRAFNUSKFTMEN-LLVKDONJSA-N	0	3	315.259	2.004	10	0		DEAEHN
O=C(Cc1ccc(F)cc1Cl)NCCNc1ccncc1	ZINC000487238257	406219055	/nfs/dbraw/zinc/21/90/55/406219055.db2.gz	HCXNRMXUFJXRHH-UHFFFAOYSA-N	0	3	307.756	2.067	10	0		DEAEHN
CC[C@H](C[C@@H](C)CO)NCc1c(Br)cnn1C	ZINC000487302732	406222313	/nfs/dbraw/zinc/22/23/13/406222313.db2.gz	RFJQCTQAPDGNFK-NXEZZACHSA-N	0	3	304.232	2.069	10	0		DEAEHN
COC(C)(C)C[C@H](C)NCc1c(Br)cnn1C	ZINC000487311854	406222593	/nfs/dbraw/zinc/22/25/93/406222593.db2.gz	QKAMPZNKXZNSME-VIFPVBQESA-N	0	3	304.232	2.476	10	0		DEAEHN
CC(C)[C@H]1CCCCN1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638001149	406517773	/nfs/dbraw/zinc/51/77/73/406517773.db2.gz	OXSKPSRMIGVPCT-ZWKOTPCHSA-N	0	3	317.477	2.483	10	0		DEAEHN
CC[C@@H]1CC[C@@H](C)N1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638313474	406692725	/nfs/dbraw/zinc/69/27/25/406692725.db2.gz	XAMDBVYSNYQFMP-DJIMGWMZSA-N	0	3	303.450	2.235	10	0		DEAEHN
Brc1ccc(-n2cc(CNCC3COC3)cn2)cc1	ZINC000527817464	406762555	/nfs/dbraw/zinc/76/25/55/406762555.db2.gz	MSLUDZGCTWJTMP-UHFFFAOYSA-N	0	3	322.206	2.371	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NC(C)(C1CC1)C1CC1	ZINC000638423668	406765020	/nfs/dbraw/zinc/76/50/20/406765020.db2.gz	CJTNTOOGYFOLKK-KRWDZBQOSA-N	0	3	315.461	2.141	10	0		DEAEHN
COc1nsc(CNC[C@@H]2CCOC2)c1Br	ZINC000638360855	406724787	/nfs/dbraw/zinc/72/47/87/406724787.db2.gz	JGRAYARHOMOOAB-ZETCQYMHSA-N	0	3	307.213	2.040	10	0		DEAEHN
C[C@H](N)c1cc(Br)ccc1N1CCn2cnnc2C1	ZINC000128929801	196004752	/nfs/dbraw/zinc/00/47/52/196004752.db2.gz	NEAZWJXTFXDWHH-VIFPVBQESA-N	0	3	322.210	2.081	10	0		DEAEHN
CSc1nc(Cl)cc(NC[C@H]2CN3CCC[C@@H]3CO2)n1	ZINC000129524510	196055137	/nfs/dbraw/zinc/05/51/37/196055137.db2.gz	WDHUYEOJSCDXCH-ZJUUUORDSA-N	0	3	314.842	2.127	10	0		DEAEHN
Cc1cscc1[C@@H](NN)c1c(Cl)cnn1CCN(C)C	ZINC000129556210	196056810	/nfs/dbraw/zinc/05/68/10/196056810.db2.gz	JZKRHARHEYXBFZ-GFCCVEGCSA-N	0	3	313.858	2.021	10	0		DEAEHN
CC(C)(C(=O)N1CCC[C@H]1c1cccs1)N1CCNCC1	ZINC000129645324	196064799	/nfs/dbraw/zinc/06/47/99/196064799.db2.gz	JGKVVHMTJYDADK-ZDUSSCGKSA-N	0	3	307.463	2.095	10	0		DEAEHN
C[C@@H](CN1C(=O)C2(CC2)N[C@@H]1c1cccs1)N1CCCC1	ZINC000130797466	196111101	/nfs/dbraw/zinc/11/11/01/196111101.db2.gz	NLPYNHQJTCLXPL-JSGCOSHPSA-N	0	3	305.447	2.195	10	0		DEAEHN
CCCN[C@H](C)c1c(CC)nn(CCS(C)(=O)=O)c1CC	ZINC000131173554	196147053	/nfs/dbraw/zinc/14/70/53/196147053.db2.gz	OTXBLSJPAKDUSS-GFCCVEGCSA-N	0	3	315.483	2.113	10	0		DEAEHN
CN[C@H](C)c1cccc(S(=O)(=O)N[C@H](C)CCSC)c1	ZINC000131238334	196152027	/nfs/dbraw/zinc/15/20/27/196152027.db2.gz	VLUHEMLVCHHFLY-VXGBXAGGSA-N	0	3	316.492	2.387	10	0		DEAEHN
CNC(=O)NC(=O)[C@H](C)N[C@@H](C)c1ccc(OCC(C)C)cc1	ZINC000131391950	196164154	/nfs/dbraw/zinc/16/41/54/196164154.db2.gz	WNEOMPVQZGRQNB-STQMWFEESA-N	0	3	321.421	2.216	10	0		DEAEHN
COc1ccc([O-])c(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c1	ZINC000131858869	196204360	/nfs/dbraw/zinc/20/43/60/196204360.db2.gz	SGYWWFAXAAIQFQ-YHWZYXNKSA-N	0	3	304.390	2.146	10	0		DEAEHN
COc1ccc([O-])c(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1	ZINC000131858869	196204363	/nfs/dbraw/zinc/20/43/63/196204363.db2.gz	SGYWWFAXAAIQFQ-YHWZYXNKSA-N	0	3	304.390	2.146	10	0		DEAEHN
Cc1cc(Br)c(-n2cc(CN)nn2)cc1Cl	ZINC000131934938	196211638	/nfs/dbraw/zinc/21/16/38/196211638.db2.gz	WSRRSUDFOJZEPT-UHFFFAOYSA-N	0	3	301.575	2.450	10	0		DEAEHN
C[C@@H]1CNC[C@H](COCc2ccc(F)c(Br)c2)O1	ZINC000132448221	196257186	/nfs/dbraw/zinc/25/71/86/196257186.db2.gz	CHWNLSVEDMSCJH-MWLCHTKSSA-N	0	3	318.186	2.482	10	0		DEAEHN
C[C@@H]1CNC[C@@H](COCc2cc(F)cc(Br)c2)O1	ZINC000132629829	196272699	/nfs/dbraw/zinc/27/26/99/196272699.db2.gz	VXSWGZZTVHCZNO-RNCFNFMXSA-N	0	3	318.186	2.482	10	0		DEAEHN
COCc1cc([C@@H](C)N[C@@H]2CCC(=O)N(C)C2)ccc1OC	ZINC000133006340	196304320	/nfs/dbraw/zinc/30/43/20/196304320.db2.gz	BHMYRYKSUQLSKQ-IUODEOHRSA-N	0	3	306.406	2.113	10	0		DEAEHN
CC[C@@H](C)c1nc(N(C)CCOC)sc1CNCCOC	ZINC000133138285	196314846	/nfs/dbraw/zinc/31/48/46/196314846.db2.gz	KBNCKEZAVRHAGR-GFCCVEGCSA-N	0	3	315.483	2.475	10	0		DEAEHN
CC[C@@H](CSC)NS(=O)(=O)c1cccc([C@@H](C)NC)c1	ZINC000133237547	196323677	/nfs/dbraw/zinc/32/36/77/196323677.db2.gz	RPFJBBXTCRJYIU-YPMHNXCESA-N	0	3	316.492	2.387	10	0		DEAEHN
NCc1ccccc1CC(=O)N1CCC[C@@H](C(F)(F)F)C1	ZINC000133245454	196324554	/nfs/dbraw/zinc/32/45/54/196324554.db2.gz	QJXLNMXPLQQNGR-CYBMUJFWSA-N	0	3	300.324	2.489	10	0		DEAEHN
C[S@](=O)CCN[C@@H]1CCc2cc(Br)ccc21	ZINC000133789048	196335282	/nfs/dbraw/zinc/33/52/82/196335282.db2.gz	FZNLYBSYMCUOGT-MLGOLLRUSA-N	0	3	302.237	2.405	10	0		DEAEHN
CCO[C@H](C)CN[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1	ZINC000135758412	196502920	/nfs/dbraw/zinc/50/29/20/196502920.db2.gz	FQJZLXFGYDDEPV-OLZOCXBDSA-N	0	3	314.451	2.013	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1NC(=O)NC(=O)CN1CCCC12CCC2	ZINC000444787712	287293953	/nfs/dbraw/zinc/29/39/53/287293953.db2.gz	YOFUTTBWGWBWLQ-KGLIPLIRSA-N	0	3	307.438	2.409	10	0		DEAEHN
CN(C)CCN(C(=O)NC[C@@H]1CCC(C)(C)O1)C1CCCC1	ZINC000188225231	225014864	/nfs/dbraw/zinc/01/48/64/225014864.db2.gz	ZARMQIQANWTFPD-HNNXBMFYSA-N	0	3	311.470	2.460	10	0		DEAEHN
CCc1oc2ccccc2c1CN1CCN(CCO)[C@H](C)C1	ZINC000190250983	225080343	/nfs/dbraw/zinc/08/03/43/225080343.db2.gz	ULAPTOPPOYRFOK-CQSZACIVSA-N	0	3	302.418	2.494	10	0		DEAEHN
Cn1nccc1CNCCN1CCc2c(Cl)cccc2C1	ZINC000191107281	225104387	/nfs/dbraw/zinc/10/43/87/225104387.db2.gz	PFSAWVPBXZHUKK-UHFFFAOYSA-N	0	3	304.825	2.221	10	0		DEAEHN
Cc1noc(CCCN2CC[C@H](n3cnc4c3CCCC4)C2)n1	ZINC000299753881	229398085	/nfs/dbraw/zinc/39/80/85/229398085.db2.gz	ZQPKDDKSWGWRML-AWEZNQCLSA-N	0	3	315.421	2.333	10	0		DEAEHN
Fc1ccccc1OCCN1CCC[C@@H](Cn2cncn2)C1	ZINC000105882901	424849446	/nfs/dbraw/zinc/84/94/46/424849446.db2.gz	VUEDXJOHMMXTMP-CQSZACIVSA-N	0	3	304.369	2.208	10	0		DEAEHN
CCN1CCC[C@@H](Nc2cc(C(F)(F)F)nc3ncnn32)C1	ZINC000193717231	424870311	/nfs/dbraw/zinc/87/03/11/424870311.db2.gz	ZERAJQBGQAEGCW-SECBINFHSA-N	0	3	314.315	2.039	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)N2CCN(C3CC3)CC2)c1	ZINC000195260406	424881216	/nfs/dbraw/zinc/88/12/16/424881216.db2.gz	HMUFCLPXGPHUJN-UHFFFAOYSA-N	0	3	302.422	2.060	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1n[nH]c2c1CCCC2)c1ccccc1	ZINC000126741680	424856119	/nfs/dbraw/zinc/85/61/19/424856119.db2.gz	LWIZGNQSWPUYJK-INIZCTEOSA-N	0	3	312.417	2.321	10	0		DEAEHN
CN(C(=O)c1ncccc1N)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000388656893	424914755	/nfs/dbraw/zinc/91/47/55/424914755.db2.gz	SIZSBIPTKJQJBU-MRXNPFEDSA-N	0	3	324.428	2.400	10	0		DEAEHN
NC1(C(=O)NCc2ccc(Cl)c(Cl)c2)CCOCC1	ZINC000659358787	425583865	/nfs/dbraw/zinc/58/38/65/425583865.db2.gz	LHZFLRGNWFLFCB-UHFFFAOYSA-N	0	3	303.189	2.118	10	0		DEAEHN
COC(=O)CC1(CC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)CCCC1	ZINC000189322073	267690725	/nfs/dbraw/zinc/69/07/25/267690725.db2.gz	JZIGBIXYTMIYRR-CABCVRRESA-N	0	3	324.465	2.441	10	0		DEAEHN
CN(C(=O)[C@@H]1Cc2ccccc2S1)[C@H](CN)C(F)(F)F	ZINC000662979242	425770079	/nfs/dbraw/zinc/77/00/79/425770079.db2.gz	UUBXHFWZWKBDED-WDEREUQCSA-N	0	3	304.337	2.051	10	0		DEAEHN
CN(C(=O)COc1cccc(Cl)c1)[C@H](CN)C(F)(F)F	ZINC000662979135	425770609	/nfs/dbraw/zinc/77/06/09/425770609.db2.gz	SUUVZHXAOLMNPS-SNVBAGLBSA-N	0	3	310.703	2.067	10	0		DEAEHN
CN(C(=O)c1occc1Br)[C@H](CN)C(F)(F)F	ZINC000662982637	425771241	/nfs/dbraw/zinc/77/12/41/425771241.db2.gz	JHNULZMPBSKLCG-ZCFIWIBFSA-N	0	3	315.089	2.004	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Cc2cnn(-c3ccccc3)c2)C1	ZINC000194648570	268554072	/nfs/dbraw/zinc/55/40/72/268554072.db2.gz	MKYHOXDIEZDRCW-MRXNPFEDSA-N	0	3	312.417	2.015	10	0		DEAEHN
C[C@]1(F)CNCCN(c2cncc(OC3CCCCC3)n2)C1	ZINC000333918907	269004430	/nfs/dbraw/zinc/00/44/30/269004430.db2.gz	ONBYOYQUHXFECD-INIZCTEOSA-N	0	3	308.401	2.326	10	0		DEAEHN
O=C(NCC1(O)CCN(Cc2ccccc2)CC1)C1CC=CC1	ZINC000397574107	269106796	/nfs/dbraw/zinc/10/67/96/269106796.db2.gz	BEWWYTVDYBVSOL-UHFFFAOYSA-N	0	3	314.429	2.096	10	0		DEAEHN
CN1CCCN(C[C@@H](O)Cc2ccccc2C(F)(F)F)CC1	ZINC000443474390	269138115	/nfs/dbraw/zinc/13/81/15/269138115.db2.gz	HYHHWHYHWBYWEK-AWEZNQCLSA-N	0	3	316.367	2.246	10	0		DEAEHN
CO[C@@H](C)[C@@H](C)N[C@@H](C)c1cc(S(N)(=O)=O)c(C)cc1C	ZINC000514895394	269335990	/nfs/dbraw/zinc/33/59/90/269335990.db2.gz	XDJYOMPTPWKHLK-AGIUHOORSA-N	0	3	314.451	2.025	10	0		DEAEHN
CN(C)C(=O)COc1ccccc1CNCCOCC1CCC1	ZINC000515191835	269346443	/nfs/dbraw/zinc/34/64/43/269346443.db2.gz	WRPCUXMWGSILPK-UHFFFAOYSA-N	0	3	320.433	2.060	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@@H]2CN1C(=O)C[C@H](N)c1ccccc1	ZINC000262041473	274372436	/nfs/dbraw/zinc/37/24/36/274372436.db2.gz	BYHLWYRMMOBOMR-OIISXLGYSA-N	0	3	301.434	2.162	10	0		DEAEHN
Cn1ccnc1[C@H](NCCCNC(=O)c1cccs1)C1CC1	ZINC000183325594	274898009	/nfs/dbraw/zinc/89/80/09/274898009.db2.gz	NISVWNAZXDZJAS-CQSZACIVSA-N	0	3	318.446	2.342	10	0		DEAEHN
O=C([C@@H]1CCCc2c(O)cccc21)N1CCN2CCC[C@@H]2C1	ZINC000190312507	275004871	/nfs/dbraw/zinc/00/48/71/275004871.db2.gz	SJKAXFHAMCVHLW-CZUORRHYSA-N	0	3	300.402	2.119	10	0		DEAEHN
CCOC[C@@H]1CCN(CC(=O)N2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000246132082	276331585	/nfs/dbraw/zinc/33/15/85/276331585.db2.gz	FIPLUHWCNWXFBB-CHWSQXEVSA-N	0	3	322.371	2.146	10	0		DEAEHN
CC[C@H](NC[C@@H]1CCC2(CCOCC2)[C@@H]1O)c1nccn1C	ZINC000374791862	276585238	/nfs/dbraw/zinc/58/52/38/276585238.db2.gz	HZQCWLPTZLIJSX-SOUVJXGZSA-N	0	3	307.438	2.029	10	0		DEAEHN
CC(C)C(=O)N1CCC(NC(=O)[C@H](C)N2[C@H](C)CC[C@@H]2C)CC1	ZINC000195527021	277328066	/nfs/dbraw/zinc/32/80/66/277328066.db2.gz	RXWXCNNJTIAULX-ZNMIVQPWSA-N	0	3	323.481	2.011	10	0		DEAEHN
CO[C@@H]1COC[C@H]1n1cc(CN[C@H]2CCC(C)(C)C[C@@H]2C)nn1	ZINC000329545248	277672644	/nfs/dbraw/zinc/67/26/44/277672644.db2.gz	ZHAUQEALZOAGBA-ARLBYUKCSA-N	0	3	322.453	2.169	10	0		DEAEHN
CC(C)[C@H](C(=O)N1CCO[C@H](CN(C)C)C1)c1ccccc1	ZINC000173522170	277862838	/nfs/dbraw/zinc/86/28/38/277862838.db2.gz	YLJWCLAGVLEHFV-SJORKVTESA-N	0	3	304.434	2.215	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)N[C@H]2CCCC(F)(F)C2)CN1C1CC1	ZINC000495063359	278021985	/nfs/dbraw/zinc/02/19/85/278021985.db2.gz	WVYBTVNWOSQGBP-WOPDTQHZSA-N	0	3	301.381	2.489	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@@H]2CCCOC2)c2ccc(F)cc2C1	ZINC000184510639	278056824	/nfs/dbraw/zinc/05/68/24/278056824.db2.gz	VKDLVBYQVINCRL-WBVHZDCISA-N	0	3	306.381	2.388	10	0		DEAEHN
C[C@@H]1Cc2ccccc2CN1C[C@@H]1CCCN(S(C)(=O)=O)C1	ZINC000176348814	279016888	/nfs/dbraw/zinc/01/68/88/279016888.db2.gz	DFILTZIHZIUNKD-CABCVRRESA-N	0	3	322.474	2.105	10	0		DEAEHN
C[C@H](C(=O)N1C[C@@H]2CCCCN2C[C@H]1C)[C@@H](N)c1ccccc1	ZINC000261737740	279209527	/nfs/dbraw/zinc/20/95/27/279209527.db2.gz	NQEHMCIDXFYYSS-MXSMSXNCSA-N	0	3	315.461	2.408	10	0		DEAEHN
C[C@H](C(=O)N1c2ccccc2C[C@@H]1C)N1CCN2CCC[C@H]2C1	ZINC000246591410	279214495	/nfs/dbraw/zinc/21/44/95/279214495.db2.gz	SYNKJSKGNXGTAR-UXLLHSPISA-N	0	3	313.445	2.133	10	0		DEAEHN
CCOC[C@H](NC(=O)N[C@@H](CC(C)C)CN(C)C)C(C)C	ZINC000190125178	279742399	/nfs/dbraw/zinc/74/23/99/279742399.db2.gz	ZNXRTEODROWGAC-GJZGRUSLSA-N	0	3	301.475	2.323	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@@H](Cc2ccccc2)C(=O)N(C)C)C1(C)C	ZINC000181729159	279874668	/nfs/dbraw/zinc/87/46/68/279874668.db2.gz	KGQIVZPRWKCPIR-YESZJQIVSA-N	0	3	318.461	2.479	10	0		DEAEHN
CCCn1nc(C)c(C(=O)N(C)C[C@@H]2CCCN2CC)c1C	ZINC000133505041	282017885	/nfs/dbraw/zinc/01/78/85/282017885.db2.gz	GVBBKOHZSBIMMP-HNNXBMFYSA-N	0	3	306.454	2.466	10	0		DEAEHN
CN(C)C(=O)Cc1ccc(NC(=O)[C@H]2NCCCC2(C)C)cc1	ZINC000261959559	288971836	/nfs/dbraw/zinc/97/18/36/288971836.db2.gz	XMJDLYLPYFSNFL-MRXNPFEDSA-N	0	3	317.433	2.034	10	0		DEAEHN
C[C@@H](N[C@@H]1CCC(=O)N(C)C1)c1ccc(Br)cn1	ZINC000576522202	326299915	/nfs/dbraw/zinc/29/99/15/326299915.db2.gz	ZJINVSOUQMDPLA-MWLCHTKSSA-N	0	3	312.211	2.116	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)N3CC[C@H](N4CCCC4)C3)cc2c1	ZINC000189229242	333066602	/nfs/dbraw/zinc/06/66/02/333066602.db2.gz	BPCZANFAYMEPPI-AWEZNQCLSA-N	0	3	313.401	2.487	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@@H](NCc2ccc(-c3cc[nH]n3)o2)C1	ZINC000577816114	341939044	/nfs/dbraw/zinc/93/90/44/341939044.db2.gz	GAGWYPYHKLHPKA-DGCLKSJQSA-N	0	3	323.418	2.115	10	0		DEAEHN
COc1ccc(O)cc1C(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000188942773	534211603	/nfs/dbraw/zinc/21/16/03/534211603.db2.gz	GHKPKUHLMFPZFV-ZDUSSCGKSA-N	0	3	306.406	2.251	10	0		DEAEHN
COC(=O)c1ccc(NCCN2CCC[C@@H](C)C2)nc1OC	ZINC000302326136	534223922	/nfs/dbraw/zinc/22/39/22/534223922.db2.gz	SLMCKNCIIKNQRU-GFCCVEGCSA-N	0	3	307.394	2.021	10	0		DEAEHN
Cc1noc(C)c1CCN(C)C1CCN(c2cccnn2)CC1	ZINC000328607891	534339356	/nfs/dbraw/zinc/33/93/56/534339356.db2.gz	LPBPEQNKDWMBSD-UHFFFAOYSA-N	0	3	315.421	2.225	10	0		DEAEHN
CCOc1ncccc1NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000246750786	521623061	/nfs/dbraw/zinc/62/30/61/521623061.db2.gz	BSEHYMNDTZAWBN-STQMWFEESA-N	0	3	306.410	2.427	10	0		DEAEHN
CCCN(C[C@@H]1CCCCO1)C(=O)NC[C@@H](C)N(C)C1CC1	ZINC000106561027	521675682	/nfs/dbraw/zinc/67/56/82/521675682.db2.gz	RGJUMGSZRCCJPZ-ZBFHGGJFSA-N	0	3	311.470	2.460	10	0		DEAEHN
CCCN(C[C@H]1CCCCO1)C(=O)NC[C@H](C)N(C)C1CC1	ZINC000106561033	521676896	/nfs/dbraw/zinc/67/68/96/521676896.db2.gz	RGJUMGSZRCCJPZ-GOEBONIOSA-N	0	3	311.470	2.460	10	0		DEAEHN
CC[N@@H+]1CC[C@@H](N(C)C(=O)c2ccc(OC)cc2[O-])[C@@H](C)C1	ZINC000247518604	521712666	/nfs/dbraw/zinc/71/26/66/521712666.db2.gz	WGMGSDFVNYETTN-SWLSCSKDSA-N	0	3	306.406	2.203	10	0		DEAEHN
CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(OC)cc2[O-])[C@@H](C)C1	ZINC000247518604	521712667	/nfs/dbraw/zinc/71/26/67/521712667.db2.gz	WGMGSDFVNYETTN-SWLSCSKDSA-N	0	3	306.406	2.203	10	0		DEAEHN
CN(C)CCN(Cc1ccco1)C(=O)c1cnn2c1CCCC2	ZINC000127499953	521752971	/nfs/dbraw/zinc/75/29/71/521752971.db2.gz	HIIPLLZJMHXZPQ-UHFFFAOYSA-N	0	3	316.405	2.016	10	0		DEAEHN
CN1CC[C@H](NC(=O)[C@@H]2CCn3ccnc3C2)[C@H]1c1ccccc1	ZINC000247914435	523985484	/nfs/dbraw/zinc/98/54/84/523985484.db2.gz	AUVAELWREBMFRB-SOLBZPMBSA-N	0	3	324.428	2.007	10	0		DEAEHN
COc1ccccc1CCN(C)C(=O)NC[C@@H](C)N(C)C1CC1	ZINC000105263142	524406947	/nfs/dbraw/zinc/40/69/47/524406947.db2.gz	FCWFEUVJASEFMG-CQSZACIVSA-N	0	3	319.449	2.362	10	0		DEAEHN
Cc1ccc([C@H](O)CNC(=O)[C@H](C)[C@@H](N)c2ccccc2)cc1	ZINC000246280631	525976052	/nfs/dbraw/zinc/97/60/52/525976052.db2.gz	MNHRBBIPCWBQSR-ZTFGCOKTSA-N	0	3	312.413	2.481	10	0		DEAEHN
Cc1nc(CN(C)C(=O)[C@H]2CCCCN2C2CCCC2)no1	ZINC000365981527	526836315	/nfs/dbraw/zinc/83/63/15/526836315.db2.gz	URGJKEODYXJIDS-CQSZACIVSA-N	0	3	306.410	2.134	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1[O-]	ZINC000331336364	527235579	/nfs/dbraw/zinc/23/55/79/527235579.db2.gz	IWXUBFUNSOUDGU-FZMZJTMJSA-N	0	3	304.390	2.150	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[O-]	ZINC000331336364	527235585	/nfs/dbraw/zinc/23/55/85/527235585.db2.gz	IWXUBFUNSOUDGU-FZMZJTMJSA-N	0	3	304.390	2.150	10	0		DEAEHN
CCCCOC[C@H](O)CN[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000195215087	528626433	/nfs/dbraw/zinc/62/64/33/528626433.db2.gz	CDMJTCKSAIBZIU-RHSMWYFYSA-N	0	3	318.421	2.096	10	0		DEAEHN
CCOC(=O)CN(C(=O)C1CCN(C2CC2)CC1)C(C)(C)C	ZINC000193832089	528766408	/nfs/dbraw/zinc/76/64/08/528766408.db2.gz	YAFTYRBWRXKVQU-UHFFFAOYSA-N	0	3	310.438	2.051	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)N[C@@H](C)c1ccncc1OC	ZINC000189852197	528998909	/nfs/dbraw/zinc/99/89/09/528998909.db2.gz	NRDVTDWZCYHWEL-UONOGXRCSA-N	0	3	320.437	2.325	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)NCCc1ccc(F)cc1	ZINC000261649025	535042135	/nfs/dbraw/zinc/04/21/35/535042135.db2.gz	FNNXFSCOIRRICK-HDMKZQKVSA-N	0	3	320.408	2.017	10	0		DEAEHN
CC(C)[C@H](NC(=O)CC1CCN(C)CC1)c1nc(C2CC2)no1	ZINC000362718552	535077040	/nfs/dbraw/zinc/07/70/40/535077040.db2.gz	YUVCONZDYWHICF-HNNXBMFYSA-N	0	3	320.437	2.492	10	0		DEAEHN
CCOc1ccccc1OCC(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000247455122	535539333	/nfs/dbraw/zinc/53/93/33/535539333.db2.gz	TVJMXHHEWHKMLF-CABCVRRESA-N	0	3	320.433	2.309	10	0		DEAEHN
CCOCCN1CCN(CCC(=O)Nc2ccccc2)C[C@H]1C	ZINC000247075846	535604014	/nfs/dbraw/zinc/60/40/14/535604014.db2.gz	GSGRYRBLDBONEJ-MRXNPFEDSA-N	0	3	319.449	2.058	10	0		DEAEHN
CCn1nccc1CN1CCNC[C@@H]1c1ccccc1OC	ZINC000261831284	535869914	/nfs/dbraw/zinc/86/99/14/535869914.db2.gz	YVDHDFUJBUOXFD-MRXNPFEDSA-N	0	3	300.406	2.058	10	0		DEAEHN
CN(C)CCn1nccc1NC(=O)Cc1ccc(Cl)c(F)c1	ZINC000359494748	535937030	/nfs/dbraw/zinc/93/70/30/535937030.db2.gz	GSJRBEYMERIFIO-UHFFFAOYSA-N	0	3	324.787	2.418	10	0		DEAEHN
CN(C)C[C@H](NC(=O)N[C@H]1CCO[C@H]1C1CC1)c1ccccc1	ZINC000332751832	535951808	/nfs/dbraw/zinc/95/18/08/535951808.db2.gz	BTVRXJIHERMIAV-ULQDDVLXSA-N	0	3	317.433	2.156	10	0		DEAEHN
CN(C)CC1CCN(C(=O)C(=O)c2ccc3c(c2)CCC3)CC1	ZINC000358017750	536116469	/nfs/dbraw/zinc/11/64/69/536116469.db2.gz	WBVPLGVDSBNVNJ-UHFFFAOYSA-N	0	3	314.429	2.158	10	0		DEAEHN
CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)[C@H](N)CCSC	ZINC000262533164	536665468	/nfs/dbraw/zinc/66/54/68/536665468.db2.gz	IZEMRRYVZWDNCW-GDLCADMTSA-N	0	3	314.426	2.098	10	0		DEAEHN
CO[C@H]1CCCN(C[C@@H](O)COCc2ccc(Cl)cc2)C1	ZINC000246130625	536709011	/nfs/dbraw/zinc/70/90/11/536709011.db2.gz	OYTCTJBNMZSICU-CVEARBPZSA-N	0	3	313.825	2.328	10	0		DEAEHN
COc1ccc2c(c1NC(=O)N1CC[C@H](N(C)C)C1)CCC2	ZINC000191354498	537023399	/nfs/dbraw/zinc/02/33/99/537023399.db2.gz	LDFWELZJXUBWSW-ZDUSSCGKSA-N	0	3	303.406	2.352	10	0		DEAEHN
Cc1nc(N)sc1C(=O)N[C@H](C)CN(C)Cc1ccccc1	ZINC000309694053	625314448	/nfs/dbraw/zinc/31/44/48/625314448.db2.gz	DRAQEDDHVMJNPT-LLVKDONJSA-N	0	3	318.446	2.284	10	0		DEAEHN
C[C@H](NCc1ccc(S(=O)(=O)N(C)C)o1)C1CCCC1	ZINC000088540827	624033946	/nfs/dbraw/zinc/03/39/46/624033946.db2.gz	VFSVQMSGCUWFJX-NSHDSACASA-N	0	3	300.424	2.198	10	0		DEAEHN
COCC[C@H](N)C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000052792491	625103658	/nfs/dbraw/zinc/10/36/58/625103658.db2.gz	NYTNZRUVJSKOOH-CABZTGNLSA-N	0	3	304.312	2.246	10	0		DEAEHN
Fc1cc(Br)cc(OC[C@H]2CNCCO2)c1F	ZINC000219987917	636842700	/nfs/dbraw/zinc/84/27/00/636842700.db2.gz	ZDYMXFHAWBGQLG-MRVPVSSYSA-N	0	3	308.122	2.095	10	0		DEAEHN
COc1cc(C[NH2+][C@H](C)[C@H](C)O)cc(Br)c1[O-]	ZINC000342244801	639500618	/nfs/dbraw/zinc/50/06/18/639500618.db2.gz	YOMMXKSKSHHBHJ-SFYZADRCSA-N	0	3	304.184	2.022	10	0		DEAEHN
Cn1nccc1CCOC(=O)c1cccc(CN2CCCC2)c1	ZINC000805897406	643750735	/nfs/dbraw/zinc/75/07/35/643750735.db2.gz	SGQXNDLTNRXFAB-UHFFFAOYSA-N	0	3	313.401	2.415	10	0		DEAEHN
C[C@H]1[C@@H](OC(=O)c2cccc(CN3CCCC3)c2)CC(=O)N1C	ZINC000806080594	644650740	/nfs/dbraw/zinc/65/07/40/644650740.db2.gz	HSVIYJIRHROJBL-BBRMVZONSA-N	0	3	316.401	2.058	10	0		DEAEHN
CN(C)[C@@H](CNC(=O)Cc1ccc(F)cn1)Cc1ccccc1	ZINC000806290148	645814661	/nfs/dbraw/zinc/81/46/61/645814661.db2.gz	HZDWMBKCUZVAEK-QGZVFWFLSA-N	0	3	315.392	2.052	10	0		DEAEHN
C[C@@H](NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1nccn1C	ZINC000230412491	646729045	/nfs/dbraw/zinc/72/90/45/646729045.db2.gz	BWBFQSVZBXGIEJ-OLZOCXBDSA-N	0	3	308.426	2.328	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CSCCS1	ZINC000179707742	648410634	/nfs/dbraw/zinc/41/06/34/648410634.db2.gz	BVSIGWQQUORYDN-ZFWWWQNUSA-N	0	3	324.515	2.472	10	0		DEAEHN
Cc1ccn2c(CN3CCC[C@@H](Cn4ccnn4)C3)cnc2c1	ZINC000092070117	684040708	/nfs/dbraw/zinc/04/07/08/684040708.db2.gz	SWWKDXQXFWLXIB-OAHLLOKOSA-N	0	3	310.405	2.146	10	0		DEAEHN
CCN(C)c1ccc(CNC[C@H](O)c2ccccc2OC)cn1	ZINC000190846321	684415768	/nfs/dbraw/zinc/41/57/68/684415768.db2.gz	LNVYLFZISBNOHB-INIZCTEOSA-N	0	3	315.417	2.370	10	0		DEAEHN
COc1ccccc1[C@H](O)CNC(=O)[C@H](C)N1[C@H](C)CC[C@H]1C	ZINC000245201828	685109411	/nfs/dbraw/zinc/10/94/11/685109411.db2.gz	MZSIFYKGVWIMMJ-HGTKMLMNSA-N	0	3	320.433	2.106	10	0		DEAEHN
Cn1cc(O[C@@H]2COC[C@@H]2NCc2cccc3ccoc32)cn1	ZINC000886080321	691998573	/nfs/dbraw/zinc/99/85/73/691998573.db2.gz	WKURMXPSMMABHN-JKSUJKDBSA-N	0	3	313.357	2.102	10	0		DEAEHN
CN(C[C@@H]1CCCCO1)C[C@](C)(O)C(F)(F)C(F)(F)F	ZINC000724112554	777243564	/nfs/dbraw/zinc/24/35/64/777243564.db2.gz	ULOOJYSYNBCYPK-UWVGGRQHSA-N	0	3	305.287	2.436	10	0		DEAEHN
Cn1nccc1CN[C@@H]1CN(C(=O)OC(C)(C)C)CC1(C)C	ZINC000721850168	787324186	/nfs/dbraw/zinc/32/41/86/787324186.db2.gz	RAPRXARDVSQSQG-CYBMUJFWSA-N	0	3	308.426	2.155	10	0		DEAEHN
Brc1c[nH]c(CN[C@@H](C2CC2)[C@H]2CCCOC2)n1	ZINC000723979499	787346101	/nfs/dbraw/zinc/34/61/01/787346101.db2.gz	XWVQVRLIILSDTD-GWCFXTLKSA-N	0	3	314.227	2.467	10	0		DEAEHN
Cn1cc(CNCC[C@@H]2CCSC2)c(Br)n1	ZINC000712499442	792190248	/nfs/dbraw/zinc/19/02/48/792190248.db2.gz	YYUMZUQWUGEWSO-SECBINFHSA-N	0	3	304.257	2.415	10	0		DEAEHN
CC1(C)CCNCCN1S(=O)(=O)c1cccc(Cl)c1F	ZINC000712516474	792192250	/nfs/dbraw/zinc/19/22/50/792192250.db2.gz	ZCTYFHQEUCDASI-UHFFFAOYSA-N	0	3	320.817	2.242	10	0		DEAEHN
CS(=O)(=O)[C@H]1C[C@H](NCc2ccccc2C(F)(F)F)C1	ZINC000714252585	792306061	/nfs/dbraw/zinc/30/60/61/792306061.db2.gz	AZGSWYJUZDPWRF-XYPYZODXSA-N	0	3	307.337	2.371	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@H]1C[C@@H](CN[C@@H]2CCn3ccnc32)C1	ZINC000715068144	792379547	/nfs/dbraw/zinc/37/95/47/792379547.db2.gz	VKKUFHXXLZDKPE-FRRDWIJNSA-N	0	3	306.410	2.221	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NCCCCC1CC1	ZINC000716418448	792957025	/nfs/dbraw/zinc/95/70/25/792957025.db2.gz	YZWWIYBMFRBWBU-QGZVFWFLSA-N	0	3	303.450	2.142	10	0		DEAEHN
NC(=O)C1CC(NCc2ccc(Cl)cc2Br)C1	ZINC000716715571	793004136	/nfs/dbraw/zinc/00/41/36/793004136.db2.gz	IHQPVFLTJNTJEH-UHFFFAOYSA-N	0	3	317.614	2.456	10	0		DEAEHN
Cc1cc(CN[C@@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)n(C)n1	ZINC000401810914	801852748	/nfs/dbraw/zinc/85/27/48/801852748.db2.gz	UEYUAYUIBXVSSQ-TZMCWYRMSA-N	0	3	322.453	2.464	10	0		DEAEHN
Cn1cc(CN[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c(Br)n1	ZINC000720657865	1085818600	/nfs/dbraw/zinc/81/86/00/1085818600.db2.gz	VMRXBLNYRQGENH-MXWKQRLJSA-N	0	3	314.227	2.086	10	0		DEAEHN
CN1CCC[C@H]2[C@H]1CCN2C(=O)c1cncc(Br)c1	ZINC000720819102	1086168970	/nfs/dbraw/zinc/16/89/70/1086168970.db2.gz	YHHUWJOIPWKRBH-OLZOCXBDSA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@@H](NCc1cnc2n1CCC2)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000719117143	1088842340	/nfs/dbraw/zinc/84/23/40/1088842340.db2.gz	QKLAKAUMWAYCHG-VXGBXAGGSA-N	0	3	308.426	2.221	10	0		DEAEHN
Cc1oc(Br)cc1C(=O)N[C@H]1CCN(C)[C@H]1C	ZINC000719391791	1089081685	/nfs/dbraw/zinc/08/16/85/1089081685.db2.gz	BQFBEWBPHUFDQS-XVKPBYJWSA-N	0	3	301.184	2.173	10	0		DEAEHN
Cc1coc(CNCCN2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000718053115	1091414256	/nfs/dbraw/zinc/41/42/56/1091414256.db2.gz	NXNDZKCNPNJBMM-UHFFFAOYSA-N	0	3	323.437	2.230	10	0		DEAEHN
Cc1noc(C)c1CNC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000148229444	282103647	/nfs/dbraw/zinc/10/36/47/282103647.db2.gz	TVISKIZFGRYKNU-INIZCTEOSA-N	0	3	316.405	2.394	10	0		DEAEHN
CCN[C@@H](CSCC(=O)OC)c1cc(OC)ccc1OC	ZINC000081793944	192324887	/nfs/dbraw/zinc/32/48/87/192324887.db2.gz	GJTPMZIVUBLHCU-ZDUSSCGKSA-N	0	3	313.419	2.261	10	0		DEAEHN
CCN[C@H](c1ccc(OC)cc1)[C@@H](C)Sc1nnnn1C	ZINC000081843724	192329926	/nfs/dbraw/zinc/32/99/26/192329926.db2.gz	NSSTYHNPVLNVFN-MFKMUULPSA-N	0	3	307.423	2.050	10	0		DEAEHN
CN(C)CCN(C[C@H]1CCCO1)C(=O)NCCC1=CCCC1	ZINC000152070443	282134347	/nfs/dbraw/zinc/13/43/47/282134347.db2.gz	DTLXFDLOFSIWJI-MRXNPFEDSA-N	0	3	309.454	2.239	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@H](C)Oc1cccc(CO)c1	ZINC000152912144	282157368	/nfs/dbraw/zinc/15/73/68/282157368.db2.gz	JRIGINWMMVBJQW-GOEBONIOSA-N	0	3	322.449	2.039	10	0		DEAEHN
COCCNCc1cc(Cl)ccc1SCC(=O)OC	ZINC000165221404	197671940	/nfs/dbraw/zinc/67/19/40/197671940.db2.gz	OWLQWBUXWDXBRD-UHFFFAOYSA-N	0	3	303.811	2.341	10	0		DEAEHN
C[C@H](CNC(=O)N1CCC[C@H](C(F)(F)F)C1)N(C)C1CC1	ZINC000171696887	282181307	/nfs/dbraw/zinc/18/13/07/282181307.db2.gz	YNPUFKWUQYKNFF-MNOVXSKESA-N	0	3	307.360	2.453	10	0		DEAEHN
CN(C)CCSc1nc(Br)cn2ccnc12	ZINC000087416986	185224314	/nfs/dbraw/zinc/22/43/14/185224314.db2.gz	FLGMCAXBYWDELT-UHFFFAOYSA-N	0	3	301.213	2.146	10	0		DEAEHN
CCN[C@H]1CCN(Cc2sccc2Br)C1=O	ZINC000087575884	185228588	/nfs/dbraw/zinc/22/85/88/185228588.db2.gz	NFSMFDKZRWXPDC-VIFPVBQESA-N	0	3	303.225	2.221	10	0		DEAEHN
OCCN1CCCN(Cc2cc(Cl)ccc2Cl)CC1	ZINC000087765530	185231384	/nfs/dbraw/zinc/23/13/84/185231384.db2.gz	ASHYUEDMWVTDHJ-UHFFFAOYSA-N	0	3	303.233	2.493	10	0		DEAEHN
COc1ccc([C@H](CN)NC[C@H]2CCCO2)c(Cl)c1OC	ZINC000087928376	185237751	/nfs/dbraw/zinc/23/77/51/185237751.db2.gz	KLWSVUSCUNMGSP-PWSUYJOCSA-N	0	3	314.813	2.126	10	0		DEAEHN
COc1ccc(CN2CCCC[C@H]2CCO)cc1C(N)=S	ZINC000087832393	185232641	/nfs/dbraw/zinc/23/26/41/185232641.db2.gz	KTQWLKJWMIYERM-ZDUSSCGKSA-N	0	3	308.447	2.066	10	0		DEAEHN
CN1CCCC[C@@H]1CNC(=O)c1ccc2nc(N)sc2c1	ZINC000087847539	185233241	/nfs/dbraw/zinc/23/32/41/185233241.db2.gz	UNJRIGRTWZSXSN-LLVKDONJSA-N	0	3	304.419	2.093	10	0		DEAEHN
COCCN(Cc1ccc2nc(N)sc2c1)[C@H](C)COC	ZINC000087848108	185233275	/nfs/dbraw/zinc/23/32/75/185233275.db2.gz	UIJYNERWZGPLSQ-LLVKDONJSA-N	0	3	309.435	2.362	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Cc2ccccc2C(F)(F)F)C1	ZINC000171508538	282196866	/nfs/dbraw/zinc/19/68/66/282196866.db2.gz	XQOFQSBLGVFTED-GFCCVEGCSA-N	0	3	300.324	2.410	10	0		DEAEHN
CC[C@H](C)C[C@@H](C)NCc1ccc(S(=O)(=O)N(C)C)o1	ZINC000088541002	185255616	/nfs/dbraw/zinc/25/56/16/185255616.db2.gz	KQHJLMZWLLCKLE-NWDGAFQWSA-N	0	3	302.440	2.444	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@H](C)CC(C)C)o1	ZINC000088542283	185256236	/nfs/dbraw/zinc/25/62/36/185256236.db2.gz	LJBRIYBWSWWRMD-GFCCVEGCSA-N	0	3	302.440	2.492	10	0		DEAEHN
CCCNCc1ccc(S(=O)(=O)N(CC)CC(C)C)o1	ZINC000088543607	185256604	/nfs/dbraw/zinc/25/66/04/185256604.db2.gz	ZNPXAAYDDGEPSY-UHFFFAOYSA-N	0	3	302.440	2.446	10	0		DEAEHN
CCCN[C@H]1c2ccccc2C[C@H]1S(=O)(=O)CCCOC	ZINC000081985401	192348792	/nfs/dbraw/zinc/34/87/92/192348792.db2.gz	HTOVQRYAHNLWFC-CVEARBPZSA-N	0	3	311.447	2.103	10	0		DEAEHN
N[C@H]1CCC[C@H]1S(=O)(=O)c1cccc(Br)c1	ZINC000081982901	192349131	/nfs/dbraw/zinc/34/91/31/192349131.db2.gz	MALSJWIGRFPKLF-WDEREUQCSA-N	0	3	304.209	2.103	10	0		DEAEHN
CCC[C@@H](C(=O)NCC[C@@H](C)NC(=O)OC(C)(C)C)N(C)C	ZINC000179148285	282216339	/nfs/dbraw/zinc/21/63/39/282216339.db2.gz	WSPRYLBDFAPRLW-OLZOCXBDSA-N	0	3	315.458	2.136	10	0		DEAEHN
CC(C)OCCN(C)[C@H](CN)c1cncc(Br)c1	ZINC000166166217	197689030	/nfs/dbraw/zinc/68/90/30/197689030.db2.gz	CDAJUISZXSNTOI-CYBMUJFWSA-N	0	3	316.243	2.201	10	0		DEAEHN
Cc1nc(-c2ccc(NC(=O)[C@@H]3COC[C@@H]3N)cc2)cs1	ZINC000090383766	185293810	/nfs/dbraw/zinc/29/38/10/185293810.db2.gz	XRQXSSPUZHSRHB-OLZOCXBDSA-N	0	3	303.387	2.031	10	0		DEAEHN
C[C@]1(C(=O)Nc2ccc(Cl)c3cccnc23)COC[C@H]1N	ZINC000090589703	185305515	/nfs/dbraw/zinc/30/55/15/185305515.db2.gz	MTZFWSUPRIBARV-DOMZBBRYSA-N	0	3	305.765	2.191	10	0		DEAEHN
C[C@@]1(C(=O)Nc2ccc(Cl)c3cccnc23)COC[C@H]1N	ZINC000090589704	185305566	/nfs/dbraw/zinc/30/55/66/185305566.db2.gz	MTZFWSUPRIBARV-IUODEOHRSA-N	0	3	305.765	2.191	10	0		DEAEHN
COC(=O)C1CCC(C(=O)NC[C@@H](C)N2CCC(C)CC2)CC1	ZINC000179482303	282226995	/nfs/dbraw/zinc/22/69/95/282226995.db2.gz	PFTXDJFCNPWFRV-QQFBHYJXSA-N	0	3	324.465	2.202	10	0		DEAEHN
C[C@@]1(c2nc(Cc3ccc(F)cc3Cl)no2)COC[C@H]1N	ZINC000090573795	185304297	/nfs/dbraw/zinc/30/42/97/185304297.db2.gz	MQGCAMZQXGNLPF-BXUZGUMPSA-N	0	3	311.744	2.068	10	0		DEAEHN
C[C@@]1(c2nc(-c3ccccc3Br)no2)COC[C@@H]1N	ZINC000090573560	185304327	/nfs/dbraw/zinc/30/43/27/185304327.db2.gz	OJEOYUVIUKZKHG-GXFFZTMASA-N	0	3	324.178	2.114	10	0		DEAEHN
C[C@]1(c2nc(-c3cccc(Br)c3)no2)COC[C@H]1N	ZINC000090573276	185304478	/nfs/dbraw/zinc/30/44/78/185304478.db2.gz	ASBOYPHYQXASTQ-MFKMUULPSA-N	0	3	324.178	2.114	10	0		DEAEHN
c1cc(C2(NCCOC3CCOCC3)CC2)cc2c1OCO2	ZINC000625307480	365722362	/nfs/dbraw/zinc/72/23/62/365722362.db2.gz	GKIBBTZAKFJGII-UHFFFAOYSA-N	0	3	305.374	2.190	10	0		DEAEHN
O=C(c1ccccn1)N1CCCSC[C@@H]1CN1CCCC1	ZINC000090700856	185310493	/nfs/dbraw/zinc/31/04/93/185310493.db2.gz	XGPDIKUZOFIWEA-AWEZNQCLSA-N	0	3	305.447	2.125	10	0		DEAEHN
Cc1nn(C)c(Cl)c1C[C@H](N)[C@H]1COc2ccccc2O1	ZINC000167249414	197705027	/nfs/dbraw/zinc/70/50/27/197705027.db2.gz	OTTAJGYWVDZTHV-SMDDNHRTSA-N	0	3	307.781	2.092	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ncccc1C(F)(F)F	ZINC000092459006	185319991	/nfs/dbraw/zinc/31/99/91/185319991.db2.gz	UIMRMDIAFKPLPS-WDEREUQCSA-N	0	3	313.323	2.409	10	0		DEAEHN
CN1CCC[C@H](n2c(N)nc3cc(Br)cnc32)C1	ZINC000092575398	185326888	/nfs/dbraw/zinc/32/68/88/185326888.db2.gz	GYCLNUQPYSASEA-VIFPVBQESA-N	0	3	310.199	2.043	10	0		DEAEHN
CCCn1cc(S(=O)(=O)NC2C(C)(C)C2(C)C)cc1CN	ZINC000092833287	185344972	/nfs/dbraw/zinc/34/49/72/185344972.db2.gz	FALBSYNTOWRCBW-UHFFFAOYSA-N	0	3	313.467	2.070	10	0		DEAEHN
COCCN(CCOC)c1cccc(Br)c1CN	ZINC000168285852	197720822	/nfs/dbraw/zinc/72/08/22/197720822.db2.gz	OYBLIVKNAIDBLX-UHFFFAOYSA-N	0	3	317.227	2.007	10	0		DEAEHN
CC[C@@H](O)CN(CCN1CCOCC1)Cc1cc(C)ccc1C	ZINC000036103820	539334011	/nfs/dbraw/zinc/33/40/11/539334011.db2.gz	HKFIDFJMIDRHJH-LJQANCHMSA-N	0	3	320.477	2.209	10	0		DEAEHN
CC(=O)Nc1ccc(C)c(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000188365087	282298489	/nfs/dbraw/zinc/29/84/89/282298489.db2.gz	GKOLZQCSFHZRFT-GUYCJALGSA-N	0	3	317.433	2.412	10	0		DEAEHN
CCN(CC(=O)OC(C)(C)C)C1CCN([C@H](C)COC)CC1	ZINC000190348957	282318761	/nfs/dbraw/zinc/31/87/61/282318761.db2.gz	GFJNXLXNHFBYAT-CQSZACIVSA-N	0	3	314.470	2.149	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCS[C@H](C)CC1	ZINC000192257560	282340386	/nfs/dbraw/zinc/34/03/86/282340386.db2.gz	FRVILQAKINOQKE-ZIAGYGMSSA-N	0	3	301.500	2.500	10	0		DEAEHN
COC(=O)C(C)(C)[C@H](NC[C@H](O)CSC)c1ccccc1	ZINC000614567748	362410083	/nfs/dbraw/zinc/41/00/83/362410083.db2.gz	LJHWGIHIKOMXGL-UONOGXRCSA-N	0	3	311.447	2.240	10	0		DEAEHN
CCc1cnc(CCNC(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)s1	ZINC000126316616	539477038	/nfs/dbraw/zinc/47/70/38/539477038.db2.gz	FJXXEGHZVGPUGF-VXGBXAGGSA-N	0	3	322.478	2.172	10	0		DEAEHN
NC(=O)NC(=O)CN[C@H](CC1CCCCC1)c1ccccc1	ZINC000181829098	199358372	/nfs/dbraw/zinc/35/83/72/199358372.db2.gz	IQRAICQBYLVXSI-OAHLLOKOSA-N	0	3	303.406	2.483	10	0		DEAEHN
CS[C@@H]1CN(C(=O)Nc2ccc(C)nc2)C[C@H]1N1CCCC1	ZINC000615932976	362735132	/nfs/dbraw/zinc/73/51/32/362735132.db2.gz	XKDHRBJJEYVZDH-HUUCEWRRSA-N	0	3	320.462	2.434	10	0		DEAEHN
C[C@@H]1CCC[C@@H](NC(=O)NC[C@@H](O)CN2CCCCC2)CC1	ZINC000249026433	282544721	/nfs/dbraw/zinc/54/47/21/282544721.db2.gz	ANJIPJOSQHDHJO-BZUAXINKSA-N	0	3	311.470	2.101	10	0		DEAEHN
COc1ccc([C@@H](C)NC[C@@H](C)CS(C)(=O)=O)cc1OC	ZINC000180881736	539647341	/nfs/dbraw/zinc/64/73/41/539647341.db2.gz	MSBAIZXMCKCYNW-VXGBXAGGSA-N	0	3	315.435	2.035	10	0		DEAEHN
C[C@H](NCC(=O)NCCc1ccc(Cl)cc1)[C@H]1CCCO1	ZINC000183085990	539659624	/nfs/dbraw/zinc/65/96/24/539659624.db2.gz	BZRYMLYOFFBXPX-SWLSCSKDSA-N	0	3	310.825	2.156	10	0		DEAEHN
Cc1cc(N2CC[C@H](CN(C)Cc3cccnc3)C2)nc(C)n1	ZINC000186558503	539676162	/nfs/dbraw/zinc/67/61/62/539676162.db2.gz	UGSVUYAQCKJPPC-QGZVFWFLSA-N	0	3	311.433	2.447	10	0		DEAEHN
COc1ccc(CN)c(Oc2cccc(S(C)(=O)=O)c2)c1	ZINC000130358645	185959736	/nfs/dbraw/zinc/95/97/36/185959736.db2.gz	FGNHQXHOGYECDH-UHFFFAOYSA-N	0	3	307.371	2.350	10	0		DEAEHN
CN[C@@H](c1cc(Br)sc1C)[C@H]1COCCO1	ZINC000084006523	192395448	/nfs/dbraw/zinc/39/54/48/192395448.db2.gz	MGYPHJPEAQOCON-KOLCDFICSA-N	0	3	306.225	2.495	10	0		DEAEHN
CN[C@H](C[S@@](=O)C1CCOCC1)c1cc(C)ccc1OC	ZINC000084054736	192397235	/nfs/dbraw/zinc/39/72/35/192397235.db2.gz	IVBDMLGNCIRDSG-VFNWGFHPSA-N	0	3	311.447	2.192	10	0		DEAEHN
CCN[C@H](C[S@](=O)C1CCOCC1)c1ccc(OC)cc1	ZINC000084055319	192398086	/nfs/dbraw/zinc/39/80/86/192398086.db2.gz	BOJBRCCLLLIWDR-IIBYNOLFSA-N	0	3	311.447	2.274	10	0		DEAEHN
CC[NH+](CC)CCCCN[C@@H](CC(=O)[O-])C(=O)c1ccccc1	ZINC000071660738	191000518	/nfs/dbraw/zinc/00/05/18/191000518.db2.gz	XRVOQUHUKUIVHB-INIZCTEOSA-N	0	3	320.433	2.424	10	0		DEAEHN
Cn1c2cccc(S(C)(=O)=O)c2nc1[C@@H]1CCCCCN1	ZINC000138232580	186015303	/nfs/dbraw/zinc/01/53/03/186015303.db2.gz	CEEBXFASGUHWQU-NSHDSACASA-N	0	3	307.419	2.182	10	0		DEAEHN
CCNCc1cc(F)c(F)c(S(=O)(=O)N2CCC[C@H]2C)c1	ZINC000138572058	186017973	/nfs/dbraw/zinc/01/79/73/186017973.db2.gz	KDKUUOQTYYZSST-SNVBAGLBSA-N	0	3	318.389	2.247	10	0		DEAEHN
Cc1cc(-c2cc(NCCN(C)C)nc3[nH]ccc32)cnc1N	ZINC000072125241	191041852	/nfs/dbraw/zinc/04/18/52/191041852.db2.gz	QAXMNPMZKUNEJH-UHFFFAOYSA-N	0	3	310.405	2.489	10	0		DEAEHN
CC[C@@]1(C)N[C@H](c2cccs2)N(C2CCN(C)CC2)C1=O	ZINC000141204063	186029425	/nfs/dbraw/zinc/02/94/25/186029425.db2.gz	ZBZNGZCJFSFGRS-GOEBONIOSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCCN(C(C)C)[C@]1(CN)CCS(=O)(=O)c2ccccc21	ZINC000147640655	186040834	/nfs/dbraw/zinc/04/08/34/186040834.db2.gz	RRCMUWJXJRQFND-INIZCTEOSA-N	0	3	310.463	2.138	10	0		DEAEHN
COC(=O)c1c(NC(=O)C2(N)CCC2)sc2c1CCCC2	ZINC000148141796	186043340	/nfs/dbraw/zinc/04/33/40/186043340.db2.gz	LLHFJAMEYVHJME-UHFFFAOYSA-N	0	3	308.403	2.233	10	0		DEAEHN
C[C@H](CN1C(=O)C2(CCCC2)N[C@@H]1c1ccsc1)N(C)C	ZINC000144941620	186035782	/nfs/dbraw/zinc/03/57/82/186035782.db2.gz	FRLYSJCAYDKHBR-OCCSQVGLSA-N	0	3	307.463	2.441	10	0		DEAEHN
C[C@H](CN1C(=O)[C@H](C)N[C@@H]1c1ccsc1)N1CCCCC1	ZINC000145684305	186037236	/nfs/dbraw/zinc/03/72/36/186037236.db2.gz	SRFFKCHYOUXZGQ-IPYPFGDCSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCOC[C@H](O)CN[C@H](C)c1ccccc1Br	ZINC000148922377	186046096	/nfs/dbraw/zinc/04/60/96/186046096.db2.gz	ZZSQNEKNBBACKJ-GHMZBOCLSA-N	0	3	302.212	2.497	10	0		DEAEHN
NCc1csc(S(=O)(=O)NCCCCC(F)(F)F)c1	ZINC000149991259	186053972	/nfs/dbraw/zinc/05/39/72/186053972.db2.gz	BRSUEWZYNRTMED-UHFFFAOYSA-N	0	3	316.370	2.218	10	0		DEAEHN
NCc1cccc(NC(=O)C[S@](=O)c2ccc(F)cc2)c1	ZINC000155920212	186123570	/nfs/dbraw/zinc/12/35/70/186123570.db2.gz	OSTOEIAQMIRSPY-OAQYLSRUSA-N	0	3	306.362	2.031	10	0		DEAEHN
O=C(Nc1cccc(C(F)(F)F)c1)OC[C@H]1CNCCO1	ZINC000164132973	186150041	/nfs/dbraw/zinc/15/00/41/186150041.db2.gz	JGUOWBYQYQMUHQ-LLVKDONJSA-N	0	3	304.268	2.242	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](O)c1ccccc1	ZINC000179712254	186209352	/nfs/dbraw/zinc/20/93/52/186209352.db2.gz	LHHAUIQUJOGUDD-YJBOKZPZSA-N	0	3	312.413	2.357	10	0		DEAEHN
CN1CCCc2cc(NC(=O)N3CCN4CCC[C@@H]4C3)ccc21	ZINC000171891884	198002953	/nfs/dbraw/zinc/00/29/53/198002953.db2.gz	UTIRVXOIEJFRPA-MRXNPFEDSA-N	0	3	314.433	2.381	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)Nc2cccc3cccnc32)CCO1	ZINC000172046892	198030716	/nfs/dbraw/zinc/03/07/16/198030716.db2.gz	WWEXBLKZGRLYBI-AWEZNQCLSA-N	0	3	314.389	2.029	10	0		DEAEHN
CN(C)C(=O)[C@H](c1ccccc1)N1CC[C@@H](c2cnn(C)c2)C1	ZINC000172054753	198032037	/nfs/dbraw/zinc/03/20/37/198032037.db2.gz	BSYQKRFJLQQWGS-WBVHZDCISA-N	0	3	312.417	2.039	10	0		DEAEHN
CN(C)C(=O)[C@H](c1ccccc1)N1CC[C@H](c2cnn(C)c2)C1	ZINC000172054755	198032143	/nfs/dbraw/zinc/03/21/43/198032143.db2.gz	BSYQKRFJLQQWGS-RDJZCZTQSA-N	0	3	312.417	2.039	10	0		DEAEHN
C[C@@H](c1nc(-c2cccnc2)no1)N1CCCN(C2CC2)CC1	ZINC000172190750	198055443	/nfs/dbraw/zinc/05/54/43/198055443.db2.gz	NKUNMKRZPBIWGF-ZDUSSCGKSA-N	0	3	313.405	2.363	10	0		DEAEHN
Cc1c(F)cccc1NC(=O)C(=O)NCCN1CCCC[C@@H]1C	ZINC000072610375	191202355	/nfs/dbraw/zinc/20/23/55/191202355.db2.gz	UWBTXBBUXZHGPQ-LBPRGKRZSA-N	0	3	321.396	2.063	10	0		DEAEHN
O=C(NCc1ccc(Cl)cc1)N1CC[C@H](N2CC=CC2)C1	ZINC000173227746	198198241	/nfs/dbraw/zinc/19/82/41/198198241.db2.gz	HVANPFXXTMTFFK-HNNXBMFYSA-N	0	3	305.809	2.496	10	0		DEAEHN
CCN(CC)CC(=O)N1C[C@@H](c2ccc(F)cc2)O[C@@H](C)C1	ZINC000173523250	198224064	/nfs/dbraw/zinc/22/40/64/198224064.db2.gz	OIOMBGIPIXGXJD-BBRMVZONSA-N	0	3	308.397	2.456	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)[C@@H](O)c1ccccc1	ZINC000073010087	191267522	/nfs/dbraw/zinc/26/75/22/191267522.db2.gz	XAYTZGYVRJWYHM-ROUUACIJSA-N	0	3	312.413	2.009	10	0		DEAEHN
CCC(CC)c1cc(CNC(=O)N2CC[C@@H](N(C)C)C2)on1	ZINC000173914815	198267805	/nfs/dbraw/zinc/26/78/05/198267805.db2.gz	MFANKSRRFDALGS-CYBMUJFWSA-N	0	3	308.426	2.424	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)Nc2ccc3c(c2)OCCO3)CCN1C	ZINC000174113017	198293179	/nfs/dbraw/zinc/29/31/79/198293179.db2.gz	RNWFDOSZCIKUOW-JSGCOSHPSA-N	0	3	319.405	2.404	10	0		DEAEHN
O=C([C@@H]1CCCN(Cc2cccc(Cl)c2)C1)N1CCOCC1	ZINC000038832728	354168521	/nfs/dbraw/zinc/16/85/21/354168521.db2.gz	HEUVRDGSGVLDAT-OAHLLOKOSA-N	0	3	322.836	2.411	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCCCC[C@@H]1CO	ZINC000379469953	540121721	/nfs/dbraw/zinc/12/17/21/540121721.db2.gz	GQTIRCAUDNQFMZ-QGZVFWFLSA-N	0	3	304.434	2.272	10	0		DEAEHN
O[C@H](CN1CCC2(CC1)OCCO2)c1ccc2cc[nH]c2c1	ZINC000004959189	181179592	/nfs/dbraw/zinc/17/95/92/181179592.db2.gz	CTXJSJUNCBVUFF-MRXNPFEDSA-N	0	3	302.374	2.040	10	0		DEAEHN
CC1(C)O[C@H]2O[C@H](CN3CCC[C@@H]3c3ccccc3)[C@@H](O)[C@@H]2O1	ZINC000106385035	355722382	/nfs/dbraw/zinc/72/23/82/355722382.db2.gz	FXRSTNMDEDRDHF-OVYGPGRDSA-N	0	3	319.401	2.061	10	0		DEAEHN
Cc1ccc(SCCNC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000139415271	355876617	/nfs/dbraw/zinc/87/66/17/355876617.db2.gz	CZMRGOWHIKCFBG-AWEZNQCLSA-N	0	3	307.463	2.481	10	0		DEAEHN
CNC(=O)N1CCC([C@H]2CCN(Cc3ccc(C)cn3)C2)CC1	ZINC000169781612	355982857	/nfs/dbraw/zinc/98/28/57/355982857.db2.gz	DPIMEWQBDBJRDD-INIZCTEOSA-N	0	3	316.449	2.263	10	0		DEAEHN
C[C@@H]1CC[C@H](C(N)=O)CN1Cc1cnn(Cc2ccccc2)c1	ZINC000179420472	356025648	/nfs/dbraw/zinc/02/56/48/356025648.db2.gz	QCOLLIXYVFGQEK-PBHICJAKSA-N	0	3	312.417	2.017	10	0		DEAEHN
CN(CCCCC(=O)OC(C)(C)C)CC(=O)NC(C)(C)C	ZINC000181533565	356084644	/nfs/dbraw/zinc/08/46/44/356084644.db2.gz	NKDWNSZNIDNRAT-UHFFFAOYSA-N	0	3	300.443	2.345	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCCC[C@@H]1NCCc1cc(F)ccc1F	ZINC000183065639	356159094	/nfs/dbraw/zinc/15/90/94/356159094.db2.gz	SEVSHTATHKXHHV-LSDHHAIUSA-N	0	3	317.401	2.453	10	0		DEAEHN
C[C@H](CC1CCCCC1)CN1CC[C@H](NS(C)(=O)=O)C1	ZINC000183357255	356169407	/nfs/dbraw/zinc/16/94/07/356169407.db2.gz	IRNVBURRGGOSAC-HIFRSBDPSA-N	0	3	302.484	2.216	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)Nc2ncn(C3CCCCC3)n2)C1	ZINC000184623579	356195365	/nfs/dbraw/zinc/19/53/65/356195365.db2.gz	JHRODVDRJRLERJ-ZDUSSCGKSA-N	0	3	320.441	2.247	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1c(C)cccc1OC	ZINC000195031641	356249152	/nfs/dbraw/zinc/24/91/52/356249152.db2.gz	DYVXDOZLNPHKTL-CQSZACIVSA-N	0	3	321.421	2.236	10	0		DEAEHN
NCc1cnc(I)cc1OC(F)(F)F	ZINC000238568221	356304452	/nfs/dbraw/zinc/30/44/52/356304452.db2.gz	GRYOSFDEXADHNL-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@H]1[C@@H](NCc2ccccc2)[C@@H]2OCC[C@@H]12	ZINC000300227984	356390186	/nfs/dbraw/zinc/39/01/86/356390186.db2.gz	ZVXRDYBDPDMHIX-ZJIFWQFVSA-N	0	3	318.417	2.457	10	0		DEAEHN
Cc1cc(F)ccc1C(=O)N1CCO[C@H](CN(C)CC2CC2)C1	ZINC000328622362	356462123	/nfs/dbraw/zinc/46/21/23/356462123.db2.gz	BFAKYFXFSBUNQQ-MRXNPFEDSA-N	0	3	320.408	2.317	10	0		DEAEHN
NC[C@H](c1c(Cl)cccc1Cl)N1CCn2cnnc2C1	ZINC000081533060	192285250	/nfs/dbraw/zinc/28/52/50/192285250.db2.gz	IMVRLMXDRUYVCG-LLVKDONJSA-N	0	3	312.204	2.101	10	0		DEAEHN
CCC[C@H](N)C(=O)N[C@@H](C)c1ccc(N2CCCC2=O)cc1	ZINC000236903753	202062881	/nfs/dbraw/zinc/06/28/81/202062881.db2.gz	VXCYOZBWSKJFQB-WFASDCNBSA-N	0	3	303.406	2.118	10	0		DEAEHN
CN[C@H](c1ccc2c(c1)CC(C)(C)O2)[C@@H]1CCS(=O)(=O)C1	ZINC000086022655	192545710	/nfs/dbraw/zinc/54/57/10/192545710.db2.gz	MDFLKMVDPDMXAU-IUODEOHRSA-N	0	3	309.431	2.095	10	0		DEAEHN
CC[C@@H]1[C@@H](CO)CCN1CC(=O)N(CC)Cc1ccccc1	ZINC000385934449	356693048	/nfs/dbraw/zinc/69/30/48/356693048.db2.gz	VHEAZUQQOWAGQD-IAGOWNOFSA-N	0	3	304.434	2.128	10	0		DEAEHN
OCCN1CCC[C@H](NCc2csc(Br)c2)C1	ZINC000384276770	356682731	/nfs/dbraw/zinc/68/27/31/356682731.db2.gz	ALJCFOOMDJWVEO-NSHDSACASA-N	0	3	319.268	2.057	10	0		DEAEHN
OCCN1CCC[C@H](NCc2cc(Br)cs2)C1	ZINC000384400400	356683106	/nfs/dbraw/zinc/68/31/06/356683106.db2.gz	UKMQCQQYLNOTBN-NSHDSACASA-N	0	3	319.268	2.057	10	0		DEAEHN
COCCN(C)CCNCc1ccsc1Br	ZINC000388754723	356706617	/nfs/dbraw/zinc/70/66/17/356706617.db2.gz	QRDNZTOCVWZOKJ-UHFFFAOYSA-N	0	3	307.257	2.178	10	0		DEAEHN
COc1cc(OC)cc(N2CC[C@H](NCCC(C)C)C2=O)c1	ZINC000237213081	202192258	/nfs/dbraw/zinc/19/22/58/202192258.db2.gz	BXISTKCJANACKE-INIZCTEOSA-N	0	3	306.406	2.445	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N1CC(=O)NCC[C@H]1COc2ccccc2O1	ZINC000579785305	357028716	/nfs/dbraw/zinc/02/87/16/357028716.db2.gz	VBZWMBJUTQUFDO-KFWWJZLASA-N	0	3	318.417	2.206	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)c(C)s1	ZINC000088920544	192657378	/nfs/dbraw/zinc/65/73/78/192657378.db2.gz	VFRZIIVXVNGTIJ-QWRGUYRKSA-N	0	3	316.492	2.443	10	0		DEAEHN
CCc1ccc(CN)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1	ZINC000088920451	192657655	/nfs/dbraw/zinc/65/76/55/192657655.db2.gz	SFSVLLDKQZIUEV-CHWSQXEVSA-N	0	3	310.463	2.374	10	0		DEAEHN
CN(C)CCN(Cc1ccco1)C(=O)NCCOCC1CCC1	ZINC000581224768	357149925	/nfs/dbraw/zinc/14/99/25/357149925.db2.gz	DNPUPALMYVAVMH-UHFFFAOYSA-N	0	3	323.437	2.170	10	0		DEAEHN
CNCc1ccc(F)c(S(=O)(=O)N(C)[C@H](C)C(C)C)c1	ZINC000088963148	192670848	/nfs/dbraw/zinc/67/08/48/192670848.db2.gz	AMJBXYZWRJSERK-LLVKDONJSA-N	0	3	302.415	2.210	10	0		DEAEHN
CCCNCc1nc(Br)c(Br)n1C	ZINC000584881901	357324033	/nfs/dbraw/zinc/32/40/33/357324033.db2.gz	SOAVEQVWXUBWLV-UHFFFAOYSA-N	0	3	311.021	2.445	10	0		DEAEHN
CCC[C@H](NC(=O)NCCNc1ccncc1)c1ccccn1	ZINC000591605778	357742723	/nfs/dbraw/zinc/74/27/23/357742723.db2.gz	UMPMCFOFVPQZOU-INIZCTEOSA-N	0	3	313.405	2.151	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H](C)Cc1ccc(OC)c(OC)c1)N(C)C	ZINC000179233795	199002430	/nfs/dbraw/zinc/00/24/30/199002430.db2.gz	YGIYTCWVKZBNAE-ZFWWWQNUSA-N	0	3	322.449	2.481	10	0		DEAEHN
COc1ccc(C[C@@H](C)CNC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000179511261	199048007	/nfs/dbraw/zinc/04/80/07/199048007.db2.gz	GWRUHOMDZZGIRJ-ZBFHGGJFSA-N	0	3	319.449	2.219	10	0		DEAEHN
CCOCCN1CCN(Cc2cnn3ccccc23)C[C@@H]1CC	ZINC000179513673	199048706	/nfs/dbraw/zinc/04/87/06/199048706.db2.gz	QAJXHWUHLUBDMI-KRWDZBQOSA-N	0	3	316.449	2.267	10	0		DEAEHN
CCn1nc(C)c(NC(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1C	ZINC000179549132	199053442	/nfs/dbraw/zinc/05/34/42/199053442.db2.gz	UZEKEXHKELNSGJ-FZMZJTMJSA-N	0	3	307.442	2.370	10	0		DEAEHN
O=C(NCc1ccc(Cl)cn1)NC1CCN(C2CC2)CC1	ZINC000180421026	199156673	/nfs/dbraw/zinc/15/66/73/199156673.db2.gz	ZRBXWJWHZAFDNN-UHFFFAOYSA-N	0	3	308.813	2.161	10	0		DEAEHN
C[C@@H](N[C@@H]1CCc2ncnn2C1)c1ccc2c(c1)OCCCO2	ZINC000180583310	199179971	/nfs/dbraw/zinc/17/99/71/199179971.db2.gz	QEQHXISWNVZERC-TZMCWYRMSA-N	0	3	314.389	2.105	10	0		DEAEHN
C[C@H](CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1)c1nccs1	ZINC000187011234	200047683	/nfs/dbraw/zinc/04/76/83/200047683.db2.gz	OHWJPBAWRLPPEP-AGIUHOORSA-N	0	3	310.467	2.371	10	0		DEAEHN
C[C@H]1NC(=S)N(C[C@@]2(C)CCCN2Cc2ccccc2)C1=O	ZINC000189417920	291188280	/nfs/dbraw/zinc/18/82/80/291188280.db2.gz	WQQUWHKRHHQRBI-CXAGYDPISA-N	0	3	317.458	2.146	10	0		DEAEHN
CO[C@H]1CN(C(=O)NCc2cccc(CN(C)C)c2)CC[C@@H]1C	ZINC000187325330	200095767	/nfs/dbraw/zinc/09/57/67/200095767.db2.gz	LBIWLTLMERWLGD-YOEHRIQHSA-N	0	3	319.449	2.315	10	0		DEAEHN
C[C@H]1CC[C@@](CO)(N(C)CC(=O)N2CCc3sccc3C2)C1	ZINC000187944420	200180568	/nfs/dbraw/zinc/18/05/68/200180568.db2.gz	XEIWJGKEVGCXLD-SUMWQHHRSA-N	0	3	322.474	2.116	10	0		DEAEHN
CO[C@H]1CN(Cc2ccccc2N2CCOCC2)CC[C@H]1C	ZINC000188329328	200228265	/nfs/dbraw/zinc/22/82/65/200228265.db2.gz	CJYFHESYZPNIKO-QAPCUYQASA-N	0	3	304.434	2.380	10	0		DEAEHN
COc1cc(CN(C)C(=O)CN(C)C2CCC2)cc(OC)c1	ZINC000608565411	361233391	/nfs/dbraw/zinc/23/33/91/361233391.db2.gz	WKQKPFZSYGGUMY-UHFFFAOYSA-N	0	3	306.406	2.147	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccoc1Br	ZINC000193323232	201029682	/nfs/dbraw/zinc/02/96/82/201029682.db2.gz	KRBRPFHDVPZLDG-NXEZZACHSA-N	0	3	313.195	2.351	10	0		DEAEHN
CCCCOC[C@@H](O)CN[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000193358426	201038167	/nfs/dbraw/zinc/03/81/67/201038167.db2.gz	DNMSSPMNJXRDKV-YOEHRIQHSA-N	0	3	318.421	2.096	10	0		DEAEHN
Cc1ccc([C@H](O)CNC(=O)N[C@H](CC(C)C)CN(C)C)cc1	ZINC000194190999	201195011	/nfs/dbraw/zinc/19/50/11/201195011.db2.gz	BNYPVMCCKPQVRB-IAGOWNOFSA-N	0	3	321.465	2.304	10	0		DEAEHN
c1cc(CNCCCOC[C@@H]2CCOC2)n(-c2ccccc2)n1	ZINC000447933094	239179428	/nfs/dbraw/zinc/17/94/28/239179428.db2.gz	SGOOEUNWEQTDLA-INIZCTEOSA-N	0	3	315.417	2.405	10	0		DEAEHN
C[C@@H]1CN(CC(=O)NC(C)(C)C)CCN(Cc2ccccc2)C1	ZINC000448552106	239365719	/nfs/dbraw/zinc/36/57/19/239365719.db2.gz	MGRVCAOGZAIPNV-INIZCTEOSA-N	0	3	317.477	2.355	10	0		DEAEHN
c1cc(CN[C@@H]2CCc3n[nH]cc3C2)n(CCc2ccccc2)n1	ZINC000621337328	364358145	/nfs/dbraw/zinc/35/81/45/364358145.db2.gz	VJAXKWMGXFUQAL-QGZVFWFLSA-N	0	3	321.428	2.496	10	0		DEAEHN
CN1CCOC[C@@H]1CNCc1cc(Br)ccc1F	ZINC000623710750	365139736	/nfs/dbraw/zinc/13/97/36/365139736.db2.gz	MPGQDARURWIALL-LBPRGKRZSA-N	0	3	317.202	2.008	10	0		DEAEHN
C[NH2+]Cc1cc(=O)[n-]c(-c2cc(F)cc(Br)c2)n1	ZINC000091332325	193041826	/nfs/dbraw/zinc/04/18/26/193041826.db2.gz	AXMDPGFQGQEESS-UHFFFAOYSA-N	0	3	312.142	2.058	10	0		DEAEHN
CCS(=O)(=O)CCn1ncc(CNC(C)(C)C)c1C(C)C	ZINC000091339850	193044110	/nfs/dbraw/zinc/04/41/10/193044110.db2.gz	IYVOGQZTXMPXIJ-UHFFFAOYSA-N	0	3	315.483	2.329	10	0		DEAEHN
Cc1ccc(C(F)(F)F)cc1NC(=O)[C@@]1(C)COC[C@@H]1N	ZINC000091479812	193062341	/nfs/dbraw/zinc/06/23/41/193062341.db2.gz	YURNFOKEQXUDOS-AAEUAGOBSA-N	0	3	302.296	2.316	10	0		DEAEHN
Nc1nc2cccc(Cl)c2n1C[C@H]1CN2CCC[C@@H]2CO1	ZINC000091675121	193089356	/nfs/dbraw/zinc/08/93/56/193089356.db2.gz	HQVBRXYZCCSKQJ-GHMZBOCLSA-N	0	3	306.797	2.135	10	0		DEAEHN
CNC(=O)[C@@H](C)CN(C)C[C@@H]1CC(c2ccc(Cl)cc2)=NO1	ZINC000091675528	193089596	/nfs/dbraw/zinc/08/95/96/193089596.db2.gz	GPHRSMSKMZWGQH-FZMZJTMJSA-N	0	3	323.824	2.147	10	0		DEAEHN
NCc1cccc2c1N(S(=O)(=O)c1cccs1)CCC2	ZINC000624388513	365406192	/nfs/dbraw/zinc/40/61/92/365406192.db2.gz	ZWEABOQRMUYNHY-UHFFFAOYSA-N	0	3	308.428	2.348	10	0		DEAEHN
COC(=O)[C@@H](O)C1CCN(Cc2cc(C)c(OC)c(C)c2)CC1	ZINC000092014738	193141627	/nfs/dbraw/zinc/14/16/27/193141627.db2.gz	SBMWFQJCVRBHBJ-INIZCTEOSA-N	0	3	321.417	2.058	10	0		DEAEHN
COc1ccccc1CN1CCC(N2CCO[C@@H](C)C2)CC1	ZINC000092079717	193154705	/nfs/dbraw/zinc/15/47/05/193154705.db2.gz	HMDDVLIMCWXVIZ-HNNXBMFYSA-N	0	3	304.434	2.380	10	0		DEAEHN
CCCNCc1ccccc1S(=O)(=O)N1C[C@H](C)[C@H](C)C1	ZINC000092113892	193161112	/nfs/dbraw/zinc/16/11/12/193161112.db2.gz	RXCFNFSAUTXHLK-OKILXGFUSA-N	0	3	310.463	2.463	10	0		DEAEHN
CNCc1cc(F)c(C)c(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)c1	ZINC000092113971	193161745	/nfs/dbraw/zinc/16/17/45/193161745.db2.gz	SZQBFOIMIMJARL-QWRGUYRKSA-N	0	3	314.426	2.130	10	0		DEAEHN
C[C@@H]1CCC[C@H](C)N1S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115550	193163247	/nfs/dbraw/zinc/16/32/47/193163247.db2.gz	SZUIRZGPIKNCHB-PHIMTYICSA-N	0	3	300.399	2.236	10	0		DEAEHN
c1c(CNC(C2CCC2)C2CCC2)nnn1C[C@H]1CCOC1	ZINC000631136191	368036789	/nfs/dbraw/zinc/03/67/89/368036789.db2.gz	SLCPJGPAYHLMLE-CYBMUJFWSA-N	0	3	304.438	2.373	10	0		DEAEHN
COc1cc(C[NH2+][C@H]2C[C@@H](CO)C2)cc(Br)c1[O-]	ZINC000631199372	368073215	/nfs/dbraw/zinc/07/32/15/368073215.db2.gz	KDYCYOBMIOWIOU-AOOOYVTPSA-N	0	3	316.195	2.024	10	0		DEAEHN
CCN(CC(C)(C)O)[C@H](C)C(=O)Nc1ccc(N)cc1Cl	ZINC000092964693	193189562	/nfs/dbraw/zinc/18/95/62/193189562.db2.gz	HCGLFQROUPEXDG-SNVBAGLBSA-N	0	3	313.829	2.342	10	0		DEAEHN
COc1ccccc1CN1CCCC[C@@H]1CN1CCOCC1	ZINC000093012091	193194012	/nfs/dbraw/zinc/19/40/12/193194012.db2.gz	UIMJPAIWFBKJKR-QGZVFWFLSA-N	0	3	304.434	2.382	10	0		DEAEHN
CCC[C@](C)(N)C(=O)NC[C@H](c1ccccc1)C(C)(C)CO	ZINC000262587925	203341655	/nfs/dbraw/zinc/34/16/55/203341655.db2.gz	TXMBZXDZMRFVQL-QAPCUYQASA-N	0	3	306.450	2.422	10	0		DEAEHN
Cc1ccc(CN)cc1S(=O)(=O)N(C)CCc1cccs1	ZINC000093294732	193226738	/nfs/dbraw/zinc/22/67/38/193226738.db2.gz	HDQQOYVOCOCSEG-UHFFFAOYSA-N	0	3	324.471	2.378	10	0		DEAEHN
CC(C)c1ccc([C@H](O)CNCC(C)(C)S(C)(=O)=O)cc1	ZINC000093519988	193262773	/nfs/dbraw/zinc/26/27/73/193262773.db2.gz	BDVKZIOIRRUTHJ-OAHLLOKOSA-N	0	3	313.463	2.256	10	0		DEAEHN
N[C@H](c1cscc1Br)[C@@H]1CN2CCC[C@@H]2CO1	ZINC000093655045	193284321	/nfs/dbraw/zinc/28/43/21/193284321.db2.gz	JXKPGBWDPIMCRU-JFUSQASVSA-N	0	3	317.252	2.374	10	0		DEAEHN
CN[C@@]1(C(N)=O)CC[C@H](Sc2ccc(C(F)(F)F)cn2)C1	ZINC000093850374	193317958	/nfs/dbraw/zinc/31/79/58/193317958.db2.gz	LTPDUIHTWUPMQZ-CABZTGNLSA-N	0	3	319.352	2.189	10	0		DEAEHN
CN1CCO[C@H](CNCc2cc(F)cc(Br)c2)C1	ZINC000093938962	193330204	/nfs/dbraw/zinc/33/02/04/193330204.db2.gz	WQWQTVJNLBBQAV-CYBMUJFWSA-N	0	3	317.202	2.008	10	0		DEAEHN
Cc1nn([C@H]2CCC[C@H](S(C)(=O)=O)C2)cc1CNC(C)C	ZINC000094644432	193389369	/nfs/dbraw/zinc/38/93/69/193389369.db2.gz	FGXDWRAABQBJPV-GJZGRUSLSA-N	0	3	313.467	2.218	10	0		DEAEHN
CC(C)NCc1nc(CN2CCN3CCCC[C@@H]3C2)cs1	ZINC000094443432	193369342	/nfs/dbraw/zinc/36/93/42/193369342.db2.gz	UNTZVTVEXAVFCD-OAHLLOKOSA-N	0	3	308.495	2.311	10	0		DEAEHN
COCCNCc1c(C)nc([C@@H]2CSCCS2)nc1C	ZINC000094500192	193374456	/nfs/dbraw/zinc/37/44/56/193374456.db2.gz	MCEUKINYYRIDGN-ZDUSSCGKSA-N	0	3	313.492	2.351	10	0		DEAEHN
CN[C@H](Cc1c(Cl)cccc1Cl)[C@H]1CN2CCN1CC2	ZINC000094509040	193376212	/nfs/dbraw/zinc/37/62/12/193376212.db2.gz	XFTYKRDXUVTDOK-HUUCEWRRSA-N	0	3	314.260	2.124	10	0		DEAEHN
CC[NH2+][C@H](C)CC(=O)Nc1cc(Br)ccc1[O-]	ZINC000094573763	193381776	/nfs/dbraw/zinc/38/17/76/193381776.db2.gz	MDIXTLCGXFLNSQ-MRVPVSSYSA-N	0	3	301.184	2.481	10	0		DEAEHN
COC(=O)[C@H](c1ccccc1F)N1CCN2CCCC[C@@H]2C1	ZINC000177778648	284305457	/nfs/dbraw/zinc/30/54/57/284305457.db2.gz	MHKDBKKQTNZPRR-CJNGLKHVSA-N	0	3	306.381	2.210	10	0		DEAEHN
COc1cccc([C@@H]2C[C@H](O)CN2Cc2nc(C)ccc2O)c1	ZINC000282689022	217176853	/nfs/dbraw/zinc/17/68/53/217176853.db2.gz	IVMZNUVHMIMZEA-YOEHRIQHSA-N	0	3	314.385	2.412	10	0		DEAEHN
COC(=O)[C@H]1CCCN(C(=O)[C@@H]2CCCCN2C2CCCC2)C1	ZINC000449841382	284330213	/nfs/dbraw/zinc/33/02/13/284330213.db2.gz	VCSAYBVPNFUYAV-HOCLYGCPSA-N	0	3	322.449	2.195	10	0		DEAEHN
CN1C[C@@H]2C[C@@H](c3cccn3-c3cccnc3)N3CCC[C@@]23C1=O	ZINC000019841439	182155606	/nfs/dbraw/zinc/15/56/06/182155606.db2.gz	ZMANNEGWFHCNAY-FNHZYXHNSA-N	0	3	322.412	2.240	10	0		DEAEHN
C[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)N1CCNCC1	ZINC000020269992	182201749	/nfs/dbraw/zinc/20/17/49/182201749.db2.gz	NLFJJTUFMQWXCM-VIFPVBQESA-N	0	3	302.205	2.226	10	0		DEAEHN
N[C@H](c1cc2c(cc1Br)OCCO2)[C@@H]1CCCO1	ZINC000036925960	182852922	/nfs/dbraw/zinc/85/29/22/182852922.db2.gz	OFEGRLRLADYIAT-GXFFZTMASA-N	0	3	314.179	2.399	10	0		DEAEHN
CC(C)[C@@H](N)C(=O)Nc1cc(Br)ccc1N(C)C	ZINC000037041935	182863981	/nfs/dbraw/zinc/86/39/81/182863981.db2.gz	JGMHPLXMKIEZFS-GFCCVEGCSA-N	0	3	314.227	2.437	10	0		DEAEHN
COc1cccc(CN[C@@H]2CCCN(C)C2)c1OC(F)F	ZINC000040672774	183116183	/nfs/dbraw/zinc/11/61/83/183116183.db2.gz	BAJLYUNCFOVLRH-GFCCVEGCSA-N	0	3	300.349	2.480	10	0		DEAEHN
Cc1ccc([C@@H](CNS(C)(=O)=O)N2CCCCCC2)cc1	ZINC000040615851	183110268	/nfs/dbraw/zinc/11/02/68/183110268.db2.gz	YLPVWBRGKRLASA-MRXNPFEDSA-N	0	3	310.463	2.461	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2ccccc2SC(F)F)C1	ZINC000040630041	183110950	/nfs/dbraw/zinc/11/09/50/183110950.db2.gz	LJDFRKVEAYARSX-PSASIEDQSA-N	0	3	302.346	2.317	10	0		DEAEHN
COC(=O)Cc1c(C)nc2ccccc2c1NC(C)(C)CO	ZINC000041474646	183193996	/nfs/dbraw/zinc/19/39/96/183193996.db2.gz	BEFUQWBZUSTBGW-UHFFFAOYSA-N	0	3	302.374	2.442	10	0		DEAEHN
CNCc1cccc(Br)c1O[C@@H](C)C(=O)N(C)C	ZINC000042411495	183265076	/nfs/dbraw/zinc/26/50/76/183265076.db2.gz	PGMBKCLWHRTJHP-VIFPVBQESA-N	0	3	315.211	2.024	10	0		DEAEHN
CC(C)N(CC(=O)Nc1ccccc1C(N)=S)CC1CC1	ZINC000042583333	183287108	/nfs/dbraw/zinc/28/71/08/183287108.db2.gz	HMRRKUJPIVVLOF-UHFFFAOYSA-N	0	3	305.447	2.380	10	0		DEAEHN
COCCN([C@@H](CN)c1cccc(Cl)c1)[C@@H](C)COC	ZINC000042606661	183290423	/nfs/dbraw/zinc/29/04/23/183290423.db2.gz	OJSSPTQCOJXULU-WFASDCNBSA-N	0	3	300.830	2.323	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccccc1Cl)N(CC(N)=O)C1CCCC1	ZINC000043052482	183333160	/nfs/dbraw/zinc/33/31/60/183333160.db2.gz	YCULDEVESYUEIE-BZNIZROVSA-N	0	3	309.841	2.458	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccc(Cl)cc1)N(C)CC(=O)N1CCCC1	ZINC000042946071	183319803	/nfs/dbraw/zinc/31/98/03/183319803.db2.gz	OTAFUFTYPPSWEX-MLGOLLRUSA-N	0	3	309.841	2.283	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccccc1Cl)N1CCCC[C@@H]1C(N)=O	ZINC000043052358	183332573	/nfs/dbraw/zinc/33/25/73/183332573.db2.gz	ZCALABZPAGXTBD-RRFJBIMHSA-N	0	3	309.841	2.458	10	0		DEAEHN
O=C(CSc1ccc(C(F)(F)F)cn1)N1CCCNCC1	ZINC000043402917	183359227	/nfs/dbraw/zinc/35/92/27/183359227.db2.gz	PTYLSGTVDHLMGD-UHFFFAOYSA-N	0	3	319.352	2.014	10	0		DEAEHN
N[C@H](c1ccc(Br)cc1F)[C@H]1CCS(=O)(=O)C1	ZINC000043299836	183351297	/nfs/dbraw/zinc/35/12/97/183351297.db2.gz	XABPTPWGEBQVHZ-CPCISQLKSA-N	0	3	322.199	2.023	10	0		DEAEHN
N[C@H](c1ccc(OC(F)(F)F)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000043300030	183352154	/nfs/dbraw/zinc/35/21/54/183352154.db2.gz	SVRHDCGOYUVTHM-MWLCHTKSSA-N	0	3	309.309	2.020	10	0		DEAEHN
CN[C@H](c1ccc(OC(F)(F)F)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000043300609	183352430	/nfs/dbraw/zinc/35/24/30/183352430.db2.gz	XKYIMTOWHQBLNW-ZYHUDNBSSA-N	0	3	323.336	2.280	10	0		DEAEHN
CN1CCC(Oc2nc3c(cc2C(N)=S)CCCC3)CC1	ZINC000043411024	183360109	/nfs/dbraw/zinc/36/01/09/183360109.db2.gz	GIQNOEZNOYKOKH-UHFFFAOYSA-N	0	3	305.447	2.068	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(C(=O)[C@H]2CCCCN2CC)C1	ZINC000105852818	194146909	/nfs/dbraw/zinc/14/69/09/194146909.db2.gz	GVAUMRZHBWMOMV-HZPDHXFCSA-N	0	3	318.465	2.483	10	0		DEAEHN
Cc1cnn(CC[NH2+]Cc2cc(=O)oc3c(C)c([O-])ccc23)c1	ZINC000105881029	194155958	/nfs/dbraw/zinc/15/59/58/194155958.db2.gz	ZZKBSIWOELHNEK-UHFFFAOYSA-N	0	3	313.357	2.102	10	0		DEAEHN
CCOc1ccc(NC(=O)[C@@H](C)NCCn2cc(C)cn2)cc1	ZINC000105881403	194156372	/nfs/dbraw/zinc/15/63/72/194156372.db2.gz	UEAYVHNSURRVJP-CQSZACIVSA-N	0	3	316.405	2.207	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(Cc2ccc(C(N)=O)cc2)C1	ZINC000105897080	194162330	/nfs/dbraw/zinc/16/23/30/194162330.db2.gz	AKCFMJQDFGFBOE-MRXNPFEDSA-N	0	3	312.417	2.382	10	0		DEAEHN
CCCCOC(=O)CCN1CCC(Nc2cccnn2)CC1	ZINC000105910099	194166363	/nfs/dbraw/zinc/16/63/63/194166363.db2.gz	VQPATQIAIDUABI-UHFFFAOYSA-N	0	3	306.410	2.086	10	0		DEAEHN
CCCCOC(=O)CCN1CCC(N(C)c2cccnn2)CC1	ZINC000105910413	194166781	/nfs/dbraw/zinc/16/67/81/194166781.db2.gz	BZHMQXIMDWWGDW-UHFFFAOYSA-N	0	3	320.437	2.111	10	0		DEAEHN
NC[C@@H](c1ccccc1Br)N1CCN(C2CC2)CC1	ZINC000048991829	183701057	/nfs/dbraw/zinc/70/10/57/183701057.db2.gz	UMNPWNINOSLDQU-HNNXBMFYSA-N	0	3	324.266	2.229	10	0		DEAEHN
C[C@H](C(N)=S)N1CCN(Cc2ccc(F)cc2Cl)CC1	ZINC000109468554	194266772	/nfs/dbraw/zinc/26/67/72/194266772.db2.gz	TWJFRDVMLIOBHW-SNVBAGLBSA-N	0	3	315.845	2.271	10	0		DEAEHN
O=c1ccccn1CCNCc1cccc(Br)c1	ZINC000110056543	194308039	/nfs/dbraw/zinc/30/80/39/194308039.db2.gz	HBGPGNHJALWACF-UHFFFAOYSA-N	0	3	307.191	2.401	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)cc1)N1CCNC(=O)[C@@H]1CC	ZINC000110677258	194349069	/nfs/dbraw/zinc/34/90/69/194349069.db2.gz	QIVOHAHAYTYFKN-ILXRZTDVSA-N	0	3	309.841	2.329	10	0		DEAEHN
C[C@H]1CCCN(S(=O)(=O)c2cccc3c2CCNC3)CC1	ZINC000110815667	194361058	/nfs/dbraw/zinc/36/10/58/194361058.db2.gz	QHVINSCDCJZORR-ZDUSSCGKSA-N	0	3	308.447	2.143	10	0		DEAEHN
Brc1ccc2c(c1)CC[C@@H](NCc1nc[nH]n1)C2	ZINC000110821892	194361302	/nfs/dbraw/zinc/36/13/02/194361302.db2.gz	PANIMNQZEADLPG-GFCCVEGCSA-N	0	3	307.195	2.214	10	0		DEAEHN
Brc1ccc2c(c1)CC[C@@H](NCc1nnc[nH]1)C2	ZINC000110821892	194361304	/nfs/dbraw/zinc/36/13/04/194361304.db2.gz	PANIMNQZEADLPG-GFCCVEGCSA-N	0	3	307.195	2.214	10	0		DEAEHN
COc1ccc([C@H](CN)N2CCCOCC2)c(Cl)c1OC	ZINC000110829619	194361943	/nfs/dbraw/zinc/36/19/43/194361943.db2.gz	UZPQUNBSIUKXKT-LBPRGKRZSA-N	0	3	314.813	2.079	10	0		DEAEHN
CCN(CC)c1nc(NC)nc(N(C)CCC(F)(F)F)n1	ZINC000156643903	197130070	/nfs/dbraw/zinc/13/00/70/197130070.db2.gz	OMQXHTQAAVLSGH-UHFFFAOYSA-N	0	3	306.336	2.148	10	0		DEAEHN
CCN(C(=O)CN1CCCN(C2CC2)CC1)c1ccccc1	ZINC000061041058	184161063	/nfs/dbraw/zinc/16/10/63/184161063.db2.gz	VBUHWZWUGSDEBG-UHFFFAOYSA-N	0	3	301.434	2.210	10	0		DEAEHN
CCN1CCC[C@H]1CNc1nc(Cl)nc(N2CCCC2)n1	ZINC000061536831	184172775	/nfs/dbraw/zinc/17/27/75/184172775.db2.gz	TYELIWAISRTCQW-NSHDSACASA-N	0	3	310.833	2.021	10	0		DEAEHN
Cc1nc2ccccc2n1CC(=O)N1CCCN(C2CC2)CC1	ZINC000061604334	184176851	/nfs/dbraw/zinc/17/68/51/184176851.db2.gz	CGIOTTRBZFXKPA-UHFFFAOYSA-N	0	3	312.417	2.041	10	0		DEAEHN
CCNCc1cc(Br)ccc1O[C@H](CC)C(N)=O	ZINC000061675717	184181701	/nfs/dbraw/zinc/18/17/01/184181701.db2.gz	UCCJADRKXFANJW-LLVKDONJSA-N	0	3	315.211	2.201	10	0		DEAEHN
C[C@H]1CN([C@@H](CN)c2ccc(OC(F)F)cc2)CCCO1	ZINC000061916325	184195072	/nfs/dbraw/zinc/19/50/72/184195072.db2.gz	YBNVONLEORGPKC-FZMZJTMJSA-N	0	3	300.349	2.399	10	0		DEAEHN
NC[C@H](c1ccccc1OC(F)(F)F)N1CCCOCC1	ZINC000061916558	184195242	/nfs/dbraw/zinc/19/52/42/184195242.db2.gz	WVDRJTNKZWCTDD-GFCCVEGCSA-N	0	3	304.312	2.307	10	0		DEAEHN
CN1CC[C@H](Nc2cccc(I)c2)C1	ZINC000061984927	184200043	/nfs/dbraw/zinc/20/00/43/184200043.db2.gz	LNTWWDUJSVIKKD-NSHDSACASA-N	0	3	302.159	2.407	10	0		DEAEHN
CN(CCNC(=O)c1cc(N)c(Cl)c(Cl)c1)C1CC1	ZINC000061992403	184200436	/nfs/dbraw/zinc/20/04/36/184200436.db2.gz	WYTVJFUGNZFXQD-UHFFFAOYSA-N	0	3	302.205	2.400	10	0		DEAEHN
C[C@H](C(=O)N(C)[C@@H](C)c1ccccc1Cl)N1CCNCC1	ZINC000062028180	184202280	/nfs/dbraw/zinc/20/22/80/184202280.db2.gz	NVXFJIJOBXMQLB-QWHCGFSZSA-N	0	3	309.841	2.153	10	0		DEAEHN
C[C@@H]1NC(=S)N(C[C@@H]2CCCCN2Cc2ccccc2)C1=O	ZINC000062427276	184235627	/nfs/dbraw/zinc/23/56/27/184235627.db2.gz	MFFDYRUZQZYPEZ-ZFWWWQNUSA-N	0	3	317.458	2.146	10	0		DEAEHN
CN(C)[C@H](C(=O)NCCc1ncc2ccccn21)c1ccccc1	ZINC000062509291	184240514	/nfs/dbraw/zinc/24/05/14/184240514.db2.gz	NKHMBSBEVJWRIZ-SFHVURJKSA-N	0	3	322.412	2.296	10	0		DEAEHN
COCCNCc1cc(Cl)ccc1O[C@@H](C)C(=O)OC	ZINC000062731112	184251124	/nfs/dbraw/zinc/25/11/24/184251124.db2.gz	JOANPGITRPWTHX-JTQLQIEISA-N	0	3	301.770	2.016	10	0		DEAEHN
COCCNCc1cccc(Br)c1OCCOC	ZINC000062733717	184251356	/nfs/dbraw/zinc/25/13/56/184251356.db2.gz	KURUBBSOEVADHQ-UHFFFAOYSA-N	0	3	318.211	2.210	10	0		DEAEHN
CN(C)[C@H]1CCN(CC(=O)c2ccc(Br)cc2)C1	ZINC000062966537	184262776	/nfs/dbraw/zinc/26/27/76/184262776.db2.gz	ZYBPCTBFWCMCKJ-ZDUSSCGKSA-N	0	3	311.223	2.268	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)c1cc2c(s1)CN(C1CC1)C2	ZINC000065238843	184317228	/nfs/dbraw/zinc/31/72/28/184317228.db2.gz	IMBABAIXUPGHJC-CQSZACIVSA-N	0	3	319.474	2.440	10	0		DEAEHN
CCNCC(=O)Nc1cccc(C(=O)NCc2ccccc2)c1	ZINC000066225776	184397711	/nfs/dbraw/zinc/39/77/11/184397711.db2.gz	KLUSTHZKQMHFQD-UHFFFAOYSA-N	0	3	311.385	2.165	10	0		DEAEHN
CNc1snc(C)c1C(=O)N[C@H](C)CN1CCCCCC1	ZINC000185427168	207365484	/nfs/dbraw/zinc/36/54/84/207365484.db2.gz	PEPBJOZSFBRHKS-LLVKDONJSA-N	0	3	310.467	2.488	10	0		DEAEHN
CC(=O)N1CC[C@@H](NCCc2nc(C)no2)c2ccccc2C1	ZINC000538713746	285052220	/nfs/dbraw/zinc/05/22/20/285052220.db2.gz	IIFRKXAJBWERPP-MRXNPFEDSA-N	0	3	314.389	2.004	10	0		DEAEHN
O=C(C1CCN(CC[C@@H]2CCOC2=O)CC1)N1CCCCCC1	ZINC000120055577	195088833	/nfs/dbraw/zinc/08/88/33/195088833.db2.gz	GQOYNQKTWBUXJR-MRXNPFEDSA-N	0	3	322.449	2.054	10	0		DEAEHN
COc1ccccc1C[C@H]1CCCN1CC(=O)N1CCCC1	ZINC000120200706	195118300	/nfs/dbraw/zinc/11/83/00/195118300.db2.gz	RQMUUILCJQCTAQ-MRXNPFEDSA-N	0	3	302.418	2.325	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1cc(C)c(Cl)cc1OC	ZINC000159092786	197326931	/nfs/dbraw/zinc/32/69/31/197326931.db2.gz	YAPGYVXHMKOYGO-LLVKDONJSA-N	0	3	300.786	2.349	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)NC2CCCC2)cc(C)c1F	ZINC000159085640	197325380	/nfs/dbraw/zinc/32/53/80/197325380.db2.gz	ZUMNCGSVVDLXOP-UHFFFAOYSA-N	0	3	314.426	2.465	10	0		DEAEHN
CC[C@@H](C)CN(C)S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159067979	197323902	/nfs/dbraw/zinc/32/39/02/197323902.db2.gz	RZCDXPWGWLSPTD-SNVBAGLBSA-N	0	3	302.415	2.259	10	0		DEAEHN
COC(C)(C)CNCc1ccc(I)o1	ZINC000158953253	197313965	/nfs/dbraw/zinc/31/39/65/197313965.db2.gz	YEIMRDMNTJMJBC-UHFFFAOYSA-N	0	3	309.147	2.399	10	0		DEAEHN
CCc1ccc(NC(=O)N(CCOC)CCN(C)C)cc1F	ZINC000158896653	197309448	/nfs/dbraw/zinc/30/94/48/197309448.db2.gz	QXGCZMSMEKMXEF-UHFFFAOYSA-N	0	3	311.401	2.430	10	0		DEAEHN
CCNCc1ccccc1S(=O)(=O)N1C[C@H]2CCC[C@@H]2C1	ZINC000158767114	197299954	/nfs/dbraw/zinc/29/99/54/197299954.db2.gz	ZKUQYBIMTCPBLV-HUUCEWRRSA-N	0	3	308.447	2.217	10	0		DEAEHN
COc1cnn(CCN(C)C)c1[C@@H](O)c1cc(C)c(C)s1	ZINC000158754140	197298723	/nfs/dbraw/zinc/29/87/23/197298723.db2.gz	XEMORUDEGCXKFC-HNNXBMFYSA-N	0	3	309.435	2.213	10	0		DEAEHN
CC1(C)CNC[C@@H](COc2nc(Br)cs2)O1	ZINC000158631325	197290016	/nfs/dbraw/zinc/29/00/16/197290016.db2.gz	VRDRZHWPMXZBDE-ZETCQYMHSA-N	0	3	307.213	2.051	10	0		DEAEHN
C[C@@H]1C[C@@H](Nc2nc3c(Br)cccn3n2)CCN1C	ZINC000158439187	197272466	/nfs/dbraw/zinc/27/24/66/197272466.db2.gz	BZIBQFXSHZBHIF-ZJUUUORDSA-N	0	3	324.226	2.386	10	0		DEAEHN
C[C@H]1C[C@@H](Nc2nc3c(Br)cccn3n2)CCN1C	ZINC000158439316	197271772	/nfs/dbraw/zinc/27/17/72/197271772.db2.gz	BZIBQFXSHZBHIF-UWVGGRQHSA-N	0	3	324.226	2.386	10	0		DEAEHN
CC[C@@H](N)CS(=O)(=O)Cc1cccc(F)c1Br	ZINC000157998419	197233946	/nfs/dbraw/zinc/23/39/46/197233946.db2.gz	YWHVUJLUOGEITF-SECBINFHSA-N	0	3	324.215	2.240	10	0		DEAEHN
CCCNc1nnc(C(=O)N[C@@H](CC(C)C)CN(C)C)s1	ZINC000157334929	197179963	/nfs/dbraw/zinc/17/99/63/197179963.db2.gz	YDHAGGRXOAJASB-NSHDSACASA-N	0	3	313.471	2.066	10	0		DEAEHN
CCCNCc1c(C)oc(C)c1S(=O)(=O)N(C)CC(F)F	ZINC000157161713	197166310	/nfs/dbraw/zinc/16/63/10/197166310.db2.gz	ZJOALJLJQGBZOM-UHFFFAOYSA-N	0	3	324.393	2.282	10	0		DEAEHN
CSc1nsc(NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)n1	ZINC000157077812	197159718	/nfs/dbraw/zinc/15/97/18/197159718.db2.gz	ORFIRFDLPIEFLO-BDAKNGLRSA-N	0	3	315.468	2.206	10	0		DEAEHN
CSC(C)(C)CNS(=O)(=O)c1cccc([C@H](C)N)c1	ZINC000156873612	197146554	/nfs/dbraw/zinc/14/65/54/197146554.db2.gz	UVFXZGUYNPPEDG-JTQLQIEISA-N	0	3	302.465	2.126	10	0		DEAEHN
CC(C)N1CCCC[C@@H]1C(=O)N1CCC(Cn2cccn2)CC1	ZINC000156675005	197132563	/nfs/dbraw/zinc/13/25/63/197132563.db2.gz	HBAGSMXWKVMCNO-QGZVFWFLSA-N	0	3	318.465	2.385	10	0		DEAEHN
Cc1csc(NC(=O)CN[C@@H]2CCCC23CCOCC3)n1	ZINC000558628981	291897041	/nfs/dbraw/zinc/89/70/41/291897041.db2.gz	DSNKOBWAFLFOHF-GFCCVEGCSA-N	0	3	309.435	2.329	10	0		DEAEHN
CCn1nc(C)c(Br)c1C[C@H](N)c1ccnc(C)n1	ZINC000156502295	197117969	/nfs/dbraw/zinc/11/79/69/197117969.db2.gz	VLPVRVYPTDNROJ-JTQLQIEISA-N	0	3	324.226	2.315	10	0		DEAEHN
CC(C)Cc1ccc([C@@H](C)C(=O)NC[C@@](C)(O)CN(C)C)cc1	ZINC000156107558	197087041	/nfs/dbraw/zinc/08/70/41/197087041.db2.gz	MJOIYSDXRUCCIA-DNVCBOLYSA-N	0	3	320.477	2.417	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccccc1CN)[S@](=O)c1cccs1	ZINC000155971064	197078438	/nfs/dbraw/zinc/07/84/38/197078438.db2.gz	WWWZUHBMIRATLO-WVDJIFEKSA-N	0	3	308.428	2.342	10	0		DEAEHN
C[C@@H](C(=O)Nc1cccc(CN)c1)[S@](=O)c1cccs1	ZINC000155970630	197078119	/nfs/dbraw/zinc/07/81/19/197078119.db2.gz	DJOVQBNJWNYJCZ-WVDJIFEKSA-N	0	3	308.428	2.342	10	0		DEAEHN
Cc1cc2c(cc1C)O[C@H](C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C)C2	ZINC000155427548	197054317	/nfs/dbraw/zinc/05/43/17/197054317.db2.gz	DGQGPIYRKMNENP-ZVZYQTTQSA-N	0	3	316.445	2.452	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC[C@H]2c2c(C)n[nH]c2C)C1	ZINC000246153829	285230213	/nfs/dbraw/zinc/23/02/13/285230213.db2.gz	TVXANLIUNJKRRC-CABCVRRESA-N	0	3	319.453	2.357	10	0		DEAEHN
Cc1nnc(CNC(=O)c2cccc(CN3CCCC3)c2)s1	ZINC000543743399	285313897	/nfs/dbraw/zinc/31/38/97/285313897.db2.gz	FXCLPVICQYKGJB-UHFFFAOYSA-N	0	3	316.430	2.372	10	0		DEAEHN
CCN1CCO[C@H]2CN(Cc3ccc4ccccc4n3)C[C@H]2C1	ZINC000249703362	257107080	/nfs/dbraw/zinc/10/70/80/257107080.db2.gz	ZMNRIPSMZSNEHK-APWZRJJASA-N	0	3	311.429	2.387	10	0		DEAEHN
O=S(=O)(c1cccc(F)c1)N1CC[C@@H]2[C@@H]1CCN2CC1CC1	ZINC000247296582	257120029	/nfs/dbraw/zinc/12/00/29/257120029.db2.gz	CPDHBGOWOVJXSR-CVEARBPZSA-N	0	3	324.421	2.073	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1cc(-c2ccncc2)on1	ZINC000120964531	195273634	/nfs/dbraw/zinc/27/36/34/195273634.db2.gz	UPDGNIXFQGUBEY-AWEZNQCLSA-N	0	3	316.405	2.443	10	0		DEAEHN
C[C@@H](CN1CCCC1)N1C(=O)C2(CC2)N[C@H]1c1cccs1	ZINC000121955100	195380771	/nfs/dbraw/zinc/38/07/71/195380771.db2.gz	BRECEUSTWUKIRJ-GXTWGEPZSA-N	0	3	305.447	2.195	10	0		DEAEHN
Cc1nc(Br)cc(OC[C@H]2CCCCN2C)n1	ZINC000123071293	195539564	/nfs/dbraw/zinc/53/95/64/195539564.db2.gz	MOCODOGTDYSLHI-SNVBAGLBSA-N	0	3	300.200	2.411	10	0		DEAEHN
C[C@@H](O)C(C)(C)NCc1ccc(I)o1	ZINC000128139680	195938948	/nfs/dbraw/zinc/93/89/48/195938948.db2.gz	KCJYVRNICMPHMX-SSDOTTSWSA-N	0	3	309.147	2.133	10	0		DEAEHN
O=C(NC[C@@H](CO)C1CC1)C1CCN(Cc2ccccc2)CC1	ZINC000359778411	133144110	/nfs/dbraw/zinc/14/41/10/133144110.db2.gz	ODIVJAWIYUIKTD-SFHVURJKSA-N	0	3	316.445	2.033	10	0		DEAEHN
CN1CCC(CC(=O)NCc2nnc(C(C)(C)C)s2)CC1	ZINC000362895143	133257648	/nfs/dbraw/zinc/25/76/48/133257648.db2.gz	JGZMIFLWYVDBFV-UHFFFAOYSA-N	0	3	310.467	2.184	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N1CC[C@H](N2CCCC2)C1	ZINC000187887963	145004449	/nfs/dbraw/zinc/00/44/49/145004449.db2.gz	KIOYYWPZXDAEKG-HNNXBMFYSA-N	0	3	321.396	2.214	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1ccc(-n2cccn2)cc1	ZINC000188720399	145016375	/nfs/dbraw/zinc/01/63/75/145016375.db2.gz	NXUSOJSAVPCUDB-UHFFFAOYSA-N	0	3	318.380	2.406	10	0		DEAEHN
FC(F)COCCN1CCC(c2nnc3ccccn32)CC1	ZINC000189276744	145024913	/nfs/dbraw/zinc/02/49/13/145024913.db2.gz	XWSSIMIUCUXGEJ-UHFFFAOYSA-N	0	3	310.348	2.190	10	0		DEAEHN
O=C1O[C@H](CN2CC[C@H](Oc3cccnc3)C2)CC12CCC2	ZINC000192078756	145070850	/nfs/dbraw/zinc/07/08/50/145070850.db2.gz	HPXGJGKAUMHQLG-GJZGRUSLSA-N	0	3	302.374	2.021	10	0		DEAEHN
C[C@H](CCc1cccn1C)NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000246399217	145101788	/nfs/dbraw/zinc/10/17/88/145101788.db2.gz	RKOKKDGDHZQEKN-HLLBOEOZSA-N	0	3	320.481	2.470	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N2CCC(c3cc[nH]n3)CC2)C1	ZINC000246452798	145103726	/nfs/dbraw/zinc/10/37/26/145103726.db2.gz	OUKWTNIVQJHJKF-CZUORRHYSA-N	0	3	319.453	2.027	10	0		DEAEHN
Cc1ccccc1Cc1noc(CN2CCN3CCC[C@H]3C2)n1	ZINC000246480184	145104455	/nfs/dbraw/zinc/10/44/55/145104455.db2.gz	HPKSBHLUCFXZKW-INIZCTEOSA-N	0	3	312.417	2.249	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCO[C@@H](c2cccs2)C1	ZINC000246652630	145109140	/nfs/dbraw/zinc/10/91/40/145109140.db2.gz	CRTULYPVQFNUNX-ZIAGYGMSSA-N	0	3	323.462	2.315	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2C[C@H]3CCCN3C[C@H]2C)c(C)c1	ZINC000246837266	145116299	/nfs/dbraw/zinc/11/62/99/145116299.db2.gz	CXCJVRJOXBPWMZ-HUUCEWRRSA-N	0	3	308.447	2.161	10	0		DEAEHN
Cc1ccc(C)c(S(=O)(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000247029084	145124090	/nfs/dbraw/zinc/12/40/90/145124090.db2.gz	GGIHQRMQDBNPFR-HUUCEWRRSA-N	0	3	308.447	2.161	10	0		DEAEHN
CCN1CC[C@@H](N(C)C(=O)c2cc(C(C)=O)cn2C)[C@@H](C)C1	ZINC000247564902	145141480	/nfs/dbraw/zinc/14/14/80/145141480.db2.gz	ZWHMWZNEVWNQBI-SWLSCSKDSA-N	0	3	305.422	2.030	10	0		DEAEHN
C[C@@H]1CC[C@H](C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)O1	ZINC000248226886	145149825	/nfs/dbraw/zinc/14/98/25/145149825.db2.gz	PTFGBKQSRPMNKL-MUIFIZLQSA-N	0	3	302.418	2.333	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCC[C@@H](n2ccnc2CC)C1	ZINC000248662232	145163281	/nfs/dbraw/zinc/16/32/81/145163281.db2.gz	YDGKGCBBKVBBHY-CVEARBPZSA-N	0	3	309.454	2.260	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](NC[C@@H]1CN(C)CCO1)CCS2	ZINC000248775380	145166990	/nfs/dbraw/zinc/16/69/90/145166990.db2.gz	AZMXPCDQMABJFZ-HIFRSBDPSA-N	0	3	308.447	2.152	10	0		DEAEHN
COCCCCNC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000248855821	145170629	/nfs/dbraw/zinc/17/06/29/145170629.db2.gz	PGYZSISRXPZYRA-DOTOQJQBSA-N	0	3	319.449	2.233	10	0		DEAEHN
COCCCCNC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000248855826	145170995	/nfs/dbraw/zinc/17/09/95/145170995.db2.gz	PGYZSISRXPZYRA-NVXWUHKLSA-N	0	3	319.449	2.233	10	0		DEAEHN
Cc1nc(C[C@H]2CCCN(C[C@H]3CC4(CCC4)C(=O)O3)C2)no1	ZINC000248915405	145173466	/nfs/dbraw/zinc/17/34/66/145173466.db2.gz	ZNZSCOQCMJXUDK-ZIAGYGMSSA-N	0	3	319.405	2.118	10	0		DEAEHN
Cc1csc([C@H]2CCCN(CCN3CCO[C@@H](C)C3)C2)n1	ZINC000249268418	145181863	/nfs/dbraw/zinc/18/18/63/145181863.db2.gz	IQZDQZVADNONPR-GJZGRUSLSA-N	0	3	309.479	2.352	10	0		DEAEHN
Fc1ccc(-c2nc(CN3CCN4CCC[C@H]4C3)no2)c(F)c1	ZINC000249316720	145182511	/nfs/dbraw/zinc/18/25/11/145182511.db2.gz	FOVBVRBCIZTHBX-LBPRGKRZSA-N	0	3	320.343	2.295	10	0		DEAEHN
CN(CCN1CCC[C@]12CCOC2=O)Cc1ccc(F)cc1	ZINC000249527868	145185911	/nfs/dbraw/zinc/18/59/11/145185911.db2.gz	AIUSAPWOIYGUHX-QGZVFWFLSA-N	0	3	306.381	2.039	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC([C@H]3CCCO3)CC2)C1	ZINC000251542674	145194829	/nfs/dbraw/zinc/19/48/29/145194829.db2.gz	DSSZDLPLVPSTNJ-HZPDHXFCSA-N	0	3	309.454	2.071	10	0		DEAEHN
C[C@@H]1CN(CCC(=O)c2ccc(F)cc2)C[C@H]1N1CCOCC1	ZINC000252734102	145199778	/nfs/dbraw/zinc/19/97/78/145199778.db2.gz	SIGOMSCWPBBEKQ-RHSMWYFYSA-N	0	3	320.408	2.051	10	0		DEAEHN
CC[C@@H]1CN(C/C=C\c2ccccc2OC)CCN1C[C@H](C)O	ZINC000255030228	145203166	/nfs/dbraw/zinc/20/31/66/145203166.db2.gz	BBAASKIBXDFEQK-NKAACUPNSA-N	0	3	318.461	2.485	10	0		DEAEHN
COc1ccc(CN2CCNC[C@@H]2c2cccnc2)cc1F	ZINC000261635858	145212122	/nfs/dbraw/zinc/21/21/22/145212122.db2.gz	FFXWSOPXOHZHMH-MRXNPFEDSA-N	0	3	301.365	2.376	10	0		DEAEHN
O=C(c1cnc(C2CC2)[nH]1)N1CCNC[C@H]1c1cccc(F)c1	ZINC000261696214	145217847	/nfs/dbraw/zinc/21/78/47/145217847.db2.gz	CQVQGAASXDRNON-HNNXBMFYSA-N	0	3	314.364	2.213	10	0		DEAEHN
CCC(CC)(CNC(=O)C1(N)CCOCC1)c1ccccc1	ZINC000261792490	145226840	/nfs/dbraw/zinc/22/68/40/145226840.db2.gz	IHUILSXMCWOJCP-UHFFFAOYSA-N	0	3	304.434	2.369	10	0		DEAEHN
c1cn(-c2ccc(CN3CCNC[C@H]3c3cccnc3)cc2)cn1	ZINC000261802064	145227998	/nfs/dbraw/zinc/22/79/98/145227998.db2.gz	QYQSMTWTAMKBQF-IBGZPJMESA-N	0	3	319.412	2.414	10	0		DEAEHN
CC(C)n1cc2cc(NC(=O)[C@@H](N)C3CCOCC3)ccc2n1	ZINC000261868554	145235411	/nfs/dbraw/zinc/23/54/11/145235411.db2.gz	SUUOITFOOBSBHA-INIZCTEOSA-N	0	3	316.405	2.310	10	0		DEAEHN
C[C@H]1CN(C(=O)C2(N)CCOCC2)CC[C@H]1c1ccccc1	ZINC000261900761	145239717	/nfs/dbraw/zinc/23/97/17/145239717.db2.gz	RQWRESKDXQFPOG-GOEBONIOSA-N	0	3	302.418	2.147	10	0		DEAEHN
NC1(C(=O)Nc2cccc(CC(F)(F)F)c2)CCOCC1	ZINC000261919548	145241742	/nfs/dbraw/zinc/24/17/42/145241742.db2.gz	UURZQXJIFKBRMY-UHFFFAOYSA-N	0	3	302.296	2.238	10	0		DEAEHN
COc1ccc(NC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)c(C)c1	ZINC000261937583	145244143	/nfs/dbraw/zinc/24/41/43/145244143.db2.gz	UGIYWJVFPSREHD-DHSIGJKJSA-N	0	3	318.417	2.475	10	0		DEAEHN
NC1(C(=O)NCCc2c(Cl)cccc2Cl)CCOCC1	ZINC000261939375	145244828	/nfs/dbraw/zinc/24/48/28/145244828.db2.gz	XDVRMRWGTFUENM-UHFFFAOYSA-N	0	3	317.216	2.160	10	0		DEAEHN
N[C@H](C(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F)C1CCOCC1	ZINC000261940368	145244833	/nfs/dbraw/zinc/24/48/33/145244833.db2.gz	JHRRVEQQQINXQZ-UPJWGTAASA-N	0	3	322.371	2.225	10	0		DEAEHN
COc1ccccc1[C@@H]1CNCCN1Cc1nccn1C(F)F	ZINC000262205179	145269703	/nfs/dbraw/zinc/26/97/03/145269703.db2.gz	KUYHSIBXOGUWLD-ZDUSSCGKSA-N	0	3	322.359	2.433	10	0		DEAEHN
CC(C)(C)NC(=O)CN1CCNC[C@H]1c1ccccc1Cl	ZINC000262289948	145273819	/nfs/dbraw/zinc/27/38/19/145273819.db2.gz	VWYKBXNLLMWZSR-AWEZNQCLSA-N	0	3	309.841	2.201	10	0		DEAEHN
CN(C)C(=O)c1cccc(NC(=O)[C@H]2NCCCC2(C)C)c1	ZINC000262448651	145284253	/nfs/dbraw/zinc/28/42/53/145284253.db2.gz	HOBCSARVVGYFBD-CQSZACIVSA-N	0	3	303.406	2.105	10	0		DEAEHN
O=C(COc1cccc(F)c1)NC[C@@H]1NCCc2ccccc21	ZINC000262473953	145286948	/nfs/dbraw/zinc/28/69/48/145286948.db2.gz	YQFYFHIRQMFXAG-KRWDZBQOSA-N	0	3	314.360	2.208	10	0		DEAEHN
C[C@@H](NC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C)c1ccccc1	ZINC000262587097	145295480	/nfs/dbraw/zinc/29/54/80/145295480.db2.gz	ZWJPMQRMFMRBNS-LJGDNWOOSA-N	0	3	302.418	2.396	10	0		DEAEHN
COc1ccccc1[C@@H](C)Cc1nc([C@H]2CNCCN2C)no1	ZINC000263134804	145328536	/nfs/dbraw/zinc/32/85/36/145328536.db2.gz	BYPHWRUWFIKEJZ-GXTWGEPZSA-N	0	3	316.405	2.001	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(/C=C/c2c(F)cccc2F)n1	ZINC000263179020	145332781	/nfs/dbraw/zinc/33/27/81/145332781.db2.gz	GNLMYTDYAMMADX-GFUIURDCSA-N	0	3	306.316	2.094	10	0		DEAEHN
CC[C@@H](C)Oc1ccc(-c2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263185046	145333677	/nfs/dbraw/zinc/33/36/77/145333677.db2.gz	HGDQXUBQUOYBPJ-DOMZBBRYSA-N	0	3	316.405	2.490	10	0		DEAEHN
Cc1ccccc1[C@@H](C)Cc1nc([C@@H]2CNCCN2C)no1	ZINC000263201419	145335678	/nfs/dbraw/zinc/33/56/78/145335678.db2.gz	JCISNKGATXQNAQ-ZFWWWQNUSA-N	0	3	300.406	2.300	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(CCSc2ccccc2F)n1	ZINC000263213587	145336569	/nfs/dbraw/zinc/33/65/69/145336569.db2.gz	KNUYAIWILGPAGW-GFCCVEGCSA-N	0	3	322.409	2.120	10	0		DEAEHN
c1ccc(OCC2CC2)c(CNCCN2CCCOCC2)c1	ZINC000349408828	146377234	/nfs/dbraw/zinc/37/72/34/146377234.db2.gz	QINMLXONOPRGGT-UHFFFAOYSA-N	0	3	304.434	2.287	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCCc1ccc2c(c1)CCO2	ZINC000358268850	147102537	/nfs/dbraw/zinc/10/25/37/147102537.db2.gz	YSCDSBSLQZEXPR-MRXNPFEDSA-N	0	3	302.418	2.155	10	0		DEAEHN
CCCN(C)CC(=O)NCCc1ccccc1Br	ZINC000358599402	147163713	/nfs/dbraw/zinc/16/37/13/147163713.db2.gz	VPLZIMMBOXNVAK-UHFFFAOYSA-N	0	3	313.239	2.450	10	0		DEAEHN
COc1cccc(CNC[C@H]2CCC3(CCOCC3)[C@H]2O)c1F	ZINC000374719584	148282402	/nfs/dbraw/zinc/28/24/02/148282402.db2.gz	VVTZXGZMVXYHOM-PBHICJAKSA-N	0	3	323.408	2.492	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c(C)c1	ZINC000246266562	292183347	/nfs/dbraw/zinc/18/33/47/292183347.db2.gz	USOJKSONJWFZFQ-HUUCEWRRSA-N	0	3	310.463	2.310	10	0		DEAEHN
COc1cccc(N2CC[C@@H](CNCc3c(C)cnn3C)C2)c1	ZINC000375683871	148399909	/nfs/dbraw/zinc/39/99/09/148399909.db2.gz	AYTIWZXOZVXOQW-HNNXBMFYSA-N	0	3	314.433	2.353	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@H](C)c1ccccc1C	ZINC000111789306	401723827	/nfs/dbraw/zinc/72/38/27/401723827.db2.gz	CLKCJFVWCABAAE-CVEARBPZSA-N	0	3	319.449	2.466	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CCCC(C)(C)CC1	ZINC000074167418	401731700	/nfs/dbraw/zinc/73/17/00/401731700.db2.gz	NINDQUFTYKWRKA-HNNXBMFYSA-N	0	3	311.470	2.319	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)Nc3cccnc3)cc2)CC1	ZINC000074165969	401731810	/nfs/dbraw/zinc/73/18/10/401731810.db2.gz	LRWCMQHXGIOTOI-UHFFFAOYSA-N	0	3	310.401	2.476	10	0		DEAEHN
CC[C@H]1CCCCCN1C(=O)NC[C@@H](C)CN1CCN(C)CC1	ZINC000074657116	401743713	/nfs/dbraw/zinc/74/37/13/401743713.db2.gz	IPKZKQVGLKNXKM-SJORKVTESA-N	0	3	324.513	2.234	10	0		DEAEHN
CC(C)[C@@](O)(C(=O)OCC1=CCN(C)CC1)c1ccccc1	ZINC000002009045	401711735	/nfs/dbraw/zinc/71/17/35/401711735.db2.gz	VZCBERXKHILZBM-SFHVURJKSA-N	0	3	303.402	2.335	10	0		DEAEHN
CCS(=O)(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1	ZINC000111350858	401712698	/nfs/dbraw/zinc/71/26/98/401712698.db2.gz	SWMAAWWFDVWDPM-MQVJKMGUSA-N	0	3	308.447	2.121	10	0		DEAEHN
CC(C)c1nccc(N2CCCC[C@H](N3CCN(C)CC3)C2)n1	ZINC000127085341	401719961	/nfs/dbraw/zinc/71/99/61/401719961.db2.gz	BIFHZPBXCAMPKM-INIZCTEOSA-N	0	3	317.481	2.206	10	0		DEAEHN
CCOC(=O)CCCN1CCC[C@@H](c2nncn2C2CC2)C1	ZINC000129462077	401804065	/nfs/dbraw/zinc/80/40/65/401804065.db2.gz	XGAUOVURRWUQTB-CYBMUJFWSA-N	0	3	306.410	2.136	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)CCn2cnc3ccccc32)CCN1C	ZINC000127904518	401755039	/nfs/dbraw/zinc/75/50/39/401755039.db2.gz	FEXQLWLCEIQCEA-GJZGRUSLSA-N	0	3	314.433	2.368	10	0		DEAEHN
CCOc1cc(C(=O)NCCCN(C)CCOC)ccc1C	ZINC000113148270	401768001	/nfs/dbraw/zinc/76/80/01/401768001.db2.gz	CBNMSFZPNLFFHT-UHFFFAOYSA-N	0	3	308.422	2.092	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)Cc1coc(-c2ccc(F)cc2)n1	ZINC000113185606	401769108	/nfs/dbraw/zinc/76/91/08/401769108.db2.gz	UOCWWPYSXVZWCM-HNNXBMFYSA-N	0	3	317.364	2.234	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N2CC[C@@H]3OCCC[C@@H]3C2)cc1	ZINC000128295950	401770504	/nfs/dbraw/zinc/77/05/04/401770504.db2.gz	SNGGHXFCWVONKM-SJORKVTESA-N	0	3	302.418	2.389	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(C(F)(F)F)nc1	ZINC000113230930	401771898	/nfs/dbraw/zinc/77/18/98/401771898.db2.gz	FYKHYLISRUAHDU-ZYHUDNBSSA-N	0	3	313.323	2.409	10	0		DEAEHN
CC(C)(C)NC(=O)CN1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000076107906	401782898	/nfs/dbraw/zinc/78/28/98/401782898.db2.gz	DBVUSLRVJMBHAJ-HOTGVXAUSA-N	0	3	304.434	2.489	10	0		DEAEHN
CCN(CC)CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2	ZINC000077330624	401811094	/nfs/dbraw/zinc/81/10/94/401811094.db2.gz	OQNFAAWKLYSWAG-AWEZNQCLSA-N	0	3	304.390	2.421	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)c1cc(C(C)(C)C)nn1C	ZINC000077639392	401822792	/nfs/dbraw/zinc/82/27/92/401822792.db2.gz	QOQAOZHVBCKKCE-ZDUSSCGKSA-N	0	3	306.454	2.322	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)NC[C@@H]1CCCC[C@@H]1O	ZINC000077837804	401834478	/nfs/dbraw/zinc/83/44/78/401834478.db2.gz	NBZWCXRDTINTBU-XHSDSOJGSA-N	0	3	311.470	2.101	10	0		DEAEHN
Cc1cccnc1[C@@H](NC(=O)N1CC[C@H](N(C)C)C1)C(C)C	ZINC000115840197	401838318	/nfs/dbraw/zinc/83/83/18/401838318.db2.gz	FGKIXAUOYXTWMB-GJZGRUSLSA-N	0	3	304.438	2.433	10	0		DEAEHN
Cc1cc(C)cc([C@@H](C)NC(=O)N2CCO[C@@H](CN(C)C)C2)c1	ZINC000117047453	401867928	/nfs/dbraw/zinc/86/79/28/401867928.db2.gz	AKBIHHPZVSVTTM-WBVHZDCISA-N	0	3	319.449	2.336	10	0		DEAEHN
C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1)[C@H]1CCCO1	ZINC000079487908	401874054	/nfs/dbraw/zinc/87/40/54/401874054.db2.gz	SGOCRGPKHOKVHK-NVXWUHKLSA-N	0	3	319.449	2.327	10	0		DEAEHN
CCOC(=O)CCCCN1CCC(N(C)c2cccnn2)CC1	ZINC000132948906	401876850	/nfs/dbraw/zinc/87/68/50/401876850.db2.gz	ZKQBDBUTEDQVNQ-UHFFFAOYSA-N	0	3	320.437	2.111	10	0		DEAEHN
C[C@@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)[C@H]1CCCO1	ZINC000079619971	401877895	/nfs/dbraw/zinc/87/78/95/401877895.db2.gz	CTYAAGMOLNSYIZ-HUUCEWRRSA-N	0	3	311.470	2.317	10	0		DEAEHN
COCCN(Cc1ccccc1C)C[C@H](O)COCC(C)C	ZINC000036099870	401902615	/nfs/dbraw/zinc/90/26/15/401902615.db2.gz	SNLYQTHCCMNWFX-SFHVURJKSA-N	0	3	309.450	2.477	10	0		DEAEHN
O=C(Nc1ccc(SC2CCCC2)cc1)[C@@H]1C[C@H](O)CN1	ZINC000037033596	401910097	/nfs/dbraw/zinc/91/00/97/401910097.db2.gz	DWOSQUUYGCRDTN-WFASDCNBSA-N	0	3	306.431	2.383	10	0		DEAEHN
OC[C@H](NC[C@@H]1CCCO1)c1cccc(Br)c1	ZINC000038114864	401923187	/nfs/dbraw/zinc/92/31/87/401923187.db2.gz	TUZCNJSFTMDPRD-STQMWFEESA-N	0	3	300.196	2.251	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccc(OCC)c(OC)c1)N(C)C	ZINC000135863180	401953998	/nfs/dbraw/zinc/95/39/98/401953998.db2.gz	IKBRLCLWCODJPV-AWEZNQCLSA-N	0	3	308.422	2.440	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccc(OCC)c(OC)c1)N(C)C	ZINC000135863216	401954137	/nfs/dbraw/zinc/95/41/37/401954137.db2.gz	IKBRLCLWCODJPV-CQSZACIVSA-N	0	3	308.422	2.440	10	0		DEAEHN
CCN(CC)C(=O)[C@H]1CCCN1CCCCn1ccnc1C	ZINC000119574899	401959715	/nfs/dbraw/zinc/95/97/15/401959715.db2.gz	LWSPUDVNDWKHJD-MRXNPFEDSA-N	0	3	306.454	2.305	10	0		DEAEHN
CN(C)CCn1ccc(NC(=O)c2scnc2C2CC2)n1	ZINC000089785154	401963236	/nfs/dbraw/zinc/96/32/36/401963236.db2.gz	RELAFEDUHUYEFK-UHFFFAOYSA-N	0	3	305.407	2.031	10	0		DEAEHN
CCCNC(=O)c1cccc(CNC(=O)[C@H](CCC)N(C)C)c1	ZINC000136354528	401966361	/nfs/dbraw/zinc/96/63/61/401966361.db2.gz	YEELLYYEMGHPRH-INIZCTEOSA-N	0	3	319.449	2.173	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)[C@@H]1CC(=O)Nc2ccccc21	ZINC000046860852	401974180	/nfs/dbraw/zinc/97/41/80/401974180.db2.gz	BGEFMBHPDRVNAT-UKRRQHHQSA-N	0	3	315.417	2.103	10	0		DEAEHN
CCC(CC)CNC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000091856297	401998446	/nfs/dbraw/zinc/99/84/46/401998446.db2.gz	RZMWVKKKCMUUST-KRWDZBQOSA-N	0	3	324.513	2.234	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1sc(COC)nc1C	ZINC000136941177	401976367	/nfs/dbraw/zinc/97/63/67/401976367.db2.gz	HHELGXQBCDHFKM-QWHCGFSZSA-N	0	3	323.462	2.297	10	0		DEAEHN
C[C@@H](NC(=O)N1CCN(C2CCCCC2)CC1)[C@H]1CCCO1	ZINC000136968736	401976630	/nfs/dbraw/zinc/97/66/30/401976630.db2.gz	ZUTWQXQXXWZFRH-GDBMZVCRSA-N	0	3	309.454	2.214	10	0		DEAEHN
O=C(NCc1cscn1)N1CCN(C2CCCCC2)CC1	ZINC000138067402	401986156	/nfs/dbraw/zinc/98/61/56/401986156.db2.gz	FAGWHEGPPHLKPP-UHFFFAOYSA-N	0	3	308.451	2.303	10	0		DEAEHN
CN(c1cccnn1)C1CCN(Cc2ccc3c[nH]nc3c2)CC1	ZINC000120339571	401987646	/nfs/dbraw/zinc/98/76/46/401987646.db2.gz	HIIQEGHRZWOHJA-UHFFFAOYSA-N	0	3	322.416	2.454	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c(C)c1	ZINC000150775571	401995024	/nfs/dbraw/zinc/99/50/24/401995024.db2.gz	NJWHEPIBONSMFY-HOCLYGCPSA-N	0	3	317.433	2.087	10	0		DEAEHN
COc1ccc([C@H](C)NCCc2nc(C)no2)cc1NC(C)=O	ZINC000089518392	401950507	/nfs/dbraw/zinc/95/05/07/401950507.db2.gz	ZGBWZHDZOLVGCY-JTQLQIEISA-N	0	3	318.377	2.238	10	0		DEAEHN
Cc1cccc([C@H](C)CNC(=O)N2CCO[C@@H](CN(C)C)C2)c1	ZINC000121029060	402011518	/nfs/dbraw/zinc/01/15/18/402011518.db2.gz	HODNTLCQVDRJTE-WBVHZDCISA-N	0	3	319.449	2.071	10	0		DEAEHN
C[C@H](C(=O)N1CCCCC1)N1CC[C@H](CNc2ccccn2)C1	ZINC000151105459	402016510	/nfs/dbraw/zinc/01/65/10/402016510.db2.gz	YHUOMRNCSORCFK-HZPDHXFCSA-N	0	3	316.449	2.216	10	0		DEAEHN
Cc1ccc([C@H](CNC(=O)CCc2ccnn2C)N(C)C)cc1	ZINC000121142213	402017675	/nfs/dbraw/zinc/01/76/75/402017675.db2.gz	AKIBDRXUQFCELY-KRWDZBQOSA-N	0	3	314.433	2.080	10	0		DEAEHN
CN1CCC(C(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2)CC1	ZINC000121194527	402019886	/nfs/dbraw/zinc/01/98/86/402019886.db2.gz	CPEBJVOYDKLTJW-CYBMUJFWSA-N	0	3	323.387	2.002	10	0		DEAEHN
COC(=O)c1sc(N2C[C@H]3CCCN3C[C@H]2C)nc1Cl	ZINC000094463915	402022293	/nfs/dbraw/zinc/02/22/93/402022293.db2.gz	BEKPCNIKTFUELD-RKDXNWHRSA-N	0	3	315.826	2.256	10	0		DEAEHN
Cc1sc2nc(CN3CCCN(C)CC3)nc(N)c2c1C	ZINC000049933681	402022549	/nfs/dbraw/zinc/02/25/49/402022549.db2.gz	LXAWITROGHPJLP-UHFFFAOYSA-N	0	3	305.451	2.028	10	0		DEAEHN
CCN1CCN(C[C@H](C)CNC(=O)NC(C)(CC)CC)CC1	ZINC000121254421	402023329	/nfs/dbraw/zinc/02/33/29/402023329.db2.gz	FLZZHKXCTJLDLW-OAHLLOKOSA-N	0	3	312.502	2.138	10	0		DEAEHN
O[C@@H](CN1CC[C@H](COCc2ccccc2)C1)C(F)(F)F	ZINC000121380798	402032226	/nfs/dbraw/zinc/03/22/26/402032226.db2.gz	HVQGVJNITXBJSQ-KBPBESRZSA-N	0	3	303.324	2.448	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCc2csc(-c3ccco3)n2)C1	ZINC000121451498	402036631	/nfs/dbraw/zinc/03/66/31/402036631.db2.gz	OGPADCSSBLXKAA-LBPRGKRZSA-N	0	3	320.418	2.249	10	0		DEAEHN
Cc1noc(C)c1[C@@H](C)CNC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000151480803	402038958	/nfs/dbraw/zinc/03/89/58/402038958.db2.gz	BLVMYGAGMYQDJM-WFASDCNBSA-N	0	3	318.421	2.051	10	0		DEAEHN
CN(CCC(=O)NCc1ccccc1Cl)C[C@@H]1CCCO1	ZINC000052103017	402039080	/nfs/dbraw/zinc/03/90/80/402039080.db2.gz	SOZZVSUCZQXOCB-AWEZNQCLSA-N	0	3	310.825	2.457	10	0		DEAEHN
C[C@H](NCc1ccnn1C)c1ccc(OCCN(C)C)cc1	ZINC000152174024	402079778	/nfs/dbraw/zinc/07/97/78/402079778.db2.gz	RNVPMVPGRSICDI-AWEZNQCLSA-N	0	3	302.422	2.211	10	0		DEAEHN
COc1cccc(OCC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000123008558	402105398	/nfs/dbraw/zinc/10/53/98/402105398.db2.gz	GIPDBMSVHPKOEJ-KGLIPLIRSA-N	0	3	306.406	2.015	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cc3ccccc3oc2=O)CCN1C	ZINC000123177693	402113951	/nfs/dbraw/zinc/11/39/51/402113951.db2.gz	MVAKSTQFQXNIJE-TZMCWYRMSA-N	0	3	314.385	2.348	10	0		DEAEHN
CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1nncs1	ZINC000065984216	402128796	/nfs/dbraw/zinc/12/87/96/402128796.db2.gz	SHYQPYWKVWVBLO-UHFFFAOYSA-N	0	3	323.397	2.273	10	0		DEAEHN
CC[C@@H](O)CN1CCN(Cc2cc(C)c(OC)c(C)c2)CC1	ZINC000123518114	402132010	/nfs/dbraw/zinc/13/20/10/402132010.db2.gz	XXZORDJFDLRBQF-QGZVFWFLSA-N	0	3	306.450	2.201	10	0		DEAEHN
CCN(CCNC(=O)N1CCO[C@H](c2ccsc2)C1)C1CC1	ZINC000123802797	402146753	/nfs/dbraw/zinc/14/67/53/402146753.db2.gz	CUKCNLDMWAYBPU-HNNXBMFYSA-N	0	3	323.462	2.315	10	0		DEAEHN
CCCCOC(=O)CCN1CCC[C@H](Cc2noc(C)n2)C1	ZINC000103230645	402182198	/nfs/dbraw/zinc/18/21/98/402182198.db2.gz	NUOCSXGPHCDNFO-CQSZACIVSA-N	0	3	309.410	2.366	10	0		DEAEHN
COc1ccc(CN2CCC(N3CCO[C@@H](C)C3)CC2)cc1	ZINC000124123432	402164994	/nfs/dbraw/zinc/16/49/94/402164994.db2.gz	LZZIYKIOYNAVIA-HNNXBMFYSA-N	0	3	304.434	2.380	10	0		DEAEHN
Cc1ccccc1[C@H](C)NCC(=O)NC(=O)NCC(F)(F)F	ZINC000102683864	402170398	/nfs/dbraw/zinc/17/03/98/402170398.db2.gz	WHCDGDULTNGRJF-JTQLQIEISA-N	0	3	317.311	2.034	10	0		DEAEHN
C[C@H](OC[C@@H]1CCCCO1)C(=O)N[C@H]1CCN(C2CCCC2)C1	ZINC000106789575	402216052	/nfs/dbraw/zinc/21/60/52/402216052.db2.gz	NSGSWJGBSAZQCT-ZOBUZTSGSA-N	0	3	324.465	2.094	10	0		DEAEHN
Cc1c(CCC(=O)N[C@@H](CN(C)C)c2ccccc2)cnn1C	ZINC000125390467	402229699	/nfs/dbraw/zinc/22/96/99/402229699.db2.gz	HHNWVDDJQSREBN-KRWDZBQOSA-N	0	3	314.433	2.080	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@H]2Oc3ccccc3[C@H]2C)C1	ZINC000155700870	402264752	/nfs/dbraw/zinc/26/47/52/402264752.db2.gz	OWIRHZDBLYOESL-LGWLGOQQSA-N	0	3	302.418	2.396	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(CC(=O)NC(C)(C)CC)C1	ZINC000105896800	402210358	/nfs/dbraw/zinc/21/03/58/402210358.db2.gz	WUSIGOHINSAAAC-CQSZACIVSA-N	0	3	306.454	2.387	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@](C)(O)c1cccc(Cl)c1)N(C)C	ZINC000185076582	402322631	/nfs/dbraw/zinc/32/26/31/402322631.db2.gz	SFSSFRQIMCKLDQ-HOCLYGCPSA-N	0	3	312.841	2.394	10	0		DEAEHN
CNC(=O)c1ccc(CN2CCC[C@H](n3cc(C)cn3)C2)cc1	ZINC000109005812	402266922	/nfs/dbraw/zinc/26/69/22/402266922.db2.gz	IIDDVRNSSJQHLB-KRWDZBQOSA-N	0	3	312.417	2.388	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)Cc1cc(-c2cnn(C)c2C)no1	ZINC000184595434	402282100	/nfs/dbraw/zinc/28/21/00/402282100.db2.gz	WWSVVPMOMQUTRP-CQSZACIVSA-N	0	3	317.437	2.300	10	0		DEAEHN
CCC(C)(C)[C@@H]1CCCN1CC(=O)NC1CCN(C(C)=O)CC1	ZINC000156833770	402289218	/nfs/dbraw/zinc/28/92/18/402289218.db2.gz	HPRIBUNYCGUVAD-INIZCTEOSA-N	0	3	323.481	2.014	10	0		DEAEHN
O=C(NCCc1cc(F)ccc1F)NCCN1CCCCC1	ZINC000176371281	402303759	/nfs/dbraw/zinc/30/37/59/402303759.db2.gz	IEFLLVUKKQVFLH-UHFFFAOYSA-N	0	3	311.376	2.292	10	0		DEAEHN
Cc1cc(C(=O)CN2CCN3CCC[C@@H]3C2)c(C)n1C1CC1	ZINC000176384927	402304786	/nfs/dbraw/zinc/30/47/86/402304786.db2.gz	FLNQHADJLWMOLW-MRXNPFEDSA-N	0	3	301.434	2.403	10	0		DEAEHN
COC(=O)C1CCN(CCN(C)Cc2ccc(F)cc2)CC1	ZINC000158540157	402307618	/nfs/dbraw/zinc/30/76/18/402307618.db2.gz	SBGCNJXCYIQRLT-UHFFFAOYSA-N	0	3	308.397	2.143	10	0		DEAEHN
CO[C@@H](C)c1nc(C)c(C(=O)NC[C@@H](C)N(C)C2CC2)s1	ZINC000176438031	402309842	/nfs/dbraw/zinc/30/98/42/402309842.db2.gz	VZHSWCKFWNFPOJ-KOLCDFICSA-N	0	3	311.451	2.371	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@@H]2CCOc3ccccc32)C1	ZINC000159107475	402318055	/nfs/dbraw/zinc/31/80/55/402318055.db2.gz	NNSAHQGLKYWCNH-BMFZPTHFSA-N	0	3	302.418	2.398	10	0		DEAEHN
CC(C)[C@@H]1OCCC[C@@H]1CNC(=O)N1CCCN(C2CC2)CC1	ZINC000176826285	402341124	/nfs/dbraw/zinc/34/11/24/402341124.db2.gz	KGDDPTIHJGWYQV-WBVHZDCISA-N	0	3	323.481	2.317	10	0		DEAEHN
Cc1c(-c2cc(CN(C)[C@H](CO)CC(C)C)on2)cnn1C	ZINC000185343888	402345355	/nfs/dbraw/zinc/34/53/55/402345355.db2.gz	KRBNAAHWPKKTBN-ZDUSSCGKSA-N	0	3	306.410	2.222	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1ccc(F)c(C)c1	ZINC000176904563	402348703	/nfs/dbraw/zinc/34/87/03/402348703.db2.gz	USZNOKFYPNMUSD-CQSZACIVSA-N	0	3	321.396	2.015	10	0		DEAEHN
C[C@@H](NCC(=O)NC(N)=O)c1ccc(Cl)c2ccccc21	ZINC000185383736	402348902	/nfs/dbraw/zinc/34/89/02/402348902.db2.gz	ASSCLRJBPKCMIS-SECBINFHSA-N	0	3	305.765	2.339	10	0		DEAEHN
CCOc1ccccc1OCC(=O)N(C)C[C@H]1CCCN1CC	ZINC000176985061	402357123	/nfs/dbraw/zinc/35/71/23/402357123.db2.gz	XJLUUWGTICZTSG-OAHLLOKOSA-N	0	3	320.433	2.407	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)s1	ZINC000177007780	402358774	/nfs/dbraw/zinc/35/87/74/402358774.db2.gz	SSFZJLPMPGPXJA-UPJWGTAASA-N	0	3	323.462	2.468	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CCc1nc(C(C)C)no1	ZINC000177028045	402360733	/nfs/dbraw/zinc/36/07/33/402360733.db2.gz	MTSBMKDKBWQMEU-ZDUSSCGKSA-N	0	3	308.426	2.068	10	0		DEAEHN
C[C@H]1CN(CCOc2ccc(Cl)cc2)C[C@@H]1N1CCOCC1	ZINC000177228785	402383258	/nfs/dbraw/zinc/38/32/58/402383258.db2.gz	DCWFHFBOYQRIEU-YOEHRIQHSA-N	0	3	324.852	2.371	10	0		DEAEHN
CS(=O)(=O)CCCCCNCc1c[nH]c(-c2ccccc2)n1	ZINC000185216392	402335632	/nfs/dbraw/zinc/33/56/32/402335632.db2.gz	YOAQJQFXSVFQSR-UHFFFAOYSA-N	0	3	321.446	2.381	10	0		DEAEHN
CC[C@@H]1CN(CCCCn2ccnc2C)CCN1CCOC	ZINC000161679331	402395761	/nfs/dbraw/zinc/39/57/61/402395761.db2.gz	AXIVCCDRQWSKJT-QGZVFWFLSA-N	0	3	308.470	2.014	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@H](c2ccccc2F)C1)N(C)C	ZINC000161968935	402405248	/nfs/dbraw/zinc/40/52/48/402405248.db2.gz	BUNOYVOIFNNCTH-CVEARBPZSA-N	0	3	308.397	2.456	10	0		DEAEHN
CCC[C@@H](C(=O)NCCc1csc(N2CCCC2)n1)N(C)C	ZINC000162155284	402411596	/nfs/dbraw/zinc/41/15/96/402411596.db2.gz	HIYSGXLNAAPQOX-AWEZNQCLSA-N	0	3	324.494	2.132	10	0		DEAEHN
CCO[C@H]1C[C@H](NCc2cccnc2N(C)C)C12CCOCC2	ZINC000186243524	402414483	/nfs/dbraw/zinc/41/44/83/402414483.db2.gz	WIWGPYSHBLECBH-HOTGVXAUSA-N	0	3	319.449	2.211	10	0		DEAEHN
CC[C@H](NC(=O)N1CC[C@H](N2CCCC2)C1)c1nccs1	ZINC000162645296	402427130	/nfs/dbraw/zinc/42/71/30/402427130.db2.gz	HAUIKQZQJRHSJO-STQMWFEESA-N	0	3	308.451	2.474	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)c1cnccc1N)c1ccccc1	ZINC000178004972	402451479	/nfs/dbraw/zinc/45/14/79/402451479.db2.gz	AHIZYMRXUVDKQN-QGZVFWFLSA-N	0	3	312.417	2.477	10	0		DEAEHN
COc1ccc(O)cc1C(=O)N1CCC[C@H]1CN1CCCCC1	ZINC000186525131	402438982	/nfs/dbraw/zinc/43/89/82/402438982.db2.gz	NKOCSWWRVMAYDP-AWEZNQCLSA-N	0	3	318.417	2.491	10	0		DEAEHN
COC(=O)N[C@@H](C(=O)Nc1cc(CN(C)C)ccc1C)C(C)C	ZINC000177314016	402390553	/nfs/dbraw/zinc/39/05/53/402390553.db2.gz	UFYKDMQPYIAMBM-OAHLLOKOSA-N	0	3	321.421	2.376	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2Cc1cnn(-c2ccccc2)n1	ZINC000177335381	402392575	/nfs/dbraw/zinc/39/25/75/402392575.db2.gz	RLWVLLSIHGTNLC-AEFFLSMTSA-N	0	3	311.433	2.326	10	0		DEAEHN
COc1cccc(CNC(=O)N[C@@H](C)CN2CCC[C@H](C)C2)n1	ZINC000245389718	402454747	/nfs/dbraw/zinc/45/47/47/402454747.db2.gz	JETUSIHNEWLTMG-KBPBESRZSA-N	0	3	320.437	2.010	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NC1Cc2ccccc2C1	ZINC000186694387	402456236	/nfs/dbraw/zinc/45/62/36/402456236.db2.gz	FHCXKRNOYLRDFN-QGZVFWFLSA-N	0	3	301.434	2.280	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@H](c1ccccc1)N(C)C	ZINC000245426329	402459343	/nfs/dbraw/zinc/45/93/43/402459343.db2.gz	FYYBZYIOKPSCNK-IRXDYDNUSA-N	0	3	303.450	2.232	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)[C@H]1CCCn2ccnc21	ZINC000245426747	402459819	/nfs/dbraw/zinc/45/98/19/402459819.db2.gz	VJZIBIRUODXUME-GJZGRUSLSA-N	0	3	304.438	2.141	10	0		DEAEHN
CC(=O)c1cc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)n(C)c1	ZINC000245465643	402463244	/nfs/dbraw/zinc/46/32/44/402463244.db2.gz	YNIJWWYPFYIQNU-CVEARBPZSA-N	0	3	317.433	2.315	10	0		DEAEHN
CC(C)N(C)C(=O)[C@H](C)N1CC[C@@H](CNc2ccccn2)C1	ZINC000245480621	402464681	/nfs/dbraw/zinc/46/46/81/402464681.db2.gz	XLVVJOXSZNCLJO-GJZGRUSLSA-N	0	3	304.438	2.071	10	0		DEAEHN
COC(=O)c1nc(N2CC[C@H]3[C@H](CCCN3C)C2)sc1C	ZINC000164694564	402467639	/nfs/dbraw/zinc/46/76/39/402467639.db2.gz	IXCKRQZORVIEHW-NEPJUHHUSA-N	0	3	309.435	2.159	10	0		DEAEHN
CC(C)(C)OC(=O)[C@@H]1CCN([C@H]2Cc3ccccc3[C@H]2O)C1	ZINC000245610210	402474323	/nfs/dbraw/zinc/47/43/23/402474323.db2.gz	AVBKIMVEKOCUMN-VNQPRFMTSA-N	0	3	303.402	2.308	10	0		DEAEHN
O=C(NCc1nc(C2CC2)cs1)N1CCN2CCC[C@@H]2C1	ZINC000178228919	402474416	/nfs/dbraw/zinc/47/44/16/402474416.db2.gz	JJVUNQCMPSNFRX-GFCCVEGCSA-N	0	3	306.435	2.010	10	0		DEAEHN
COc1ccccc1NC(=O)CN(C)CC1(N(C)C)CCC1	ZINC000186982690	402476037	/nfs/dbraw/zinc/47/60/37/402476037.db2.gz	KAMOBYPBHUVSSP-UHFFFAOYSA-N	0	3	305.422	2.050	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc(Br)s1	ZINC000165449082	402476171	/nfs/dbraw/zinc/47/61/71/402476171.db2.gz	GRGHUXJWLUZZJK-NSHDSACASA-N	0	3	308.241	2.388	10	0		DEAEHN
Cc1cccc(O[C@@H](C)CNC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000245665371	402477920	/nfs/dbraw/zinc/47/79/20/402477920.db2.gz	DSQSSRUKKTZDLD-HOTGVXAUSA-N	0	3	317.433	2.252	10	0		DEAEHN
C[C@H](NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)[C@H]1CCCO1	ZINC000245663918	402477930	/nfs/dbraw/zinc/47/79/30/402477930.db2.gz	QJLDXNWFMCGZPZ-SVGFKBNWSA-N	0	3	317.433	2.299	10	0		DEAEHN
CCO[C@H]1C[C@@H](O)C12CCN(Cc1ccc(C)nc1C)CC2	ZINC000187075753	402480800	/nfs/dbraw/zinc/48/08/00/402480800.db2.gz	MQIOWEIVPSSTNZ-SJORKVTESA-N	0	3	304.434	2.450	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@@H](C)N[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000245733415	402484191	/nfs/dbraw/zinc/48/41/91/402484191.db2.gz	SJFLRVFKVQPPKO-BFHYXJOUSA-N	0	3	315.421	2.221	10	0		DEAEHN
COc1ccc(O)cc1C(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000187328848	402494498	/nfs/dbraw/zinc/49/44/98/402494498.db2.gz	UGSXQGISAHNJNJ-MRXNPFEDSA-N	0	3	314.385	2.434	10	0		DEAEHN
O=C([C@@H]1C[C@@H]1c1ccc(F)c(F)c1)N1CCN2CCC[C@H]2C1	ZINC000246027799	402504303	/nfs/dbraw/zinc/50/43/03/402504303.db2.gz	NMHZQBXHURNWSS-BFHYXJOUSA-N	0	3	306.356	2.375	10	0		DEAEHN
COc1cc([C@H](C)NC[C@H]2CC[C@@H](C(=O)N(C)C)O2)ccc1F	ZINC000246049290	402505653	/nfs/dbraw/zinc/50/56/53/402505653.db2.gz	PINBEBPELUNHSZ-LNSITVRQSA-N	0	3	324.396	2.121	10	0		DEAEHN
CC(C)(C)OC(=O)[C@@H]1CCN(CCC(=O)NC2CCCC2)C1	ZINC000178510880	402506083	/nfs/dbraw/zinc/50/60/83/402506083.db2.gz	VVKTXCPLMSYQLX-CYBMUJFWSA-N	0	3	310.438	2.099	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CCC([C@@H]3CCCO3)CC2)C1	ZINC000187640050	402506500	/nfs/dbraw/zinc/50/65/00/402506500.db2.gz	QVBLMDFOVQTCAW-PVAVHDDUSA-N	0	3	323.481	2.316	10	0		DEAEHN
COC[C@H](C)CN[C@@H](CCSC)c1nnc2ccccn21	ZINC000187629173	402506863	/nfs/dbraw/zinc/50/68/63/402506863.db2.gz	JPKCBJMXZWJZRZ-OLZOCXBDSA-N	0	3	308.451	2.396	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@H]2C[C@@H]2c2cccc(OC)c2)C1	ZINC000170945810	402543676	/nfs/dbraw/zinc/54/36/76/402543676.db2.gz	OFLOSZSXGRMHEZ-USXIJHARSA-N	0	3	302.418	2.399	10	0		DEAEHN
O=C1[C@@H](N2CCN3CCC[C@H]3C2)CCCN1c1cccc(F)c1	ZINC000246812605	402545587	/nfs/dbraw/zinc/54/55/87/402545587.db2.gz	OEGINSPNMGSFHZ-IRXDYDNUSA-N	0	3	317.408	2.101	10	0		DEAEHN
Cc1cc2c(cc1C)O[C@H](C(=O)N[C@H]1CN(C(C)C)C[C@H]1C)C2	ZINC000246810283	402545851	/nfs/dbraw/zinc/54/58/51/402545851.db2.gz	DGQGPIYRKMNENP-HFTRVMKXSA-N	0	3	316.445	2.452	10	0		DEAEHN
O=C(c1csc(-c2ccoc2)n1)N1CCN2CCC[C@H]2C1	ZINC000170982699	402546990	/nfs/dbraw/zinc/54/69/90/402546990.db2.gz	WYRGYLKBHTXPKQ-LBPRGKRZSA-N	0	3	303.387	2.323	10	0		DEAEHN
CCc1c(C(=O)N2CCN3CCC[C@@H]3C2)cnn1CC(C)C	ZINC000178886907	402550734	/nfs/dbraw/zinc/55/07/34/402550734.db2.gz	KFCQSUJOFSTFGU-CQSZACIVSA-N	0	3	304.438	2.022	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)CCC(=O)c1ccccc1	ZINC000247012942	402553712	/nfs/dbraw/zinc/55/37/12/402553712.db2.gz	FVNOZAMDVZOSLW-ZBFHGGJFSA-N	0	3	300.402	2.345	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2cccc(NC(=O)C3CC3)c2)C1	ZINC000171075140	402554857	/nfs/dbraw/zinc/55/48/57/402554857.db2.gz	OJCYGOCXQIJTOK-OAHLLOKOSA-N	0	3	316.405	2.203	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2cccc(NC(=O)C3CC3)c2)C1	ZINC000171075146	402554867	/nfs/dbraw/zinc/55/48/67/402554867.db2.gz	OJCYGOCXQIJTOK-HNNXBMFYSA-N	0	3	316.405	2.203	10	0		DEAEHN
CCC(=O)Nc1ccc(NC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000171077700	402555247	/nfs/dbraw/zinc/55/52/47/402555247.db2.gz	VNCFAQTVRNRTRT-CQSZACIVSA-N	0	3	304.394	2.203	10	0		DEAEHN
CC(=O)Nc1ccc(Cl)c(NC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000171080082	402555833	/nfs/dbraw/zinc/55/58/33/402555833.db2.gz	WHOXGKVFHBRQHX-LBPRGKRZSA-N	0	3	324.812	2.466	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc2c(c(Cl)c1)OCO2	ZINC000247081922	402556369	/nfs/dbraw/zinc/55/63/69/402556369.db2.gz	HWVXFQFXFUZTFP-JQWIXIFHSA-N	0	3	322.792	2.377	10	0		DEAEHN
C[C@@H](C(=O)N1C[C@H]2CCCN2C[C@H]1C)n1cnc2ccccc21	ZINC000247508840	402570219	/nfs/dbraw/zinc/57/02/19/402570219.db2.gz	VRFPLHAQYKQRHR-QLFBSQMISA-N	0	3	312.417	2.292	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@H](C)Oc2ccccc2F)C1	ZINC000246177394	402515557	/nfs/dbraw/zinc/51/55/57/402515557.db2.gz	LPYUAHGYJVIAEX-UONOGXRCSA-N	0	3	323.412	2.377	10	0		DEAEHN
CCC[C@@H](C(=O)NCCCc1nc2ccccc2[nH]1)N(C)C	ZINC000178653847	402521864	/nfs/dbraw/zinc/52/18/64/402521864.db2.gz	GQAGLSMBYKKCJT-HNNXBMFYSA-N	0	3	302.422	2.342	10	0		DEAEHN
COc1cccc(C(=O)N2CCC[C@H]2C[NH+]2CCCCC2)c1[O-]	ZINC000170804454	402527318	/nfs/dbraw/zinc/52/73/18/402527318.db2.gz	CAYIIDSVELFSOA-AWEZNQCLSA-N	0	3	318.417	2.491	10	0		DEAEHN
CN(CCC(=O)N1CCc2ccccc2C1)C[C@@H]1CCCO1	ZINC000188969472	402529248	/nfs/dbraw/zinc/52/92/48/402529248.db2.gz	PGXIHLJOLDZOHB-KRWDZBQOSA-N	0	3	302.418	2.072	10	0		DEAEHN
Cc1cccc(C[C@@H](CO)NCc2cnc3nc(C)cc(C)n23)c1	ZINC000189011533	402530398	/nfs/dbraw/zinc/53/03/98/402530398.db2.gz	JPBYLDQLOSVBND-KRWDZBQOSA-N	0	3	324.428	2.348	10	0		DEAEHN
CC[C@H](O)CN(Cc1ccccc1)C[C@@H](O)COC(C)(C)C	ZINC000246489978	402533361	/nfs/dbraw/zinc/53/33/61/402533361.db2.gz	HBOUQSJBGGFZSY-DLBZAZTESA-N	0	3	309.450	2.436	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCCCn2ccc3ccccc32)C1	ZINC000170861295	402534191	/nfs/dbraw/zinc/53/41/91/402534191.db2.gz	BCDMECCIJOYUEW-MRXNPFEDSA-N	0	3	314.433	2.377	10	0		DEAEHN
CCc1c(C(=O)N2CC[C@H](N(C)C)C2)cnn1-c1ccccc1	ZINC000170867408	402535684	/nfs/dbraw/zinc/53/56/84/402535684.db2.gz	BTHOMBKQZINGOD-HNNXBMFYSA-N	0	3	312.417	2.211	10	0		DEAEHN
COC[C@H](NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)C1CC1	ZINC000179207392	402580991	/nfs/dbraw/zinc/58/09/91/402580991.db2.gz	USIURASNTJSNGP-ULQDDVLXSA-N	0	3	317.433	2.156	10	0		DEAEHN
CCC(O)(CC)CNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248062701	402581456	/nfs/dbraw/zinc/58/14/56/402581456.db2.gz	PKAUSUYETFFABR-HOTGVXAUSA-N	0	3	319.449	2.282	10	0		DEAEHN
CCN1CCN(c2ccc(NC(=O)[C@H](C)COC)c(C)c2)CC1	ZINC000171429167	402586499	/nfs/dbraw/zinc/58/64/99/402586499.db2.gz	MKHMNQMBCAJXBS-OAHLLOKOSA-N	0	3	319.449	2.358	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@@H]1CCCN1C[C@@H](O)CC(F)(F)F	ZINC000249378166	402627359	/nfs/dbraw/zinc/62/73/59/402627359.db2.gz	PYQVMNQZIJGJNQ-RYUDHWBXSA-N	0	3	305.344	2.487	10	0		DEAEHN
COC(=O)[C@H](c1ccccc1C)N1CCN2CCCC[C@H]2C1	ZINC000248604089	402598285	/nfs/dbraw/zinc/59/82/85/402598285.db2.gz	DXUIIMQOBCAUQK-RDJZCZTQSA-N	0	3	302.418	2.379	10	0		DEAEHN
Cc1nn(C)cc1CN1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190489770	402605179	/nfs/dbraw/zinc/60/51/79/402605179.db2.gz	JVNJNPOOUAKGIT-QGZVFWFLSA-N	0	3	313.449	2.077	10	0		DEAEHN
Cc1c(NC(=O)N2CCN3CCC[C@@H]3C2)cccc1N(C)C	ZINC000180119656	402607822	/nfs/dbraw/zinc/60/78/22/402607822.db2.gz	WPAUISQUFNNRTL-CQSZACIVSA-N	0	3	302.422	2.373	10	0		DEAEHN
CN1CC[C@@H](NC(=O)CC2(O)CCCC2)[C@@H]1c1ccccc1	ZINC000180136139	402608585	/nfs/dbraw/zinc/60/85/85/402608585.db2.gz	HOXYCRAIWHTRLL-WBVHZDCISA-N	0	3	302.418	2.243	10	0		DEAEHN
CN(C[C@H](O)CC1CCCC1)C[C@H](O)COCc1ccccc1	ZINC000190542341	402608602	/nfs/dbraw/zinc/60/86/02/402608602.db2.gz	RNQVFVJLLHDTCK-MOPGFXCFSA-N	0	3	321.461	2.437	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2ccc(F)c(COC)c2)C1	ZINC000171683131	402609583	/nfs/dbraw/zinc/60/95/83/402609583.db2.gz	UIOXVOSQUIKZTG-HNNXBMFYSA-N	0	3	323.412	2.256	10	0		DEAEHN
O=C(NCCN1CCCC1)c1ccc(-n2cccc2)c(F)c1	ZINC000171723597	402615005	/nfs/dbraw/zinc/61/50/05/402615005.db2.gz	NHAJJGSBBGLZBS-UHFFFAOYSA-N	0	3	301.365	2.442	10	0		DEAEHN
O=C(NCc1ccc(Cl)cn1)N1CC[C@H](N2CCCC2)C1	ZINC000180853684	402628299	/nfs/dbraw/zinc/62/82/99/402628299.db2.gz	UJMQPHREENIIPO-AWEZNQCLSA-N	0	3	308.813	2.115	10	0		DEAEHN
CO[C@@H]1CN(Cc2cn(C)nc2-c2cccnc2)CC[C@@H]1C	ZINC000249195732	402622855	/nfs/dbraw/zinc/62/28/55/402622855.db2.gz	QCIKNQVDNLBTKY-XJKSGUPXSA-N	0	3	300.406	2.339	10	0		DEAEHN
Cc1cccc(F)c1NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000249218326	402623587	/nfs/dbraw/zinc/62/35/87/402623587.db2.gz	UAVIWJBQBKKOBK-QWHCGFSZSA-N	0	3	321.396	2.014	10	0		DEAEHN
CSCCCNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000179168467	402577629	/nfs/dbraw/zinc/57/76/29/402577629.db2.gz	ZGELMEPQRZBYCJ-CABCVRRESA-N	0	3	307.463	2.484	10	0		DEAEHN
CC(C)COc1ccc(NC(=O)N2CCN3CCC[C@@H]3C2)cn1	ZINC000172106197	402640356	/nfs/dbraw/zinc/64/03/56/402640356.db2.gz	CQNMIVTYENMUKH-OAHLLOKOSA-N	0	3	318.421	2.428	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)N[C@@H](c2ccccc2)C2CC2)CCO1	ZINC000172118649	402641464	/nfs/dbraw/zinc/64/14/64/402641464.db2.gz	FHMAXBSIQQNWRW-SJORKVTESA-N	0	3	317.433	2.110	10	0		DEAEHN
Cc1ccc([C@@H](C)NC[C@@H](O)COC2CCOCC2)cc1F	ZINC000181343587	402642181	/nfs/dbraw/zinc/64/21/81/402642181.db2.gz	ZJUWBXGYVHNVPA-UKRRQHHQSA-N	0	3	311.397	2.341	10	0		DEAEHN
COCCN(C)CCCNC(=O)N1CCC(C(C)(C)C)CC1	ZINC000172175785	402644069	/nfs/dbraw/zinc/64/40/69/402644069.db2.gz	LUNUJMNLWCLLCK-UHFFFAOYSA-N	0	3	313.486	2.422	10	0		DEAEHN
C[C@@H]1OCCC[C@H]1C(=O)NCc1cccc(OCCN(C)C)c1	ZINC000191140198	402644657	/nfs/dbraw/zinc/64/46/57/402644657.db2.gz	DZNYVETZJSEGQG-WMLDXEAASA-N	0	3	320.433	2.058	10	0		DEAEHN
Cc1c(-c2cc(CN3[C@H](C)CC(O)C[C@H]3C)on2)cnn1C	ZINC000191170059	402647417	/nfs/dbraw/zinc/64/74/17/402647417.db2.gz	KKWNGLDFLIKSTO-GHMZBOCLSA-N	0	3	304.394	2.117	10	0		DEAEHN
COc1cccc(CN[C@H]2CCN(c3ccccc3OC)C2)n1	ZINC000191314571	402659880	/nfs/dbraw/zinc/65/98/80/402659880.db2.gz	YMRBSUNGWCNXRH-HNNXBMFYSA-N	0	3	313.401	2.467	10	0		DEAEHN
COC(=O)c1cccc(OCCN2CC[C@H](C)[C@H](OC)C2)c1	ZINC000251896710	402650759	/nfs/dbraw/zinc/65/07/59/402650759.db2.gz	QQKUEEKNYOWCFG-XJKSGUPXSA-N	0	3	307.390	2.209	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)CSCc1ccccn1	ZINC000252443778	402653329	/nfs/dbraw/zinc/65/33/29/402653329.db2.gz	OYYNWSDIDCNWNO-HIFRSBDPSA-N	0	3	305.447	2.010	10	0		DEAEHN
O=C(NCCC1CCCC1)N1CCN(CC2CCOCC2)CC1	ZINC000172445398	402656375	/nfs/dbraw/zinc/65/63/75/402656375.db2.gz	QQWQJKFBAPGYIZ-UHFFFAOYSA-N	0	3	323.481	2.321	10	0		DEAEHN
COC(=O)CNC(=O)[C@H](C)N[C@@H](C)c1ccc(C(C)(C)C)cc1	ZINC000182608863	402703703	/nfs/dbraw/zinc/70/37/03/402703703.db2.gz	DWMHUKLSNMXXBY-STQMWFEESA-N	0	3	320.433	2.312	10	0		DEAEHN
O=C1Nc2ccccc2CC[C@@H]1N1C[C@H]2CCC[C@@H](C1)C2O	ZINC000192028957	402706853	/nfs/dbraw/zinc/70/68/53/402706853.db2.gz	MQGMHTYZAKLHLI-IINVVDAPSA-N	0	3	300.402	2.033	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)Nc1ccc2c[nH]nc2c1	ZINC000261823506	402718168	/nfs/dbraw/zinc/71/81/68/402718168.db2.gz	HOMYKGBMAMUOKU-QEORTHHSSA-N	0	3	314.389	2.034	10	0		DEAEHN
Cn1ccnc1C[C@@H]1CCCN(Cc2cc(C(N)=O)cs2)C1	ZINC000182090843	402666789	/nfs/dbraw/zinc/66/67/89/402666789.db2.gz	QIGLGKBVLAYLKJ-LBPRGKRZSA-N	0	3	318.446	2.035	10	0		DEAEHN
Cc1cnc(CNC(=O)c2ccccc2OCCN(C)C)s1	ZINC000172718650	402671970	/nfs/dbraw/zinc/67/19/70/402671970.db2.gz	SCKXEDBSJDYYCC-UHFFFAOYSA-N	0	3	319.430	2.322	10	0		DEAEHN
COC(=O)c1ccccc1OCCN1CC[C@H]2OCCC[C@@H]2C1	ZINC000182244989	402675607	/nfs/dbraw/zinc/67/56/07/402675607.db2.gz	NVNQOTGANHMPLU-GDBMZVCRSA-N	0	3	319.401	2.353	10	0		DEAEHN
Cc1ccc(CNC(=O)N2CC[C@@H](N3CC=CC3)C2)cc1F	ZINC000173227420	402688996	/nfs/dbraw/zinc/68/89/96/402688996.db2.gz	HFHLAANWTYCUFV-OAHLLOKOSA-N	0	3	303.381	2.290	10	0		DEAEHN
COC[C@H](C)N1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000173252993	402689593	/nfs/dbraw/zinc/68/95/93/402689593.db2.gz	PWFHUZPQLVTIMH-AWEZNQCLSA-N	0	3	302.418	2.323	10	0		DEAEHN
CC[C@H](O)CN1CCN(CCCc2ccccc2OC)CC1	ZINC000182512501	402696068	/nfs/dbraw/zinc/69/60/68/402696068.db2.gz	BTMOVCJVVXKMHA-KRWDZBQOSA-N	0	3	306.450	2.016	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)[C@H](C)N1CCCCCC1	ZINC000173490789	402699999	/nfs/dbraw/zinc/69/99/99/402699999.db2.gz	ADRYIRLHYNDJAT-CJNGLKHVSA-N	0	3	320.481	2.349	10	0		DEAEHN
C[C@H]1CN(CC2CCN(C(=O)NCCC3CC3)CC2)C[C@H](C)O1	ZINC000174057341	402725473	/nfs/dbraw/zinc/72/54/73/402725473.db2.gz	LCMWORUHLGZQPN-GJZGRUSLSA-N	0	3	323.481	2.317	10	0		DEAEHN
CCC(CC)N1C[C@@H](C(=O)NCCN2CCCC[C@@H]2C)CC1=O	ZINC000192528609	402734913	/nfs/dbraw/zinc/73/49/13/402734913.db2.gz	CDOWFMVMFSSYBX-GJZGRUSLSA-N	0	3	323.481	2.014	10	0		DEAEHN
CCCNc1ccc(CNC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000192580467	402738049	/nfs/dbraw/zinc/73/80/49/402738049.db2.gz	MKDUFHUIRKVNIN-INIZCTEOSA-N	0	3	304.438	2.354	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(C(=O)Nc3ccccc3)C2)CC1	ZINC000174369934	402738499	/nfs/dbraw/zinc/73/84/99/402738499.db2.gz	BGWGHGVFLRUPOT-KRWDZBQOSA-N	0	3	316.449	2.320	10	0		DEAEHN
CCN(Cc1cccc(F)c1)C(=O)CN[C@H](C)[C@H]1CCCO1	ZINC000183119209	402740512	/nfs/dbraw/zinc/74/05/12/402740512.db2.gz	RQERBJKFJVHETE-CZUORRHYSA-N	0	3	308.397	2.331	10	0		DEAEHN
C[C@@H](NCc1cccc(CN2CCOCC2)c1)c1ccnn1C	ZINC000192694657	402744238	/nfs/dbraw/zinc/74/42/38/402744238.db2.gz	ZKINIDKMDUJKMB-OAHLLOKOSA-N	0	3	314.433	2.103	10	0		DEAEHN
COc1ccc(NC(=O)[C@H](C)N[C@H](C)[C@H]2CCCO2)cc1OC	ZINC000183181751	402745259	/nfs/dbraw/zinc/74/52/59/402745259.db2.gz	UZPQTHWIZAGDSE-MBNYWOFBSA-N	0	3	322.405	2.188	10	0		DEAEHN
COC[C@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccccc1	ZINC000174625905	402748847	/nfs/dbraw/zinc/74/88/47/402748847.db2.gz	RWWDWHAGMJHUIG-IRXDYDNUSA-N	0	3	315.417	2.030	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(/C=C/c2ccccc2Cl)n1	ZINC000263250221	402750137	/nfs/dbraw/zinc/75/01/37/402750137.db2.gz	PVALGNQTYXHJCO-KTRBRXNASA-N	0	3	304.781	2.470	10	0		DEAEHN
O=C(Cc1ccccc1)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000183462984	402769608	/nfs/dbraw/zinc/76/96/08/402769608.db2.gz	YITOSVWZBVPJSQ-IBGZPJMESA-N	0	3	324.424	2.112	10	0		DEAEHN
Cc1ccccc1[C@@H](CN1CCOCC1)N[C@@H]1CCCOC1	ZINC000183563397	402776370	/nfs/dbraw/zinc/77/63/70/402776370.db2.gz	LTIOEUVJPIHBSC-SJLPKXTDSA-N	0	3	304.434	2.137	10	0		DEAEHN
OCC1CCN(Cc2ccccc2NCc2cocn2)CC1	ZINC000192324104	402723203	/nfs/dbraw/zinc/72/32/03/402723203.db2.gz	GNBAFGGZRKJPPF-UHFFFAOYSA-N	0	3	301.390	2.491	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1cc(C)cc(F)c1	ZINC000175218023	402789082	/nfs/dbraw/zinc/78/90/82/402789082.db2.gz	OOYDRPVTTXOIKA-GFCCVEGCSA-N	0	3	302.415	2.143	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)N(CCN(C)C)Cc1cccs1	ZINC000194628027	402805833	/nfs/dbraw/zinc/80/58/33/402805833.db2.gz	MVYONTVEXGPDJH-HIFRSBDPSA-N	0	3	310.463	2.311	10	0		DEAEHN
CN(C)c1ccncc1C(=O)N1CCN(C2CCCCC2)CC1	ZINC000183957510	402808435	/nfs/dbraw/zinc/80/84/35/402808435.db2.gz	TYRRXBAPGHYFOX-UHFFFAOYSA-N	0	3	316.449	2.238	10	0		DEAEHN
CC(C)NC(=O)Nc1ccc(C(=O)NC[C@@H]2CCCN2C)cc1	ZINC000194692733	402811226	/nfs/dbraw/zinc/81/12/26/402811226.db2.gz	KCJPILHZQHXKOE-HNNXBMFYSA-N	0	3	318.421	2.041	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NC[C@@H]2CCCN2C)c1	ZINC000194702295	402811334	/nfs/dbraw/zinc/81/13/34/402811334.db2.gz	ROSRITZBLOQOJF-UHOFOFEASA-N	0	3	315.417	2.105	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cc(-c2ccc(F)cc2)n[nH]1	ZINC000194702989	402811684	/nfs/dbraw/zinc/81/16/84/402811684.db2.gz	DHVFPVTXGRXBHX-ZDUSSCGKSA-N	0	3	302.353	2.040	10	0		DEAEHN
Cc1c(C(=O)NC[C@@H]2CCCN2C)cnn1-c1ccccc1F	ZINC000194709615	402811781	/nfs/dbraw/zinc/81/17/81/402811781.db2.gz	BQWROYCMPYCBSB-ZDUSSCGKSA-N	0	3	316.380	2.144	10	0		DEAEHN
Cc1oc(-c2ccccc2)nc1CC(=O)NC[C@@H]1CCCN1C	ZINC000194711968	402811968	/nfs/dbraw/zinc/81/19/68/402811968.db2.gz	IOLMYQYRYIJJHC-HNNXBMFYSA-N	0	3	313.401	2.403	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCC[C@H](c2nncn2C(C)C)C1	ZINC000195195444	402835984	/nfs/dbraw/zinc/83/59/84/402835984.db2.gz	VGJJLYZQHQHSJQ-HOTGVXAUSA-N	0	3	324.469	2.216	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc(OC(C)C)c(OC)c1	ZINC000175855993	402838301	/nfs/dbraw/zinc/83/83/01/402838301.db2.gz	NQXHYAUPZRXLRH-QGZVFWFLSA-N	0	3	311.422	2.360	10	0		DEAEHN
C[C@@H]1CCN(CCCN2C(=O)CNC2=O)[C@@H]1c1cccc(F)c1	ZINC000175149438	402783363	/nfs/dbraw/zinc/78/33/63/402783363.db2.gz	RDQBVVBVLRPGML-WBMJQRKESA-N	0	3	319.380	2.151	10	0		DEAEHN
c1cc(CNCCCO[C@H]2CCOC2)n(-c2ccccc2)n1	ZINC000279133306	402907749	/nfs/dbraw/zinc/90/77/49/402907749.db2.gz	MYKLHUQMORQUNM-KRWDZBQOSA-N	0	3	301.390	2.158	10	0		DEAEHN
Cc1nc(C2CC2)oc1C(=O)NC[C@@]1(N(C)C)CCSC1	ZINC000273583793	403017124	/nfs/dbraw/zinc/01/71/24/403017124.db2.gz	FCTSRZSYQQGUAW-HNNXBMFYSA-N	0	3	309.435	2.028	10	0		DEAEHN
C[C@H](NC(=O)N[C@H]1CCC[C@@H](C(N)=O)C1)C1=CCN(C)CC1	ZINC000332903784	403634169	/nfs/dbraw/zinc/63/41/69/403634169.db2.gz	ZDXJHVFYBCFAQT-YUTCNCBUSA-N	0	3	308.426	2.030	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1N(C)C(=O)CN1CCC[C@@H](c2nc[nH]n2)C1	ZINC000333096408	403665813	/nfs/dbraw/zinc/66/58/13/403665813.db2.gz	UJNBSUXMJVRNSQ-RBSFLKMASA-N	0	3	319.453	2.021	10	0		DEAEHN
COCCC1(C)CN(C(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)C1	ZINC000358526207	292299529	/nfs/dbraw/zinc/29/95/29/292299529.db2.gz	BDPVRWOJRJJOTP-CABCVRRESA-N	0	3	311.470	2.175	10	0		DEAEHN
CN(Cc1cccnc1)C[C@H]1CCN(Cc2ccc(CO)o2)C1	ZINC000328646207	404122262	/nfs/dbraw/zinc/12/22/62/404122262.db2.gz	SNGDKAOIGPQJKI-MRXNPFEDSA-N	0	3	315.417	2.121	10	0		DEAEHN
COCCOC[C@H](O)CN(C)[C@H](C)c1ccc(Cl)cc1	ZINC000296462108	404259993	/nfs/dbraw/zinc/25/99/93/404259993.db2.gz	JJLRXMUMAJFMTL-IUODEOHRSA-N	0	3	301.814	2.357	10	0		DEAEHN
CC[C@H](C(=O)N1CCC(Nc2nc(C)cs2)CC1)N(C)C	ZINC000364284843	404333734	/nfs/dbraw/zinc/33/37/34/404333734.db2.gz	XNAIVINBNAAZHG-CYBMUJFWSA-N	0	3	310.467	2.195	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)N(C)C1CCN(C)CC1)CC2	ZINC000364556258	404447601	/nfs/dbraw/zinc/44/76/01/404447601.db2.gz	XLQVZYXNOJMZBU-CYBMUJFWSA-N	0	3	318.465	2.191	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N(C)C1CCN(C)CC1)C2	ZINC000364556258	404447604	/nfs/dbraw/zinc/44/76/04/404447604.db2.gz	XLQVZYXNOJMZBU-CYBMUJFWSA-N	0	3	318.465	2.191	10	0		DEAEHN
Cc1cnc([C@H](C)N2CCC[C@@H]2[C@@H]2COCC[C@@]2(C)O)cn1	ZINC000330245917	404599099	/nfs/dbraw/zinc/59/90/99/404599099.db2.gz	KXMMOYBZBFUSLY-XJNFMUPTSA-N	0	3	305.422	2.098	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNCCCNc1ccccn1	ZINC000291989247	404615510	/nfs/dbraw/zinc/61/55/10/404615510.db2.gz	SXPAKERXJUNECB-UHFFFAOYSA-N	0	3	322.416	2.313	10	0		DEAEHN
C[C@H]1CCOCCN1CCC(=O)N1CCCc2ccccc21	ZINC000375701769	404730842	/nfs/dbraw/zinc/73/08/42/404730842.db2.gz	DXFINBSKJYITGE-HNNXBMFYSA-N	0	3	302.418	2.467	10	0		DEAEHN
c1ccc(-c2ccc(N3CCCN([C@@H]4CCOC4)CC3)nn2)cc1	ZINC000375724300	404734956	/nfs/dbraw/zinc/73/49/56/404734956.db2.gz	VGLXZLAEDRVKDL-QGZVFWFLSA-N	0	3	324.428	2.445	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@@H](C)N2CCC[C@H](C)C2)C1	ZINC000358603423	404768401	/nfs/dbraw/zinc/76/84/01/404768401.db2.gz	KAHVULVVURLCFE-LSDHHAIUSA-N	0	3	311.470	2.175	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCCN(C)Cc1ccc(F)cc1	ZINC000360894941	404847578	/nfs/dbraw/zinc/84/75/78/404847578.db2.gz	SMYZCRXBFLYKHZ-KRWDZBQOSA-N	0	3	321.440	2.248	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCC[C@H](Cc2nccn2C)C1	ZINC000361543071	405123246	/nfs/dbraw/zinc/12/32/46/405123246.db2.gz	KBECMPNFRHWDCT-HZPDHXFCSA-N	0	3	318.465	2.076	10	0		DEAEHN
C[C@H](NC[C@@H]1[C@H]2COC[C@H]21)c1ncc(Br)s1	ZINC000367683099	405123903	/nfs/dbraw/zinc/12/39/03/405123903.db2.gz	CGTSFSPCJHKZND-XSPKLOCKSA-N	0	3	303.225	2.449	10	0		DEAEHN
C[C@H]1CN(CCO)CCN1CCn1ccc2cc(Cl)ccc21	ZINC000452136161	405192116	/nfs/dbraw/zinc/19/21/16/405192116.db2.gz	XMFQBNZMAZUYMD-AWEZNQCLSA-N	0	3	321.852	2.293	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)c2ccc3c(c2[O-])CCCC3)CC[N@@H+]1C	ZINC000408414991	405201934	/nfs/dbraw/zinc/20/19/34/405201934.db2.gz	MTBHLELBONOMSI-OCCSQVGLSA-N	0	3	302.418	2.484	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)c2ccc3c(c2[O-])CCCC3)CC[N@H+]1C	ZINC000408414991	405201937	/nfs/dbraw/zinc/20/19/37/405201937.db2.gz	MTBHLELBONOMSI-OCCSQVGLSA-N	0	3	302.418	2.484	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)[C@@H](C)N2C[C@H]3CCC[C@@H](C2)N3)cc1	ZINC000420353167	405329002	/nfs/dbraw/zinc/32/90/02/405329002.db2.gz	ZZEYAWTZNGXWAC-JLZZUVOBSA-N	0	3	315.417	2.043	10	0		DEAEHN
CC(C)(C)OC(=O)c1ccc(CNC[C@@]2(C)CCC(=O)N2)cc1	ZINC000453585514	405292544	/nfs/dbraw/zinc/29/25/44/405292544.db2.gz	GQJMXTIHTIEYJT-GOSISDBHSA-N	0	3	318.417	2.400	10	0		DEAEHN
CN(C)CC(C)(C)NC(=O)Nc1ccc2ccc(=O)n(C)c2c1	ZINC000455284775	405393304	/nfs/dbraw/zinc/39/33/04/405393304.db2.gz	SDNHYHQGHVDUPY-UHFFFAOYSA-N	0	3	316.405	2.000	10	0		DEAEHN
c1cc(CN2CCOCC2)cc(CN2CCOCC3(CC3)C2)c1	ZINC000420928270	405407982	/nfs/dbraw/zinc/40/79/82/405407982.db2.gz	CLXSVKGCOLRAOZ-UHFFFAOYSA-N	0	3	316.445	2.131	10	0		DEAEHN
Brc1cccc(-c2noc(CCOC3CNC3)n2)c1	ZINC000577828346	405521667	/nfs/dbraw/zinc/52/16/67/405521667.db2.gz	PNDJQAHSMBUUQH-UHFFFAOYSA-N	0	3	324.178	2.030	10	0		DEAEHN
c1cc(CN[C@H](Cc2ccccc2)CN2CCOCC2)sn1	ZINC000638638886	405586836	/nfs/dbraw/zinc/58/68/36/405586836.db2.gz	KTCWZBMZSAUOMD-MRXNPFEDSA-N	0	3	317.458	2.176	10	0		DEAEHN
O=C(NCCNc1ccncc1)NC[C@H](c1ccccc1)C1CC1	ZINC000458792687	405596288	/nfs/dbraw/zinc/59/62/88/405596288.db2.gz	LXFHYXFCBPMYNI-GOSISDBHSA-N	0	3	324.428	2.408	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N1C[C@@H]2CCCC[C@@]21C	ZINC000638757328	405652088	/nfs/dbraw/zinc/65/20/88/405652088.db2.gz	LGSLNKKUAABIIS-SCTDSRPQSA-N	0	3	315.461	2.237	10	0		DEAEHN
COc1nsc(CNCCC[C@H](C)CO)c1Br	ZINC000638820311	405692718	/nfs/dbraw/zinc/69/27/18/405692718.db2.gz	AWYMQYBEFJNCFZ-QMMMGPOBSA-N	0	3	323.256	2.412	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N[C@@H]2C[C@H](N(C)C)C2(C)C)c1C	ZINC000636087320	405728440	/nfs/dbraw/zinc/72/84/40/405728440.db2.gz	OUQKKFDCRJPTBA-OLZOCXBDSA-N	0	3	305.422	2.293	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CC[C@](C)(C(=O)OC(C)(C)C)C1	ZINC000457277204	405776117	/nfs/dbraw/zinc/77/61/17/405776117.db2.gz	YEDQILPVGMUXCK-KDOFPFPSSA-N	0	3	324.465	2.441	10	0		DEAEHN
CC(=O)N1CCN(C[C@H]2CCN(c3ccccc3)C2)C(C)(C)C1	ZINC000638927386	405763248	/nfs/dbraw/zinc/76/32/48/405763248.db2.gz	UEGSSMRKNYOPCG-KRWDZBQOSA-N	0	3	315.461	2.456	10	0		DEAEHN
Cn1cc(CN[C@H]2CCO[C@@H]2c2ccnn2-c2ccccc2)cn1	ZINC000583616614	405775162	/nfs/dbraw/zinc/77/51/62/405775162.db2.gz	SAZIAOOGTKUOPO-WMZOPIPTSA-N	0	3	323.400	2.226	10	0		DEAEHN
Cn1cccc1[C@@H]1CCCCN1C[C@H](O)COC[C@H]1CCCO1	ZINC000530867733	405874734	/nfs/dbraw/zinc/87/47/34/405874734.db2.gz	KUCAECKXJFZBPP-JZXOWHBKSA-N	0	3	322.449	2.109	10	0		DEAEHN
CCN(Cc1cnnn1CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000459397329	405886022	/nfs/dbraw/zinc/88/60/22/405886022.db2.gz	HFYYMMFLVRYGRW-KRWDZBQOSA-N	0	3	313.449	2.394	10	0		DEAEHN
CN1CCCC(C)(C)[C@H]1CNC(=O)NCCOCC1CCC1	ZINC000516950339	406115310	/nfs/dbraw/zinc/11/53/10/406115310.db2.gz	GHVCUHUVHBEBEG-OAHLLOKOSA-N	0	3	311.470	2.223	10	0		DEAEHN
c1nc2n(n1)[C@@H](CN1CCC3(CC1)OCc1ccccc13)CC2	ZINC000639517365	406124988	/nfs/dbraw/zinc/12/49/88/406124988.db2.gz	IFXKLMAVOAFMDZ-OAHLLOKOSA-N	0	3	310.401	2.287	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@@H]1SCCc2ccccc21	ZINC000534527798	406190159	/nfs/dbraw/zinc/19/01/59/406190159.db2.gz	VYGVUJBYLYTJCK-MRXNPFEDSA-N	0	3	313.426	2.062	10	0		DEAEHN
Cc1ccc([C@H](C)NC(=O)CN2CC[C@H](CO)[C@@H]2C)cc1C	ZINC000488732264	406342781	/nfs/dbraw/zinc/34/27/81/406342781.db2.gz	MMKDVOFCYDKEKD-YQQAZPJKSA-N	0	3	304.434	2.183	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)c2cncnc2)[C@H]1c1cccs1	ZINC000546891186	406385433	/nfs/dbraw/zinc/38/54/33/406385433.db2.gz	AJVIGKMBITYHLN-WFASDCNBSA-N	0	3	316.430	2.351	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N(C)CC1CCCC1	ZINC000637963005	406499311	/nfs/dbraw/zinc/49/93/11/406499311.db2.gz	JKWKXHURGMGAKZ-KRWDZBQOSA-N	0	3	303.450	2.094	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N(C)c1ccc(F)cc1	ZINC000637931724	406482652	/nfs/dbraw/zinc/48/26/52/406482652.db2.gz	PJAXFSQWJXYHQT-KRWDZBQOSA-N	0	3	315.392	2.248	10	0		DEAEHN
CCC1CCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)CC1	ZINC000637941274	406488715	/nfs/dbraw/zinc/48/87/15/406488715.db2.gz	MKRUKGLFHSABBT-QGZVFWFLSA-N	0	3	303.450	2.094	10	0		DEAEHN
COc1ccccc1[C@]1(C)C[C@@H]1NC(=O)NC[C@@H]1CCCN1C	ZINC000524781812	406460562	/nfs/dbraw/zinc/46/05/62/406460562.db2.gz	CAGLKJFFLBLTQU-OWQGQXMQSA-N	0	3	317.433	2.119	10	0		DEAEHN
C[C@H](N(C)C(=O)[C@@H](N)CN(C)Cc1ccccc1)C1(C)CC1	ZINC000638042283	406539708	/nfs/dbraw/zinc/53/97/08/406539708.db2.gz	QFBXULHXCZBLAX-HOCLYGCPSA-N	0	3	303.450	2.093	10	0		DEAEHN
O=C(c1ccccc1-c1cn[nH]c1)N1CC[C@@H](N2CCCC2)C1	ZINC000635479867	406555634	/nfs/dbraw/zinc/55/56/34/406555634.db2.gz	LOERLMIDRHMDHG-OAHLLOKOSA-N	0	3	310.401	2.387	10	0		DEAEHN
Cn1cc(CCN2CCC[C@H](CC(=O)OC(C)(C)C)C2)cn1	ZINC000551899752	406647104	/nfs/dbraw/zinc/64/71/04/406647104.db2.gz	XFUDAYSRKGXHTN-CQSZACIVSA-N	0	3	307.438	2.406	10	0		DEAEHN
O[C@@H]1CCN([C@H]2CCC[C@H]2NCc2cc(-c3ccco3)on2)C1	ZINC000643963455	407066407	/nfs/dbraw/zinc/06/64/07/407066407.db2.gz	XLNPSFHXGZIOAT-KFWWJZLASA-N	0	3	317.389	2.012	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCc3cc(F)ccc3C2)C1	ZINC000129167298	196025775	/nfs/dbraw/zinc/02/57/75/196025775.db2.gz	HJNIMCAMRLUERC-INIZCTEOSA-N	0	3	305.397	2.378	10	0		DEAEHN
COc1ccc(Oc2cc(NN)ncn2)c(Br)c1	ZINC000129684218	196067476	/nfs/dbraw/zinc/06/74/76/196067476.db2.gz	IFVUTVCYDIBWOJ-UHFFFAOYSA-N	0	3	311.139	2.326	10	0		DEAEHN
CN[C@@H](Cc1cc(C)nn1C)c1ccc(Br)cn1	ZINC000130801048	196110887	/nfs/dbraw/zinc/11/08/87/196110887.db2.gz	KGKQXKKJOZCJMS-ZDUSSCGKSA-N	0	3	309.211	2.389	10	0		DEAEHN
CNCc1ccc(CS(=O)(=O)c2ccc3c(c2)CCC3)o1	ZINC000130895348	196121174	/nfs/dbraw/zinc/12/11/74/196121174.db2.gz	SRMBCTBVZMTWOZ-UHFFFAOYSA-N	0	3	305.399	2.462	10	0		DEAEHN
CCCN[C@@H](Cc1ncnn1C)c1ccc(Br)cn1	ZINC000130918638	196123061	/nfs/dbraw/zinc/12/30/61/196123061.db2.gz	GDHDFBHNNOOLFD-LBPRGKRZSA-N	0	3	324.226	2.256	10	0		DEAEHN
CNc1ncc(Br)c(N[C@@H](CN(C)C)C(C)C)n1	ZINC000130977560	196128401	/nfs/dbraw/zinc/12/84/01/196128401.db2.gz	VXJAUJIRLRTBDU-JTQLQIEISA-N	0	3	316.247	2.279	10	0		DEAEHN
CCCNc1nc(Cl)nc(N[C@@H](CN(C)C)C(C)C)n1	ZINC000131125714	196141916	/nfs/dbraw/zinc/14/19/16/196141916.db2.gz	UCCXONQEYWLFLU-JTQLQIEISA-N	0	3	300.838	2.345	10	0		DEAEHN
CNC(=O)NC(=O)[C@H](C)N[C@H](C)c1ccc(OCC(C)C)cc1	ZINC000131391749	196164200	/nfs/dbraw/zinc/16/42/00/196164200.db2.gz	WNEOMPVQZGRQNB-OLZOCXBDSA-N	0	3	321.421	2.216	10	0		DEAEHN
CN[C@@H](c1ncccc1F)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000131547563	196178873	/nfs/dbraw/zinc/17/88/73/196178873.db2.gz	GYAPQBMIGZPOMF-NTZNESFSSA-N	0	3	300.399	2.085	10	0		DEAEHN
O=C(C1CCN(CCn2ccnc2)CC1)N1CCc2ccccc21	ZINC000131832302	196202842	/nfs/dbraw/zinc/20/28/42/196202842.db2.gz	MLAYFBITBPYQAD-UHFFFAOYSA-N	0	3	324.428	2.184	10	0		DEAEHN
C[C@H]1CC[C@](O)(c2c(Br)cnn2CCN(C)C)C1	ZINC000132360243	196249174	/nfs/dbraw/zinc/24/91/74/196249174.db2.gz	ZKBOTSOLAFIEMT-GXFFZTMASA-N	0	3	316.243	2.215	10	0		DEAEHN
CC(C)(CNC(=O)[C@@H]1CCCc2n[nH]cc21)N1CCCCC1	ZINC000132381184	196250827	/nfs/dbraw/zinc/25/08/27/196250827.db2.gz	ZRAXBDXZVJMATA-CYBMUJFWSA-N	0	3	304.438	2.210	10	0		DEAEHN
C[C@@H]1CNC[C@@H](COCc2cccc(F)c2Br)O1	ZINC000132495641	196259979	/nfs/dbraw/zinc/25/99/79/196259979.db2.gz	OXTFFPOEXQSJRV-KOLCDFICSA-N	0	3	318.186	2.482	10	0		DEAEHN
CC[S@@](=O)CCNCCOc1ccc(Br)cc1	ZINC000132781157	196283593	/nfs/dbraw/zinc/28/35/93/196283593.db2.gz	QAXAYYFGQQFOPB-KRWDZBQOSA-N	0	3	320.252	2.186	10	0		DEAEHN
C[C@]1(C(=O)N(C[C@@H]2CCCO2)[C@@H]2CCSC2)CCCCN1	ZINC000133243691	196324212	/nfs/dbraw/zinc/32/42/12/196324212.db2.gz	OHBGXEHNIDIUDL-IJEWVQPXSA-N	0	3	312.479	2.032	10	0		DEAEHN
C[C@@](CN)(Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	ZINC000134476057	196394800	/nfs/dbraw/zinc/39/48/00/196394800.db2.gz	OUFIMFPEISHFBJ-INIZCTEOSA-N	0	3	304.415	2.376	10	0		DEAEHN
Cc1cc2c(ncnc2N2CCN(CCCCCO)CC2)s1	ZINC000189518830	225055293	/nfs/dbraw/zinc/05/52/93/225055293.db2.gz	FWMFHKFECRUCPD-UHFFFAOYSA-N	0	3	320.462	2.284	10	0		DEAEHN
C[C@H](O)CN(Cc1ccc(Br)c(F)c1)[C@@H](C)CO	ZINC000190857633	225097524	/nfs/dbraw/zinc/09/75/24/225097524.db2.gz	JWFAHGHUKVHWBO-UWVGGRQHSA-N	0	3	320.202	2.152	10	0		DEAEHN
CC[C@H](C)CS(=O)(=O)N1CCCC[C@@H](N2CCCC2)C1	ZINC000247516103	287551854	/nfs/dbraw/zinc/55/18/54/287551854.db2.gz	WGVOFXCCBUZTKS-LSDHHAIUSA-N	0	3	302.484	2.313	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NCCc1ccccn1)c1ccccc1	ZINC000047634245	424827275	/nfs/dbraw/zinc/82/72/75/424827275.db2.gz	WZEJONDDNBOTKO-KRWDZBQOSA-N	0	3	312.417	2.226	10	0		DEAEHN
O=C(NCCN1CCCC1)[C@@H]1CCCO[C@H]1c1ccccc1	ZINC000055036189	424838241	/nfs/dbraw/zinc/83/82/41/424838241.db2.gz	BPHIGZGLHKGXLF-SJORKVTESA-N	0	3	302.418	2.366	10	0		DEAEHN
CCOCCCCNC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000194363965	424876096	/nfs/dbraw/zinc/87/60/96/424876096.db2.gz	IZCXXRJQBMKWMU-MRXNPFEDSA-N	0	3	307.438	2.405	10	0		DEAEHN
Cc1nccn1C[C@H](C)CNC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000194895988	424879799	/nfs/dbraw/zinc/87/97/99/424879799.db2.gz	WOOIQXBVEDEXDO-GDBMZVCRSA-N	0	3	323.485	2.103	10	0		DEAEHN
Cn1c(CN2CCN(CC3CCCCC3)CC2)nnc1C1CC1	ZINC000195114339	424880369	/nfs/dbraw/zinc/88/03/69/424880369.db2.gz	MQCXPWJPDPAYMT-UHFFFAOYSA-N	0	3	317.481	2.390	10	0		DEAEHN
COc1ccc(CCC(=O)N2CCN3CCC[C@@H]3C2)cc1F	ZINC000195323547	424882928	/nfs/dbraw/zinc/88/29/28/424882928.db2.gz	PKLSOLLITSUGEK-CQSZACIVSA-N	0	3	306.381	2.074	10	0		DEAEHN
CN(C)[C@H]1CCCN(C(=O)c2nscc2Br)C1	ZINC000404801443	424930113	/nfs/dbraw/zinc/93/01/13/424930113.db2.gz	KWUXFVWFFXYICL-QMMMGPOBSA-N	0	3	318.240	2.072	10	0		DEAEHN
CN1C[C@H](CNCc2cccc(F)c2Br)CC1=O	ZINC000657695225	425386933	/nfs/dbraw/zinc/38/69/33/425386933.db2.gz	JRTKVUHCVTXAEG-VIFPVBQESA-N	0	3	315.186	2.156	10	0		DEAEHN
C[C@@H]1CC[C@@H](NC(=O)N2CCOC3(CNC3)C2)c2ccccc21	ZINC000333454508	268948645	/nfs/dbraw/zinc/94/86/45/268948645.db2.gz	YAWPGRLLVHBUCB-CZUORRHYSA-N	0	3	315.417	2.009	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)N2CCC[C@@H]2c2noc(C(C)C)n2)C1	ZINC000334110195	269019788	/nfs/dbraw/zinc/01/97/88/269019788.db2.gz	BDAOKGJBHDMDPI-CHWSQXEVSA-N	0	3	321.425	2.134	10	0		DEAEHN
CCC1(C(=O)NCC2(O)CCN(Cc3ccccc3)CC2)CC1	ZINC000397633048	269106944	/nfs/dbraw/zinc/10/69/44/269106944.db2.gz	OGXMGYXYVFBRDR-UHFFFAOYSA-N	0	3	316.445	2.320	10	0		DEAEHN
CC(=O)c1cccc(OC[C@@H](O)CNCCOC(C)(C)C)c1	ZINC000515637223	269352519	/nfs/dbraw/zinc/35/25/19/269352519.db2.gz	ICFCOGFNFDLOBK-HNNXBMFYSA-N	0	3	309.406	2.034	10	0		DEAEHN
O=C1NCCC[C@H]1N[C@H]1CCc2cc(Br)ccc2C1	ZINC000104358111	275023207	/nfs/dbraw/zinc/02/32/07/275023207.db2.gz	SIUJPPZUZAVBMX-UONOGXRCSA-N	0	3	323.234	2.175	10	0		DEAEHN
C(CN1CCO[C@H]2CCCC[C@H]21)N1CCO[C@@H]2CCCC[C@H]21	ZINC000246714987	275392776	/nfs/dbraw/zinc/39/27/76/275392776.db2.gz	MCWCTGOGKOQFQX-TVFCKZIOSA-N	0	3	308.466	2.273	10	0		DEAEHN
CC(C)n1nnnc1CNC(C)(C)CN(C)Cc1ccccc1	ZINC000091075150	276093191	/nfs/dbraw/zinc/09/31/91/276093191.db2.gz	ZMYUMFWDCYKMRF-UHFFFAOYSA-N	0	3	316.453	2.254	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1cc(C)cc(C)c1	ZINC000176900693	276179729	/nfs/dbraw/zinc/17/97/29/276179729.db2.gz	ILPHAHKBIYNNPK-INIZCTEOSA-N	0	3	317.433	2.185	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)Nc1ccccc1OC	ZINC000177697260	276182891	/nfs/dbraw/zinc/18/28/91/276182891.db2.gz	JEUWVYXOLHFYKZ-AWEZNQCLSA-N	0	3	305.422	2.050	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@H]1[C@H](C)CCC[C@@H]1C	ZINC000246277817	277223343	/nfs/dbraw/zinc/22/33/43/277223343.db2.gz	WNUXLICGJAWUCJ-XUWVNRHRSA-N	0	3	311.470	2.221	10	0		DEAEHN
CC(C)(C)c1nnsc1C(=O)N[C@@H]1CCN2CCCC[C@H]12	ZINC000408320361	277280711	/nfs/dbraw/zinc/28/07/11/277280711.db2.gz	KZCFXWHMMSLQOO-GHMZBOCLSA-N	0	3	308.451	2.192	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1cc(F)cc2nccnc21	ZINC000194920063	277436688	/nfs/dbraw/zinc/43/66/88/277436688.db2.gz	FFHGPZZDFNIPMC-ZDUSSCGKSA-N	0	3	318.396	2.475	10	0		DEAEHN
COc1cccc2c1CCN(C[C@@H](O)CC(F)(F)F)CC2	ZINC000365357773	278028208	/nfs/dbraw/zinc/02/82/08/278028208.db2.gz	MSTVQUBAYMDAQB-LBPRGKRZSA-N	0	3	303.324	2.409	10	0		DEAEHN
C[C@@H]1NCCN(C(=O)C2=Cc3cc(Cl)ccc3OC2)[C@H]1C	ZINC000262899371	278049891	/nfs/dbraw/zinc/04/98/91/278049891.db2.gz	XMVBMYSYJZEQLN-QWRGUYRKSA-N	0	3	306.793	2.325	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)Nc1ccc(C(=O)NC2CC2)cc1	ZINC000261619004	278221250	/nfs/dbraw/zinc/22/12/50/278221250.db2.gz	BZIAIYQEIXAZRJ-OAHLLOKOSA-N	0	3	315.417	2.296	10	0		DEAEHN
C[C@H](N[C@H]1CCC(=O)N[C@@H]1C1CC1)C(=O)N1CCCCCC1	ZINC000328844985	278280726	/nfs/dbraw/zinc/28/07/26/278280726.db2.gz	RJVKKTPDCSNLNX-DUVNUKRYSA-N	0	3	307.438	2.265	10	0		DEAEHN
C[C@@H](CO)N(C)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000119619901	278288246	/nfs/dbraw/zinc/28/82/46/278288246.db2.gz	LLCUJBTUUREBKI-YJBOKZPZSA-N	0	3	319.449	2.063	10	0		DEAEHN
CC(C)(C)NC(=O)NC(=O)CN1CCC[C@]2(CC=CCC2)C1	ZINC000114495735	278363789	/nfs/dbraw/zinc/36/37/89/278363789.db2.gz	BNJGHJAALHGTPK-QGZVFWFLSA-N	0	3	307.438	2.433	10	0		DEAEHN
CC(C)CCS(=O)(=O)N1CCCC[C@H](N2CCCC2)C1	ZINC000107708153	278776665	/nfs/dbraw/zinc/77/66/65/278776665.db2.gz	FASMFRQCKOCCLP-HNNXBMFYSA-N	0	3	302.484	2.313	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H]1OCCc2ccccc21	ZINC000129603258	278973266	/nfs/dbraw/zinc/97/32/66/278973266.db2.gz	ZVIXOEVIPKQABE-DOTOQJQBSA-N	0	3	304.434	2.393	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)CC[N@@H+]1C	ZINC000408410589	280007509	/nfs/dbraw/zinc/00/75/09/280007509.db2.gz	VCFIFIAMXSZUQM-WCQYABFASA-N	0	3	318.417	2.318	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)CC[N@H+]1C	ZINC000408410589	280007510	/nfs/dbraw/zinc/00/75/10/280007510.db2.gz	VCFIFIAMXSZUQM-WCQYABFASA-N	0	3	318.417	2.318	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@@H]1NCc1ccc(Br)c(F)c1	ZINC000282480406	280040190	/nfs/dbraw/zinc/04/01/90/280040190.db2.gz	VHRXSVSMGZTDGJ-PELKAZGASA-N	0	3	315.186	2.345	10	0		DEAEHN
CC[C@@H](NCC1(C(N)=O)CCOCC1)c1ccccc1OC	ZINC000153211836	280185236	/nfs/dbraw/zinc/18/52/36/280185236.db2.gz	XAZVDWFIQSWMGG-CQSZACIVSA-N	0	3	306.406	2.018	10	0		DEAEHN
C[C@H](C(=O)N(CCN(C)C)Cc1ccccn1)C1CCOCC1	ZINC000132263456	281984975	/nfs/dbraw/zinc/98/49/75/281984975.db2.gz	OWFFWASYCOIDDA-HNNXBMFYSA-N	0	3	319.449	2.035	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@@]2(O)CCCC[C@H]2C1)N1CCCCCC1	ZINC000246854909	289300583	/nfs/dbraw/zinc/30/05/83/289300583.db2.gz	CFPCVABGLLAIHU-RYRKJORJSA-N	0	3	308.466	2.405	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)N[C@H](C2CCCC2)C(F)(F)F)C1	ZINC000127208096	289383450	/nfs/dbraw/zinc/38/34/50/289383450.db2.gz	ZJPKASHOLUVOPG-NWDGAFQWSA-N	0	3	307.360	2.453	10	0		DEAEHN
C[C@H](CN[C@@H]1CCCOc2ccc(F)cc21)N1CCOCC1	ZINC000123286360	289691842	/nfs/dbraw/zinc/69/18/42/289691842.db2.gz	AGQHKVOQGLPAHM-CZUORRHYSA-N	0	3	308.397	2.350	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@]2(O)CCCC[C@H]2C1)N1CCCCCC1	ZINC000246854937	298088147	/nfs/dbraw/zinc/08/81/47/298088147.db2.gz	CFPCVABGLLAIHU-SOLBZPMBSA-N	0	3	308.466	2.405	10	0		DEAEHN
Fc1ccc2c(c1)OCCC[C@@H]2N[C@H]1CCc2ncnn2C1	ZINC000182131676	303132886	/nfs/dbraw/zinc/13/28/86/303132886.db2.gz	VTLSJDZYSYFNEG-JSGCOSHPSA-N	0	3	302.353	2.236	10	0		DEAEHN
C[C@H]1CC(NCc2c(Br)cnn2C)C[C@H](C)O1	ZINC000584565226	337361919	/nfs/dbraw/zinc/36/19/19/337361919.db2.gz	FTCCFMNNFKPCRX-IUCAKERBSA-N	0	3	302.216	2.228	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)OC(C)(C)C	ZINC000584604958	337371499	/nfs/dbraw/zinc/37/14/99/337371499.db2.gz	AFJWHEDNSWBCOI-AVGNSLFASA-N	0	3	300.443	2.232	10	0		DEAEHN
Cc1ccc(C2(O)CCN(Cc3ccccc3)CC2)c(CO)n1	ZINC000584629609	337376595	/nfs/dbraw/zinc/37/65/95/337376595.db2.gz	MJPKNOUXYDQAEJ-UHFFFAOYSA-N	0	3	312.413	2.366	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N(C)[C@@H]1CCN(C)C[C@H]1C	ZINC000246173706	519522354	/nfs/dbraw/zinc/52/23/54/519522354.db2.gz	GIFGDSNGSOYUPV-HUUCEWRRSA-N	0	3	321.469	2.021	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)ccc1F	ZINC000247381407	519703610	/nfs/dbraw/zinc/70/36/10/519703610.db2.gz	PTCVXUHACYXVSP-MEDUHNTESA-N	0	3	321.396	2.243	10	0		DEAEHN
CC(C)c1ccccc1OC[C@H](O)CN1CC[C@H](O)[C@H](C)C1	ZINC000249596476	519847953	/nfs/dbraw/zinc/84/79/53/519847953.db2.gz	WZNVDNAYTPCQEH-INMHGKMJSA-N	0	3	307.434	2.252	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCN([C@H](C)c2cccnc2)CC1)N(C)C	ZINC000162156660	520583412	/nfs/dbraw/zinc/58/34/12/520583412.db2.gz	UCITVWDUHGQWDL-WBVHZDCISA-N	0	3	318.465	2.017	10	0		DEAEHN
Cc1nnc([C@@H]2CCCN(Cc3nc4cccnc4s3)C2)[nH]1	ZINC000328858486	534562323	/nfs/dbraw/zinc/56/23/23/534562323.db2.gz	DMJHAFZDMSNFDN-LLVKDONJSA-N	0	3	314.418	2.497	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H](C)Cc2c(C)noc2C)C1	ZINC000247453220	521620973	/nfs/dbraw/zinc/62/09/73/521620973.db2.gz	ZNJKXQOPSYAUFR-BXUZGUMPSA-N	0	3	308.426	2.006	10	0		DEAEHN
CCN1CC[C@H](N(C)C(=O)c2cn(CCC(C)C)nn2)[C@@H](C)C1	ZINC000247484480	521718749	/nfs/dbraw/zinc/71/87/49/521718749.db2.gz	TUYXTGATMSWZLO-HOCLYGCPSA-N	0	3	321.469	2.127	10	0		DEAEHN
COCCN(CCO)CCOc1c(Cl)cccc1Cl	ZINC000104958482	523706379	/nfs/dbraw/zinc/70/63/79/523706379.db2.gz	NDDGAGMQVWKYOU-UHFFFAOYSA-N	0	3	308.205	2.313	10	0		DEAEHN
CN1CCC2(CCN(Cc3ccc(-c4cc[nH]n4)o3)CC2)C1=O	ZINC000366033137	523787268	/nfs/dbraw/zinc/78/72/68/523787268.db2.gz	YEPJMLPIUJUHQX-UHFFFAOYSA-N	0	3	314.389	2.114	10	0		DEAEHN
COCCOc1ccccc1CN1CC[C@H](c2cnn(C)c2)C1	ZINC000128506161	524058218	/nfs/dbraw/zinc/05/82/18/524058218.db2.gz	RJBGJGMRGOCDCK-HNNXBMFYSA-N	0	3	315.417	2.435	10	0		DEAEHN
Cc1ccc(NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1C(N)=O	ZINC000246850261	525113309	/nfs/dbraw/zinc/11/33/09/525113309.db2.gz	RBUDKKAWKAWIBL-GXTWGEPZSA-N	0	3	318.421	2.040	10	0		DEAEHN
Cc1ccc(OCCN(C)C(=O)NC[C@@H](C)N(C)C2CC2)cc1	ZINC000105266431	525415227	/nfs/dbraw/zinc/41/52/27/525415227.db2.gz	GBRBTPVAZYCLSW-OAHLLOKOSA-N	0	3	319.449	2.498	10	0		DEAEHN
CC(=O)[C@](C)(O)CN1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000411129552	527151845	/nfs/dbraw/zinc/15/18/45/527151845.db2.gz	HBIJUMFHUGLKPT-QGZVFWFLSA-N	0	3	324.852	2.188	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)CN(C)[C@H]2CCN(C)[C@@H](C)C2)c1C	ZINC000299378131	527158490	/nfs/dbraw/zinc/15/84/90/527158490.db2.gz	SKSSJMTXRJXFNH-NHYWBVRUSA-N	0	3	319.449	2.431	10	0		DEAEHN
CCCCCNC(=O)[C@@H](C)N1CCC[C@H]1Cn1ccnc1C	ZINC000247074689	535063937	/nfs/dbraw/zinc/06/39/37/535063937.db2.gz	OUMOOTPGTFSMHG-ZBFHGGJFSA-N	0	3	306.454	2.351	10	0		DEAEHN
CC(C)(C)c1ccc2c(c1)CCN2C(=O)C1(N)CCOCC1	ZINC000261863967	535122884	/nfs/dbraw/zinc/12/28/84/535122884.db2.gz	NKKOFDNGRUKHDG-UHFFFAOYSA-N	0	3	302.418	2.381	10	0		DEAEHN
CC(C)N1CCC[C@H](N2CC[C@@H](CNc3ccccn3)C2)C1=O	ZINC000248358600	535178029	/nfs/dbraw/zinc/17/80/29/535178029.db2.gz	QYUYOEQUDYMLHW-HOTGVXAUSA-N	0	3	316.449	2.215	10	0		DEAEHN
CC[C@@H](C)N1CCN(c2nnc(CCc3ccco3)n2C)CC1	ZINC000453447957	535567513	/nfs/dbraw/zinc/56/75/13/535567513.db2.gz	MOQZOLOMOBUJDY-CQSZACIVSA-N	0	3	317.437	2.114	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)N[C@@H](C)[C@H](C)CO)c1ccccc1	ZINC000246958488	535671705	/nfs/dbraw/zinc/67/17/05/535671705.db2.gz	FZJMACVFSMZZAC-HLLBOEOZSA-N	0	3	321.465	2.386	10	0		DEAEHN
CCc1cccc(OCCN2CCN(CCOC)[C@@H](C)C2)c1	ZINC000247804661	535907331	/nfs/dbraw/zinc/90/73/31/535907331.db2.gz	SGEOZGLFZSVPBM-INIZCTEOSA-N	0	3	306.450	2.280	10	0		DEAEHN
CC[C@H](Cc1ccccc1)NC(=O)N1CCN2CCC[C@H]2C1	ZINC000247656071	536136198	/nfs/dbraw/zinc/13/61/98/536136198.db2.gz	YJMXPTGXHSBZGK-SJORKVTESA-N	0	3	301.434	2.497	10	0		DEAEHN
COc1ccc(NC(=O)CN2CCN3CCC[C@H]3C2)cc1Cl	ZINC000246735810	536766646	/nfs/dbraw/zinc/76/66/46/536766646.db2.gz	WIDWYNCOAUYRIX-ZDUSSCGKSA-N	0	3	323.824	2.067	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@]2(C1)NCCc1nc[nH]c12	ZINC000724104165	563496568	/nfs/dbraw/zinc/49/65/68/563496568.db2.gz	ZBVCGFKBIVDBRN-BDJLRTHQSA-N	0	3	306.410	2.218	10	0		DEAEHN
CCN(C)c1ccc(CNC[C@@H](O)c2ccccc2OC)cn1	ZINC000190846334	625489953	/nfs/dbraw/zinc/48/99/53/625489953.db2.gz	LNVYLFZISBNOHB-MRXNPFEDSA-N	0	3	315.417	2.370	10	0		DEAEHN
COCC[C@@H](N)C(=O)N[C@H]1CCSc2ccc(Cl)cc21	ZINC000052792484	625104945	/nfs/dbraw/zinc/10/49/45/625104945.db2.gz	YXFTWQSVQAUVPM-NEPJUHHUSA-N	0	3	314.838	2.357	10	0		DEAEHN
C[C@H](N[C@@H]1CCC[C@H]1CNC(=O)OC(C)(C)C)c1nncn1C	ZINC000299982798	633307132	/nfs/dbraw/zinc/30/71/32/633307132.db2.gz	CVNBMZUVGMBAPK-RWMBFGLXSA-N	0	3	323.441	2.159	10	0		DEAEHN
C[C@H](C(=O)Nc1ncccn1)N1C[C@H]2[C@@H]3CC[C@@H](C3)[C@]2(C)C1	ZINC000585159440	635718253	/nfs/dbraw/zinc/71/82/53/635718253.db2.gz	OWONNMMVMCSGBH-QDEPRCCBSA-N	0	3	300.406	2.172	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)Nc1ccc(C)c(C(=O)NC(C)C)c1	ZINC000236897965	636111038	/nfs/dbraw/zinc/11/10/38/636111038.db2.gz	FMHJLGOIFKDGHA-XHDPSFHLSA-N	0	3	305.422	2.445	10	0		DEAEHN
COC(=O)/C(C)=C/CN1C[C@@H]2CN(c3ccccc3)C[C@H]2C1	ZINC000748812798	638593431	/nfs/dbraw/zinc/59/34/31/638593431.db2.gz	HQRAYKNLEIGJNN-RCVIBLRSSA-N	0	3	300.402	2.174	10	0		DEAEHN
CN(C)Cc1ccccc1NC(=O)[C@@H]1CCCC12OCCO2	ZINC000806441206	645831287	/nfs/dbraw/zinc/83/12/87/645831287.db2.gz	MERMEBMOXNDTHP-AWEZNQCLSA-N	0	3	304.390	2.230	10	0		DEAEHN
COC(=O)C[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000151464366	646385802	/nfs/dbraw/zinc/38/58/02/646385802.db2.gz	PURFPBDKMOZUHK-DZGCQCFKSA-N	0	3	305.374	2.003	10	0		DEAEHN
Cc1[nH]c2ccc(F)cc2c1CC(=O)N[C@@H]1CN2CCC1CC2	ZINC000222555534	646452755	/nfs/dbraw/zinc/45/27/55/646452755.db2.gz	OBVJILCZBUYYID-QGZVFWFLSA-N	0	3	315.392	2.368	10	0		DEAEHN
C[C@H](N[C@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C)c1nncn1C	ZINC000229084603	646666044	/nfs/dbraw/zinc/66/60/44/646666044.db2.gz	CVNBMZUVGMBAPK-XQQFMLRXSA-N	0	3	323.441	2.159	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCn2c(C(C)C)nnc2[C@H]1C)N(C)C	ZINC000188800596	646753591	/nfs/dbraw/zinc/75/35/91/646753591.db2.gz	FMLZCWRRYQJAEN-OLZOCXBDSA-N	0	3	307.442	2.035	10	0		DEAEHN
C[C@H]1CCCN(CCNC(=O)c2cc(Cl)nc(N(C)C)c2)C1	ZINC000733130889	647889353	/nfs/dbraw/zinc/88/93/53/647889353.db2.gz	UCCQRRIQDCSXDA-LBPRGKRZSA-N	0	3	324.856	2.263	10	0		DEAEHN
CC(C)[C@@H](CN(C)C)NC(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000733164298	647893670	/nfs/dbraw/zinc/89/36/70/647893670.db2.gz	ONMCNHYVHGFTCO-MRXNPFEDSA-N	0	3	302.418	2.060	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCCO[C@H](CNCc2ccoc2)C1	ZINC000389806506	685435826	/nfs/dbraw/zinc/43/58/26/685435826.db2.gz	LMUQSFRLIHKSKG-CQSZACIVSA-N	0	3	310.394	2.395	10	0		DEAEHN
Cc1cc(C)cc([C@@H](O)CN2CCN(CC(C)(C)O)[C@H](C)C2)c1	ZINC000189927497	684392684	/nfs/dbraw/zinc/39/26/84/684392684.db2.gz	ZEWUUNZBCBDLGK-AEFFLSMTSA-N	0	3	320.477	2.114	10	0		DEAEHN
Cc1ccc(CC(=O)NC[C@@H]2CCN(C)[C@H]2c2cccnc2)cn1	ZINC000886052903	691993494	/nfs/dbraw/zinc/99/34/94/691993494.db2.gz	YJFUVBONLDDXNS-HKUYNNGSSA-N	0	3	324.428	2.137	10	0		DEAEHN
Cc1noc(CCC(=O)O[C@H]2CCN(Cc3ccccc3)C2)n1	ZINC000176389792	782366252	/nfs/dbraw/zinc/36/62/52/782366252.db2.gz	CSSRCGWXJSTTPK-HNNXBMFYSA-N	0	3	315.373	2.128	10	0		DEAEHN
Cc1cn(C)nc1CN[C@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000723504962	777115666	/nfs/dbraw/zinc/11/56/66/777115666.db2.gz	JSUZOGQSNCNOCM-GFCCVEGCSA-N	0	3	308.426	2.074	10	0		DEAEHN
C[C@@](O)(CNC[C@H](O)c1ccsc1)C(F)(F)C(F)(F)F	ZINC000724056610	777232345	/nfs/dbraw/zinc/23/23/45/777232345.db2.gz	FPOAHKOQCXYSER-DTWKUNHWSA-N	0	3	319.295	2.320	10	0		DEAEHN
Cn1cc(CN[C@H](CCO)C2CCCC2)c(Br)n1	ZINC000725115012	777588208	/nfs/dbraw/zinc/58/82/08/777588208.db2.gz	VLEMPVFKZFXQLA-GFCCVEGCSA-N	0	3	316.243	2.213	10	0		DEAEHN
Cc1nn(C)cc1CN[C@H]1CN(C(=O)OC(C)(C)C)CC1(C)C	ZINC000721905663	781600125	/nfs/dbraw/zinc/60/01/25/781600125.db2.gz	SGUPFQZJMXVDKG-AWEZNQCLSA-N	0	3	322.453	2.464	10	0		DEAEHN
CCN1CC[C@@H]1CNc1ccc(I)cn1	ZINC000712591947	792191816	/nfs/dbraw/zinc/19/18/16/792191816.db2.gz	OIHPYCRFDGXGOO-SNVBAGLBSA-N	0	3	317.174	2.192	10	0		DEAEHN
COc1cc(CN[C@H]2C[C@H](S(C)(=O)=O)C2)ccc1Cl	ZINC000714248901	792305810	/nfs/dbraw/zinc/30/58/10/792305810.db2.gz	HHRLQMSOPPKXOX-XYPYZODXSA-N	0	3	303.811	2.014	10	0		DEAEHN
CCn1cc(CNC[C@H]2CCCCN2Cc2ccccc2)nn1	ZINC000714904619	792357162	/nfs/dbraw/zinc/35/71/62/792357162.db2.gz	DEHIOEFNXNKNSR-GOSISDBHSA-N	0	3	313.449	2.442	10	0		DEAEHN
CN1CC[C@H](NC(=O)N[C@H]2CCCOCC2)[C@@H]1c1ccccc1	ZINC000245640548	797935229	/nfs/dbraw/zinc/93/52/29/797935229.db2.gz	YTNQZWWUOFOIGF-ULQDDVLXSA-N	0	3	317.433	2.300	10	0		DEAEHN
C[C@@H](O)[C@@H](O)CNCc1cccc(OCc2ccccc2)c1	ZINC000717337994	799381239	/nfs/dbraw/zinc/38/12/39/799381239.db2.gz	AVQSVWMWVQKVKQ-KDOFPFPSSA-N	0	3	301.386	2.097	10	0		DEAEHN
O[C@@]1(CCNCc2cscc2Br)CCOC1	ZINC000404219486	802009649	/nfs/dbraw/zinc/00/96/49/802009649.db2.gz	RHUPUPZLDPFWSI-NSHDSACASA-N	0	3	306.225	2.142	10	0		DEAEHN
CC(C)(C)OC(=O)NC1CCN(CCNCc2ccoc2)CC1	ZINC000721928866	1084485277	/nfs/dbraw/zinc/48/52/77/1084485277.db2.gz	CQVRBGGYVYNGLS-UHFFFAOYSA-N	0	3	323.437	2.358	10	0		DEAEHN
Cc1ncc(CN[C@H]2CN(C(=O)OC(C)(C)C)CC2(C)C)n1C	ZINC000721939233	1084717687	/nfs/dbraw/zinc/71/76/87/1084717687.db2.gz	KGBFJXLWLLPSQO-AWEZNQCLSA-N	0	3	322.453	2.464	10	0		DEAEHN
Cc1n[nH]cc1CNCC12CC(C1)CN2C(=O)OC(C)(C)C	ZINC000701921901	1086395827	/nfs/dbraw/zinc/39/58/27/1086395827.db2.gz	AQVOENZTFDFOEK-UHFFFAOYSA-N	0	3	306.410	2.207	10	0		DEAEHN
Cc1nc(NC(=O)[C@H](N)CN(C)Cc2ccccc2)sc1C	ZINC000702354424	1086422934	/nfs/dbraw/zinc/42/29/34/1086422934.db2.gz	BXBGEXBPKJQEAJ-CQSZACIVSA-N	0	3	318.446	2.158	10	0		DEAEHN
Cc1nc(NC(=O)[C@@H](N)CN(C)Cc2ccccc2)sc1C	ZINC000702354417	1086423135	/nfs/dbraw/zinc/42/31/35/1086423135.db2.gz	BXBGEXBPKJQEAJ-AWEZNQCLSA-N	0	3	318.446	2.158	10	0		DEAEHN
C[C@H](Cc1ccccn1)N[C@H]1CON(C(=O)OC(C)(C)C)C1	ZINC000703316068	1086493421	/nfs/dbraw/zinc/49/34/21/1086493421.db2.gz	XEPNHBOVQCESKS-TZMCWYRMSA-N	0	3	307.394	2.153	10	0		DEAEHN
COC[C@H](C)OC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000704405065	1086580951	/nfs/dbraw/zinc/58/09/51/1086580951.db2.gz	OBPINPPBUCUPOZ-OFQRWUPVSA-N	0	3	306.406	2.268	10	0		DEAEHN
Cc1cc(Cl)cc(CNC(C)(C)CNS(C)(=O)=O)c1	ZINC000708274572	1086677995	/nfs/dbraw/zinc/67/79/95/1086677995.db2.gz	IUSAAKSWLVRVRV-UHFFFAOYSA-N	0	3	304.843	2.066	10	0		DEAEHN
CCN(C(=O)c1ccc(Br)nc1)[C@H]1CCN(C)C1	ZINC000710566980	1086687652	/nfs/dbraw/zinc/68/76/52/1086687652.db2.gz	XMRSDWQWUNFWFE-NSHDSACASA-N	0	3	312.211	2.010	10	0		DEAEHN
CC[C@H](CN[C@H]1CCC1(OC)OC)NC(=O)OC(C)(C)C	ZINC000710959128	1086691374	/nfs/dbraw/zinc/69/13/74/1086691374.db2.gz	KXFVLOGWJKXYDQ-NEPJUHHUSA-N	0	3	302.415	2.031	10	0		DEAEHN
O=C(NCc1cnc(Cl)s1)[C@@H]1CNCc2ccccc21	ZINC000718165165	1088395052	/nfs/dbraw/zinc/39/50/52/1088395052.db2.gz	OKOAJSBDMIENCZ-GFCCVEGCSA-N	0	3	307.806	2.300	10	0		DEAEHN
Cc1nc(CNC[C@@H]2CCCN2C)sc1Br	ZINC000719305095	1088944159	/nfs/dbraw/zinc/94/41/59/1088944159.db2.gz	LYMJSFCECUBBBT-VIFPVBQESA-N	0	3	304.257	2.398	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1ccc(F)cc1F	ZINC000076686560	185031397	/nfs/dbraw/zinc/03/13/97/185031397.db2.gz	LWLBLTVNDZZHFU-LBPRGKRZSA-N	0	3	313.348	2.197	10	0		DEAEHN
CCOC(=O)CSC[C@@H](NC)c1ccc2c(c1)OCCO2	ZINC000081796374	192324385	/nfs/dbraw/zinc/32/43/85/192324385.db2.gz	LBRYGWYCXAPXEL-GFCCVEGCSA-N	0	3	311.403	2.015	10	0		DEAEHN
N[C@@H]1CCC[C@H]1S(=O)(=O)c1ccc(Br)cc1	ZINC000081934016	192341271	/nfs/dbraw/zinc/34/12/71/192341271.db2.gz	XIXAFHJXBRVKNB-GHMZBOCLSA-N	0	3	304.209	2.103	10	0		DEAEHN
CN[C@@H](CS(=O)(=O)c1ccccc1Br)C1CC1	ZINC000081931501	192341887	/nfs/dbraw/zinc/34/18/87/192341887.db2.gz	RKSMPNWKXPKXIW-NSHDSACASA-N	0	3	318.236	2.221	10	0		DEAEHN
Cc1c([C@H]2OCC[C@@H]2NC[C@@H](O)c2cccc(F)c2)cnn1C	ZINC000328619962	231249292	/nfs/dbraw/zinc/24/92/92/231249292.db2.gz	GONMBVNMVKDKSN-GVDBMIGSSA-N	0	3	319.380	2.021	10	0		DEAEHN
CC[C@H]1CN(C(=O)c2snnc2C(C)(C)C)[C@@H](CC)CN1	ZINC000087456117	185225619	/nfs/dbraw/zinc/22/56/19/185225619.db2.gz	AHDDKWVWFOFXLL-QWRGUYRKSA-N	0	3	310.467	2.438	10	0		DEAEHN
CC[C@@H]1CN[C@@H](CC)CN1C(=O)c1snnc1C(C)(C)C	ZINC000087456116	185225683	/nfs/dbraw/zinc/22/56/83/185225683.db2.gz	AHDDKWVWFOFXLL-WDEREUQCSA-N	0	3	310.467	2.438	10	0		DEAEHN
CC(C)NCc1snnc1-c1ccc(S(C)(=O)=O)cc1	ZINC000087457485	185225863	/nfs/dbraw/zinc/22/58/63/185225863.db2.gz	WHQCXCMKEXMLMB-UHFFFAOYSA-N	0	3	311.432	2.107	10	0		DEAEHN
CCCN[C@@H](CC(N)=O)c1ccc(OC)c(OC(F)F)c1	ZINC000087551802	185227988	/nfs/dbraw/zinc/22/79/88/185227988.db2.gz	DBIGYHIAWBIQDO-JTQLQIEISA-N	0	3	302.321	2.213	10	0		DEAEHN
NN=c1cc(Sc2ccccc2Br)[nH]c(N)n1	ZINC000087889484	185234786	/nfs/dbraw/zinc/23/47/86/185234786.db2.gz	OWHQPLFIJFZCHA-UHFFFAOYSA-N	0	3	312.196	2.258	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@]1(CN)Nc1ccccc1Cl	ZINC000087915971	185237273	/nfs/dbraw/zinc/23/72/73/185237273.db2.gz	DYQIUKZHOARAMY-CHWSQXEVSA-N	0	3	302.827	2.047	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@@]1(CN)Nc1ccc(Cl)cc1	ZINC000087914282	185237368	/nfs/dbraw/zinc/23/73/68/185237368.db2.gz	KSFCWLZBWULAKX-OLZOCXBDSA-N	0	3	302.827	2.047	10	0		DEAEHN
CCOCCN(C)[C@H](CN)c1cc(Br)cs1	ZINC000087975877	185237726	/nfs/dbraw/zinc/23/77/26/185237726.db2.gz	HLMHPKYUXLRYLS-SNVBAGLBSA-N	0	3	307.257	2.479	10	0		DEAEHN
CC[C@@H](N)CS(=O)(=O)Cc1ccccc1Br	ZINC000088074707	185238769	/nfs/dbraw/zinc/23/87/69/185238769.db2.gz	CDIUHDVISGEPND-SNVBAGLBSA-N	0	3	306.225	2.101	10	0		DEAEHN
O=S(=O)(Nc1c(Cl)cccc1Cl)[C@@H]1CCCNC1	ZINC000088171777	185241034	/nfs/dbraw/zinc/24/10/34/185241034.db2.gz	ZQPUKCDPMRPNFI-MRVPVSSYSA-N	0	3	309.218	2.487	10	0		DEAEHN
CC[C@H](CN)S(=O)(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000088471777	185252038	/nfs/dbraw/zinc/25/20/38/185252038.db2.gz	CCKQGMXETSTHSV-SNVBAGLBSA-N	0	3	312.313	2.064	10	0		DEAEHN
CCCCc1nc(Cl)c(CNCCN(C)CCOC)[nH]1	ZINC000088399233	185248429	/nfs/dbraw/zinc/24/84/29/185248429.db2.gz	LAFFYBIVROSMGB-UHFFFAOYSA-N	0	3	302.850	2.074	10	0		DEAEHN
CCOC(=O)[C@](C)(N)CCCN1CCC(C(F)(F)F)CC1	ZINC000088435553	185250343	/nfs/dbraw/zinc/25/03/43/185250343.db2.gz	XEHAGUKBVMNNPX-CYBMUJFWSA-N	0	3	310.360	2.321	10	0		DEAEHN
CCN[C@](CO)(CN(C)CCC(F)(F)F)c1ccccc1	ZINC000088439526	185250800	/nfs/dbraw/zinc/25/08/00/185250800.db2.gz	VIBAWSFVNIEDJP-AWEZNQCLSA-N	0	3	304.356	2.368	10	0		DEAEHN
CCN[C@H](c1ccc(C)cc1)[C@H](C)S(=O)(=O)CCCOC	ZINC000081986156	192348852	/nfs/dbraw/zinc/34/88/52/192348852.db2.gz	NKAXFHLFHCLJNL-HOCLYGCPSA-N	0	3	313.463	2.485	10	0		DEAEHN
CN[C@@H](c1ccccc1)[C@@H](C(C)C)S(=O)(=O)CCCOC	ZINC000081985745	192349002	/nfs/dbraw/zinc/34/90/02/192349002.db2.gz	JPKPHCZEAQIEFK-JKSUJKDBSA-N	0	3	313.463	2.423	10	0		DEAEHN
CCOC(=O)[C@@H]1CNCCN1[C@@H](C)c1ccc(Cl)s1	ZINC000088658014	185261882	/nfs/dbraw/zinc/26/18/82/185261882.db2.gz	WUJAOHZZLAQMHB-UWVGGRQHSA-N	0	3	302.827	2.299	10	0		DEAEHN
CCOC(=O)[C@H]1CNCCN1[C@@H](C)c1ccc(F)c(Cl)c1	ZINC000088657783	185261929	/nfs/dbraw/zinc/26/19/29/185261929.db2.gz	QYSSRLZBZBFRSD-IINYFYTJSA-N	0	3	314.788	2.377	10	0		DEAEHN
CCCN[C@H]1CCOC[C@H]1S(=O)(=O)Cc1cccc(C)c1	ZINC000081984212	192349948	/nfs/dbraw/zinc/34/99/48/192349948.db2.gz	KQIAAIGUNMCLRT-JKSUJKDBSA-N	0	3	311.447	2.067	10	0		DEAEHN
C[C@H](NC[C@@H](O)CO)c1cc2cc(Br)ccc2o1	ZINC000090282335	185289464	/nfs/dbraw/zinc/28/94/64/185289464.db2.gz	VQJDSDMXTQQEBU-GZMMTYOYSA-N	0	3	314.179	2.199	10	0		DEAEHN
C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)[C@@H]1COC[C@@H]1N	ZINC000090382175	185293748	/nfs/dbraw/zinc/29/37/48/185293748.db2.gz	HLROCZJSWHXLJB-DYLAAIIWSA-N	0	3	317.216	2.487	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1ccc(F)c(C(F)(F)F)c1	ZINC000090436282	185296106	/nfs/dbraw/zinc/29/61/06/185296106.db2.gz	OKJBJMYJHIBZES-KWQFWETISA-N	0	3	306.259	2.017	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1ccc(Cl)c2ncccc12	ZINC000090433783	185296256	/nfs/dbraw/zinc/29/62/56/185296256.db2.gz	ZIPKIHQGTARFCT-MFKMUULPSA-N	0	3	305.765	2.061	10	0		DEAEHN
CCCOc1ccc(NC(=O)[C@@H]2COC[C@H]2NC)cc1Cl	ZINC000090434326	185296454	/nfs/dbraw/zinc/29/64/54/185296454.db2.gz	JUZQDJNOOUZHKJ-DGCLKSJQSA-N	0	3	312.797	2.302	10	0		DEAEHN
C[C@]1(C(=O)Nc2c3ncsc3ccc2Cl)COC[C@H]1N	ZINC000090585550	185305044	/nfs/dbraw/zinc/30/50/44/185305044.db2.gz	FYFJPIUUMPLDIJ-RNCFNFMXSA-N	0	3	311.794	2.252	10	0		DEAEHN
CCCOc1ccc(NC(=O)[C@@]2(C)COC[C@@H]2N)cc1Cl	ZINC000090590084	185305336	/nfs/dbraw/zinc/30/53/36/185305336.db2.gz	GZGIEFHJYZSYQN-ZFWWWQNUSA-N	0	3	312.797	2.431	10	0		DEAEHN
C[C@]1(C(=O)Nc2cccc(-c3nccs3)c2)COC[C@H]1N	ZINC000090589994	185305388	/nfs/dbraw/zinc/30/53/88/185305388.db2.gz	GNVZRIPFQMFDHV-DOMZBBRYSA-N	0	3	303.387	2.112	10	0		DEAEHN
CN(Cc1ccc(Cl)cc1Cl)C(=O)[C@@]1(C)COC[C@H]1N	ZINC000090591496	185305481	/nfs/dbraw/zinc/30/54/81/185305481.db2.gz	BYHSKWLZURGGFM-OCCSQVGLSA-N	0	3	317.216	2.316	10	0		DEAEHN
C[C@H](Oc1ccccc1)C(=O)N1CCCSC[C@@H]1CN(C)C	ZINC000090699924	185310345	/nfs/dbraw/zinc/31/03/45/185310345.db2.gz	LOAKKQBORCVDHK-GJZGRUSLSA-N	0	3	322.474	2.350	10	0		DEAEHN
COc1ccc(CC(=O)N2CCCSC[C@H]2CN(C)C)cc1	ZINC000090699954	185310684	/nfs/dbraw/zinc/31/06/84/185310684.db2.gz	WXLOVQVOKUVFEE-OAHLLOKOSA-N	0	3	322.474	2.133	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccc(C(=O)OC(C)(C)C)cc1	ZINC000092457785	185320055	/nfs/dbraw/zinc/32/00/55/185320055.db2.gz	HGDYNEQTPQZZAM-HNNXBMFYSA-N	0	3	318.417	2.466	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cnc(NC)c(Cl)c1	ZINC000092674762	185332992	/nfs/dbraw/zinc/33/29/92/185332992.db2.gz	YXRYCUXYLIBREX-LBPRGKRZSA-N	0	3	310.829	2.333	10	0		DEAEHN
CCNc1ccc(Cl)c(C(=O)N(C)C[C@@H]2CCCN2C)n1	ZINC000092674215	185333257	/nfs/dbraw/zinc/33/32/57/185333257.db2.gz	YHVMTIZQIUJGRB-NSHDSACASA-N	0	3	310.829	2.333	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)NCCN1CCC[C@@H](C)C1	ZINC000186298371	282271589	/nfs/dbraw/zinc/27/15/89/282271589.db2.gz	MZLUWUGJKNTNTO-CYBMUJFWSA-N	0	3	323.412	2.365	10	0		DEAEHN
CCN[C@H](Cc1c(F)cccc1Cl)[C@H](C)S(C)(=O)=O	ZINC000168589114	197726088	/nfs/dbraw/zinc/72/60/88/197726088.db2.gz	SNWAECZYKMFEIU-TVQRCGJNSA-N	0	3	307.818	2.433	10	0		DEAEHN
Cc1cc(CCNCc2ccc(C(=O)N(C)C)[nH]2)cc(C)c1O	ZINC000190393883	282319885	/nfs/dbraw/zinc/31/98/85/282319885.db2.gz	MMVMFIRNEBPJLL-UHFFFAOYSA-N	0	3	315.417	2.371	10	0		DEAEHN
COC(=O)C(C)(C)[C@@H](NC[C@H](O)CSC)c1ccccc1	ZINC000614567746	362410028	/nfs/dbraw/zinc/41/00/28/362410028.db2.gz	LJHWGIHIKOMXGL-KBPBESRZSA-N	0	3	311.447	2.240	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](COC)c2ccccc2)C1	ZINC000245392620	282384607	/nfs/dbraw/zinc/38/46/07/282384607.db2.gz	BDUUTUNCBCUDDM-JKSUJKDBSA-N	0	3	305.422	2.158	10	0		DEAEHN
CO[C@]1(C)C[C@H](NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)C1(C)C	ZINC000245481911	282391166	/nfs/dbraw/zinc/39/11/66/282391166.db2.gz	CVJNBOFXBANWPT-VWPFQQQWSA-N	0	3	311.470	2.314	10	0		DEAEHN
COc1ccc2c(c1)[C@H](NC[C@@]1(CCO)CCOC1)CCCO2	ZINC000125477907	539472791	/nfs/dbraw/zinc/47/27/91/539472791.db2.gz	CYCPGQZTZYDUFY-SJLPKXTDSA-N	0	3	321.417	2.288	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)NCCN2CCC[C@@H](C)C2)cc1	ZINC000279541202	214954126	/nfs/dbraw/zinc/95/41/26/214954126.db2.gz	QCLXIATYWMHRDF-CQSZACIVSA-N	0	3	317.433	2.131	10	0		DEAEHN
CC(C)[C@H]([NH3+])CC(=O)Nc1cc(Br)ccc1[O-]	ZINC000136488520	539517669	/nfs/dbraw/zinc/51/76/69/539517669.db2.gz	JZPAMJJJVYELLF-SECBINFHSA-N	0	3	301.184	2.467	10	0		DEAEHN
Cc1nscc1C(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000181822991	199357662	/nfs/dbraw/zinc/35/76/62/199357662.db2.gz	AXIPWFIAPBEZMF-AWEZNQCLSA-N	0	3	303.431	2.354	10	0		DEAEHN
CC(C)OC1CCC(NC(=O)N2CC[C@@H](N3CC=CC3)C2)CC1	ZINC000151984822	539533830	/nfs/dbraw/zinc/53/38/30/539533830.db2.gz	AKGJZWXIEVMVPC-AQFXKWCLSA-N	0	3	321.465	2.378	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@H]1OCCc2ccccc21	ZINC000123818858	185845204	/nfs/dbraw/zinc/84/52/04/185845204.db2.gz	VECAGOCHGDJJLR-WBVHZDCISA-N	0	3	302.418	2.243	10	0		DEAEHN
NC[C@H]1OCCN(C2CC2)[C@@H]1c1ccccc1Br	ZINC000070289006	190877410	/nfs/dbraw/zinc/87/74/10/190877410.db2.gz	JZRDJLHPDWVQTG-ZIAGYGMSSA-N	0	3	311.223	2.312	10	0		DEAEHN
CCN1C(=O)C[C@@H](N)[C@@H]1c1ccc(Br)cc1F	ZINC000070293088	190877793	/nfs/dbraw/zinc/87/77/93/190877793.db2.gz	DDJOKZSQCFNHBP-PWSUYJOCSA-N	0	3	301.159	2.209	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCCC[C@H](n2cccn2)C1	ZINC000616627550	362900852	/nfs/dbraw/zinc/90/08/52/362900852.db2.gz	KOENEXANBUNERA-AWEZNQCLSA-N	0	3	308.426	2.435	10	0		DEAEHN
O[C@@H]1CCCC[C@H]1N1CCN(c2nc3ccccc3o2)CC1	ZINC000179286522	539640189	/nfs/dbraw/zinc/64/01/89/539640189.db2.gz	RPTONQJAMOOVIQ-HUUCEWRRSA-N	0	3	301.390	2.253	10	0		DEAEHN
Cc1ccc([C@H](C)NC[C@H](O)COC2CCOCC2)cc1F	ZINC000181343568	539651117	/nfs/dbraw/zinc/65/11/17/539651117.db2.gz	ZJUWBXGYVHNVPA-ZFWWWQNUSA-N	0	3	311.397	2.341	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cncc(Br)c1	ZINC000083550531	192372687	/nfs/dbraw/zinc/37/26/87/192372687.db2.gz	DJSIFRIPTUMFCY-GXFFZTMASA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@H](N)c1cc(Br)ccc1O[C@H]1CCN(C)C1=O	ZINC000071183106	190938229	/nfs/dbraw/zinc/93/82/29/190938229.db2.gz	XQXKXKMOMGAUJW-UFBFGSQYSA-N	0	3	313.195	2.078	10	0		DEAEHN
O=C1[C@@H](N[C@H]2CCCOC2)CCCN1Cc1ccc(F)cc1F	ZINC000191647634	539702879	/nfs/dbraw/zinc/70/28/79/539702879.db2.gz	OXQFOWKLQRIYQN-HOCLYGCPSA-N	0	3	324.371	2.224	10	0		DEAEHN
CC(C)c1ccc([C@@H](C)NCc2cc(=O)n(C)c(=O)n2C)cc1	ZINC000192479918	539707095	/nfs/dbraw/zinc/70/70/95/539707095.db2.gz	FLMWRGFTVSKNDN-CYBMUJFWSA-N	0	3	315.417	2.058	10	0		DEAEHN
CCOc1ccccc1[C@@H](C[S@@](=O)C1CCOCC1)NC	ZINC000084055005	192397476	/nfs/dbraw/zinc/39/74/76/192397476.db2.gz	KDCGNEXOMKOBJV-VFNWGFHPSA-N	0	3	311.447	2.274	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N2CCCC[C@H]2C)c1	ZINC000138257589	186015780	/nfs/dbraw/zinc/01/57/80/186015780.db2.gz	XKJPNRGEPSFRMP-SNVBAGLBSA-N	0	3	318.389	2.247	10	0		DEAEHN
NCc1cc(F)c(F)c(S(=O)(=O)N2CCCCCCC2)c1	ZINC000138403492	186016674	/nfs/dbraw/zinc/01/66/74/186016674.db2.gz	LZFBIXHZDAQXPG-UHFFFAOYSA-N	0	3	318.389	2.378	10	0		DEAEHN
CCCNCc1cc(F)c(F)c(S(=O)(=O)N(C)C2CC2)c1	ZINC000138440005	186017075	/nfs/dbraw/zinc/01/70/75/186017075.db2.gz	WUPYXCGLGRQECJ-UHFFFAOYSA-N	0	3	318.389	2.247	10	0		DEAEHN
CCC[C@H](C)N(C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138530411	186017641	/nfs/dbraw/zinc/01/76/41/186017641.db2.gz	HNNXRCDZNFLUTM-VIFPVBQESA-N	0	3	306.378	2.233	10	0		DEAEHN
CSc1cc2c(cc1CNCCc1ncc[nH]1)OCCO2	ZINC000139204021	186021153	/nfs/dbraw/zinc/02/11/53/186021153.db2.gz	KDINYZQNERJVHA-UHFFFAOYSA-N	0	3	305.403	2.235	10	0		DEAEHN
CC[C@@H]1N[C@H](c2ccsc2)N(C[C@@H]2CCCN2CC)C1=O	ZINC000140311000	186025913	/nfs/dbraw/zinc/02/59/13/186025913.db2.gz	GMEXUMAGBVZHRL-KKUMJFAQSA-N	0	3	307.463	2.441	10	0		DEAEHN
Cc1cc(N)c(C(=O)Nc2ccncc2Br)cn1	ZINC000147811001	186042162	/nfs/dbraw/zinc/04/21/62/186042162.db2.gz	IOFAZVZSSGYCQO-UHFFFAOYSA-N	0	3	307.151	2.382	10	0		DEAEHN
NC(=O)N1CCC(NCc2sccc2Br)CC1	ZINC000147984862	186042583	/nfs/dbraw/zinc/04/25/83/186042583.db2.gz	UMOOKEOWDJVFKL-UHFFFAOYSA-N	0	3	318.240	2.143	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)NCCCCC(C)C)o1	ZINC000147896066	186042702	/nfs/dbraw/zinc/04/27/02/186042702.db2.gz	SSBIKUHFMVHSQD-UHFFFAOYSA-N	0	3	302.440	2.494	10	0		DEAEHN
O=S(=O)([N-]CC(F)F)c1cc(C[NH2+]C2CC2)ccc1Cl	ZINC000148188372	186043545	/nfs/dbraw/zinc/04/35/45/186043545.db2.gz	YIJKOWYBEOIHAA-UHFFFAOYSA-N	0	3	324.780	2.135	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)N1CCC[C@H]2CCCC[C@@H]21	ZINC000145768146	186037800	/nfs/dbraw/zinc/03/78/00/186037800.db2.gz	BWFHYGSOBUCUDR-AEFFLSMTSA-N	0	3	319.493	2.338	10	0		DEAEHN
CCOC[C@@H](O)CN[C@H](C)c1ccccc1Br	ZINC000148922583	186046135	/nfs/dbraw/zinc/04/61/35/186046135.db2.gz	ZZSQNEKNBBACKJ-MNOVXSKESA-N	0	3	302.212	2.497	10	0		DEAEHN
O=C1[C@@H](NC2CC2)CCN1Cc1sccc1Br	ZINC000148892124	186046527	/nfs/dbraw/zinc/04/65/27/186046527.db2.gz	WACRYOGISLJHHC-JTQLQIEISA-N	0	3	315.236	2.364	10	0		DEAEHN
CNc1nc(NCc2ccc(F)c(Cl)c2)nc(N(C)C)n1	ZINC000149042606	186046763	/nfs/dbraw/zinc/04/67/63/186046763.db2.gz	DKUGXIVVKHNQTD-UHFFFAOYSA-N	0	3	310.764	2.384	10	0		DEAEHN
CN[C@@H](C[C@@H]1CN(C)CCN1C)c1ccc(F)c(F)c1F	ZINC000149554496	186050994	/nfs/dbraw/zinc/05/09/94/186050994.db2.gz	LIIFYOHZVFKSHB-MFKMUULPSA-N	0	3	301.356	2.000	10	0		DEAEHN
CCN[C@H](c1cnc2ccccc2c1)[C@@H]1CCS(=O)(=O)C1	ZINC000150100392	186054715	/nfs/dbraw/zinc/05/47/15/186054715.db2.gz	JNBCBNDLQRAHTI-CJNGLKHVSA-N	0	3	304.415	2.320	10	0		DEAEHN
CCN[C@H](c1ccc2cccnc2c1)[C@H]1CCS(=O)(=O)C1	ZINC000150124520	186054878	/nfs/dbraw/zinc/05/48/78/186054878.db2.gz	LTWLFHXRGGNUNS-GOEBONIOSA-N	0	3	304.415	2.320	10	0		DEAEHN
C[C@@H](N)c1cccc(S(=O)(=O)NN2[C@H](C)CCC[C@@H]2C)c1	ZINC000148541983	186045139	/nfs/dbraw/zinc/04/51/39/186045139.db2.gz	XIEBNHSHWWARNH-FRRDWIJNSA-N	0	3	311.451	2.163	10	0		DEAEHN
CCC[C@](F)(CN)c1c(Br)cnn1CCOC	ZINC000164035249	186146218	/nfs/dbraw/zinc/14/62/18/186146218.db2.gz	FBPQFVYFLPLSJK-NSHDSACASA-N	0	3	308.195	2.216	10	0		DEAEHN
COc1ccc(CCNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000173285118	186172001	/nfs/dbraw/zinc/17/20/01/186172001.db2.gz	KNGPVWPRSCSODL-HOCLYGCPSA-N	0	3	319.449	2.362	10	0		DEAEHN
CN1CCCN(c2ccc(C(F)(F)F)c(C(N)=S)c2)CC1	ZINC000164147469	186150694	/nfs/dbraw/zinc/15/06/94/186150694.db2.gz	BJCXNEWEZKLQCB-UHFFFAOYSA-N	0	3	317.380	2.482	10	0		DEAEHN
C[C@@H]1C[C@@H](C)N(S(=O)(=O)c2ccc(CN)cc2Cl)C1	ZINC000164242771	186153366	/nfs/dbraw/zinc/15/33/66/186153366.db2.gz	ZOVZLLKLLPCOPV-NXEZZACHSA-N	0	3	302.827	2.218	10	0		DEAEHN
CN[C@H](c1cccc2cnccc21)[C@H]1CCCCS1(=O)=O	ZINC000164322831	186155523	/nfs/dbraw/zinc/15/55/23/186155523.db2.gz	PXVTUQPLQLNBHK-HZPDHXFCSA-N	0	3	304.415	2.463	10	0		DEAEHN
Cc1cc(C(=O)N2CC[C@H](N3CCCC3)C2)nn1-c1ccccc1	ZINC000171440272	186160656	/nfs/dbraw/zinc/16/06/56/186160656.db2.gz	DWNOFVRTFLWBRY-KRWDZBQOSA-N	0	3	324.428	2.491	10	0		DEAEHN
CCN(CC)[C@@H](C(=O)N1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000171471469	186165558	/nfs/dbraw/zinc/16/55/58/186165558.db2.gz	GMBARYSWMSLSII-QZTJIDSGSA-N	0	3	315.461	2.376	10	0		DEAEHN
COc1ccccc1[C@H](C)CC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171480413	186166653	/nfs/dbraw/zinc/16/66/53/186166653.db2.gz	CROQHNYSOOWRNH-HUUCEWRRSA-N	0	3	302.418	2.495	10	0		DEAEHN
Cc1ccc(OCCNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1	ZINC000173334888	186178059	/nfs/dbraw/zinc/17/80/59/186178059.db2.gz	JBDLRHWQUIZCEQ-CVEARBPZSA-N	0	3	319.449	2.498	10	0		DEAEHN
COC[C@H](NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)c1ccc(C)o1	ZINC000175689036	186188304	/nfs/dbraw/zinc/18/83/04/186188304.db2.gz	ADNWDVYYPZBUKN-YUELXQCFSA-N	0	3	323.437	2.400	10	0		DEAEHN
C[C@@H]1CC[C@@](CO)(N(C)Cc2cccc(C(=O)N(C)C)c2)C1	ZINC000187991211	186240336	/nfs/dbraw/zinc/24/03/36/186240336.db2.gz	INEVCNNMIGWWKB-RDTXWAMCSA-N	0	3	304.434	2.371	10	0		DEAEHN
c1ccc(CN2CCSC[C@@H]2CNCc2cncnc2)cc1	ZINC000276957984	539806655	/nfs/dbraw/zinc/80/66/55/539806655.db2.gz	CUKPVIDNHLDKBM-KRWDZBQOSA-N	0	3	314.458	2.184	10	0		DEAEHN
c1sc(-c2ccccn2)nc1CN1CCN2CCC[C@@H]2C1	ZINC000171884163	198001316	/nfs/dbraw/zinc/00/13/16/198001316.db2.gz	SVIXCWWPXHWXDI-CQSZACIVSA-N	0	3	300.431	2.485	10	0		DEAEHN
O=C(NCCCc1cccc(F)c1)N1CCN2CCC[C@@H]2C1	ZINC000171908219	198006532	/nfs/dbraw/zinc/00/65/32/198006532.db2.gz	PKXVJUQOSURAAR-MRXNPFEDSA-N	0	3	305.397	2.248	10	0		DEAEHN
C/C(=C\C(=O)N1CCO[C@@H](CN(C)C)C1)c1ccc(F)cc1	ZINC000172305848	198076135	/nfs/dbraw/zinc/07/61/35/198076135.db2.gz	LLYOSNFJEVOEQY-ISBHARSQSA-N	0	3	306.381	2.018	10	0		DEAEHN
COc1cccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000173188249	198193367	/nfs/dbraw/zinc/19/33/67/198193367.db2.gz	IBPFTBGWEVHBRF-UKRRQHHQSA-N	0	3	305.422	2.319	10	0		DEAEHN
c1c[nH]c([C@@H](N[C@@H]2CCc3nnnn3CC2)C2CCCCC2)n1	ZINC000333707447	539969715	/nfs/dbraw/zinc/96/97/15/539969715.db2.gz	HXNROJMACJLFRH-HIFRSBDPSA-N	0	3	315.425	2.012	10	0		DEAEHN
Cc1cc(N2CCC[C@@H](NCc3sccc3C)C2=O)n(C)n1	ZINC000173852242	198259868	/nfs/dbraw/zinc/25/98/68/198259868.db2.gz	LCPXJRDRZQCQET-CYBMUJFWSA-N	0	3	318.446	2.384	10	0		DEAEHN
COCc1ccccc1CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000173812222	198255652	/nfs/dbraw/zinc/25/56/52/198255652.db2.gz	RNGZYMPZPYMXFC-PBHICJAKSA-N	0	3	319.449	2.457	10	0		DEAEHN
COc1ccc(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1F	ZINC000174004320	198279113	/nfs/dbraw/zinc/27/91/13/198279113.db2.gz	IVLVLRWPPFJEIT-JSGCOSHPSA-N	0	3	323.412	2.458	10	0		DEAEHN
CC[C@H]1CN(C[C@H](O)c2ccc(C)cc2)CCN1CCOC	ZINC000174782619	198384405	/nfs/dbraw/zinc/38/44/05/198384405.db2.gz	XHXNLUSSHDAJPV-ROUUACIJSA-N	0	3	306.450	2.071	10	0		DEAEHN
Fc1cc2c(c(F)c1F)[C@@H](N[C@@H]1CCc3nnnn3CC1)CC2	ZINC000333510891	282933990	/nfs/dbraw/zinc/93/39/90/282933990.db2.gz	JCRJMHDZJHNKOJ-KOLCDFICSA-N	0	3	323.322	2.072	10	0		DEAEHN
CCC(C)(C)NC(=O)CN1CCCN(Cc2ccccc2)CC1	ZINC000022807429	354056003	/nfs/dbraw/zinc/05/60/03/354056003.db2.gz	YPOVLFHPUDNHCQ-UHFFFAOYSA-N	0	3	317.477	2.499	10	0		DEAEHN
CCCCCC(=O)NC[C@@H](C)NC[C@@H](O)COc1ccccc1	ZINC000028264338	354100195	/nfs/dbraw/zinc/10/01/95/354100195.db2.gz	SSJXDSZSOGYJMJ-HZPDHXFCSA-N	0	3	322.449	2.101	10	0		DEAEHN
CCC[C@@H](N)C(=O)Nc1ccc(Cl)c(C[S@](C)=O)c1	ZINC000236782300	202006107	/nfs/dbraw/zinc/00/61/07/202006107.db2.gz	BBIUYQABKCXAKX-BLVKFPJESA-N	0	3	302.827	2.284	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1cccc(C)c1C	ZINC000176905175	198635631	/nfs/dbraw/zinc/63/56/31/198635631.db2.gz	LYZUXEDVVAWHJQ-HNNXBMFYSA-N	0	3	317.433	2.185	10	0		DEAEHN
Cc1cccc(N2CCN(CCC(=O)NC(C)C)CC2)c1C	ZINC000056397962	354531636	/nfs/dbraw/zinc/53/16/36/354531636.db2.gz	KBEJPYSVRWKSDN-UHFFFAOYSA-N	0	3	303.450	2.340	10	0		DEAEHN
CN1CCC(NC(=O)CSc2ccc3c(c2)CCC3)CC1	ZINC000061031806	354622542	/nfs/dbraw/zinc/62/25/42/354622542.db2.gz	AMHUGTQIWRMZJT-UHFFFAOYSA-N	0	3	304.459	2.478	10	0		DEAEHN
Cn1cc(CN[C@@H]2CC(=O)N(C)C2)c(-c2ccccc2Cl)n1	ZINC000066905814	354738510	/nfs/dbraw/zinc/73/85/10/354738510.db2.gz	VDOCQIXCCGZJJJ-GFCCVEGCSA-N	0	3	318.808	2.061	10	0		DEAEHN
COc1cccc(F)c1[C@@H](C)NC(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000074267402	355018677	/nfs/dbraw/zinc/01/86/77/355018677.db2.gz	SYNDMDMBEQEKMD-VXGBXAGGSA-N	0	3	321.396	2.431	10	0		DEAEHN
COc1c(Cl)cc(Cl)cc1CC(=O)NCCN(C)C	ZINC000074963754	191396765	/nfs/dbraw/zinc/39/67/65/191396765.db2.gz	NOUFQKIOZCKOQD-UHFFFAOYSA-N	0	3	305.205	2.222	10	0		DEAEHN
CC1(C)O[C@H]2O[C@H](CN3CCC[C@@H]3c3ccccc3)[C@@H](O)[C@H]2O1	ZINC000106385032	355722466	/nfs/dbraw/zinc/72/24/66/355722466.db2.gz	FXRSTNMDEDRDHF-WRQOLXDDSA-N	0	3	319.401	2.061	10	0		DEAEHN
CN1CCC[C@@H]1CNC(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000139475185	355878031	/nfs/dbraw/zinc/87/80/31/355878031.db2.gz	LWQLOPABEZLHLI-CYBMUJFWSA-N	0	3	312.417	2.330	10	0		DEAEHN
CCOc1ccccc1CCNC(=O)NC[C@@H]1CCCN1C	ZINC000170812701	355994291	/nfs/dbraw/zinc/99/42/91/355994291.db2.gz	VCKRUFKAYCNLDE-HNNXBMFYSA-N	0	3	305.422	2.021	10	0		DEAEHN
CCC[C@@H](C)CN1CCN([C@@H](C)C(=O)NC2CCCC2)CC1	ZINC000180046497	356040828	/nfs/dbraw/zinc/04/08/28/356040828.db2.gz	KMJRNHWBRONHDG-CVEARBPZSA-N	0	3	309.498	2.488	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc3c(c2)N(C)CC3)C1	ZINC000180224374	356046092	/nfs/dbraw/zinc/04/60/92/356046092.db2.gz	QEIDNEZEVYDGPK-HNNXBMFYSA-N	0	3	302.422	2.285	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)Nc1ccc(-c2ncon2)cc1	ZINC000184270896	356189389	/nfs/dbraw/zinc/18/93/89/356189389.db2.gz	ILGWRMNFRDWRPE-UHFFFAOYSA-N	0	3	315.377	2.295	10	0		DEAEHN
C[C@@H](CNC(=O)NCCN1CCCC[C@@H]1C)c1nccs1	ZINC000248612848	356323085	/nfs/dbraw/zinc/32/30/85/356323085.db2.gz	YBYDPRALCCUUPY-STQMWFEESA-N	0	3	310.467	2.420	10	0		DEAEHN
CC[C@](C)(CO)[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000080886410	192199157	/nfs/dbraw/zinc/19/91/57/192199157.db2.gz	WNMPSAKVJDMSOV-CYBMUJFWSA-N	0	3	318.211	2.414	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)CC/C=C\c2ccccc2)CCO1	ZINC000254994332	356337272	/nfs/dbraw/zinc/33/72/72/356337272.db2.gz	BSSOSNQIKOOPCX-XBMZPMPPSA-N	0	3	302.418	2.269	10	0		DEAEHN
C[C@H](CCc1ccco1)N[C@H]1CCCN(c2ncc[nH]c2=O)C1	ZINC000328625898	356462830	/nfs/dbraw/zinc/46/28/30/356462830.db2.gz	DQVFYYHFVKEDNJ-KGLIPLIRSA-N	0	3	316.405	2.355	10	0		DEAEHN
CN(CC1CC1)C[C@H]1CN(C(=O)CC2=CCCCC2)CCO1	ZINC000328629493	356463934	/nfs/dbraw/zinc/46/39/34/356463934.db2.gz	IHRXCLBVCOGNDL-KRWDZBQOSA-N	0	3	306.450	2.446	10	0		DEAEHN
Cc1c([C@H]2OCC[C@@H]2NC[C@H](O)c2ccccc2F)cnn1C	ZINC000328642213	356465479	/nfs/dbraw/zinc/46/54/79/356465479.db2.gz	YGMRBPWJAQPBQE-YESZJQIVSA-N	0	3	319.380	2.021	10	0		DEAEHN
CCN[C@H](C)c1cccc(S(=O)(=O)N[C@@H](C)CCOC)c1	ZINC000081717776	192316236	/nfs/dbraw/zinc/31/62/36/192316236.db2.gz	GTHWBSLHFVSPNL-QWHCGFSZSA-N	0	3	314.451	2.060	10	0		DEAEHN
O[C@]1(CCNCc2ccsc2Br)CCOC1	ZINC000404206750	356732197	/nfs/dbraw/zinc/73/21/97/356732197.db2.gz	QVOWQJMVDOKTGP-LLVKDONJSA-N	0	3	306.225	2.142	10	0		DEAEHN
c1cc2c(o1)CCCN(CCc1nnnn1-c1ccccc1)C2	ZINC000579769648	357027601	/nfs/dbraw/zinc/02/76/01/357027601.db2.gz	UQZKWRFWRLFYHP-UHFFFAOYSA-N	0	3	309.373	2.246	10	0		DEAEHN
CC[C@H](C)CN(C)S(=O)(=O)c1cc(CNC)ccc1F	ZINC000088952646	192667713	/nfs/dbraw/zinc/66/77/13/192667713.db2.gz	YLKDACVTODNAOZ-NSHDSACASA-N	0	3	302.415	2.212	10	0		DEAEHN
CC(C)NCc1cc(S(=O)(=O)N2CC[C@H](C)C2)ccc1F	ZINC000088986947	192682897	/nfs/dbraw/zinc/68/28/97/192682897.db2.gz	BTNJLJSVZHSFQZ-LBPRGKRZSA-N	0	3	314.426	2.354	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1cc(F)cc(OC)c1	ZINC000179474773	199042490	/nfs/dbraw/zinc/04/24/90/199042490.db2.gz	PRECXAIWULSOHL-HNNXBMFYSA-N	0	3	323.412	2.460	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(C(=O)OC(C)(C)C)cc2)C1	ZINC000180145378	199123333	/nfs/dbraw/zinc/12/33/33/199123333.db2.gz	RFJQTPMHXKZXIF-HNNXBMFYSA-N	0	3	318.417	2.418	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1ccc(Cl)cn1	ZINC000181026860	199242282	/nfs/dbraw/zinc/24/22/82/199242282.db2.gz	VREFHFAFZSRDOM-CQSZACIVSA-N	0	3	310.829	2.361	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2cnn3ccccc23)C12CCOCC2	ZINC000185663972	199875208	/nfs/dbraw/zinc/87/52/08/199875208.db2.gz	BDTLOMOUBIBMIM-IAGOWNOFSA-N	0	3	315.417	2.398	10	0		DEAEHN
CCN(c1ccc(C)cc1)S(=O)(=O)c1c[nH]c(CNC)c1	ZINC000089015118	192700440	/nfs/dbraw/zinc/70/04/40/192700440.db2.gz	GDEQVSBAPIXYTF-UHFFFAOYSA-N	0	3	307.419	2.258	10	0		DEAEHN
CCC[C@H](C)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000187684694	200144485	/nfs/dbraw/zinc/14/44/85/200144485.db2.gz	SJWOLEOBRYCLLJ-IRXDYDNUSA-N	0	3	306.450	2.233	10	0		DEAEHN
CN(C[C@@H](O)COCc1ccccc1Cl)C[C@@H]1CCCO1	ZINC000187827061	200162353	/nfs/dbraw/zinc/16/23/53/200162353.db2.gz	NUMJMAJPBMBEFZ-CABCVRRESA-N	0	3	313.825	2.328	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)NCc1ccc2c(c1)CNC2	ZINC000188723455	200294549	/nfs/dbraw/zinc/29/45/49/200294549.db2.gz	JQKBJFRRDLTBOH-UHFFFAOYSA-N	0	3	311.385	2.402	10	0		DEAEHN
O=C([C@@H]1CCCC12OCCO2)N1CCCN(C2CCCC2)CC1	ZINC000375098699	296007419	/nfs/dbraw/zinc/00/74/19/296007419.db2.gz	CFPRIDYSHMADMA-INIZCTEOSA-N	0	3	322.449	2.007	10	0		DEAEHN
C[C@@H]1OCCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000189182693	200361524	/nfs/dbraw/zinc/36/15/24/200361524.db2.gz	IPWJXESBALYKKL-BHYGNILZSA-N	0	3	304.434	2.091	10	0		DEAEHN
CCN1CC[C@H](CNC(=O)C[C@H](C)C(=O)c2ccccc2)C1	ZINC000602103557	360265968	/nfs/dbraw/zinc/26/59/68/360265968.db2.gz	FYVBTJGNTCLADZ-LSDHHAIUSA-N	0	3	302.418	2.354	10	0		DEAEHN
CCSCC[C@@H](C)NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000602457891	360382517	/nfs/dbraw/zinc/38/25/17/360382517.db2.gz	JIRGVGRCMSDVPQ-ZBFHGGJFSA-N	0	3	323.506	2.094	10	0		DEAEHN
C[C@H]1C[C@@H](NCC2(C)OCCCO2)CN1Cc1ccccc1	ZINC000192248599	200841713	/nfs/dbraw/zinc/84/17/13/200841713.db2.gz	WHJMHXQRLZMGNJ-DOTOQJQBSA-N	0	3	304.434	2.392	10	0		DEAEHN
CCc1ccc(S(=O)(=O)N[C@H]2CNCC[C@H]2C)cc1CC	ZINC000193407112	201048407	/nfs/dbraw/zinc/04/84/07/201048407.db2.gz	FADNSVRRSKQYMP-WBMJQRKESA-N	0	3	310.463	2.088	10	0		DEAEHN
Cn1ncc(Cl)c1C1=C[C@@H](N)CN(C(=O)OC(C)(C)C)C1	ZINC000675078125	541286536	/nfs/dbraw/zinc/28/65/36/541286536.db2.gz	MQSRABKKLWNXTC-SNVBAGLBSA-N	0	3	312.801	2.035	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2cccc(OCC)c2)CC12COC2	ZINC000449362828	240392331	/nfs/dbraw/zinc/39/23/31/240392331.db2.gz	LFTHLKLNKJGJRD-INIZCTEOSA-N	0	3	319.401	2.097	10	0		DEAEHN
C[C@H](CN1CCCC1)NC(=O)c1ccc(Br)nc1	ZINC000091448321	193057703	/nfs/dbraw/zinc/05/77/03/193057703.db2.gz	UGMZCWVVZBPAKA-SNVBAGLBSA-N	0	3	312.211	2.058	10	0		DEAEHN
CC(C)(C)NCc1cnn([C@H]2CCS(=O)(=O)C2)c1C1CC1	ZINC000091336165	193043460	/nfs/dbraw/zinc/04/34/60/193043460.db2.gz	KHTXPLZWGVJRIZ-ZDUSSCGKSA-N	0	3	311.451	2.008	10	0		DEAEHN
C[C@H](N[C@@H]1CCOC[C@@H]1O)c1sccc1Br	ZINC000624237378	365346463	/nfs/dbraw/zinc/34/64/63/365346463.db2.gz	WCNNAHYCUQNTIC-SFGNSQDASA-N	0	3	306.225	2.311	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1c1nc(Cl)ncc1Br	ZINC000091658991	193085622	/nfs/dbraw/zinc/08/56/22/193085622.db2.gz	UDFIVJDAXIDEMH-QMMMGPOBSA-N	0	3	319.634	2.423	10	0		DEAEHN
Nc1c2ncsc2ccc1NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000091662813	193086519	/nfs/dbraw/zinc/08/65/19/193086519.db2.gz	BQDIQVVAXIUISU-GHMZBOCLSA-N	0	3	304.419	2.154	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@@H]1O)c1ccc(Br)cc1	ZINC000624235888	365344952	/nfs/dbraw/zinc/34/49/52/365344952.db2.gz	RHTDAXGPOMKTJL-XDTLVQLUSA-N	0	3	300.196	2.250	10	0		DEAEHN
CC[C@H](C)[C@@H](C)NC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000091847960	193117121	/nfs/dbraw/zinc/11/71/21/193117121.db2.gz	IEROIGMXAGYVKG-BBWFWOEESA-N	0	3	324.513	2.233	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-]CC(C)C)c(F)c1	ZINC000092115808	193163363	/nfs/dbraw/zinc/16/33/63/193163363.db2.gz	IVNQSFAVAFZGCN-UHFFFAOYSA-N	0	3	302.415	2.260	10	0		DEAEHN
CC[C@H]1CCCN1S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115747	193163654	/nfs/dbraw/zinc/16/36/54/193163654.db2.gz	AJYUTPXTSGBMCI-LBPRGKRZSA-N	0	3	300.399	2.108	10	0		DEAEHN
CC1(C)CCN(S(=O)(=O)c2ccc(CN)cc2F)CC1	ZINC000092116129	193164584	/nfs/dbraw/zinc/16/45/84/193164584.db2.gz	NOFXRFYZSFTPOK-UHFFFAOYSA-N	0	3	300.399	2.095	10	0		DEAEHN
C[C@H](C(N)=S)N1CCN(C[C@@H]2CSc3ccccc32)CC1	ZINC000092275970	193183506	/nfs/dbraw/zinc/18/35/06/193183506.db2.gz	PGDWAQYGVHFONO-CHWSQXEVSA-N	0	3	321.515	2.168	10	0		DEAEHN
COCCN(c1nc(C(C)C)c(CN)s1)[C@@H](C)COC	ZINC000093000060	193192162	/nfs/dbraw/zinc/19/21/62/193192162.db2.gz	ZTPLNJFEMLEXTJ-NSHDSACASA-N	0	3	301.456	2.213	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)NC[C@@H](c1ccco1)N1CCCCC1	ZINC000262297146	203253566	/nfs/dbraw/zinc/25/35/66/203253566.db2.gz	JIBCGCKFPRPJEM-WMLDXEAASA-N	0	3	307.438	2.440	10	0		DEAEHN
CN[C@]1(C(=O)OC)CCC[C@@H]1CCN(C)CCC(F)(F)F	ZINC000093596098	193271671	/nfs/dbraw/zinc/27/16/71/193271671.db2.gz	AXJVCBISPJOTNW-DGCLKSJQSA-N	0	3	310.360	2.192	10	0		DEAEHN
CCN[C@@]1(C(N)=O)CCC[C@@H](N(CC(F)(F)F)C(C)C)C1	ZINC000093751260	193300431	/nfs/dbraw/zinc/30/04/31/193300431.db2.gz	RZWJRVIPBHTFBH-YPMHNXCESA-N	0	3	309.376	2.035	10	0		DEAEHN
CN[C@H](c1ccc(C(F)(F)F)cc1)[C@@H]1CN(C)CCN1C	ZINC000093894768	193325049	/nfs/dbraw/zinc/32/50/49/193325049.db2.gz	QBKZXIIGKNUKKO-UONOGXRCSA-N	0	3	301.356	2.212	10	0		DEAEHN
CCC(N)(CC)C(=O)NCCc1ccc(OC(F)F)cc1	ZINC000094245157	193354880	/nfs/dbraw/zinc/35/48/80/193354880.db2.gz	AAOXGMGMLDZHLS-UHFFFAOYSA-N	0	3	300.349	2.464	10	0		DEAEHN
CCN[C@H](Cc1nc2ccccc2s1)[C@@H]1CN(C)CCO1	ZINC000094251519	193355499	/nfs/dbraw/zinc/35/54/99/193355499.db2.gz	YADFVFRLEPTRHX-KGLIPLIRSA-N	0	3	305.447	2.148	10	0		DEAEHN
CCC[C@@H](C)NC(=O)COc1c(F)cc(CNC)cc1F	ZINC000094346668	193363012	/nfs/dbraw/zinc/36/30/12/193363012.db2.gz	KVQYWWXXCFYENM-SNVBAGLBSA-N	0	3	300.349	2.368	10	0		DEAEHN
CCS(=O)(=O)CCOc1c(F)cc(CNC(C)C)cc1F	ZINC000094347504	193363744	/nfs/dbraw/zinc/36/37/44/193363744.db2.gz	UZSXAYMGDUANFI-UHFFFAOYSA-N	0	3	321.389	2.276	10	0		DEAEHN
CCC(N)(CC)C(=O)N(C[C@@H]1CCCO1)[C@@H]1CCSC1	ZINC000094244630	193354710	/nfs/dbraw/zinc/35/47/10/193354710.db2.gz	JYBWZTCGJBHGPZ-OLZOCXBDSA-N	0	3	300.468	2.017	10	0		DEAEHN
N[C@H]1COC[C@@H]1C(=O)Nc1ccc(Cl)c(Br)c1	ZINC000094670423	193390831	/nfs/dbraw/zinc/39/08/31/193390831.db2.gz	FGYDPMAZCUCEQA-XVKPBYJWSA-N	0	3	319.586	2.015	10	0		DEAEHN
CC[C@H](C)[NH2+]CC(=O)Nc1cc(Br)ccc1[O-]	ZINC000094573592	193381376	/nfs/dbraw/zinc/38/13/76/193381376.db2.gz	CXPLHYHTUNJGHU-QMMMGPOBSA-N	0	3	301.184	2.481	10	0		DEAEHN
CN1CCCC[C@@H]1CNc1nc2ccc(Br)cn2n1	ZINC000094604869	193383672	/nfs/dbraw/zinc/38/36/72/193383672.db2.gz	GORNUBLJCBWVMY-LLVKDONJSA-N	0	3	324.226	2.388	10	0		DEAEHN
CCN[C@@H](Cc1ncnn1CC)c1cncc(Br)c1	ZINC000094824696	193401792	/nfs/dbraw/zinc/40/17/92/193401792.db2.gz	IGRYWQZQROPGLG-LBPRGKRZSA-N	0	3	324.226	2.349	10	0		DEAEHN
COC(=O)c1ccc(CN(CCC(N)=S)CC(C)C)nc1	ZINC000094761703	193395389	/nfs/dbraw/zinc/39/53/89/193395389.db2.gz	PSDAQFSPZRFKCE-UHFFFAOYSA-N	0	3	309.435	2.002	10	0		DEAEHN
CN(C)CCN1CCOCC12CCN(c1ccccc1F)CC2	ZINC000096093371	193534552	/nfs/dbraw/zinc/53/45/52/193534552.db2.gz	HEGQUWMAQAKTLW-UHFFFAOYSA-N	0	3	321.440	2.059	10	0		DEAEHN
C[C@H](C1CC1)n1nccc1NC(=O)N1CCN2CCC[C@H]2C1	ZINC000274917114	212032166	/nfs/dbraw/zinc/03/21/66/212032166.db2.gz	LHRQFMKSYKEXPP-OCCSQVGLSA-N	0	3	303.410	2.166	10	0		DEAEHN
COc1ccc(OC)c(-c2csc(N3CCNCC3)n2)c1	ZINC000019728702	182138978	/nfs/dbraw/zinc/13/89/78/182138978.db2.gz	GLHRYAQOPHEAMQ-UHFFFAOYSA-N	0	3	305.403	2.237	10	0		DEAEHN
O=C(Nc1c(Cl)cc(Cl)cc1Cl)[C@@H]1C[C@H](O)CN1	ZINC000020505406	182225625	/nfs/dbraw/zinc/22/56/25/182225625.db2.gz	DYHXQBLYUDCING-RCOVLWMOSA-N	0	3	309.580	2.308	10	0		DEAEHN
CC(C)[C@@H]1OCC[C@@H]1CN[C@H](C(=O)N(C)C)c1ccccc1	ZINC000267441038	206067941	/nfs/dbraw/zinc/06/79/41/206067941.db2.gz	PDSWPAJXBIVFLT-IKGGRYGDSA-N	0	3	304.434	2.467	10	0		DEAEHN
CO[C@@H]1CC[C@H](NC(=O)N[C@@H](CC(C)C)CN2CCCC2)C1	ZINC000454838625	246184034	/nfs/dbraw/zinc/18/40/34/246184034.db2.gz	BKPMMKIACQMIEL-HRCADAONSA-N	0	3	311.470	2.364	10	0		DEAEHN
COc1ccc(Cl)cc1CNC(=O)NC(C)(C)CN(C)C	ZINC000457847493	248043095	/nfs/dbraw/zinc/04/30/95/248043095.db2.gz	CWLSJDLBOCJIMC-UHFFFAOYSA-N	0	3	313.829	2.488	10	0		DEAEHN
C[C@H](CNCc1ccc(Br)cc1F)[S@@](C)=O	ZINC000159809206	197366520	/nfs/dbraw/zinc/36/65/20/197366520.db2.gz	CJSAOKZXCOLHHC-BCTVWOGZSA-N	0	3	308.216	2.445	10	0		DEAEHN
CCCC[C@@H](N)C(=O)Nc1sc2c(c1C(=O)OC)CCC2	ZINC000040858918	183142688	/nfs/dbraw/zinc/14/26/88/183142688.db2.gz	PALXPFIIYZHKOI-SNVBAGLBSA-N	0	3	310.419	2.479	10	0		DEAEHN
CC(C)[N@H+](C)CCCC[N-]S(=O)(=O)c1cccnc1Cl	ZINC000041678835	183216467	/nfs/dbraw/zinc/21/64/67/183216467.db2.gz	PCHKLVVFBJATCV-UHFFFAOYSA-N	0	3	319.858	2.134	10	0		DEAEHN
CC(C)[N@@H+](C)CCCC[N-]S(=O)(=O)c1cccnc1Cl	ZINC000041678835	183216469	/nfs/dbraw/zinc/21/64/69/183216469.db2.gz	PCHKLVVFBJATCV-UHFFFAOYSA-N	0	3	319.858	2.134	10	0		DEAEHN
CCc1noc(COc2c(Br)cccc2CN)n1	ZINC000042411409	183264929	/nfs/dbraw/zinc/26/49/29/183264929.db2.gz	SEBXUNABKDPYLK-UHFFFAOYSA-N	0	3	312.167	2.432	10	0		DEAEHN
CCCN(CCO)c1cc(Br)ccc1CNC	ZINC000042453104	183271932	/nfs/dbraw/zinc/27/19/32/183271932.db2.gz	JBJVBJJBFGBFOH-UHFFFAOYSA-N	0	3	301.228	2.377	10	0		DEAEHN
CC(C)N(CC(=O)Nc1ccc(C(N)=S)cc1)CC1CC1	ZINC000042583339	183287186	/nfs/dbraw/zinc/28/71/86/183287186.db2.gz	BCXKMRJTXXGQJP-UHFFFAOYSA-N	0	3	305.447	2.380	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccccc1Cl)N1CCC[C@@H]1C(=O)NC	ZINC000043052324	183333079	/nfs/dbraw/zinc/33/30/79/183333079.db2.gz	NJGGABSHIPYHST-ZNMIVQPWSA-N	0	3	309.841	2.329	10	0		DEAEHN
NC[C@H](c1cccc(Br)c1)N1CCCC[C@@H]1CO	ZINC000043021095	183329654	/nfs/dbraw/zinc/32/96/54/183329654.db2.gz	BQMHJVWTHMIITQ-ZIAGYGMSSA-N	0	3	313.239	2.296	10	0		DEAEHN
C[C@H](N)c1cccc(S(=O)(=O)N(CC(F)(F)F)C2CC2)c1	ZINC000042782205	183308435	/nfs/dbraw/zinc/30/84/35/183308435.db2.gz	JMDFKGVUFGCXKZ-VIFPVBQESA-N	0	3	322.352	2.422	10	0		DEAEHN
C[C@@H]1c2ccsc2CCN1S(=O)(=O)C[C@@H]1CCCCN1	ZINC000042782421	183309174	/nfs/dbraw/zinc/30/91/74/183309174.db2.gz	AEOMIIWHOFXPLG-NEPJUHHUSA-N	0	3	314.476	2.139	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)s1)N1CCC[C@@H]1C(=O)NC	ZINC000043253670	183348163	/nfs/dbraw/zinc/34/81/63/183348163.db2.gz	UDTGBUHUTMPTKL-OPQQBVKSSA-N	0	3	315.870	2.390	10	0		DEAEHN
CCCN(CCO)[C@@H](CN)c1ccc(Br)s1	ZINC000043261588	183349069	/nfs/dbraw/zinc/34/90/69/183349069.db2.gz	AATUIJXUUQNLLT-VIFPVBQESA-N	0	3	307.257	2.215	10	0		DEAEHN
NC[C@@H](c1ccc(Br)s1)N1CCCC[C@@H]1CO	ZINC000043261302	183349072	/nfs/dbraw/zinc/34/90/72/183349072.db2.gz	WENDTQMOQCAMAL-ZJUUUORDSA-N	0	3	319.268	2.357	10	0		DEAEHN
CCCN[C@H](c1ccc2c(c1)CCO2)[C@H]1CCS(=O)(=O)C1	ZINC000043301497	183352235	/nfs/dbraw/zinc/35/22/35/183352235.db2.gz	YKBHTLVXNSYNCV-GOEBONIOSA-N	0	3	309.431	2.097	10	0		DEAEHN
CN[C@@H](c1ccc(Br)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000043300259	183352474	/nfs/dbraw/zinc/35/24/74/183352474.db2.gz	VQZGDMUGKLTQRL-JQWIXIFHSA-N	0	3	318.236	2.144	10	0		DEAEHN
CCCN[C@H](c1cc(F)ccc1F)[C@@H]1CCS(=O)(=O)C1	ZINC000043301286	183352515	/nfs/dbraw/zinc/35/25/15/183352515.db2.gz	GWHAAWVRHCIKAB-YGRLFVJLSA-N	0	3	303.374	2.440	10	0		DEAEHN
CCCN[C@@H](c1ccc2c(c1)CCO2)[C@@H]1CCS(=O)(=O)C1	ZINC000043301492	183352649	/nfs/dbraw/zinc/35/26/49/183352649.db2.gz	YKBHTLVXNSYNCV-ZBFHGGJFSA-N	0	3	309.431	2.097	10	0		DEAEHN
CN[C@H](c1ccccc1C(F)(F)F)[C@@H]1CCS(=O)(=O)C1	ZINC000043300413	183352675	/nfs/dbraw/zinc/35/26/75/183352675.db2.gz	HQXKFGXZUQWNFW-SKDRFNHKSA-N	0	3	307.337	2.401	10	0		DEAEHN
N[C@H](c1ccc(OC(F)(F)F)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000043300032	183352820	/nfs/dbraw/zinc/35/28/20/183352820.db2.gz	SVRHDCGOYUVTHM-GXSJLCMTSA-N	0	3	309.309	2.020	10	0		DEAEHN
CN1CCC(Nc2nc3c(cc2C(N)=S)CCCC3)CC1	ZINC000043410831	183359596	/nfs/dbraw/zinc/35/95/96/183359596.db2.gz	PULNIPCYZWFXFF-UHFFFAOYSA-N	0	3	304.463	2.101	10	0		DEAEHN
CN[C@H](CN(C)CC(F)(F)F)c1ccc(OC)c(OC)c1	ZINC000043900764	183389283	/nfs/dbraw/zinc/38/92/83/183389283.db2.gz	RRPWVQLJHDZHAC-LLVKDONJSA-N	0	3	306.328	2.458	10	0		DEAEHN
CN[C@H](CN1C(=O)CCC1=O)c1cccc(C(F)(F)F)c1	ZINC000043993529	183392003	/nfs/dbraw/zinc/39/20/03/183392003.db2.gz	BCQSHZVKNZYNLO-LLVKDONJSA-N	0	3	300.280	2.115	10	0		DEAEHN
CO[C@H]1C[C@@H](CN(C)Cc2c[nH]c(-c3ccccc3)n2)N(C)C1	ZINC000284762272	218167360	/nfs/dbraw/zinc/16/73/60/218167360.db2.gz	IZURMLWMAPYVLA-IRXDYDNUSA-N	0	3	314.433	2.228	10	0		DEAEHN
CN(CCOc1ccccc1)[C@H]1CCCN(c2cccnn2)C1	ZINC000105802631	194131529	/nfs/dbraw/zinc/13/15/29/194131529.db2.gz	PCMGTFBEOUYOCI-INIZCTEOSA-N	0	3	312.417	2.456	10	0		DEAEHN
Cc1ccc(C)c(OCCN2CCN(C[C@@H](C)O)[C@H](C)C2)c1	ZINC000105821107	194135604	/nfs/dbraw/zinc/13/56/04/194135604.db2.gz	YJFGEKHPMFBFRK-IAGOWNOFSA-N	0	3	306.450	2.069	10	0		DEAEHN
C[C@@H](O)CN1CCN(CCOc2cccc(Cl)c2)C[C@H]1C	ZINC000105912405	194168145	/nfs/dbraw/zinc/16/81/45/194168145.db2.gz	MJNJKQRTEWQQFM-ZIAGYGMSSA-N	0	3	312.841	2.106	10	0		DEAEHN
C[C@@H](NCCc1nncn1C)c1ccccc1Br	ZINC000109421239	194262684	/nfs/dbraw/zinc/26/26/84/194262684.db2.gz	FSXXDEUIFHZWJM-SNVBAGLBSA-N	0	3	309.211	2.471	10	0		DEAEHN
CCC[C@H](C(N)=S)N1CCN(Cc2cccc(F)c2)CC1	ZINC000110513994	194336205	/nfs/dbraw/zinc/33/62/05/194336205.db2.gz	LBUHDDOJBBXENE-OAHLLOKOSA-N	0	3	309.454	2.398	10	0		DEAEHN
CCCN([C@@H]1CCCNC1)S(=O)(=O)Cc1ccc(F)cc1	ZINC000110942033	194372635	/nfs/dbraw/zinc/37/26/35/194372635.db2.gz	HGIXCMKODODVRL-OAHLLOKOSA-N	0	3	314.426	2.120	10	0		DEAEHN
O=S(=O)(CC[C@H]1CCCC[NH2+]1)[N-]c1cc(F)cc(F)c1F	ZINC000061120349	184162363	/nfs/dbraw/zinc/16/23/63/184162363.db2.gz	GHXXJHVLNHVGBV-SNVBAGLBSA-N	0	3	322.352	2.378	10	0		DEAEHN
CCCN(CCN(C)C)c1nc(Cl)nc(N(CC)CC)n1	ZINC000061541622	184174127	/nfs/dbraw/zinc/17/41/27/184174127.db2.gz	OYCXUOPJBBNNJV-UHFFFAOYSA-N	0	3	314.865	2.149	10	0		DEAEHN
OC[C@]1(Nc2ccc(Br)cc2)CCN(C2CC2)C1	ZINC000061992153	184199878	/nfs/dbraw/zinc/19/98/78/184199878.db2.gz	XXPDBYQRTQSGBF-AWEZNQCLSA-N	0	3	311.223	2.460	10	0		DEAEHN
OC[C@]1(Nc2cccc(Br)c2)CCN(C2CC2)C1	ZINC000061992157	184200420	/nfs/dbraw/zinc/20/04/20/184200420.db2.gz	KRRLEJPUJLDFNO-AWEZNQCLSA-N	0	3	311.223	2.460	10	0		DEAEHN
CCCN1C(=O)CC[C@@H](N)[C@@H]1c1ccc(Br)o1	ZINC000062212209	184221353	/nfs/dbraw/zinc/22/13/53/184221353.db2.gz	KWBZKJRJHADFQA-PRHODGIISA-N	0	3	301.184	2.443	10	0		DEAEHN
CCc1nc(N2CCn3ccnc3C2)sc1CNC1CC1	ZINC000062328113	184230877	/nfs/dbraw/zinc/23/08/77/184230877.db2.gz	ZPXJUIUNWGDQBQ-UHFFFAOYSA-N	0	3	303.435	2.174	10	0		DEAEHN
COCCNCc1cc(Cl)c(OCC(C)(C)O)c(OC)c1	ZINC000062727881	184250689	/nfs/dbraw/zinc/25/06/89/184250689.db2.gz	URMCOYLOZIMINC-UHFFFAOYSA-N	0	3	317.813	2.234	10	0		DEAEHN
CC(C)(C)c1ncc(CNC2CCS(=O)(=O)CC2)s1	ZINC000062838860	184255719	/nfs/dbraw/zinc/25/57/19/184255719.db2.gz	GOKCUVICOQMPLF-UHFFFAOYSA-N	0	3	302.465	2.107	10	0		DEAEHN
O=C(NOCCN1CCCC1)c1ccc(C(F)(F)F)cc1	ZINC000062578341	184244632	/nfs/dbraw/zinc/24/46/32/184244632.db2.gz	UXHQQBSGQGQSIK-UHFFFAOYSA-N	0	3	302.296	2.463	10	0		DEAEHN
CCCNCc1ccc(OC)cc1OCCCS(C)(=O)=O	ZINC000063014422	184266473	/nfs/dbraw/zinc/26/64/73/184266473.db2.gz	LIXLZZDVCQYTIZ-UHFFFAOYSA-N	0	3	315.435	2.008	10	0		DEAEHN
CS(=O)(=O)c1ccc(S[C@H](CN)c2ccncc2)cc1	ZINC000063131273	184272192	/nfs/dbraw/zinc/27/21/92/184272192.db2.gz	DOIKJVOJSVZNAH-CQSZACIVSA-N	0	3	308.428	2.277	10	0		DEAEHN
CS(=O)(=O)c1ccc(S[C@@H](CN)c2cccnc2)cc1	ZINC000063131264	184272434	/nfs/dbraw/zinc/27/24/34/184272434.db2.gz	UBAHIBRITBUALX-AWEZNQCLSA-N	0	3	308.428	2.277	10	0		DEAEHN
CN(C)C(=O)c1cccc(NC(=O)CNC2CCCCC2)c1	ZINC000066214661	184397294	/nfs/dbraw/zinc/39/72/94/184397294.db2.gz	BDCGHKKXMSZWEK-UHFFFAOYSA-N	0	3	303.406	2.249	10	0		DEAEHN
CCOC1CCN([C@@H](C)C[C@](C)([NH2+]C(C)C)C(=O)[O-])CC1	ZINC000068628370	184494390	/nfs/dbraw/zinc/49/43/90/184494390.db2.gz	KBROXEOCEDTYGU-BBRMVZONSA-N	0	3	300.443	2.107	10	0		DEAEHN
CCCNS(=O)(=O)c1cc(C)c(F)c(CNC(C)C)c1	ZINC000159078354	197326013	/nfs/dbraw/zinc/32/60/13/197326013.db2.gz	ZQUGRQAZRKJFFE-UHFFFAOYSA-N	0	3	302.415	2.320	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC2CC2)cc(CNC(C)C)c1F	ZINC000159084136	197325728	/nfs/dbraw/zinc/32/57/28/197325728.db2.gz	OJARQYJGUSPBSD-UHFFFAOYSA-N	0	3	300.399	2.073	10	0		DEAEHN
COC[C@H](O)CN[C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000540323453	285115030	/nfs/dbraw/zinc/11/50/30/285115030.db2.gz	DRZDMIOLTGQWSR-WMLDXEAASA-N	0	3	316.401	2.319	10	0		DEAEHN
Cc1ccc([C@H](CN)N(C)[C@@H]2CCOC2)c(Br)c1	ZINC000158646307	197290751	/nfs/dbraw/zinc/29/07/51/197290751.db2.gz	IYJJTERMEXUWJV-RISCZKNCSA-N	0	3	313.239	2.478	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)cc(CN)c1F	ZINC000158761410	197299303	/nfs/dbraw/zinc/29/93/03/197299303.db2.gz	ZNGGSEMMSBQQJE-TXEJJXNPSA-N	0	3	312.410	2.013	10	0		DEAEHN
C[C@@H](NCc1ccc(I)o1)[C@@H]1CCOC1	ZINC000158489906	197277290	/nfs/dbraw/zinc/27/72/90/197277290.db2.gz	FTPSWKZXZLHCQY-RKDXNWHRSA-N	0	3	321.158	2.399	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@@H](c2cccc(O)c2)C1)N(C)C	ZINC000158250785	197256849	/nfs/dbraw/zinc/25/68/49/197256849.db2.gz	QAVHOEVHWQFWQG-HZPDHXFCSA-N	0	3	306.406	2.022	10	0		DEAEHN
COc1cccc2ccc(CNC3CCS(=O)CC3)nc21	ZINC000158021430	197236051	/nfs/dbraw/zinc/23/60/51/197236051.db2.gz	SKCIVGFQWLGPJF-UHFFFAOYSA-N	0	3	304.415	2.244	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)N2CC[C@@]3(O)CCCC[C@@H]3C2)C1	ZINC000246913181	296389410	/nfs/dbraw/zinc/38/94/10/296389410.db2.gz	FXPMEHCCHPIJIM-NUJGCVRESA-N	0	3	323.481	2.055	10	0		DEAEHN
CSc1nsc(NC(=O)N[C@H]2CN(C(C)C)C[C@H]2C)n1	ZINC000157049764	197158578	/nfs/dbraw/zinc/15/85/78/197158578.db2.gz	YOWYYLISMNJBHV-BDAKNGLRSA-N	0	3	315.468	2.110	10	0		DEAEHN
Cc1cc(CNCCOCC2CCC2)ccc1-n1cncn1	ZINC000558649033	291898022	/nfs/dbraw/zinc/89/80/22/291898022.db2.gz	CBUBTCSCYSZNPK-UHFFFAOYSA-N	0	3	300.406	2.482	10	0		DEAEHN
Cc1cc(N2CCO[C@@H]3CCCC[C@@H]32)c(C(N)=S)c(C)n1	ZINC000156660648	197131365	/nfs/dbraw/zinc/13/13/65/197131365.db2.gz	DMKAGMSUNJNQFW-GXTWGEPZSA-N	0	3	305.447	2.480	10	0		DEAEHN
CCn1nc(C)c(Br)c1C[C@@H](N)c1ccnc(C)n1	ZINC000156502416	197118725	/nfs/dbraw/zinc/11/87/25/197118725.db2.gz	VLPVRVYPTDNROJ-SNVBAGLBSA-N	0	3	324.226	2.315	10	0		DEAEHN
CCS(=O)(=O)CCC[C@@H](NC)c1c(F)cccc1OC	ZINC000156111895	197087968	/nfs/dbraw/zinc/08/79/68/197087968.db2.gz	RALXRULSLVGBDN-GFCCVEGCSA-N	0	3	303.399	2.310	10	0		DEAEHN
COc1cccc2sc(C(=O)NC[C@H](C)N(C)C)c(N)c21	ZINC000156177453	197093167	/nfs/dbraw/zinc/09/31/67/197093167.db2.gz	DWGOXSBLDAHFRE-VIFPVBQESA-N	0	3	307.419	2.172	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccccc1CN)[S@](=O)CC1CCCC1	ZINC000156070715	197084349	/nfs/dbraw/zinc/08/43/49/197084349.db2.gz	BJIVVGBUJPHTCF-QKVFXAPYSA-N	0	3	308.447	2.411	10	0		DEAEHN
C[C@@H]1CNC[C@@H](C)N1C(=O)c1csc(Br)c1	ZINC000153105530	196852042	/nfs/dbraw/zinc/85/20/42/196852042.db2.gz	ALQIQZNIAOADLB-HTQZYQBOSA-N	0	3	303.225	2.333	10	0		DEAEHN
c1ccc(CO[C@@H]2CC[C@@H]3[C@@H]2OCCN3C2CCOCC2)nc1	ZINC000247845221	257116349	/nfs/dbraw/zinc/11/63/49/257116349.db2.gz	PLJLRCXBEIUMFG-KURKYZTESA-N	0	3	318.417	2.009	10	0		DEAEHN
O=C(NCC1CC1)[C@@H]1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2O1	ZINC000096065461	257136572	/nfs/dbraw/zinc/13/65/72/257136572.db2.gz	IRTWMMXXPWDVEM-BZSNNMDCSA-N	0	3	314.429	2.192	10	0		DEAEHN
Fc1cnc(N2CCO[C@@H]3CN(CC4CCCCC4)C[C@H]32)nc1	ZINC000503718776	257208006	/nfs/dbraw/zinc/20/80/06/257208006.db2.gz	VYNYFEXQXHBWHW-HZPDHXFCSA-N	0	3	320.412	2.085	10	0		DEAEHN
Cc1cc(N2CC[C@H](N[C@@H]3CC[C@H]3C3CCC3)C2=O)n(C)n1	ZINC000560941458	291949479	/nfs/dbraw/zinc/94/94/79/291949479.db2.gz	BBENSZJCDAGMEL-ZNMIVQPWSA-N	0	3	302.422	2.002	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)N1CCC(Cc2nccn2C)CC1	ZINC000121908534	195372473	/nfs/dbraw/zinc/37/24/73/195372473.db2.gz	BZMXXSQVGAMYCJ-INIZCTEOSA-N	0	3	318.465	2.076	10	0		DEAEHN
COC[C@H](NC(=O)N[C@@H](CN(C)C)c1ccccc1)C1CC1	ZINC000157208284	285392971	/nfs/dbraw/zinc/39/29/71/285392971.db2.gz	JZNMFHJOMWLISF-HOTGVXAUSA-N	0	3	305.422	2.014	10	0		DEAEHN
COc1cc(C)c(CN(C)C[C@@H](O)COC(C)C)cc1OC	ZINC000194893178	533568189	/nfs/dbraw/zinc/56/81/89/533568189.db2.gz	DWFQWUWGOKRSIM-OAHLLOKOSA-N	0	3	311.422	2.230	10	0		DEAEHN
C[C@H](NC(=O)c1cccc2ncnn21)[C@H](c1ccccc1)N(C)C	ZINC000545317736	285422367	/nfs/dbraw/zinc/42/23/67/285422367.db2.gz	UZZCRAATBLICTP-SUMWQHHRSA-N	0	3	323.400	2.151	10	0		DEAEHN
Cc1cc(C)cc(OCCCN2CCO[C@H](CN(C)C)C2)c1	ZINC000177713603	132529233	/nfs/dbraw/zinc/52/92/33/132529233.db2.gz	SHYWVDGDSNWMBT-GOSISDBHSA-N	0	3	306.450	2.335	10	0		DEAEHN
CCN1C2(CCC(C(C)(C)CC)CC2)[C@@H](N)CS1(=O)=O	ZINC000725256364	542770503	/nfs/dbraw/zinc/77/05/03/542770503.db2.gz	HHXYAWVCBDEVDJ-OWYJLGKBSA-N	0	3	302.484	2.344	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)NCc2ccc3cc[nH]c3n2)C1	ZINC000357607588	133087963	/nfs/dbraw/zinc/08/79/63/133087963.db2.gz	KQOODYHSTGLSTC-CYBMUJFWSA-N	0	3	315.421	2.094	10	0		DEAEHN
Cc1nn2c(CNCCN3CC=C(C)CC3)c(C)nc2s1	ZINC000358127867	133122827	/nfs/dbraw/zinc/12/28/27/133122827.db2.gz	CJFKKOLRBITYIP-UHFFFAOYSA-N	0	3	305.451	2.149	10	0		DEAEHN
c1cc(OCCCN2CCOCC3(CC3)C2)cc2c1OCO2	ZINC000360089826	133161398	/nfs/dbraw/zinc/16/13/98/133161398.db2.gz	SUHYKMROJNAGDQ-UHFFFAOYSA-N	0	3	305.374	2.297	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCc1cc(COC(C)(C)C)on1	ZINC000362426349	133229593	/nfs/dbraw/zinc/22/95/93/133229593.db2.gz	CNDBKEPCHCDCQS-OAHLLOKOSA-N	0	3	323.437	2.480	10	0		DEAEHN
COC[C@@H](Cc1ccccc1)NC(=O)CC1CCN(C)CC1	ZINC000362878564	133256966	/nfs/dbraw/zinc/25/69/66/133256966.db2.gz	XGBGCMMFGXXQLE-QGZVFWFLSA-N	0	3	304.434	2.092	10	0		DEAEHN
Cc1ccccc1C1CC(N[C@H]2CCN(c3ccn(C)n3)C2=O)C1	ZINC000368405703	133272141	/nfs/dbraw/zinc/27/21/41/133272141.db2.gz	UMTXRAWUYNISCV-DQPZFDDXSA-N	0	3	324.428	2.370	10	0		DEAEHN
O=S1(=O)CCCC[C@@H]1CNC1CC(OCc2ccccc2)C1	ZINC000563853446	292076467	/nfs/dbraw/zinc/07/64/67/292076467.db2.gz	OXFANQBWQNXZFQ-OFLPRAFFSA-N	0	3	323.458	2.291	10	0		DEAEHN
COC(CN(CCCO)C[C@H]1CCC2(CCCCC2)O1)OC	ZINC000191015634	292078849	/nfs/dbraw/zinc/07/88/49/292078849.db2.gz	LRVCGZAAXYYVEC-OAHLLOKOSA-N	0	3	315.454	2.172	10	0		DEAEHN
Cc1ccc(C)c(S(=O)(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c1	ZINC000247660683	292086225	/nfs/dbraw/zinc/08/62/25/292086225.db2.gz	XXKQUWQHZIUUFN-HZPDHXFCSA-N	0	3	322.474	2.408	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)CSCc2cccnc2)CCN1C	ZINC000124119766	144706603	/nfs/dbraw/zinc/70/66/03/144706603.db2.gz	AXYGFJVLXWFADC-HIFRSBDPSA-N	0	3	307.463	2.256	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)N1CC[C@@H](N2CCCC2)C1	ZINC000187476402	144999772	/nfs/dbraw/zinc/99/97/72/144999772.db2.gz	CCKVIUMLLUCFPN-ZIAGYGMSSA-N	0	3	318.421	2.031	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1cc2ccccc2oc1=O	ZINC000188722926	145016252	/nfs/dbraw/zinc/01/62/52/145016252.db2.gz	DQDNATVCOJFCFF-UHFFFAOYSA-N	0	3	320.348	2.326	10	0		DEAEHN
O=C(c1c[nH]nc1-c1ccccc1F)N1CCN2CCC1CC2	ZINC000188855188	145018602	/nfs/dbraw/zinc/01/86/02/145018602.db2.gz	ZOWNZODBBBZYKN-UHFFFAOYSA-N	0	3	314.364	2.136	10	0		DEAEHN
Cn1cc([C@@H]2CCN(CCOCC(F)(F)C(F)F)C2)cn1	ZINC000189338754	145026458	/nfs/dbraw/zinc/02/64/58/145026458.db2.gz	PWPITOIXVAGGPX-SNVBAGLBSA-N	0	3	309.307	2.126	10	0		DEAEHN
CC(C)OC1CC(N[C@H]2CCCN(c3cccnc3)C2=O)C1	ZINC000189569465	145029975	/nfs/dbraw/zinc/02/99/75/145029975.db2.gz	MKNNHWDCKBQBTF-BCLQGDPASA-N	0	3	303.406	2.123	10	0		DEAEHN
O=C1CCCCN1C1CCN(C[C@H](O)CC2CCCC2)CC1	ZINC000190717621	145047091	/nfs/dbraw/zinc/04/70/91/145047091.db2.gz	JWQYPUVIKQVSGI-QGZVFWFLSA-N	0	3	308.466	2.405	10	0		DEAEHN
O[C@H](CN1CCN(Cc2cccnc2)CC1)C1CCCCC1	ZINC000190985057	145050993	/nfs/dbraw/zinc/05/09/93/145050993.db2.gz	FDJGOUNDTIMXAB-GOSISDBHSA-N	0	3	303.450	2.140	10	0		DEAEHN
CC[C@@H](O)CN1CCN(Cc2ccc(OCC3CC3)cc2)CC1	ZINC000191346382	145056439	/nfs/dbraw/zinc/05/64/39/145056439.db2.gz	DLSZYBJFTIBWBJ-GOSISDBHSA-N	0	3	318.461	2.364	10	0		DEAEHN
CCc1nnc(C2CCN(Cc3c(C)nn(C)c3Cl)CC2)[nH]1	ZINC000191690432	145063072	/nfs/dbraw/zinc/06/30/72/145063072.db2.gz	SANGKQPJQCHSDM-UHFFFAOYSA-N	0	3	322.844	2.442	10	0		DEAEHN
Cc1csc2c1ncnc2N1CCN(C[C@H]2CCOC2)CC1	ZINC000192666737	145077291	/nfs/dbraw/zinc/07/72/91/145077291.db2.gz	QJIHRSHJGAHLKF-CYBMUJFWSA-N	0	3	318.446	2.158	10	0		DEAEHN
C[C@H](N[C@@H](C)[C@@H]1CCCO1)C(=O)N(C)Cc1cccc(F)c1	ZINC000193128360	145082997	/nfs/dbraw/zinc/08/29/97/145082997.db2.gz	OMCOFKWIFSNNSK-XEZPLFJOSA-N	0	3	308.397	2.330	10	0		DEAEHN
Cc1cc(NC(=O)CCN2CC[C@H](C)[C@@H](n3ccnc3)C2)no1	ZINC000246345033	145099225	/nfs/dbraw/zinc/09/92/25/145099225.db2.gz	VEYHOUNCJAYRDI-JSGCOSHPSA-N	0	3	317.393	2.091	10	0		DEAEHN
CO[C@H](CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)c1ccccc1	ZINC000246368841	145100135	/nfs/dbraw/zinc/10/01/35/145100135.db2.gz	QEDYSBYAJLVVAA-DJIMGWMZSA-N	0	3	319.449	2.498	10	0		DEAEHN
COc1cc(F)c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1OC	ZINC000246576639	145107894	/nfs/dbraw/zinc/10/78/94/145107894.db2.gz	SFIFNDUDTWLKIF-RYUDHWBXSA-N	0	3	322.380	2.152	10	0		DEAEHN
COc1ccc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c(OC)c1	ZINC000246741327	145112419	/nfs/dbraw/zinc/11/24/19/145112419.db2.gz	GSSJWMPJYCHYDQ-XJKSGUPXSA-N	0	3	318.417	2.260	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000246837372	145116634	/nfs/dbraw/zinc/11/66/34/145116634.db2.gz	CXGUBDROKMQQTE-DYVFJYSZSA-N	0	3	312.413	2.053	10	0		DEAEHN
COc1cccc(F)c1[C@@H](C)NC(=O)N1CCN2CCC[C@H]2C1	ZINC000246884230	145117769	/nfs/dbraw/zinc/11/77/69/145117769.db2.gz	GWDOQBHASYPTCD-OLZOCXBDSA-N	0	3	321.396	2.385	10	0		DEAEHN
CC(C)CC[C@](C)(O)CNC(=O)NCCN1CCC[C@H](C)C1	ZINC000246971843	145121240	/nfs/dbraw/zinc/12/12/40/145121240.db2.gz	GQWYQJJDLGGUID-RDJZCZTQSA-N	0	3	313.486	2.205	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)N3C[C@H]4CCCN4C[C@H]3C)cc2)c1	ZINC000247066614	145124919	/nfs/dbraw/zinc/12/49/19/145124919.db2.gz	HKUKQUPTAHLDAL-CRAIPNDOSA-N	0	3	324.428	2.489	10	0		DEAEHN
C[C@@H](C(=O)Nc1cc(F)ccc1F)N1CCN2CCC[C@H]2C1	ZINC000247098666	145126460	/nfs/dbraw/zinc/12/64/60/145126460.db2.gz	ICFUYSMVCGPDPR-AAEUAGOBSA-N	0	3	309.360	2.072	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@H](C)N2CCN3CCC[C@H]3C2)c(C)c1	ZINC000247392075	145136053	/nfs/dbraw/zinc/13/60/53/145136053.db2.gz	XEMWYTRKEYBVTM-CVEARBPZSA-N	0	3	301.434	2.410	10	0		DEAEHN
C[C@@H]1C[C@@H](c2cccc(F)c2)N(C[C@@H](O)CN2CCCC2=O)C1	ZINC000247485280	145138106	/nfs/dbraw/zinc/13/81/06/145138106.db2.gz	KMQWBQINGQRXLK-COXVUDFISA-N	0	3	320.408	2.192	10	0		DEAEHN
O[C@H](CN1CCCC[C@H]1CN1CCOCC1)c1ccc(F)cc1	ZINC000247495744	145139269	/nfs/dbraw/zinc/13/92/69/145139269.db2.gz	HKPAHDBHAIYYDQ-ZWKOTPCHSA-N	0	3	322.424	2.046	10	0		DEAEHN
Cc1ccc(-c2cc(C(=O)N3C[C@@H]4CCC[N@H+]4C[C@H]3C)[n-]n2)o1	ZINC000247503900	145139625	/nfs/dbraw/zinc/13/96/25/145139625.db2.gz	VHLSUHDLKWQUQZ-YPMHNXCESA-N	0	3	314.389	2.287	10	0		DEAEHN
Cc1ccc(-c2cc(C(=O)N3C[C@@H]4CCC[N@@H+]4C[C@H]3C)[n-]n2)o1	ZINC000247503900	145139626	/nfs/dbraw/zinc/13/96/26/145139626.db2.gz	VHLSUHDLKWQUQZ-YPMHNXCESA-N	0	3	314.389	2.287	10	0		DEAEHN
C[C@H]1CN(C2CCN(C[C@@](C)(O)c3ccccc3)CC2)CCO1	ZINC000247577609	145141375	/nfs/dbraw/zinc/14/13/75/145141375.db2.gz	IALSCYWQBDDHBA-QFBILLFUSA-N	0	3	318.461	2.079	10	0		DEAEHN
COC(=O)COc1ccccc1[C@H](C)N[C@H](C)[C@H]1CCCO1	ZINC000248488223	145156786	/nfs/dbraw/zinc/15/67/86/145156786.db2.gz	MIOUSEQAXQBDJC-GZBFAFLISA-N	0	3	307.390	2.457	10	0		DEAEHN
CN(C[C@H]1CCC(C)(C)O1)[C@H]1CCCN(c2cccnn2)C1	ZINC000248566916	145159227	/nfs/dbraw/zinc/15/92/27/145159227.db2.gz	JKGZCAOHTXCDDX-LSDHHAIUSA-N	0	3	304.438	2.335	10	0		DEAEHN
Cc1cccc(OCCNC(=O)[C@H](C)N[C@@H](C)[C@H]2CCCO2)c1	ZINC000248584799	145160419	/nfs/dbraw/zinc/16/04/19/145160419.db2.gz	JJPOIBKEVTXLBW-YQQAZPJKSA-N	0	3	320.433	2.036	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCC[C@@H](c2nncn2C(C)C)C1	ZINC000248659492	145163449	/nfs/dbraw/zinc/16/34/49/145163449.db2.gz	VGJJLYZQHQHSJQ-CVEARBPZSA-N	0	3	324.469	2.216	10	0		DEAEHN
COC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CCCCn1ccnc1C	ZINC000248849472	145170042	/nfs/dbraw/zinc/17/00/42/145170042.db2.gz	PTNYFNCCCGWDBZ-JYJNAYRXSA-N	0	3	305.422	2.245	10	0		DEAEHN
CC(C)OCCNC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000248876709	145171490	/nfs/dbraw/zinc/17/14/90/145171490.db2.gz	RCXCMXJWDQUKKT-DOTOQJQBSA-N	0	3	319.449	2.231	10	0		DEAEHN
Cc1cnn([C@@H]2CCCN(C[C@H]3CC4(CCC4)C(=O)O3)C2)c1	ZINC000248894752	145172664	/nfs/dbraw/zinc/17/26/64/145172664.db2.gz	TUVUVKUGGOHVBU-HUUCEWRRSA-N	0	3	303.406	2.314	10	0		DEAEHN
CCc1ccccc1S(=O)(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000249432180	145184385	/nfs/dbraw/zinc/18/43/85/145184385.db2.gz	HLDKMAKZXNSPPC-JKSUJKDBSA-N	0	3	322.474	2.354	10	0		DEAEHN
CCCCNC(=O)[C@@H](C)N1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000249882114	145191558	/nfs/dbraw/zinc/19/15/58/145191558.db2.gz	NTSGHNSMKFFUIM-CVEARBPZSA-N	0	3	318.465	2.429	10	0		DEAEHN
Cc1nc(C[C@H]2CCCN(C[C@@H](O)Cc3ccccc3)C2)no1	ZINC000249906419	145192335	/nfs/dbraw/zinc/19/23/35/145192335.db2.gz	UXSSVIUJYFLMBV-SJORKVTESA-N	0	3	315.417	2.236	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COc2ccc(Cl)cc2)CC[C@H]1C	ZINC000252059646	145198291	/nfs/dbraw/zinc/19/82/91/145198291.db2.gz	ZPXJVMZYOYLCTO-XNRPHZJLSA-N	0	3	313.825	2.437	10	0		DEAEHN
CO[C@@H]1CCCN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)C1	ZINC000252801350	145200959	/nfs/dbraw/zinc/20/09/59/145200959.db2.gz	CPQNHWNWWYADNV-BRWVUGGUSA-N	0	3	317.433	2.252	10	0		DEAEHN
CN(C[C@@H]1COc2ccccc2O1)C(=O)[C@@H]1NCCCC1(C)C	ZINC000261864338	145235495	/nfs/dbraw/zinc/23/54/95/145235495.db2.gz	KRQIHGCAELIESA-CJNGLKHVSA-N	0	3	318.417	2.063	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)NCCc1cccc(F)c1	ZINC000261876653	145236942	/nfs/dbraw/zinc/23/69/42/145236942.db2.gz	LYFSNGYGWRJNLR-IIDMSEBBSA-N	0	3	320.408	2.017	10	0		DEAEHN
c1c(CN2CCNC[C@H]2c2ccncc2)[nH]nc1-c1cccnc1	ZINC000261921311	145241849	/nfs/dbraw/zinc/24/18/49/145241849.db2.gz	BREKKODWZDCAKX-SFHVURJKSA-N	0	3	320.400	2.013	10	0		DEAEHN
CCCC(=O)NCC(=O)Nc1cc(CN)cc(C(F)(F)F)c1	ZINC000263012257	145318143	/nfs/dbraw/zinc/31/81/43/145318143.db2.gz	RHTXIGUBPAVUMN-UHFFFAOYSA-N	0	3	317.311	2.019	10	0		DEAEHN
COc1cccc([C@H](C)Cc2nc([C@@H]3CNCCN3C)no2)c1	ZINC000263199772	145335604	/nfs/dbraw/zinc/33/56/04/145335604.db2.gz	IWEWKGHTSQDFMG-DOMZBBRYSA-N	0	3	316.405	2.001	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2csc(C(C)(C)C)n2)n1	ZINC000263198695	145335615	/nfs/dbraw/zinc/33/56/15/145335615.db2.gz	ISWWHTAKSNICQT-SNVBAGLBSA-N	0	3	307.423	2.067	10	0		DEAEHN
COCc1cccc(CNC(=O)CN2CCCC23CCC3)c1	ZINC000373103996	148211261	/nfs/dbraw/zinc/21/12/61/148211261.db2.gz	KTXXOXVVLNSUQZ-UHFFFAOYSA-N	0	3	302.418	2.468	10	0		DEAEHN
CCc1cnc(CCNC(=O)NCCN2CCC[C@@H](C)C2)s1	ZINC000073659855	401720181	/nfs/dbraw/zinc/72/01/81/401720181.db2.gz	CBTYWARNGMIBRH-CYBMUJFWSA-N	0	3	324.494	2.279	10	0		DEAEHN
CC(C)c1ccc(CN(C)C[C@@H](O)CN2CCCC2=O)cc1	ZINC000111683137	401720668	/nfs/dbraw/zinc/72/06/68/401720668.db2.gz	SCTCKOPYHSVTJX-QGZVFWFLSA-N	0	3	304.434	2.225	10	0		DEAEHN
C[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000073896255	401724047	/nfs/dbraw/zinc/72/40/47/401724047.db2.gz	LLERNUWBHSHDTM-BBRMVZONSA-N	0	3	315.417	2.107	10	0		DEAEHN
CCc1nc(CNC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cs1	ZINC000074137303	401731035	/nfs/dbraw/zinc/73/10/35/401731035.db2.gz	FNHHIHBYQFSDOI-OLZOCXBDSA-N	0	3	308.451	2.084	10	0		DEAEHN
CN1[C@@H]2CC[C@H]1CC(NS(=O)(=O)c1ccc(Cl)cc1)C2	ZINC000000135921	401688413	/nfs/dbraw/zinc/68/84/13/401688413.db2.gz	XHRMLNQFHNAKTQ-YHWZYXNKSA-N	0	3	314.838	2.244	10	0		DEAEHN
C[C@@H](CNC(=O)N[C@@H](C)[C@@H]1CCCO1)N(C)Cc1ccccc1	ZINC000111451659	401716344	/nfs/dbraw/zinc/71/63/44/401716344.db2.gz	QRXDGBIOTJZBQD-ZOBUZTSGSA-N	0	3	319.449	2.374	10	0		DEAEHN
C[C@@H]1CC[C@H](C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)O1	ZINC000127912421	401755570	/nfs/dbraw/zinc/75/55/70/401755570.db2.gz	PTFGBKQSRPMNKL-XOSAIJSUSA-N	0	3	302.418	2.333	10	0		DEAEHN
CC1(CNC(=O)N[C@H](CN2CCCC2)c2ccccc2)COC1	ZINC000112723148	401756493	/nfs/dbraw/zinc/75/64/93/401756493.db2.gz	LSDOLSRFMRGBEH-MRXNPFEDSA-N	0	3	317.433	2.159	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2c(F)cccc2N2CCCC2)CCO1	ZINC000128049692	401760903	/nfs/dbraw/zinc/76/09/03/401760903.db2.gz	SXNMZFXZLSRENQ-OAHLLOKOSA-N	0	3	321.440	2.188	10	0		DEAEHN
CCCn1c2ccccc2nc1CN1CCO[C@@H](CN(C)C)C1	ZINC000128059611	401761400	/nfs/dbraw/zinc/76/14/00/401761400.db2.gz	UDBMQUYLECWFSO-HNNXBMFYSA-N	0	3	316.449	2.209	10	0		DEAEHN
CC(C)OC(=O)CCN1CCC(C(=O)N[C@H](C)C(C)C)CC1	ZINC000075677610	401766425	/nfs/dbraw/zinc/76/64/25/401766425.db2.gz	HAJUTTGMOITTHH-CQSZACIVSA-N	0	3	312.454	2.201	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000113222331	401770885	/nfs/dbraw/zinc/77/08/85/401770885.db2.gz	CXGUBDROKMQQTE-SUMWQHHRSA-N	0	3	312.413	2.053	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)CSCc1cccnc1	ZINC000113227041	401771320	/nfs/dbraw/zinc/77/13/20/401771320.db2.gz	HJIZBYVEFKWPQJ-UKRRQHHQSA-N	0	3	305.447	2.010	10	0		DEAEHN
Cc1ccc(C(C)(C)CN(C)C[C@@H](O)CN2CCCC2=O)cc1	ZINC000075861585	401771777	/nfs/dbraw/zinc/77/17/77/401771777.db2.gz	YPYJVUQKCDPAOO-QGZVFWFLSA-N	0	3	318.461	2.188	10	0		DEAEHN
COc1ccc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1OC	ZINC000113233606	401772596	/nfs/dbraw/zinc/77/25/96/401772596.db2.gz	WQZZDLXSTARDIC-GXTWGEPZSA-N	0	3	304.390	2.013	10	0		DEAEHN
CC(C)(C)c1n[nH]cc1CN1CCC[C@@H](Cn2cncn2)C1	ZINC000128497931	401779698	/nfs/dbraw/zinc/77/96/98/401779698.db2.gz	VBEQPNIJCNAGPZ-CYBMUJFWSA-N	0	3	302.426	2.211	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cccc(-n2cccn2)c1	ZINC000116764621	401858258	/nfs/dbraw/zinc/85/82/58/401858258.db2.gz	LGKHSZHTPZCINV-WMLDXEAASA-N	0	3	310.401	2.181	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)[C@@]2(C)CCCc3ccccc32)CCO1	ZINC000116791030	401859241	/nfs/dbraw/zinc/85/92/41/401859241.db2.gz	OOHHVUSGVQLVSS-LPHOPBHVSA-N	0	3	316.445	2.070	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)[C@@]2(C)CCCc3ccccc32)CCO1	ZINC000116791027	401859457	/nfs/dbraw/zinc/85/94/57/401859457.db2.gz	OOHHVUSGVQLVSS-APWZRJJASA-N	0	3	316.445	2.070	10	0		DEAEHN
Cc1cccc(CSCC(=O)N2CCO[C@H](CN(C)C)C2)c1	ZINC000116796652	401860044	/nfs/dbraw/zinc/86/00/44/401860044.db2.gz	RGVWYABMLOIRKO-MRXNPFEDSA-N	0	3	322.474	2.017	10	0		DEAEHN
CSc1ccc(C)c(C(=O)N2CCO[C@@H](CN(C)C)C2)c1	ZINC000116797673	401860071	/nfs/dbraw/zinc/86/00/71/401860071.db2.gz	QZVGHNRYBZDKCO-ZDUSSCGKSA-N	0	3	308.447	2.120	10	0		DEAEHN
C[C@@H](O)CCNCc1cc(Br)c2c(c1)OCCO2	ZINC000078781869	401865975	/nfs/dbraw/zinc/86/59/75/401865975.db2.gz	QXBUNCWHCZWGCR-SECBINFHSA-N	0	3	316.195	2.081	10	0		DEAEHN
O=C(C[C@@H]1C(=O)Nc2ccccc21)NCCN1CCCCCC1	ZINC000132550274	401869521	/nfs/dbraw/zinc/86/95/21/401869521.db2.gz	CYYGAFKSEKJCIQ-HNNXBMFYSA-N	0	3	315.417	2.105	10	0		DEAEHN
C[C@@H](c1cn(-c2ccccc2)nn1)N1CCN2CCCC[C@@H]2C1	ZINC000129977153	401813655	/nfs/dbraw/zinc/81/36/55/401813655.db2.gz	PFABSWDINZPMTR-DOTOQJQBSA-N	0	3	311.433	2.498	10	0		DEAEHN
COC(=O)c1ccccc1N1CCN[C@@H](Cc2ccccc2)C1	ZINC000039952510	401924700	/nfs/dbraw/zinc/92/47/00/401924700.db2.gz	XUNNCBOLCYRKRN-INIZCTEOSA-N	0	3	310.397	2.494	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1)N(C)C	ZINC000119171204	401930690	/nfs/dbraw/zinc/93/06/90/401930690.db2.gz	QXNJLLKCGOOPQN-YOEHRIQHSA-N	0	3	321.440	2.499	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N1CC[C@H](N2CCCC2)C1	ZINC000079540471	401875704	/nfs/dbraw/zinc/87/57/04/401875704.db2.gz	QGDDSZJDJNMQAS-AWEZNQCLSA-N	0	3	303.406	2.179	10	0		DEAEHN
O=C(CCN1CC=C(c2cccs2)CC1)N1CCOCC1	ZINC000117894845	401886851	/nfs/dbraw/zinc/88/68/51/401886851.db2.gz	QQKLAQGTGDQTDZ-UHFFFAOYSA-N	0	3	306.431	2.086	10	0		DEAEHN
C[C@@H](CNC(=O)[C@@H]1CCCc2n[nH]cc21)N1CCC(C)CC1	ZINC000133736088	401894174	/nfs/dbraw/zinc/89/41/74/401894174.db2.gz	XMRZJSYSZMVKRB-UONOGXRCSA-N	0	3	304.438	2.066	10	0		DEAEHN
CCCOc1cccc(NC(=O)N2CCO[C@H](CN(C)C)C2)c1	ZINC000118800537	401908507	/nfs/dbraw/zinc/90/85/07/401908507.db2.gz	HMLJLZRAPNYCFI-MRXNPFEDSA-N	0	3	321.421	2.270	10	0		DEAEHN
COc1cc(C[NH2+]CC[C@@H](C)O)cc(Br)c1[O-]	ZINC000085984244	401920034	/nfs/dbraw/zinc/92/00/34/401920034.db2.gz	WALBMRWSNBNATK-MRVPVSSYSA-N	0	3	304.184	2.024	10	0		DEAEHN
C[C@H](NCCCS(N)(=O)=O)c1ccc(Cl)c(Cl)c1	ZINC000045067140	401953504	/nfs/dbraw/zinc/95/35/04/401953504.db2.gz	ARPOUMSRBJMPJA-QMMMGPOBSA-N	0	3	311.234	2.323	10	0		DEAEHN
Cc1noc(CCCC(=O)N[C@H](CN(C)C)c2ccccc2)n1	ZINC000046745634	401972301	/nfs/dbraw/zinc/97/23/01/401972301.db2.gz	AIUADCIFQJYDBI-OAHLLOKOSA-N	0	3	316.405	2.120	10	0		DEAEHN
CCCn1nc(C)c(CN2CCN(C[C@@H](C)O)[C@H](CC)C2)c1C	ZINC000120684930	401998491	/nfs/dbraw/zinc/99/84/91/401998491.db2.gz	UHHJMFYPAGPBQK-RHSMWYFYSA-N	0	3	322.497	2.187	10	0		DEAEHN
CC(C)OCCCNC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000047682452	401987977	/nfs/dbraw/zinc/98/79/77/401987977.db2.gz	VGERSASYEDULAJ-INIZCTEOSA-N	0	3	307.438	2.404	10	0		DEAEHN
C[C@@H](C(=O)Nc1cc(-c2nccn2C)[nH]n1)N1CCCCCC1	ZINC000119369731	401945398	/nfs/dbraw/zinc/94/53/98/401945398.db2.gz	PFILYJSXXMILDY-LBPRGKRZSA-N	0	3	316.409	2.013	10	0		DEAEHN
CC(C)CNC(=O)[C@H](C)N[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000121103864	402015258	/nfs/dbraw/zinc/01/52/58/402015258.db2.gz	XJGWTROBYBEBBG-KGLIPLIRSA-N	0	3	315.421	2.079	10	0		DEAEHN
O=C(CCN1CC=C(c2ccccc2)CC1)N1CCOCC1	ZINC000051292973	402033226	/nfs/dbraw/zinc/03/32/26/402033226.db2.gz	SGIMUYHBSIIAIE-UHFFFAOYSA-N	0	3	300.402	2.025	10	0		DEAEHN
CCN(CCN1CCCCCC1)C(=O)c1cccnc1NC	ZINC000055134153	402076677	/nfs/dbraw/zinc/07/66/77/402076677.db2.gz	FONIDRXDGWWBOY-UHFFFAOYSA-N	0	3	304.438	2.461	10	0		DEAEHN
CN(CCc1ccc(F)cc1)C(=O)C1(N)Cc2ccccc2C1	ZINC000152337359	402090554	/nfs/dbraw/zinc/09/05/54/402090554.db2.gz	QVQRNAIOHBXZRL-UHFFFAOYSA-N	0	3	312.388	2.323	10	0		DEAEHN
Cc1cccc(CN(CCN(C)C)C(=O)[C@H]2CC[C@H](C)O2)c1	ZINC000152349215	402091116	/nfs/dbraw/zinc/09/11/16/402091116.db2.gz	MIEKPHONBUSLFO-DOTOQJQBSA-N	0	3	304.434	2.453	10	0		DEAEHN
CCC(CC)CN1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000122718548	402091242	/nfs/dbraw/zinc/09/12/42/402091242.db2.gz	FEAFYLFQWKKIJZ-GOSISDBHSA-N	0	3	320.477	2.480	10	0		DEAEHN
CC(C)CCC[C@@H](C)NC(=O)CN1CCCN(C2CC2)CC1	ZINC000061041361	402106872	/nfs/dbraw/zinc/10/68/72/402106872.db2.gz	BVJGMJWPBPZMOC-MRXNPFEDSA-N	0	3	309.498	2.488	10	0		DEAEHN
c1ccc(Cc2noc(CN3CCCN(C4CC4)CC3)n2)cc1	ZINC000061040933	402107015	/nfs/dbraw/zinc/10/70/15/402107015.db2.gz	IDWDWHQODRPJJJ-UHFFFAOYSA-N	0	3	312.417	2.331	10	0		DEAEHN
Cc1cc(F)cc(NC(=O)NC[C@H](O)CN2CCCCC2)c1	ZINC000152766122	402107638	/nfs/dbraw/zinc/10/76/38/402107638.db2.gz	YOMROGRVUWCWFQ-HNNXBMFYSA-N	0	3	309.385	2.102	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2S(=O)(=O)/C=C/c2ccccc2)C1	ZINC000152878176	402114405	/nfs/dbraw/zinc/11/44/05/402114405.db2.gz	IUQFFBPAIKRDIY-WCEBEWAISA-N	0	3	320.458	2.403	10	0		DEAEHN
COc1ccc(OC)c(CC(=O)N[C@H](CC(C)C)CN(C)C)c1	ZINC000097359392	402122343	/nfs/dbraw/zinc/12/23/43/402122343.db2.gz	VAVAIRDBQYYUMR-OAHLLOKOSA-N	0	3	322.449	2.339	10	0		DEAEHN
CC[C@H](O)CN1CCN(Cc2cc(C)c(OC)c(C)c2)CC1	ZINC000123517855	402131867	/nfs/dbraw/zinc/13/18/67/402131867.db2.gz	XXZORDJFDLRBQF-KRWDZBQOSA-N	0	3	306.450	2.201	10	0		DEAEHN
CC[C@@H](O)CN1CCN(Cc2ccc3c(c2)CC(C)(C)O3)CC1	ZINC000123524677	402132680	/nfs/dbraw/zinc/13/26/80/402132680.db2.gz	MSIMMJBESJRAIN-QGZVFWFLSA-N	0	3	318.461	2.289	10	0		DEAEHN
CC[C@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1c(C)noc1C	ZINC000123369889	402124092	/nfs/dbraw/zinc/12/40/92/402124092.db2.gz	LXFQHULINMYVCL-GJZGRUSLSA-N	0	3	318.421	2.398	10	0		DEAEHN
CCN(CCNC(=O)Cc1c(Cl)cccc1OC)C1CC1	ZINC000153482802	402148271	/nfs/dbraw/zinc/14/82/71/402148271.db2.gz	WNYNODXFDYQGEH-UHFFFAOYSA-N	0	3	310.825	2.492	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2ccn(-c3ccccc3)n2)CCN1C	ZINC000123823611	402148418	/nfs/dbraw/zinc/14/84/18/402148418.db2.gz	MHXYBPNWQSMXGX-HOCLYGCPSA-N	0	3	312.417	2.427	10	0		DEAEHN
Cc1ccc(CN2CCC[C@H](C(=O)N3CCOCC3)C2)cc1F	ZINC000124516336	402183913	/nfs/dbraw/zinc/18/39/13/402183913.db2.gz	QLWMMAQNCDMDBD-INIZCTEOSA-N	0	3	320.408	2.205	10	0		DEAEHN
COc1cc(C)c(CN(C)CCC(=O)NC(C)C)cc1OC	ZINC000124922326	402203765	/nfs/dbraw/zinc/20/37/65/402203765.db2.gz	NXNHNEFSWFNRRU-UHFFFAOYSA-N	0	3	308.422	2.359	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)N[C@H](Cc2ccccc2)C2CC2)C1	ZINC000154169566	402196996	/nfs/dbraw/zinc/19/69/96/402196996.db2.gz	FXTLHNAPFXKPBN-DLBZAZTESA-N	0	3	301.434	2.353	10	0		DEAEHN
COc1cc2[nH]c(=O)c(CN3CCCC3)cc2c(OC)c1OC	ZINC000067446554	402160070	/nfs/dbraw/zinc/16/00/70/402160070.db2.gz	QIOLQOVKMOYAOW-UHFFFAOYSA-N	0	3	318.373	2.150	10	0		DEAEHN
COC(=O)CCNC(=O)CN[C@@H](C)c1ccc2ccccc2c1	ZINC000102686892	402170410	/nfs/dbraw/zinc/17/04/10/402170410.db2.gz	KQIQPMNQDRNLGA-ZDUSSCGKSA-N	0	3	314.385	2.170	10	0		DEAEHN
O=C([C@@H]1CCCc2n[nH]cc21)N1CCN(C2CCCCC2)CC1	ZINC000154743805	402229428	/nfs/dbraw/zinc/22/94/28/402229428.db2.gz	BQJWYRSVYYEJBY-OAHLLOKOSA-N	0	3	316.449	2.307	10	0		DEAEHN
COc1ccccc1C[C@H](C)CC(=O)NC[C@@H]1CCCN1C	ZINC000107349451	402230667	/nfs/dbraw/zinc/23/06/67/402230667.db2.gz	SJSGTSYGHBGUOC-HOCLYGCPSA-N	0	3	304.434	2.474	10	0		DEAEHN
COc1cc(C)c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1OC	ZINC000154790141	402232378	/nfs/dbraw/zinc/23/23/78/402232378.db2.gz	NEONEPKTUQWSSO-KBPBESRZSA-N	0	3	318.417	2.321	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)[C@@H]1CSC(=O)N1)c1ccccc1	ZINC000154798670	402232996	/nfs/dbraw/zinc/23/29/96/402232996.db2.gz	CDJZGUBSQZRGRT-KBPBESRZSA-N	0	3	321.446	2.011	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2csc(-c3ccoc3)n2)CCO1	ZINC000108373579	402252378	/nfs/dbraw/zinc/25/23/78/402252378.db2.gz	YMXDXPXTFHHXEH-CQSZACIVSA-N	0	3	307.419	2.166	10	0		DEAEHN
CN(CCc1ccc(F)cc1)C(=O)NC[C@@H]1CCCN(C)C1	ZINC000108588943	402258174	/nfs/dbraw/zinc/25/81/74/402258174.db2.gz	GDBVHCIXFFRFRN-HNNXBMFYSA-N	0	3	307.413	2.351	10	0		DEAEHN
Cc1ccc(OCCN(C)C[C@@H](O)COCc2ccco2)cc1	ZINC000070869971	402265759	/nfs/dbraw/zinc/26/57/59/402265759.db2.gz	FUPVCVYWWKGTED-MRXNPFEDSA-N	0	3	319.401	2.476	10	0		DEAEHN
c1cncc(-c2nc(-c3ccncc3)cc(N3CCNCC3)n2)c1	ZINC000070451643	402260326	/nfs/dbraw/zinc/26/03/26/402260326.db2.gz	DJMLHDLFKJBOTD-UHFFFAOYSA-N	0	3	318.384	2.010	10	0		DEAEHN
CC(C)NC(=O)CCCC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000104825684	402205525	/nfs/dbraw/zinc/20/55/25/402205525.db2.gz	FAVNYSWKCROMNY-INIZCTEOSA-N	0	3	319.449	2.100	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)NC[C@H]1CCCN1C	ZINC000154358693	402208027	/nfs/dbraw/zinc/20/80/27/402208027.db2.gz	UYOMGGKRSOANIX-GXTWGEPZSA-N	0	3	321.469	2.401	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ncccc1OC(C)C	ZINC000176075447	402276236	/nfs/dbraw/zinc/27/62/36/402276236.db2.gz	LODHZUWBOTVPGU-AWEZNQCLSA-N	0	3	305.422	2.425	10	0		DEAEHN
CCc1ccccc1NC(=O)NC[C@@H]1CCCN1CCOC	ZINC000110086505	402281423	/nfs/dbraw/zinc/28/14/23/402281423.db2.gz	OMOZFDOHEOTBFI-HNNXBMFYSA-N	0	3	305.422	2.481	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(C(C)=O)cc1	ZINC000110083090	402281468	/nfs/dbraw/zinc/28/14/68/402281468.db2.gz	IPCQBPGWIUFLIE-MRXNPFEDSA-N	0	3	319.405	2.122	10	0		DEAEHN
Fc1ccc2oc(CN3CCN(C[C@H]4CCOC4)CC3)nc2c1	ZINC000176218363	402291243	/nfs/dbraw/zinc/29/12/43/402291243.db2.gz	CRYOINNEPANANZ-CYBMUJFWSA-N	0	3	319.380	2.121	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCCOCc1ccccc1	ZINC000176226906	402292730	/nfs/dbraw/zinc/29/27/30/402292730.db2.gz	QIYIFOOTNOBBEV-QGZVFWFLSA-N	0	3	321.465	2.479	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1ccc2c(c1)OCO2	ZINC000176243754	402293903	/nfs/dbraw/zinc/29/39/03/402293903.db2.gz	PAPNZBCUBUQTIH-ZDUSSCGKSA-N	0	3	305.378	2.363	10	0		DEAEHN
CCOc1ncccc1NC(=O)N(C)C[C@H]1CCCN1CC	ZINC000176301213	402298162	/nfs/dbraw/zinc/29/81/62/402298162.db2.gz	CABUXWXEUCJDHX-CYBMUJFWSA-N	0	3	306.410	2.428	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)NCCc2cc(F)ccc2F)C1	ZINC000176344143	402301742	/nfs/dbraw/zinc/30/17/42/402301742.db2.gz	LRNWELVCFCANNP-LBPRGKRZSA-N	0	3	311.376	2.148	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)NCCOCc1ccccc1	ZINC000176368517	402303840	/nfs/dbraw/zinc/30/38/40/402303840.db2.gz	HVBYORGGVOCLFW-INIZCTEOSA-N	0	3	319.449	2.377	10	0		DEAEHN
Cc1ccc([O-])c(C[NH2+]C(C)(C)CNC(=O)OC(C)(C)C)n1	ZINC000221379864	402303922	/nfs/dbraw/zinc/30/39/22/402303922.db2.gz	UDULWAKDVUHNEH-UHFFFAOYSA-N	0	3	309.410	2.489	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCc1cccc(C)n1	ZINC000176431309	402308645	/nfs/dbraw/zinc/30/86/45/402308645.db2.gz	MNQLJTJCXSZTCS-CVEARBPZSA-N	0	3	302.422	2.158	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCOCc2ccccc2)CCN1C	ZINC000176443499	402309989	/nfs/dbraw/zinc/30/99/89/402309989.db2.gz	JLTOWBBTBVLBSZ-WBVHZDCISA-N	0	3	319.449	2.327	10	0		DEAEHN
C[C@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1ncncc1Cl	ZINC000176551097	402319043	/nfs/dbraw/zinc/31/90/43/402319043.db2.gz	ZTYYCLGWUXUVBU-IJLUTSLNSA-N	0	3	310.829	2.226	10	0		DEAEHN
CC(=O)NC[C@@H]1CN(c2c(C)cnc3c(C)cccc32)CCO1	ZINC000185310527	402342662	/nfs/dbraw/zinc/34/26/62/402342662.db2.gz	BPTCMSGEPAETBW-OAHLLOKOSA-N	0	3	313.401	2.193	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1cc(F)ccc1C	ZINC000176900752	402347997	/nfs/dbraw/zinc/34/79/97/402347997.db2.gz	KXLKWFKQWMTPER-CQSZACIVSA-N	0	3	321.396	2.015	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)N[C@H]1CCCC[C@@H]1n1cccn1	ZINC000185495650	402357070	/nfs/dbraw/zinc/35/70/70/402357070.db2.gz	JTVBVRPNBWHAGG-HOTGVXAUSA-N	0	3	319.453	2.102	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(OC)cc(OC)c1	ZINC000176995950	402357579	/nfs/dbraw/zinc/35/75/79/402357579.db2.gz	APZPQKQMFHMIEJ-CQSZACIVSA-N	0	3	306.406	2.260	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C[C@@H](C)NC(=O)C1CCCC1	ZINC000177032691	402361832	/nfs/dbraw/zinc/36/18/32/402361832.db2.gz	WLBBQHRYNLTGJY-GDBMZVCRSA-N	0	3	323.481	2.014	10	0		DEAEHN
COc1ccc(F)cc1CC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000185603312	402364593	/nfs/dbraw/zinc/36/45/93/402364593.db2.gz	CZSWXRFPPSPMFF-OAHLLOKOSA-N	0	3	310.413	2.469	10	0		DEAEHN
CC(C)O[C@H]1C[C@@H](NCc2cccnc2-n2cncn2)C1(C)C	ZINC000185198614	402333393	/nfs/dbraw/zinc/33/33/93/402333393.db2.gz	CKMWMUDBVBYYHM-CABCVRRESA-N	0	3	315.421	2.344	10	0		DEAEHN
CCC[C@@H](C(=O)Nc1ccc(OCCN(C)C)cc1)N(C)C	ZINC000161656365	402394900	/nfs/dbraw/zinc/39/49/00/402394900.db2.gz	ZCRMNSOYJNGMRQ-INIZCTEOSA-N	0	3	307.438	2.296	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1ccc(Cl)nc1	ZINC000177378389	402395866	/nfs/dbraw/zinc/39/58/66/402395866.db2.gz	YHIGDBPNFMKSRN-CYBMUJFWSA-N	0	3	310.829	2.361	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1cccc(COC)c1	ZINC000177396677	402397820	/nfs/dbraw/zinc/39/78/20/402397820.db2.gz	LBGGSJXFBSJIHV-QGZVFWFLSA-N	0	3	319.449	2.459	10	0		DEAEHN
Cc1csc(CN2CCCC[C@@H](N3CCN(C)CC3)C2)n1	ZINC000162051155	402408117	/nfs/dbraw/zinc/40/81/17/402408117.db2.gz	NGBWKJVRJFPIKG-OAHLLOKOSA-N	0	3	308.495	2.053	10	0		DEAEHN
C[C@H](c1cn(-c2ccccc2)nn1)N1CCCN(C2CC2)CC1	ZINC000177515958	402411792	/nfs/dbraw/zinc/41/17/92/402411792.db2.gz	BRSVLGSTKQMFIO-OAHLLOKOSA-N	0	3	311.433	2.498	10	0		DEAEHN
CCO[C@H]1C[C@H](NCc2ccc(CO)c(F)c2)C12CCOCC2	ZINC000186271112	402416796	/nfs/dbraw/zinc/41/67/96/402416796.db2.gz	RLBWPRKMADAWOD-IRXDYDNUSA-N	0	3	323.408	2.382	10	0		DEAEHN
CCOc1ncccc1C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000186279775	402417127	/nfs/dbraw/zinc/41/71/27/402417127.db2.gz	IRBZCDYXNRIXCW-AWEZNQCLSA-N	0	3	305.422	2.475	10	0		DEAEHN
CCC[C@@H](C(=O)NCCc1nc2cc(F)ccc2[nH]1)N(C)C	ZINC000162369707	402417645	/nfs/dbraw/zinc/41/76/45/402417645.db2.gz	BRFIJJDDTATMGX-AWEZNQCLSA-N	0	3	306.385	2.091	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)NCCc1ccc(Cl)nc1	ZINC000177669101	402424912	/nfs/dbraw/zinc/42/49/12/402424912.db2.gz	YQVLWEMKMFENIN-CYBMUJFWSA-N	0	3	324.856	2.451	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)Nc1ccc(OC)cc1	ZINC000177706871	402428921	/nfs/dbraw/zinc/42/89/21/402428921.db2.gz	CCNZZQJYFRPGCG-GOEBONIOSA-N	0	3	319.449	2.438	10	0		DEAEHN
NC(=O)N1CCC(N[C@H]2CCOc3c(Cl)cccc32)CC1	ZINC000177948871	402446965	/nfs/dbraw/zinc/44/69/65/402446965.db2.gz	FALPZDJVCLNGPY-ZDUSSCGKSA-N	0	3	309.797	2.296	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2)N(C)C	ZINC000161534890	402391207	/nfs/dbraw/zinc/39/12/07/402391207.db2.gz	BTVMRCFKRZZOKF-GXTWGEPZSA-N	0	3	306.406	2.365	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1	ZINC000237038286	402392216	/nfs/dbraw/zinc/39/22/16/402392216.db2.gz	QGXPNIVDNAOFEJ-USXIJHARSA-N	0	3	303.450	2.487	10	0		DEAEHN
CCOC(=O)[C@H]1CCCN1CCN(C)Cc1ccc(F)cc1	ZINC000161617093	402393678	/nfs/dbraw/zinc/39/36/78/402393678.db2.gz	LWOMZEOKRVABOC-MRXNPFEDSA-N	0	3	308.397	2.285	10	0		DEAEHN
C[C@@H](C(=O)N[C@H]1CCC[C@@H](C)[C@@H]1C)N1CCCN(C2CC2)CC1	ZINC000246107066	402510552	/nfs/dbraw/zinc/51/05/52/402510552.db2.gz	DGELBGVHSYFXOK-CVYDXHPNSA-N	0	3	321.509	2.486	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](NCc1cccnc1-n1cncn1)CC2	ZINC000178050860	402455625	/nfs/dbraw/zinc/45/56/25/402455625.db2.gz	BZCJEOUTKXYXET-KRWDZBQOSA-N	0	3	321.384	2.448	10	0		DEAEHN
CC1(C)C[C@H](NCc2cccnc2-n2cncn2)C(C)(C)O1	ZINC000178056564	402456203	/nfs/dbraw/zinc/45/62/03/402456203.db2.gz	AVFAWFVFZMCGTB-ZDUSSCGKSA-N	0	3	301.394	2.098	10	0		DEAEHN
CC(C)Nc1ncccc1C(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000245452591	402461663	/nfs/dbraw/zinc/46/16/63/402461663.db2.gz	DRVYPGHAUHAIGG-KGLIPLIRSA-N	0	3	302.422	2.211	10	0		DEAEHN
C[C@@H](CCOc1ccccc1)C(=O)N1CCN2CCC[C@H]2C1	ZINC000245458078	402462523	/nfs/dbraw/zinc/46/25/23/402462523.db2.gz	USMARJMDVIBHDT-HOTGVXAUSA-N	0	3	302.418	2.398	10	0		DEAEHN
CCS(=O)(=O)NCCCN1CC[C@H](c2ccccc2)[C@H]1C	ZINC000245515308	402467364	/nfs/dbraw/zinc/46/73/64/402467364.db2.gz	PYRZHEOCQNGUND-ZBFHGGJFSA-N	0	3	310.463	2.194	10	0		DEAEHN
COCCOc1ccc(CN2CCN3CCCC[C@H]3C2)cc1	ZINC000245555044	402470982	/nfs/dbraw/zinc/47/09/82/402470982.db2.gz	HWTPRQBZICLHJC-KRWDZBQOSA-N	0	3	304.434	2.382	10	0		DEAEHN
COc1cccc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1F	ZINC000245594524	402472834	/nfs/dbraw/zinc/47/28/34/402472834.db2.gz	RGQZKNZDMLUWGR-JSGCOSHPSA-N	0	3	306.381	2.391	10	0		DEAEHN
COc1ccc([C@@H](C)NCCNC(=O)C(C)C)cc1NC(C)=O	ZINC000178225493	402473491	/nfs/dbraw/zinc/47/34/91/402473491.db2.gz	ZEPFKMRGISTLPO-GFCCVEGCSA-N	0	3	321.421	2.076	10	0		DEAEHN
CCC(CC)NC(=O)[C@@H](C)N1CCC[C@@H]1Cn1ccnc1C	ZINC000178291088	402480325	/nfs/dbraw/zinc/48/03/25/402480325.db2.gz	ZVENWRRONOBTEM-CZUORRHYSA-N	0	3	306.454	2.349	10	0		DEAEHN
Cc1ccc2[nH]c([C@H]3CCCN([C@H]4CCN(C)C4=O)C3)nc2c1	ZINC000245704974	402481865	/nfs/dbraw/zinc/48/18/65/402481865.db2.gz	OAJFMFSOOJBLQG-BBRMVZONSA-N	0	3	312.417	2.281	10	0		DEAEHN
Cc1ccc2nc([C@H]3CCCN([C@H]4CCN(C)C4=O)C3)[nH]c2c1	ZINC000245704974	402481870	/nfs/dbraw/zinc/48/18/70/402481870.db2.gz	OAJFMFSOOJBLQG-BBRMVZONSA-N	0	3	312.417	2.281	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CC(=O)N(C(C)C)C(C)C	ZINC000178307549	402482959	/nfs/dbraw/zinc/48/29/59/402482959.db2.gz	AQEFLDZTFSEZHM-MRXNPFEDSA-N	0	3	306.454	2.301	10	0		DEAEHN
COc1ccccc1/C=C/CN1CCN(C[C@H](C)O)[C@@H](C)C1	ZINC000245726426	402483380	/nfs/dbraw/zinc/48/33/80/402483380.db2.gz	IWKYTLZZFQYVAE-OHOWAWRESA-N	0	3	304.434	2.095	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2	ZINC000245736616	402484260	/nfs/dbraw/zinc/48/42/60/402484260.db2.gz	BJTDSTRBCOBGOC-QKPAOTATSA-N	0	3	321.465	2.070	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CC(=O)NCC1CCCCC1	ZINC000178320128	402484497	/nfs/dbraw/zinc/48/44/97/402484497.db2.gz	LNBGACUDIAYJIT-QGZVFWFLSA-N	0	3	318.465	2.352	10	0		DEAEHN
CCOc1cccc(CN2CCN(C[C@H](C)O)[C@H](CC)C2)c1	ZINC000245769515	402487208	/nfs/dbraw/zinc/48/72/08/402487208.db2.gz	RLVYEZJSSVELLJ-DOTOQJQBSA-N	0	3	306.450	2.362	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cc(C)oc1C	ZINC000245850994	402491439	/nfs/dbraw/zinc/49/14/39/402491439.db2.gz	GJEXGOOFYCHSHW-KGLIPLIRSA-N	0	3	312.435	2.144	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)c2cc(C)oc2C)[C@@H](C)C1	ZINC000245865584	402492688	/nfs/dbraw/zinc/49/26/88/402492688.db2.gz	IOLIOBUVEOPTCL-FZMZJTMJSA-N	0	3	314.451	2.247	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(C)oc2C)[C@@H](C)C1	ZINC000245865589	402492798	/nfs/dbraw/zinc/49/27/98/402492798.db2.gz	IOLIOBUVEOPTCL-SMDDNHRTSA-N	0	3	314.451	2.247	10	0		DEAEHN
CNc1ncc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)s1	ZINC000245895442	402495623	/nfs/dbraw/zinc/49/56/23/402495623.db2.gz	SJWOPQTVNPEHCL-NEPJUHHUSA-N	0	3	308.451	2.272	10	0		DEAEHN
O=C(CN1CCN2CCC[C@H]2C1)NCCCC1CCCCC1	ZINC000245915425	402497016	/nfs/dbraw/zinc/49/70/16/402497016.db2.gz	KRIGZPRTLCJXER-KRWDZBQOSA-N	0	3	307.482	2.243	10	0		DEAEHN
CC(C)[C@H](CNC(=O)N1CCN2CCC[C@H]2C1)c1cccnc1	ZINC000246160119	402513969	/nfs/dbraw/zinc/51/39/69/402513969.db2.gz	QJGSFDIHYBPFGV-IRXDYDNUSA-N	0	3	316.449	2.311	10	0		DEAEHN
CCC[C@H](C)CS(=O)(=O)N1C[C@@H]2CCCN2C[C@H]1CC	ZINC000246051395	402506262	/nfs/dbraw/zinc/50/62/62/402506262.db2.gz	CIJCTMGIJARYBS-ZNMIVQPWSA-N	0	3	302.484	2.311	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000246088165	402508242	/nfs/dbraw/zinc/50/82/42/402508242.db2.gz	GJXUXZICTHXNEU-SWLSCSKDSA-N	0	3	314.426	2.177	10	0		DEAEHN
C[C@@H](C(=O)N(C)C1CCCCC1)N1CCCN(C2CC2)CC1	ZINC000178869987	402548889	/nfs/dbraw/zinc/54/88/89/402548889.db2.gz	USPRNLNRLZMOAD-HNNXBMFYSA-N	0	3	307.482	2.336	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2ccc(N(C)C)cc2F)C1	ZINC000246942303	402550502	/nfs/dbraw/zinc/55/05/02/402550502.db2.gz	ZIAMDDISNFUSFB-BLLLJJGKSA-N	0	3	307.413	2.350	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@H](C(=O)OC(C)(C)C)C1)N1[C@H](C)CC[C@@H]1C	ZINC000247128852	402558278	/nfs/dbraw/zinc/55/82/78/402558278.db2.gz	SFHIFSFJJRUMMK-BARDWOONSA-N	0	3	324.465	2.438	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)C2C[C@H]3CCC[C@@H](C2)C3=O)CCN1C	ZINC000247159556	402558667	/nfs/dbraw/zinc/55/86/67/402558667.db2.gz	AJTHJEZXIQBCKZ-JDOFQRQTSA-N	0	3	306.450	2.323	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(Br)o1	ZINC000247492818	402569315	/nfs/dbraw/zinc/56/93/15/402569315.db2.gz	UISOAWGHZJELHW-UWVGGRQHSA-N	0	3	313.195	2.351	10	0		DEAEHN
CCC[C@H](C(=O)NCCn1c(C)nc2ccccc21)N(C)C	ZINC000178662309	402522923	/nfs/dbraw/zinc/52/29/23/402522923.db2.gz	PMDATYRNHPBLMR-MRXNPFEDSA-N	0	3	302.422	2.191	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)N1CC[C@H](N(C)C)C1)c1ccco1	ZINC000170834776	402530791	/nfs/dbraw/zinc/53/07/91/402530791.db2.gz	PTDQJDRBOBWUHJ-GJZGRUSLSA-N	0	3	322.453	2.008	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCCCCN(C)c2ccccc2)C1	ZINC000170833337	402530927	/nfs/dbraw/zinc/53/09/27/402530927.db2.gz	LOSZYZBEGIXJDS-QGZVFWFLSA-N	0	3	318.465	2.249	10	0		DEAEHN
CC[C@@H](Oc1cccc(C)c1)C(=O)N1CCN2CCC[C@H]2C1	ZINC000246442743	402531540	/nfs/dbraw/zinc/53/15/40/402531540.db2.gz	KWXNMLIFJFPGIP-DOTOQJQBSA-N	0	3	302.418	2.459	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)CCC(=O)c2ccc3c(c2)CCC3)C1	ZINC000170860205	402533728	/nfs/dbraw/zinc/53/37/28/402533728.db2.gz	YRURTJOVYQRVET-QGZVFWFLSA-N	0	3	314.429	2.301	10	0		DEAEHN
C[C@@H](CNC(=O)NCCCc1ccccn1)N1CCC(C)CC1	ZINC000179188784	402579552	/nfs/dbraw/zinc/57/95/52/402579552.db2.gz	WBVJJHFVCQXAFJ-INIZCTEOSA-N	0	3	318.465	2.434	10	0		DEAEHN
CC[C@H]1CN(Cc2cccc(COC)c2)CCN1C[C@@H](C)O	ZINC000179212766	402581689	/nfs/dbraw/zinc/58/16/89/402581689.db2.gz	SBBYKQPMIFSNBE-QAPCUYQASA-N	0	3	306.450	2.110	10	0		DEAEHN
C[C@H]1CN(C2CCN(Cc3cccc4nccn43)CC2)CCO1	ZINC000179784910	402600358	/nfs/dbraw/zinc/60/03/58/402600358.db2.gz	PJRPPEQSAMUHRI-HNNXBMFYSA-N	0	3	314.433	2.019	10	0		DEAEHN
CN1CCC(N(Cc2ccco2)C(=O)N[C@@H]2CCCOC2)CC1	ZINC000171616704	402601980	/nfs/dbraw/zinc/60/19/80/402601980.db2.gz	BSLIHNFXSDNCND-CQSZACIVSA-N	0	3	321.421	2.064	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NC[C@@H](c2ccccc2)N(C)C)CC[C@@H]1C	ZINC000190452882	402602489	/nfs/dbraw/zinc/60/24/89/402602489.db2.gz	UUIUWNZMOXIESH-BHYGNILZSA-N	0	3	319.449	2.356	10	0		DEAEHN
CCn1cc(CN2CC[C@H](CN(C)Cc3cccnc3)C2)cn1	ZINC000190475998	402604036	/nfs/dbraw/zinc/60/40/36/402604036.db2.gz	MPCSRLRWPFFCKJ-QGZVFWFLSA-N	0	3	313.449	2.252	10	0		DEAEHN
CSC[C@H](C)C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190604560	402613162	/nfs/dbraw/zinc/61/31/62/402613162.db2.gz	XLOYVIYGNNMHQE-GOEBONIOSA-N	0	3	321.490	2.361	10	0		DEAEHN
COc1ccc([C@H](C)NCCn2cccn2)cc1NC(C)=O	ZINC000180432398	402616088	/nfs/dbraw/zinc/61/60/88/402616088.db2.gz	GALHOZANJBVKQF-LBPRGKRZSA-N	0	3	302.378	2.201	10	0		DEAEHN
Cc1cc2c(cc1C)[C@H](NC[C@H]1CN(C)CCO1)CCCO2	ZINC000180490066	402618112	/nfs/dbraw/zinc/61/81/12/402618112.db2.gz	YJFPPYAMQNYUMF-DOTOQJQBSA-N	0	3	304.434	2.437	10	0		DEAEHN
CCNC(=O)CCN1[C@@H]2CCCC[C@@H]2C[C@H]1C(=O)OC(C)(C)C	ZINC000249397990	402628429	/nfs/dbraw/zinc/62/84/29/402628429.db2.gz	BMIFDURBCUCIFD-KFWWJZLASA-N	0	3	324.465	2.487	10	0		DEAEHN
CCc1cc(NC(=O)C(=O)NCCN(CC)C2CC2)ccc1C	ZINC000180598846	402621228	/nfs/dbraw/zinc/62/12/28/402621228.db2.gz	NPNBUMQMGVPLPE-UHFFFAOYSA-N	0	3	317.433	2.096	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)N2CC(C)(C)OC(C)(C)C2)C1	ZINC000249138734	402621973	/nfs/dbraw/zinc/62/19/73/402621973.db2.gz	XIMMHVPPPPOPTN-UONOGXRCSA-N	0	3	311.470	2.314	10	0		DEAEHN
CC[C@H]1CN(c2ccccc2)CCN1CCN1CCO[C@@H](C)C1	ZINC000249262077	402624516	/nfs/dbraw/zinc/62/45/16/402624516.db2.gz	HFAQZXLSBFGSKK-ROUUACIJSA-N	0	3	317.477	2.308	10	0		DEAEHN
CCOCCN1CCN(Cc2cccc(OC)n2)C[C@H]1CC	ZINC000171828713	402626379	/nfs/dbraw/zinc/62/63/79/402626379.db2.gz	RCLAVNBQQREUSU-MRXNPFEDSA-N	0	3	307.438	2.023	10	0		DEAEHN
COC(=O)[C@@H](C)CN(Cc1ccccc1)C[C@@H](O)CSC	ZINC000249451386	402629981	/nfs/dbraw/zinc/62/99/81/402629981.db2.gz	MGTNWLOZWRILAB-DZGCQCFKSA-N	0	3	311.447	2.022	10	0		DEAEHN
CCOc1ccccc1CCNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171906906	402632436	/nfs/dbraw/zinc/63/24/36/402632436.db2.gz	SRWMTLYHTJFCGY-MRXNPFEDSA-N	0	3	317.433	2.117	10	0		DEAEHN
Cc1ncc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c(C(C)C)n1	ZINC000172142848	402642067	/nfs/dbraw/zinc/64/20/67/402642067.db2.gz	VTLQVKDQNODLCM-GXTWGEPZSA-N	0	3	302.422	2.217	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2ccc(OCC3CC3)cc2)CCO1	ZINC000191154125	402646476	/nfs/dbraw/zinc/64/64/76/402646476.db2.gz	HRHHKIJUNQROFR-GOSISDBHSA-N	0	3	304.434	2.238	10	0		DEAEHN
COCCCN(C)CCNC(=O)N1CCC[C@@]2(CC=CCC2)C1	ZINC000173585832	402704014	/nfs/dbraw/zinc/70/40/14/402704014.db2.gz	PFOLHMMOAHDEHF-SFHVURJKSA-N	0	3	323.481	2.487	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NS(=O)(=O)c2ccc3c(c2)CCC3)C1	ZINC000173886074	402716681	/nfs/dbraw/zinc/71/66/81/402716681.db2.gz	GXUQRUFYWJBJFY-DYVFJYSZSA-N	0	3	322.474	2.182	10	0		DEAEHN
CO[C@@H]1CCCN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)C1	ZINC000252801353	402661017	/nfs/dbraw/zinc/66/10/17/402661017.db2.gz	CPQNHWNWWYADNV-ZACQAIPSSA-N	0	3	317.433	2.252	10	0		DEAEHN
Cc1cnc([C@H](NC(=O)N2CC[C@H](N(C)C)C2)C2CC2)s1	ZINC000173914756	402718850	/nfs/dbraw/zinc/71/88/50/402718850.db2.gz	ALZIXDDOGDHXJD-QWHCGFSZSA-N	0	3	308.451	2.248	10	0		DEAEHN
CC[C@H](CO)N1CCN(c2ccc3cc(OC)ccc3n2)CC1	ZINC000172784616	402675221	/nfs/dbraw/zinc/67/52/21/402675221.db2.gz	HLBIUBDNQDRIHV-OAHLLOKOSA-N	0	3	315.417	2.136	10	0		DEAEHN
O=C1O[C@H](CN2C[C@H]3CCC[C@@H](C2)C3O)CN1c1ccccc1	ZINC000172822749	402676949	/nfs/dbraw/zinc/67/69/49/402676949.db2.gz	DSWGJVLSTHOBCA-NUCGDHGJSA-N	0	3	316.401	2.105	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N[C@H]1CCc2ccccc21	ZINC000261943388	402719827	/nfs/dbraw/zinc/71/98/27/402719827.db2.gz	VBSRCXMVMSTWHT-GGXPGOJBSA-N	0	3	314.429	2.323	10	0		DEAEHN
COc1cccc(F)c1[C@@H](C)NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000173509308	402700879	/nfs/dbraw/zinc/70/08/79/402700879.db2.gz	GWDOQBHASYPTCD-CHWSQXEVSA-N	0	3	321.396	2.385	10	0		DEAEHN
CN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H]1NCCCC1(C)C	ZINC000262518170	402726790	/nfs/dbraw/zinc/72/67/90/402726790.db2.gz	NTWRYWJLYKNEMT-HNNXBMFYSA-N	0	3	304.390	2.152	10	0		DEAEHN
C[C@@H](O)CN1CCN(CCSCc2ccccc2)C[C@@H]1C	ZINC000192575014	402738258	/nfs/dbraw/zinc/73/82/58/402738258.db2.gz	BMKAORYSPCKVLK-JKSUJKDBSA-N	0	3	308.491	2.307	10	0		DEAEHN
COCc1csc(NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)n1	ZINC000174376743	402738514	/nfs/dbraw/zinc/73/85/14/402738514.db2.gz	WWFUYWSDXYCRKJ-JQWIXIFHSA-N	0	3	312.439	2.236	10	0		DEAEHN
COCc1csc(NC(=O)N[C@@H](C)CN2CCCCC2)n1	ZINC000174398314	402739719	/nfs/dbraw/zinc/73/97/19/402739719.db2.gz	DYQQMSPZFKMGAW-NSHDSACASA-N	0	3	312.439	2.285	10	0		DEAEHN
CCCCNC(=O)[C@H](C)N[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000192622396	402740874	/nfs/dbraw/zinc/74/08/74/402740874.db2.gz	OJFLHIJTDYFIIQ-KGLIPLIRSA-N	0	3	315.421	2.223	10	0		DEAEHN
CN1CCNC[C@H]1c1noc([C@@]2(C)CCCc3ccccc32)n1	ZINC000263250920	402750797	/nfs/dbraw/zinc/75/07/97/402750797.db2.gz	PWFNIGLJPVNYIY-YJBOKZPZSA-N	0	3	312.417	2.288	10	0		DEAEHN
Cc1cc(-c2nc([C@@H]3CNCCN3C)no2)nc2ccccc12	ZINC000263286112	402754341	/nfs/dbraw/zinc/75/43/41/402754341.db2.gz	UZRGDDYRBWAERZ-HNNXBMFYSA-N	0	3	309.373	2.169	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(Cc3cccc(F)c3)C2)CC1	ZINC000174880052	402761214	/nfs/dbraw/zinc/76/12/14/402761214.db2.gz	YJGNDYZONDNYPL-SFHVURJKSA-N	0	3	305.441	2.428	10	0		DEAEHN
Cc1cnc([C@@H](C)NC(=O)N2CC[C@@H](N3CC=CC3)C2)s1	ZINC000174922605	402763764	/nfs/dbraw/zinc/76/37/64/402763764.db2.gz	ZQXZPQOHKQCTLA-CHWSQXEVSA-N	0	3	306.435	2.168	10	0		DEAEHN
CCN(CC)c1ccc(C(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000195314838	402841912	/nfs/dbraw/zinc/84/19/12/402841912.db2.gz	UORVBPHBTODXGR-QGZVFWFLSA-N	0	3	301.434	2.453	10	0		DEAEHN
CCCCO[C@@H]1C[C@@H](NC(=O)N2CC[C@H](N(C)C)C2)C1(C)C	ZINC000175910847	402842000	/nfs/dbraw/zinc/84/20/00/402842000.db2.gz	AQQDGKZZDPUTRK-RRFJBIMHSA-N	0	3	311.470	2.316	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2nnc(C(F)(F)F)s2)C1	ZINC000194326221	402792032	/nfs/dbraw/zinc/79/20/32/402792032.db2.gz	RYRKPEUPJVNRLN-ZETCQYMHSA-N	0	3	323.344	2.163	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc(-n3cccn3)cc2)C1	ZINC000194331670	402792943	/nfs/dbraw/zinc/79/29/43/402792943.db2.gz	RSKLQAFKRMFUMU-OAHLLOKOSA-N	0	3	313.405	2.478	10	0		DEAEHN
C[C@H]1COCC[C@H]1C(=O)N(CCN(C)C)Cc1cccs1	ZINC000194628085	402805904	/nfs/dbraw/zinc/80/59/04/402805904.db2.gz	MVYONTVEXGPDJH-DZGCQCFKSA-N	0	3	310.463	2.311	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC(C)(C)c2ncc(C)s2)C1	ZINC000175435967	402806449	/nfs/dbraw/zinc/80/64/49/402806449.db2.gz	IFHMRJURPRAHKO-GFCCVEGCSA-N	0	3	310.467	2.470	10	0		DEAEHN
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000195339115	402843028	/nfs/dbraw/zinc/84/30/28/402843028.db2.gz	JEVGLKVLJLCFQO-VXGBXAGGSA-N	0	3	310.344	2.039	10	0		DEAEHN
CCc1c(C(=O)NC[C@@H]2CCCN2C)cnn1-c1ccccc1	ZINC000194706931	402811602	/nfs/dbraw/zinc/81/16/02/402811602.db2.gz	NKUNKLYYAQBRHG-HNNXBMFYSA-N	0	3	312.417	2.259	10	0		DEAEHN
COc1ccc2c(CC(=O)NC[C@@H]3CCCN3C)coc2c1	ZINC000194743864	402814206	/nfs/dbraw/zinc/81/42/06/402814206.db2.gz	JJVCSUOYYJYFQI-ZDUSSCGKSA-N	0	3	302.374	2.194	10	0		DEAEHN
CC(C)OC(=O)c1cccnc1N1CCCN(C2CC2)CC1	ZINC000184100619	402817780	/nfs/dbraw/zinc/81/77/80/402817780.db2.gz	AFKFUFMLFSNSNM-UHFFFAOYSA-N	0	3	303.406	2.321	10	0		DEAEHN
C[C@H](NC[C@@H](O)COC(C)(C)C)c1ccc(-n2cncn2)cc1	ZINC000194894748	402821811	/nfs/dbraw/zinc/82/18/11/402821811.db2.gz	AVYYHTPMMGXLLG-XJKSGUPXSA-N	0	3	318.421	2.094	10	0		DEAEHN
C[C@H](N[C@@H]1CCCN(c2cnn(C)c2)C1)c1cccc(O)c1	ZINC000194901072	402821823	/nfs/dbraw/zinc/82/18/23/402821823.db2.gz	OWFWVWTXUWZTAG-DZGCQCFKSA-N	0	3	300.406	2.445	10	0		DEAEHN
CN(Cc1ccc2c(c1)sc(=O)n2C)CC1(O)CCCC1	ZINC000195025493	402827465	/nfs/dbraw/zinc/82/74/65/402827465.db2.gz	KNRNHUSCPRMDPE-UHFFFAOYSA-N	0	3	306.431	2.337	10	0		DEAEHN
CNC(=O)[C@@H](NCCOc1ccccc1C(F)(F)F)C(C)C	ZINC000183642300	402784873	/nfs/dbraw/zinc/78/48/73/402784873.db2.gz	ILKWZKWEVIAFBE-ZDUSSCGKSA-N	0	3	318.339	2.444	10	0		DEAEHN
O=C(CN1CCC(c2ccn[nH]2)CC1)Nc1ccc(Cl)cn1	ZINC000195505815	402848119	/nfs/dbraw/zinc/84/81/19/402848119.db2.gz	AMFQNJDOZSQVBJ-UHFFFAOYSA-N	0	3	319.796	2.276	10	0		DEAEHN
CC/C=C/CCN1CCN(c2nc(C)nc3c2cnn3C)CC1	ZINC000184526926	402849204	/nfs/dbraw/zinc/84/92/04/402849204.db2.gz	PQSIFQHVVMMBOI-AATRIKPKSA-N	0	3	314.437	2.150	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN(CC(=O)NC3CCCC3)C2)n1	ZINC000195516127	402849658	/nfs/dbraw/zinc/84/96/58/402849658.db2.gz	BULJMHSSRSHYBL-HNNXBMFYSA-N	0	3	316.449	2.183	10	0		DEAEHN
Cc1c(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)[nH]c2c1C(=O)CCC2	ZINC000268430701	403082442	/nfs/dbraw/zinc/08/24/42/403082442.db2.gz	YCXLESJEGWOVPU-RISCZKNCSA-N	0	3	317.433	2.301	10	0		DEAEHN
Brc1ccc2c(c1)CC[C@H]2NCCn1cncn1	ZINC000268793882	403114662	/nfs/dbraw/zinc/11/46/62/403114662.db2.gz	CVLOKORILSOSPT-CYBMUJFWSA-N	0	3	307.195	2.318	10	0		DEAEHN
Cc1cc(C)n(-c2cncc(NCCN3CCC[C@H](C)C3)n2)n1	ZINC000301504993	403638637	/nfs/dbraw/zinc/63/86/37/403638637.db2.gz	GMQWGNDXRQYGOB-ZDUSSCGKSA-N	0	3	314.437	2.423	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2ccc3[nH]ccc3c2)C1	ZINC000333065542	403658780	/nfs/dbraw/zinc/65/87/80/403658780.db2.gz	JJFPBYKQOXPBIB-INIZCTEOSA-N	0	3	314.433	2.494	10	0		DEAEHN
Cc1c(Cl)c(C(=O)NC2C[C@H]3CCC[C@@H](C2)N3C)nn1C	ZINC000333712549	403828591	/nfs/dbraw/zinc/82/85/91/403828591.db2.gz	IOTMQMRIBJBIIZ-YOGCLGLASA-N	0	3	310.829	2.127	10	0		DEAEHN
CC(=O)[C@](C)(O)CN1CCC(CN2CCc3ccccc32)CC1	ZINC000347728924	403830630	/nfs/dbraw/zinc/83/06/30/403830630.db2.gz	BFMSOWBYIHDIJD-LJQANCHMSA-N	0	3	316.445	2.101	10	0		DEAEHN
NC1(c2ncc(I)cn2)CCCCC1	ZINC000307517460	403953761	/nfs/dbraw/zinc/95/37/61/403953761.db2.gz	JKTWVBAJRMCPTR-UHFFFAOYSA-N	0	3	303.147	2.199	10	0		DEAEHN
Cn1ccnc(N2CCC[C@H](NC/C=C\c3ccccc3)C2)c1=O	ZINC000337542135	404086315	/nfs/dbraw/zinc/08/63/15/404086315.db2.gz	ZPLZLTIRSLDLOI-OOYWPUHTSA-N	0	3	324.428	2.052	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)N(C)[C@H]2CN3CCC2CC3)cc1	ZINC000320489126	404067191	/nfs/dbraw/zinc/06/71/91/404067191.db2.gz	CHOOGMNDFWAXEM-INIZCTEOSA-N	0	3	301.390	2.447	10	0		DEAEHN
c1cc(-c2ccc(CN3CCS[C@H]4COCC[C@@H]43)o2)n[nH]1	ZINC000369485712	404113069	/nfs/dbraw/zinc/11/30/69/404113069.db2.gz	RWQPBNVOUFJFOI-ZFWWWQNUSA-N	0	3	305.403	2.376	10	0		DEAEHN
c1ccc(CN2CCCO[C@@H](CN3C[C@H]4CC[C@@H](C3)O4)C2)cc1	ZINC000341890558	404237725	/nfs/dbraw/zinc/23/77/25/404237725.db2.gz	ALHPISGLJIUWOK-CEXWTWQISA-N	0	3	316.445	2.141	10	0		DEAEHN
C[C@H]1CCN(CC(=O)N2CCC[C@@H](C(N)=O)C2)CC12CCC2	ZINC000329157355	404248853	/nfs/dbraw/zinc/24/88/53/404248853.db2.gz	WFSBXTRYFVUDGS-UONOGXRCSA-N	0	3	307.438	2.272	10	0		DEAEHN
CCn1nccc1CCN1C[C@H](O)C[C@@H]1c1ccc(F)cc1	ZINC000338569243	404409588	/nfs/dbraw/zinc/40/95/88/404409588.db2.gz	HSXMQAAJBKFNPH-IAGOWNOFSA-N	0	3	303.381	2.393	10	0		DEAEHN
C1CCN([C@@H]2CCCN(c3nnc(C4CCOCC4)s3)C2)C1	ZINC000338652589	404462146	/nfs/dbraw/zinc/46/21/46/404462146.db2.gz	RKCCAEDDXTXYNC-CQSZACIVSA-N	0	3	322.478	2.497	10	0		DEAEHN
CC(=O)N1CC[C@H](NCC[C@@H](C)[S@](C)=O)c2ccccc2C1	ZINC000352847748	404661743	/nfs/dbraw/zinc/66/17/43/404661743.db2.gz	GGTUOBVTPBOJKF-BUTRMIIQSA-N	0	3	322.474	2.227	10	0		DEAEHN
Cc1cnc([C@H](C)N2CCC[C@@H]2[C@@H]2COCC[C@]2(C)O)cn1	ZINC000330245916	404599453	/nfs/dbraw/zinc/59/94/53/404599453.db2.gz	KXMMOYBZBFUSLY-DIECFANBSA-N	0	3	305.422	2.098	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)[C@@H](C)N1CCC[C@H](c2nc[nH]n2)C1	ZINC000374548277	404708471	/nfs/dbraw/zinc/70/84/71/404708471.db2.gz	JRXMAJWWZIESPQ-QLFBSQMISA-N	0	3	319.453	2.164	10	0		DEAEHN
O=C([C@H]1CCCC12OCCO2)N1CCCN(C2CCCC2)CC1	ZINC000375098704	404717485	/nfs/dbraw/zinc/71/74/85/404717485.db2.gz	CFPRIDYSHMADMA-MRXNPFEDSA-N	0	3	322.449	2.007	10	0		DEAEHN
CCO[C@H]1C[C@@H](NCc2c(C)nn(C)c2C)C12CCOCC2	ZINC000186304368	286493790	/nfs/dbraw/zinc/49/37/90/286493790.db2.gz	CHVKAVJLPQOXLZ-CVEARBPZSA-N	0	3	307.438	2.101	10	0		DEAEHN
C[C@H]1OCC[C@]1(O)CNCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000435034425	404951331	/nfs/dbraw/zinc/95/13/31/404951331.db2.gz	NEXNOEWKGWVNPT-ACJLOTCBSA-N	0	3	321.417	2.271	10	0		DEAEHN
c1cn(-c2ccccc2)nc1CN[C@@H]1CCO[C@@]2(CCOC2)C1	ZINC000367365677	405025483	/nfs/dbraw/zinc/02/54/83/405025483.db2.gz	QOHHAWVUGWNDFX-QAPCUYQASA-N	0	3	313.401	2.300	10	0		DEAEHN
CCN1CC[C@@H](CNC(=O)[C@H](C)CC(=O)c2ccccc2F)C1	ZINC000361364071	405040625	/nfs/dbraw/zinc/04/06/25/405040625.db2.gz	ABSLJZCCSLYAJJ-KGLIPLIRSA-N	0	3	320.408	2.493	10	0		DEAEHN
C[C@@H](Cc1ccccc1)C(=O)Nc1ccnn1CCN(C)C	ZINC000436713222	405128757	/nfs/dbraw/zinc/12/87/57/405128757.db2.gz	QHXDWZZUTUNFJJ-AWEZNQCLSA-N	0	3	300.406	2.262	10	0		DEAEHN
Cc1cc(=O)[nH]c(C(=O)N2CCN(CC3CCCCC3)CC2)c1	ZINC000408397525	405196257	/nfs/dbraw/zinc/19/62/57/405196257.db2.gz	YFTBNTFHOQADCV-UHFFFAOYSA-N	0	3	317.433	2.434	10	0		DEAEHN
CC(C)(C)c1nnsc1C(=O)N[C@H]1CCN2CCCC[C@H]12	ZINC000408320364	405173013	/nfs/dbraw/zinc/17/30/13/405173013.db2.gz	KZCFXWHMMSLQOO-WDEREUQCSA-N	0	3	308.451	2.192	10	0		DEAEHN
CN(C)c1ncc(CN(C[C@@H]2CCCO2)C2CCCC2)n1C	ZINC000425333120	405274844	/nfs/dbraw/zinc/27/48/44/405274844.db2.gz	FIDBDYSNKSCVQD-INIZCTEOSA-N	0	3	306.454	2.410	10	0		DEAEHN
Cn1cc(C(=O)N2C[C@H]3CCN(C)[C@H]3C2)c2cc(F)ccc21	ZINC000456176638	405530665	/nfs/dbraw/zinc/53/06/65/405530665.db2.gz	YLIVLFVKSLGLAM-BZNIZROVSA-N	0	3	301.365	2.094	10	0		DEAEHN
O=C(NC[C@H](O)C1CCC1)c1cccc(CN2CCCC2)c1	ZINC000456865056	405595942	/nfs/dbraw/zinc/59/59/42/405595942.db2.gz	HHKWVPSFLGHAKY-KRWDZBQOSA-N	0	3	302.418	2.173	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N[C@H]2C[C@@H]([NH+](C)C)C2(C)C)cc1[O-]	ZINC000636090502	405731929	/nfs/dbraw/zinc/73/19/29/405731929.db2.gz	GOABVOMIKMLJHF-LSDHHAIUSA-N	0	3	304.390	2.053	10	0		DEAEHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)N[C@H]1CCCC(F)(F)C1	ZINC000495036683	405803426	/nfs/dbraw/zinc/80/34/26/405803426.db2.gz	NVDZSMQUWBZHAY-NTZNESFSSA-N	0	3	301.381	2.346	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)NC[C@H](C)N1CCCC1)CC2	ZINC000530473586	405809472	/nfs/dbraw/zinc/80/94/72/405809472.db2.gz	AXBHURISBZQFAC-UONOGXRCSA-N	0	3	318.465	2.239	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NC[C@H](C)N1CCCC1)C2	ZINC000530473586	405809476	/nfs/dbraw/zinc/80/94/76/405809476.db2.gz	AXBHURISBZQFAC-UONOGXRCSA-N	0	3	318.465	2.239	10	0		DEAEHN
Cc1cc(N2CC[C@H](N[C@H]3CC[C@H]3C3CCC3)C2=O)n(C)n1	ZINC000560941456	405879417	/nfs/dbraw/zinc/87/94/17/405879417.db2.gz	BBENSZJCDAGMEL-KKUMJFAQSA-N	0	3	302.422	2.002	10	0		DEAEHN
c1c2c(cc3c1OCCC[C@H]3NC[C@H]1CNCCO1)CCCC2	ZINC000423531129	405846049	/nfs/dbraw/zinc/84/60/49/405846049.db2.gz	XOYDROQNQXJOHJ-SJLPKXTDSA-N	0	3	316.445	2.357	10	0		DEAEHN
C[C@H]1CCCN(C(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)CC1	ZINC000530813705	405864080	/nfs/dbraw/zinc/86/40/80/405864080.db2.gz	AXRXJCONRZYNBS-QFBILLFUSA-N	0	3	316.445	2.272	10	0		DEAEHN
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NCCCC1CC1	ZINC000531139835	405915167	/nfs/dbraw/zinc/91/51/67/405915167.db2.gz	UUIZJQGXWIKSAU-UHFFFAOYSA-N	0	3	317.433	2.302	10	0		DEAEHN
c1ccc2c(CCNCc3cc4c(cn3)OCCO4)noc2c1	ZINC000639304373	406032717	/nfs/dbraw/zinc/03/27/17/406032717.db2.gz	YBHSRCLQYJRRIR-UHFFFAOYSA-N	0	3	311.341	2.326	10	0		DEAEHN
c1cc(OCCN2CCOCC2)ccc1CN1CC[C@H]1C1CC1	ZINC000639223483	405985564	/nfs/dbraw/zinc/98/55/64/405985564.db2.gz	VPYDGKXCKSUAHF-IBGZPJMESA-N	0	3	316.445	2.382	10	0		DEAEHN
CCC(F)(F)C(C)(C)CNCc1ccc(S(N)(=O)=O)o1	ZINC000639350313	406060091	/nfs/dbraw/zinc/06/00/91/406060091.db2.gz	DZUSCDVKSRYQOV-UHFFFAOYSA-N	0	3	310.366	2.088	10	0		DEAEHN
CCN(CC)CC(=O)N1CCC[C@@H](CC(=O)OC(C)(C)C)C1	ZINC000532379478	406072470	/nfs/dbraw/zinc/07/24/70/406072470.db2.gz	MSDSFZIRZQZBRL-AWEZNQCLSA-N	0	3	312.454	2.299	10	0		DEAEHN
c1nc2n(n1)[C@H](CN1CCC[C@@]3(C1)OCc1ccccc13)CC2	ZINC000639593874	406160325	/nfs/dbraw/zinc/16/03/25/406160325.db2.gz	WVJJUTRSYLLYHS-YJBOKZPZSA-N	0	3	310.401	2.287	10	0		DEAEHN
Cn1ccc2c1cccc2NC(=O)NCCNc1ccncc1	ZINC000533815450	406163534	/nfs/dbraw/zinc/16/35/34/406163534.db2.gz	NQQAOBSZOYSAEY-UHFFFAOYSA-N	0	3	309.373	2.229	10	0		DEAEHN
CC(=O)N(CC(=O)NCCN1CCCC[C@@H]1C)c1ccccc1	ZINC000639528033	406131010	/nfs/dbraw/zinc/13/10/10/406131010.db2.gz	ZPRAQHNLZIMQSJ-HNNXBMFYSA-N	0	3	317.433	2.030	10	0		DEAEHN
c1cnn(-c2ccc(CN3CC[C@@H](Nc4ncccn4)C3)cc2)c1	ZINC000567905385	406158237	/nfs/dbraw/zinc/15/82/37/406158237.db2.gz	VLYZIMPZMHGNLM-MRXNPFEDSA-N	0	3	320.400	2.349	10	0		DEAEHN
CSCC(=O)N[C@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000193952703	286660806	/nfs/dbraw/zinc/66/08/06/286660806.db2.gz	RSWCJFCOROQDPT-AWEZNQCLSA-N	0	3	320.458	2.454	10	0		DEAEHN
O=C(NCCNc1ccncc1)NCc1cc2ccccc2o1	ZINC000535260933	406217256	/nfs/dbraw/zinc/21/72/56/406217256.db2.gz	LKQKLPSUWRGMDC-UHFFFAOYSA-N	0	3	310.357	2.161	10	0		DEAEHN
CC(C)c1ccc(CCNC(=O)CN2CC[C@H](CO)[C@@H]2C)cc1	ZINC000488716541	406339683	/nfs/dbraw/zinc/33/96/83/406339683.db2.gz	JQOUTKQGCUFJJF-MAUKXSAKSA-N	0	3	318.461	2.171	10	0		DEAEHN
CCCN(Cc1ccc(C)cc1)C(=O)CN1CC[C@H](CO)[C@@H]1C	ZINC000488800140	406350419	/nfs/dbraw/zinc/35/04/19/406350419.db2.gz	DVRFNOWQBCUPFR-FUHWJXTLSA-N	0	3	318.461	2.436	10	0		DEAEHN
CC(C)C[C@H]1CCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)C1	ZINC000637992953	406514447	/nfs/dbraw/zinc/51/44/47/406514447.db2.gz	WIKGQGAJQYUMEJ-QZTJIDSGSA-N	0	3	317.477	2.340	10	0		DEAEHN
CC[C@@H]1CC[C@@H](C)N1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638313475	406693281	/nfs/dbraw/zinc/69/32/81/406693281.db2.gz	XAMDBVYSNYQFMP-OIISXLGYSA-N	0	3	303.450	2.235	10	0		DEAEHN
COC(=O)CCC(=O)c1ccc(OCCN2CCCC2)cc1	ZINC000575358871	406807335	/nfs/dbraw/zinc/80/73/35/406807335.db2.gz	HFNOQTKQJHZWLS-UHFFFAOYSA-N	0	3	305.374	2.297	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)[C@H]1OCCc2ccccc21	ZINC000129395563	196044775	/nfs/dbraw/zinc/04/47/75/196044775.db2.gz	OANVQDWGOWCYLI-PBHICJAKSA-N	0	3	302.418	2.291	10	0		DEAEHN
CN(CC[C@H]1COCCN1)Cc1csc(Br)c1	ZINC000129417663	196046414	/nfs/dbraw/zinc/04/64/14/196046414.db2.gz	LMSNIAJKXRVNEC-NSHDSACASA-N	0	3	319.268	2.321	10	0		DEAEHN
C[C@H](CNS(=O)(=O)c1cccc(CN)c1)c1ccccc1	ZINC000131162770	196145352	/nfs/dbraw/zinc/14/53/52/196145352.db2.gz	NQNZXOXYTSIRDJ-CYBMUJFWSA-N	0	3	304.415	2.227	10	0		DEAEHN
Cc1cc(F)ccc1CCNC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000132676282	196275472	/nfs/dbraw/zinc/27/54/72/196275472.db2.gz	CBHAMQYBXCDXFV-QGZVFWFLSA-N	0	3	317.408	2.332	10	0		DEAEHN
CC[C@H](NCCNC(N)=O)c1ccc(Br)cc1	ZINC000132781811	196283484	/nfs/dbraw/zinc/28/34/84/196283484.db2.gz	UCOAGHRJUXEANZ-NSHDSACASA-N	0	3	300.200	2.158	10	0		DEAEHN
CCCNC(=O)c1cccc(C(=O)N[C@@H]2CCCN(CC)C2)c1	ZINC000133017991	196305298	/nfs/dbraw/zinc/30/52/98/196305298.db2.gz	HKMSWWOMUSLOKJ-MRXNPFEDSA-N	0	3	317.433	2.041	10	0		DEAEHN
CCOC(=O)c1csc(N2CC[C@@H](N3CCCCC3)C2)n1	ZINC000133141633	196315186	/nfs/dbraw/zinc/31/51/86/196315186.db2.gz	NRFUEHVRKYDQQS-GFCCVEGCSA-N	0	3	309.435	2.384	10	0		DEAEHN
COc1ccc(C2CC(NC[C@@H]3CCCS3(=O)=O)C2)cc1	ZINC000133873176	196341924	/nfs/dbraw/zinc/34/19/24/196341924.db2.gz	KPEMIWYUTHVIQP-XUJLQICISA-N	0	3	309.431	2.108	10	0		DEAEHN
CN[C@@H](CC[C@H]1CCCO1)c1c(Cl)cnn1CCOC	ZINC000133970126	196350231	/nfs/dbraw/zinc/35/02/31/196350231.db2.gz	LVLFZXUYFUDPPY-YPMHNXCESA-N	0	3	301.818	2.403	10	0		DEAEHN
CN(C)[C@H](CNCCNC(=O)OC(C)(C)C)c1cccs1	ZINC000134520677	196398124	/nfs/dbraw/zinc/39/81/24/196398124.db2.gz	VEHNEBUARBPASY-GFCCVEGCSA-N	0	3	313.467	2.465	10	0		DEAEHN
Cc1ccc2c(CCN[C@H](C)CS(C)(=O)=O)cn(C)c2c1	ZINC000188699574	225030296	/nfs/dbraw/zinc/03/02/96/225030296.db2.gz	APOXLRRGWJTEHD-CYBMUJFWSA-N	0	3	308.447	2.052	10	0		DEAEHN
CO[C@H](C)CCC(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190622820	225090337	/nfs/dbraw/zinc/09/03/37/225090337.db2.gz	DASGJGGZERTVOH-NVXWUHKLSA-N	0	3	319.449	2.177	10	0		DEAEHN
O=C(Cc1ccc(OC(F)F)cc1)N1CCN2CCC[C@H]2C1	ZINC000195319274	424882087	/nfs/dbraw/zinc/88/20/87/424882087.db2.gz	ZTHBYOQLZKYODD-ZDUSSCGKSA-N	0	3	310.344	2.137	10	0		DEAEHN
CN(Cc1ccc(Br)cn1)[C@@H]1CN2CCC1CC2	ZINC000385747487	424911523	/nfs/dbraw/zinc/91/15/23/424911523.db2.gz	RATZREKJFGVDBZ-CQSZACIVSA-N	0	3	310.239	2.370	10	0		DEAEHN
Cc1nc(-c2ccccc2NC(=O)N2CC[C@H](N(C)C)C2)no1	ZINC000363470144	269064755	/nfs/dbraw/zinc/06/47/55/269064755.db2.gz	KUDWDYZXIXYXMF-LBPRGKRZSA-N	0	3	315.377	2.213	10	0		DEAEHN
Cc1oc(Br)cc1C(=O)N1CC[C@H](N(C)C)C1	ZINC000396727986	269104083	/nfs/dbraw/zinc/10/40/83/269104083.db2.gz	NJNWKHUHSKJMGB-VIFPVBQESA-N	0	3	301.184	2.127	10	0		DEAEHN
Cc1cccc(C(C)C)c1NC(=O)C(=O)N[C@H](C)CN(C)C	ZINC000357602696	274789314	/nfs/dbraw/zinc/78/93/14/274789314.db2.gz	XTLDBEXSJIPBEH-CYBMUJFWSA-N	0	3	305.422	2.123	10	0		DEAEHN
c1ccc(OCCOCCN2CCS[C@@H]3COCC[C@H]32)cc1	ZINC000362959636	275067892	/nfs/dbraw/zinc/06/78/92/275067892.db2.gz	BUPOMMCRTNYVFS-IAGOWNOFSA-N	0	3	323.458	2.288	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)N(C)C	ZINC000179338690	276038749	/nfs/dbraw/zinc/03/87/49/276038749.db2.gz	XZKPBOPYTUYKHC-BRWVUGGUSA-N	0	3	303.450	2.278	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@@H]1OCCc2ccccc21	ZINC000246344886	276169191	/nfs/dbraw/zinc/16/91/91/276169191.db2.gz	VECAGOCHGDJJLR-NVXWUHKLSA-N	0	3	302.418	2.243	10	0		DEAEHN
C[C@@H](C(=O)N[C@H]1CCC[C@@H](C)[C@H]1C)N1CCCN(C2CC2)CC1	ZINC000246107060	278213068	/nfs/dbraw/zinc/21/30/68/278213068.db2.gz	DGELBGVHSYFXOK-CBZIJGRNSA-N	0	3	321.509	2.486	10	0		DEAEHN
CC(=O)[C@](C)(O)CN1CCC[C@H](CCC(=O)OC(C)(C)C)C1	ZINC000412059680	278238712	/nfs/dbraw/zinc/23/87/12/278238712.db2.gz	CWHAVBUSRAWIFF-RHSMWYFYSA-N	0	3	313.438	2.160	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H]1COC2(CCC(C)CC2)O1)N(C)C	ZINC000180871412	278921751	/nfs/dbraw/zinc/92/17/51/278921751.db2.gz	KYJSIJLLIJMJCD-GYMHETDLSA-N	0	3	312.454	2.155	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1nc2cccnc2s1	ZINC000193885200	279133259	/nfs/dbraw/zinc/13/32/59/279133259.db2.gz	PMIZBHZTJZLUBB-LLVKDONJSA-N	0	3	306.435	2.397	10	0		DEAEHN
CC(C)C[C@H](CO)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248130097	279170509	/nfs/dbraw/zinc/17/05/09/279170509.db2.gz	WJNBCAVPDYVXES-ZACQAIPSSA-N	0	3	319.449	2.138	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)N1CC[C@H]2OCCC[C@H]2C1	ZINC000246780522	279271208	/nfs/dbraw/zinc/27/12/08/279271208.db2.gz	QTWMJXCJZGSUGK-ARFHVFGLSA-N	0	3	309.454	2.071	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@H]1Oc2ccccc2O[C@H]1C	ZINC000177017817	279301024	/nfs/dbraw/zinc/30/10/24/279301024.db2.gz	NLQPXEOICMMPSY-VBQJREDUSA-N	0	3	318.417	2.158	10	0		DEAEHN
C[C@H]1CC(O)C[C@H](C)N1Cc1cc(=O)n2cc(Cl)ccc2n1	ZINC000191285939	279639931	/nfs/dbraw/zinc/63/99/31/279639931.db2.gz	QJWIGPLBNUGTGG-QWRGUYRKSA-N	0	3	321.808	2.082	10	0		DEAEHN
CC(C)[C@H](O)CNC(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000153511237	280347459	/nfs/dbraw/zinc/34/74/59/280347459.db2.gz	SZGHBQAVGMSZLF-IAGOWNOFSA-N	0	3	319.449	2.140	10	0		DEAEHN
Cc1ccccc1C1CCN(C(=O)[C@H](N)C2CCOCC2)CC1	ZINC000261903170	281337729	/nfs/dbraw/zinc/33/77/29/281337729.db2.gz	WUAWVGAQGKDSQV-GOSISDBHSA-N	0	3	316.445	2.455	10	0		DEAEHN
COc1cccc(CNC(=O)N[C@H](CC(C)C)CN(C)C)c1	ZINC000079122047	281586823	/nfs/dbraw/zinc/58/68/23/281586823.db2.gz	QYSVYFRUOGNEKZ-OAHLLOKOSA-N	0	3	307.438	2.471	10	0		DEAEHN
CC(C)NC(=O)CCCC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000104825688	281657541	/nfs/dbraw/zinc/65/75/41/281657541.db2.gz	FAVNYSWKCROMNY-MRXNPFEDSA-N	0	3	319.449	2.100	10	0		DEAEHN
OC[C@@H](NCC1=CCCOC1)c1cccc(Br)c1	ZINC000127972291	281871303	/nfs/dbraw/zinc/87/13/03/281871303.db2.gz	KNYGRTPQMHTXRP-CQSZACIVSA-N	0	3	312.207	2.419	10	0		DEAEHN
CN(C)[C@H](CNC(=O)N(C)C[C@H]1CCCO1)c1ccccc1	ZINC000076996476	289354545	/nfs/dbraw/zinc/35/45/45/289354545.db2.gz	AFZXXGJQKORIDC-HZPDHXFCSA-N	0	3	305.422	2.110	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)NCc1ccc(Cl)cn1	ZINC000180892264	289566051	/nfs/dbraw/zinc/56/60/51/289566051.db2.gz	JEKUYCJTNMKSDX-GFCCVEGCSA-N	0	3	310.829	2.409	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N[C@@H]1CCC(=O)N(C)C1)CCCO2	ZINC000152355241	295275392	/nfs/dbraw/zinc/27/53/92/295275392.db2.gz	FZWKORHESFIAIQ-IUODEOHRSA-N	0	3	304.390	2.119	10	0		DEAEHN
O=C(NC1(C(F)(F)F)CCOCC1)C1CCN(C2CC2)CC1	ZINC000362607162	295591745	/nfs/dbraw/zinc/59/17/45/295591745.db2.gz	TZJIGKAASFZTDM-UHFFFAOYSA-N	0	3	320.355	2.089	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@@H](C)N[C@@H](C)CN1CCOCC1	ZINC000156743645	302729414	/nfs/dbraw/zinc/72/94/14/302729414.db2.gz	YHGUMSBUDQAYQY-UONOGXRCSA-N	0	3	308.470	2.318	10	0		DEAEHN
CN(C)C1(CNC(=O)N2CCC(C3CCOCC3)CC2)CCC1	ZINC000572568007	325949030	/nfs/dbraw/zinc/94/90/30/325949030.db2.gz	PKHCAHLDZYBYNQ-UHFFFAOYSA-N	0	3	323.481	2.319	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(C)CC2(N(C)C)CCC2)s1	ZINC000189928774	335142700	/nfs/dbraw/zinc/14/27/00/335142700.db2.gz	HNMOOAGAINTWMA-UHFFFAOYSA-N	0	3	324.494	2.374	10	0		DEAEHN
OC1(C(F)(F)F)CCC(NCc2nnc3ccccn32)CC1	ZINC000396321934	337238790	/nfs/dbraw/zinc/23/87/90/337238790.db2.gz	LENSXXAZLQKADF-UHFFFAOYSA-N	0	3	314.311	2.055	10	0		DEAEHN
O=c1c2nccn2ccn1[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000584605249	337371428	/nfs/dbraw/zinc/37/14/28/337371428.db2.gz	JPLFUEBVPJZFCU-MRXNPFEDSA-N	0	3	308.385	2.333	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H](O)CN2Cc2ccc(CO)cc2)c1	ZINC000225731161	337383686	/nfs/dbraw/zinc/38/36/86/337383686.db2.gz	QZCKZBWTPSLQBI-MJGOQNOKSA-N	0	3	313.397	2.495	10	0		DEAEHN
CC(C)(C)CCCCNC(=O)NC[C@H](O)CN1CCCCC1	ZINC000105253496	518641435	/nfs/dbraw/zinc/64/14/35/518641435.db2.gz	VAZRLVMMMKPYOQ-HNNXBMFYSA-N	0	3	313.486	2.349	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)NCCCN1CCc2ccccc2C1	ZINC000193989674	534483403	/nfs/dbraw/zinc/48/34/03/534483403.db2.gz	FLCWRSQHHRGETE-QAPCUYQASA-N	0	3	316.445	2.224	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)[C@@H]1C[C@@H]1c1cccc(OC)c1	ZINC000106902881	521638395	/nfs/dbraw/zinc/63/83/95/521638395.db2.gz	BDIQCMUXCOWRTH-DJIMGWMZSA-N	0	3	302.418	2.399	10	0		DEAEHN
CCCN(C[C@H]1CCCCO1)C(=O)NC[C@@H](C)N(C)C1CC1	ZINC000106561029	521676884	/nfs/dbraw/zinc/67/68/84/521676884.db2.gz	RGJUMGSZRCCJPZ-GDBMZVCRSA-N	0	3	311.470	2.460	10	0		DEAEHN
CCCN(C[C@H]1CCCCO1)C(=O)N[C@H]1CCCN(CC)C1	ZINC000106541555	521677010	/nfs/dbraw/zinc/67/70/10/521677010.db2.gz	DQCAGTNJVCIEPF-JKSUJKDBSA-N	0	3	311.470	2.461	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N2CCC(c3cc[nH]n3)CC2)c1	ZINC000156674437	521912258	/nfs/dbraw/zinc/91/22/58/521912258.db2.gz	PSFJSBAFBAPZID-UHFFFAOYSA-N	0	3	312.417	2.491	10	0		DEAEHN
CCc1nc(CNC(=O)N2CCN(C3CCCC3)CC2)cs1	ZINC000107854016	522331130	/nfs/dbraw/zinc/33/11/30/522331130.db2.gz	LMTUVVCIRMYJLC-UHFFFAOYSA-N	0	3	322.478	2.475	10	0		DEAEHN
COC[C@H](NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1)C1CC1	ZINC000157276276	522751066	/nfs/dbraw/zinc/75/10/66/522751066.db2.gz	MXOVYVWUQLVEQS-ZQIUZPCESA-N	0	3	319.449	2.210	10	0		DEAEHN
COC(=O)[C@@H]1CCN(Cc2ccc(NC(C)=O)cc2)C[C@H]1C	ZINC000248891343	523717966	/nfs/dbraw/zinc/71/79/66/523717966.db2.gz	JPSJNPAVVYMIBU-MLGOLLRUSA-N	0	3	304.390	2.276	10	0		DEAEHN
COCCN1CCC[C@@H]1CN[C@H](C)c1cc(OC)ccc1OC	ZINC000163285780	523829442	/nfs/dbraw/zinc/82/94/42/523829442.db2.gz	ASLBYFRMGWWBBW-HUUCEWRRSA-N	0	3	322.449	2.465	10	0		DEAEHN
COCCOc1ccccc1C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000158856202	524058082	/nfs/dbraw/zinc/05/80/82/524058082.db2.gz	ZUUKDZLHFIZVEF-ZBFHGGJFSA-N	0	3	320.433	2.170	10	0		DEAEHN
C[C@H]1CN([C@@H](CNCC2=CCCOC2)c2cccs2)CCO1	ZINC000127121626	524663510	/nfs/dbraw/zinc/66/35/10/524663510.db2.gz	JFYNOZHSMFBJKC-HOCLYGCPSA-N	0	3	322.474	2.446	10	0		DEAEHN
COc1ccccc1OCCN1CCC[C@H](n2cncn2)C1	ZINC000105899043	524673894	/nfs/dbraw/zinc/67/38/94/524673894.db2.gz	LRZHUHODDDMFKL-AWEZNQCLSA-N	0	3	302.378	2.003	10	0		DEAEHN
C[C@@H]1C[C@@H]1NC(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000111599429	525321306	/nfs/dbraw/zinc/32/13/06/525321306.db2.gz	OSMNNRZUMINHGL-WBVHZDCISA-N	0	3	301.434	2.113	10	0		DEAEHN
CO[C@H](C)c1nc(CN2CCNC[C@H]2c2cccnc2)cs1	ZINC000261868312	536508016	/nfs/dbraw/zinc/50/80/16/536508016.db2.gz	XBDLHQMQAKXSRD-DOMZBBRYSA-N	0	3	318.446	2.392	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cnn([C@@H](C)C3CC3)c2)C1	ZINC000189654699	529090505	/nfs/dbraw/zinc/09/05/05/529090505.db2.gz	WJQMRUUFMVHCKI-JSGCOSHPSA-N	0	3	305.426	2.460	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)c1cnc(C2CC2)nc1	ZINC000294973604	529273461	/nfs/dbraw/zinc/27/34/61/529273461.db2.gz	QVYYNJHNJOJRGO-OAHLLOKOSA-N	0	3	302.422	2.348	10	0		DEAEHN
CC(C)Oc1ccccc1CN1CCN(C[C@H](C)O)[C@@H](C)C1	ZINC000247805657	535061465	/nfs/dbraw/zinc/06/14/65/535061465.db2.gz	SODHEOOYKMBNFD-HOTGVXAUSA-N	0	3	306.450	2.361	10	0		DEAEHN
CC1(C)[C@H](N[C@@H]2CCS(=O)(=O)c3ccccc32)[C@H]2CCO[C@H]21	ZINC000248571604	535078184	/nfs/dbraw/zinc/07/81/84/535078184.db2.gz	RGEASEOVDYMELY-RRCSTGOVSA-N	0	3	321.442	2.308	10	0		DEAEHN
CC(C)OC(=O)[C@H](C)NC(=O)c1cccc(CN2CCCC2)c1	ZINC000456639642	535313589	/nfs/dbraw/zinc/31/35/89/535313589.db2.gz	SNCPNWMNIFWPAU-AWEZNQCLSA-N	0	3	318.417	2.352	10	0		DEAEHN
CCO[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCCN(CC)C2)C12CCC2	ZINC000248043617	535452542	/nfs/dbraw/zinc/45/25/42/535452542.db2.gz	ULBGJKLRDCPLHG-OWCLPIDISA-N	0	3	323.481	2.460	10	0		DEAEHN
CCOc1cccnc1C(=O)NC[C@@H](C)N1CCC[C@@H](C)C1	ZINC000248345517	535555087	/nfs/dbraw/zinc/55/50/87/535555087.db2.gz	MWGFPUMCLNQNQY-ZIAGYGMSSA-N	0	3	305.422	2.331	10	0		DEAEHN
CCOc1cccnc1C(=O)NC[C@H](C)N1CCC[C@@H](C)C1	ZINC000248345516	535555195	/nfs/dbraw/zinc/55/51/95/535555195.db2.gz	MWGFPUMCLNQNQY-KGLIPLIRSA-N	0	3	305.422	2.331	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(OC)ccc1OC	ZINC000246906848	535875723	/nfs/dbraw/zinc/87/57/23/535875723.db2.gz	HZVYPYZVDJMFKQ-KGLIPLIRSA-N	0	3	318.417	2.403	10	0		DEAEHN
CCc1cccc(OCCN2C[C@@H](C)[C@@H](N3CCOCC3)C2)c1	ZINC000246496359	535907487	/nfs/dbraw/zinc/90/74/87/535907487.db2.gz	PRAOYZKDVNPJOH-APWZRJJASA-N	0	3	318.461	2.280	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(OC)cc1OC	ZINC000246894755	536168016	/nfs/dbraw/zinc/16/80/16/536168016.db2.gz	HBAMQGQWYCNSKI-KBPBESRZSA-N	0	3	318.417	2.403	10	0		DEAEHN
CN(Cc1ccccc1F)C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C	ZINC000261919709	536482851	/nfs/dbraw/zinc/48/28/51/536482851.db2.gz	RKQSDTUHEQFUCK-JCKWVBRZSA-N	0	3	320.408	2.317	10	0		DEAEHN
COC(=O)c1ccc(F)c(NC(=O)[C@H]2NCCCC2(C)C)c1	ZINC000262394547	536718778	/nfs/dbraw/zinc/71/87/78/536718778.db2.gz	BQYKORXXGSNFGZ-CYBMUJFWSA-N	0	3	308.353	2.329	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2ccc(N3CCC(C)CC3)cc2)C1	ZINC000187891764	536742025	/nfs/dbraw/zinc/74/20/25/536742025.db2.gz	GRPAMPPAQUKFQB-DLBZAZTESA-N	0	3	317.433	2.238	10	0		DEAEHN
COc1ccccc1N1CC[C@H](NC(=O)C2(N)CCCCC2)C1	ZINC000262677062	537074845	/nfs/dbraw/zinc/07/48/45/537074845.db2.gz	SZCZIMGCVYMTDV-AWEZNQCLSA-N	0	3	317.433	2.052	10	0		DEAEHN
F[C@@H]1CC2(CC[C@H]1N1CCC(c3cc[nH]n3)CC1)OCCO2	ZINC000891891047	624647176	/nfs/dbraw/zinc/64/71/76/624647176.db2.gz	KXKSXUAHCDABHW-UKRRQHHQSA-N	0	3	309.385	2.223	10	0		DEAEHN
COCC[C@@H](N)C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000052792489	625104852	/nfs/dbraw/zinc/10/48/52/625104852.db2.gz	NYTNZRUVJSKOOH-JOYOIKCWSA-N	0	3	304.312	2.246	10	0		DEAEHN
COCCCN(CCOC)C[C@H](O)c1ccccc1Cl	ZINC000054365850	625854474	/nfs/dbraw/zinc/85/44/74/625854474.db2.gz	CWMLHGYJOURSHI-HNNXBMFYSA-N	0	3	301.814	2.358	10	0		DEAEHN
Brc1ccoc1CNCCCCN1CCOCC1	ZINC000735320774	633502104	/nfs/dbraw/zinc/50/21/04/633502104.db2.gz	MJRMYIJFNRUOHJ-UHFFFAOYSA-N	0	3	317.227	2.244	10	0		DEAEHN
CN(Cc1ccsc1)C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C	ZINC000228894781	636839422	/nfs/dbraw/zinc/83/94/22/636839422.db2.gz	ZSIHJDINZZTBLY-HEHGZKQESA-N	0	3	308.447	2.239	10	0		DEAEHN
C[C@]1(CNC(=O)c2cnsn2)CCCN1Cc1ccccc1	ZINC000163399410	640314686	/nfs/dbraw/zinc/31/46/86/640314686.db2.gz	LEWWKYNQFZRQND-MRXNPFEDSA-N	0	3	316.430	2.323	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NC[C@@H](O)c1ccc(CC)cc1	ZINC000804156946	645733275	/nfs/dbraw/zinc/73/32/75/645733275.db2.gz	XPSPLCUOCBNLAH-DLBZAZTESA-N	0	3	304.434	2.273	10	0		DEAEHN
COc1ccc(CNC/C=C/CNC(=O)OC(C)(C)C)cn1	ZINC000227756724	646606558	/nfs/dbraw/zinc/60/65/58/646606558.db2.gz	GEOSBZHAHPOHLA-AATRIKPKSA-N	0	3	307.394	2.261	10	0		DEAEHN
Cn1cc(CC(=O)O[C@H]2CCCN(Cc3ccccc3)C2)cn1	ZINC000183174744	649044328	/nfs/dbraw/zinc/04/43/28/649044328.db2.gz	OJPAWAUUPJIVFA-KRWDZBQOSA-N	0	3	313.401	2.170	10	0		DEAEHN
C=CC[C@@H](CO)[NH2+]Cc1cc(Br)cc(OC)c1[O-]	ZINC000184273210	649253070	/nfs/dbraw/zinc/25/30/70/649253070.db2.gz	VZXLSTAXGFXYGL-NSHDSACASA-N	0	3	316.195	2.190	10	0		DEAEHN
COc1cc(Cl)cc(C[N@@H+]2C[C@@H](C(N)=O)CC[C@@H]2C)c1[O-]	ZINC000184680364	649344740	/nfs/dbraw/zinc/34/47/40/649344740.db2.gz	QLPIIUXKAMHEER-UWVGGRQHSA-N	0	3	312.797	2.140	10	0		DEAEHN
COc1cc(Cl)cc(C[N@H+]2C[C@@H](C(N)=O)CC[C@@H]2C)c1[O-]	ZINC000184680364	649344744	/nfs/dbraw/zinc/34/47/44/649344744.db2.gz	QLPIIUXKAMHEER-UWVGGRQHSA-N	0	3	312.797	2.140	10	0		DEAEHN
N#Cc1sc(NC[C@H]2NCCc3ccccc32)nc1Cl	ZINC000380315430	685396471	/nfs/dbraw/zinc/39/64/71/685396471.db2.gz	JAQJLFFLRLBXHU-LLVKDONJSA-N	0	3	304.806	2.389	10	0		DEAEHN
CCOCCCNC(=S)N[C@@H](C)CN(C)Cc1ccccc1	ZINC000381049361	685399093	/nfs/dbraw/zinc/39/90/93/685399093.db2.gz	GRIIJZJEXQHQKJ-HNNXBMFYSA-N	0	3	323.506	2.398	10	0		DEAEHN
CN(CCNCc1nc(Br)c[nH]1)Cc1ccccc1	ZINC000386728541	685419078	/nfs/dbraw/zinc/41/90/78/685419078.db2.gz	ARKOQCAZGIITSW-UHFFFAOYSA-N	0	3	323.238	2.394	10	0		DEAEHN
CCOC(=O)C1CCC(O)(CN(C)Cc2c(C)noc2C)CC1	ZINC000190813069	684414973	/nfs/dbraw/zinc/41/49/73/684414973.db2.gz	RBYCZJUDKIQXFO-UHFFFAOYSA-N	0	3	324.421	2.208	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)C[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000246285309	685127311	/nfs/dbraw/zinc/12/73/11/685127311.db2.gz	BWURVULUHSCUPK-HUUCEWRRSA-N	0	3	310.825	2.364	10	0		DEAEHN
C[C@H](N[C@H]1C[C@@H](O)[C@@H]1n1cccn1)c1ccc(-n2ccnc2)cc1	ZINC000886096746	692002856	/nfs/dbraw/zinc/00/28/56/692002856.db2.gz	CDJOSIQDHGWRBG-VIBAHUMZSA-N	0	3	323.400	2.094	10	0		DEAEHN
C[C@@H](N[C@H]1C[C@@H](O)[C@@H]1n1cccn1)c1ccc(-n2ccnc2)cc1	ZINC000886096745	692002919	/nfs/dbraw/zinc/00/29/19/692002919.db2.gz	CDJOSIQDHGWRBG-BVPBIZIASA-N	0	3	323.400	2.094	10	0		DEAEHN
CO[C@]1(C)CCCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724110695	777242658	/nfs/dbraw/zinc/24/26/58/777242658.db2.gz	ISVMYDBXWSGPSO-NXEZZACHSA-N	0	3	305.287	2.436	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@H]1CN[C@@H]1CCCc2n[nH]cc21	ZINC000724915360	777520039	/nfs/dbraw/zinc/52/00/39/777520039.db2.gz	SUSCHUFEVRNYKP-WCQYABFASA-N	0	3	306.410	2.386	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCn2c(C(C)C)nnc2[C@H]1C	ZINC000439781424	781809402	/nfs/dbraw/zinc/80/94/02/781809402.db2.gz	MEWPNUKONKBJAR-KGLIPLIRSA-N	0	3	319.453	2.179	10	0		DEAEHN
CS(=O)(=O)[C@H]1C[C@H](NCc2ccc(Br)s2)C1	ZINC000714243610	792304500	/nfs/dbraw/zinc/30/45/00/792304500.db2.gz	BSUCHDMBIWGOMJ-XWEPSHTISA-N	0	3	324.265	2.176	10	0		DEAEHN
COc1ccc(CN[C@H]2C[C@H](S(C)(=O)=O)C2)cc1Cl	ZINC000714250596	792305876	/nfs/dbraw/zinc/30/58/76/792305876.db2.gz	PTSZCXHSRATIMF-XYPYZODXSA-N	0	3	303.811	2.014	10	0		DEAEHN
c1cn(-c2ccccc2)nc1CNCCCOC[C@@H]1CCOC1	ZINC000091060972	801486546	/nfs/dbraw/zinc/48/65/46/801486546.db2.gz	FXBGWBRKXBEDOR-INIZCTEOSA-N	0	3	315.417	2.405	10	0		DEAEHN
CN1CCC[C@H]2[C@@H]1CCN2C(=O)c1ccncc1Br	ZINC000720831074	1086193579	/nfs/dbraw/zinc/19/35/79/1086193579.db2.gz	SBQWAQIFNXHVIA-STQMWFEESA-N	0	3	324.222	2.153	10	0		DEAEHN
COC1(OC)CC[C@@H]1NC[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000710906659	1086690313	/nfs/dbraw/zinc/69/03/13/1086690313.db2.gz	PQRJQHOGMKGKIB-OLZOCXBDSA-N	0	3	314.426	2.127	10	0		DEAEHN
CO[C@]1(CNCc2ccc(Br)cn2)CCSC1	ZINC000719316265	1088934740	/nfs/dbraw/zinc/93/47/40/1088934740.db2.gz	MWMQMSGDHQMWSK-LBPRGKRZSA-N	0	3	317.252	2.456	10	0		DEAEHN
C[C@H]1[C@@H](NC(=O)c2cc(Br)ccc2F)CCN1C	ZINC000719388443	1089070860	/nfs/dbraw/zinc/07/08/60/1089070860.db2.gz	QGTQGMDXEAHDMH-UFBFGSQYSA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@H]1[C@@H](NC(=O)c2ccc(F)c(Br)c2)CCN1C	ZINC000719384331	1089077981	/nfs/dbraw/zinc/07/79/81/1089077981.db2.gz	CUCAITFCPATXBO-UFBFGSQYSA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@H]1[C@@H](NC(=O)c2cc(Cl)c(N)c(Cl)c2)CCN1C	ZINC000719391752	1089081525	/nfs/dbraw/zinc/08/15/25/1089081525.db2.gz	IRFRERKUNJPENT-CPCISQLKSA-N	0	3	302.205	2.398	10	0		DEAEHN
CCN[C@H](CSCCS(C)(=O)=O)c1ccc(C)cc1	ZINC000081769100	192322386	/nfs/dbraw/zinc/32/23/86/192322386.db2.gz	WGJJWCGHUQCTAZ-CQSZACIVSA-N	0	3	301.477	2.423	10	0		DEAEHN
CN[C@H]1c2ccc(OC)cc2CC[C@H]1Sc1nncn1C	ZINC000081867079	192332946	/nfs/dbraw/zinc/33/29/46/192332946.db2.gz	LGPYSURRWQUSSQ-KGLIPLIRSA-N	0	3	304.419	2.191	10	0		DEAEHN
CCN[C@H]1c2ccccc2OC[C@H]1Sc1nnc(C)n1C	ZINC000081897297	192335674	/nfs/dbraw/zinc/33/56/74/192335674.db2.gz	KQLGVTNEXYQEQY-KGLIPLIRSA-N	0	3	304.419	2.327	10	0		DEAEHN
CN[C@H]1CCC[C@@H]1S(=O)(=O)c1ccccc1Br	ZINC000081931554	192341958	/nfs/dbraw/zinc/34/19/58/192341958.db2.gz	FDYRBQVYDURPOR-JQWIXIFHSA-N	0	3	318.236	2.363	10	0		DEAEHN
CCCN[C@@H](c1ccc(C)cc1)[C@@H](C)S(=O)(=O)CCOC	ZINC000081945007	192345578	/nfs/dbraw/zinc/34/55/78/192345578.db2.gz	PQFPZAQXYZUZSW-GDBMZVCRSA-N	0	3	313.463	2.485	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NC[C@H]2CCCc3ccccc32)C1	ZINC000170830489	282180575	/nfs/dbraw/zinc/18/05/75/282180575.db2.gz	GXQYAYUWIMKBLG-CVEARBPZSA-N	0	3	301.434	2.452	10	0		DEAEHN
O=c1cc2c(nn1Cc1cc(Cl)ccc1Cl)CCNC2	ZINC000087755668	185231406	/nfs/dbraw/zinc/23/14/06/185231406.db2.gz	IECUERRTUXKLPI-UHFFFAOYSA-N	0	3	310.184	2.244	10	0		DEAEHN
O=S1(=O)CC[C@@H](N[C@H]2CCCc3c4ccccc4[nH]c32)C1	ZINC000087816048	185232663	/nfs/dbraw/zinc/23/26/63/185232663.db2.gz	TXTBAHVOFPRVIL-ABAIWWIYSA-N	0	3	304.415	2.322	10	0		DEAEHN
CC[C@@]1(CO)CCCN(Cc2ccccc2C(=O)N(C)C)C1	ZINC000417983671	529553266	/nfs/dbraw/zinc/55/32/66/529553266.db2.gz	CJKGBKMBPKCNMX-GOSISDBHSA-N	0	3	304.434	2.373	10	0		DEAEHN
COc1ccc(Br)c(-n2nnc([C@@H](C)N)c2C)c1	ZINC000088321094	185245381	/nfs/dbraw/zinc/24/53/81/185245381.db2.gz	FVDYSJYVZLWALD-SSDOTTSWSA-N	0	3	311.183	2.367	10	0		DEAEHN
CN[C@@H]1CCCN(c2ccc(OC)c(Br)c2)C1=O	ZINC000088330728	185245951	/nfs/dbraw/zinc/24/59/51/185245951.db2.gz	VRTQEEZAPCLQHR-LLVKDONJSA-N	0	3	313.195	2.173	10	0		DEAEHN
CC[C@H](CN)S(=O)(=O)Nc1ccc(C)c(C(F)(F)F)c1	ZINC000088473400	185252279	/nfs/dbraw/zinc/25/22/79/185252279.db2.gz	MFYTXYASTRSPBY-SNVBAGLBSA-N	0	3	310.341	2.493	10	0		DEAEHN
C[C@@H](N)c1cccc(S(=O)(=O)N(C)CCC(F)(F)F)c1	ZINC000088432907	185249632	/nfs/dbraw/zinc/24/96/32/185249632.db2.gz	YQBRUDTTZKGQFD-SECBINFHSA-N	0	3	310.341	2.279	10	0		DEAEHN
CCOC(=O)[C@](C)(N)C[C@H](C)N1CCC(C(F)(F)F)CC1	ZINC000088435423	185250548	/nfs/dbraw/zinc/25/05/48/185250548.db2.gz	PZGGVLMNQIUUBC-GXFFZTMASA-N	0	3	310.360	2.320	10	0		DEAEHN
C[N-]S(=O)(=O)c1ccc(C[NH2+][C@@H]2CC[C@H](C)[C@@H](C)C2)o1	ZINC000088540916	185255979	/nfs/dbraw/zinc/25/59/79/185255979.db2.gz	WKOBFRNXWVLSIQ-SDDRHHMPSA-N	0	3	300.424	2.102	10	0		DEAEHN
COCCCS(=O)(=O)[C@@H]1C[C@@H](c2ccccc2)CC[C@@H]1N	ZINC000081986035	192349178	/nfs/dbraw/zinc/34/91/78/192349178.db2.gz	DLTQWHAUQSTCQN-HRCADAONSA-N	0	3	311.447	2.101	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N[C@H](C)CCC(C)C)o1	ZINC000088551095	185257693	/nfs/dbraw/zinc/25/76/93/185257693.db2.gz	UUUHIGUPMRKYRP-GFCCVEGCSA-N	0	3	302.440	2.492	10	0		DEAEHN
CC(C)[C@H]1CCCN1CC(=O)Nc1ccc(C(N)=S)cc1	ZINC000088837012	185266774	/nfs/dbraw/zinc/26/67/74/185266774.db2.gz	LNPRINWJEXWSJE-CQSZACIVSA-N	0	3	305.447	2.380	10	0		DEAEHN
CC(C)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)c(CN)c1	ZINC000088836767	185266900	/nfs/dbraw/zinc/26/69/00/185266900.db2.gz	DEAODQJHHJCSMO-AWEZNQCLSA-N	0	3	300.399	2.094	10	0		DEAEHN
CC(C)[C@@H]1CCCN1CC(=O)Nc1ccccc1C(N)=S	ZINC000088836965	185266932	/nfs/dbraw/zinc/26/69/32/185266932.db2.gz	XHOPBKGEULXBPC-AWEZNQCLSA-N	0	3	305.447	2.380	10	0		DEAEHN
CC(C)[C@H]1CCCN1S(=O)(=O)c1cccc2c1CCNC2	ZINC000088845425	185266940	/nfs/dbraw/zinc/26/69/40/185266940.db2.gz	IVNDBXCVIZULKA-OAHLLOKOSA-N	0	3	308.447	2.141	10	0		DEAEHN
N[C@H]1CCCC[C@H]1S(=O)(=O)c1cccc(Br)c1	ZINC000081982813	192349267	/nfs/dbraw/zinc/34/92/67/192349267.db2.gz	VZGDCABSKIKGPB-NWDGAFQWSA-N	0	3	318.236	2.493	10	0		DEAEHN
NCc1ccccc1S(=O)(=O)Nc1c(F)cc(F)cc1F	ZINC000088721043	185263324	/nfs/dbraw/zinc/26/33/24/185263324.db2.gz	BSHUXFRYSWNIBC-UHFFFAOYSA-N	0	3	316.304	2.363	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@@H](C)C(=O)N1CCCCCC1	ZINC000178315086	282217630	/nfs/dbraw/zinc/21/76/30/282217630.db2.gz	CAPPZVAAAJRPTF-DOTOQJQBSA-N	0	3	318.465	2.447	10	0		DEAEHN
CCn1c([C@H]2COCCO2)nnc1N1CCC[C@@H]1CC(C)C	ZINC000329541755	231555438	/nfs/dbraw/zinc/55/54/38/231555438.db2.gz	DOEKUUKBSVRMSB-ZIAGYGMSSA-N	0	3	308.426	2.401	10	0		DEAEHN
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)[C@@]1(C)COC[C@@H]1N	ZINC000090590488	185305436	/nfs/dbraw/zinc/30/54/36/185305436.db2.gz	RGRYJIDMDZOHIN-JSGCOSHPSA-N	0	3	317.216	2.316	10	0		DEAEHN
C[C@@]1(c2nc(Cc3c(F)cccc3Cl)no2)COC[C@H]1N	ZINC000090573785	185304472	/nfs/dbraw/zinc/30/44/72/185304472.db2.gz	YVBGWNFJFVYUKN-BXUZGUMPSA-N	0	3	311.744	2.068	10	0		DEAEHN
Cc1cc(CN[C@@H]2CCCS(=O)(=O)C2)c2ccccc2n1	ZINC000092345772	185313472	/nfs/dbraw/zinc/31/34/72/185313472.db2.gz	LATINMHBPUBFKT-CQSZACIVSA-N	0	3	304.415	2.210	10	0		DEAEHN
COCCNCC(=O)N[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000092495563	185322305	/nfs/dbraw/zinc/32/23/05/185322305.db2.gz	BLWKMPAMHLHXLH-JTQLQIEISA-N	0	3	304.312	2.119	10	0		DEAEHN
COCCOc1cccc(CN2CCN3CCCC[C@@H]3C2)c1	ZINC000092616018	185328924	/nfs/dbraw/zinc/32/89/24/185328924.db2.gz	FROIIDCMIVYCDM-QGZVFWFLSA-N	0	3	304.434	2.382	10	0		DEAEHN
CC1(C)C(C[N-]S(=O)(=O)c2ccc(C[NH3+])cc2F)C1(C)C	ZINC000092833166	185344895	/nfs/dbraw/zinc/34/48/95/185344895.db2.gz	JTWAMICLSQFQIN-UHFFFAOYSA-N	0	3	314.426	2.245	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N)[C@@H](Sc1nnc(N(C)C)s1)C2	ZINC000092860050	185347024	/nfs/dbraw/zinc/34/70/24/185347024.db2.gz	MRWOGIHTEYCPJI-RYUDHWBXSA-N	0	3	322.459	2.330	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1[C@H](NC2CC(C(C)C)C2)CC(=O)N1C	ZINC000330201574	282266354	/nfs/dbraw/zinc/26/63/54/282266354.db2.gz	XZGXSVOPZRQCCH-PPPKJHQXSA-N	0	3	318.465	2.333	10	0		DEAEHN
C[NH+](C)[C@H]1CC[C@H](NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)C1	ZINC000093994641	282271038	/nfs/dbraw/zinc/27/10/38/282271038.db2.gz	SOYYJLILDMNPQR-STQMWFEESA-N	0	3	318.417	2.318	10	0		DEAEHN
CCc1nc(CNC(=O)N(C)CC2(N(C)C)CCC2)cs1	ZINC000189835593	529737980	/nfs/dbraw/zinc/73/79/80/529737980.db2.gz	QWEVUYRVFACSES-UHFFFAOYSA-N	0	3	310.467	2.331	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)Cc1ccc(Cl)cc1	ZINC000036076821	539333708	/nfs/dbraw/zinc/33/37/08/539333708.db2.gz	ZDUNZVDFDUJOTM-GFCCVEGCSA-N	0	3	318.870	2.490	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1c(F)ccc(OC)c1OC	ZINC000188537961	282304336	/nfs/dbraw/zinc/30/43/36/282304336.db2.gz	VSXFJWAEBIGEMU-LBPRGKRZSA-N	0	3	324.396	2.399	10	0		DEAEHN
C[C@@H]1C[C@@H](NCc2cc(C(N)=O)co2)CN1Cc1ccccc1	ZINC000189411340	282309359	/nfs/dbraw/zinc/30/93/59/282309359.db2.gz	MPEBUXJYLNVPRL-CZUORRHYSA-N	0	3	313.401	2.131	10	0		DEAEHN
COC[C@H](O)CN[C@@H](C)c1ccc(Br)cc1OC	ZINC000190435121	282320474	/nfs/dbraw/zinc/32/04/74/282320474.db2.gz	QNVZBYMRZGXJKE-GXSJLCMTSA-N	0	3	318.211	2.116	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCC1(c2ccc(F)cc2)CC1	ZINC000195130338	282369400	/nfs/dbraw/zinc/36/94/00/282369400.db2.gz	XLIVCRDQJYTPPP-HNNXBMFYSA-N	0	3	305.397	2.251	10	0		DEAEHN
CNC(=O)NC(=O)CCN1CC[C@H](C)[C@@H]1c1cccc(F)c1	ZINC000245407713	282385300	/nfs/dbraw/zinc/38/53/00/282385300.db2.gz	CMILKCKWHBIZKQ-XHDPSFHLSA-N	0	3	307.369	2.054	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H]2CCO[C@@H]2c2ccccc2)C1	ZINC000245477811	282391280	/nfs/dbraw/zinc/39/12/80/282391280.db2.gz	URPSINBXLBNYPQ-YESZJQIVSA-N	0	3	317.433	2.300	10	0		DEAEHN
CCOc1ncccc1CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000245585405	282398794	/nfs/dbraw/zinc/39/87/94/282398794.db2.gz	AGNWKLBWFRILHJ-ZFWWWQNUSA-N	0	3	320.437	2.104	10	0		DEAEHN
CC[C@@H](NCCCNC(=O)c1cccs1)c1nccn1C	ZINC000183264494	199564997	/nfs/dbraw/zinc/56/49/97/199564997.db2.gz	MGHCAKUHBPUOMT-GFCCVEGCSA-N	0	3	306.435	2.342	10	0		DEAEHN
CC(C)(C)n1cc(CN2CCN([C@@H]3CCCC[C@H]3O)CC2)cn1	ZINC000153554858	539545032	/nfs/dbraw/zinc/54/50/32/539545032.db2.gz	CVGNLZXXLPXDGU-IAGOWNOFSA-N	0	3	320.481	2.059	10	0		DEAEHN
C[C@H]1CN(CC2CC[NH+](CCCCC(=O)[O-])CC2)C[C@H](C)O1	ZINC000262261563	290839232	/nfs/dbraw/zinc/83/92/32/290839232.db2.gz	REFKKOXEUMIGTQ-GJZGRUSLSA-N	0	3	312.454	2.063	10	0		DEAEHN
CC[C@](C)(O)CNCc1ccc(I)o1	ZINC000083463157	192371417	/nfs/dbraw/zinc/37/14/17/192371417.db2.gz	JSIJXIINRODEOA-JTQLQIEISA-N	0	3	309.147	2.135	10	0		DEAEHN
Cc1cc(-c2nnc(CN(C)CCN3CCCC3)o2)c(C)o1	ZINC000162499599	539596892	/nfs/dbraw/zinc/59/68/92/539596892.db2.gz	UNFYCONEQTUIFO-UHFFFAOYSA-N	0	3	304.394	2.474	10	0		DEAEHN
CCOC(=O)CCCNCC(=O)N[C@@H](C)CCCC(C)C	ZINC000070272476	190876672	/nfs/dbraw/zinc/87/66/72/190876672.db2.gz	YNQUXCADHUHWLH-AWEZNQCLSA-N	0	3	300.443	2.250	10	0		DEAEHN
COCCN1C(=O)CC[C@H](N)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000070292898	190877671	/nfs/dbraw/zinc/87/76/71/190877671.db2.gz	BJSAXLMVUNRMGW-JSGCOSHPSA-N	0	3	300.761	2.116	10	0		DEAEHN
NC[C@H]1OCCN(C2CC2)[C@@H]1c1ccc(Br)s1	ZINC000070289088	190877800	/nfs/dbraw/zinc/87/78/00/190877800.db2.gz	QXAQEPDHSUJTQR-SKDRFNHKSA-N	0	3	317.252	2.374	10	0		DEAEHN
NC(=O)c1cccc([C@H]2COCCN(Cc3ccccc3)C2)c1	ZINC000616664246	362906422	/nfs/dbraw/zinc/90/64/22/362906422.db2.gz	YHMILYPEGYQCKQ-GOSISDBHSA-N	0	3	310.397	2.402	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)NC[C@H]2CCN(C3CC3)C2)s1	ZINC000176103020	539626347	/nfs/dbraw/zinc/62/63/47/539626347.db2.gz	SMKLHNXTUYDEFL-VXGBXAGGSA-N	0	3	323.462	2.373	10	0		DEAEHN
COc1ccc(OC)c([C@@H](C)NC[C@H](C)CS(C)(=O)=O)c1	ZINC000176954662	539628848	/nfs/dbraw/zinc/62/88/48/539628848.db2.gz	JOXUSZXQEKICCJ-NWDGAFQWSA-N	0	3	315.435	2.035	10	0		DEAEHN
Cc1ccc(CN(C(=O)CN[C@H](C)[C@H]2CCCO2)C2CC2)o1	ZINC000183124859	539659389	/nfs/dbraw/zinc/65/93/89/539659389.db2.gz	QTIRVYKXURMFFM-CZUORRHYSA-N	0	3	306.406	2.236	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)[C@H](C)N[C@@H](C)[C@H]2CCCO2)cc1	ZINC000183224027	539660214	/nfs/dbraw/zinc/66/02/14/539660214.db2.gz	BHWHWLNAAIVXTN-MQIPJXDCSA-N	0	3	304.390	2.373	10	0		DEAEHN
CN[C@H]1CCCN(c2cc(Br)ccc2OC)C1=O	ZINC000071034640	190930965	/nfs/dbraw/zinc/93/09/65/190930965.db2.gz	PKQCDPNPRZNJOP-JTQLQIEISA-N	0	3	313.195	2.173	10	0		DEAEHN
COc1cc(CN2CCC[C@@H]2Cn2ccnc2)cc2c1OCO2	ZINC000188415146	539682527	/nfs/dbraw/zinc/68/25/27/539682527.db2.gz	IRMPPCCTXDCQMQ-CQSZACIVSA-N	0	3	315.373	2.285	10	0		DEAEHN
C[C@H](O)CN1Cc2ccc(OCc3ccccc3)cc2[C@@H]1CN	ZINC000071684832	191008528	/nfs/dbraw/zinc/00/85/28/191008528.db2.gz	NNAJFTIZVZKGCL-LIRRHRJNSA-N	0	3	312.413	2.462	10	0		DEAEHN
COC(=O)c1ccc(Cl)c(N[C@@H](C)C[C@@H]2COCCN2)c1	ZINC000133649430	186003392	/nfs/dbraw/zinc/00/33/92/186003392.db2.gz	VJAOOIUTBKBXSB-CMPLNLGQSA-N	0	3	312.797	2.306	10	0		DEAEHN
C[C@@H]1CCCCCN1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000139105603	186019977	/nfs/dbraw/zinc/01/99/77/186019977.db2.gz	VSYGERVCLRUFEN-SNVBAGLBSA-N	0	3	318.389	2.377	10	0		DEAEHN
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2cc(CN)cc(F)c2F)C1	ZINC000138347445	186016337	/nfs/dbraw/zinc/01/63/37/186016337.db2.gz	IDWBTLVMYLFOHV-UWVGGRQHSA-N	0	3	318.389	2.090	10	0		DEAEHN
CCNCc1cc(F)c(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000138352754	186016663	/nfs/dbraw/zinc/01/66/63/186016663.db2.gz	QDCKZSXFYCGKME-UHFFFAOYSA-N	0	3	318.389	2.249	10	0		DEAEHN
CC[C@H]1CCCN(S(=O)(=O)c2cc(CN)cc(F)c2F)C1	ZINC000138535984	186017623	/nfs/dbraw/zinc/01/76/23/186017623.db2.gz	PSCOZFQCPLMAHR-JTQLQIEISA-N	0	3	318.389	2.234	10	0		DEAEHN
CN(CC(C)(C)C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138874369	186019171	/nfs/dbraw/zinc/01/91/71/186019171.db2.gz	IACVLMJHYWZAFX-UHFFFAOYSA-N	0	3	306.378	2.090	10	0		DEAEHN
CC[C@@H]1CC[C@H](C)N1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000139277793	186020885	/nfs/dbraw/zinc/02/08/85/186020885.db2.gz	LQEOBSLNRPHZJV-GXSJLCMTSA-N	0	3	318.389	2.375	10	0		DEAEHN
CCC[C@H]1N[C@@H](c2ccsc2)N(C2CCN(C)CC2)C1=O	ZINC000141186277	186029017	/nfs/dbraw/zinc/02/90/17/186029017.db2.gz	OAFJHUQGLUQZHS-HUUCEWRRSA-N	0	3	307.463	2.441	10	0		DEAEHN
CC[C@H]1N[C@@H](c2ccc(C)s2)N(C2CCN(C)CC2)C1=O	ZINC000141225691	186029293	/nfs/dbraw/zinc/02/92/93/186029293.db2.gz	KKJKQLZNIJYCJU-UKRRQHHQSA-N	0	3	307.463	2.360	10	0		DEAEHN
CCOC(=O)c1c(NC(=O)C2(N)CCC2)sc2c1CCC2	ZINC000148131866	186043348	/nfs/dbraw/zinc/04/33/48/186043348.db2.gz	WYZBPIOZOANSNL-UHFFFAOYSA-N	0	3	308.403	2.233	10	0		DEAEHN
CCN1CCC[C@@H](N2C(=O)C3(CC3)N[C@H]2c2ccsc2)C1	ZINC000144278903	186035141	/nfs/dbraw/zinc/03/51/41/186035141.db2.gz	XVCDTNKMYQAZSX-ZIAGYGMSSA-N	0	3	305.447	2.195	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2ccsc2)N([C@@H]2CCN(C3CC3)C2)C1=O	ZINC000144696657	186035527	/nfs/dbraw/zinc/03/55/27/186035527.db2.gz	DRGDTOSTSCNDPX-QLFBSQMISA-N	0	3	305.447	2.194	10	0		DEAEHN
C[C@H](c1ccccc1Cl)N(C)c1nc(N)nc(N(C)C)n1	ZINC000149582120	186050896	/nfs/dbraw/zinc/05/08/96/186050896.db2.gz	LVZZBOWUSQTRTM-SECBINFHSA-N	0	3	306.801	2.371	10	0		DEAEHN
O=C([C@@H]1CCCO[C@H]1c1ccccc1)N1CCN2CCC[C@H]2C1	ZINC000249834830	539782421	/nfs/dbraw/zinc/78/24/21/539782421.db2.gz	QWXBTVVGJWCLCP-KSZLIROESA-N	0	3	314.429	2.461	10	0		DEAEHN
CCn1ncc(Br)c1[C@](C)(F)C[C@@H]1COCCN1	ZINC000164055811	186146903	/nfs/dbraw/zinc/14/69/03/186146903.db2.gz	SJWIZJQLLMYXHX-BXKDBHETSA-N	0	3	320.206	2.229	10	0		DEAEHN
C[C@H]1C[C@@H](Nc2ccccc2SCC(N)=O)CN1C1CC1	ZINC000164409847	186158379	/nfs/dbraw/zinc/15/83/79/186158379.db2.gz	BKFJPDJFWMLFJV-NWDGAFQWSA-N	0	3	305.447	2.301	10	0		DEAEHN
CC[C@@H](CNC(=O)NC[C@@H]1CCCN1C)Oc1ccccc1F	ZINC000175683777	186187824	/nfs/dbraw/zinc/18/78/24/186187824.db2.gz	OVKUJPPSTDJWAU-KBPBESRZSA-N	0	3	323.412	2.377	10	0		DEAEHN
COC(=O)CCCN[C@@H](CO)c1cccc(Br)c1	ZINC000183895223	186228432	/nfs/dbraw/zinc/22/84/32/186228432.db2.gz	KXSMVAJKUIBSHO-LBPRGKRZSA-N	0	3	316.195	2.025	10	0		DEAEHN
CNc1cnc(C[C@H]2COCCN(Cc3ccccc3)C2)cn1	ZINC000072388209	191146292	/nfs/dbraw/zinc/14/62/92/191146292.db2.gz	CWFBMAWINVEZMS-MRXNPFEDSA-N	0	3	312.417	2.209	10	0		DEAEHN
Cn1ccnc(N2CCC(NC/C=C/c3ccccc3)CC2)c1=O	ZINC000328629417	539909219	/nfs/dbraw/zinc/90/92/19/539909219.db2.gz	IEMULKUJWDZUFO-VMPITWQZSA-N	0	3	324.428	2.052	10	0		DEAEHN
C[C@H](NCC(=O)N[C@H]1CCCc2ccccc21)[C@H]1CCCO1	ZINC000332907453	539943733	/nfs/dbraw/zinc/94/37/33/539943733.db2.gz	XNFWWWRUXRDCAJ-RRQGHBQHSA-N	0	3	302.418	2.337	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000173512331	198222371	/nfs/dbraw/zinc/22/23/71/198222371.db2.gz	HDGTUBKBADDKNS-DOTOQJQBSA-N	0	3	317.433	2.081	10	0		DEAEHN
C[C@H](CCc1ccccc1F)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000173522572	198223976	/nfs/dbraw/zinc/22/39/76/198223976.db2.gz	LDTMNMKMXACDEL-GDBMZVCRSA-N	0	3	322.424	2.183	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCCN(C)c2ccccc2)CCN1C	ZINC000173598734	198231750	/nfs/dbraw/zinc/23/17/50/198231750.db2.gz	STADQYKOLOOYPE-DOTOQJQBSA-N	0	3	318.465	2.247	10	0		DEAEHN
COc1ccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1F	ZINC000174004222	198279141	/nfs/dbraw/zinc/27/91/41/198279141.db2.gz	IVLVLRWPPFJEIT-TZMCWYRMSA-N	0	3	323.412	2.458	10	0		DEAEHN
CC[C@H](O)CN1CCN(Cc2cccc(OC(C)C)c2)CC1	ZINC000174079486	198289067	/nfs/dbraw/zinc/28/90/67/198289067.db2.gz	GNIUTVHXERAOMP-KRWDZBQOSA-N	0	3	306.450	2.362	10	0		DEAEHN
CC[C@H](O)CN1CCN(Cc2ccc(OC(C)C)cc2)CC1	ZINC000174094120	198291247	/nfs/dbraw/zinc/29/12/47/198291247.db2.gz	SMBOQFOPVUIABR-KRWDZBQOSA-N	0	3	306.450	2.362	10	0		DEAEHN
CC[C@@H](O)CN1CCN(CCCOc2ccc(C)c(C)c2)CC1	ZINC000174094680	198291646	/nfs/dbraw/zinc/29/16/46/198291646.db2.gz	ZYRTXTUOHPAQTM-GOSISDBHSA-N	0	3	320.477	2.461	10	0		DEAEHN
C[C@H](CC(=O)N1CC[C@H](N(C)C)C1)C(=O)c1cccc(F)c1	ZINC000174584712	198355870	/nfs/dbraw/zinc/35/58/70/198355870.db2.gz	KJNVKYBEKMQTET-DOMZBBRYSA-N	0	3	306.381	2.197	10	0		DEAEHN
Cc1ccc2ncnc(NC[C@@H](O)CN3CCCCC3)c2c1	ZINC000174685105	198370592	/nfs/dbraw/zinc/37/05/92/198370592.db2.gz	CLTHWYHDKHHDTL-CQSZACIVSA-N	0	3	300.406	2.197	10	0		DEAEHN
C=C/C(C)=C/CC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000617703863	363227705	/nfs/dbraw/zinc/22/77/05/363227705.db2.gz	QEIXTKWTQGMQLL-FTTDQBRBSA-N	0	3	314.429	2.392	10	0		DEAEHN
COC(=O)C(C)(C)CNCc1cnc2c(cnn2C(C)C)c1	ZINC000182231575	199407388	/nfs/dbraw/zinc/40/73/88/199407388.db2.gz	XJEUTVTYZUDKST-UHFFFAOYSA-N	0	3	304.394	2.301	10	0		DEAEHN
O=C(C=CCN1CCCC1)C=C1C(=O)OC2(CCCC2)OC1=O	ZINC000048546633	354353642	/nfs/dbraw/zinc/35/36/42/354353642.db2.gz	VKLJKSZCCZVNQG-PDGPDOJCSA-N	0	3	319.357	2.335	10	0		DEAEHN
Cc1noc(C)c1Cn1ccc2ccn(CCN(C)C)c2c1=O	ZINC000065224791	354679922	/nfs/dbraw/zinc/67/99/22/354679922.db2.gz	VNINYUMZEQCMCL-UHFFFAOYSA-N	0	3	314.389	2.018	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCC(C)(C)C[C@@H](C)O	ZINC000073722211	191346980	/nfs/dbraw/zinc/34/69/80/191346980.db2.gz	ZSNABQNWBJRWEL-ZIAGYGMSSA-N	0	3	301.475	2.059	10	0		DEAEHN
C[C@H]1CN(c2ccc(CNCC3=CCCOC3)cn2)C[C@H](C)O1	ZINC000126504055	355817522	/nfs/dbraw/zinc/81/75/22/355817522.db2.gz	UZEYMDNXEDSIBF-GJZGRUSLSA-N	0	3	317.433	2.132	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCCCCOc1ccc(F)cc1	ZINC000139451191	355877342	/nfs/dbraw/zinc/87/73/42/355877342.db2.gz	RTDOGIKKYUNMTK-HNNXBMFYSA-N	0	3	323.412	2.378	10	0		DEAEHN
CC[C@H]1CN(Cc2cn(C)nc2C(C)(C)C)CCN1CCOC	ZINC000180087482	356042212	/nfs/dbraw/zinc/04/22/12/356042212.db2.gz	JACVPYKTNLJLIK-INIZCTEOSA-N	0	3	322.497	2.260	10	0		DEAEHN
COc1ccc([C@H](C)NC[C@H](C)CS(C)(=O)=O)cc1F	ZINC000182021096	356105258	/nfs/dbraw/zinc/10/52/58/356105258.db2.gz	NDUWKMRCGVBGIP-QWRGUYRKSA-N	0	3	303.399	2.166	10	0		DEAEHN
COCCN1CCN(CCCCC(=O)OC(C)(C)C)C[C@@H]1C	ZINC000181817839	356097547	/nfs/dbraw/zinc/09/75/47/356097547.db2.gz	NCPMREGZLVEABQ-HNNXBMFYSA-N	0	3	314.470	2.151	10	0		DEAEHN
CCS(=O)(=O)C[C@@H](C)NC[C@@H](C)c1ccc(F)cc1F	ZINC000183051776	356157641	/nfs/dbraw/zinc/15/76/41/356157641.db2.gz	UTRHDWZEZFNOGW-GHMZBOCLSA-N	0	3	305.390	2.481	10	0		DEAEHN
C[C@@H]1CCC[C@](N)(C(=O)Nc2cc(C(N)=O)ccc2Cl)C1	ZINC000080913778	192200278	/nfs/dbraw/zinc/20/02/78/192200278.db2.gz	SLNXIHLMQYOUNL-RFAUZJTJSA-N	0	3	309.797	2.285	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)N2CCO[C@@H](c3cccs3)C2)C1	ZINC000246010225	356311472	/nfs/dbraw/zinc/31/14/72/356311472.db2.gz	KUVZJVIOQCEEQM-ZIAGYGMSSA-N	0	3	323.462	2.173	10	0		DEAEHN
CN[C@H](C)C(=O)Nc1cc(I)ccc1C	ZINC000300984813	356391251	/nfs/dbraw/zinc/39/12/51/356391251.db2.gz	SXUYHDQUNDPIPP-MRVPVSSYSA-N	0	3	318.158	2.146	10	0		DEAEHN
C[C@H](C(=O)N(C)[C@@H](C)C(=O)OC(C)(C)C)N1CCCCCC1	ZINC000081450496	192269311	/nfs/dbraw/zinc/26/93/11/192269311.db2.gz	RNWOBPCDMMGDSM-KGLIPLIRSA-N	0	3	312.454	2.440	10	0		DEAEHN
CCN[C@@H](C)c1cccc(S(=O)(=O)N[C@@H](C)CCOC)c1	ZINC000081717772	192316225	/nfs/dbraw/zinc/31/62/25/192316225.db2.gz	GTHWBSLHFVSPNL-STQMWFEESA-N	0	3	314.451	2.060	10	0		DEAEHN
N#Cc1cncnc1NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000379665896	356668044	/nfs/dbraw/zinc/66/80/44/356668044.db2.gz	URIXRJIJAOEFTQ-KRWDZBQOSA-N	0	3	307.401	2.237	10	0		DEAEHN
CCCNCc1ccc(OC)c(S(=O)(=O)N(C)CCC)c1	ZINC000088947230	192665070	/nfs/dbraw/zinc/66/50/70/192665070.db2.gz	QGKUCHVOJLPMMM-UHFFFAOYSA-N	0	3	314.451	2.225	10	0		DEAEHN
CCCCN(C1CC1)S(=O)(=O)c1cc(CN)sc1C	ZINC000088995408	192687900	/nfs/dbraw/zinc/68/79/00/192687900.db2.gz	CMLFMFCUMDJUNA-UHFFFAOYSA-N	0	3	302.465	2.468	10	0		DEAEHN
O=C(Nc1ccc2c(c1F)CCNC2)[C@@H]1CSCCS1	ZINC000261707516	295945244	/nfs/dbraw/zinc/94/52/44/295945244.db2.gz	KELNLVGCTYFQBI-LBPRGKRZSA-N	0	3	312.435	2.259	10	0		DEAEHN
c1ncn(-c2ccc(CNCc3n[nH]c4ccccc34)cc2)n1	ZINC000591704940	357752471	/nfs/dbraw/zinc/75/24/71/357752471.db2.gz	BTLQOSMRVPZKQD-UHFFFAOYSA-N	0	3	304.357	2.433	10	0		DEAEHN
c1ncn(-c2ccc(CNCc3[nH]nc4ccccc43)cc2)n1	ZINC000591704940	357752477	/nfs/dbraw/zinc/75/24/77/357752477.db2.gz	BTLQOSMRVPZKQD-UHFFFAOYSA-N	0	3	304.357	2.433	10	0		DEAEHN
COc1ccc(-c2nnc(CN3CCN4CCC[C@@H]4C3)o2)cc1	ZINC000591923662	357798279	/nfs/dbraw/zinc/79/82/79/357798279.db2.gz	RSFAPYRDEHJULO-CQSZACIVSA-N	0	3	314.389	2.025	10	0		DEAEHN
O=C(Nc1ccc(C(F)(F)F)nc1)N1CCN2CCC[C@@H]2C1	ZINC000179375007	199024156	/nfs/dbraw/zinc/02/41/56/199024156.db2.gz	ZCCDQHZOKQCTIK-LLVKDONJSA-N	0	3	314.311	2.412	10	0		DEAEHN
COc1ccc(C[C@@H](C)C(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000179342992	199018021	/nfs/dbraw/zinc/01/80/21/199018021.db2.gz	YVUOMNVHYPYFHC-GDBMZVCRSA-N	0	3	302.418	2.180	10	0		DEAEHN
CC[C@H](C)[C@H](O)CNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179464592	199039943	/nfs/dbraw/zinc/03/99/43/199039943.db2.gz	XNLRIEVQHRGXRI-RKTXRCNFSA-N	0	3	319.449	2.138	10	0		DEAEHN
CCCCN(CCO)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179473305	199042332	/nfs/dbraw/zinc/04/23/32/199042332.db2.gz	ZSMPEKLQGUKXPK-IAGOWNOFSA-N	0	3	319.449	2.236	10	0		DEAEHN
Cc1nc([C@H](C)NC(=O)NC2CCN(C3CC3)CC2)cs1	ZINC000594083373	358203244	/nfs/dbraw/zinc/20/32/44/358203244.db2.gz	KKESBSKMKAGOPC-JTQLQIEISA-N	0	3	308.451	2.439	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCc2ccc(Cl)cn2)CCN1C	ZINC000180846224	199218208	/nfs/dbraw/zinc/21/82/08/199218208.db2.gz	FNEBQBNNJMNIBH-FZMZJTMJSA-N	0	3	310.829	2.359	10	0		DEAEHN
C[C@@H]1C[C@H]1NS(=O)(=O)c1ccc(Cl)c(CN)c1Cl	ZINC000089024632	192704537	/nfs/dbraw/zinc/70/45/37/192704537.db2.gz	HYNLFXSTQXKMDU-HZGVNTEJSA-N	0	3	309.218	2.139	10	0		DEAEHN
CC[C@H](C)CNS(=O)(=O)c1cc(CNC)n(C(C)C)c1	ZINC000089025563	192705048	/nfs/dbraw/zinc/70/50/48/192705048.db2.gz	VNVWWRMVRDOHKO-LBPRGKRZSA-N	0	3	301.456	2.113	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2CCC[C@H](C)CC2)cs1	ZINC000089036704	192712668	/nfs/dbraw/zinc/71/26/68/192712668.db2.gz	QVUUIKFDLXBLAB-NSHDSACASA-N	0	3	302.465	2.278	10	0		DEAEHN
CCc1nn(C)c(CNCCN(C)C(C)C)c1Br	ZINC000089318692	192765623	/nfs/dbraw/zinc/76/56/23/192765623.db2.gz	LAIKRFPIBNTLAS-UHFFFAOYSA-N	0	3	317.275	2.175	10	0		DEAEHN
CCSc1cc(CNC(=O)N[C@H]2CCCN(CC)C2)ccn1	ZINC000187068138	200055687	/nfs/dbraw/zinc/05/56/87/200055687.db2.gz	SAGIFZXTLFUJEE-AWEZNQCLSA-N	0	3	322.478	2.477	10	0		DEAEHN
CO[C@H]1CN(C(=O)NCCN(C)Cc2ccccc2)CC[C@@H]1C	ZINC000187424559	200110900	/nfs/dbraw/zinc/11/09/00/200110900.db2.gz	KATFFGUGYLNGBI-RDJZCZTQSA-N	0	3	319.449	2.185	10	0		DEAEHN
CN(Cc1cnc(-c2ccccc2)[nH]1)CC1(O)CCOCC1	ZINC000188845164	200311312	/nfs/dbraw/zinc/31/13/12/200311312.db2.gz	WAYDPENONFFVQH-UHFFFAOYSA-N	0	3	301.390	2.050	10	0		DEAEHN
COC[C@@H](N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O)C(C)C	ZINC000189049554	200341541	/nfs/dbraw/zinc/34/15/41/200341541.db2.gz	BOCQSVCFEHJZCS-HZPDHXFCSA-N	0	3	308.397	2.187	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)C(=O)Nc1cscc1C	ZINC000276093135	212670555	/nfs/dbraw/zinc/67/05/55/212670555.db2.gz	FJTVQRADAKPABD-OLZOCXBDSA-N	0	3	321.446	2.080	10	0		DEAEHN
OC[C@@H]1CCCCN1C[C@@H](O)Cc1ccccc1C(F)(F)F	ZINC000443619208	238116907	/nfs/dbraw/zinc/11/69/07/238116907.db2.gz	BPQIFVZNBGPPIN-KBPBESRZSA-N	0	3	317.351	2.456	10	0		DEAEHN
C[C@@H]1CN(CCCCNC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)C[C@H](C)O1	ZINC000443676460	238119863	/nfs/dbraw/zinc/11/98/63/238119863.db2.gz	TUAZXSXWLURVNY-UYVKZUBASA-N	0	3	308.466	2.428	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1C[C@H](C)O[C@H](C(F)(F)F)C1	ZINC000608597725	361235875	/nfs/dbraw/zinc/23/58/75/361235875.db2.gz	AZSYQVVJLMFSEM-TUAOUCFPSA-N	0	3	308.344	2.039	10	0		DEAEHN
c1cnnc(N2CCN(CCCc3ccc4c(c3)CCO4)CC2)c1	ZINC000193243775	201012148	/nfs/dbraw/zinc/01/21/48/201012148.db2.gz	MMKXANMBQPXIPO-UHFFFAOYSA-N	0	3	324.428	2.166	10	0		DEAEHN
CC(C)Cc1ccc(S(=O)(=O)N[C@@H]2CNCC[C@@H]2C)cc1	ZINC000193400688	201045647	/nfs/dbraw/zinc/04/56/47/201045647.db2.gz	AMIADQFTSHZNGA-XJKSGUPXSA-N	0	3	310.463	2.161	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H]2CCC[NH2+][C@@H]2C)c(Cl)cc1F	ZINC000193450347	201053264	/nfs/dbraw/zinc/05/32/64/201053264.db2.gz	DNZQIKVWQJWLBI-BXKDBHETSA-N	0	3	320.817	2.206	10	0		DEAEHN
COC[C@H](N[C@@H]1CCc2ncnn2C1)c1ccc(Cl)cc1	ZINC000194094655	201176552	/nfs/dbraw/zinc/17/65/52/201176552.db2.gz	VEBWEWBDZWCNLD-KGLIPLIRSA-N	0	3	306.797	2.224	10	0		DEAEHN
COC[C@@](C)(CO)NCc1cccc(C(=O)OC(C)(C)C)c1	ZINC000611498429	361613492	/nfs/dbraw/zinc/61/34/92/361613492.db2.gz	RMZAGQFTZZWODV-QGZVFWFLSA-N	0	3	309.406	2.129	10	0		DEAEHN
CCO[C@H](CNC(=O)N1CC[C@@H](N(C)C)C1)c1ccccc1	ZINC000195187168	201354634	/nfs/dbraw/zinc/35/46/34/201354634.db2.gz	TWEQDZHJHNMGBX-HZPDHXFCSA-N	0	3	305.422	2.110	10	0		DEAEHN
CN(CCO)CCN(C)Cc1csc(-c2ccsc2)n1	ZINC000623091815	364883535	/nfs/dbraw/zinc/88/35/35/364883535.db2.gz	UHHXMAKGVNQGNU-UHFFFAOYSA-N	0	3	311.476	2.228	10	0		DEAEHN
CN[C@H](c1ccc(F)c(F)c1F)[C@H]1CN2CCC[C@@H]2CO1	ZINC000091721335	193097161	/nfs/dbraw/zinc/09/71/61/193097161.db2.gz	IGAXDHLQPVNMDD-DDHOLCJHSA-N	0	3	300.324	2.228	10	0		DEAEHN
CO[C@@H](C)c1noc(CN2CCCN(CC(C)(C)C)CC2)n1	ZINC000091867625	193120183	/nfs/dbraw/zinc/12/01/83/193120183.db2.gz	GIGFQFMIGADINI-ZDUSSCGKSA-N	0	3	310.442	2.331	10	0		DEAEHN
CCOc1nc2cc(C(=O)NC[C@@H]3CC[N@H+](CC)C3)ccc2[n-]1	ZINC000449811880	241110412	/nfs/dbraw/zinc/11/04/12/241110412.db2.gz	ASEULRPKBDREGS-LBPRGKRZSA-N	0	3	316.405	2.033	10	0		DEAEHN
CCOc1nc2cc(C(=O)NC[C@@H]3CC[N@@H+](CC)C3)ccc2[n-]1	ZINC000449811880	241110421	/nfs/dbraw/zinc/11/04/21/241110421.db2.gz	ASEULRPKBDREGS-LBPRGKRZSA-N	0	3	316.405	2.033	10	0		DEAEHN
c1c(CNC2CCCC2)nnn1C[C@H]1COc2ccccc2O1	ZINC000630604375	367753294	/nfs/dbraw/zinc/75/32/94/367753294.db2.gz	VYGIXZFYGQDQNQ-HNNXBMFYSA-N	0	3	314.389	2.150	10	0		DEAEHN
CNCc1sc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)cc1C	ZINC000092113840	193161183	/nfs/dbraw/zinc/16/11/83/193161183.db2.gz	JXIGPMXMWFNAJZ-QWRGUYRKSA-N	0	3	302.465	2.052	10	0		DEAEHN
CC(C)NCc1ccccc1S(=O)(=O)N1C[C@H](C)[C@H](C)C1	ZINC000092113963	193161603	/nfs/dbraw/zinc/16/16/03/193161603.db2.gz	XSURBBPRMILURB-OKILXGFUSA-N	0	3	310.463	2.461	10	0		DEAEHN
CCCC[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)cc1F	ZINC000092115830	193163021	/nfs/dbraw/zinc/16/30/21/193163021.db2.gz	VAWZFSRGBUGNCG-UHFFFAOYSA-N	0	3	302.415	2.402	10	0		DEAEHN
CC(C)C[C@@H](C)N(C)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115962	193164273	/nfs/dbraw/zinc/16/42/73/193164273.db2.gz	UXBZEULOQBOTKU-LLVKDONJSA-N	0	3	302.415	2.340	10	0		DEAEHN
[NH3+]CC1([N-]S(=O)(=O)c2ccc(Cl)s2)CCCCC1	ZINC000631981429	368479961	/nfs/dbraw/zinc/47/99/61/368479961.db2.gz	TXDQLYZMACFDOE-UHFFFAOYSA-N	0	3	308.856	2.341	10	0		DEAEHN
CC(C)(O)CN1CCN(C[C@H]2Cc3ccccc3S2)CC1	ZINC000092270276	193183794	/nfs/dbraw/zinc/18/37/94/193183794.db2.gz	FYSVEGHZBGWUCJ-OAHLLOKOSA-N	0	3	306.475	2.092	10	0		DEAEHN
C[C@@H](NC[C@H](C)N1CCOCC1)c1nc2c(s1)CCCC2	ZINC000093371632	296131245	/nfs/dbraw/zinc/13/12/45/296131245.db2.gz	FIKPEJKMVQNTEO-QWHCGFSZSA-N	0	3	309.479	2.393	10	0		DEAEHN
O=C(CC/C=C/c1ccccc1)NC[C@H]1CCCN1CCCO	ZINC000452362153	244194703	/nfs/dbraw/zinc/19/47/03/244194703.db2.gz	KNEVOTWQDYHFRL-YDMXYTAQSA-N	0	3	316.445	2.443	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)N(C)CC(=O)Nc1ccccc1SC	ZINC000262304201	203256272	/nfs/dbraw/zinc/25/62/72/203256272.db2.gz	LPHCIYCBVROGLE-MRXNPFEDSA-N	0	3	323.462	2.323	10	0		DEAEHN
Cc1ccc([C@@H]2CCCC[N@@H+]2CCCOC(=O)N=C(N)[O-])o1	ZINC000093175955	193211723	/nfs/dbraw/zinc/21/17/23/193211723.db2.gz	MHPXEZPJTWWUGI-LBPRGKRZSA-N	0	3	309.366	2.310	10	0		DEAEHN
Cc1ccc([C@@H]2CCCC[N@H+]2CCCOC(=O)N=C(N)[O-])o1	ZINC000093175955	193211725	/nfs/dbraw/zinc/21/17/25/193211725.db2.gz	MHPXEZPJTWWUGI-LBPRGKRZSA-N	0	3	309.366	2.310	10	0		DEAEHN
CCN[C@H](Cc1c(Cl)c(C)nn1C)C(OCC)OCC	ZINC000093307132	193228302	/nfs/dbraw/zinc/22/83/02/193228302.db2.gz	SEWJBVZHUFRGHW-LLVKDONJSA-N	0	3	303.834	2.302	10	0		DEAEHN
CCCN1CCN(c2nc(C(F)(F)F)ccc2CN)CC1	ZINC000094334044	193360441	/nfs/dbraw/zinc/36/04/41/193360441.db2.gz	DQRAWWHMTUVNRM-UHFFFAOYSA-N	0	3	302.344	2.091	10	0		DEAEHN
CCNCc1cc(F)c(O[C@@H](C)C(=O)NC(C)C)c(F)c1	ZINC000094346899	193363240	/nfs/dbraw/zinc/36/32/40/193363240.db2.gz	BJHATEAEHCYKBP-JTQLQIEISA-N	0	3	300.349	2.366	10	0		DEAEHN
CCN(CC)C(=O)[C@H](C)Oc1c(F)cc(CNC)cc1F	ZINC000094346355	193363684	/nfs/dbraw/zinc/36/36/84/193363684.db2.gz	FJOJUHPSMMESMM-JTQLQIEISA-N	0	3	300.349	2.320	10	0		DEAEHN
CNCc1cc(F)c(OCC(=O)N[C@@H](C)C(C)C)c(F)c1	ZINC000094346655	193363774	/nfs/dbraw/zinc/36/37/74/193363774.db2.gz	JGYGGVLRVLXGAW-JTQLQIEISA-N	0	3	300.349	2.224	10	0		DEAEHN
CC[C@@](C)(N)C(=O)NCc1cc(Br)ccc1F	ZINC000094237140	193353573	/nfs/dbraw/zinc/35/35/73/193353573.db2.gz	QQGOUMVLWARVNA-GFCCVEGCSA-N	0	3	303.175	2.332	10	0		DEAEHN
CCC(N)(CC)C(=O)N(C[C@H]1CCCO1)[C@H]1CCSC1	ZINC000094244633	193354525	/nfs/dbraw/zinc/35/45/25/193354525.db2.gz	JYBWZTCGJBHGPZ-QWHCGFSZSA-N	0	3	300.468	2.017	10	0		DEAEHN
C[C@H]1CN2CCCC[C@@H]2CN1c1ncc(CNC2CC2)s1	ZINC000094444155	193370020	/nfs/dbraw/zinc/37/00/20/193370020.db2.gz	XMDTUACIBZLGAH-GXTWGEPZSA-N	0	3	306.479	2.458	10	0		DEAEHN
COCCNCc1c(C)nc([C@H]2CSCCS2)nc1C	ZINC000094500193	193374490	/nfs/dbraw/zinc/37/44/90/193374490.db2.gz	MCEUKINYYRIDGN-CYBMUJFWSA-N	0	3	313.492	2.351	10	0		DEAEHN
C[C@H](CN)S(=O)(=O)NC12CC3C[C@@](C)(C1)C[C@](C)(C3)C2	ZINC000094544503	193378390	/nfs/dbraw/zinc/37/83/90/193378390.db2.gz	WNWLJSJMWLYYSR-YPHRVZEWSA-N	0	3	300.468	2.002	10	0		DEAEHN
CN1CCCC[C@@H]1CNc1nc2c(Br)cccn2n1	ZINC000094604875	193384206	/nfs/dbraw/zinc/38/42/06/193384206.db2.gz	AVSIXRPUHBQICS-SNVBAGLBSA-N	0	3	324.226	2.388	10	0		DEAEHN
CN[C@H](C)c1cc(F)ccc1OCC(=O)NCC(F)(F)F	ZINC000094619500	193385365	/nfs/dbraw/zinc/38/53/65/193385365.db2.gz	NKIOZLNNLHWBOE-MRVPVSSYSA-N	0	3	308.275	2.163	10	0		DEAEHN
CCc1nnsc1[C@@H](NC)[C@@H]1CCOC2(CCOCC2)C1	ZINC000097310726	193707022	/nfs/dbraw/zinc/70/70/22/193707022.db2.gz	AVAZFBGLDRPQHW-YPMHNXCESA-N	0	3	311.451	2.337	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cc3ccccc3c(=O)[nH]2)CCN1C	ZINC000266124458	205118922	/nfs/dbraw/zinc/11/89/22/205118922.db2.gz	YNCKZOYHQHODRP-OCCSQVGLSA-N	0	3	313.401	2.495	10	0		DEAEHN
CCN(CC)CCNS(=O)(=O)c1cc(C)c(F)cc1Cl	ZINC000153554225	291572590	/nfs/dbraw/zinc/57/25/90/291572590.db2.gz	RZGKOWHLKOKLLG-UHFFFAOYSA-N	0	3	322.833	2.408	10	0		DEAEHN
CCN(CC)C(=O)COc1ccc(Br)cc1CN	ZINC000020483506	182223175	/nfs/dbraw/zinc/22/31/75/182223175.db2.gz	HZLIVRXADYAKTK-UHFFFAOYSA-N	0	3	315.211	2.155	10	0		DEAEHN
CO[C@]1(CN[C@@H](C)c2ccc(Br)o2)CCOC1	ZINC000160086567	197384676	/nfs/dbraw/zinc/38/46/76/197384676.db2.gz	WZEPHUOBSUQNJI-CABZTGNLSA-N	0	3	304.184	2.498	10	0		DEAEHN
O=S(=O)(Nc1cccc(C(F)(F)F)c1)[C@@H]1CCCNC1	ZINC000020564077	182232144	/nfs/dbraw/zinc/23/21/44/182232144.db2.gz	QMZDPICMSRUYAV-LLVKDONJSA-N	0	3	308.325	2.199	10	0		DEAEHN
O=S(=O)(Nc1cccc(C(F)(F)F)c1)[C@H]1CCCNC1	ZINC000020564079	182232372	/nfs/dbraw/zinc/23/23/72/182232372.db2.gz	QMZDPICMSRUYAV-NSHDSACASA-N	0	3	308.325	2.199	10	0		DEAEHN
CCCN1CCN([C@@H](CN)c2ccc(Br)o2)CC1	ZINC000022174359	182311843	/nfs/dbraw/zinc/31/18/43/182311843.db2.gz	BNEYGNAXUNOYPE-NSHDSACASA-N	0	3	316.243	2.070	10	0		DEAEHN
Cc1ccc(C(=O)N2C[C@H](C)N(CCN(C)C)[C@@H](C)C2)cc1C	ZINC000036126200	182804693	/nfs/dbraw/zinc/80/46/93/182804693.db2.gz	LRAPAIKGJVUJNI-IRXDYDNUSA-N	0	3	317.477	2.400	10	0		DEAEHN
Cn1cc(CN2CCN(CC3CCC(F)(F)CC3)CC2)cn1	ZINC000459361241	248617453	/nfs/dbraw/zinc/61/74/53/248617453.db2.gz	ZIPRRDWKLZWONH-UHFFFAOYSA-N	0	3	312.408	2.363	10	0		DEAEHN
CCOCCNC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000037892791	182934325	/nfs/dbraw/zinc/93/43/25/182934325.db2.gz	PPKXAQGBPBAYLY-JTQLQIEISA-N	0	3	308.205	2.359	10	0		DEAEHN
CCOC(=O)c1c(NC(=O)CNC2CC2)sc2c1CCC2	ZINC000040415407	183063825	/nfs/dbraw/zinc/06/38/25/183063825.db2.gz	TWYWOFXKOHUFAG-UHFFFAOYSA-N	0	3	308.403	2.104	10	0		DEAEHN
COC(=O)c1c2c(sc1NC(=O)[C@@H]1CCCCN1)CCC2	ZINC000040858825	183142732	/nfs/dbraw/zinc/14/27/32/183142732.db2.gz	JRZLDLFPZXWMKL-JTQLQIEISA-N	0	3	308.403	2.104	10	0		DEAEHN
NC[C@H](c1ccc(Br)o1)N1CCCSCC1	ZINC000042443728	183271157	/nfs/dbraw/zinc/27/11/57/183271157.db2.gz	GDKNNQZJQZVGSE-SECBINFHSA-N	0	3	305.241	2.481	10	0		DEAEHN
CC(C)N(CCCO)[C@H](C)C(=O)Nc1ccc(Cl)cc1N	ZINC000042482921	183275578	/nfs/dbraw/zinc/27/55/78/183275578.db2.gz	YBVZQXDGEZWXHT-LLVKDONJSA-N	0	3	313.829	2.342	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(C)s1)N(C)CC(=O)N1CCCC1	ZINC000043242117	183346865	/nfs/dbraw/zinc/34/68/65/183346865.db2.gz	HLWJVIBSENESCM-BBRMVZONSA-N	0	3	309.479	2.389	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccc(Br)s1)N(CCO)C1CC1	ZINC000043262749	183348718	/nfs/dbraw/zinc/34/87/18/183348718.db2.gz	HHBKVKQXDBDIJW-UFBFGSQYSA-N	0	3	319.268	2.356	10	0		DEAEHN
CN[C@@H](c1cccc(C(F)(F)F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000043300561	183352312	/nfs/dbraw/zinc/35/23/12/183352312.db2.gz	DQYYQVDHDFCBBO-PWSUYJOCSA-N	0	3	307.337	2.401	10	0		DEAEHN
COc1ccc(Cl)c([N-]S(=O)(=O)C[C@@H]2CCCC[NH2+]2)c1	ZINC000043318846	183354677	/nfs/dbraw/zinc/35/46/77/183354677.db2.gz	LLCZFPJZVHXWLV-JTQLQIEISA-N	0	3	318.826	2.232	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)N[C@@H](C)c2ccccc2)c1	ZINC000105881135	194156391	/nfs/dbraw/zinc/15/63/91/194156391.db2.gz	JEZRIUSDAUJFGW-LSDHHAIUSA-N	0	3	300.406	2.047	10	0		DEAEHN
CCOc1ccc(CNC(=O)N2CC[C@H](N(C)C)C2)cc1F	ZINC000106340185	194198360	/nfs/dbraw/zinc/19/83/60/194198360.db2.gz	DBAGDLLJAQRPPO-ZDUSSCGKSA-N	0	3	309.385	2.070	10	0		DEAEHN
CCc1ccc(CN2CCN(C(C)(C)C(N)=S)CC2)cc1	ZINC000109470654	194267200	/nfs/dbraw/zinc/26/72/00/194267200.db2.gz	GJJYPORTUKOXMG-UHFFFAOYSA-N	0	3	305.491	2.431	10	0		DEAEHN
CCC[C@@H](C(N)=S)N1CCN(CCc2ccccc2)CC1	ZINC000109470426	194267452	/nfs/dbraw/zinc/26/74/52/194267452.db2.gz	NPNRVIZDFRNOFQ-INIZCTEOSA-N	0	3	305.491	2.302	10	0		DEAEHN
COc1ccc([C@H](CN)N2CCSCC2)c(Cl)c1OC	ZINC000110827615	194361830	/nfs/dbraw/zinc/36/18/30/194361830.db2.gz	RMISUKOKQSTFEB-NSHDSACASA-N	0	3	316.854	2.406	10	0		DEAEHN
C[C@@H]1CN(CCNc2ccc(Br)cc2)CCN1C	ZINC000110755589	194357067	/nfs/dbraw/zinc/35/70/67/194357067.db2.gz	YTGGJTZUGZBCKA-GFCCVEGCSA-N	0	3	312.255	2.497	10	0		DEAEHN
CN([C@@H]1CCCNC1)S(=O)(=O)c1ccc2ccccc2c1	ZINC000110928320	194370049	/nfs/dbraw/zinc/37/00/49/194370049.db2.gz	OBRRDEGHHHZANI-OAHLLOKOSA-N	0	3	304.415	2.212	10	0		DEAEHN
CCCN([C@@H]1CCCNC1)S(=O)(=O)c1ccc(Cl)cc1	ZINC000110942394	194371900	/nfs/dbraw/zinc/37/19/00/194371900.db2.gz	YNPRXSUFKNDRTO-CYBMUJFWSA-N	0	3	316.854	2.493	10	0		DEAEHN
CCCN([C@H]1CCCNC1)S(=O)(=O)c1ccc(CC)cc1	ZINC000110942375	194372147	/nfs/dbraw/zinc/37/21/47/194372147.db2.gz	PXFMEOICRVCNJX-HNNXBMFYSA-N	0	3	310.463	2.402	10	0		DEAEHN
CCN([C@H]1CCCNC1)S(=O)(=O)c1ccc(Cl)s1	ZINC000110941688	194372707	/nfs/dbraw/zinc/37/27/07/194372707.db2.gz	MNMVRBFDTPLNQX-VIFPVBQESA-N	0	3	308.856	2.164	10	0		DEAEHN
COc1ccc(OCCN(C)C[C@H](O)COC(C)(C)C)cc1	ZINC000057158957	184029028	/nfs/dbraw/zinc/02/90/28/184029028.db2.gz	IVGOMAXOMLJJCI-AWEZNQCLSA-N	0	3	311.422	2.182	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)Nc1nccs1	ZINC000057205914	184029538	/nfs/dbraw/zinc/02/95/38/184029538.db2.gz	QZOJPZOOLOEARW-ZDUSSCGKSA-N	0	3	304.419	2.438	10	0		DEAEHN
Cc1cccc(OCc2nc3c(c(N4CCNCC4)n2)CCC3)c1	ZINC000057328736	184033418	/nfs/dbraw/zinc/03/34/18/184033418.db2.gz	YFPAVRNLGSGDGP-UHFFFAOYSA-N	0	3	324.428	2.262	10	0		DEAEHN
CCCN[C@@](C)(C[C@@H](C)N(C)CCOC(C)C)C(=O)OC	ZINC000157519200	197192627	/nfs/dbraw/zinc/19/26/27/197192627.db2.gz	LYSJRTPJOGAICI-ZBFHGGJFSA-N	0	3	302.459	2.053	10	0		DEAEHN
C[C@H](CN1CCCC1)NC(=O)c1ccc(Br)cn1	ZINC000061874425	184191284	/nfs/dbraw/zinc/19/12/84/184191284.db2.gz	QNHVMBANYFHRFI-SNVBAGLBSA-N	0	3	312.211	2.058	10	0		DEAEHN
COCCN[C@@](C)(CO)c1ccc(F)c(Br)c1	ZINC000061689785	184182785	/nfs/dbraw/zinc/18/27/85/184182785.db2.gz	NJVBCTOGEINURT-LBPRGKRZSA-N	0	3	306.175	2.032	10	0		DEAEHN
Cc1ccc([C@@H]([C@@H](C)N)N2CCN(CC(F)(F)F)CC2)o1	ZINC000061940771	184197287	/nfs/dbraw/zinc/19/72/87/184197287.db2.gz	QMQORBULLIBWOP-DGCLKSJQSA-N	0	3	305.344	2.156	10	0		DEAEHN
C[C@H](C(=O)N(C)[C@H](C)c1ccc(Cl)cc1)N1CCNCC1	ZINC000062010857	184201003	/nfs/dbraw/zinc/20/10/03/184201003.db2.gz	GIIVCESMCULOGZ-CHWSQXEVSA-N	0	3	309.841	2.153	10	0		DEAEHN
COCCCN(C)[C@@H](CN)c1ccc(Br)s1	ZINC000062029274	184202118	/nfs/dbraw/zinc/20/21/18/184202118.db2.gz	JKYJRFFUQDBJQT-VIFPVBQESA-N	0	3	307.257	2.479	10	0		DEAEHN
C[C@@H](Cc1ccccc1)NC(=O)c1c[nH]c(=NN)c(Cl)c1	ZINC000062192164	184218611	/nfs/dbraw/zinc/21/86/11/184218611.db2.gz	WQRXREFLPWJHFE-JTQLQIEISA-N	0	3	304.781	2.382	10	0		DEAEHN
COCCN1C(=O)C[C@H](N)[C@H]1c1c(Cl)cccc1Cl	ZINC000062210263	184220856	/nfs/dbraw/zinc/22/08/56/184220856.db2.gz	FCMGBGIVIDXCLS-GWCFXTLKSA-N	0	3	303.189	2.241	10	0		DEAEHN
CCS(=O)(=O)N1CCC(c2ccccc2)(N2CCCC2)CC1	ZINC000062554753	184242117	/nfs/dbraw/zinc/24/21/17/184242117.db2.gz	IJQITMDDUWPAMJ-UHFFFAOYSA-N	0	3	322.474	2.423	10	0		DEAEHN
CCN[C@@H](CCSc1ccccc1Br)C(N)=O	ZINC000062597093	184245224	/nfs/dbraw/zinc/24/52/24/184245224.db2.gz	HBCFDDBSBMLKIR-JTQLQIEISA-N	0	3	317.252	2.395	10	0		DEAEHN
CCOc1ccc(S(=O)(=O)[N-]c2cccc(C[NH3+])c2)cc1	ZINC000063191125	184277158	/nfs/dbraw/zinc/27/71/58/184277158.db2.gz	IYDCVSBDQLSZGT-UHFFFAOYSA-N	0	3	306.387	2.345	10	0		DEAEHN
COc1ccc(-c2cc(C(=O)NC3CC3)c(CN)c(C)n2)cc1	ZINC000066102880	184389841	/nfs/dbraw/zinc/38/98/41/184389841.db2.gz	HAVYLWDMXRGGTG-UHFFFAOYSA-N	0	3	311.385	2.417	10	0		DEAEHN
C[C@H]1c2ccccc2O[C@H]1C(=O)N(C)CC1(N(C)C)CCC1	ZINC000188003074	207369365	/nfs/dbraw/zinc/36/93/65/207369365.db2.gz	VVKIHWQIBZVLET-XJKSGUPXSA-N	0	3	302.418	2.494	10	0		DEAEHN
N[C@H](CS(=O)(=O)c1ccc(Cl)c(Cl)c1)[C@H]1CCOC1	ZINC000159121402	197329792	/nfs/dbraw/zinc/32/97/92/197329792.db2.gz	WRGAHRXXGAWHOL-QPUJVOFHSA-N	0	3	324.229	2.131	10	0		DEAEHN
CC[C@H]1CCCN1S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159075622	197324244	/nfs/dbraw/zinc/32/42/44/197324244.db2.gz	VZQMZDIAXSZRIF-LBPRGKRZSA-N	0	3	300.399	2.156	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N(CC)C2CC2)cc(C)c1F	ZINC000159060614	197323925	/nfs/dbraw/zinc/32/39/25/197323925.db2.gz	WXEQGIUGQRVGBP-UHFFFAOYSA-N	0	3	314.426	2.417	10	0		DEAEHN
CCN(C)S(=O)(=O)c1ccc(F)c(CNC(C)(C)C)c1	ZINC000159060013	197323942	/nfs/dbraw/zinc/32/39/42/197323942.db2.gz	RHAPESQKZILDKD-UHFFFAOYSA-N	0	3	302.415	2.354	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc2c(c1)CCC(=O)N2	ZINC000120218038	195120397	/nfs/dbraw/zinc/12/03/97/195120397.db2.gz	QKYDHPVQKYOKEH-HNNXBMFYSA-N	0	3	317.433	2.277	10	0		DEAEHN
CC[S@@](=O)c1ccccc1C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000159003000	197318291	/nfs/dbraw/zinc/31/82/91/197318291.db2.gz	WFKLNDXCIIWQBO-XUHFEKCNSA-N	0	3	322.474	2.273	10	0		DEAEHN
Cc1c(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cnn1C(C)(C)C	ZINC000158925316	197311640	/nfs/dbraw/zinc/31/16/40/197311640.db2.gz	GGNMHVRBIQCQPY-WFASDCNBSA-N	0	3	306.454	2.405	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)c(C)s1	ZINC000158775682	197299796	/nfs/dbraw/zinc/29/97/96/197299796.db2.gz	XKGXRZHMQMPTDT-RYUDHWBXSA-N	0	3	314.476	2.197	10	0		DEAEHN
CCN[C@@H](CS(=O)(=O)c1ccc(C)cc1C)[C@H]1CCOC1	ZINC000158737140	197298154	/nfs/dbraw/zinc/29/81/54/197298154.db2.gz	IBFZFGFDTIWIEZ-GJZGRUSLSA-N	0	3	311.447	2.092	10	0		DEAEHN
CCCN[C@H](CS(=O)(=O)c1ccc(C)cc1)[C@@H]1CCOC1	ZINC000158725146	197297590	/nfs/dbraw/zinc/29/75/90/197297590.db2.gz	WVIDRLKQVOXQHP-GDBMZVCRSA-N	0	3	311.447	2.173	10	0		DEAEHN
CCCn1c(CNC2CCS(=O)CC2)nc2ccccc21	ZINC000158002260	197234130	/nfs/dbraw/zinc/23/41/30/197234130.db2.gz	SFDFOBKJHBZIRT-UHFFFAOYSA-N	0	3	305.447	2.447	10	0		DEAEHN
O=S1CCC(NCc2cc3c(c(Cl)c2)OCO3)CC1	ZINC000157920801	197227838	/nfs/dbraw/zinc/22/78/38/197227838.db2.gz	HBOFCBAJJHQASS-UHFFFAOYSA-N	0	3	301.795	2.069	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1[C@@H](O)CC1CC1	ZINC000157818664	197217480	/nfs/dbraw/zinc/21/74/80/197217480.db2.gz	IVYHVBJGGZCTIW-NSHDSACASA-N	0	3	302.216	2.041	10	0		DEAEHN
Cc1cccc([C@@H](O)CN(Cc2ccccc2)C(=O)[C@@H](C)N)c1	ZINC000157655281	197205855	/nfs/dbraw/zinc/20/58/55/197205855.db2.gz	YCYCGQAFCUKWGK-QAPCUYQASA-N	0	3	312.413	2.404	10	0		DEAEHN
CN(C)C(=O)c1cc(NC(=O)[C@H](N)C(C)(C)C)ccc1Cl	ZINC000157608980	197201436	/nfs/dbraw/zinc/20/14/36/197201436.db2.gz	LASIZVOCEAPXOK-LBPRGKRZSA-N	0	3	311.813	2.354	10	0		DEAEHN
Cc1cc(S(=O)(=O)NCCC2CCC2)cc(CN)c1F	ZINC000157506595	197192236	/nfs/dbraw/zinc/19/22/36/197192236.db2.gz	AKGOSDMSSQOOLU-UHFFFAOYSA-N	0	3	300.399	2.061	10	0		DEAEHN
Cc1c(F)cc(CN)cc1S(=O)(=O)NCCC1CCC1	ZINC000157496409	197192040	/nfs/dbraw/zinc/19/20/40/197192040.db2.gz	DZVFGDUFXGLTOL-UHFFFAOYSA-N	0	3	300.399	2.061	10	0		DEAEHN
CC(C)C[C@H](N)C(=O)N[C@@H](C)c1ccccc1-n1cccn1	ZINC000157438438	197186957	/nfs/dbraw/zinc/18/69/57/197186957.db2.gz	PVJHNUIRUUNZJV-ZFWWWQNUSA-N	0	3	300.406	2.423	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCc2c(nc(C(C)C)n2C)C1)N(C)C	ZINC000157013825	197155508	/nfs/dbraw/zinc/15/55/08/197155508.db2.gz	DKSDEJMPGZTMJW-HNNXBMFYSA-N	0	3	306.454	2.159	10	0		DEAEHN
C[C@@](O)(Cc1cc(Br)cs1)C[C@H]1COCCN1	ZINC000156923694	197150198	/nfs/dbraw/zinc/15/01/98/197150198.db2.gz	IHLYWHBCVRYCPL-JQWIXIFHSA-N	0	3	320.252	2.183	10	0		DEAEHN
CC(C)N1CCCC[C@H]1C(=O)N1CCC(c2cc[nH]n2)CC1	ZINC000156674723	197132215	/nfs/dbraw/zinc/13/22/15/197132215.db2.gz	FSRAJZGVBCGZIE-INIZCTEOSA-N	0	3	304.438	2.379	10	0		DEAEHN
Cc1cccc([S@](=O)CC(=O)Nc2cccc(CN)c2)c1	ZINC000156024623	197082032	/nfs/dbraw/zinc/08/20/32/197082032.db2.gz	YXARNNQJLMYHNL-NRFANRHFSA-N	0	3	302.399	2.200	10	0		DEAEHN
C[C@@H]1CNC[C@@H](C)N1C(=O)c1cccc(F)c1Br	ZINC000155994861	197079044	/nfs/dbraw/zinc/07/90/44/197079044.db2.gz	UCWTWZDYGUWZMX-RKDXNWHRSA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@@H](C(=O)Nc1cccc(CN)c1)[S@@](=O)c1cccs1	ZINC000155970487	197078179	/nfs/dbraw/zinc/07/81/79/197078179.db2.gz	DJOVQBNJWNYJCZ-FVINQWEUSA-N	0	3	308.428	2.342	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)c2ccc(N3CCCC3)nc2)[C@@H](C)C1	ZINC000155435545	197054643	/nfs/dbraw/zinc/05/46/43/197054643.db2.gz	XLQGQMGZQVFWCU-HOCLYGCPSA-N	0	3	316.449	2.140	10	0		DEAEHN
CC(C)C(=O)N1CCCN(C[C@@](C)(O)c2ccccc2)CC1	ZINC000155070676	197019156	/nfs/dbraw/zinc/01/91/56/197019156.db2.gz	ZYDPYTVVPQWPAO-GOSISDBHSA-N	0	3	304.434	2.084	10	0		DEAEHN
C[C@@H](Cc1ccccc1Cl)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000155121234	197024678	/nfs/dbraw/zinc/02/46/78/197024678.db2.gz	RLAUWPMUZJQNTA-DZGCQCFKSA-N	0	3	324.852	2.308	10	0		DEAEHN
CC(=O)N1CCC[C@H](CN[C@@H](C)c2cn3ccccc3n2)C1	ZINC000559903199	291919244	/nfs/dbraw/zinc/91/92/44/291919244.db2.gz	KJVZCTRJPGBWCD-DZGCQCFKSA-N	0	3	300.406	2.243	10	0		DEAEHN
CN(C)C(=O)[C@@H]1CO[C@@H]2CCN(Cc3ccsc3)C[C@@H]2C1	ZINC000247990250	257111421	/nfs/dbraw/zinc/11/14/21/257111421.db2.gz	LJFWLZNVNJQBBS-SOUVJXGZSA-N	0	3	308.447	2.063	10	0		DEAEHN
O=C(C[C@@H]1C[C@@H]2CN(Cc3ccsc3)C[C@@H]2O1)NCC1CC1	ZINC000247798327	257116887	/nfs/dbraw/zinc/11/68/87/257116887.db2.gz	SWPVSFBZMDESDH-PMPSAXMXSA-N	0	3	320.458	2.254	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C)cc1	ZINC000121820270	195354087	/nfs/dbraw/zinc/35/40/87/195354087.db2.gz	HTQVFQKACROSPI-INIZCTEOSA-N	0	3	319.449	2.280	10	0		DEAEHN
NCc1ccc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)cc1Cl	ZINC000126499364	195845568	/nfs/dbraw/zinc/84/55/68/195845568.db2.gz	FPXURZRXBYJKAZ-VXGBXAGGSA-N	0	3	314.838	2.219	10	0		DEAEHN
C[C@H](CC[S@@](C)=O)NCC(=O)Nc1cccc(Cl)c1	ZINC000128381369	195959915	/nfs/dbraw/zinc/95/99/15/195959915.db2.gz	SQWQKLBNIJGESG-DGIBIBHMSA-N	0	3	302.827	2.025	10	0		DEAEHN
COC(=O)CCNCc1cc(Br)cc2c1OCC2	ZINC000128408793	195961093	/nfs/dbraw/zinc/96/10/93/195961093.db2.gz	GBPZEXCMZQTFBN-UHFFFAOYSA-N	0	3	314.179	2.037	10	0		DEAEHN
CO[C@@H]1COC[C@H]1n1cc(CN[C@@H]2CCCC23CCCC3)nn1	ZINC000328803674	533524557	/nfs/dbraw/zinc/52/45/57/533524557.db2.gz	BJKXPCULVZWKSD-BZUAXINKSA-N	0	3	320.437	2.067	10	0		DEAEHN
O=C(NCCNc1ccncc1)NC1CC(c2ccccc2)C1	ZINC000545969593	285465698	/nfs/dbraw/zinc/46/56/98/285465698.db2.gz	FHAQRHOZQPVDKJ-UHFFFAOYSA-N	0	3	310.401	2.161	10	0		DEAEHN
Cc1ccc([C@H](C)NCCN2CCN(C(=O)C3CCC3)CC2)o1	ZINC000358142345	133124253	/nfs/dbraw/zinc/12/42/53/133124253.db2.gz	QTDWPQKQAGYIFX-HNNXBMFYSA-N	0	3	319.449	2.183	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC[C@@H](c2noc(C3CC3)n2)C1)N(C)C	ZINC000360692451	133195240	/nfs/dbraw/zinc/19/52/40/133195240.db2.gz	PQJZSFRZMVXYIS-KGLIPLIRSA-N	0	3	320.437	2.383	10	0		DEAEHN
CCN1CCC(NC(=O)CN2CC3(CC3)c3ccccc32)CC1	ZINC000362484011	133232753	/nfs/dbraw/zinc/23/27/53/133232753.db2.gz	IQNSZRRMBKDOIL-UHFFFAOYSA-N	0	3	313.445	2.139	10	0		DEAEHN
COc1ccc(CCNC(=O)CC2CCN(C)CC2)c(OC)c1	ZINC000362682017	133245448	/nfs/dbraw/zinc/24/54/48/133245448.db2.gz	VMDPPGWGQVRUJP-UHFFFAOYSA-N	0	3	320.433	2.094	10	0		DEAEHN
CCCOc1nc(C)ccc1C(=O)N1CC[C@H]2CC[C@@H](C1)N2C	ZINC000188615506	145014467	/nfs/dbraw/zinc/01/44/67/145014467.db2.gz	SUBHDORXKJSOIN-CABCVRRESA-N	0	3	317.433	2.488	10	0		DEAEHN
COc1ccccc1/C(C)=C/C(=O)N1CCN2CCC1CC2	ZINC000188634126	145015258	/nfs/dbraw/zinc/01/52/58/145015258.db2.gz	QQMAZWDFWIYBER-BUHFOSPRSA-N	0	3	300.402	2.405	10	0		DEAEHN
CCc1nc(C2CCN(CCOCC(F)(F)F)CC2)n[nH]1	ZINC000190704450	145046249	/nfs/dbraw/zinc/04/62/49/145046249.db2.gz	YSPQENFJNVZQHT-UHFFFAOYSA-N	0	3	306.332	2.125	10	0		DEAEHN
CCc1n[nH]c(C2CCN(CCOCC(F)(F)F)CC2)n1	ZINC000190704450	145046250	/nfs/dbraw/zinc/04/62/50/145046250.db2.gz	YSPQENFJNVZQHT-UHFFFAOYSA-N	0	3	306.332	2.125	10	0		DEAEHN
CCc1nnc(C2CCN(CCOCC(F)(F)F)CC2)[nH]1	ZINC000190704450	145046251	/nfs/dbraw/zinc/04/62/51/145046251.db2.gz	YSPQENFJNVZQHT-UHFFFAOYSA-N	0	3	306.332	2.125	10	0		DEAEHN
CCn1cc([C@H]2CN(CCN3CCC(C)CC3)CCO2)cn1	ZINC000190807578	145048732	/nfs/dbraw/zinc/04/87/32/145048732.db2.gz	YGEHVDRNUDKQFV-QGZVFWFLSA-N	0	3	306.454	2.008	10	0		DEAEHN
COCCN1CCC[C@@H]1CNCc1nccn1-c1ccccc1	ZINC000190944115	145050767	/nfs/dbraw/zinc/05/07/67/145050767.db2.gz	IJSPVSPVCCXCBW-QGZVFWFLSA-N	0	3	314.433	2.073	10	0		DEAEHN
COc1cccc(CNCCc2csc(N3CCCC3)n2)n1	ZINC000191111507	145053256	/nfs/dbraw/zinc/05/32/56/145053256.db2.gz	WAKOVDNHNAJFIX-UHFFFAOYSA-N	0	3	318.446	2.479	10	0		DEAEHN
Cc1cc(=O)[n-]c([C@H](C)N2CCC(C[NH+]3CCCC3)CC2)n1	ZINC000192544805	145075094	/nfs/dbraw/zinc/07/50/94/145075094.db2.gz	OLIYMJAMATYFBG-AWEZNQCLSA-N	0	3	304.438	2.359	10	0		DEAEHN
COc1ccnc(NC2CCN(CCOCCC(C)C)CC2)n1	ZINC000192860037	145080071	/nfs/dbraw/zinc/08/00/71/145080071.db2.gz	KBUIRRRNZJKBRH-UHFFFAOYSA-N	0	3	322.453	2.424	10	0		DEAEHN
C[C@@H](N[C@@H](C)C(=O)N(C)Cc1cccc(F)c1)[C@H]1CCCO1	ZINC000193128414	145082925	/nfs/dbraw/zinc/08/29/25/145082925.db2.gz	OMCOFKWIFSNNSK-DVOMOZLQSA-N	0	3	308.397	2.330	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000246283078	145097435	/nfs/dbraw/zinc/09/74/35/145097435.db2.gz	BRDKQGQCZMCIDB-GDBMZVCRSA-N	0	3	317.433	2.087	10	0		DEAEHN
C[C@@H]1CN(C[C@H](O)c2cccc(Cl)c2)C[C@H]1N1CCOCC1	ZINC000246580499	145107387	/nfs/dbraw/zinc/10/73/87/145107387.db2.gz	WBWZPDRFBOHUJV-XYPHTWIQSA-N	0	3	324.852	2.026	10	0		DEAEHN
COCc1cccc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1	ZINC000246773463	145113823	/nfs/dbraw/zinc/11/38/23/145113823.db2.gz	QMVLVNRVPRWBKJ-IRXDYDNUSA-N	0	3	302.418	2.389	10	0		DEAEHN
Cc1cccc(C)c1OCC(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000247037789	145124675	/nfs/dbraw/zinc/12/46/75/145124675.db2.gz	GNACIOYMXGURHW-HZPDHXFCSA-N	0	3	302.418	2.377	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@H]2Cc3cc(F)ccc3O2)CCN1C	ZINC000247415848	145136671	/nfs/dbraw/zinc/13/66/71/145136671.db2.gz	NNOVPMODMPDZPV-DJSGYFEHSA-N	0	3	306.381	2.070	10	0		DEAEHN
C[C@@H]1CC[C@H](NCC(=O)N2CC(=O)Nc3ccccc32)[C@@H](C)C1	ZINC000248552322	145158816	/nfs/dbraw/zinc/15/88/16/145158816.db2.gz	JCDMWLKXTSYNKO-RDBSUJKOSA-N	0	3	315.417	2.386	10	0		DEAEHN
Cn1cc(-c2cc(CN3CC[C@@H]4OCCC[C@H]4C3)on2)cn1	ZINC000248906376	145173481	/nfs/dbraw/zinc/17/34/81/145173481.db2.gz	BHDNDNNIHATEFV-LRDDRELGSA-N	0	3	302.378	2.076	10	0		DEAEHN
CC(C)[C@@H]1C[C@H]1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000249270259	145181399	/nfs/dbraw/zinc/18/13/99/145181399.db2.gz	AUZNZNMXBAOCLN-FGTMMUONSA-N	0	3	316.445	2.162	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COc2ccccc2Cl)CC[C@H]1C	ZINC000251903582	145197499	/nfs/dbraw/zinc/19/74/99/145197499.db2.gz	RDSQIJBDQLDGSU-XJKCOSOUSA-N	0	3	313.825	2.437	10	0		DEAEHN
CO[C@](C)(C(=O)N1C[C@@H]2CCCN2C[C@H]1C)c1ccccc1F	ZINC000253335841	145201518	/nfs/dbraw/zinc/20/15/18/145201518.db2.gz	ASTYJHGGRBGPJB-GLJUWKHASA-N	0	3	320.408	2.382	10	0		DEAEHN
CCO[C@@H](CNC(=O)N1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000253354695	145202031	/nfs/dbraw/zinc/20/20/31/145202031.db2.gz	HYABEWLPQHMHAH-IRXDYDNUSA-N	0	3	317.433	2.254	10	0		DEAEHN
CC[C@H](CO)N1CCN(C/C=C\c2ccccc2OC)CC1	ZINC000255752723	145205209	/nfs/dbraw/zinc/20/52/09/145205209.db2.gz	CFLXQNUAEGALFY-BQLWYNFJSA-N	0	3	304.434	2.097	10	0		DEAEHN
Cc1cnn(CCC(=O)Nc2ccc3c(c2F)CCNC3)c1	ZINC000261645730	145212825	/nfs/dbraw/zinc/21/28/25/145212825.db2.gz	COYUUWLDUIYLDV-UHFFFAOYSA-N	0	3	302.353	2.005	10	0		DEAEHN
Cc1cccc(NC(=O)CN2CCNC[C@H]2c2cccnc2)c1C	ZINC000261683458	145216315	/nfs/dbraw/zinc/21/63/15/145216315.db2.gz	IMCBEDMRDFTHPJ-SFHVURJKSA-N	0	3	324.428	2.283	10	0		DEAEHN
CCCn1ccc2cc(NC(=O)C3(N)CCOCC3)ccc21	ZINC000261760710	145223507	/nfs/dbraw/zinc/22/35/07/145223507.db2.gz	FXLNAOVRTLPWHL-UHFFFAOYSA-N	0	3	301.390	2.498	10	0		DEAEHN
C[C@H]1CCCN1C(=O)CCN1CCNC[C@H]1c1cccc(F)c1	ZINC000261829099	145231575	/nfs/dbraw/zinc/23/15/75/145231575.db2.gz	SUNKJJFFLQRJML-YOEHRIQHSA-N	0	3	319.424	2.173	10	0		DEAEHN
CCc1ccccc1CNC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C	ZINC000261845448	145232898	/nfs/dbraw/zinc/23/28/98/145232898.db2.gz	IYZVNUXTWQSIEZ-GPMSIDNRSA-N	0	3	316.445	2.398	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)NCCc1cccc(F)c1	ZINC000261876652	145237077	/nfs/dbraw/zinc/23/70/77/145237077.db2.gz	LYFSNGYGWRJNLR-HDMKZQKVSA-N	0	3	320.408	2.017	10	0		DEAEHN
N[C@H](C(=O)Nc1ccc2nc(C3CC3)oc2c1)C1CCOCC1	ZINC000261909974	145240041	/nfs/dbraw/zinc/24/00/41/145240041.db2.gz	XLBKCITVYJJIRO-HNNXBMFYSA-N	0	3	315.373	2.398	10	0		DEAEHN
NC1(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CCOCC1	ZINC000261955438	145246386	/nfs/dbraw/zinc/24/63/86/145246386.db2.gz	ZQJPJWTWDCYEKI-UHFFFAOYSA-N	0	3	322.836	2.386	10	0		DEAEHN
c1sc(CN[C@@H]2CCC[C@H]2[C@@H]2COCCN2)nc1C1CC1	ZINC000261995503	145251506	/nfs/dbraw/zinc/25/15/06/145251506.db2.gz	TZCUMPKSJBHTDZ-MCIONIFRSA-N	0	3	307.463	2.267	10	0		DEAEHN
COc1cccc(NC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000262504448	145288672	/nfs/dbraw/zinc/28/86/72/145288672.db2.gz	MIGXXBWNARESKH-GRDNDAEWSA-N	0	3	304.390	2.166	10	0		DEAEHN
C[C@@H]1C[NH2+]CC[C@@H]1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000262769045	145304106	/nfs/dbraw/zinc/30/41/06/145304106.db2.gz	LREHCYXYCPHDIK-SCZZXKLOSA-N	0	3	323.245	2.270	10	0		DEAEHN
CCc1ccc([C@H](C)c2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263189013	145334462	/nfs/dbraw/zinc/33/44/62/145334462.db2.gz	HQSNJSDHMLHHNR-WFASDCNBSA-N	0	3	300.406	2.360	10	0		DEAEHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)NC[C@](C)(O)C1CCCCC1	ZINC000359208664	147282406	/nfs/dbraw/zinc/28/24/06/147282406.db2.gz	KAVPHVYDWNRLQL-SKDZVZGDSA-N	0	3	323.481	2.100	10	0		DEAEHN
O=C([C@H]1CCN(CCOc2ccc(F)cc2)C1)N1CCCC1	ZINC000370683830	148044624	/nfs/dbraw/zinc/04/46/24/148044624.db2.gz	WPZTZZMRNCOEMV-AWEZNQCLSA-N	0	3	306.381	2.149	10	0		DEAEHN
Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)CC1CCN(C)CC1	ZINC000371803442	148141874	/nfs/dbraw/zinc/14/18/74/148141874.db2.gz	PLRKVSZTERKXKX-OAHLLOKOSA-N	0	3	304.438	2.422	10	0		DEAEHN
O=C1[C@H](NCc2cccc3[nH]ccc32)CCN1C1CCOCC1	ZINC000371820855	148144241	/nfs/dbraw/zinc/14/42/41/148144241.db2.gz	QPCIFWBDRDPIOR-QGZVFWFLSA-N	0	3	313.401	2.037	10	0		DEAEHN
C[C@@H](Cn1c(=O)[nH]c2ccccc2c1=O)N(C)Cc1ccccc1	ZINC000111672585	401721058	/nfs/dbraw/zinc/72/10/58/401721058.db2.gz	GOXQRMHZRQDTLQ-AWEZNQCLSA-N	0	3	323.396	2.210	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C[C@@H](C)c1c(C)n[nH]c1C	ZINC000127232734	401725243	/nfs/dbraw/zinc/72/52/43/401725243.db2.gz	XNPYPCQIDWGMLU-DOMZBBRYSA-N	0	3	306.454	2.463	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NCC1CCC(C)CC1	ZINC000111839117	401725769	/nfs/dbraw/zinc/72/57/69/401725769.db2.gz	HWRRGTVPAHCQCX-UYSNPLJNSA-N	0	3	311.470	2.223	10	0		DEAEHN
COc1ccc(C)nc1NC(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000127449411	401735703	/nfs/dbraw/zinc/73/57/03/401735703.db2.gz	GSRAYOIPJDMMNK-AAEUAGOBSA-N	0	3	306.410	2.249	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cn(C)nc2C(C)(C)C)C1	ZINC000127567941	401740600	/nfs/dbraw/zinc/74/06/00/401740600.db2.gz	GLGJNVUVDVYAGL-OCCSQVGLSA-N	0	3	306.454	2.176	10	0		DEAEHN
CC[C@H]1CCCCCN1C(=O)NC[C@H](C)CN1CCN(C)CC1	ZINC000074657118	401743264	/nfs/dbraw/zinc/74/32/64/401743264.db2.gz	IPKZKQVGLKNXKM-IRXDYDNUSA-N	0	3	324.513	2.234	10	0		DEAEHN
CC[C@H]1CN(CCCCCn2cc(C)cn2)CCN1CCOC	ZINC000111228122	401702004	/nfs/dbraw/zinc/70/20/04/401702004.db2.gz	HQISMLDIYQSYIN-SFHVURJKSA-N	0	3	322.497	2.404	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)C[C@@H]1c2ccccc2NC1=O	ZINC000126818658	401710140	/nfs/dbraw/zinc/71/01/40/401710140.db2.gz	UDLPVLFBCKBIBB-DZGCQCFKSA-N	0	3	317.433	2.205	10	0		DEAEHN
C[C@@H](CCNCc1cnn(Cc2ccccc2)c1)[S@](C)=O	ZINC000129506774	401805251	/nfs/dbraw/zinc/80/52/51/401805251.db2.gz	OMGVFGFCDDHBRV-LHSJRXKWSA-N	0	3	305.447	2.178	10	0		DEAEHN
CN(CCN1CCCCC1)[C@@H]1CCN(c2ccccc2)C1=O	ZINC000077285794	401808791	/nfs/dbraw/zinc/80/87/91/401808791.db2.gz	NFIYGONOXRLMSD-QGZVFWFLSA-N	0	3	301.434	2.210	10	0		DEAEHN
CC(C)c1csc([C@H]2CCCN(CCC(=O)NC(N)=O)C2)n1	ZINC000127842528	401752015	/nfs/dbraw/zinc/75/20/15/401752015.db2.gz	XEDJNSVXKSZJMY-NSHDSACASA-N	0	3	324.450	2.031	10	0		DEAEHN
NC1(C(=O)Nc2ccc(Br)c(F)c2)CCOCC1	ZINC000127992225	401758723	/nfs/dbraw/zinc/75/87/23/401758723.db2.gz	MLZPJVVNHBGZKH-UHFFFAOYSA-N	0	3	317.158	2.035	10	0		DEAEHN
COc1ccc(SCC(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1	ZINC000113226681	401770422	/nfs/dbraw/zinc/77/04/22/401770422.db2.gz	OESOVVQAXFSGEN-UONOGXRCSA-N	0	3	320.458	2.482	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(-c2ncon2)cc1	ZINC000113222406	401770461	/nfs/dbraw/zinc/77/04/61/401770461.db2.gz	CFPHEZRLFUBFPR-IUODEOHRSA-N	0	3	312.373	2.045	10	0		DEAEHN
CCC(=O)Nc1cccc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000113224347	401770490	/nfs/dbraw/zinc/77/04/90/401770490.db2.gz	JIZWZPMIFIBIIH-XJKSGUPXSA-N	0	3	315.417	2.344	10	0		DEAEHN
OCCOCCNCc1cccc(OCc2ccccc2)c1	ZINC000010435674	401770578	/nfs/dbraw/zinc/77/05/78/401770578.db2.gz	OJNXCIMXTJNJLS-UHFFFAOYSA-N	0	3	301.386	2.364	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000113222329	401770640	/nfs/dbraw/zinc/77/06/40/401770640.db2.gz	CXGUBDROKMQQTE-CXAGYDPISA-N	0	3	312.413	2.053	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1coc(Br)c1	ZINC000113226179	401770677	/nfs/dbraw/zinc/77/06/77/401770677.db2.gz	MTVMKWNLLXGJLW-MWLCHTKSSA-N	0	3	313.195	2.351	10	0		DEAEHN
Cc1cccc(C)c1OCC(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000113226822	401770888	/nfs/dbraw/zinc/77/08/88/401770888.db2.gz	GNACIOYMXGURHW-HOTGVXAUSA-N	0	3	302.418	2.377	10	0		DEAEHN
O=C(Nc1ccccc1)[C@@H]1CCCN([C@@H]2CCCCNC2=O)C1	ZINC000011165748	401773457	/nfs/dbraw/zinc/77/34/57/401773457.db2.gz	AUUMVKPVEAHHES-GDBMZVCRSA-N	0	3	315.417	2.006	10	0		DEAEHN
COCCOc1cccc(CN2CC[C@@H](c3cnn(C)c3)C2)c1	ZINC000128387681	401774640	/nfs/dbraw/zinc/77/46/40/401774640.db2.gz	MLMKZCSUFALUOW-MRXNPFEDSA-N	0	3	315.417	2.435	10	0		DEAEHN
O=C(CN[C@H]1CCCC[C@@H]1n1cccn1)N1CCCCCC1	ZINC000128695388	401788119	/nfs/dbraw/zinc/78/81/19/401788119.db2.gz	UMDHSBRQQSPXIR-HOTGVXAUSA-N	0	3	304.438	2.359	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)COc1ccc(F)cc1F	ZINC000077730555	401827863	/nfs/dbraw/zinc/82/78/63/401827863.db2.gz	XYBFIXKBQLLTKL-ZDUSSCGKSA-N	0	3	314.376	2.436	10	0		DEAEHN
CCNC(=O)CCN1CCC[C@@H]1c1cc(OC)ccc1OC	ZINC000025926938	401837801	/nfs/dbraw/zinc/83/78/01/401837801.db2.gz	FSMUXXZSCZSBBA-OAHLLOKOSA-N	0	3	306.406	2.367	10	0		DEAEHN
Cc1cccc(NC(=O)CN2CCN(C3CCCC3)CC2)c1	ZINC000027117842	401843860	/nfs/dbraw/zinc/84/38/60/401843860.db2.gz	LNAGYDUIWVYYQQ-UHFFFAOYSA-N	0	3	301.434	2.494	10	0		DEAEHN
COc1ccc(OCCN2CC[C@@H](c3cnn(C)c3)C2)cc1	ZINC000116324198	401849964	/nfs/dbraw/zinc/84/99/64/401849964.db2.gz	AQRQOBVHCPQXJF-CQSZACIVSA-N	0	3	301.390	2.297	10	0		DEAEHN
O=C(Cc1cnc2ccccc2c1)N1CC[C@@H](N2CCCC2)C1	ZINC000131425231	401850620	/nfs/dbraw/zinc/85/06/20/401850620.db2.gz	NORYCDOIFXLCQV-QGZVFWFLSA-N	0	3	309.413	2.474	10	0		DEAEHN
CC[C@@H](Sc1ccccc1)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000116783276	401858433	/nfs/dbraw/zinc/85/84/33/401858433.db2.gz	RMOSUZFDSWDAAJ-GDBMZVCRSA-N	0	3	322.474	2.346	10	0		DEAEHN
c1csc(-c2noc(-c3cccnc3N3CCNCC3)n2)c1	ZINC000040351921	401925262	/nfs/dbraw/zinc/92/52/62/401925262.db2.gz	WTTQQDWBYFDTTR-UHFFFAOYSA-N	0	3	313.386	2.270	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccc(OC)c(OC)c1OC)N(C)C	ZINC000135118629	401927507	/nfs/dbraw/zinc/92/75/07/401927507.db2.gz	VDYURCSJFMMOSY-ZDUSSCGKSA-N	0	3	324.421	2.059	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1cccc(Cl)c1	ZINC000032072947	401875636	/nfs/dbraw/zinc/87/56/36/401875636.db2.gz	HTPQSSWRHVDMAF-NSHDSACASA-N	0	3	304.843	2.349	10	0		DEAEHN
CCc1ccc(CNC[C@@H]2CCCN2c2cc(NC)ncn2)o1	ZINC000133038299	401878229	/nfs/dbraw/zinc/87/82/29/401878229.db2.gz	JKQBDXUWSTVBQY-ZDUSSCGKSA-N	0	3	315.421	2.432	10	0		DEAEHN
[NH3+]C1(C[N-]S(=O)(=O)c2ccc(F)cc2F)CCCCCC1	ZINC000036266844	401903896	/nfs/dbraw/zinc/90/38/96/401903896.db2.gz	VAROXTIYTAAOIM-UHFFFAOYSA-N	0	3	318.389	2.295	10	0		DEAEHN
CC[C@H](O)CN1CCN(CCCOc2ccccc2C)CC1	ZINC000118858180	401913261	/nfs/dbraw/zinc/91/32/61/401913261.db2.gz	GVIVZOYEALQDDZ-KRWDZBQOSA-N	0	3	306.450	2.152	10	0		DEAEHN
COCCOc1ccc([C@H](C)NCCc2nc(C)no2)cc1	ZINC000089518193	401950803	/nfs/dbraw/zinc/95/08/03/401950803.db2.gz	JYSRXXIWYZSAJC-LBPRGKRZSA-N	0	3	305.378	2.297	10	0		DEAEHN
CCC[C@H](C(=O)NCc1c(OC)cc(OC)cc1OC)N(C)C	ZINC000136686706	401972045	/nfs/dbraw/zinc/97/20/45/401972045.db2.gz	AMYVTIXXZGURTC-CQSZACIVSA-N	0	3	324.421	2.059	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000120135975	401979681	/nfs/dbraw/zinc/97/96/81/401979681.db2.gz	CSSDRXKNVHYXKH-UONOGXRCSA-N	0	3	324.494	2.446	10	0		DEAEHN
O=C(NC1CCN(CC[C@H]2CCOC2=O)CC1)C1CCCCC1	ZINC000120283801	401984751	/nfs/dbraw/zinc/98/47/51/401984751.db2.gz	SEULQWBGWVMBSJ-HNNXBMFYSA-N	0	3	322.449	2.101	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)C(=O)Nc2cccc(Cl)c2)[C@@H](C)C1	ZINC000150775620	401995151	/nfs/dbraw/zinc/99/51/51/401995151.db2.gz	UTBTXCRQQJFTHA-FZMZJTMJSA-N	0	3	323.824	2.123	10	0		DEAEHN
COc1ccc(C[C@H](C)CNC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000120634259	401996594	/nfs/dbraw/zinc/99/65/94/401996594.db2.gz	AKXASLICZJIUSN-HOCLYGCPSA-N	0	3	319.449	2.267	10	0		DEAEHN
Nc1c(Br)cc(Br)cc1[C@H](N)CCO	ZINC000044233349	401940516	/nfs/dbraw/zinc/94/05/16/401940516.db2.gz	VNCQWTNKHVFWTC-MRVPVSSYSA-N	0	3	324.016	2.176	10	0		DEAEHN
COc1ccc([C@@H]2C[C@H](C)N(CC(=O)N3CCCC3)C2)cc1	ZINC000151043415	402012878	/nfs/dbraw/zinc/01/28/78/402012878.db2.gz	HLIHSXXAUKRLAT-GOEBONIOSA-N	0	3	302.418	2.495	10	0		DEAEHN
COC(=O)[C@H](C)CN(CCn1cccn1)Cc1ccccc1	ZINC000121107824	402016075	/nfs/dbraw/zinc/01/60/75/402016075.db2.gz	BXIFJGWDPADKOB-OAHLLOKOSA-N	0	3	301.390	2.194	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCc2ccccc2OCC2CC2)C1	ZINC000121312717	402027745	/nfs/dbraw/zinc/02/77/45/402027745.db2.gz	UEPXAMBXALSACT-INIZCTEOSA-N	0	3	317.433	2.321	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2ccc(OC)cc2)C1	ZINC000052497353	402042980	/nfs/dbraw/zinc/04/29/80/402042980.db2.gz	HAOKBVVFIUQIBB-OAHLLOKOSA-N	0	3	305.422	2.021	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCOc2ccccc2C)C1	ZINC000052561836	402043533	/nfs/dbraw/zinc/04/35/33/402043533.db2.gz	FZNVALUEBHREDR-HNNXBMFYSA-N	0	3	305.422	2.157	10	0		DEAEHN
C[C@H](C(=O)N[C@H](Cc1ccccc1)CN(C)C)C1CCOCC1	ZINC000121586120	402045348	/nfs/dbraw/zinc/04/53/48/402045348.db2.gz	MCTQQRDTMOEXNW-MAUKXSAKSA-N	0	3	318.461	2.338	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCC2(c3cccc(F)c3)CC2)C1	ZINC000120911427	402006701	/nfs/dbraw/zinc/00/67/01/402006701.db2.gz	MGWIDMGRKBMPAA-HNNXBMFYSA-N	0	3	305.397	2.203	10	0		DEAEHN
CC(C)OC(=O)CCN1CCC[C@H](c2nncn2C2CC2)C1	ZINC000152426903	402095336	/nfs/dbraw/zinc/09/53/36/402095336.db2.gz	OFMNSDHIDUOZJF-ZDUSSCGKSA-N	0	3	306.410	2.134	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@@H](C)N(C)c2ccccc2)C1	ZINC000057821718	402097068	/nfs/dbraw/zinc/09/70/68/402097068.db2.gz	IDERMVVXMQGHCL-HZPDHXFCSA-N	0	3	318.465	2.295	10	0		DEAEHN
CNC(=O)c1ccc(CN2CC[C@@H](Oc3cccnc3)C2)cc1	ZINC000152473169	402097585	/nfs/dbraw/zinc/09/75/85/402097585.db2.gz	ZJEPBONYODFMSX-QGZVFWFLSA-N	0	3	311.385	2.095	10	0		DEAEHN
COCCNCCNC(=O)c1ccc(-c2ccc(F)cc2)o1	ZINC000152502203	402098571	/nfs/dbraw/zinc/09/85/71/402098571.db2.gz	IFSXDEURJWRKFB-UHFFFAOYSA-N	0	3	306.337	2.052	10	0		DEAEHN
COc1ccc(CCCC(=O)N2CC[C@@H](N(C)C)C2)c(OC)c1	ZINC000152571196	402100761	/nfs/dbraw/zinc/10/07/61/402100761.db2.gz	PRCUHHZJBNFFEP-OAHLLOKOSA-N	0	3	320.433	2.189	10	0		DEAEHN
CCN(CC)CC(=O)Nc1ccccc1N1CCN(CC)CC1	ZINC000058791228	402103149	/nfs/dbraw/zinc/10/31/49/402103149.db2.gz	VYPSYUOIDINHPC-UHFFFAOYSA-N	0	3	318.465	2.109	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N(C)C(=O)NC2CCN(C)CC2)C12CCCC2	ZINC000152899316	402115875	/nfs/dbraw/zinc/11/58/75/402115875.db2.gz	OMIKTXLUOZEKET-HZPDHXFCSA-N	0	3	323.481	2.460	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)Cn2c3ccccc3[nH]c2=O)c1	ZINC000123387715	402124795	/nfs/dbraw/zinc/12/47/95/402124795.db2.gz	XYZQSMCUPABNRV-UHFFFAOYSA-N	0	3	324.384	2.030	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1cnc(C(F)(F)F)nc1	ZINC000123533051	402132924	/nfs/dbraw/zinc/13/29/24/402132924.db2.gz	DMHWYYSLEWMBLZ-LLVKDONJSA-N	0	3	318.343	2.202	10	0		DEAEHN
CN1CC[C@@H](CNC(=O)c2cnn(-c3cccc(Cl)c3)c2)C1	ZINC000066652125	402139140	/nfs/dbraw/zinc/13/91/40/402139140.db2.gz	HDVVQVMAEJDSMR-LBPRGKRZSA-N	0	3	318.808	2.207	10	0		DEAEHN
CCCCCCNC(=O)[C@@H]1CCCN([C@@H]2CCCCNC2=O)C1	ZINC000153381730	402141814	/nfs/dbraw/zinc/14/18/14/402141814.db2.gz	QYLOFGOBTIVPMU-HZPDHXFCSA-N	0	3	323.481	2.064	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](C)c1ccccc1)N1CC[C@]2(CCOC2)C1	ZINC000153476310	402147612	/nfs/dbraw/zinc/14/76/12/402147612.db2.gz	XTVQGGAHGARBST-DAYGRLMNSA-N	0	3	302.418	2.365	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccc2c(c1)OCC(=O)N2)N1[C@H](C)CC[C@H]1C	ZINC000101649266	402152529	/nfs/dbraw/zinc/15/25/29/402152529.db2.gz	PBDVYQLFCHTPTP-UTUOFQBUSA-N	0	3	317.389	2.217	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1cc(F)cc2[nH]cnc21	ZINC000068224331	402187990	/nfs/dbraw/zinc/18/79/90/402187990.db2.gz	WWKICZJRZQNOEJ-LBPRGKRZSA-N	0	3	306.385	2.408	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)ccc1F	ZINC000124071493	402162675	/nfs/dbraw/zinc/16/26/75/402162675.db2.gz	FQUZXSPGSPOQJD-BXUZGUMPSA-N	0	3	321.396	2.339	10	0		DEAEHN
Cc1cc(C)n(C[C@H](C)NCc2ccc(-n3cncn3)cc2)n1	ZINC000067642095	402166066	/nfs/dbraw/zinc/16/60/66/402166066.db2.gz	CVHLTQQHZVUIKK-AWEZNQCLSA-N	0	3	310.405	2.259	10	0		DEAEHN
CN(C)CCNC(=O)C(C)(C)c1cccc(Br)c1	ZINC000102486739	402167493	/nfs/dbraw/zinc/16/74/93/402167493.db2.gz	KZTCUOSKKJAVAM-UHFFFAOYSA-N	0	3	313.239	2.405	10	0		DEAEHN
CC(C)OC[C@@H](O)CN1CCC[C@@H]1c1ccc2c(c1)OCO2	ZINC000102950532	402175485	/nfs/dbraw/zinc/17/54/85/402175485.db2.gz	CNXOUWBGIBHGJF-LSDHHAIUSA-N	0	3	307.390	2.338	10	0		DEAEHN
Cc1nccn1CCCN(C)[C@H]1CCN(c2ccccc2)C1=O	ZINC000125161609	402216826	/nfs/dbraw/zinc/21/68/26/402216826.db2.gz	VOVQNGTTWIAUEQ-KRWDZBQOSA-N	0	3	312.417	2.319	10	0		DEAEHN
CCc1noc(CC)c1CC(=O)N(C)C[C@H]1CCCN1CC	ZINC000154661689	402224660	/nfs/dbraw/zinc/22/46/60/402224660.db2.gz	VBCQJVHCCZDRRA-CYBMUJFWSA-N	0	3	307.438	2.285	10	0		DEAEHN
COc1ccccc1C[C@@H](C)CC(=O)NC[C@@H]1CCCN1C	ZINC000107349453	402230768	/nfs/dbraw/zinc/23/07/68/402230768.db2.gz	SJSGTSYGHBGUOC-ZBFHGGJFSA-N	0	3	304.434	2.474	10	0		DEAEHN
CCc1nc(CNC(=O)N[C@H](CC(C)C)CN(C)C)cs1	ZINC000107835492	402241137	/nfs/dbraw/zinc/24/11/37/402241137.db2.gz	OQJFBWZHFBRLLL-GFCCVEGCSA-N	0	3	312.483	2.481	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)c2c[nH]nc2-c2ccc(F)cc2)C1	ZINC000108462245	402254373	/nfs/dbraw/zinc/25/43/73/402254373.db2.gz	GQXIPHDMXYFWAA-GFCCVEGCSA-N	0	3	316.380	2.287	10	0		DEAEHN
CN(C[C@@H]1CCN(C)C1)C(=O)c1ccc(Br)o1	ZINC000071190456	402271318	/nfs/dbraw/zinc/27/13/18/402271318.db2.gz	JUVRFTMZNWZTEH-SECBINFHSA-N	0	3	301.184	2.066	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1cc(F)ccc1C	ZINC000110085319	402280893	/nfs/dbraw/zinc/28/08/93/402280893.db2.gz	IZRDHNVVFQLOSJ-AWEZNQCLSA-N	0	3	309.385	2.366	10	0		DEAEHN
CCOc1cccnc1C(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000176192759	402288978	/nfs/dbraw/zinc/28/89/78/402288978.db2.gz	GGYJCFTWMLEAPF-AWEZNQCLSA-N	0	3	305.422	2.331	10	0		DEAEHN
CN(C[C@H]1CCC(C)(C)O1)[C@@H]1CCCN(c2cccnn2)C1	ZINC000184669020	402290423	/nfs/dbraw/zinc/29/04/23/402290423.db2.gz	JKGZCAOHTXCDDX-HUUCEWRRSA-N	0	3	304.438	2.335	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000176294937	402297174	/nfs/dbraw/zinc/29/71/74/402297174.db2.gz	BZDXGXNXLUHDMF-RHSMWYFYSA-N	0	3	319.449	2.366	10	0		DEAEHN
CCCn1c(C)cc(C(=O)CN2CCN3CCC[C@@H]3C2)c1C	ZINC000176332283	402300327	/nfs/dbraw/zinc/30/03/27/402300327.db2.gz	GBHZRJXBKDFBOE-MRXNPFEDSA-N	0	3	303.450	2.478	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1nc2c(s1)COCC2	ZINC000176357847	402302447	/nfs/dbraw/zinc/30/24/47/402302447.db2.gz	MLJSLLIPMDIIOH-LLVKDONJSA-N	0	3	324.450	2.164	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)NCc2ccc(Cl)cn2)C1	ZINC000222206024	402306061	/nfs/dbraw/zinc/30/60/61/402306061.db2.gz	ORURRGCYUBTQKT-WFASDCNBSA-N	0	3	322.840	2.361	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)N2CCC[C@@H](N(C)C)C2)s1	ZINC000176407906	402307041	/nfs/dbraw/zinc/30/70/41/402307041.db2.gz	JLPUZLGRFWISBE-VXGBXAGGSA-N	0	3	311.451	2.325	10	0		DEAEHN
CCc1ccc(NC(=O)NC[C@H](O)CN2CCCCC2)cc1F	ZINC000158759511	402311135	/nfs/dbraw/zinc/31/11/35/402311135.db2.gz	DTLQVPHHKYJKRT-HNNXBMFYSA-N	0	3	323.412	2.356	10	0		DEAEHN
CCO[C@H](CCNC(=O)N1CC[C@H](N(C)C)C1)C1CCCC1	ZINC000176504707	402315780	/nfs/dbraw/zinc/31/57/80/402315780.db2.gz	ORCFXENCBDKSLS-JKSUJKDBSA-N	0	3	311.470	2.317	10	0		DEAEHN
CCO[C@@H](CCNC(=O)N1CCN2CCC[C@@H]2C1)C1CCCC1	ZINC000176512766	402316192	/nfs/dbraw/zinc/31/61/92/402316192.db2.gz	XPUHWEUUVQUSSR-SJORKVTESA-N	0	3	323.481	2.461	10	0		DEAEHN
CO[C@@H](C)c1nc(C)c(C(=O)NC[C@@H]2CCCN(C)C2)s1	ZINC000176563503	402320175	/nfs/dbraw/zinc/32/01/75/402320175.db2.gz	NTUPJFJIRBSFCL-RYUDHWBXSA-N	0	3	311.451	2.231	10	0		DEAEHN
Cc1cccc2c1ncc(C)c2NCCOCCS(C)(=O)=O	ZINC000185321800	402343314	/nfs/dbraw/zinc/34/33/14/402343314.db2.gz	YHEVTPJNVNCAKH-UHFFFAOYSA-N	0	3	322.430	2.325	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1cccc(Cl)c1	ZINC000176900587	402347957	/nfs/dbraw/zinc/34/79/57/402347957.db2.gz	QTYSCWBLEDMJRX-CQSZACIVSA-N	0	3	323.824	2.221	10	0		DEAEHN
Cc1cnn(CCCCCN2CC[C@](O)(C(F)(F)F)C2)c1	ZINC000177281770	402387392	/nfs/dbraw/zinc/38/73/92/402387392.db2.gz	XWTMZDWWRRNEKU-CYBMUJFWSA-N	0	3	305.344	2.361	10	0		DEAEHN
COc1ccc([C@H](NC[C@H](C)CS(C)(=O)=O)C2CC2)cc1	ZINC000176956371	402354160	/nfs/dbraw/zinc/35/41/60/402354160.db2.gz	HJCWROMCBMPLMX-BLLLJJGKSA-N	0	3	311.447	2.417	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1cccc(Br)n1	ZINC000234262720	402359821	/nfs/dbraw/zinc/35/98/21/402359821.db2.gz	VVSPSYVVABBNEH-SNVBAGLBSA-N	0	3	312.211	2.010	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(-c2cccnc2)on1	ZINC000177026255	402361130	/nfs/dbraw/zinc/36/11/30/402361130.db2.gz	MYZJGUCESUYOGN-CQSZACIVSA-N	0	3	314.389	2.293	10	0		DEAEHN
CCOc1ncccc1NC(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000177027913	402361154	/nfs/dbraw/zinc/36/11/54/402361154.db2.gz	CZVVZFMYPDXAKF-GXTWGEPZSA-N	0	3	306.410	2.331	10	0		DEAEHN
c1cnn(CC2CCN(Cc3ccc(-n4ccnc4)nc3)CC2)c1	ZINC000177139256	402374287	/nfs/dbraw/zinc/37/42/87/402374287.db2.gz	MEPLSRGKCDWASH-UHFFFAOYSA-N	0	3	322.416	2.376	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCC[C@@H]1CCCO	ZINC000161654862	402394812	/nfs/dbraw/zinc/39/48/12/402394812.db2.gz	ZVLOKXPUEAMKIK-QGZVFWFLSA-N	0	3	304.434	2.272	10	0		DEAEHN
COC(=O)c1ccccc1NC(=O)N(C)C[C@@H]1CCCN(C)C1	ZINC000161846268	402401327	/nfs/dbraw/zinc/40/13/27/402401327.db2.gz	DZYJTDSYHJELQC-CYBMUJFWSA-N	0	3	319.405	2.279	10	0		DEAEHN
COCCNCCNC(=O)c1csc(-c2ccc(C)cc2)n1	ZINC000237345784	402405237	/nfs/dbraw/zinc/40/52/37/402405237.db2.gz	DPOIMYREVJXILS-UHFFFAOYSA-N	0	3	319.430	2.084	10	0		DEAEHN
CCC(=O)N(C)CC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000177467935	402406031	/nfs/dbraw/zinc/40/60/31/402406031.db2.gz	NYYQFWVHGXYKGT-QGZVFWFLSA-N	0	3	304.434	2.300	10	0		DEAEHN
C[C@@H](NC(=O)[C@H](CN)c1ccccc1)c1ccc2c(c1)OCO2	ZINC000237414185	402407961	/nfs/dbraw/zinc/40/79/61/402407961.db2.gz	AZWYPFBWMQNGAP-IUODEOHRSA-N	0	3	312.369	2.335	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2cccc3c2OCO3)C12CCOCC2	ZINC000186265478	402416239	/nfs/dbraw/zinc/41/62/39/402416239.db2.gz	AZCDTJFPOBMSOD-JKSUJKDBSA-N	0	3	319.401	2.479	10	0		DEAEHN
CC(=O)Nc1nc(C(=O)N[C@H](C)CN2CCCCCC2)cs1	ZINC000186299236	402418736	/nfs/dbraw/zinc/41/87/36/402418736.db2.gz	WWQCSHCBVLDSGI-LLVKDONJSA-N	0	3	324.450	2.096	10	0		DEAEHN
C[C@]1(CNC(=O)C2=COCCO2)CCCN1Cc1ccccc1	ZINC000162425561	402419354	/nfs/dbraw/zinc/41/93/54/402419354.db2.gz	OHSUKZQWPAFWOU-GOSISDBHSA-N	0	3	316.401	2.046	10	0		DEAEHN
C[C@@]1(CNC(=O)C2=COCCO2)CCCN1Cc1ccccc1	ZINC000162425665	402419387	/nfs/dbraw/zinc/41/93/87/402419387.db2.gz	OHSUKZQWPAFWOU-SFHVURJKSA-N	0	3	316.401	2.046	10	0		DEAEHN
COCCC1(CNC(=O)N2CCN3CCC[C@@H]3C2)CCCC1	ZINC000177618089	402420830	/nfs/dbraw/zinc/42/08/30/402420830.db2.gz	MRHLJFNHCMJAOA-OAHLLOKOSA-N	0	3	309.454	2.073	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)N2CC[C@]3(O)CCCC[C@@H]3C2)C1	ZINC000162786547	402432081	/nfs/dbraw/zinc/43/20/81/402432081.db2.gz	FXPMEHCCHPIJIM-JFIYKMOQSA-N	0	3	323.481	2.055	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)N(C[C@@H]1CCCO1)C1CCCC1	ZINC000238041237	402433855	/nfs/dbraw/zinc/43/38/55/402433855.db2.gz	FETUMKVSKGLOKZ-HIFRSBDPSA-N	0	3	312.479	2.032	10	0		DEAEHN
N[C@@H](Cc1ccccc1)C(=O)N1CCO[C@@H](c2cccs2)C1	ZINC000238075495	402436404	/nfs/dbraw/zinc/43/64/04/402436404.db2.gz	QYVMOCBBCPOGSQ-LSDHHAIUSA-N	0	3	316.426	2.218	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Cc1cc(F)ccc1OC	ZINC000186588814	402444866	/nfs/dbraw/zinc/44/48/66/402444866.db2.gz	IIXCHZSOECFREQ-HNNXBMFYSA-N	0	3	308.397	2.320	10	0		DEAEHN
O=C(c1cc(-c2ccc(F)cc2)on1)N1CCN2CCC[C@@H]2C1	ZINC000178061258	402456491	/nfs/dbraw/zinc/45/64/91/402456491.db2.gz	RQOTWBJFEXHLTE-CQSZACIVSA-N	0	3	315.348	2.401	10	0		DEAEHN
COc1cc(C)c(NC(=O)N2CCN3CCC[C@@H]3C2)cc1F	ZINC000186736547	402461431	/nfs/dbraw/zinc/46/14/31/402461431.db2.gz	PZPNXQVJJVCAHR-GFCCVEGCSA-N	0	3	307.369	2.455	10	0		DEAEHN
COc1ccc2nc(C(=O)N(C)CCN(C)C3CC3)ccc2c1	ZINC000186743133	402461483	/nfs/dbraw/zinc/46/14/83/402461483.db2.gz	IMMWTTTYDAZFPU-UHFFFAOYSA-N	0	3	313.401	2.410	10	0		DEAEHN
CC(C)Nc1ncccc1C(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000245452590	402461842	/nfs/dbraw/zinc/46/18/42/402461842.db2.gz	DRVYPGHAUHAIGG-KBPBESRZSA-N	0	3	302.422	2.211	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H]1CCN(c2ccccc2F)C1=O	ZINC000245480667	402464845	/nfs/dbraw/zinc/46/48/45/402464845.db2.gz	XMXXABFTCUFXGN-PBHICJAKSA-N	0	3	319.424	2.347	10	0		DEAEHN
c1ccc(COc2ccnc(N3CCN4CCC[C@H]4C3)n2)cc1	ZINC000245615688	402474219	/nfs/dbraw/zinc/47/42/19/402474219.db2.gz	LPDBVTURGVRUHU-INIZCTEOSA-N	0	3	310.401	2.340	10	0		DEAEHN
CN(C[C@@H]1CCOC1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000245642768	402476133	/nfs/dbraw/zinc/47/61/33/402476133.db2.gz	KTZFTRYBLORYOD-USXIJHARSA-N	0	3	317.433	2.110	10	0		DEAEHN
COC(=O)c1ccc(CN2CCC[C@@H]2Cn2ccnc2C)o1	ZINC000178299806	402481956	/nfs/dbraw/zinc/48/19/56/402481956.db2.gz	MWCXPHLEPCZOJT-CYBMUJFWSA-N	0	3	303.362	2.236	10	0		DEAEHN
COc1ccccc1C[C@H](NCc1nnc(C)n1C)C(C)C	ZINC000178308722	402483441	/nfs/dbraw/zinc/48/34/41/402483441.db2.gz	ZWECLOYWJYOPJR-HNNXBMFYSA-N	0	3	302.422	2.489	10	0		DEAEHN
CCCOc1cccc(CC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000178314507	402484031	/nfs/dbraw/zinc/48/40/31/402484031.db2.gz	BGRRSRVINWYJBH-MRXNPFEDSA-N	0	3	302.418	2.325	10	0		DEAEHN
COc1c(C)cc(CN2CCN(C[C@H](C)O)[C@H](C)C2)cc1C	ZINC000245747029	402485784	/nfs/dbraw/zinc/48/57/84/402485784.db2.gz	NAVOWZBIMCMCJU-CVEARBPZSA-N	0	3	306.450	2.199	10	0		DEAEHN
CCOC(=O)C(C)(C)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245757141	402486549	/nfs/dbraw/zinc/48/65/49/402486549.db2.gz	YQLSAUMKCAANCG-GJZGRUSLSA-N	0	3	318.417	2.137	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NCC(C)(C)N2CCCCC2)CC[C@H]1C	ZINC000187246685	402489869	/nfs/dbraw/zinc/48/98/69/402489869.db2.gz	ANGPQBABECVYFA-HUUCEWRRSA-N	0	3	311.470	2.317	10	0		DEAEHN
COc1ccccc1[C@@H](C)CC(=O)N1CCN2CCC[C@H]2C1	ZINC000245835403	402490445	/nfs/dbraw/zinc/49/04/45/402490445.db2.gz	CROQHNYSOOWRNH-GJZGRUSLSA-N	0	3	302.418	2.495	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CC(C)(C)OC2(C)C)CCN1C	ZINC000245875386	402493519	/nfs/dbraw/zinc/49/35/19/402493519.db2.gz	AMLUKMCYSFVIIJ-MCIONIFRSA-N	0	3	311.470	2.457	10	0		DEAEHN
Cc1n[nH]c(C)c1CC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245910825	402497059	/nfs/dbraw/zinc/49/70/59/402497059.db2.gz	REJHLSDBVVVYJV-AEFFLSMTSA-N	0	3	312.417	2.131	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CC[C@H]3[C@@H](CCCN3C)C2)c(C)o1	ZINC000245919218	402497676	/nfs/dbraw/zinc/49/76/76/402497676.db2.gz	QLWWZVFZVGVEBH-KBPBESRZSA-N	0	3	312.435	2.001	10	0		DEAEHN
O=C1CC[C@@H]2CN(C[C@H](O)c3ccccc3)CC[C@@H]2N1C1CC1	ZINC000245936757	402499083	/nfs/dbraw/zinc/49/90/83/402499083.db2.gz	ZPXURCSZXNUNGZ-NJAFHUGGSA-N	0	3	314.429	2.195	10	0		DEAEHN
C[C@H](C(=O)NCc1ccc(CO)c(F)c1)N1[C@H](C)CC[C@@H]1C	ZINC000245998454	402502561	/nfs/dbraw/zinc/50/25/61/402502561.db2.gz	CYBIAEOMFNURLX-FRRDWIJNSA-N	0	3	308.397	2.196	10	0		DEAEHN
C[C@H](C(=O)N[C@H]1Cc2ccccc2[C@H]1O)N1[C@H](C)CC[C@@H]1C	ZINC000246026022	402504272	/nfs/dbraw/zinc/50/42/72/402504272.db2.gz	WSFOAFXJIXSUMU-BBAXIROVSA-N	0	3	302.418	2.022	10	0		DEAEHN
C/C(=C\C(=O)NC[C@H](O)CN1CCCCC1)c1ccc(F)cc1	ZINC000178508164	402505141	/nfs/dbraw/zinc/50/51/41/402505141.db2.gz	RAFJGXAQJCUWMU-WKOYGUFESA-N	0	3	320.408	2.192	10	0		DEAEHN
C[C@@H](CCc1ccc2c(c1)OCO2)NCc1cc(C(N)=O)co1	ZINC000187715886	402509360	/nfs/dbraw/zinc/50/93/60/402509360.db2.gz	KAEUWXZSLNIDJD-NSHDSACASA-N	0	3	316.357	2.218	10	0		DEAEHN
O=C(CN1CCN2CCC[C@@H]2C1)NCCCC1CCCCC1	ZINC000170958807	402544895	/nfs/dbraw/zinc/54/48/95/402544895.db2.gz	KRIGZPRTLCJXER-QGZVFWFLSA-N	0	3	307.482	2.243	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2C[C@@H]3CCCN3C[C@H]2C)c(C)c1	ZINC000246837253	402546629	/nfs/dbraw/zinc/54/66/29/402546629.db2.gz	CXCJVRJOXBPWMZ-CABCVRRESA-N	0	3	308.447	2.161	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cncc(Br)c1	ZINC000246961070	402551145	/nfs/dbraw/zinc/55/11/45/402551145.db2.gz	DJSIFRIPTUMFCY-MFKMUULPSA-N	0	3	324.222	2.153	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2ccn(Cc3ccccc3)n2)C1	ZINC000171079411	402555254	/nfs/dbraw/zinc/55/52/54/402555254.db2.gz	YLTCBCSBXITHCM-OAHLLOKOSA-N	0	3	313.405	2.099	10	0		DEAEHN
CCC(C)(C)NC(=O)CN1CC[C@H]2[C@@H](CCCN2C2CC2)C1	ZINC000247057480	402555771	/nfs/dbraw/zinc/55/57/71/402555771.db2.gz	ZOTXLGHWNPFLES-HOCLYGCPSA-N	0	3	307.482	2.240	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H]2CCCO[C@H]2C(C)C)C1	ZINC000247098678	402556967	/nfs/dbraw/zinc/55/69/67/402556967.db2.gz	QGYDLHRDLVSDKH-PMPSAXMXSA-N	0	3	311.470	2.221	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCCc1cccc(O)c1	ZINC000171108952	402558705	/nfs/dbraw/zinc/55/87/05/402558705.db2.gz	TWWUDMWMJCNUEE-OAHLLOKOSA-N	0	3	307.438	2.210	10	0		DEAEHN
COc1c(CNCC[C@@](C)(O)c2ccccc2)c(C)nn1C	ZINC000189834795	402561562	/nfs/dbraw/zinc/56/15/62/402561562.db2.gz	NPWHMLWXVHRMJJ-QGZVFWFLSA-N	0	3	303.406	2.125	10	0		DEAEHN
C[C@H](CNC(=O)NC[C@@H]1CCCN1C)COCc1ccccc1	ZINC000171191229	402565510	/nfs/dbraw/zinc/56/55/10/402565510.db2.gz	MQZFHAXUJGOVHY-WBVHZDCISA-N	0	3	319.449	2.233	10	0		DEAEHN
C[C@H](CN[C@H](C)c1cccc(-n2ccnc2)c1)CS(C)(=O)=O	ZINC000189914551	402566946	/nfs/dbraw/zinc/56/69/46/402566946.db2.gz	PYGWVYFCSWMAGP-ZIAGYGMSSA-N	0	3	321.446	2.204	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(-c2cccnc2)on1	ZINC000247461406	402567677	/nfs/dbraw/zinc/56/76/77/402567677.db2.gz	QVNQTKMGCLSMDY-OCCSQVGLSA-N	0	3	312.373	2.045	10	0		DEAEHN
C[C@H](C(=O)N1CCO[C@H](c2nccs2)C1)N1[C@H](C)CC[C@@H]1C	ZINC000247493928	402569528	/nfs/dbraw/zinc/56/95/28/402569528.db2.gz	MGIFJCTVNMEKDW-RQJABVFESA-N	0	3	323.462	2.304	10	0		DEAEHN
O=C(NCCc1ccc(C(F)(F)F)cc1)[C@H]1C[C@H](F)CN1	ZINC000188225643	402517519	/nfs/dbraw/zinc/51/75/19/402517519.db2.gz	JTFTYGOSIUUMQE-NWDGAFQWSA-N	0	3	304.287	2.064	10	0		DEAEHN
CC(C)N(C(=O)CN1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000246261095	402521518	/nfs/dbraw/zinc/52/15/18/402521518.db2.gz	GHWSYUUJCLXYKM-KRWDZBQOSA-N	0	3	301.434	2.208	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NC[C@H]2Cc3ccccc32)CCN1C	ZINC000246328190	402525606	/nfs/dbraw/zinc/52/56/06/402525606.db2.gz	OIIFNZYIOPEEDZ-FVQBIDKESA-N	0	3	301.434	2.450	10	0		DEAEHN
CO[C@@H]1CCCN(C[C@H](O)COCc2ccc(Cl)cc2)C1	ZINC000170817576	402528424	/nfs/dbraw/zinc/52/84/24/402528424.db2.gz	OYTCTJBNMZSICU-JKSUJKDBSA-N	0	3	313.825	2.328	10	0		DEAEHN
CCOC[C@@H](O)CN[C@H](C)c1cnn(-c2ccc(F)cc2)c1C	ZINC000178710145	402529021	/nfs/dbraw/zinc/52/90/21/402529021.db2.gz	ILDWKTFKSMHFAI-WBMJQRKESA-N	0	3	321.396	2.368	10	0		DEAEHN
Cc1ccc(C[C@H](CO)NCc2cnc3nc(C)cc(C)n23)cc1	ZINC000188974464	402529804	/nfs/dbraw/zinc/52/98/04/402529804.db2.gz	OPXQDXDJYZUDMU-QGZVFWFLSA-N	0	3	324.428	2.348	10	0		DEAEHN
CCCOc1ccc(CNC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170828955	402530230	/nfs/dbraw/zinc/53/02/30/402530230.db2.gz	ZMNVRJQXSSAZIR-HNNXBMFYSA-N	0	3	305.422	2.321	10	0		DEAEHN
CCOCc1ccccc1CNC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170829439	402530416	/nfs/dbraw/zinc/53/04/16/402530416.db2.gz	OFXKJLVLOBWQHW-MRXNPFEDSA-N	0	3	305.422	2.069	10	0		DEAEHN
CCOc1ccc(C(=O)N2CC[C@H](N(C)C)C2)cc1OCC	ZINC000170863305	402534155	/nfs/dbraw/zinc/53/41/55/402534155.db2.gz	DFVLWQTVTYSVGB-AWEZNQCLSA-N	0	3	306.406	2.260	10	0		DEAEHN
CCOc1ccc(C(=O)CCC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170862339	402534310	/nfs/dbraw/zinc/53/43/10/402534310.db2.gz	HHVAPYUPTXIHDX-OAHLLOKOSA-N	0	3	318.417	2.211	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cnn(-c3ccc(Cl)cc3)c2)C1	ZINC000170865548	402534944	/nfs/dbraw/zinc/53/49/44/402534944.db2.gz	LFARJSKTVXVMIC-HNNXBMFYSA-N	0	3	318.808	2.302	10	0		DEAEHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)[C@@H]1CCCc2n[nH]cc21	ZINC000246641189	402539264	/nfs/dbraw/zinc/53/92/64/402539264.db2.gz	ULTAHWAQDVDHET-HZSPNIEDSA-N	0	3	304.438	2.066	10	0		DEAEHN
Cc1cccc2[nH]cc(CCNC(=O)NC[C@@H]3CCCN3C)c21	ZINC000171356325	402580317	/nfs/dbraw/zinc/58/03/17/402580317.db2.gz	HRJXWUZUMNMUQL-HNNXBMFYSA-N	0	3	314.433	2.412	10	0		DEAEHN
CC(C)OCCNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248554946	402595491	/nfs/dbraw/zinc/59/54/91/402595491.db2.gz	HVSUIAHQYXDNAR-HOTGVXAUSA-N	0	3	305.422	2.156	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1CCCN1C[C@@H](O)CC(F)(F)F	ZINC000249378163	402627367	/nfs/dbraw/zinc/62/73/67/402627367.db2.gz	PYQVMNQZIJGJNQ-NWDGAFQWSA-N	0	3	305.344	2.487	10	0		DEAEHN
Cc1n[nH]cc1CN1CCC(C(=O)NCc2ccccc2)CC1	ZINC000179750352	402599619	/nfs/dbraw/zinc/59/96/19/402599619.db2.gz	RNYADSDMLYBWKD-UHFFFAOYSA-N	0	3	312.417	2.247	10	0		DEAEHN
C[C@@H]1CN(C2CCN(Cc3cccc4nccn43)CC2)CCO1	ZINC000179784893	402600420	/nfs/dbraw/zinc/60/04/20/402600420.db2.gz	PJRPPEQSAMUHRI-OAHLLOKOSA-N	0	3	314.433	2.019	10	0		DEAEHN
CCCCOC[C@@H](O)CN(CCO)[C@H]1CCc2ccccc21	ZINC000248663655	402602445	/nfs/dbraw/zinc/60/24/45/402602445.db2.gz	ZYESPLNCWRWDIQ-WMZOPIPTSA-N	0	3	307.434	2.146	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(C[C@H](O)COCC(C)C)C1	ZINC000171625445	402602815	/nfs/dbraw/zinc/60/28/15/402602815.db2.gz	SMZJJSCAKJAMIB-HOTGVXAUSA-N	0	3	309.454	2.116	10	0		DEAEHN
Cc1ccc(F)cc1CN1CCC[C@H](C(=O)N2CCOCC2)C1	ZINC000179903097	402602903	/nfs/dbraw/zinc/60/29/03/402602903.db2.gz	PPXYSLPPJQOMEA-HNNXBMFYSA-N	0	3	320.408	2.205	10	0		DEAEHN
Cc1cccc(NC(=O)[C@H](C)N2CCN3CCC[C@@H]3C2)c1C	ZINC000171639337	402604612	/nfs/dbraw/zinc/60/46/12/402604612.db2.gz	SVTIBTMRZGRSNP-JKSUJKDBSA-N	0	3	301.434	2.410	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)[C@@H](C)N2CCN3CCC[C@@H]3C2)c1	ZINC000171640929	402605332	/nfs/dbraw/zinc/60/53/32/402605332.db2.gz	GNMACHLQEXWEHN-HZPDHXFCSA-N	0	3	301.434	2.410	10	0		DEAEHN
CCc1nc2n(n1)C[C@@H](N[C@H]1CCc3ccc(OC)cc31)CC2	ZINC000180608626	402621599	/nfs/dbraw/zinc/62/15/99/402621599.db2.gz	RKWABSFRQIWGNJ-BBRMVZONSA-N	0	3	312.417	2.441	10	0		DEAEHN
Cc1cc(F)ccc1NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000249146220	402622425	/nfs/dbraw/zinc/62/24/25/402622425.db2.gz	GITUDKJEWVFVEB-JSGCOSHPSA-N	0	3	321.396	2.014	10	0		DEAEHN
C[C@@]1(C(=O)Nc2cccc(N3CCOC3=O)c2)CCCCN1	ZINC000180925664	402630704	/nfs/dbraw/zinc/63/07/04/402630704.db2.gz	YNKNABFPRLDVSV-INIZCTEOSA-N	0	3	303.362	2.114	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)NCCCC1CCCC1	ZINC000171901308	402632456	/nfs/dbraw/zinc/63/24/56/402632456.db2.gz	OFWJCZHNEUFXAQ-INIZCTEOSA-N	0	3	311.470	2.367	10	0		DEAEHN
Cc1ccc(-c2cc(C(=O)N3C[C@@H]4CCC[N@H+]4C[C@@H]3C)[n-]n2)o1	ZINC000172056520	402638737	/nfs/dbraw/zinc/63/87/37/402638737.db2.gz	VHLSUHDLKWQUQZ-AAEUAGOBSA-N	0	3	314.389	2.287	10	0		DEAEHN
Cc1ccc(-c2cc(C(=O)N3C[C@@H]4CCC[N@@H+]4C[C@@H]3C)[n-]n2)o1	ZINC000172056520	402638739	/nfs/dbraw/zinc/63/87/39/402638739.db2.gz	VHLSUHDLKWQUQZ-AAEUAGOBSA-N	0	3	314.389	2.287	10	0		DEAEHN
CCC(=O)c1cccc(NC(=O)N2CCO[C@H](CN(C)C)C2)c1	ZINC000181246042	402639131	/nfs/dbraw/zinc/63/91/31/402639131.db2.gz	LMCWUNUFKZYJPV-OAHLLOKOSA-N	0	3	319.405	2.074	10	0		DEAEHN
Cc1ccc2cc(CN3CCN(C[C@H](C)O)[C@@H](C)C3)ccc2n1	ZINC000249985593	402643794	/nfs/dbraw/zinc/64/37/94/402643794.db2.gz	ZBNPFZHMVBFMDF-HOTGVXAUSA-N	0	3	313.445	2.430	10	0		DEAEHN
C[C@H]1CCCN(CCNC(=O)N[C@H]2COc3ccccc32)C1	ZINC000250219787	402646113	/nfs/dbraw/zinc/64/61/13/402646113.db2.gz	YHZZNSJJJRNQTJ-ZFWWWQNUSA-N	0	3	303.406	2.151	10	0		DEAEHN
CCC(C)(C)NC(=O)CN[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000181527826	402648528	/nfs/dbraw/zinc/64/85/28/402648528.db2.gz	XABJRVRLPRMTLY-ZDUSSCGKSA-N	0	3	315.421	2.223	10	0		DEAEHN
Cc1nc(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)sc1C	ZINC000173650091	402706573	/nfs/dbraw/zinc/70/65/73/402706573.db2.gz	HURMKTKXPORPNL-MFKMUULPSA-N	0	3	310.467	2.384	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)Nc1nc2ccccc2[nH]1	ZINC000261648985	402715420	/nfs/dbraw/zinc/71/54/20/402715420.db2.gz	FMVMQVRKQDBFFF-GDKCJGSASA-N	0	3	314.389	2.034	10	0		DEAEHN
Cc1ncsc1CCN1CCCC[C@@H]1CN1CCOCC1	ZINC000172537858	402661420	/nfs/dbraw/zinc/66/14/20/402661420.db2.gz	CGIWFSVBACOJDR-OAHLLOKOSA-N	0	3	309.479	2.181	10	0		DEAEHN
COc1cccc(CCN[C@@H]2CCCC[C@@H]2S(C)(=O)=O)c1	ZINC000182464057	402692131	/nfs/dbraw/zinc/69/21/31/402692131.db2.gz	YOEXFWBCAJTGLG-CVEARBPZSA-N	0	3	311.447	2.183	10	0		DEAEHN
Cc1ccc(C[C@H](C)C(=O)NC[C@H](O)CN2CCCCC2)cc1	ZINC000182556953	402699334	/nfs/dbraw/zinc/69/93/34/402699334.db2.gz	IZDPOZBRSHKTHN-WMZOPIPTSA-N	0	3	318.461	2.137	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCc3c(cccc3OC)C2)C1	ZINC000182584600	402701436	/nfs/dbraw/zinc/70/14/36/402701436.db2.gz	CAIMQHQNQFXMFW-OAHLLOKOSA-N	0	3	317.433	2.247	10	0		DEAEHN
COC(=O)Nc1ccc(NC(=O)N2CC[C@H](N(C)C)C2)cc1F	ZINC000182586653	402701733	/nfs/dbraw/zinc/70/17/33/402701733.db2.gz	NAMUCXBHGIJYBS-NSHDSACASA-N	0	3	324.356	2.172	10	0		DEAEHN
Cn1c2ccc(CNC[C@@H](O)CC(C)(C)C)cc2sc1=O	ZINC000192578270	402738245	/nfs/dbraw/zinc/73/82/45/402738245.db2.gz	LJCPEKNOJQBLHQ-LBPRGKRZSA-N	0	3	308.447	2.487	10	0		DEAEHN
O=C(NCCc1cc(F)ccc1F)C1CCN(C2CC2)CC1	ZINC000192673039	402744067	/nfs/dbraw/zinc/74/40/67/402744067.db2.gz	ZQRBNGFTPXYPJU-UHFFFAOYSA-N	0	3	308.372	2.498	10	0		DEAEHN
COc1ccc(NC(=O)[C@H](C)N[C@@H](C)[C@H]2CCCO2)cc1OC	ZINC000183181731	402745244	/nfs/dbraw/zinc/74/52/44/402745244.db2.gz	UZPQTHWIZAGDSE-SGMGOOAPSA-N	0	3	322.405	2.188	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2C[C@H]2c2cc(F)ccc2F)n1	ZINC000263276739	402753075	/nfs/dbraw/zinc/75/30/75/402753075.db2.gz	SWMUZWFIFOSBFZ-VHRBIJSZSA-N	0	3	320.343	2.195	10	0		DEAEHN
CC(C)Nc1ncccc1C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000174849009	402760305	/nfs/dbraw/zinc/76/03/05/402760305.db2.gz	DRVYPGHAUHAIGG-ZIAGYGMSSA-N	0	3	302.422	2.211	10	0		DEAEHN
COc1ncc(C)cc1NC(=O)NCCN1CCCC[C@@H]1C	ZINC000174973248	402768115	/nfs/dbraw/zinc/76/81/15/402768115.db2.gz	IYNXIAIXZHKDJD-ZDUSSCGKSA-N	0	3	306.410	2.395	10	0		DEAEHN
COC(=O)c1ccc(NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1	ZINC000175000399	402770444	/nfs/dbraw/zinc/77/04/44/402770444.db2.gz	GWXVOZNAQUFPQQ-DOMZBBRYSA-N	0	3	319.405	2.420	10	0		DEAEHN
COc1cc(C)cc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1O	ZINC000175098529	402778978	/nfs/dbraw/zinc/77/89/78/402778978.db2.gz	UCFOPZREHDYVDU-CHWSQXEVSA-N	0	3	306.406	2.264	10	0		DEAEHN
C[C@H](C(=O)N1CCC(c2ccnn2C)CC1)N1CCCCCC1	ZINC000174030650	402724397	/nfs/dbraw/zinc/72/43/97/402724397.db2.gz	ASJRUWXBUAXULU-OAHLLOKOSA-N	0	3	318.465	2.391	10	0		DEAEHN
CCC(CC)[C@@H]1C[C@H](NC(=O)N2CC[C@H](N(C)C)C2)CCO1	ZINC000183729013	402792607	/nfs/dbraw/zinc/79/26/07/402792607.db2.gz	DQZBXTCPJBKQEW-PMPSAXMXSA-N	0	3	311.470	2.316	10	0		DEAEHN
COC[C@@H](NC(=O)N[C@@H](CC(C)C)CN(C)C)c1ccco1	ZINC000175315295	402796430	/nfs/dbraw/zinc/79/64/30/402796430.db2.gz	RHPHKZBFIXFMOA-UONOGXRCSA-N	0	3	311.426	2.243	10	0		DEAEHN
CCCN(CC)CCNS(=O)(=O)c1cccc2ncccc21	ZINC000175361442	402800142	/nfs/dbraw/zinc/80/01/42/402800142.db2.gz	JOHGTGAORFLSRR-UHFFFAOYSA-N	0	3	321.446	2.245	10	0		DEAEHN
COc1cc(C(=O)NC[C@@H]2CCCN2C)ccc1OC(C)C	ZINC000194737906	402813639	/nfs/dbraw/zinc/81/36/39/402813639.db2.gz	YSBPCMAOIOEFRF-AWEZNQCLSA-N	0	3	306.406	2.306	10	0		DEAEHN
Cn1c2ccc(CN3CCCN(C4CC4)CC3)cc2sc1=O	ZINC000194997116	402825740	/nfs/dbraw/zinc/82/57/40/402825740.db2.gz	ZVRZUCLFZLATAR-UHFFFAOYSA-N	0	3	317.458	2.270	10	0		DEAEHN
O=C(NCCC[C@H]1CCCCO1)N1CCCN(C2CC2)CC1	ZINC000184386328	402840111	/nfs/dbraw/zinc/84/01/11/402840111.db2.gz	PQUPJGPJGKMVFB-MRXNPFEDSA-N	0	3	309.454	2.215	10	0		DEAEHN
C[C@@H](NC[C@H]1CN(C)CCO1)c1cc(Br)cs1	ZINC000194091899	402784105	/nfs/dbraw/zinc/78/41/05/402784105.db2.gz	LPPYRBFTWYWLNW-KOLCDFICSA-N	0	3	319.268	2.492	10	0		DEAEHN
CC[C@H]1CN(c2ncnc3ccc(C)cc32)CCN1C[C@@H](C)O	ZINC000266369180	402968977	/nfs/dbraw/zinc/96/89/77/402968977.db2.gz	LJRBNSKVMYYSOJ-CABCVRRESA-N	0	3	314.433	2.220	10	0		DEAEHN
Brc1cnn(CCCCNCc2cncnc2)c1	ZINC000280715032	403029809	/nfs/dbraw/zinc/02/98/09/403029809.db2.gz	XMQXKIUNIDYQIG-UHFFFAOYSA-N	0	3	310.199	2.006	10	0		DEAEHN
CN(C[C@@H](O)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000274148697	403031393	/nfs/dbraw/zinc/03/13/93/403031393.db2.gz	KQCPEFOEZJPFFH-UONOGXRCSA-N	0	3	302.340	2.116	10	0		DEAEHN
CN(Cc1ccccn1)[C@@H]1CCCN(Cc2csnn2)CC1	ZINC000275862206	403129025	/nfs/dbraw/zinc/12/90/25/403129025.db2.gz	XOWQMXMEULCBRZ-MRXNPFEDSA-N	0	3	317.462	2.420	10	0		DEAEHN
C[NH+](C)[C@@H]1CCN(C2Cc3ccccc3C2)C[C@@H]1CCC(=O)[O-]	ZINC000299780475	403573345	/nfs/dbraw/zinc/57/33/45/403573345.db2.gz	BFWOIETXGTVPCY-FUHWJXTLSA-N	0	3	316.445	2.271	10	0		DEAEHN
CN(C)[C@@H]1CC[N@@H+](C2Cc3ccccc3C2)C[C@@H]1CCC(=O)[O-]	ZINC000299780475	403573347	/nfs/dbraw/zinc/57/33/47/403573347.db2.gz	BFWOIETXGTVPCY-FUHWJXTLSA-N	0	3	316.445	2.271	10	0		DEAEHN
CN(C)[C@@H]1CC[N@H+](C2Cc3ccccc3C2)C[C@@H]1CCC(=O)[O-]	ZINC000299780475	403573350	/nfs/dbraw/zinc/57/33/50/403573350.db2.gz	BFWOIETXGTVPCY-FUHWJXTLSA-N	0	3	316.445	2.271	10	0		DEAEHN
C[C@@H](NC(=O)c1snnc1C(C)(C)C)C1=CCN(C)CC1	ZINC000333291718	403717771	/nfs/dbraw/zinc/71/77/71/403717771.db2.gz	KRCSBVPNHMAIKB-SNVBAGLBSA-N	0	3	308.451	2.216	10	0		DEAEHN
C(CN1CCO[C@@H](C2CCC2)C1)CN1CCO[C@@H](C2CCC2)C1	ZINC000411846680	403990983	/nfs/dbraw/zinc/99/09/83/403990983.db2.gz	LWVGOQBOUVHEQM-RTBURBONSA-N	0	3	322.493	2.378	10	0		DEAEHN
Cc1c[nH]nc1CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C	ZINC000289464050	403974427	/nfs/dbraw/zinc/97/44/27/403974427.db2.gz	IJMBBDBVNJTCJZ-STQMWFEESA-N	0	3	308.426	2.453	10	0		DEAEHN
Cn1nccc1[C@H]1CCC[C@@H](NCc2nnc3ccccn32)C1	ZINC000363923430	404252642	/nfs/dbraw/zinc/25/26/42/404252642.db2.gz	GUKAJKACEGJKLP-UONOGXRCSA-N	0	3	310.405	2.279	10	0		DEAEHN
C([C@@H]1CCOC1)N1CCN(C[C@@H]2CCOC2)C2(CCCCC2)C1	ZINC000370086046	404329358	/nfs/dbraw/zinc/32/93/58/404329358.db2.gz	CXYJHCJMJCPBLD-ROUUACIJSA-N	0	3	322.493	2.380	10	0		DEAEHN
c1cncc(-c2nc3c(c(N4CCN5CCC4CC5)n2)CCC3)c1	ZINC000344805007	404378588	/nfs/dbraw/zinc/37/85/88/404378588.db2.gz	CVSARNJAMNSJRU-UHFFFAOYSA-N	0	3	321.428	2.312	10	0		DEAEHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)N(C)CCCO)CC1	ZINC000370242508	404379983	/nfs/dbraw/zinc/37/99/83/404379983.db2.gz	SBUZFEAIJSBKDU-HNNXBMFYSA-N	0	3	319.449	2.236	10	0		DEAEHN
Cc1nc(C)n(C[C@H]2CCCN2Cc2ccc3c(c2)CCO3)n1	ZINC000365253123	404586047	/nfs/dbraw/zinc/58/60/47/404586047.db2.gz	KWDGNSZQYUYSGQ-QGZVFWFLSA-N	0	3	312.417	2.494	10	0		DEAEHN
CC(=O)c1cccc(OC[C@H](O)CN(C(C)C)[C@@H]2CCOC2)c1	ZINC000291953156	404597573	/nfs/dbraw/zinc/59/75/73/404597573.db2.gz	UQDHVGGJMKPNKV-IAGOWNOFSA-N	0	3	321.417	2.128	10	0		DEAEHN
C[C@@H](C(=O)N1C[C@@]2(CCOC2)OC(C)(C)C1)N1[C@H](C)CC[C@@H]1C	ZINC000358234732	404757039	/nfs/dbraw/zinc/75/70/39/404757039.db2.gz	JCLJQADGTSZIBN-JTOWHCCKSA-N	0	3	324.465	2.044	10	0		DEAEHN
CCCNC(=O)[C@H]1CCCN(Cc2ccc(-c3cc[nH]n3)o2)C1	ZINC000435132577	404957810	/nfs/dbraw/zinc/95/78/10/404957810.db2.gz	YDFIJHCLNLZKIP-ZDUSSCGKSA-N	0	3	316.405	2.408	10	0		DEAEHN
C[C@H]1CCOCCN1C(=O)NC[C@H](c1ccccc1)N(C)C	ZINC000378496470	404982990	/nfs/dbraw/zinc/98/29/90/404982990.db2.gz	KATPIPGZXMTNAP-GOEBONIOSA-N	0	3	305.422	2.110	10	0		DEAEHN
CN(C)CCOc1ccccc1CNC(=O)N1CCC12CCC2	ZINC000435502188	404986135	/nfs/dbraw/zinc/98/61/35/404986135.db2.gz	QGWMAUVNPYNAKU-UHFFFAOYSA-N	0	3	317.433	2.465	10	0		DEAEHN
CCN1CC[C@H](NC(=O)c2csc(Br)c2)C1	ZINC000389866503	405041596	/nfs/dbraw/zinc/04/15/96/405041596.db2.gz	YUCSLTRKLBZSAW-VIFPVBQESA-N	0	3	303.225	2.335	10	0		DEAEHN
Cc1cc(=O)[nH]c(C(=O)N2CCN(C3CCC(C)CC3)CC2)c1	ZINC000408010103	405089386	/nfs/dbraw/zinc/08/93/86/405089386.db2.gz	VZWHZBARNXVFHH-UHFFFAOYSA-N	0	3	317.433	2.432	10	0		DEAEHN
CCS(=O)(=O)C[C@@H](C)N[C@H]1CCOC2(CCCCC2)C1	ZINC000408102873	405113029	/nfs/dbraw/zinc/11/30/29/405113029.db2.gz	DOHOZMIXKYMFNI-KGLIPLIRSA-N	0	3	303.468	2.281	10	0		DEAEHN
C[C@H](NCCc1cn(C)cn1)c1cncc(Br)c1	ZINC000577627586	405483930	/nfs/dbraw/zinc/48/39/30/405483930.db2.gz	BJWHGQRFUDKNEO-JTQLQIEISA-N	0	3	309.211	2.471	10	0		DEAEHN
CCc1noc(C)c1CN1CC2(CCOCC2)CC[C@@H]1CO	ZINC000528637915	405689987	/nfs/dbraw/zinc/68/99/87/405689987.db2.gz	HOOLKTVHQUGPKL-CQSZACIVSA-N	0	3	308.422	2.299	10	0		DEAEHN
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)C1=COCCC1	ZINC000583621750	405778403	/nfs/dbraw/zinc/77/84/03/405778403.db2.gz	HWQNEQAEFWGWQE-RDJZCZTQSA-N	0	3	315.417	2.227	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NC[C@@H](C)N1CCCC1)CC2	ZINC000530473585	405809451	/nfs/dbraw/zinc/80/94/51/405809451.db2.gz	AXBHURISBZQFAC-KGLIPLIRSA-N	0	3	318.465	2.239	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NC[C@@H](C)N1CCCC1)C2	ZINC000530473585	405809457	/nfs/dbraw/zinc/80/94/57/405809457.db2.gz	AXBHURISBZQFAC-KGLIPLIRSA-N	0	3	318.465	2.239	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)NC[C@H](CC(C)C)N(C)C)c1	ZINC000457552287	405894765	/nfs/dbraw/zinc/89/47/65/405894765.db2.gz	HDBUXAUAZLAJNI-INIZCTEOSA-N	0	3	320.433	2.488	10	0		DEAEHN
CCC(=O)N[C@@H]1CCCN(C[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450327885	405837446	/nfs/dbraw/zinc/83/74/46/405837446.db2.gz	NLIYBLPYZAGUKN-UAGQMJEPSA-N	0	3	304.434	2.142	10	0		DEAEHN
Cc1cc(NC(=O)N(C)CC2CC2)n(C2CCN(C)CC2)n1	ZINC000531187657	405923632	/nfs/dbraw/zinc/92/36/32/405923632.db2.gz	NUEDVAODKBDJQU-UHFFFAOYSA-N	0	3	305.426	2.332	10	0		DEAEHN
COc1nsc(CNC[C@H](C)CCCO)c1Br	ZINC000639220519	405982872	/nfs/dbraw/zinc/98/28/72/405982872.db2.gz	DLAAOENAIAMONU-MRVPVSSYSA-N	0	3	323.256	2.412	10	0		DEAEHN
C[C@H](c1ccccc1)[C@H](O)CN1C[C@@]2(CCOC2)OC(C)(C)C1	ZINC000450897484	405985122	/nfs/dbraw/zinc/98/51/22/405985122.db2.gz	QALPZPQXIYAXCV-SZVBFZGTSA-N	0	3	319.445	2.421	10	0		DEAEHN
Cc1csc([C@H](C)NC(=O)N[C@H]2CN(C3CC3)C[C@H]2C)n1	ZINC000532060541	406039559	/nfs/dbraw/zinc/03/95/59/406039559.db2.gz	JSLFJKQGWFMXAO-CDMKHQONSA-N	0	3	308.451	2.294	10	0		DEAEHN
CCN1CCCC[C@H]1CNCc1c(Br)cnn1C	ZINC000487280703	406220900	/nfs/dbraw/zinc/22/09/00/406220900.db2.gz	RTPBGUPMTKCJAG-NSHDSACASA-N	0	3	315.259	2.147	10	0		DEAEHN
COCCC1(CNCc2c(Br)cnn2C)CCC1	ZINC000487288241	406220970	/nfs/dbraw/zinc/22/09/70/406220970.db2.gz	MFDYVRAIWBIBKO-UHFFFAOYSA-N	0	3	316.243	2.479	10	0		DEAEHN
O=C(NCc1ccc(Cn2ccnc2)cc1)[C@H]1CCCN1C1CC1	ZINC000570502118	406401692	/nfs/dbraw/zinc/40/16/92/406401692.db2.gz	SZBNTAUCNYMYMQ-GOSISDBHSA-N	0	3	324.428	2.174	10	0		DEAEHN
Cc1ccsc1CNC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637907396	406472210	/nfs/dbraw/zinc/47/22/10/406472210.db2.gz	LNXIBUVSXUXKQL-OAHLLOKOSA-N	0	3	317.458	2.132	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N(C)c1ccc(F)cc1	ZINC000637931725	406482925	/nfs/dbraw/zinc/48/29/25/406482925.db2.gz	PJAXFSQWJXYHQT-QGZVFWFLSA-N	0	3	315.392	2.248	10	0		DEAEHN
c1cc2c(ncnc2N2CCN(CCC[C@@H]3CCO3)CC2)s1	ZINC000637890742	406464629	/nfs/dbraw/zinc/46/46/29/406464629.db2.gz	XCSSEQCYDTZVNC-CYBMUJFWSA-N	0	3	318.446	2.382	10	0		DEAEHN
O=C1C[C@@H](CNCc2ccccn2)[C@H](c2cccnc2)N1C1CC1	ZINC000571800400	406568544	/nfs/dbraw/zinc/56/85/44/406568544.db2.gz	ZLXCQPMOCPNENX-KXBFYZLASA-N	0	3	322.412	2.318	10	0		DEAEHN
CCCC1(CNC(=O)[C@H](N)CN(C)Cc2ccccc2)CC1	ZINC000638045739	406541359	/nfs/dbraw/zinc/54/13/59/406541359.db2.gz	VYNIARMWOKQDTB-MRXNPFEDSA-N	0	3	303.450	2.142	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)[C@H]1C	ZINC000637971508	406502437	/nfs/dbraw/zinc/50/24/37/406502437.db2.gz	WCKAOOCEEAUYQY-VYDXJSESSA-N	0	3	303.450	2.093	10	0		DEAEHN
c1ccc(N2CC[C@@H](CN3CCOC4(CCOCC4)C3)C2)cc1	ZINC000638167743	406603318	/nfs/dbraw/zinc/60/33/18/406603318.db2.gz	HJGKQCSUHJEXLD-KRWDZBQOSA-N	0	3	316.445	2.394	10	0		DEAEHN
CC[C@@H]1CC[C@H](C)N1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638313476	406693532	/nfs/dbraw/zinc/69/35/32/406693532.db2.gz	XAMDBVYSNYQFMP-UAGQMJEPSA-N	0	3	303.450	2.235	10	0		DEAEHN
c1nc2cnccn2c1CNCC[C@@H]1COc2ccccc2O1	ZINC000553581107	406766027	/nfs/dbraw/zinc/76/60/27/406766027.db2.gz	RWNPQXXHBZAXFK-CQSZACIVSA-N	0	3	310.357	2.049	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)N2CCC(C3CCOCC3)CC2)CCN1C	ZINC000554587495	406814797	/nfs/dbraw/zinc/81/47/97/406814797.db2.gz	ARXMABWECISCFK-WMLDXEAASA-N	0	3	323.481	2.317	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)CCC(C)(C)C	ZINC000173832595	287224909	/nfs/dbraw/zinc/22/49/09/287224909.db2.gz	VAJVETNWLZYNIX-ZIAGYGMSSA-N	0	3	302.484	2.311	10	0		DEAEHN
CCN(CC)c1ncc(CNCC[C@H](C)[S@@](C)=O)s1	ZINC000129399704	196044664	/nfs/dbraw/zinc/04/46/64/196044664.db2.gz	MZEBODCLPCSDEG-WLRWDXFRSA-N	0	3	303.497	2.236	10	0		DEAEHN
CN(CC[C@@H]1COCCN1)Cc1ccccc1Br	ZINC000129402667	196044875	/nfs/dbraw/zinc/04/48/75/196044875.db2.gz	SLRJYOXSMGLHDX-CYBMUJFWSA-N	0	3	313.239	2.259	10	0		DEAEHN
CSCC[C@H](N)C(=O)Nc1ncc(Br)cc1C	ZINC000129563244	196058232	/nfs/dbraw/zinc/05/82/32/196058232.db2.gz	UMMRAEWYKXJXOL-VIFPVBQESA-N	0	3	318.240	2.171	10	0		DEAEHN
CC(C)(C(=O)N1CCC[C@@H]1c1cccs1)N1CCNCC1	ZINC000129645114	196064619	/nfs/dbraw/zinc/06/46/19/196064619.db2.gz	JGKVVHMTJYDADK-CYBMUJFWSA-N	0	3	307.463	2.095	10	0		DEAEHN
CC[C@@H]1N[C@H](c2cccs2)N(C[C@@H](C)N2CCCC2)C1=O	ZINC000130780121	196109910	/nfs/dbraw/zinc/10/99/10/196109910.db2.gz	RJWUYDPUSUJIGM-IPYPFGDCSA-N	0	3	307.463	2.441	10	0		DEAEHN
COc1nc2sccn2c1CNCC1(CO)CCCCC1	ZINC000130803110	196111223	/nfs/dbraw/zinc/11/12/23/196111223.db2.gz	PBBGLMFGLHWXTQ-UHFFFAOYSA-N	0	3	309.435	2.437	10	0		DEAEHN
CN[C@@H](C)c1cccc(S(=O)(=O)N[C@H](C)CCSC)c1	ZINC000131238737	196151856	/nfs/dbraw/zinc/15/18/56/196151856.db2.gz	VLUHEMLVCHHFLY-NEPJUHHUSA-N	0	3	316.492	2.387	10	0		DEAEHN
CN(CCN1CCCN(c2cccnn2)CC1)c1ccccc1	ZINC000131438896	196169138	/nfs/dbraw/zinc/16/91/38/196169138.db2.gz	YRLVFIMPIXHQJH-UHFFFAOYSA-N	0	3	311.433	2.125	10	0		DEAEHN
CN[C@H](Cc1cccc(F)c1F)[C@H]1CCCCS1(=O)=O	ZINC000131482942	196173392	/nfs/dbraw/zinc/17/33/92/196173392.db2.gz	UKRMGSRYWIVYPU-CHWSQXEVSA-N	0	3	303.374	2.063	10	0		DEAEHN
CCN[C@H](Cc1cccc(F)c1F)[C@H]1CCCCS1(=O)=O	ZINC000131484621	196173888	/nfs/dbraw/zinc/17/38/88/196173888.db2.gz	MNTJOEKLTMRWJB-ZIAGYGMSSA-N	0	3	317.401	2.453	10	0		DEAEHN
CN[C@@H](Cc1cccc(F)c1F)[C@@H]1CCCCS1(=O)=O	ZINC000131482362	196173965	/nfs/dbraw/zinc/17/39/65/196173965.db2.gz	UKRMGSRYWIVYPU-STQMWFEESA-N	0	3	303.374	2.063	10	0		DEAEHN
C[C@@H](CN(C)C)N1C(=O)C2(CCCC2)N[C@H]1c1ccsc1	ZINC000131647986	196186882	/nfs/dbraw/zinc/18/68/82/196186882.db2.gz	PNPLKTGRLAMIMQ-GXTWGEPZSA-N	0	3	307.463	2.441	10	0		DEAEHN
COc1ccc(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c([O-])c1	ZINC000131859906	196204631	/nfs/dbraw/zinc/20/46/31/196204631.db2.gz	GZOHCJMXDCYCCR-YHWZYXNKSA-N	0	3	304.390	2.146	10	0		DEAEHN
COc1ccc(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c([O-])c1	ZINC000131859906	196204633	/nfs/dbraw/zinc/20/46/33/196204633.db2.gz	GZOHCJMXDCYCCR-YHWZYXNKSA-N	0	3	304.390	2.146	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)c1ccc2[nH]cnc2c1	ZINC000132183899	196233634	/nfs/dbraw/zinc/23/36/34/196233634.db2.gz	JGYYHJDCQHTOFQ-INIZCTEOSA-N	0	3	322.412	2.466	10	0		DEAEHN
COC[C@](C)(CCO)NCCOc1ccc(C(F)(F)F)cc1	ZINC000132543027	196264560	/nfs/dbraw/zinc/26/45/60/196264560.db2.gz	YGWZHHVDYAISMD-AWEZNQCLSA-N	0	3	321.339	2.461	10	0		DEAEHN
CC[C@@H](NCCNC(N)=O)c1ccc(Br)cc1	ZINC000132781972	196283411	/nfs/dbraw/zinc/28/34/11/196283411.db2.gz	UCOAGHRJUXEANZ-LLVKDONJSA-N	0	3	300.200	2.158	10	0		DEAEHN
Cc1cnn(CCN[C@H]2CCN(c3ccc(Cl)cc3)C2=O)c1	ZINC000132974181	196301230	/nfs/dbraw/zinc/30/12/30/196301230.db2.gz	SVEDWAUIMYZCHS-HNNXBMFYSA-N	0	3	318.808	2.240	10	0		DEAEHN
CCN[C@H](Cc1cc(C)ccc1OC)C(C)(C)S(C)(=O)=O	ZINC000133171837	196318332	/nfs/dbraw/zinc/31/83/32/196318332.db2.gz	ILBCVWVMFHVDDQ-OAHLLOKOSA-N	0	3	313.463	2.347	10	0		DEAEHN
COc1ccc(C(C)(C)C(=O)N2CC[C@@H](N(C)C)C2)cc1OC	ZINC000134265851	196374750	/nfs/dbraw/zinc/37/47/50/196374750.db2.gz	WDVCGGISIUBHDJ-CQSZACIVSA-N	0	3	320.433	2.144	10	0		DEAEHN
Cc1ccccc1S(=O)(=O)N[C@](C)(CN)c1ccccc1	ZINC000134472294	196393890	/nfs/dbraw/zinc/39/38/90/196393890.db2.gz	CFTRCGJBLXIJHJ-MRXNPFEDSA-N	0	3	304.415	2.147	10	0		DEAEHN
CCn1c(CN[C@@H]2CCCC[C@@H]2C(N)=O)nc2cc(F)ccc21	ZINC000184822227	224942770	/nfs/dbraw/zinc/94/27/70/224942770.db2.gz	GDIUXGQWWQALBV-QWHCGFSZSA-N	0	3	318.396	2.329	10	0		DEAEHN
C[C@@H]1CC(O)C[C@@H](C)N1CCOCC(F)(F)C(F)(F)F	ZINC000191168392	225105918	/nfs/dbraw/zinc/10/59/18/225105918.db2.gz	UGIXCLCSVUCCNH-RKDXNWHRSA-N	0	3	305.287	2.434	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(CC1CCC1)C(C)C	ZINC000193653342	225166006	/nfs/dbraw/zinc/16/60/06/225166006.db2.gz	RHEFJQIRSBNCCM-MRXNPFEDSA-N	0	3	311.470	2.317	10	0		DEAEHN
COCCN1CCC(NC(=O)Nc2ccc3cc[nH]c3c2)CC1	ZINC000194315836	225178876	/nfs/dbraw/zinc/17/88/76/225178876.db2.gz	RAKBDBYWAUZSCW-UHFFFAOYSA-N	0	3	316.405	2.400	10	0		DEAEHN
O=C(c1cc(Br)cs1)N1CCN2CCC[C@@H]2C1	ZINC000195338940	225204358	/nfs/dbraw/zinc/20/43/58/225204358.db2.gz	QOGDQIQSBQNSLK-SNVBAGLBSA-N	0	3	315.236	2.431	10	0		DEAEHN
c1ncn2cc(CNCc3ccccc3N3CCOCC3)ccc12	ZINC000297628818	227389314	/nfs/dbraw/zinc/38/93/14/227389314.db2.gz	WLPCNAAARJNJRJ-UHFFFAOYSA-N	0	3	322.412	2.461	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC[C@H](c2c[nH]nc2N)CC1	ZINC000616629965	422515792	/nfs/dbraw/zinc/51/57/92/422515792.db2.gz	XDDGAOHCTSPXTQ-LBPRGKRZSA-N	0	3	323.441	2.086	10	0		DEAEHN
CCOC(=O)c1cc(NCCN2CC=C(C)CC2)ncc1Cl	ZINC000359567911	424830839	/nfs/dbraw/zinc/83/08/39/424830839.db2.gz	WHLVTAAVWFGSGJ-UHFFFAOYSA-N	0	3	323.824	2.976	10	0		DEAEHN
Cc1nc(C)n(C[C@H]2CCCN(CCOCC(F)(F)F)C2)n1	ZINC000105885476	424849472	/nfs/dbraw/zinc/84/94/72/424849472.db2.gz	SQIZCODGWCEPBN-ZDUSSCGKSA-N	0	3	320.359	2.186	10	0		DEAEHN
Cc1ccc([C@@H](C)NC(=O)NC[C@H](O)CN2CCCCC2)cc1	ZINC000194452084	424876233	/nfs/dbraw/zinc/87/62/33/424876233.db2.gz	YSEYBUCWJNIEGJ-WBVHZDCISA-N	0	3	319.449	2.202	10	0		DEAEHN
CC(C)C(=O)N1CCO[C@H]2CCN(Cc3ccccc3)C[C@@H]21	ZINC000404151857	424925612	/nfs/dbraw/zinc/92/56/12/424925612.db2.gz	QBZASLDSHIVVRU-IRXDYDNUSA-N	0	3	302.418	2.144	10	0		DEAEHN
COc1c(CNC[C@@H]2CCN2Cc2ccccc2)c(C)nn1C	ZINC000657808661	425404921	/nfs/dbraw/zinc/40/49/21/425404921.db2.gz	ZNDVSCMEWAKFDU-INIZCTEOSA-N	0	3	314.433	2.101	10	0		DEAEHN
Cc1ccc(SCC(=O)N(C)[C@H](CN)C(F)(F)F)cc1	ZINC000662976379	425770405	/nfs/dbraw/zinc/77/04/05/425770405.db2.gz	OWPRYIDDYUTABX-LLVKDONJSA-N	0	3	306.353	2.435	10	0		DEAEHN
Brc1cnn(C2CCN([C@H]3CCOC3)CC2)c1	ZINC000363461694	269063702	/nfs/dbraw/zinc/06/37/02/269063702.db2.gz	WSWGBQUETAEGRM-LBPRGKRZSA-N	0	3	300.200	2.071	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)c2cccc(Br)c2F)C1	ZINC000390015305	269097159	/nfs/dbraw/zinc/09/71/59/269097159.db2.gz	UQEMPCUBVKGEGY-SECBINFHSA-N	0	3	315.186	2.412	10	0		DEAEHN
CCC[C@@H](C(=O)NCC1CCN(CC(F)(F)F)CC1)N(C)C	ZINC000186990922	273616699	/nfs/dbraw/zinc/61/66/99/273616699.db2.gz	DRIDPBDYGPUWRM-ZDUSSCGKSA-N	0	3	323.403	2.107	10	0		DEAEHN
Cn1ccnc1[C@@H](NCCCNC(=O)c1cccs1)C1CC1	ZINC000183325625	274897380	/nfs/dbraw/zinc/89/73/80/274897380.db2.gz	NISVWNAZXDZJAS-AWEZNQCLSA-N	0	3	318.446	2.342	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCC(N[C@H]2CCCn3ncnc32)CC1	ZINC000152502927	275518492	/nfs/dbraw/zinc/51/84/92/275518492.db2.gz	SLGYYUCNCKDNHE-ZDUSSCGKSA-N	0	3	321.425	2.102	10	0		DEAEHN
CC1(C)C[C@H](NCC(=O)N2CCO[C@@H]3CCCC[C@H]32)C(C)(C)O1	ZINC000249483902	275867117	/nfs/dbraw/zinc/86/71/17/275867117.db2.gz	XOQBRHQNYWVGNF-KFWWJZLASA-N	0	3	324.465	2.092	10	0		DEAEHN
CCN(CCNC(=O)N1CC[C@@H](C(F)(F)F)[C@@H]1C)C1CC1	ZINC000471816322	276126663	/nfs/dbraw/zinc/12/66/63/276126663.db2.gz	NCQUKIXGMWDAPL-CMPLNLGQSA-N	0	3	307.360	2.453	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)Nc1cc(C)ccc1OC	ZINC000175357773	276182609	/nfs/dbraw/zinc/18/26/09/276182609.db2.gz	DXKIJIXULZUQAH-HNNXBMFYSA-N	0	3	319.449	2.358	10	0		DEAEHN
C[C@@H]1NC(=S)N(C[C@H]2CCCN(C)[C@H]2c2cccs2)C1=O	ZINC000369676929	279029545	/nfs/dbraw/zinc/02/95/45/279029545.db2.gz	BMPJEGMOMIDKBQ-DMDPSCGWSA-N	0	3	323.487	2.236	10	0		DEAEHN
CC(C)C[C@H](C)S(=O)(=O)N1CCC[C@H]1CN1CCCC1	ZINC000246324152	279117381	/nfs/dbraw/zinc/11/73/81/279117381.db2.gz	FXLNARXQJUMJAH-GJZGRUSLSA-N	0	3	302.484	2.311	10	0		DEAEHN
Cc1ncc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c(C(C)C)n1	ZINC000177143555	279150872	/nfs/dbraw/zinc/15/08/72/279150872.db2.gz	BRUSBCFSVSGWTB-SWLSCSKDSA-N	0	3	304.438	2.367	10	0		DEAEHN
C[C@H](C(=O)NC[C@H]1CCCO1)N1CCC[C@@]2(CC=CCC2)C1	ZINC000114563972	279226029	/nfs/dbraw/zinc/22/60/29/279226029.db2.gz	GMZJRYXFCJZVBJ-NUJGCVRESA-N	0	3	306.450	2.492	10	0		DEAEHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)[C@@H]1CCCc2n[nH]cc21	ZINC000133491691	279308629	/nfs/dbraw/zinc/30/86/29/279308629.db2.gz	ULTAHWAQDVDHET-MGPQQGTHSA-N	0	3	304.438	2.066	10	0		DEAEHN
CCOC(C)(C)CNC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000187698152	279647433	/nfs/dbraw/zinc/64/74/33/279647433.db2.gz	WXEAYSSTQGIEBN-MRXNPFEDSA-N	0	3	321.465	2.274	10	0		DEAEHN
CCOC(C)(C)CNC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000187698132	279647497	/nfs/dbraw/zinc/64/74/97/279647497.db2.gz	WXEAYSSTQGIEBN-INIZCTEOSA-N	0	3	321.465	2.274	10	0		DEAEHN
Cc1c(CNC[C@H]2CCCN2C(=O)OC(C)(C)C)cnn1C	ZINC000229809658	280226941	/nfs/dbraw/zinc/22/69/41/280226941.db2.gz	WCBZASLEZDUVEA-CQSZACIVSA-N	0	3	308.426	2.218	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN(C[C@H](O)COC(C)(C)C)C2)n1	ZINC000151111223	281246997	/nfs/dbraw/zinc/24/69/97/281246997.db2.gz	XQUQOJNQFWHDFW-CVEARBPZSA-N	0	3	321.465	2.300	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(C)cc1	ZINC000173830528	288312616	/nfs/dbraw/zinc/31/26/16/288312616.db2.gz	VPTUCRHYBXSBKM-LSDHHAIUSA-N	0	3	308.447	2.242	10	0		DEAEHN
Cc1ccccc1NC(=O)C[C@H](C)NCC1(C)OCCCO1	ZINC000190665202	281349975	/nfs/dbraw/zinc/34/99/75/281349975.db2.gz	PWLHJDGTBVZJBH-AWEZNQCLSA-N	0	3	306.406	2.455	10	0		DEAEHN
CCCNC(=O)CCCC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000104825674	281657533	/nfs/dbraw/zinc/65/75/33/281657533.db2.gz	YDSPKBQNGVFUOF-INIZCTEOSA-N	0	3	319.449	2.102	10	0		DEAEHN
C[C@H](CCNCc1cc(Cl)c2c(c1)OCCO2)[S@](C)=O	ZINC000129384434	281910598	/nfs/dbraw/zinc/91/05/98/281910598.db2.gz	AEPYPICSRUVAPJ-CFMSYZGJSA-N	0	3	317.838	2.358	10	0		DEAEHN
CC[C@](C)(CCO)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000153803353	288389181	/nfs/dbraw/zinc/38/91/81/288389181.db2.gz	NMNJYGBKNRFROA-FUHWJXTLSA-N	0	3	321.465	2.010	10	0		DEAEHN
CO[C@@]1(C)C[C@H](NC(=O)N2CCCN(C3CC3)CC2)C1(C)C	ZINC000074943821	294161576	/nfs/dbraw/zinc/16/15/76/294161576.db2.gz	SXRNRVGFCFCQLT-YOEHRIQHSA-N	0	3	309.454	2.070	10	0		DEAEHN
C[C@H](CN[C@H]1CCCOc2ccc(F)cc21)N1CCOCC1	ZINC000123286804	298791645	/nfs/dbraw/zinc/79/16/45/298791645.db2.gz	AGQHKVOQGLPAHM-CJNGLKHVSA-N	0	3	308.397	2.350	10	0		DEAEHN
C[C@H]1CN(CCN2CCC[C@@H]2c2ccc3c(c2)OCO3)CCO1	ZINC000191477747	300258784	/nfs/dbraw/zinc/25/87/84/300258784.db2.gz	KAWCXMUBMRNNQT-GOEBONIOSA-N	0	3	318.417	2.273	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cccnc1Br	ZINC000135561768	300314989	/nfs/dbraw/zinc/31/49/89/300314989.db2.gz	XFTKYJIGORPUIJ-WDEREUQCSA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@H]1C[NH2+]CC[C@H]1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000262765625	300326093	/nfs/dbraw/zinc/32/60/93/300326093.db2.gz	KRVKJDNMSNXDNF-QPUJVOFHSA-N	0	3	323.245	2.270	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNC[C@@H]1CSCCS1	ZINC000291953938	304865295	/nfs/dbraw/zinc/86/52/95/304865295.db2.gz	OKWFSKMEDQTCMO-OAHLLOKOSA-N	0	3	320.487	2.265	10	0		DEAEHN
CCOc1cccc(CNC[C@@H]2CCC3(CCOCC3)[C@@H]2O)n1	ZINC000577126306	326344671	/nfs/dbraw/zinc/34/46/71/326344671.db2.gz	KRDFGDRBCJVCJS-WMLDXEAASA-N	0	3	320.433	2.138	10	0		DEAEHN
CCc1nc(C(C)(C)NC(=O)NC[C@H]2CCCCN2CC)no1	ZINC000577336548	326357718	/nfs/dbraw/zinc/35/77/18/326357718.db2.gz	TUAYROYDRROJIY-GFCCVEGCSA-N	0	3	323.441	2.041	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1	ZINC000189977547	336257614	/nfs/dbraw/zinc/25/76/14/336257614.db2.gz	CJQHZYBDPIDBQZ-FRRDWIJNSA-N	0	3	318.421	2.076	10	0		DEAEHN
CN1C[C@H](C(O)(c2cccs2)c2cccs2)C[C@H](O)C1	ZINC000584631761	337377096	/nfs/dbraw/zinc/37/70/96/337377096.db2.gz	UAQNWQBJYFDZLR-NEPJUHHUSA-N	0	3	309.456	2.358	10	0		DEAEHN
CCOC(=O)C(C(=O)OCC)[C@H](c1cccc(C)c1)N(C)C	ZINC000584651115	337380919	/nfs/dbraw/zinc/38/09/19/337380919.db2.gz	MUTBYKGKKSPOGP-HNNXBMFYSA-N	0	3	307.390	2.340	10	0		DEAEHN
CC(C)Nc1ncccc1C(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000247273659	519742650	/nfs/dbraw/zinc/74/26/50/519742650.db2.gz	KACQNKPWEAUPPE-UKRRQHHQSA-N	0	3	304.438	2.360	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@H](c2cccc(O)c2)C1)N(C)C	ZINC000158250374	520582685	/nfs/dbraw/zinc/58/26/85/520582685.db2.gz	QAVHOEVHWQFWQG-HOTGVXAUSA-N	0	3	306.406	2.022	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000107851677	522051900	/nfs/dbraw/zinc/05/19/00/522051900.db2.gz	CWRASQFOFQUFON-OAHLLOKOSA-N	0	3	314.433	2.446	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)NCc1ccc(C)c(F)c1	ZINC000111413458	523831118	/nfs/dbraw/zinc/83/11/18/523831118.db2.gz	FNFXNVHQCCJKDW-HNNXBMFYSA-N	0	3	323.412	2.044	10	0		DEAEHN
CC(=O)N(C)c1ccccc1NC(=O)CC1CCN(C)CC1	ZINC000362815611	534746695	/nfs/dbraw/zinc/74/66/95/534746695.db2.gz	VYWNLACTNYUMDA-UHFFFAOYSA-N	0	3	303.406	2.340	10	0		DEAEHN
CCc1ccc([C@H]2CCCCN2CCC(=O)NCC(=O)OC)o1	ZINC000124855028	524053735	/nfs/dbraw/zinc/05/37/35/524053735.db2.gz	HXYMWEOQTKFBKA-CQSZACIVSA-N	0	3	322.405	2.048	10	0		DEAEHN
Cc1cc(C)cc(OC[C@H](O)CN2[C@H](C)C[C@@H](O)C[C@@H]2C)c1	ZINC000249106404	524452417	/nfs/dbraw/zinc/45/24/17/524452417.db2.gz	XDPNGICWRDXHHY-YYIAUSFCSA-N	0	3	307.434	2.277	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1nncs1	ZINC000157774151	524631471	/nfs/dbraw/zinc/63/14/71/524631471.db2.gz	PVQVQAYBXBLLPS-AAEUAGOBSA-N	0	3	317.418	2.180	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2noc3c2CCCCC3)CCN1C	ZINC000154338920	524785042	/nfs/dbraw/zinc/78/50/42/524785042.db2.gz	JNIIXAPDBIPJRO-STQMWFEESA-N	0	3	305.422	2.498	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1F	ZINC000249148875	524991579	/nfs/dbraw/zinc/99/15/79/524991579.db2.gz	GVMSAQUFLBMQMC-JSGCOSHPSA-N	0	3	321.396	2.014	10	0		DEAEHN
Cc1cn[nH]c1CN1CCC[C@H](C(=O)Nc2ncccc2C)C1	ZINC000365671036	526028031	/nfs/dbraw/zinc/02/80/31/526028031.db2.gz	XUDSDBGLCRNTHL-AWEZNQCLSA-N	0	3	313.405	2.272	10	0		DEAEHN
CCCCOc1ccc(C(=O)N2CC[C@@H]([NH+](C)C)C2)c([O-])c1	ZINC000190286899	528660254	/nfs/dbraw/zinc/66/02/54/528660254.db2.gz	PNCUOTVLFISXKM-CYBMUJFWSA-N	0	3	306.406	2.347	10	0		DEAEHN
CC(=O)c1ccccc1OCCN(C)[C@H]1CCN(C2CC2)C1	ZINC000348181142	534926325	/nfs/dbraw/zinc/92/63/25/534926325.db2.gz	OTNXEMLSROLRJU-INIZCTEOSA-N	0	3	302.418	2.437	10	0		DEAEHN
CC(C)N1CCC[C@@H](N2CC[C@@H](CNc3ccccn3)C2)C1=O	ZINC000248358601	535166526	/nfs/dbraw/zinc/16/65/26/535166526.db2.gz	QYUYOEQUDYMLHW-JKSUJKDBSA-N	0	3	316.449	2.215	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)CSC[C@H]2CCCCO2)C1	ZINC000247342211	535256182	/nfs/dbraw/zinc/25/61/82/535256182.db2.gz	NPOYFLMVGMHTNO-RBSFLKMASA-N	0	3	314.495	2.134	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)N1CCN(C(C)C)CC1)CC2	ZINC000373569692	535382809	/nfs/dbraw/zinc/38/28/09/535382809.db2.gz	TXNKZZIGABULPD-CQSZACIVSA-N	0	3	318.465	2.191	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N1CCN(C(C)C)CC1)C2	ZINC000373569692	535382810	/nfs/dbraw/zinc/38/28/10/535382810.db2.gz	TXNKZZIGABULPD-CQSZACIVSA-N	0	3	318.465	2.191	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N[C@H](C)c2cn(C)nc2C)C12CCOCC2	ZINC000249039260	535416134	/nfs/dbraw/zinc/41/61/34/535416134.db2.gz	UTLRUBNYHOLKCU-DAXOMENPSA-N	0	3	307.438	2.353	10	0		DEAEHN
CC[C@@H](C)N[C@H](CNC(=O)Cc1cn(C)nc1C)c1ccco1	ZINC000451676580	535605234	/nfs/dbraw/zinc/60/52/34/535605234.db2.gz	SSNMNEGJQCDPSS-IUODEOHRSA-N	0	3	318.421	2.110	10	0		DEAEHN
CCC[C@H]1CN(C[C@@H](O)CC2CCCC2)CCN1CCOC	ZINC000249029437	535741954	/nfs/dbraw/zinc/74/19/54/535741954.db2.gz	FCLFRYXIIUMALN-ROUUACIJSA-N	0	3	312.498	2.360	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)NC[C@H](c1ccco1)N1CCCCC1	ZINC000262234274	535847154	/nfs/dbraw/zinc/84/71/54/535847154.db2.gz	PKKXRFZEJRHVPU-SQWLQELKSA-N	0	3	307.438	2.296	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)N[C@H](C)CN1CCC[C@H](C)C1	ZINC000454651517	535881891	/nfs/dbraw/zinc/88/18/91/535881891.db2.gz	VKQKSPJHIIYJBS-QWHCGFSZSA-N	0	3	322.453	2.465	10	0		DEAEHN
CCc1nn(C)c(CC)c1CC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000190135577	536179316	/nfs/dbraw/zinc/17/93/16/536179316.db2.gz	HUBGRKIJWOSMHU-CQSZACIVSA-N	0	3	322.497	2.180	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2c[nH]c3ncccc23)C1	ZINC000246809009	536469834	/nfs/dbraw/zinc/46/98/34/536469834.db2.gz	RWQVYPQMKDDIIT-XJKSGUPXSA-N	0	3	312.417	2.048	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COc2ccc(Cl)cc2)CC[C@H]1C	ZINC000252059644	536730931	/nfs/dbraw/zinc/73/09/31/536730931.db2.gz	ZPXJVMZYOYLCTO-IVMMDQJWSA-N	0	3	313.825	2.437	10	0		DEAEHN
COCc1ccccc1C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000246541889	536809731	/nfs/dbraw/zinc/80/97/31/536809731.db2.gz	SKVHXXDNZJOQDO-WMLDXEAASA-N	0	3	302.418	2.389	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC[C@H]1CCC[C@@H](C)C1	ZINC000247476485	536860201	/nfs/dbraw/zinc/86/02/01/536860201.db2.gz	IGSOPNNQOUZNKG-OWCLPIDISA-N	0	3	311.470	2.223	10	0		DEAEHN
COc1ccccc1CCCN1CCN(C[C@H](C)O)[C@H](C)C1	ZINC000248517700	537029328	/nfs/dbraw/zinc/02/93/28/537029328.db2.gz	ALXXJMDFQCFQNE-CVEARBPZSA-N	0	3	306.450	2.015	10	0		DEAEHN
COc1ccccc1C[C@H]1CCCN1CCN1CCO[C@H](C)C1	ZINC000191465383	537057025	/nfs/dbraw/zinc/05/70/25/537057025.db2.gz	PRRFAKLYXGESGZ-SJLPKXTDSA-N	0	3	318.461	2.423	10	0		DEAEHN
COc1cc([C@@H]2[C@H](N)CCN2C(=O)OC(C)(C)C)ccc1O	ZINC000536952588	563889768	/nfs/dbraw/zinc/88/97/68/563889768.db2.gz	DLNXXEBQTYULFU-BXUZGUMPSA-N	0	3	308.378	2.410	10	0		DEAEHN
Cc1cc(F)ccc1-c1noc(CN2CCCC[C@H](N)C2=O)n1	ZINC000888078391	625059059	/nfs/dbraw/zinc/05/90/59/625059059.db2.gz	NGYBXRAUWNWSHO-ZDUSSCGKSA-N	0	3	318.352	2.024	10	0		DEAEHN
COCC[C@H](N)C(=O)Nc1ccc(OC(C)C)c(Cl)c1	ZINC000052792660	625104124	/nfs/dbraw/zinc/10/41/24/625104124.db2.gz	QTJUVWBWHYOTDE-LBPRGKRZSA-N	0	3	300.786	2.430	10	0		DEAEHN
COC(=O)/C(C)=C/CN1CCN(CCc2cccs2)CC1	ZINC000748814290	637312157	/nfs/dbraw/zinc/31/21/57/637312157.db2.gz	YNGBFTWAFSMFDM-LHHJGKSTSA-N	0	3	308.447	2.028	10	0		DEAEHN
c1cn(-c2ncccc2CNCc2n[nH]c3ccccc23)cn1	ZINC000727466269	637953615	/nfs/dbraw/zinc/95/36/15/637953615.db2.gz	FRKOIOBWBJNGJW-UHFFFAOYSA-N	0	3	304.357	2.433	10	0		DEAEHN
c1cn(-c2ncccc2CNCc2[nH]nc3ccccc32)cn1	ZINC000727466269	637953619	/nfs/dbraw/zinc/95/36/19/637953619.db2.gz	FRKOIOBWBJNGJW-UHFFFAOYSA-N	0	3	304.357	2.433	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)c2ncccn2)[C@@H]1c1cccs1	ZINC000743568497	638157573	/nfs/dbraw/zinc/15/75/73/638157573.db2.gz	WCCPCFFUMSEPNS-TZMCWYRMSA-N	0	3	316.430	2.351	10	0		DEAEHN
Cc1ccc2c(c1)CC[C@H]2N[C@@H]1CCN(C2CCOCC2)C1=O	ZINC000747816181	638480470	/nfs/dbraw/zinc/48/04/70/638480470.db2.gz	UUUPRFDYBYHUNF-QZTJIDSGSA-N	0	3	314.429	2.352	10	0		DEAEHN
CC[C@H](C)C(=O)Nc1cccc(CNCCC(=O)N(C)OC)c1	ZINC000806626991	645854456	/nfs/dbraw/zinc/85/44/56/645854456.db2.gz	JAXRWBOUOPBNQZ-ZDUSSCGKSA-N	0	3	321.421	2.171	10	0		DEAEHN
CCN1CCN(c2ccc(NC(=O)C3=COCCC3)cc2)CC1	ZINC000730742078	647391434	/nfs/dbraw/zinc/39/14/34/647391434.db2.gz	TUCNHDPTFBNZOA-UHFFFAOYSA-N	0	3	315.417	2.461	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)c1cc(Cl)nc(N(C)C)c1	ZINC000733131977	647891335	/nfs/dbraw/zinc/89/13/35/647891335.db2.gz	WEYVHVXUTLURIU-GFCCVEGCSA-N	0	3	324.856	2.405	10	0		DEAEHN
CC(=O)CCN(C)C[C@@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000114461465	651956668	/nfs/dbraw/zinc/95/66/68/651956668.db2.gz	QOCLZHSBCPUTLK-CYBMUJFWSA-N	0	3	319.323	2.356	10	0		DEAEHN
COCCNC(=S)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000379706946	685393669	/nfs/dbraw/zinc/39/36/69/685393669.db2.gz	SMMIPTMJEIGDJH-INIZCTEOSA-N	0	3	321.490	2.152	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)N(C)Cc1ccc(Br)o1	ZINC000037819842	683884507	/nfs/dbraw/zinc/88/45/07/683884507.db2.gz	YVMRGZXCMJLNRB-LDYMZIIASA-N	0	3	303.200	2.374	10	0		DEAEHN
Cc1cc(N2CCN(c3cccc(Cl)c3)CC2)nc(N)n1	ZINC000043532128	683900396	/nfs/dbraw/zinc/90/03/96/683900396.db2.gz	CSMIASVDLRCDJI-UHFFFAOYSA-N	0	3	303.797	2.347	10	0		DEAEHN
CC(C)N(C)CC(=O)NCc1ccc(N2CCCCC2=O)cc1	ZINC000127600438	684164918	/nfs/dbraw/zinc/16/49/18/684164918.db2.gz	GBQTYSBUSHPELS-UHFFFAOYSA-N	0	3	317.433	2.160	10	0		DEAEHN
O=C(/C=C/c1ccncn1)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000158903744	684306646	/nfs/dbraw/zinc/30/66/46/684306646.db2.gz	YIFDDBMMAJGCEK-DKRLNXSXSA-N	0	3	309.369	2.308	10	0		DEAEHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCO[C@@H]2C)c1	ZINC000192196955	684444343	/nfs/dbraw/zinc/44/43/43/684444343.db2.gz	HMCBKDFUYDOSDT-BPLDGKMQSA-N	0	3	300.358	2.458	10	0		DEAEHN
CC[C@H](N[C@H]1C[C@@H](O)[C@@H]1n1cccn1)c1ccc2c(c1)CCO2	ZINC000886096766	692002504	/nfs/dbraw/zinc/00/25/04/692002504.db2.gz	DUYXGKRYJRPROD-LISAXSMJSA-N	0	3	313.401	2.233	10	0		DEAEHN
C[C@@](O)(CN1CCC(CCO)CC1)C(F)(F)C(F)(F)F	ZINC000724056181	777231401	/nfs/dbraw/zinc/23/14/01/777231401.db2.gz	DCLGIXWSZWLNCG-SNVBAGLBSA-N	0	3	305.287	2.029	10	0		DEAEHN
O=C(/C=C\c1ccncn1)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000588539061	777373534	/nfs/dbraw/zinc/37/35/34/777373534.db2.gz	YIFDDBMMAJGCEK-JTGQJZMRSA-N	0	3	309.369	2.308	10	0		DEAEHN
COc1ccccc1C/C(C)=C\C(=O)N1CCN2CCC1CC2	ZINC000588562010	777417749	/nfs/dbraw/zinc/41/77/49/777417749.db2.gz	AKZYYKHFFAGGMD-PFONDFGASA-N	0	3	314.429	2.491	10	0		DEAEHN
CC(C)c1nnc2n1CCN(C(=O)CN1[C@H](C)CC[C@H]1C)[C@H]2C	ZINC000439776382	781808751	/nfs/dbraw/zinc/80/87/51/781808751.db2.gz	VUKFIFOTRNULKK-MCIONIFRSA-N	0	3	319.453	2.178	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@H]1C[C@@H](CN[C@H]2CCn3ccnc32)C1	ZINC000715068146	792380528	/nfs/dbraw/zinc/38/05/28/792380528.db2.gz	VKKUFHXXLZDKPE-XQQFMLRXSA-N	0	3	306.410	2.221	10	0		DEAEHN
C[C@H](NC1CC(C(N)=O)C1)c1sccc1Br	ZINC000716775297	793006614	/nfs/dbraw/zinc/00/66/14/793006614.db2.gz	PQANVJKOEGYPRV-KKMMWDRVSA-N	0	3	303.225	2.425	10	0		DEAEHN
C[C@H](O)[C@@H](O)CNCc1cccc(OCc2ccccc2)c1	ZINC000717337996	799381277	/nfs/dbraw/zinc/38/12/77/799381277.db2.gz	AVQSVWMWVQKVKQ-KSSFIOAISA-N	0	3	301.386	2.097	10	0		DEAEHN
Cc1c(CN[C@@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)cnn1C	ZINC000401717217	801844707	/nfs/dbraw/zinc/84/47/07/801844707.db2.gz	YTOAYCSSIFFGPI-SWLSCSKDSA-N	0	3	322.453	2.464	10	0		DEAEHN
CC(C)=CC(=O)N1CCO[C@H]2CCN(Cc3ccccc3)C[C@@H]21	ZINC000404199736	802007481	/nfs/dbraw/zinc/00/74/81/802007481.db2.gz	HQNAEJVZBCKBRF-ROUUACIJSA-N	0	3	314.429	2.455	10	0		DEAEHN
CC(C)(C)OC(=O)NCC1(NCc2ccccn2)CCOCC1	ZINC000705626003	1086619419	/nfs/dbraw/zinc/61/94/19/1086619419.db2.gz	ZWKXXDCDYRCWBF-UHFFFAOYSA-N	0	3	321.421	2.245	10	0		DEAEHN
CN(CCOCCNCc1cccc(O)c1)C(=O)OC(C)(C)C	ZINC000705928848	1086626790	/nfs/dbraw/zinc/62/67/90/1086626790.db2.gz	UYIKOAQWVCIUGO-UHFFFAOYSA-N	0	3	324.421	2.365	10	0		DEAEHN
Cc1nnsc1CNC[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000711478191	1087120686	/nfs/dbraw/zinc/12/06/86/1087120686.db2.gz	VZPIMKAMBWWTPH-PHIMTYICSA-N	0	3	312.439	2.239	10	0		DEAEHN
Cn1nccc1CN[C@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000711620658	1087176338	/nfs/dbraw/zinc/17/63/38/1087176338.db2.gz	GCCWELJBAYPNNS-PBHICJAKSA-N	0	3	320.437	2.442	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@]23CCC[C@H]2[NH2+]CC3)sc1Cl	ZINC000711622337	1087177342	/nfs/dbraw/zinc/17/73/42/1087177342.db2.gz	JANKZIWKBKQUSZ-SKDRFNHKSA-N	0	3	320.867	2.273	10	0		DEAEHN
Cn1cc(CN[C@@]23CCC[C@H]2N(C(=O)OC(C)(C)C)CC3)cn1	ZINC000711637534	1087179223	/nfs/dbraw/zinc/17/92/23/1087179223.db2.gz	ADXORLGWLCBGCV-RHSMWYFYSA-N	0	3	320.437	2.442	10	0		DEAEHN
CN[C@H](CSCCC(=O)OC)c1ccc2c(c1)OCCO2	ZINC000081791375	192323619	/nfs/dbraw/zinc/32/36/19/192323619.db2.gz	IVSMHSCEQAFTKF-GFCCVEGCSA-N	0	3	311.403	2.015	10	0		DEAEHN
N[C@@H](CSc1nncs1)c1ccc2c(c1)OCCCO2	ZINC000081869379	192333538	/nfs/dbraw/zinc/33/35/38/192333538.db2.gz	OVROMWBSXWMUCK-JTQLQIEISA-N	0	3	309.416	2.492	10	0		DEAEHN
N[C@@H](CSc1cnccn1)c1ccc2c(c1)OCCCO2	ZINC000081885469	192334067	/nfs/dbraw/zinc/33/40/67/192334067.db2.gz	HMWUZOVHYZFLFW-LBPRGKRZSA-N	0	3	303.387	2.430	10	0		DEAEHN
COCCNCc1cc(Cl)ccc1N(C)CC(C)(C)O	ZINC000162863146	197597676	/nfs/dbraw/zinc/59/76/76/197597676.db2.gz	XJEMKFHDUICYPZ-UHFFFAOYSA-N	0	3	300.830	2.283	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2ccccc2C(F)(F)F)CCO1	ZINC000116793721	282127277	/nfs/dbraw/zinc/12/72/77/282127277.db2.gz	ABWLLNUNJMGAOR-LLVKDONJSA-N	0	3	316.323	2.108	10	0		DEAEHN
Cc1nccn1CCN1CCN(Cc2ccc(F)cc2)CC1	ZINC000077121648	185110302	/nfs/dbraw/zinc/11/03/02/185110302.db2.gz	PVNIJCLBNQISNO-UHFFFAOYSA-N	0	3	302.397	2.148	10	0		DEAEHN
CC[C@H]1CN(CCOc2cccc(OC)c2)CCN1CCOC	ZINC000152612490	282149586	/nfs/dbraw/zinc/14/95/86/282149586.db2.gz	LORSJXZWWFSYJN-INIZCTEOSA-N	0	3	322.449	2.117	10	0		DEAEHN
CCN(CCCO)[C@H](CN)c1ccccc1Br	ZINC000165068839	197669542	/nfs/dbraw/zinc/66/95/42/197669542.db2.gz	IXNMZBJDLPVSKG-CYBMUJFWSA-N	0	3	301.228	2.153	10	0		DEAEHN
COCc1ccc(CN(CC2CC2)C[C@H]2CN(C)CCO2)cc1	ZINC000328656739	231292714	/nfs/dbraw/zinc/29/27/14/231292714.db2.gz	ZQJAGQPFOHOYME-LJQANCHMSA-N	0	3	318.461	2.376	10	0		DEAEHN
CCOCCN(C)[C@@H](CN)c1cc(Br)cs1	ZINC000087975876	185237793	/nfs/dbraw/zinc/23/77/93/185237793.db2.gz	HLMHPKYUXLRYLS-JTQLQIEISA-N	0	3	307.257	2.479	10	0		DEAEHN
CCO[C@@H](CCNC(=O)N1CC[C@H](N2CC=CC2)C1)C(C)C	ZINC000174324482	282192716	/nfs/dbraw/zinc/19/27/16/282192716.db2.gz	FREGVLPPANEOQL-HOTGVXAUSA-N	0	3	309.454	2.093	10	0		DEAEHN
CCCN(CCN(C)C)Cc1ccc(OC)c(C(N)=S)c1	ZINC000087832604	185232823	/nfs/dbraw/zinc/23/28/23/185232823.db2.gz	BWGUOEIBZOFQKQ-UHFFFAOYSA-N	0	3	309.479	2.103	10	0		DEAEHN
CN(Cc1cc(Br)cs1)c1ccnc(=NN)[nH]1	ZINC000087866261	185233892	/nfs/dbraw/zinc/23/38/92/185233892.db2.gz	YAZRDEMPDJCCNP-UHFFFAOYSA-N	0	3	314.212	2.223	10	0		DEAEHN
CN(Cc1ccc(Br)cc1)c1ccnc(=NN)[nH]1	ZINC000087864152	185233964	/nfs/dbraw/zinc/23/39/64/185233964.db2.gz	HGAJKWDSQPLOPI-UHFFFAOYSA-N	0	3	308.183	2.161	10	0		DEAEHN
C[C@@H]1CCC[C@H](C)N1C(=O)CN[C@@H]1CCC(=O)N[C@@H]1C1CC1	ZINC000328919430	231386845	/nfs/dbraw/zinc/38/68/45/231386845.db2.gz	SLTWYJZKKOXZHY-DMVWFOPNSA-N	0	3	307.438	2.263	10	0		DEAEHN
COc1ccc(-n2nnc([C@H](C)N)c2C)cc1Br	ZINC000088321114	185245397	/nfs/dbraw/zinc/24/53/97/185245397.db2.gz	GSSWCYGCAMFLLS-ZETCQYMHSA-N	0	3	311.183	2.367	10	0		DEAEHN
CN(CCC(F)(F)F)C[C@H](N)c1ccc2c(c1)OCCO2	ZINC000088418221	185249186	/nfs/dbraw/zinc/24/91/86/185249186.db2.gz	AUDQKBLOYWPTSP-NSHDSACASA-N	0	3	304.312	2.342	10	0		DEAEHN
CCOC(=O)[C@@](C)(N)CCCN1CCC(C(F)(F)F)CC1	ZINC000088435554	185250507	/nfs/dbraw/zinc/25/05/07/185250507.db2.gz	XEHAGUKBVMNNPX-ZDUSSCGKSA-N	0	3	310.360	2.321	10	0		DEAEHN
CN[C@](C)(C[C@H](C)N1CCC(C(F)(F)F)CC1)C(=O)OC	ZINC000088435531	185250575	/nfs/dbraw/zinc/25/05/75/185250575.db2.gz	YUYXQXOFVMFROW-GXFFZTMASA-N	0	3	310.360	2.190	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N[C@H](C)C[C@H](C)CC)o1	ZINC000088551583	185257310	/nfs/dbraw/zinc/25/73/10/185257310.db2.gz	LUXKMLPYWMSVCA-VXGBXAGGSA-N	0	3	302.440	2.492	10	0		DEAEHN
CN[C@H](Cc1nc2ccccc2s1)C(C)(C)S(C)(=O)=O	ZINC000088518734	185254685	/nfs/dbraw/zinc/25/46/85/185254685.db2.gz	AIMPVAFYCLFJHV-GFCCVEGCSA-N	0	3	312.460	2.250	10	0		DEAEHN
CC[C@H](C)[C@@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000088542941	185256391	/nfs/dbraw/zinc/25/63/91/185256391.db2.gz	AJTHHDFXRQWKJC-NWDGAFQWSA-N	0	3	302.440	2.491	10	0		DEAEHN
CC[C@H](C)[C@@H](C)NS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000088542941	185256392	/nfs/dbraw/zinc/25/63/92/185256392.db2.gz	AJTHHDFXRQWKJC-NWDGAFQWSA-N	0	3	302.440	2.491	10	0		DEAEHN
CN[C@H](CS(=O)(=O)CCCOC)c1c(C)cc(C)cc1C	ZINC000081986119	192349105	/nfs/dbraw/zinc/34/91/05/192349105.db2.gz	IBNMRZXGVCLMEQ-OAHLLOKOSA-N	0	3	313.463	2.324	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N[C@@H](C)C(CC)CC)o1	ZINC000088551037	185257667	/nfs/dbraw/zinc/25/76/67/185257667.db2.gz	DNFHXTIMYZALBX-NSHDSACASA-N	0	3	302.440	2.492	10	0		DEAEHN
C[C@H]1CC[C@H](C)N(S(=O)(=O)c2ccc(F)c(CN)c2)C1	ZINC000088704764	185262632	/nfs/dbraw/zinc/26/26/32/185262632.db2.gz	NVFOBKMUDIOJJC-QWRGUYRKSA-N	0	3	300.399	2.094	10	0		DEAEHN
O=C(NC[C@@H]1CCCCN1Cc1ccccc1)N[C@@H]1CCOC1	ZINC000179147619	282215968	/nfs/dbraw/zinc/21/59/68/282215968.db2.gz	XSBQIWFSQRIXKK-SJORKVTESA-N	0	3	317.433	2.129	10	0		DEAEHN
Cc1nc(-c2cccc(NC(=O)[C@H]3COC[C@@H]3N)c2)cs1	ZINC000090380491	185293587	/nfs/dbraw/zinc/29/35/87/185293587.db2.gz	IUUZJELFJBDGMK-STQMWFEESA-N	0	3	303.387	2.031	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)N(C)Cc1cccc(Cl)c1Cl	ZINC000090434502	185296078	/nfs/dbraw/zinc/29/60/78/185296078.db2.gz	BDNIFCNOJVDLAZ-PWSUYJOCSA-N	0	3	317.216	2.186	10	0		DEAEHN
C[C@]1(C(=O)Nc2cc(Cl)cc3cccnc32)COC[C@H]1N	ZINC000090585366	185305290	/nfs/dbraw/zinc/30/52/90/185305290.db2.gz	BIBSTIDOIDKIJV-DOMZBBRYSA-N	0	3	305.765	2.191	10	0		DEAEHN
C[C@@]1(C(=O)Nc2ccc(-c3nccs3)cc2)COC[C@H]1N	ZINC000090589679	185305487	/nfs/dbraw/zinc/30/54/87/185305487.db2.gz	LMBFDXQGFXLJSV-IUODEOHRSA-N	0	3	303.387	2.112	10	0		DEAEHN
CC(C)(C)OC(=O)[C@@H]1CCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000247016057	534933366	/nfs/dbraw/zinc/93/33/66/534933366.db2.gz	LPBYKWGZWYOLID-CVEARBPZSA-N	0	3	305.418	2.254	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@]2(C)COC[C@@H]2N)c(Br)c1	ZINC000090580188	185304765	/nfs/dbraw/zinc/30/47/65/185304765.db2.gz	KOLSQVAFSHXDLP-AAEUAGOBSA-N	0	3	313.195	2.060	10	0		DEAEHN
CN(C)C[C@@H]1CSCCCN1C(=O)c1ccc2[nH]cnc2c1	ZINC000090699690	185310114	/nfs/dbraw/zinc/31/01/14/185310114.db2.gz	FLJKGSKDRMLWOT-CYBMUJFWSA-N	0	3	318.446	2.072	10	0		DEAEHN
CN(C)C[C@H]1CSCCCN1C(=O)c1ccc2[nH]cnc2c1	ZINC000090699691	185310270	/nfs/dbraw/zinc/31/02/70/185310270.db2.gz	FLJKGSKDRMLWOT-ZDUSSCGKSA-N	0	3	318.446	2.072	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NC[C@@H](C)c1nccs1	ZINC000184257692	282249877	/nfs/dbraw/zinc/24/98/77/282249877.db2.gz	HOMWXXRQEMWRFJ-CHWSQXEVSA-N	0	3	310.467	2.372	10	0		DEAEHN
CNCc1cccc(S(=O)(=O)NC2C(C)(C)C2(C)C)c1C	ZINC000092833291	185345031	/nfs/dbraw/zinc/34/50/31/185345031.db2.gz	XZSRIZBQAVGZDU-UHFFFAOYSA-N	0	3	310.463	2.427	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)c2cc(COC(C)(C)C)on2)[C@@H](C)C1	ZINC000186374231	282273995	/nfs/dbraw/zinc/27/39/95/282273995.db2.gz	QTEIYYLRSWIEBR-WFASDCNBSA-N	0	3	323.437	2.448	10	0		DEAEHN
COC(=O)[C@@H]1CCCN(CCC(=O)OCc2ccccc2)C1	ZINC000181446066	199297773	/nfs/dbraw/zinc/29/77/73/199297773.db2.gz	NNKARMCGKHHXMF-OAHLLOKOSA-N	0	3	305.374	2.005	10	0		DEAEHN
Cc1ccccc1[C@H](C)NCc1ccc(S(N)(=O)=O)cc1	ZINC000020003772	539330522	/nfs/dbraw/zinc/33/05/22/539330522.db2.gz	VEEACAWUQWIIPY-ZDUSSCGKSA-N	0	3	304.415	2.493	10	0		DEAEHN
CN1C[C@@H](C(=O)Nc2ccnc3ccncc32)[C@H](C(F)(F)F)C1	ZINC000299744760	529816778	/nfs/dbraw/zinc/81/67/78/529816778.db2.gz	PTHMNPVIDCRCBH-GHMZBOCLSA-N	0	3	324.306	2.308	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCS[C@H](C)CC1	ZINC000192257550	282340232	/nfs/dbraw/zinc/34/02/32/282340232.db2.gz	FRVILQAKINOQKE-KGLIPLIRSA-N	0	3	301.500	2.500	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCCN(C)[C@H]1c1cnn(C)c1	ZINC000328622627	530006431	/nfs/dbraw/zinc/00/64/31/530006431.db2.gz	BKFMGPLUNCPOFW-FUHWJXTLSA-N	0	3	313.449	2.330	10	0		DEAEHN
CC1(OCC(=O)NCCc2ccc(Cl)cc2Cl)CNC1	ZINC000098060321	539436099	/nfs/dbraw/zinc/43/60/99/539436099.db2.gz	UKDHLOAFUMDUPP-UHFFFAOYSA-N	0	3	317.216	2.031	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(C(C)C)nn1C	ZINC000245407905	282385473	/nfs/dbraw/zinc/38/54/73/282385473.db2.gz	DNFBFPVLJQOERT-KBPBESRZSA-N	0	3	304.438	2.242	10	0		DEAEHN
C[C@H](NCC(=O)NCCc1ccc(Cl)cc1)[C@@H]1CCCO1	ZINC000183085956	539659536	/nfs/dbraw/zinc/65/95/36/539659536.db2.gz	BZRYMLYOFFBXPX-WFASDCNBSA-N	0	3	310.825	2.156	10	0		DEAEHN
Cc1cc(Br)c([C@@H](N)[C@@H]2CCS(=O)(=O)C2)s1	ZINC000083677986	192377995	/nfs/dbraw/zinc/37/79/95/192377995.db2.gz	NZEVHZNIEHTOPZ-APPZFPTMSA-N	0	3	324.265	2.254	10	0		DEAEHN
CCOc1ccccc1[C@@H](C[S@](=O)C1CCOCC1)NC	ZINC000084055013	192397776	/nfs/dbraw/zinc/39/77/76/192397776.db2.gz	KDCGNEXOMKOBJV-QVKFZJNVSA-N	0	3	311.447	2.274	10	0		DEAEHN
CN(C)CCN(Cc1cccs1)C(=O)Nc1nncs1	ZINC000084070419	192399143	/nfs/dbraw/zinc/39/91/43/192399143.db2.gz	BHIXVOSMVUNRQZ-UHFFFAOYSA-N	0	3	311.436	2.195	10	0		DEAEHN
CC(=O)N1C[C@H](C(C)C)Oc2ccc(C(=O)[C@@H]3CCCN3)cc21	ZINC000071664386	191000019	/nfs/dbraw/zinc/00/00/19/191000019.db2.gz	DYCUWUCVWCNVPL-WMLDXEAASA-N	0	3	316.401	2.391	10	0		DEAEHN
CC(=O)NC1CCN([C@H](CN)c2ccc(Cl)s2)CC1	ZINC000133720888	186009377	/nfs/dbraw/zinc/00/93/77/186009377.db2.gz	CQCORVNHTKSITF-LLVKDONJSA-N	0	3	301.843	2.002	10	0		DEAEHN
CC[C@H](C)CN(C)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138469566	186016938	/nfs/dbraw/zinc/01/69/38/186016938.db2.gz	GIPDWIPJCKQYSX-JTQLQIEISA-N	0	3	320.405	2.351	10	0		DEAEHN
C[C@H]1CC[C@H](C)N(S(=O)(=O)c2cc(CN)cc(F)c2F)C1	ZINC000139158887	186020563	/nfs/dbraw/zinc/02/05/63/186020563.db2.gz	KFYMFLWHLAJQDP-UWVGGRQHSA-N	0	3	318.389	2.233	10	0		DEAEHN
Brc1cc2c(cc1CNCCc1ncc[nH]1)OCO2	ZINC000139197333	186021118	/nfs/dbraw/zinc/02/11/18/186021118.db2.gz	XXAUXQAWYMAGRK-UHFFFAOYSA-N	0	3	324.178	2.233	10	0		DEAEHN
CC[C@H]1CCN(S(=O)(=O)c2cc(CNC)cc(F)c2F)C1	ZINC000139293998	186021669	/nfs/dbraw/zinc/02/16/69/186021669.db2.gz	YMYIQOIRJCPWDF-JTQLQIEISA-N	0	3	318.389	2.105	10	0		DEAEHN
CN(C)CCn1ncc(Cl)c1[C@H](O)[C@@]1(C)CCCS1	ZINC000140179174	186026235	/nfs/dbraw/zinc/02/62/35/186026235.db2.gz	AIYNQFQWSDKOCZ-QWHCGFSZSA-N	0	3	303.859	2.417	10	0		DEAEHN
CC[C@]1(C)N[C@H](c2cccs2)N(C2CCN(C)CC2)C1=O	ZINC000141204248	186029289	/nfs/dbraw/zinc/02/92/89/186029289.db2.gz	ZBZNGZCJFSFGRS-HOCLYGCPSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCn1cc(S(=O)(=O)NCCCCC(C)C)cc1CNC	ZINC000147923418	186042400	/nfs/dbraw/zinc/04/24/00/186042400.db2.gz	BYNWIUFTMNXYMD-UHFFFAOYSA-N	0	3	315.483	2.332	10	0		DEAEHN
Cc1oc(CNC(C)C)cc1S(=O)(=O)N(C)C1CCC1	ZINC000144632250	186035714	/nfs/dbraw/zinc/03/57/14/186035714.db2.gz	DMAHZGMHPUSXQP-UHFFFAOYSA-N	0	3	300.424	2.259	10	0		DEAEHN
C[C@@H]1OCC[C@@H]1NCc1cccc(NC(=O)C(F)(F)F)c1	ZINC000149414746	186049565	/nfs/dbraw/zinc/04/95/65/186049565.db2.gz	XXQWZROUCWRFKP-CABZTGNLSA-N	0	3	302.296	2.454	10	0		DEAEHN
CN[C@H](C[C@@H]1CN(C)CCN1C)c1cc(Cl)ccc1OC	ZINC000149595095	186052042	/nfs/dbraw/zinc/05/20/42/186052042.db2.gz	YFIUIWAFSIIQHH-UKRRQHHQSA-N	0	3	311.857	2.245	10	0		DEAEHN
N[C@@H](Cc1nc(-c2ccccc2)cs1)[C@@H]1CCS(=O)(=O)C1	ZINC000150001361	186053983	/nfs/dbraw/zinc/05/39/83/186053983.db2.gz	SSVZVNYXZSRYLS-OLZOCXBDSA-N	0	3	322.455	2.115	10	0		DEAEHN
CN[C@H]1CC(C)(C)Cc2nc([C@@H]3CCS(=O)(=O)C3)sc21	ZINC000150259170	186056201	/nfs/dbraw/zinc/05/62/01/186056201.db2.gz	DOVWKPQUHNUXDT-ZJUUUORDSA-N	0	3	314.476	2.278	10	0		DEAEHN
Cc1ccc([C@H](CN)N2CCOC[C@@H]2C)c(Br)c1	ZINC000164064468	186147576	/nfs/dbraw/zinc/14/75/76/186147576.db2.gz	NPCSDJQECSRWTP-FZMZJTMJSA-N	0	3	313.239	2.478	10	0		DEAEHN
CCOC(=O)[C@@H](NCCN(C)C)c1ccc(F)c(Cl)c1	ZINC000163859670	186140293	/nfs/dbraw/zinc/14/02/93/186140293.db2.gz	AJCMBRLDZUKLKE-ZDUSSCGKSA-N	0	3	302.777	2.235	10	0		DEAEHN
CCCN(CCN(C)C)C(=O)[C@H](C(=O)OCC)C(C)(C)C	ZINC000164323004	186155639	/nfs/dbraw/zinc/15/56/39/186155639.db2.gz	YHQUGHGPINDSCC-CYBMUJFWSA-N	0	3	300.443	2.012	10	0		DEAEHN
C[C@@H]1CCC[C@](N)(C(=O)c2c(Cl)cnn2CCN(C)C)C1	ZINC000164351298	186156494	/nfs/dbraw/zinc/15/64/94/186156494.db2.gz	YCPCJGDNVMJZCH-IAQYHMDHSA-N	0	3	312.845	2.188	10	0		DEAEHN
COC[C@@H](C)C(=O)NCC(C)(C)N1CCc2ccccc2C1	ZINC000171443642	186160652	/nfs/dbraw/zinc/16/06/52/186160652.db2.gz	VBPAUZIPHFWEKE-CQSZACIVSA-N	0	3	304.434	2.222	10	0		DEAEHN
C[C@H](COCc1ccccc1)NC(=O)N1CCC[C@@H](N(C)C)C1	ZINC000173344491	186179076	/nfs/dbraw/zinc/17/90/76/186179076.db2.gz	HPIBMPXOJMCGPG-NVXWUHKLSA-N	0	3	319.449	2.327	10	0		DEAEHN
CC[C@H](CNC(=O)N1CC[C@@H](N(C)C)C1)Oc1cccc(F)c1	ZINC000175641603	186184242	/nfs/dbraw/zinc/18/42/42/186184242.db2.gz	NAZBFIWMFWWBHT-HUUCEWRRSA-N	0	3	323.412	2.329	10	0		DEAEHN
CN(C)C[C@H](NC(=O)[C@@H]1Cc2ccccc2O1)c1ccccc1	ZINC000171888320	198001701	/nfs/dbraw/zinc/00/17/01/198001701.db2.gz	RXYJCCOGCNKCQN-WMZOPIPTSA-N	0	3	310.397	2.409	10	0		DEAEHN
COc1c(F)cc(NC(=O)N2CCN3CCC[C@@H]3C2)cc1F	ZINC000171891105	198002015	/nfs/dbraw/zinc/00/20/15/198002015.db2.gz	UFCLRGGXULMQOV-LLVKDONJSA-N	0	3	311.332	2.285	10	0		DEAEHN
CCn1ncc2ccc(NC(=O)N3CCN4CCC[C@H]4C3)cc21	ZINC000171892142	198002703	/nfs/dbraw/zinc/00/27/03/198002703.db2.gz	XMLJIDSHCXGSBY-HNNXBMFYSA-N	0	3	313.405	2.368	10	0		DEAEHN
Cc1ccccc1-n1cc(C(=O)N2CCN3CCC[C@H]3C2)cn1	ZINC000171954185	198013959	/nfs/dbraw/zinc/01/39/59/198013959.db2.gz	WFGHQGXIKYKYEF-INIZCTEOSA-N	0	3	310.401	2.101	10	0		DEAEHN
CC(C)COc1ccc(NC(=O)N2CCN3CCC[C@H]3C2)cn1	ZINC000172106200	198040038	/nfs/dbraw/zinc/04/00/38/198040038.db2.gz	CQNMIVTYENMUKH-HNNXBMFYSA-N	0	3	318.421	2.428	10	0		DEAEHN
CC[C@H](NC(=O)N1CCO[C@@H](CN(C)C)C1)c1ccc(C)cc1	ZINC000172115774	198041609	/nfs/dbraw/zinc/04/16/09/198041609.db2.gz	FWWBXHDPYHQMQB-IRXDYDNUSA-N	0	3	319.449	2.418	10	0		DEAEHN
C[C@H](c1nc(-c2cccnc2)no1)N1CCCN(C2CC2)CC1	ZINC000172190756	198055897	/nfs/dbraw/zinc/05/58/97/198055897.db2.gz	NKUNMKRZPBIWGF-CYBMUJFWSA-N	0	3	313.405	2.363	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NC[C@H](O)CC(C)(C)C	ZINC000172296784	198072679	/nfs/dbraw/zinc/07/26/79/198072679.db2.gz	AHDIWOXZFROVFJ-CQSZACIVSA-N	0	3	322.449	2.154	10	0		DEAEHN
C[C@@H]1[C@H](NC(=O)c2ncccc2N)CCN1Cc1ccccc1	ZINC000309734764	539878259	/nfs/dbraw/zinc/87/82/59/539878259.db2.gz	QHNOROUYLYVCNP-CZUORRHYSA-N	0	3	310.401	2.057	10	0		DEAEHN
C[C@@H](c1nc2ccccc2c(=O)[nH]1)N1CCN2CCCC[C@@H]2C1	ZINC000172805666	198152165	/nfs/dbraw/zinc/15/21/65/198152165.db2.gz	TYWZSOSMGNAFBV-UONOGXRCSA-N	0	3	312.417	2.154	10	0		DEAEHN
Cc1ccc(O[C@H](C)CNC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000173917068	198267845	/nfs/dbraw/zinc/26/78/45/198267845.db2.gz	IDYSKSZHDOOMSN-CABCVRRESA-N	0	3	305.422	2.108	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCc2ccc(Cl)nc2)CCN1C	ZINC000174120526	198293820	/nfs/dbraw/zinc/29/38/20/198293820.db2.gz	MBXQVSJGYKVPKG-DGCLKSJQSA-N	0	3	310.829	2.359	10	0		DEAEHN
Cc1ccc(O[C@H](C)CNC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000174351740	198322968	/nfs/dbraw/zinc/32/29/68/198322968.db2.gz	IBDTVXHGSFTBIT-CABCVRRESA-N	0	3	305.422	2.156	10	0		DEAEHN
C[C@@H]1CCc2nc(NC(=O)NC3CCN(C)CC3)sc2C1	ZINC000043577611	354223957	/nfs/dbraw/zinc/22/39/57/354223957.db2.gz	XLIZJUGXSJSBEH-SNVBAGLBSA-N	0	3	308.451	2.484	10	0		DEAEHN
CC(=O)c1ccc(OCC(=O)NC2CCN(C3CC3)CC2)cc1	ZINC000073945267	354993702	/nfs/dbraw/zinc/99/37/02/354993702.db2.gz	UYDMJWHYDZGFQC-UHFFFAOYSA-N	0	3	316.401	2.011	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCC(C)(C)C[C@@H](C)O	ZINC000073722209	191346219	/nfs/dbraw/zinc/34/62/19/191346219.db2.gz	ZSNABQNWBJRWEL-KGLIPLIRSA-N	0	3	301.475	2.059	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)NCc1nccs1	ZINC000079732787	355327566	/nfs/dbraw/zinc/32/75/66/355327566.db2.gz	NOJSPMMWLCOHPW-CQSZACIVSA-N	0	3	318.446	2.115	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2c2ncncc2Br)C1	ZINC000089375278	283099944	/nfs/dbraw/zinc/09/99/44/283099944.db2.gz	DEZMKRXJFWVXIL-ZYHUDNBSSA-N	0	3	311.227	2.160	10	0		DEAEHN
CCC[C@H](C)CN1CCN(CC(=O)NCc2ccccc2)CC1	ZINC000179659313	356030926	/nfs/dbraw/zinc/03/09/26/356030926.db2.gz	RPLODKURXQNHFC-KRWDZBQOSA-N	0	3	317.477	2.357	10	0		DEAEHN
CCC(C)(C)NC(=O)CN[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000182044079	356106959	/nfs/dbraw/zinc/10/69/59/356106959.db2.gz	WLUQTEQBBPSRCQ-ZDUSSCGKSA-N	0	3	315.421	2.223	10	0		DEAEHN
CCC[C@H](C(=O)NCc1cn(C)nc1-c1ccccc1)N(C)C	ZINC000183960623	199656179	/nfs/dbraw/zinc/65/61/79/199656179.db2.gz	TWNJDMDTKWWADN-MRXNPFEDSA-N	0	3	314.433	2.434	10	0		DEAEHN
C[C@@H](CN[C@H]1CCCS(=O)(=O)C1)c1ccc(F)cc1F	ZINC000183051590	356157981	/nfs/dbraw/zinc/15/79/81/356157981.db2.gz	ZIYMKMLFKBAZDY-JQWIXIFHSA-N	0	3	303.374	2.235	10	0		DEAEHN
NC(=O)N1CCC(NC2(c3ccc(F)cc3F)CCC2)CC1	ZINC000182676232	356138831	/nfs/dbraw/zinc/13/88/31/356138831.db2.gz	RUDYSXADLSAGIT-UHFFFAOYSA-N	0	3	309.360	2.477	10	0		DEAEHN
CNCc1ccn(Cc2ccc(OC)c(Br)c2)n1	ZINC000080093888	192000708	/nfs/dbraw/zinc/00/07/08/192000708.db2.gz	RZFKWYPLNGLQGO-UHFFFAOYSA-N	0	3	310.195	2.422	10	0		DEAEHN
CCC[C@@H](N)C(=O)Nc1nc2cc3c(cc2s1)OCCO3	ZINC000236823875	202027323	/nfs/dbraw/zinc/02/73/23/202027323.db2.gz	DARGBVHUYWFHMO-MRVPVSSYSA-N	0	3	307.375	2.133	10	0		DEAEHN
Cc1ccc(C[C@@H](C)NS(=O)(=O)C[C@@H]2CCCCN2)s1	ZINC000080248262	192017281	/nfs/dbraw/zinc/01/72/81/192017281.db2.gz	UUWGSQBRAWVHEO-YPMHNXCESA-N	0	3	316.492	2.049	10	0		DEAEHN
CN(C[C@H]1CCN(C)C1)c1ncc(Br)cc1F	ZINC000234336669	356286890	/nfs/dbraw/zinc/28/68/90/356286890.db2.gz	XZQZVMZCKQMQSM-VIFPVBQESA-N	0	3	302.191	2.371	10	0		DEAEHN
NCc1cc(OC(F)(F)F)ncc1I	ZINC000238675769	356305221	/nfs/dbraw/zinc/30/52/21/356305221.db2.gz	PREZITDOEMGMLA-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
C[C@@H]1CCC[C@](N)(C(=O)NC[C@@H](c2cccs2)N(C)C)C1	ZINC000080937353	192202240	/nfs/dbraw/zinc/20/22/40/192202240.db2.gz	JIVLGLAXPZTBQI-DVOMOZLQSA-N	0	3	309.479	2.375	10	0		DEAEHN
C[C@H](N[C@@H](C)[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1nncn1C	ZINC000400399500	283156694	/nfs/dbraw/zinc/15/66/94/283156694.db2.gz	KFICWALKDICHII-AVGNSLFASA-N	0	3	323.441	2.111	10	0		DEAEHN
CCCNCc1c(N2CC[C@@H](COC)C2)nc2sccn12	ZINC000081072427	192222744	/nfs/dbraw/zinc/22/27/44/192222744.db2.gz	FQPOEIQCCLSEQE-GFCCVEGCSA-N	0	3	308.451	2.368	10	0		DEAEHN
COCC[C@H](C)NCc1ccc(I)o1	ZINC000081709390	192316070	/nfs/dbraw/zinc/31/60/70/192316070.db2.gz	QGTXIVNTFVCBNE-QMMMGPOBSA-N	0	3	309.147	2.399	10	0		DEAEHN
CC[C@H](NC)c1cccc(S(=O)(=O)N[C@H](C)CCOC)c1	ZINC000081717822	192317000	/nfs/dbraw/zinc/31/70/00/192317000.db2.gz	MGDGRKFUKGABNJ-DOMZBBRYSA-N	0	3	314.451	2.060	10	0		DEAEHN
CN(CCOCc1ccccc1)C(=O)[C@H]1NCCCC1(C)C	ZINC000384077436	356682226	/nfs/dbraw/zinc/68/22/26/356682226.db2.gz	SZOWVHGYYAGHPD-MRXNPFEDSA-N	0	3	304.434	2.440	10	0		DEAEHN
C[C@@]1(CNc2ncncc2C#N)CCCN1Cc1ccccc1	ZINC000397915437	356719136	/nfs/dbraw/zinc/71/91/36/356719136.db2.gz	JZEOWSUYKVFLBG-SFHVURJKSA-N	0	3	307.401	2.237	10	0		DEAEHN
CCOCC[C@H](O)CN1CCC[C@@H](CC(=O)OC(C)(C)C)C1	ZINC000578875894	356885947	/nfs/dbraw/zinc/88/59/47/356885947.db2.gz	BYHPZAKIBIHVHM-GJZGRUSLSA-N	0	3	315.454	2.218	10	0		DEAEHN
CC(=O)c1sccc1OCC(=O)NC1CCN(C2CC2)CC1	ZINC000579201082	356936400	/nfs/dbraw/zinc/93/64/00/356936400.db2.gz	ZXZIRQBZHFMTLC-UHFFFAOYSA-N	0	3	322.430	2.073	10	0		DEAEHN
CC(C)c1nc(C(=O)Nc2cnn(CCN(C)C)c2)cs1	ZINC000588216502	357402189	/nfs/dbraw/zinc/40/21/89/357402189.db2.gz	NTFGWKCJZVYPBC-UHFFFAOYSA-N	0	3	307.423	2.277	10	0		DEAEHN
CN1CC[C@@H](NC(=O)N2CCSCC2)[C@@H]1c1ccccc1	ZINC000179270534	199008024	/nfs/dbraw/zinc/00/80/24/199008024.db2.gz	YCRWGTUXMVEPFI-CABCVRRESA-N	0	3	305.447	2.190	10	0		DEAEHN
Cc1[nH]c(=O)ccc1C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000180138621	199121954	/nfs/dbraw/zinc/12/19/54/199121954.db2.gz	TZUPXXILWHAOHC-DOTOQJQBSA-N	0	3	311.385	2.271	10	0		DEAEHN
Cc1nccn1-c1ccc([C@H](C)NC[C@@H]2CN(C)CCO2)cc1	ZINC000180490563	199166312	/nfs/dbraw/zinc/16/63/12/199166312.db2.gz	RJQNBVXBHLPOOF-KBXCAEBGSA-N	0	3	314.433	2.162	10	0		DEAEHN
Cc1nccn1-c1ccc([C@H](C)N[C@H]2CCc3ncnn3C2)cc1	ZINC000180589405	199180478	/nfs/dbraw/zinc/18/04/78/199180478.db2.gz	WKOHCONEJQIXMF-BBRMVZONSA-N	0	3	322.416	2.438	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1cccc(C)c1F	ZINC000180660265	199192607	/nfs/dbraw/zinc/19/26/07/199192607.db2.gz	IYWOJNPOJDWJOW-ZDUSSCGKSA-N	0	3	321.396	2.015	10	0		DEAEHN
CNCc1cccc(S(=O)(=O)N(C)CCC(F)(F)F)c1C	ZINC000089049883	192720505	/nfs/dbraw/zinc/72/05/05/192720505.db2.gz	WPUDGSWQTSRVIK-UHFFFAOYSA-N	0	3	324.368	2.287	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N(C)CCN(C)C1CC1)c1ccccc1	ZINC000186788423	200011534	/nfs/dbraw/zinc/01/15/34/200011534.db2.gz	NGAQYVRAENAMQA-GJZGRUSLSA-N	0	3	303.450	2.278	10	0		DEAEHN
C[C@H](CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1)c1nccs1	ZINC000187011197	200047140	/nfs/dbraw/zinc/04/71/40/200047140.db2.gz	OHWJPBAWRLPPEP-FRRDWIJNSA-N	0	3	310.467	2.371	10	0		DEAEHN
CCc1nc(CN[C@H](C)C2CCS(=O)(=O)CC2)cs1	ZINC000187185090	200073287	/nfs/dbraw/zinc/07/32/87/200073287.db2.gz	ZDDJAOAVYKQKFZ-SNVBAGLBSA-N	0	3	302.465	2.008	10	0		DEAEHN
CCc1nc(CN[C@@H](C)C2CCS(=O)(=O)CC2)cs1	ZINC000187185069	200073639	/nfs/dbraw/zinc/07/36/39/200073639.db2.gz	ZDDJAOAVYKQKFZ-JTQLQIEISA-N	0	3	302.465	2.008	10	0		DEAEHN
CC(C)C[C@H](CO)N(C)C(=O)NC[C@@H](c1ccccc1)N(C)C	ZINC000188164366	200202904	/nfs/dbraw/zinc/20/29/04/200202904.db2.gz	HVKJFWIHTXNRDN-SJORKVTESA-N	0	3	321.465	2.338	10	0		DEAEHN
COc1ccccc1CN(CCO)C[C@H](O)C1CCCCC1	ZINC000190511990	200549766	/nfs/dbraw/zinc/54/97/66/200549766.db2.gz	KVEHXHVOTSRKCG-KRWDZBQOSA-N	0	3	307.434	2.431	10	0		DEAEHN
Cn1ccc(CN2CCC[C@H](CC(=O)OC(C)(C)C)C2)cc1=O	ZINC000610763318	361462591	/nfs/dbraw/zinc/46/25/91/361462591.db2.gz	SYVXTGQXJYUPAJ-CQSZACIVSA-N	0	3	320.433	2.329	10	0		DEAEHN
COc1cc(CN2C[C@H](C)[C@H](N3CCOCC3)C2)ccc1C	ZINC000194053320	201170363	/nfs/dbraw/zinc/17/03/63/201170363.db2.gz	NRTZRIPKAAOPHV-DOTOQJQBSA-N	0	3	304.434	2.156	10	0		DEAEHN
CCC1(NC(=O)C(=O)Nc2cc(CN(C)C)ccc2C)CCC1	ZINC000194695771	201274489	/nfs/dbraw/zinc/27/44/89/201274489.db2.gz	BMWKFVHWRVFSME-UHFFFAOYSA-N	0	3	317.433	2.444	10	0		DEAEHN
Cc1nc(CN2CCN(CCSC3CCCCC3)CC2)n[nH]1	ZINC000619719909	363864941	/nfs/dbraw/zinc/86/49/41/363864941.db2.gz	MGWVGOQWFNYESZ-UHFFFAOYSA-N	0	3	323.510	2.297	10	0		DEAEHN
CCNCc1cncc(-n2nc(C)c(Br)c2C)n1	ZINC000091422259	193053905	/nfs/dbraw/zinc/05/39/05/193053905.db2.gz	HBKBQOUCVQHPQO-UHFFFAOYSA-N	0	3	310.199	2.151	10	0		DEAEHN
CN[C@@H](c1ccc(F)c(F)c1F)C(C)(C)N1CCOCC1	ZINC000091566671	193073195	/nfs/dbraw/zinc/07/31/95/193073195.db2.gz	FVBYDBKMYKUXRY-AWEZNQCLSA-N	0	3	302.340	2.475	10	0		DEAEHN
C[C@H](N[C@@H]1CCOC[C@@H]1O)c1ccc(Br)cc1F	ZINC000624237848	365347283	/nfs/dbraw/zinc/34/72/83/365347283.db2.gz	FSQFLFYCJRZWHD-CKLFPEKLSA-N	0	3	318.186	2.389	10	0		DEAEHN
CC(C)Cc1nnc(NC(=O)N2C[C@H]3CCCN3C[C@H]2C)s1	ZINC000091988577	193137539	/nfs/dbraw/zinc/13/75/39/193137539.db2.gz	FFKRTAHUSXWYKN-VXGBXAGGSA-N	0	3	323.466	2.437	10	0		DEAEHN
CCOc1nc2cc(C(=O)NC[C@H]3CC[N@H+](CC)C3)ccc2[n-]1	ZINC000449811879	241110833	/nfs/dbraw/zinc/11/08/33/241110833.db2.gz	ASEULRPKBDREGS-GFCCVEGCSA-N	0	3	316.405	2.033	10	0		DEAEHN
CCOc1nc2cc(C(=O)NC[C@H]3CC[N@@H+](CC)C3)ccc2[n-]1	ZINC000449811879	241110843	/nfs/dbraw/zinc/11/08/43/241110843.db2.gz	ASEULRPKBDREGS-GFCCVEGCSA-N	0	3	316.405	2.033	10	0		DEAEHN
C[C@@H](C(=O)Nc1cccc(C(N)=S)c1)N1C[C@H](C)[C@H](C)C1	ZINC000092085490	193155109	/nfs/dbraw/zinc/15/51/09/193155109.db2.gz	MZFZTVBRWACLBY-TUAOUCFPSA-N	0	3	305.447	2.236	10	0		DEAEHN
C[C@H]1CCCN1S(=O)(=O)c1ccc(CNC2CC2)cc1F	ZINC000092115741	193163270	/nfs/dbraw/zinc/16/32/70/193163270.db2.gz	VKGGUFVZIKZCMY-NSHDSACASA-N	0	3	312.410	2.251	10	0		DEAEHN
C[NH2+]Cc1ccc(S(=O)(=O)[N-]C(C2CC2)C2CC2)c(F)c1	ZINC000092115935	193164405	/nfs/dbraw/zinc/16/44/05/193164405.db2.gz	SIZRTSQHOKYQKX-UHFFFAOYSA-N	0	3	312.410	2.012	10	0		DEAEHN
C[C@H]1CCCC[C@@H]1N(C)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115973	193164530	/nfs/dbraw/zinc/16/45/30/193164530.db2.gz	VRVBLUKWXVQWNH-FZMZJTMJSA-N	0	3	314.426	2.484	10	0		DEAEHN
c1cc(OCCN2CCOCC2)ccc1CN[C@H]1CC12CC2	ZINC000631164198	368055463	/nfs/dbraw/zinc/05/54/63/368055463.db2.gz	YUFDQLJPQKQUHR-KRWDZBQOSA-N	0	3	302.418	2.040	10	0		DEAEHN
c1c(CNC[C@@H]2CC3CCC2CC3)nnn1C[C@@H]1CCOC1	ZINC000631166517	368056010	/nfs/dbraw/zinc/05/60/10/368056010.db2.gz	VGRKCDOTKWQUOB-GRAKBVBRSA-N	0	3	304.438	2.231	10	0		DEAEHN
c1ccc([C@H](C[C@H]2CCOC2)NC2CN(c3ccncn3)C2)cc1	ZINC000631747332	368367364	/nfs/dbraw/zinc/36/73/64/368367364.db2.gz	FEKSICIEXTWAFL-QAPCUYQASA-N	0	3	324.428	2.423	10	0		DEAEHN
CCc1nn(C)cc1C(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000092247649	193179554	/nfs/dbraw/zinc/17/95/54/193179554.db2.gz	WSVPSCSDJKHVIV-INIZCTEOSA-N	0	3	300.406	2.015	10	0		DEAEHN
CC[C@@H](C)CN(CC)S(=O)(=O)c1cc(CN)ccc1OC	ZINC000093265823	193222440	/nfs/dbraw/zinc/22/24/40/193222440.db2.gz	GJOIPZDAPJRDBK-GFCCVEGCSA-N	0	3	314.451	2.211	10	0		DEAEHN
CC[C@@H](C)CN(CC)S(=O)(=O)c1ccc(OC)c(CN)c1	ZINC000093265709	193222773	/nfs/dbraw/zinc/22/27/73/193222773.db2.gz	SHQIIRWFNCEAJH-GFCCVEGCSA-N	0	3	314.451	2.211	10	0		DEAEHN
CCC(CC)N(CC(C)C)S(=O)(=O)c1ccc(CN)cn1	ZINC000093326630	193233735	/nfs/dbraw/zinc/23/37/35/193233735.db2.gz	NUNIPKDDQZOYRI-UHFFFAOYSA-N	0	3	313.467	2.376	10	0		DEAEHN
COc1ccc2c(c1)CCC[C@@H]2NCC(C)(C)S(C)(=O)=O	ZINC000093520712	193263321	/nfs/dbraw/zinc/26/33/21/193263321.db2.gz	AZFKDCLDOAXXHZ-HNNXBMFYSA-N	0	3	311.447	2.485	10	0		DEAEHN
NC(=O)[C@]1(N)CCC[C@H](Oc2ccccc2C(F)(F)F)C1	ZINC000093773819	193304447	/nfs/dbraw/zinc/30/44/47/193304447.db2.gz	RGTHJCFHKYZNIS-ZANVPECISA-N	0	3	302.296	2.210	10	0		DEAEHN
NC(=O)[C@@]1(N)CC[C@@H](Sc2ccc(Br)cc2)C1	ZINC000093848877	193317494	/nfs/dbraw/zinc/31/74/94/193317494.db2.gz	YIKXJFQGDZORSE-ZYHUDNBSSA-N	0	3	315.236	2.277	10	0		DEAEHN
CCN[C@@H](Cc1nc2ccccc2s1)[C@H]1CN(C)CCO1	ZINC000094251520	193355397	/nfs/dbraw/zinc/35/53/97/193355397.db2.gz	YADFVFRLEPTRHX-UONOGXRCSA-N	0	3	305.447	2.148	10	0		DEAEHN
CCN[C@H](c1ccc(F)cn1)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094643094	193388639	/nfs/dbraw/zinc/38/86/39/193388639.db2.gz	XWPPGTYHVJHLLP-WHOFXGATSA-N	0	3	314.426	2.475	10	0		DEAEHN
CC(C)C[C@@H]1CN(CCS(C)(=O)=O)c2ccccc2CN1	ZINC000094420878	193369050	/nfs/dbraw/zinc/36/90/50/193369050.db2.gz	UUTOOOVQPDEJKF-OAHLLOKOSA-N	0	3	310.463	2.056	10	0		DEAEHN
Brc1cn2ccnc2c(N[C@H]2CCN(C3CC3)C2)n1	ZINC000094489928	193373924	/nfs/dbraw/zinc/37/39/24/193373924.db2.gz	RSSWWQFOPLIUHA-VIFPVBQESA-N	0	3	322.210	2.140	10	0		DEAEHN
CC[NH2+]C[C@H](C)C(=O)Nc1cc(Br)ccc1[O-]	ZINC000094573597	193381646	/nfs/dbraw/zinc/38/16/46/193381646.db2.gz	IAGAVHZXZNKBQX-QMMMGPOBSA-N	0	3	301.184	2.339	10	0		DEAEHN
CN[C@H](Cc1ncnn1C)c1cc(C(F)(F)F)ccc1F	ZINC000094594900	193381963	/nfs/dbraw/zinc/38/19/63/193381963.db2.gz	DXIPLOKGYICXJJ-LLVKDONJSA-N	0	3	302.275	2.476	10	0		DEAEHN
Cc1cc(CNS(=O)(=O)C[C@@H]2CCCCN2)cc(C)c1F	ZINC000094895186	193405969	/nfs/dbraw/zinc/40/59/69/193405969.db2.gz	IJCMQACRHOJJFD-AWEZNQCLSA-N	0	3	314.426	2.004	10	0		DEAEHN
COc1cc(CNCC(C)(C)O)cc(Br)c1OC	ZINC000096480894	193664183	/nfs/dbraw/zinc/66/41/83/193664183.db2.gz	KTAZJASQZJDBGW-UHFFFAOYSA-N	0	3	318.211	2.327	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cc3ccccc3c(=O)[nH]2)CCN1C	ZINC000266124462	205117850	/nfs/dbraw/zinc/11/78/50/205117850.db2.gz	YNCKZOYHQHODRP-TZMCWYRMSA-N	0	3	313.401	2.495	10	0		DEAEHN
CCCOc1c(CNCCO)cc(Br)cc1OC	ZINC000020934087	182255307	/nfs/dbraw/zinc/25/53/07/182255307.db2.gz	PSKOINMAHUYUMH-UHFFFAOYSA-N	0	3	318.211	2.328	10	0		DEAEHN
COc1cccc(OC)c1C(=O)NCC(C)(C)N1CCCC1	ZINC000040616084	183109620	/nfs/dbraw/zinc/10/96/20/183109620.db2.gz	CJTLDGIHDKNIQT-UHFFFAOYSA-N	0	3	306.406	2.308	10	0		DEAEHN
Cc1nn(-c2ccccc2F)c2ncnc(NCCN(C)C)c12	ZINC000041472100	183193573	/nfs/dbraw/zinc/19/35/73/183193573.db2.gz	OEKFIUWHIFRXIS-UHFFFAOYSA-N	0	3	314.368	2.237	10	0		DEAEHN
CNCc1cccc(Br)c1OCc1noc(C)n1	ZINC000042411575	183265878	/nfs/dbraw/zinc/26/58/78/183265878.db2.gz	HOCXDZQHIJUPJF-UHFFFAOYSA-N	0	3	312.167	2.439	10	0		DEAEHN
CCNCc1cccc(Br)c1OCC(=O)OC	ZINC000042411761	183265924	/nfs/dbraw/zinc/26/59/24/183265924.db2.gz	BWEIGBOPXALESO-UHFFFAOYSA-N	0	3	302.168	2.110	10	0		DEAEHN
CNCc1cccc(Br)c1OCCC(=O)N(C)C	ZINC000042411590	183266085	/nfs/dbraw/zinc/26/60/85/183266085.db2.gz	HURZNXCVJMIQMT-UHFFFAOYSA-N	0	3	315.211	2.026	10	0		DEAEHN
CN(C[C@H]1CCCO1)[C@@H](CN)c1ccc(Br)o1	ZINC000042463564	183273697	/nfs/dbraw/zinc/27/36/97/183273697.db2.gz	VDYZZKLCUJXYKK-ZJUUUORDSA-N	0	3	303.200	2.153	10	0		DEAEHN
CCCN(CC(=O)Nc1ccccc1CN)CC(F)(F)F	ZINC000042741045	183303461	/nfs/dbraw/zinc/30/34/61/183303461.db2.gz	KMTZSQILJZIUIY-UHFFFAOYSA-N	0	3	303.328	2.358	10	0		DEAEHN
CN(Cc1cscn1)[C@H](CN)c1ccc2c(c1)OCCO2	ZINC000042862346	183315202	/nfs/dbraw/zinc/31/52/02/183315202.db2.gz	RELIQRHDLLRFQS-CYBMUJFWSA-N	0	3	305.403	2.046	10	0		DEAEHN
C[C@H](N)[C@@H](c1cccs1)N1CCN(c2nccs2)CC1	ZINC000043102877	183338558	/nfs/dbraw/zinc/33/85/58/183338558.db2.gz	MQXYXONKZSXHLG-AAEUAGOBSA-N	0	3	308.476	2.415	10	0		DEAEHN
Cc1nc(C)n([C@H](CN)c2ccc(Br)s2)n1	ZINC000043263507	183349188	/nfs/dbraw/zinc/34/91/88/183349188.db2.gz	AQXJUOROZGXLCS-MRVPVSSYSA-N	0	3	301.213	2.267	10	0		DEAEHN
Cc1nn(C)c(-n2ccc(C(F)(F)F)n2)c1CNC(C)C	ZINC000043298879	183351701	/nfs/dbraw/zinc/35/17/01/183351701.db2.gz	YCYHQABCKZDCEN-UHFFFAOYSA-N	0	3	301.316	2.431	10	0		DEAEHN
CC(C)CCNC(=O)[C@H](C)N(CCC(N)=S)CC(C)C	ZINC000043418458	183360839	/nfs/dbraw/zinc/36/08/39/183360839.db2.gz	DJQLGBSMGHUYQQ-ZDUSSCGKSA-N	0	3	301.500	2.171	10	0		DEAEHN
C[C@@H](Cc1ccsc1)N[C@H]1CC(=O)N(C2CCCC2)C1=O	ZINC000105034566	194065356	/nfs/dbraw/zinc/06/53/56/194065356.db2.gz	MWKYOJOSQPKSOP-FZMZJTMJSA-N	0	3	306.431	2.339	10	0		DEAEHN
C[C@@H](O)CN1CCN(CCOc2ccc(Cl)cc2)C[C@@H]1C	ZINC000105821079	194136646	/nfs/dbraw/zinc/13/66/46/194136646.db2.gz	WSQMTBHAPRPDSU-UONOGXRCSA-N	0	3	312.841	2.106	10	0		DEAEHN
Fc1ccc(OCCN2CCCN(c3cccnn3)CC2)cc1	ZINC000105798214	194130678	/nfs/dbraw/zinc/13/06/78/194130678.db2.gz	VVAHMKWWVQQCJW-UHFFFAOYSA-N	0	3	316.380	2.207	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(CC(=O)N2CCCCC2)C1	ZINC000105896602	194161824	/nfs/dbraw/zinc/16/18/24/194161824.db2.gz	UOFTXCCSZFHZNN-HNNXBMFYSA-N	0	3	304.438	2.095	10	0		DEAEHN
Cc1oc(-c2cccs2)nc1CN1CCO[C@H](CN(C)C)C1	ZINC000105925636	194170733	/nfs/dbraw/zinc/17/07/33/194170733.db2.gz	XOASGHWQRCCIFK-CYBMUJFWSA-N	0	3	321.446	2.474	10	0		DEAEHN
CC[C@@H]1CN(Cc2cc(OC)ccc2OC)CCN1CCOC	ZINC000106115328	194186599	/nfs/dbraw/zinc/18/65/99/194186599.db2.gz	KXCDAPHWRUMXGQ-MRXNPFEDSA-N	0	3	322.449	2.246	10	0		DEAEHN
CC1CCN(CCNC(=O)[C@H](Cc2ccccc2)N(C)C)CC1	ZINC000106431823	194213691	/nfs/dbraw/zinc/21/36/91/194213691.db2.gz	JDNZULOLQRWZPV-SFHVURJKSA-N	0	3	317.477	2.007	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)[C@@H](Cc1ccccc1)N(C)C	ZINC000106458402	194217360	/nfs/dbraw/zinc/21/73/60/194217360.db2.gz	BQVHZRMLNLMZTC-FUHWJXTLSA-N	0	3	317.477	2.150	10	0		DEAEHN
CCN[C@@H](CN)c1cc(OC)c(OC)cc1Br	ZINC000050270052	183781304	/nfs/dbraw/zinc/78/13/04/183781304.db2.gz	MJSWSNFEEDTOCZ-JTQLQIEISA-N	0	3	303.200	2.076	10	0		DEAEHN
CC[C@@H](C(N)=S)N1CCN(Cc2ccc(F)cc2F)CC1	ZINC000109469438	194267571	/nfs/dbraw/zinc/26/75/71/194267571.db2.gz	SBXVKWGVDCVFTK-AWEZNQCLSA-N	0	3	313.417	2.147	10	0		DEAEHN
CC[C@@H]1CNCCN1c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000110678402	194349537	/nfs/dbraw/zinc/34/95/37/194349537.db2.gz	NKYRSVSBDQNKTP-SNVBAGLBSA-N	0	3	322.352	2.168	10	0		DEAEHN
Cc1ccc(Cl)cc1S(=O)(=O)N(C)[C@@H]1CCCNC1	ZINC000110927799	194369682	/nfs/dbraw/zinc/36/96/82/194369682.db2.gz	JSLVLAURXHJOLR-GFCCVEGCSA-N	0	3	302.827	2.021	10	0		DEAEHN
CCN([C@H]1CCCNC1)S(=O)(=O)c1ccc(C)cc1Cl	ZINC000110941881	194371752	/nfs/dbraw/zinc/37/17/52/194371752.db2.gz	OOYDQIWZLYMRBB-LBPRGKRZSA-N	0	3	316.854	2.411	10	0		DEAEHN
CCN([C@@H]1CCCNC1)S(=O)(=O)c1ccc(Cl)s1	ZINC000110941683	194372198	/nfs/dbraw/zinc/37/21/98/194372198.db2.gz	MNMVRBFDTPLNQX-SECBINFHSA-N	0	3	308.856	2.164	10	0		DEAEHN
CCc1cccc(NC(=O)CN2CCCN(C3CC3)CC2)c1	ZINC000061041314	184160645	/nfs/dbraw/zinc/16/06/45/184160645.db2.gz	XEICNPKONHEXAE-UHFFFAOYSA-N	0	3	301.434	2.358	10	0		DEAEHN
O=S(=O)(CC[C@@H]1CCCC[NH2+]1)[N-]c1cc(F)c(F)c(F)c1	ZINC000061120354	184162691	/nfs/dbraw/zinc/16/26/91/184162691.db2.gz	WGULEKQWSVWLBI-VIFPVBQESA-N	0	3	322.352	2.378	10	0		DEAEHN
CCNCc1cc(Br)ccc1O[C@@H](CC)C(N)=O	ZINC000061675716	184181910	/nfs/dbraw/zinc/18/19/10/184181910.db2.gz	UCCJADRKXFANJW-NSHDSACASA-N	0	3	315.211	2.201	10	0		DEAEHN
Nc1ccc(NC(=O)CCCN2CCCOCC2)c(Cl)c1	ZINC000061913675	184195223	/nfs/dbraw/zinc/19/52/23/184195223.db2.gz	OHTBYXPLUSKHPF-UHFFFAOYSA-N	0	3	311.813	2.363	10	0		DEAEHN
COc1ccc(Br)cc1C[C@]1(O)CCN(C)C1	ZINC000061986836	184199590	/nfs/dbraw/zinc/19/95/90/184199590.db2.gz	QSVXXJUXTIQHFA-CYBMUJFWSA-N	0	3	300.196	2.067	10	0		DEAEHN
CCCNc1cc(C(=O)NCCN(C)C2CC2)cc(Cl)n1	ZINC000062011898	184201428	/nfs/dbraw/zinc/20/14/28/184201428.db2.gz	HBOYKKYNEFYFPY-UHFFFAOYSA-N	0	3	310.829	2.381	10	0		DEAEHN
COCCNCc1ccc(Br)cc1-n1ccnc1	ZINC000062738543	184251729	/nfs/dbraw/zinc/25/17/29/184251729.db2.gz	XTAMAJGANYVTTJ-UHFFFAOYSA-N	0	3	310.195	2.371	10	0		DEAEHN
COC[C@@H](C)CN1CCCN(C(=O)CCc2ccccc2)CC1	ZINC000189806972	335045307	/nfs/dbraw/zinc/04/53/07/335045307.db2.gz	PRQSTLALOAVTQA-KRWDZBQOSA-N	0	3	318.461	2.436	10	0		DEAEHN
CN[C@@H](Cc1cc(Br)ccc1OC)c1cn[nH]n1	ZINC000158848467	197306149	/nfs/dbraw/zinc/30/61/49/197306149.db2.gz	IXEJMRNQWOPOMI-JTQLQIEISA-N	0	3	311.183	2.079	10	0		DEAEHN
COCCCNCC(=O)Nc1ccc(NC(=O)CC(C)C)cc1	ZINC000066068342	184386292	/nfs/dbraw/zinc/38/62/92/184386292.db2.gz	NZYHAGUTMLCHBO-UHFFFAOYSA-N	0	3	321.421	2.236	10	0		DEAEHN
CCNCC(=O)Nc1cccc(C(=O)NC2CCCCC2)c1	ZINC000066225731	184397718	/nfs/dbraw/zinc/39/77/18/184397718.db2.gz	MPPRWFFRHZGIAK-UHFFFAOYSA-N	0	3	303.406	2.297	10	0		DEAEHN
CNCC(=O)Nc1cccc(NC(=O)CCc2ccccc2)c1	ZINC000066225853	184397778	/nfs/dbraw/zinc/39/77/78/184397778.db2.gz	IRUCMNJQEOULRS-UHFFFAOYSA-N	0	3	311.385	2.416	10	0		DEAEHN
C[C@@H](CC(=O)N(C)CCCN(C)C)C(=O)c1cccc(F)c1	ZINC000539416505	285076871	/nfs/dbraw/zinc/07/68/71/285076871.db2.gz	RKNCHNRSFJPXHP-ZDUSSCGKSA-N	0	3	308.397	2.445	10	0		DEAEHN
CC[C@H]1CCCN(S(=O)(=O)c2cc(C)c(F)c(CN)c2)C1	ZINC000159073279	197324857	/nfs/dbraw/zinc/32/48/57/197324857.db2.gz	MXVSPNSPCIYWCN-LBPRGKRZSA-N	0	3	314.426	2.404	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000158838394	197305044	/nfs/dbraw/zinc/30/50/44/197305044.db2.gz	JYSYQGFIXGHARH-KGLIPLIRSA-N	0	3	305.422	2.327	10	0		DEAEHN
CCNCc1ccccc1S(=O)(=O)N1C[C@@H]2CCC[C@@H]2C1	ZINC000158766969	197299824	/nfs/dbraw/zinc/29/98/24/197299824.db2.gz	ZKUQYBIMTCPBLV-GASCZTMLSA-N	0	3	308.447	2.217	10	0		DEAEHN
CCCN[C@H](C)c1c(Br)cnn1CCN(C)C	ZINC000158739608	197298022	/nfs/dbraw/zinc/29/80/22/197298022.db2.gz	RTDHXYMSVIZESO-SNVBAGLBSA-N	0	3	303.248	2.268	10	0		DEAEHN
COc1ccc(CC(=O)N[C@H](CC(C)C)CN(C)C)cc1F	ZINC000120234475	195124931	/nfs/dbraw/zinc/12/49/31/195124931.db2.gz	ZAZHWOPHOXIKNO-CQSZACIVSA-N	0	3	310.413	2.469	10	0		DEAEHN
C[C@H]1C[C@H](Nc2nc(Cl)nc(N3CCCC3)n2)CCN1C	ZINC000158605708	197288274	/nfs/dbraw/zinc/28/82/74/197288274.db2.gz	OMPZOUNAKMGZEN-WDEREUQCSA-N	0	3	310.833	2.020	10	0		DEAEHN
C[C@@H](NCc1ccc(I)o1)[C@H]1CCOC1	ZINC000158490202	197277470	/nfs/dbraw/zinc/27/74/70/197277470.db2.gz	FTPSWKZXZLHCQY-BDAKNGLRSA-N	0	3	321.158	2.399	10	0		DEAEHN
CN(Cc1cscn1)[C@@H](CN)c1cn(C)nc1C(C)(C)C	ZINC000158393890	197268524	/nfs/dbraw/zinc/26/85/24/197268524.db2.gz	DYSVWKJKAPWBEX-ZDUSSCGKSA-N	0	3	307.467	2.306	10	0		DEAEHN
COc1ccc([C@H](C)NC[C@]2(O)CCSC2)cc1NC(C)=O	ZINC000158247500	197257233	/nfs/dbraw/zinc/25/72/33/197257233.db2.gz	SBOOZNREZDOGCG-MEDUHNTESA-N	0	3	324.446	2.172	10	0		DEAEHN
C[C@@H]1C[C@H](Nc2nc3c(cc2C(N)=S)CCC3)CCN1C	ZINC000158059728	197240151	/nfs/dbraw/zinc/24/01/51/197240151.db2.gz	JOIJUUWXZILAMG-ZYHUDNBSSA-N	0	3	304.463	2.099	10	0		DEAEHN
O=C(CCN1CCC(n2cncn2)CC1)Nc1ccccc1F	ZINC000157764877	197213962	/nfs/dbraw/zinc/21/39/62/197213962.db2.gz	PAAMBTODEUWUIZ-UHFFFAOYSA-N	0	3	317.368	2.083	10	0		DEAEHN
CC(C)(C)[C@@H](N)C(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000157626467	197202877	/nfs/dbraw/zinc/20/28/77/197202877.db2.gz	DOTLCSJKVSBUTH-AWEZNQCLSA-N	0	3	309.841	2.362	10	0		DEAEHN
CCO[C@H]1C[C@@](N)(C(=O)NCCCCC(F)(F)F)C1(C)C	ZINC000157513432	197192897	/nfs/dbraw/zinc/19/28/97/197192897.db2.gz	ZDFUTQLWRFUVPE-GXFFZTMASA-N	0	3	310.360	2.368	10	0		DEAEHN
CS(=O)(=O)c1ccc(N[C@@H]2C[C@@H](N)c3ccccc32)cn1	ZINC000157305411	197178165	/nfs/dbraw/zinc/17/81/65/197178165.db2.gz	MMLBPOQZNMNTJK-ZIAGYGMSSA-N	0	3	303.387	2.042	10	0		DEAEHN
CCOCCN(C)[C@H](CN)c1cc2c(c(Cl)c1)OCO2	ZINC000157098934	197162144	/nfs/dbraw/zinc/16/21/44/197162144.db2.gz	HAFRZKDAIIPCRU-GFCCVEGCSA-N	0	3	300.786	2.037	10	0		DEAEHN
C[C@@](O)(Cc1ccc(C(F)(F)F)cc1)C[C@@H]1COCCN1	ZINC000156779553	197140056	/nfs/dbraw/zinc/14/00/56/197140056.db2.gz	ZUEVQSJMCLKBJH-ZIAGYGMSSA-N	0	3	303.324	2.377	10	0		DEAEHN
COc1cccc(OC)c1C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000155443659	197055983	/nfs/dbraw/zinc/05/59/83/197055983.db2.gz	YJKKFHUXBKBKDA-STQMWFEESA-N	0	3	306.406	2.162	10	0		DEAEHN
CCCC1(CNC(=O)NC[C@H](O)CN2CCCCC2)CCC1	ZINC000155317654	197043566	/nfs/dbraw/zinc/04/35/66/197043566.db2.gz	RSCOHHXJMVILIN-HNNXBMFYSA-N	0	3	311.470	2.103	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)CCCSC(C)(C)C)CCO1	ZINC000155120424	197024230	/nfs/dbraw/zinc/02/42/30/197024230.db2.gz	BCHPCPUTPMFJGH-ZDUSSCGKSA-N	0	3	302.484	2.087	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCCC[C@@H]2c2ccnn2C)C1	ZINC000332827241	285230022	/nfs/dbraw/zinc/23/00/22/285230022.db2.gz	YCOBAHKMWAPAJK-GDBMZVCRSA-N	0	3	319.453	2.141	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C(=O)N(C)C)c1ccccc1	ZINC000177698730	285275007	/nfs/dbraw/zinc/27/50/07/285275007.db2.gz	WMUZFIHZVCKYIX-IRXDYDNUSA-N	0	3	303.450	2.232	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000120677508	195213965	/nfs/dbraw/zinc/21/39/65/195213965.db2.gz	AEKJYGVIOXBOPD-ZBFHGGJFSA-N	0	3	317.433	2.183	10	0		DEAEHN
Cc1ccc(CN2CC[C@@H]3CO[C@@H](CN4CCCC4=O)[C@@H]3C2)o1	ZINC000248097114	257109349	/nfs/dbraw/zinc/10/93/49/257109349.db2.gz	MUYRYBXZMWVNRW-OIISXLGYSA-N	0	3	318.417	2.047	10	0		DEAEHN
CC[C@H]1CN(Cc2cnc3c(C)cccn23)CCN1CCOC	ZINC000120950421	195270200	/nfs/dbraw/zinc/27/02/00/195270200.db2.gz	VORGCJGCSSFQRS-INIZCTEOSA-N	0	3	316.449	2.185	10	0		DEAEHN
Cn1ccnc1CC1CCN(Cc2cc(C(N)=O)cs2)CC1	ZINC000121801658	195350079	/nfs/dbraw/zinc/35/00/79/195350079.db2.gz	VOZSKPSWPVSRJD-UHFFFAOYSA-N	0	3	318.446	2.035	10	0		DEAEHN
CC(C)[C@H](C)N(C)S(=O)(=O)c1ccc(CN)cc1Cl	ZINC000126221099	195821757	/nfs/dbraw/zinc/82/17/57/195821757.db2.gz	SQAYKZRTQXBMES-JTQLQIEISA-N	0	3	304.843	2.464	10	0		DEAEHN
c1c2c(nn1-c1ccccc1)CCC[C@@H]2NC[C@@H]1COCCO1	ZINC000358913795	285421094	/nfs/dbraw/zinc/42/10/94/285421094.db2.gz	JBXNIEKHUZYZIN-WBVHZDCISA-N	0	3	313.401	2.255	10	0		DEAEHN
O=C([C@@H](C1CC1)N1CCCC1)N1CCCC[C@H]1c1cn[nH]c1	ZINC000124172502	304289442	/nfs/dbraw/zinc/28/94/42/304289442.db2.gz	VQXOOLYMPPIDMK-JKSUJKDBSA-N	0	3	302.422	2.338	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@](C)(C[NH3+])C2CC2)sc1Cl	ZINC000231810769	132553743	/nfs/dbraw/zinc/55/37/43/132553743.db2.gz	QHCPZTXRDKXOCY-NSHDSACASA-N	0	3	308.856	2.116	10	0		DEAEHN
C/C(=C/c1nc([C@H]2CNCCN2C)no1)c1ccc(F)cc1	ZINC000263238937	132578864	/nfs/dbraw/zinc/57/88/64/132578864.db2.gz	OJENKUTWTXOHOD-RBJHHQRMSA-N	0	3	302.353	2.345	10	0		DEAEHN
CC1=CCN(CCNC(=O)NC[C@H](C)N2CCC(C)CC2)CC1	ZINC000358188805	133127052	/nfs/dbraw/zinc/12/70/52/133127052.db2.gz	LSWPJPIKFSVDFK-KRWDZBQOSA-N	0	3	322.497	2.058	10	0		DEAEHN
c1ccc2c(c1)CC[C@H](CN1CCN(C[C@H]3CCOC3)CC1)C2	ZINC000359591336	133132669	/nfs/dbraw/zinc/13/26/69/133132669.db2.gz	WCBLOZHLBSGXPX-ZWKOTPCHSA-N	0	3	314.473	2.446	10	0		DEAEHN
COCCn1cc(CN2CCC(C3CCOCC3)CC2)cn1	ZINC000362386941	133227034	/nfs/dbraw/zinc/22/70/34/133227034.db2.gz	YIDAAAGXTUXAOW-UHFFFAOYSA-N	0	3	307.438	2.168	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@@H](C(=O)N1CCN(C(C)C)CC1)CC2	ZINC000373569691	133395790	/nfs/dbraw/zinc/39/57/90/133395790.db2.gz	TXNKZZIGABULPD-AWEZNQCLSA-N	0	3	318.465	2.191	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@H](C(=O)N1CCN(C(C)C)CC1)C2	ZINC000373569691	133395791	/nfs/dbraw/zinc/39/57/91/133395791.db2.gz	TXNKZZIGABULPD-AWEZNQCLSA-N	0	3	318.465	2.191	10	0		DEAEHN
C[C@H]1CC[C@@](CO)(N(C)Cc2ccc(-n3ccnc3)nc2)C1	ZINC000187908335	145005020	/nfs/dbraw/zinc/00/50/20/145005020.db2.gz	VSALUCWHQQWYTF-WMLDXEAASA-N	0	3	300.406	2.250	10	0		DEAEHN
O=C(N1CCN2CCC[C@@H]2C1)C1(Cc2ccccc2F)CC1	ZINC000188384308	145011093	/nfs/dbraw/zinc/01/10/93/145011093.db2.gz	JSSHHTWSMAXRAC-OAHLLOKOSA-N	0	3	302.393	2.455	10	0		DEAEHN
Cc1ccc(NC(=O)c2n[nH]c3c2CNCC3)cc1-c1ncco1	ZINC000188638874	145015154	/nfs/dbraw/zinc/01/51/54/145015154.db2.gz	XGERUXIHQYTRHT-UHFFFAOYSA-N	0	3	323.356	2.271	10	0		DEAEHN
O=C([C@@H]1C[C@@H]1c1ccc(F)c(F)c1)N1CCN2CCC1CC2	ZINC000188642108	145015248	/nfs/dbraw/zinc/01/52/48/145015248.db2.gz	QOABVIUMFLNYJS-ZIAGYGMSSA-N	0	3	306.356	2.375	10	0		DEAEHN
CCc1nn(C)c(CC)c1CC(=O)N(C)C[C@@H]1CCCN1CC	ZINC000188705296	145016347	/nfs/dbraw/zinc/01/63/47/145016347.db2.gz	QGRDBHPVEKUHPY-AWEZNQCLSA-N	0	3	320.481	2.030	10	0		DEAEHN
CC(C)Oc1ccc(CC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000189147358	145023335	/nfs/dbraw/zinc/02/33/35/145023335.db2.gz	KPQVFSJGIVSQSZ-MRXNPFEDSA-N	0	3	302.418	2.323	10	0		DEAEHN
CCc1nnc(C2CCN(CC(=O)NCCC(C)(C)C)CC2)[nH]1	ZINC000190665726	145045728	/nfs/dbraw/zinc/04/57/28/145045728.db2.gz	WWFLQKYPOXPLQY-UHFFFAOYSA-N	0	3	321.469	2.099	10	0		DEAEHN
CCCN(CCC)C(=O)CN1CCC(c2n[nH]c(CC)n2)CC1	ZINC000190700983	145046108	/nfs/dbraw/zinc/04/61/08/145046108.db2.gz	JIFPCQJUXKULPQ-UHFFFAOYSA-N	0	3	321.469	2.195	10	0		DEAEHN
CCCN(CCC)C(=O)CN1CCC(c2nc(CC)n[nH]2)CC1	ZINC000190700983	145046109	/nfs/dbraw/zinc/04/61/09/145046109.db2.gz	JIFPCQJUXKULPQ-UHFFFAOYSA-N	0	3	321.469	2.195	10	0		DEAEHN
CCCN(CCC)C(=O)CN1CCC(c2nnc(CC)[nH]2)CC1	ZINC000190700983	145046110	/nfs/dbraw/zinc/04/61/10/145046110.db2.gz	JIFPCQJUXKULPQ-UHFFFAOYSA-N	0	3	321.469	2.195	10	0		DEAEHN
COCCN(CCN(C)C)C(=O)NCc1ccc(C2CC2)cc1	ZINC000191613886	145061477	/nfs/dbraw/zinc/06/14/77/145061477.db2.gz	PTNGRNOTSRSWDV-UHFFFAOYSA-N	0	3	319.449	2.284	10	0		DEAEHN
CCc1nc2n(n1)C[C@@H](NCc1cccc(OC)c1F)CC2	ZINC000192680758	145077057	/nfs/dbraw/zinc/07/70/57/145077057.db2.gz	HZUXLHZUUPUPOZ-LBPRGKRZSA-N	0	3	304.369	2.093	10	0		DEAEHN
c1ccc(N2CCCN(CCO[C@@H]3CCCCO3)CC2)nc1	ZINC000193121550	145082975	/nfs/dbraw/zinc/08/29/75/145082975.db2.gz	LQORRWJKKRBHAF-QGZVFWFLSA-N	0	3	305.422	2.137	10	0		DEAEHN
COc1ncccc1CN1CCC[C@H](Cc2nccn2C)C1	ZINC000193456645	145086180	/nfs/dbraw/zinc/08/61/80/145086180.db2.gz	FSYSGHDQMMAQKF-CQSZACIVSA-N	0	3	300.406	2.278	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H](C)Oc2ccccc2)C1	ZINC000246333587	145099599	/nfs/dbraw/zinc/09/95/99/145099599.db2.gz	IINSANSEVXQTOC-GJZGRUSLSA-N	0	3	305.422	2.237	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCC[C@@H](n2cc(C)cn2)C1	ZINC000246405495	145102177	/nfs/dbraw/zinc/10/21/77/145102177.db2.gz	RUWRASANEUATMV-HZPDHXFCSA-N	0	3	319.453	2.022	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)N2CCC(c3cc[nH]n3)CC2)C1	ZINC000246452807	145103769	/nfs/dbraw/zinc/10/37/69/145103769.db2.gz	OUKWTNIVQJHJKF-XJKSGUPXSA-N	0	3	319.453	2.027	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)[C@H]1CCCc2n[nH]cc21	ZINC000246536058	145106243	/nfs/dbraw/zinc/10/62/43/145106243.db2.gz	LNVCQLVPEJREGI-KGLIPLIRSA-N	0	3	304.438	2.210	10	0		DEAEHN
C[C@@H]1CN(C[C@@H](O)c2cccc(Cl)c2)C[C@H]1N1CCOCC1	ZINC000246580474	145107762	/nfs/dbraw/zinc/10/77/62/145107762.db2.gz	WBWZPDRFBOHUJV-KBRIMQKVSA-N	0	3	324.852	2.026	10	0		DEAEHN
C[C@H](C(=O)Nc1cccc2ncccc21)N1CCN2CCC[C@H]2C1	ZINC000246718369	145112218	/nfs/dbraw/zinc/11/22/18/145112218.db2.gz	UWZOKVBHIUXRFI-CABCVRRESA-N	0	3	324.428	2.342	10	0		DEAEHN
CN(C(=O)CCN1CCN2CCCC[C@H]2C1)c1ccccc1	ZINC000246853628	145117034	/nfs/dbraw/zinc/11/70/34/145117034.db2.gz	PGBZFQSEFAUHHS-KRWDZBQOSA-N	0	3	301.434	2.210	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cn(CCC(C)C)nn1	ZINC000246958697	145120988	/nfs/dbraw/zinc/12/09/88/145120988.db2.gz	MKMDBQYGQXZMAW-GJZGRUSLSA-N	0	3	319.453	2.023	10	0		DEAEHN
O[C@@]12CCCC[C@H]1CN(Cc1ccc(-n3ccnc3)nc1)CC2	ZINC000247039564	145124557	/nfs/dbraw/zinc/12/45/57/145124557.db2.gz	RCMJQSZYPGNLDI-FUHWJXTLSA-N	0	3	312.417	2.394	10	0		DEAEHN
Cc1ccc(F)cc1NC(=O)[C@H](C)N1CCN2CCC[C@H]2C1	ZINC000247050340	145124811	/nfs/dbraw/zinc/12/48/11/145124811.db2.gz	FGNWZSDOQKKGPE-ZFWWWQNUSA-N	0	3	305.397	2.241	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(C[C@@H](O)COC(C)(C)C)C1	ZINC000247062299	145124953	/nfs/dbraw/zinc/12/49/53/145124953.db2.gz	GAMGQJJCPOMWPN-LSDHHAIUSA-N	0	3	309.454	2.258	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N[C@H]1CCCC[C@@H]1C	ZINC000247187244	145129209	/nfs/dbraw/zinc/12/92/09/145129209.db2.gz	WGLOVZNKDYYPRO-XIRDDKMYSA-N	0	3	318.465	2.351	10	0		DEAEHN
COC(=O)Nc1cccc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000247406279	145135963	/nfs/dbraw/zinc/13/59/63/145135963.db2.gz	PTRFBGHOTHHAHQ-DOMZBBRYSA-N	0	3	317.389	2.174	10	0		DEAEHN
O=C(N[C@H]1CCCOC1)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000247808429	145144525	/nfs/dbraw/zinc/14/45/25/145144525.db2.gz	UBFVVLWCFGPREC-RDJZCZTQSA-N	0	3	320.408	2.333	10	0		DEAEHN
C[S@](=O)C[C@H](N[C@H]1Cc2ccccc2[C@@H]1O)c1ccccc1	ZINC000248564265	145159398	/nfs/dbraw/zinc/15/93/98/145159398.db2.gz	KJLUNMJVBQTYQV-ORGXJRBJSA-N	0	3	315.438	2.354	10	0		DEAEHN
COC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CCCCCn1cccn1	ZINC000248785025	145167761	/nfs/dbraw/zinc/16/77/61/145167761.db2.gz	COADSKAHJIZVCP-JYJNAYRXSA-N	0	3	305.422	2.327	10	0		DEAEHN
OC[C@@H]1CN(CCO[C@H]2CCCCO2)C[C@@H]1c1ccsc1	ZINC000248836697	145169293	/nfs/dbraw/zinc/16/92/93/145169293.db2.gz	OMHYBMUFXZQEDS-XHSDSOJGSA-N	0	3	311.447	2.299	10	0		DEAEHN
O=C1O[C@@H](CN2CCCN(c3ccccn3)CC2)CC12CCC2	ZINC000248841986	145170148	/nfs/dbraw/zinc/17/01/48/145170148.db2.gz	LWPWJXVNBPGDFU-OAHLLOKOSA-N	0	3	315.417	2.080	10	0		DEAEHN
NC(=O)[C@H](Cc1ccc(Cl)cc1)N1CC[C@@H]2OCCC[C@@H]2C1	ZINC000248879057	145171169	/nfs/dbraw/zinc/17/11/69/145171169.db2.gz	NPDOBMPNFGCWJD-KBMXLJTQSA-N	0	3	322.836	2.237	10	0		DEAEHN
CCCNC(=O)[C@@H](C)N1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000249885013	145191323	/nfs/dbraw/zinc/19/13/23/145191323.db2.gz	OTRKVVRORDNKHV-CABCVRRESA-N	0	3	304.438	2.039	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)[C@H]2C[C@H]2C2CC2)C1	ZINC000252006373	145198222	/nfs/dbraw/zinc/19/82/22/145198222.db2.gz	XQBLJXAOHSUBRC-SZMVWBNQSA-N	0	3	313.445	2.408	10	0		DEAEHN
Cc1ccc(OCC(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1C	ZINC000252443828	145198850	/nfs/dbraw/zinc/19/88/50/145198850.db2.gz	PAWQQTHDTBZAGY-CVEARBPZSA-N	0	3	302.418	2.377	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN([C@H]2CCCN(C(C)C)C2=O)C1	ZINC000252648877	145199902	/nfs/dbraw/zinc/19/99/02/145199902.db2.gz	NLBMRGDFIXLMAD-CVEARBPZSA-N	0	3	318.465	2.482	10	0		DEAEHN
CC(C)(C)[C@H](C[NH3+])[N-]S(=O)(=O)c1ccc(F)cc1Cl	ZINC000261558561	145207698	/nfs/dbraw/zinc/20/76/98/145207698.db2.gz	BFJJBBCDRVDINH-NSHDSACASA-N	0	3	308.806	2.131	10	0		DEAEHN
Cn1nccc1C1C[C@H]2CC[C@@H](C1)N2Cc1cnc(N)s1	ZINC000261599768	145209370	/nfs/dbraw/zinc/20/93/70/145209370.db2.gz	AYOJRQPKGBQTKN-YOGCLGLASA-N	0	3	303.435	2.369	10	0		DEAEHN
C[C@H](NC(=O)[C@@H]1NCCCC1(C)C)c1ccc2c(c1)OCCO2	ZINC000261626226	145211563	/nfs/dbraw/zinc/21/15/63/145211563.db2.gz	CQRWYPVFYXIYFV-LRDDRELGSA-N	0	3	318.417	2.413	10	0		DEAEHN
COc1ccccc1[C@H]1CNCCN1Cc1cncc(F)c1	ZINC000261767627	145224055	/nfs/dbraw/zinc/22/40/55/145224055.db2.gz	RVKXDINFLBBLPV-MRXNPFEDSA-N	0	3	301.365	2.376	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)CN2CCNC[C@H]2c2cccnc2)c1	ZINC000261768664	145224247	/nfs/dbraw/zinc/22/42/47/145224247.db2.gz	OPXLRKUBXNJNGO-SFHVURJKSA-N	0	3	324.428	2.283	10	0		DEAEHN
Cc1ccc(CSCCNC(=O)[C@@H](N)C2CCOCC2)cc1	ZINC000261776126	145224744	/nfs/dbraw/zinc/22/47/44/145224744.db2.gz	MPVQPOCHGFBHMQ-INIZCTEOSA-N	0	3	322.474	2.098	10	0		DEAEHN
COc1cc(N[C@@H]2CCC[C@@H]2[C@H]2COCCN2)cc(OC)c1	ZINC000261888056	145238078	/nfs/dbraw/zinc/23/80/78/145238078.db2.gz	GDQMBRSSCRDPSK-GVDBMIGSSA-N	0	3	306.406	2.273	10	0		DEAEHN
c1c(CN2CCNC[C@@H]2c2ccncc2)[nH]nc1-c1cccnc1	ZINC000261921309	145242142	/nfs/dbraw/zinc/24/21/42/145242142.db2.gz	BREKKODWZDCAKX-GOSISDBHSA-N	0	3	320.400	2.013	10	0		DEAEHN
NC1(C(=O)Nc2cccc(Oc3ccncc3)c2)CCOCC1	ZINC000261922526	145242662	/nfs/dbraw/zinc/24/26/62/145242662.db2.gz	VEPFDPDKPNGCGH-UHFFFAOYSA-N	0	3	313.357	2.320	10	0		DEAEHN
CN(Cc1ccc(F)cc1)C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C	ZINC000261973995	145248834	/nfs/dbraw/zinc/24/88/34/145248834.db2.gz	ZJYWFYKKGDZVSU-HDMKZQKVSA-N	0	3	320.408	2.317	10	0		DEAEHN
C[C@@H](NC(=O)C1(N)CCOCC1)c1ccc2c(c1)CCCC2	ZINC000262139082	145265378	/nfs/dbraw/zinc/26/53/78/145265378.db2.gz	MESQNVDGQAHBPE-CYBMUJFWSA-N	0	3	302.418	2.251	10	0		DEAEHN
CC1CCC(CNC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)CC1	ZINC000262464640	145285913	/nfs/dbraw/zinc/28/59/13/145285913.db2.gz	IVTKFTLGZOMEPF-LJQAXIPVSA-N	0	3	308.466	2.461	10	0		DEAEHN
C[C@H]1NCCN(C(=O)c2ccn(-c3cccc(Cl)c3)n2)[C@@H]1C	ZINC000262787914	145305320	/nfs/dbraw/zinc/30/53/20/145305320.db2.gz	MQABGMXTYMLVOK-VXGBXAGGSA-N	0	3	318.808	2.348	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(C[C@@H]2CCCc3ccccc32)n1	ZINC000263153301	145330111	/nfs/dbraw/zinc/33/01/11/145330111.db2.gz	DFBAEUBROJLRPL-HOCLYGCPSA-N	0	3	312.417	2.308	10	0		DEAEHN
C[C@H](Cc1ccccc1F)c1nc([C@H]2CNCCN2C)no1	ZINC000263227210	145338476	/nfs/dbraw/zinc/33/84/76/145338476.db2.gz	MZLSMISFBVSHJN-BXUZGUMPSA-N	0	3	304.369	2.131	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CC[C@H](n2cc(Cl)cn2)C1	ZINC000358489503	147144067	/nfs/dbraw/zinc/14/40/67/147144067.db2.gz	YSWNEAOKAZEZBW-UONOGXRCSA-N	0	3	310.829	2.184	10	0		DEAEHN
CC[C@H](C)N[C@@H](CNC(=O)Cn1nc(C)cc1C)c1ccco1	ZINC000359536805	147346807	/nfs/dbraw/zinc/34/68/07/147346807.db2.gz	KOZSZTROZKRKQC-WFASDCNBSA-N	0	3	318.421	2.339	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)[C@H](C)N1CCC[C@@H](c2nc[nH]n2)C1	ZINC000374548279	148260226	/nfs/dbraw/zinc/26/02/26/148260226.db2.gz	JRXMAJWWZIESPQ-RRFJBIMHSA-N	0	3	319.453	2.164	10	0		DEAEHN
C/C(=C\C(C)(C)C)C(=O)N1CCN([C@@H]2CCCN(C)C2)CC1	ZINC000375378316	148365316	/nfs/dbraw/zinc/36/53/16/148365316.db2.gz	IXVSXSRVMAZCLM-QJPKHSJYSA-N	0	3	307.482	2.217	10	0		DEAEHN
O=C1OCC[C@@H]1CCN1CCC(c2ccccc2CO)CC1	ZINC000375571881	148386936	/nfs/dbraw/zinc/38/69/36/148386936.db2.gz	QGINRBWLQGUJMH-HNNXBMFYSA-N	0	3	303.402	2.312	10	0		DEAEHN
C[C@H]1CCCN(C(C)(C)CNC(=O)c2cnn3c2CCCC3)C1	ZINC000127206598	401724991	/nfs/dbraw/zinc/72/49/91/401724991.db2.gz	NVOJCEQNIBJFSN-AWEZNQCLSA-N	0	3	318.465	2.460	10	0		DEAEHN
CC(C)COC1CCN(C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)CC1	ZINC000127323103	401729407	/nfs/dbraw/zinc/72/94/07/401729407.db2.gz	PCZLBUMIWYBKBY-HUUCEWRRSA-N	0	3	323.481	2.458	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)c2cn(C)nc2C(C)(C)C)[C@@H](C)C1	ZINC000127568165	401740478	/nfs/dbraw/zinc/74/04/78/401740478.db2.gz	GLGJNVUVDVYAGL-JSGCOSHPSA-N	0	3	306.454	2.176	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)NC1CCN(CCc2ccncc2)CC1	ZINC000072075212	401703031	/nfs/dbraw/zinc/70/30/31/401703031.db2.gz	UMNQQZPNTKAKTR-HNNXBMFYSA-N	0	3	318.465	2.432	10	0		DEAEHN
O[C@H](CN1CCCC[C@@H]1CN1CCOCC1)c1ccc(F)cc1	ZINC000111302418	401710088	/nfs/dbraw/zinc/71/00/88/401710088.db2.gz	HKPAHDBHAIYYDQ-QZTJIDSGSA-N	0	3	322.424	2.046	10	0		DEAEHN
Fc1cccc(CNCCCn2ccnn2)c1Br	ZINC000126939858	401714545	/nfs/dbraw/zinc/71/45/45/401714545.db2.gz	VJGAKPFXDYUVLU-UHFFFAOYSA-N	0	3	313.174	2.360	10	0		DEAEHN
O=C(Nc1nccs1)[C@H]1CCCN1CCN1CCCCC1	ZINC000077313004	401809317	/nfs/dbraw/zinc/80/93/17/401809317.db2.gz	RDHVMKMSTHPHIY-CYBMUJFWSA-N	0	3	308.451	2.032	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)Cc2cc(Cl)cn2C)C1	ZINC000128077414	401761950	/nfs/dbraw/zinc/76/19/50/401761950.db2.gz	NJNGOFISQQXRBH-CYBMUJFWSA-N	0	3	312.845	2.304	10	0		DEAEHN
CCOc1ncc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1Cl	ZINC000113222465	401770891	/nfs/dbraw/zinc/77/08/91/401770891.db2.gz	QDRPFFRPPULLGQ-AAEUAGOBSA-N	0	3	323.824	2.442	10	0		DEAEHN
COc1cccc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1OC	ZINC000113229321	401771865	/nfs/dbraw/zinc/77/18/65/401771865.db2.gz	AYKGCWKLOQRWSC-QWHCGFSZSA-N	0	3	304.390	2.013	10	0		DEAEHN
Cc1cc(N2C[C@H]3OCCN(C)[C@H]3C2)c2cc(F)ccc2n1	ZINC000130259012	401824946	/nfs/dbraw/zinc/82/49/46/401824946.db2.gz	OGCUVRDVLSXOSR-DLBZAZTESA-N	0	3	301.365	2.202	10	0		DEAEHN
CC(C)(CNC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccncc1	ZINC000130266028	401825163	/nfs/dbraw/zinc/82/51/63/401825163.db2.gz	GUIVWLFZQOGYNS-INIZCTEOSA-N	0	3	314.433	2.015	10	0		DEAEHN
CC(C)CC[C@](C)(O)CNC(=O)NCCN1CCC(C)CC1	ZINC000077774341	401830151	/nfs/dbraw/zinc/83/01/51/401830151.db2.gz	NRUBXFFCXXADSJ-KRWDZBQOSA-N	0	3	313.486	2.205	10	0		DEAEHN
CN1CC[C@@H](N2CCC[C@H](c3nc(-c4ccccc4)c[nH]3)C2)C1=O	ZINC000116281043	401847815	/nfs/dbraw/zinc/84/78/15/401847815.db2.gz	QNXHJKYBSBOPML-DOTOQJQBSA-N	0	3	324.428	2.487	10	0		DEAEHN
O=C(Cc1ccc(Br)cc1)N1CCN2CCC[C@H]2C1	ZINC000027932844	401848875	/nfs/dbraw/zinc/84/88/75/401848875.db2.gz	NQFRFUDIHZJSCF-AWEZNQCLSA-N	0	3	323.234	2.298	10	0		DEAEHN
COC(=O)c1cc(CN2CC[C@H](c3cnn(C)c3)C2)oc1C	ZINC000116314964	401849581	/nfs/dbraw/zinc/84/95/81/401849581.db2.gz	XKKUMOCGBAAOLU-LBPRGKRZSA-N	0	3	303.362	2.098	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2cc(Cl)ccc2Cl)CCO1	ZINC000116788393	401858975	/nfs/dbraw/zinc/85/89/75/401858975.db2.gz	DNHNUVDKSQJSJU-NSHDSACASA-N	0	3	317.216	2.396	10	0		DEAEHN
C[C@H]1CCc2c(C(=O)N3CCO[C@H](CN(C)C)C3)csc2C1	ZINC000116791782	401859041	/nfs/dbraw/zinc/85/90/41/401859041.db2.gz	APGMEYVXJXDXMM-QWHCGFSZSA-N	0	3	322.474	2.276	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)Nc1cnn(CC(F)F)c1	ZINC000116930379	401864837	/nfs/dbraw/zinc/86/48/37/401864837.db2.gz	GZZVCZMFVMDQAS-LLVKDONJSA-N	0	3	315.368	2.144	10	0		DEAEHN
CC(C)[C@@H]1CN(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)CCS1	ZINC000132438524	401867364	/nfs/dbraw/zinc/86/73/64/401867364.db2.gz	DDTAEIJBEMPIPY-KKUMJFAQSA-N	0	3	313.511	2.498	10	0		DEAEHN
CCCC1CCC(NC(=O)N2CCO[C@H](CN(C)C)C2)CC1	ZINC000117038505	401867882	/nfs/dbraw/zinc/86/78/82/401867882.db2.gz	OIWBDPOJJGCXRS-UYSNPLJNSA-N	0	3	311.470	2.317	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)CSCc2cscn2)CCN1C	ZINC000132538589	401869083	/nfs/dbraw/zinc/86/90/83/401869083.db2.gz	RSRNEVPRSPYIAK-WCQYABFASA-N	0	3	313.492	2.317	10	0		DEAEHN
CCc1cnc(CCNC(=O)N2CC[C@@H](N3CCCC3)C2)s1	ZINC000080532178	401890175	/nfs/dbraw/zinc/89/01/75/401890175.db2.gz	CBITXGMBPUDVLI-CYBMUJFWSA-N	0	3	322.478	2.128	10	0		DEAEHN
Cc1cccc(CN[C@H](C)c2ccc(S(N)(=O)=O)cc2)c1	ZINC000035230410	401897092	/nfs/dbraw/zinc/89/70/92/401897092.db2.gz	PJOQCILMFZGPPV-CYBMUJFWSA-N	0	3	304.415	2.493	10	0		DEAEHN
CCOC(=O)CCN1CC[C@H](c2cc(OC)cc(OC)c2)C1	ZINC000083402937	401901264	/nfs/dbraw/zinc/90/12/64/401901264.db2.gz	SVLAOOOIWBWSOA-ZDUSSCGKSA-N	0	3	307.390	2.446	10	0		DEAEHN
CCC[C@@H](O)CN(CCN1CCOCC1)Cc1ccccc1C	ZINC000036104377	401902520	/nfs/dbraw/zinc/90/25/20/401902520.db2.gz	NQGLFDSJGWASPX-LJQANCHMSA-N	0	3	320.477	2.290	10	0		DEAEHN
CCOc1ccc(NC(=O)N2CCO[C@@H](CN(C)C)C2)c(C)c1	ZINC000118808873	401909099	/nfs/dbraw/zinc/90/90/99/401909099.db2.gz	JFXOLXLMLNKRCJ-HNNXBMFYSA-N	0	3	321.421	2.188	10	0		DEAEHN
O=C(c1ccc(Br)cc1)N1CCN2CCC[C@@H]2C1	ZINC000037503242	401914642	/nfs/dbraw/zinc/91/46/42/401914642.db2.gz	ALVVEJBBQCEHFW-CYBMUJFWSA-N	0	3	309.207	2.369	10	0		DEAEHN
CCNC(=O)CCN1CCC[C@H]1CC(=O)c1ccc(F)cc1	ZINC000134842914	401916693	/nfs/dbraw/zinc/91/66/93/401916693.db2.gz	WZUATXUSJIBJSS-HNNXBMFYSA-N	0	3	306.381	2.389	10	0		DEAEHN
COC(=O)C[C@H](N)c1cc(OC)c(OC)cc1Br	ZINC000037754943	401916984	/nfs/dbraw/zinc/91/69/84/401916984.db2.gz	NVHNTVBCNLKQPD-VIFPVBQESA-N	0	3	318.167	2.029	10	0		DEAEHN
O=S(=O)([C@H]1CCN(CC2CCCCC2)C1)N1CCCC1	ZINC000135750269	401952560	/nfs/dbraw/zinc/95/25/60/401952560.db2.gz	ZBKRQXCTRCDBCZ-HNNXBMFYSA-N	0	3	300.468	2.067	10	0		DEAEHN
CCC[C@H](C(=O)NCc1cccc(N2CCCC2=O)c1)N(C)C	ZINC000135959975	401955994	/nfs/dbraw/zinc/95/59/94/401955994.db2.gz	NZWDQUBAAZJUDQ-MRXNPFEDSA-N	0	3	317.433	2.160	10	0		DEAEHN
COc1ccc(COCCCC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000089782200	401962852	/nfs/dbraw/zinc/96/28/52/401962852.db2.gz	SYAVWKLTKMMCAY-INIZCTEOSA-N	0	3	320.433	2.202	10	0		DEAEHN
Cn1cc(CN2CCCN(CCc3ccccc3F)CC2)cn1	ZINC000137595355	401985010	/nfs/dbraw/zinc/98/50/10/401985010.db2.gz	MSZBKTSOULRGBV-UHFFFAOYSA-N	0	3	316.424	2.310	10	0		DEAEHN
COc1ccc([C@H](C)NC(=O)NC2CCN(C)CC2)c(OC)c1	ZINC000047885922	401990275	/nfs/dbraw/zinc/99/02/75/401990275.db2.gz	XRNSGDDUCHTPDR-LBPRGKRZSA-N	0	3	321.421	2.158	10	0		DEAEHN
COc1cccc(C(=O)N2CCC[C@@H]([NH+]3CCCC3)CC2)c1[O-]	ZINC000150808704	401996419	/nfs/dbraw/zinc/99/64/19/401996419.db2.gz	JAGMOIBTCKPCHI-CQSZACIVSA-N	0	3	318.417	2.491	10	0		DEAEHN
CCc1cccc(NC(=O)NC[C@@H](O)CN2CCCCC2)c1	ZINC000043333199	401938046	/nfs/dbraw/zinc/93/80/46/401938046.db2.gz	ZRQUVOMUBQFZEL-MRXNPFEDSA-N	0	3	305.422	2.217	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)c1cc(-c2cccnc2)on1	ZINC000044532614	401944982	/nfs/dbraw/zinc/94/49/82/401944982.db2.gz	MCTXYNYIPKWFLW-CYBMUJFWSA-N	0	3	314.389	2.341	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H](C)N1CCc2sccc2C1)N(C)C	ZINC000135635622	401949030	/nfs/dbraw/zinc/94/90/30/401949030.db2.gz	RQFIIIDGELAAAR-UKRRQHHQSA-N	0	3	323.506	2.341	10	0		DEAEHN
CC(C)CCn1cccc1CN1CC[C@@H](N2CCOCC2)C1	ZINC000121100129	402015143	/nfs/dbraw/zinc/01/51/43/402015143.db2.gz	YXAUXYITXARNBG-GOSISDBHSA-N	0	3	305.466	2.441	10	0		DEAEHN
CCCCCNC(=O)CN1CC[C@H](CNc2cccc(C)n2)C1	ZINC000151114017	402016963	/nfs/dbraw/zinc/01/69/63/402016963.db2.gz	SHXFYIZSDHQYKD-MRXNPFEDSA-N	0	3	318.465	2.430	10	0		DEAEHN
Cc1ccc([C@@H](CNC(=O)CCc2ccnn2C)N(C)C)cc1	ZINC000121142042	402017326	/nfs/dbraw/zinc/01/73/26/402017326.db2.gz	AKIBDRXUQFCELY-QGZVFWFLSA-N	0	3	314.433	2.080	10	0		DEAEHN
NC1(C(=O)NCc2cc(F)ccc2F)Cc2ccccc2C1	ZINC000151133160	402018314	/nfs/dbraw/zinc/01/83/14/402018314.db2.gz	TZYXLELNPAWSMQ-UHFFFAOYSA-N	0	3	302.324	2.077	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)NCCN2CCCC[C@H]2C)ccc1F	ZINC000053809759	402060282	/nfs/dbraw/zinc/06/02/82/402060282.db2.gz	ZSHWEWUBGPYFBE-GFCCVEGCSA-N	0	3	321.396	2.388	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)CCOc2cccc(C)c2)C1	ZINC000052593454	402044392	/nfs/dbraw/zinc/04/43/92/402044392.db2.gz	NEPNOTFKNHMFCG-MRXNPFEDSA-N	0	3	319.449	2.500	10	0		DEAEHN
CCN(CC)C(=O)CCC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000151843956	402060542	/nfs/dbraw/zinc/06/05/42/402060542.db2.gz	QNFUMVYMBJMJMB-MRXNPFEDSA-N	0	3	319.449	2.054	10	0		DEAEHN
CCN(CC)CC(=O)NCc1ccccc1-n1ccc(C)n1	ZINC000152030686	402071754	/nfs/dbraw/zinc/07/17/54/402071754.db2.gz	DBIFYNOHARIVAD-UHFFFAOYSA-N	0	3	300.406	2.139	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2cc(C)ccc2OC)C1	ZINC000057798078	402097084	/nfs/dbraw/zinc/09/70/84/402097084.db2.gz	FBDNMCRJOBNJJW-INIZCTEOSA-N	0	3	319.449	2.330	10	0		DEAEHN
Cc1cc(C)cc(OC[C@@H](O)CN2CCCN(C3CC3)CC2)c1	ZINC000061041159	402106921	/nfs/dbraw/zinc/10/69/21/402106921.db2.gz	TXCOQZFWRYHFEC-SFHVURJKSA-N	0	3	318.461	2.213	10	0		DEAEHN
CC(C)[C@H](Cc1ccccc1)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000123041446	402107115	/nfs/dbraw/zinc/10/71/15/402107115.db2.gz	UTULDOPEFGURNY-MSOLQXFVSA-N	0	3	318.461	2.290	10	0		DEAEHN
COc1ccccc1OCCC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000123143708	402112757	/nfs/dbraw/zinc/11/27/57/402112757.db2.gz	FPGWNHCAFYSTPK-HUUCEWRRSA-N	0	3	320.433	2.405	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1cc(C)cc(F)c1	ZINC000152960474	402119497	/nfs/dbraw/zinc/11/94/97/402119497.db2.gz	VWEPRCHGMCACGJ-OAHLLOKOSA-N	0	3	309.385	2.366	10	0		DEAEHN
C[C@H]1CCNC[C@H]1NS(=O)(=O)c1cccc2ccccc21	ZINC000122158491	402064389	/nfs/dbraw/zinc/06/43/89/402064389.db2.gz	VBBHRAQFINLVSZ-SWLSCSKDSA-N	0	3	304.415	2.116	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(-n3cccn3)cc2)CCN1C	ZINC000123377476	402124436	/nfs/dbraw/zinc/12/44/36/402124436.db2.gz	BXWZQBCIMPADEH-PBHICJAKSA-N	0	3	312.417	2.427	10	0		DEAEHN
Cc1cc(C)n(CCCNC(=O)N[C@@H](CC(C)C)CN(C)C)n1	ZINC000097394475	402124471	/nfs/dbraw/zinc/12/44/71/402124471.db2.gz	FXNSCGSUDXQPJS-INIZCTEOSA-N	0	3	323.485	2.166	10	0		DEAEHN
CCCOc1cccc(CN2CCN(C[C@@H](O)CC)CC2)c1	ZINC000123574533	402135692	/nfs/dbraw/zinc/13/56/92/402135692.db2.gz	VKKNCALNVXCJMI-KRWDZBQOSA-N	0	3	306.450	2.364	10	0		DEAEHN
CC[C@@](C)(O)CN1CCCN(C(=O)Cc2cccc(F)c2)CC1	ZINC000123636824	402139082	/nfs/dbraw/zinc/13/90/82/402139082.db2.gz	FPJGZEQZHSOZDA-GOSISDBHSA-N	0	3	322.424	2.064	10	0		DEAEHN
Cc1cccc(NC(=O)N2CCO[C@H](CN(C)C)C2)c1Cl	ZINC000153444261	402145971	/nfs/dbraw/zinc/14/59/71/402145971.db2.gz	LEYLJSZFKMNKBQ-GFCCVEGCSA-N	0	3	311.813	2.443	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cnc(-c3ccccc3)nc2)C1	ZINC000066921642	402146480	/nfs/dbraw/zinc/14/64/80/402146480.db2.gz	XTKQPRDYNWPGDE-INIZCTEOSA-N	0	3	310.401	2.358	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccc2c(c1)OCC(=O)N2)N1[C@H](C)CC[C@@H]1C	ZINC000101649257	402152324	/nfs/dbraw/zinc/15/23/24/402152324.db2.gz	PBDVYQLFCHTPTP-TUAOUCFPSA-N	0	3	317.389	2.217	10	0		DEAEHN
CC(C)[C@H](C(=O)NCc1cccnc1N(C)C)N1CCCCC1	ZINC000067292468	402156446	/nfs/dbraw/zinc/15/64/46/402156446.db2.gz	CGJDCWVZLFRKIL-MRXNPFEDSA-N	0	3	318.465	2.274	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H]1CCN(c2ccccc2OC)C1)N(C)C	ZINC000153932710	402180943	/nfs/dbraw/zinc/18/09/43/402180943.db2.gz	WQSGVBIAZSQMCV-GDBMZVCRSA-N	0	3	319.449	2.120	10	0		DEAEHN
CC(C(=O)N[C@@H](C)c1ccccc1)S(=O)(=O)c1nccs1	ZINC000068144709	402185016	/nfs/dbraw/zinc/18/50/16/402185016.db2.gz	XOCJXCCCPKPMIO-WDEREUQCSA-N	0	3	324.427	2.183	10	0		DEAEHN
Cc1cc(C)n(C[C@@H](C)NCc2ccc(-n3cncn3)cc2)n1	ZINC000067642094	402165899	/nfs/dbraw/zinc/16/58/99/402165899.db2.gz	CVHLTQQHZVUIKK-CQSZACIVSA-N	0	3	310.405	2.259	10	0		DEAEHN
Cc1ccc(CNC(=O)[C@H]2CCCN2C2CCOCC2)cc1F	ZINC000153744181	402167453	/nfs/dbraw/zinc/16/74/53/402167453.db2.gz	BYQZURSHNLREII-QGZVFWFLSA-N	0	3	320.408	2.394	10	0		DEAEHN
CSc1ccc2cc(CN3CCCN(C)CC3)c(=O)[nH]c2c1	ZINC000067804648	402173100	/nfs/dbraw/zinc/17/31/00/402173100.db2.gz	ZZPUWXTXLUXBMO-UHFFFAOYSA-N	0	3	317.458	2.388	10	0		DEAEHN
NC(=O)N1CCC(NCc2cccnc2OC2CCCC2)CC1	ZINC000153877565	402176694	/nfs/dbraw/zinc/17/66/94/402176694.db2.gz	RUSXOSVCGZVKDY-UHFFFAOYSA-N	0	3	318.421	2.036	10	0		DEAEHN
CC1(C)Cc2cc(CNC[C@H]3CN(C4CC4)CCO3)ccc2O1	ZINC000106379598	402213314	/nfs/dbraw/zinc/21/33/14/402213314.db2.gz	PDLJGFAOBSIXDX-KRWDZBQOSA-N	0	3	316.445	2.353	10	0		DEAEHN
COc1cccc(C(=O)N2CCC([NH+]3CCCC3)CC2)c1[O-]	ZINC000108894902	402263647	/nfs/dbraw/zinc/26/36/47/402263647.db2.gz	JDFGRRLEFCMGOO-UHFFFAOYSA-N	0	3	304.390	2.101	10	0		DEAEHN
COc1cc(C)c(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1OC	ZINC000154790252	402232291	/nfs/dbraw/zinc/23/22/91/402232291.db2.gz	NEONEPKTUQWSSO-UONOGXRCSA-N	0	3	318.417	2.321	10	0		DEAEHN
CC(=O)Nc1cccc([C@H](C)NC[C@]2(CCO)CCOC2)c1	ZINC000125435947	402232564	/nfs/dbraw/zinc/23/25/64/402232564.db2.gz	NIBLYOZBSHBBOK-GUYCJALGSA-N	0	3	306.406	2.085	10	0		DEAEHN
O=S(=O)(c1ccccc1)N1CCCC[C@H](N2CCCC2)C1	ZINC000107708035	402239124	/nfs/dbraw/zinc/23/91/24/402239124.db2.gz	LLDNTPRCTHZOKA-HNNXBMFYSA-N	0	3	308.447	2.326	10	0		DEAEHN
CC(C)c1noc2ncc(C(=O)NC[C@H]3CCCN(C)C3)cc21	ZINC000108329615	402249595	/nfs/dbraw/zinc/24/95/95/402249595.db2.gz	RROUAJWOPWMUSB-GFCCVEGCSA-N	0	3	316.405	2.418	10	0		DEAEHN
CCCN(C[C@@H]1CCCCO1)C(=O)NC[C@H]1CCCN(C)C1	ZINC000108590354	402257882	/nfs/dbraw/zinc/25/78/82/402257882.db2.gz	KTQLUNPRWJSTSK-CVEARBPZSA-N	0	3	311.470	2.319	10	0		DEAEHN
Cc1ccc(-c2cc3c(N4CCNCC4)nccn3n2)c(C)c1	ZINC000070459153	402261412	/nfs/dbraw/zinc/26/14/12/402261412.db2.gz	LVDSBZNZBTVVIM-UHFFFAOYSA-N	0	3	307.401	2.423	10	0		DEAEHN
COc1cc(C)ccc1OCC(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000155610219	402263164	/nfs/dbraw/zinc/26/31/64/402263164.db2.gz	IBPALDMTRBGTPR-LSDHHAIUSA-N	0	3	320.433	2.227	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(CC(=O)N2CCC(C)CC2)C1	ZINC000105896598	402210644	/nfs/dbraw/zinc/21/06/44/402210644.db2.gz	SPJCODNHAYQHCN-INIZCTEOSA-N	0	3	318.465	2.341	10	0		DEAEHN
C[C@@H](C(=O)N1CCCO1)N1CCC(Cc2ccccc2)CC1	ZINC000155878467	402269845	/nfs/dbraw/zinc/26/98/45/402269845.db2.gz	UHMBPQMGNXQVDG-HNNXBMFYSA-N	0	3	302.418	2.494	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(F)cc2Br)C1	ZINC000071139980	402270510	/nfs/dbraw/zinc/27/05/10/402270510.db2.gz	VSUHJVZUIAFSCI-JTQLQIEISA-N	0	3	315.186	2.364	10	0		DEAEHN
C[C@H](NCC(=O)Nc1cccc(C(=O)N(C)C)c1)C1CCCC1	ZINC000184654769	402288817	/nfs/dbraw/zinc/28/88/17/402288817.db2.gz	AANRQTFPOOAMCT-ZDUSSCGKSA-N	0	3	317.433	2.495	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1nnc(C(F)F)s1	ZINC000176326660	402299963	/nfs/dbraw/zinc/29/99/63/402299963.db2.gz	MROWYOMMZGMTRP-QMMMGPOBSA-N	0	3	319.381	2.424	10	0		DEAEHN
COC(=O)c1ccc(Br)c(OCCN(C)C)c1	ZINC000221717953	402304486	/nfs/dbraw/zinc/30/44/86/402304486.db2.gz	BBDHSRTWKZMNBH-UHFFFAOYSA-N	0	3	302.168	2.176	10	0		DEAEHN
CO[C@@H](C)c1nc(C)c(C(=O)N2CC[C@@H](N3CCCC3)C2)s1	ZINC000176399503	402305995	/nfs/dbraw/zinc/30/59/95/402305995.db2.gz	RVQLLBSVIKZWCX-QWHCGFSZSA-N	0	3	323.462	2.469	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NC2Cc3ccccc3C2)CCN1C	ZINC000184918486	402309042	/nfs/dbraw/zinc/30/90/42/402309042.db2.gz	FSVUCCZJTJKBQR-DYVFJYSZSA-N	0	3	301.434	2.278	10	0		DEAEHN
CCN1CCN(c2cccc(NC(=O)N[C@H]3C[C@H]3C)c2)CC1	ZINC000184919591	402309590	/nfs/dbraw/zinc/30/95/90/402309590.db2.gz	PJBCQBJNTUPMNC-CJNGLKHVSA-N	0	3	302.422	2.358	10	0		DEAEHN
Cc1ncc(CN(C)C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)s1	ZINC000176842136	402342003	/nfs/dbraw/zinc/34/20/03/402342003.db2.gz	PWQYPESWENARDJ-SMDDNHRTSA-N	0	3	310.467	2.322	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cnc2onc(C)c2c1	ZINC000177018555	402359829	/nfs/dbraw/zinc/35/98/29/402359829.db2.gz	MTILSRLTIPWKRJ-CYBMUJFWSA-N	0	3	302.378	2.088	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cnc2onc(C)c2c1	ZINC000177018574	402359904	/nfs/dbraw/zinc/35/99/04/402359904.db2.gz	MTILSRLTIPWKRJ-ZDUSSCGKSA-N	0	3	302.378	2.088	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Cn1nc(C)c(Cl)c1C	ZINC000177041044	402362812	/nfs/dbraw/zinc/36/28/12/402362812.db2.gz	SGUWTNVFDBCJKB-ZDUSSCGKSA-N	0	3	312.845	2.096	10	0		DEAEHN
COCCOc1ccc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1	ZINC000177056947	402364835	/nfs/dbraw/zinc/36/48/35/402364835.db2.gz	PEFKZBGMILZTSB-PBHICJAKSA-N	0	3	320.433	2.170	10	0		DEAEHN
COCCC(C)(C)CNC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000185792813	402377499	/nfs/dbraw/zinc/37/74/99/402377499.db2.gz	UTFMWWNRIVEWRU-CQSZACIVSA-N	0	3	301.475	2.325	10	0		DEAEHN
CCc1oc(C(=O)OC)cc1CN1CC[C@@H](c2cnn(C)c2)C1	ZINC000177189558	402379646	/nfs/dbraw/zinc/37/96/46/402379646.db2.gz	FEYKOCFNRRKDJW-GFCCVEGCSA-N	0	3	317.389	2.352	10	0		DEAEHN
C[C@@H]1CN([C@@H]2CCc3ccc(F)cc32)C[C@@H]1N1CCOCC1	ZINC000177225738	402383191	/nfs/dbraw/zinc/38/31/91/402383191.db2.gz	CHFDVNBGGVMPGG-XWIAVFTESA-N	0	3	304.409	2.466	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC(O)(c2ccccc2)CC1)N(C)C	ZINC000185862131	402383639	/nfs/dbraw/zinc/38/36/39/402383639.db2.gz	WWJNADMUDGSPRZ-INIZCTEOSA-N	0	3	304.434	2.227	10	0		DEAEHN
OC[C@H]1C[C@H](O)CN1CCCOc1ccc2ccccc2c1	ZINC000185153224	402328705	/nfs/dbraw/zinc/32/87/05/402328705.db2.gz	YJASQHUZIQYRKI-SJORKVTESA-N	0	3	301.386	2.036	10	0		DEAEHN
OC[C@H]1C[C@@H](O)CN1CCCOc1cccc2ccccc21	ZINC000185179822	402331043	/nfs/dbraw/zinc/33/10/43/402331043.db2.gz	AFTVDRWSBDLOJP-HZPDHXFCSA-N	0	3	301.386	2.036	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(Cc3ccnc(Cl)c3)C2)CC1	ZINC000177368467	402395160	/nfs/dbraw/zinc/39/51/60/402395160.db2.gz	DRINYHHXDULSOI-MRXNPFEDSA-N	0	3	322.884	2.337	10	0		DEAEHN
Cc1ccc(C[C@@H](C)N(C)C(=O)C[C@H]2CSCCN2)cc1	ZINC000237507810	402410585	/nfs/dbraw/zinc/41/05/85/402410585.db2.gz	JUCOHSBKDAHICH-ZBFHGGJFSA-N	0	3	306.475	2.480	10	0		DEAEHN
CC(C)C[C@@H]1OCCC[C@H]1NC(=O)N1CCCN(C2CC2)CC1	ZINC000186216232	402411503	/nfs/dbraw/zinc/41/15/03/402411503.db2.gz	YJSGTXLBTPDQAU-SJORKVTESA-N	0	3	323.481	2.460	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H](CN)c1ccccc1)c1ccc2c(c1)OCO2	ZINC000237656798	402417058	/nfs/dbraw/zinc/41/70/58/402417058.db2.gz	AZWYPFBWMQNGAP-DOMZBBRYSA-N	0	3	312.369	2.335	10	0		DEAEHN
CCOC(=O)[C@H](c1ccccc1)N1CCN2CCCC[C@@H]2C1	ZINC000177756055	402432632	/nfs/dbraw/zinc/43/26/32/402432632.db2.gz	QHRZDQKNJVLVBK-SJORKVTESA-N	0	3	302.418	2.461	10	0		DEAEHN
CCc1ccccc1S(=O)(=O)N1CCC(N2CCCC2)CC1	ZINC000186508576	402437334	/nfs/dbraw/zinc/43/73/34/402437334.db2.gz	IMEJLGZIGWYCDZ-UHFFFAOYSA-N	0	3	322.474	2.498	10	0		DEAEHN
CCC1(CC)CCN([C@@H](C)C(=O)N(C)CC(=O)NC2CC2)CC1	ZINC000186546351	402440547	/nfs/dbraw/zinc/44/05/47/402440547.db2.gz	ZCWZBBIJCFMDAY-AWEZNQCLSA-N	0	3	323.481	2.014	10	0		DEAEHN
C[C@@H](NCC[C@H]1CCCO1)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000177844903	402440640	/nfs/dbraw/zinc/44/06/40/402440640.db2.gz	CJMNYDADEDEDCV-DGCLKSJQSA-N	0	3	315.410	2.449	10	0		DEAEHN
C[C@@H](NC(=O)CCc1ccnn1C)[C@H](c1ccccc1)N(C)C	ZINC000185949718	402391777	/nfs/dbraw/zinc/39/17/77/402391777.db2.gz	YSIIYOAPCOWODX-RDTXWAMCSA-N	0	3	314.433	2.160	10	0		DEAEHN
CCCN(CC)c1ccc(C(=O)N2CCN3CCC[C@H]3C2)cn1	ZINC000245202937	402452576	/nfs/dbraw/zinc/45/25/76/402452576.db2.gz	XTOCRWMAPDWDBJ-INIZCTEOSA-N	0	3	316.449	2.238	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)c2cccs2)[C@@H](C)C1	ZINC000246121983	402511733	/nfs/dbraw/zinc/51/17/33/402511733.db2.gz	JDDLEHWVQYDUIR-RYUDHWBXSA-N	0	3	302.465	2.099	10	0		DEAEHN
CNC(=O)[C@@H]1CCCN1C[C@H](C)Cc1ccc(OC)c(F)c1	ZINC000186704759	402457673	/nfs/dbraw/zinc/45/76/73/402457673.db2.gz	GLBZHJCXDWGPKN-DOMZBBRYSA-N	0	3	308.397	2.223	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@@H]1COc2ccccc2C1	ZINC000245428965	402459720	/nfs/dbraw/zinc/45/97/20/402459720.db2.gz	JSXAXTLWSOEVLA-JKSUJKDBSA-N	0	3	302.418	2.180	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C)C(=O)NCc1cccs1	ZINC000245472845	402463980	/nfs/dbraw/zinc/46/39/80/402463980.db2.gz	PKUKICRGUIFFKW-KGLIPLIRSA-N	0	3	309.479	2.169	10	0		DEAEHN
C[C@@H]1CC[C@@H]([N-]S(=O)(=O)c2ccccc2C(F)(F)F)C[NH2+]1	ZINC000164748703	402468719	/nfs/dbraw/zinc/46/87/19/402468719.db2.gz	VPYQKNRKOLCUEJ-NXEZZACHSA-N	0	3	322.352	2.124	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cnc([C@H]3CCCO3)s2)C1	ZINC000245623427	402475298	/nfs/dbraw/zinc/47/52/98/402475298.db2.gz	PCHJGCCPPDKJJC-FRRDWIJNSA-N	0	3	323.462	2.453	10	0		DEAEHN
COc1ccc2nc(CN3CCO[C@@H](CN(C)C)C3)sc2c1	ZINC000186991122	402476333	/nfs/dbraw/zinc/47/63/33/402476333.db2.gz	WNCOFQFXDCAVAX-ZDUSSCGKSA-N	0	3	321.446	2.067	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N1[C@H](C)CCC[C@@H]1C	ZINC000178326936	402485235	/nfs/dbraw/zinc/48/52/35/402485235.db2.gz	DPLLVNGNUNEISV-UXLLHSPISA-N	0	3	318.465	2.445	10	0		DEAEHN
Cc1ccc(CNC2CCN(C(N)=O)CC2)c(OCC2CC2)c1	ZINC000166907484	402488461	/nfs/dbraw/zinc/48/84/61/402488461.db2.gz	DMADSFBIPPTXNS-UHFFFAOYSA-N	0	3	317.433	2.417	10	0		DEAEHN
CCN(C)[C@H](C(=O)N[C@@H]1CCCN(CC)C1)c1ccccc1	ZINC000245852681	402491210	/nfs/dbraw/zinc/49/12/10/402491210.db2.gz	MVWKJANQQVDEEC-SJORKVTESA-N	0	3	303.450	2.280	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCCCc2ccccn2)C1	ZINC000245944166	402499728	/nfs/dbraw/zinc/49/97/28/402499728.db2.gz	KFYSFLFNEFFYIH-DOTOQJQBSA-N	0	3	316.449	2.140	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)NCCCc2ccccn2)C1	ZINC000245944170	402499829	/nfs/dbraw/zinc/49/98/29/402499829.db2.gz	KFYSFLFNEFFYIH-RDJZCZTQSA-N	0	3	316.449	2.140	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccn(C2CCCC2)n1	ZINC000245964762	402500684	/nfs/dbraw/zinc/50/06/84/402500684.db2.gz	DLMKSXRJJNEXJU-ZFWWWQNUSA-N	0	3	302.422	2.307	10	0		DEAEHN
C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000246014506	402503716	/nfs/dbraw/zinc/50/37/16/402503716.db2.gz	LMZDJDKLISRMSK-WQVCFCJDSA-N	0	3	315.417	2.057	10	0		DEAEHN
CCc1noc(C2CCC(NCc3cc(C(N)=O)co3)CC2)n1	ZINC000187706096	402508767	/nfs/dbraw/zinc/50/87/67/402508767.db2.gz	YORSEQKNDWWDHL-UHFFFAOYSA-N	0	3	318.377	2.140	10	0		DEAEHN
C[C@H](CCc1ccc2c(c1)OCO2)NCc1cc(C(N)=O)co1	ZINC000187715905	402509271	/nfs/dbraw/zinc/50/92/71/402509271.db2.gz	KAEUWXZSLNIDJD-LLVKDONJSA-N	0	3	316.357	2.218	10	0		DEAEHN
CCOC[C@H](NC(=O)c1ccccc1OCCN(C)C)C(C)C	ZINC000189545768	402544267	/nfs/dbraw/zinc/54/42/67/402544267.db2.gz	UUQRVTXYGIVTRU-INIZCTEOSA-N	0	3	322.449	2.418	10	0		DEAEHN
COC(C)(C)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000170960761	402545196	/nfs/dbraw/zinc/54/51/96/402545196.db2.gz	IWUDAIHEVLYXAY-UHFFFAOYSA-N	0	3	304.434	2.235	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@H](N[C@H]2Cc3ccccc3[C@@H]2O)C1	ZINC000178861545	402547745	/nfs/dbraw/zinc/54/77/45/402547745.db2.gz	IMFMNSLGSKLTDQ-BPUTZDHNSA-N	0	3	318.417	2.244	10	0		DEAEHN
Cc1nn(-c2ccccc2)cc1C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000246957268	402550994	/nfs/dbraw/zinc/55/09/94/402550994.db2.gz	DHMFGRKHINCNFR-RHSMWYFYSA-N	0	3	324.428	2.489	10	0		DEAEHN
CC(C)[C@@H](O)CC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000178898488	402552035	/nfs/dbraw/zinc/55/20/35/402552035.db2.gz	JUOLJRXGHZBEST-SFHVURJKSA-N	0	3	318.461	2.217	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H](COC)c2ccccc2)C1	ZINC000171048379	402552310	/nfs/dbraw/zinc/55/23/10/402552310.db2.gz	BDUUTUNCBCUDDM-CVEARBPZSA-N	0	3	305.422	2.158	10	0		DEAEHN
Cc1cccc(C)c1OCCN1CCN(C[C@H](C)O)[C@H](C)C1	ZINC000246999667	402553098	/nfs/dbraw/zinc/55/30/98/402553098.db2.gz	BLZVRLCKASVIPK-SJORKVTESA-N	0	3	306.450	2.069	10	0		DEAEHN
Cc1nc(-c2cccc(NC(=O)N3CC[C@@H](N(C)C)C3)c2)no1	ZINC000171082073	402555922	/nfs/dbraw/zinc/55/59/22/402555922.db2.gz	HFYNPVXMBHNRDV-CQSZACIVSA-N	0	3	315.377	2.213	10	0		DEAEHN
Cc1cc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)n(C)n1	ZINC000179011759	402564768	/nfs/dbraw/zinc/56/47/68/402564768.db2.gz	GBCLOIWTHJKUTN-GOEBONIOSA-N	0	3	313.405	2.295	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NC1CCN(c2ccccc2)CC1	ZINC000171192979	402565974	/nfs/dbraw/zinc/56/59/74/402565974.db2.gz	MITIFGSAEHZNDZ-KRWDZBQOSA-N	0	3	316.449	2.049	10	0		DEAEHN
C[C@@H](C(=O)N[C@H]1CCC[C@@H](C)[C@H]1C)N1CCN2CCC[C@H]2C1	ZINC000246304115	402523985	/nfs/dbraw/zinc/52/39/85/402523985.db2.gz	JHNPJXZDOVEZBP-NRKLIOEPSA-N	0	3	307.482	2.096	10	0		DEAEHN
C[C@@H](C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1)c1cccnc1	ZINC000246368973	402527231	/nfs/dbraw/zinc/52/72/31/402527231.db2.gz	QSCQBFFWPFXDNB-BZUAXINKSA-N	0	3	319.449	2.191	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)N[C@H]2CCCOC2)CN1Cc1ccccc1	ZINC000246400609	402529505	/nfs/dbraw/zinc/52/95/05/402529505.db2.gz	ABSXIIYWOSTPGI-PVAVHDDUSA-N	0	3	317.433	2.128	10	0		DEAEHN
CCN(CCCNC(=O)N1CC[C@@H](N(C)C)C1)c1ccccc1	ZINC000170826877	402529661	/nfs/dbraw/zinc/52/96/61/402529661.db2.gz	MIVVACKLZGCYHZ-QGZVFWFLSA-N	0	3	318.465	2.249	10	0		DEAEHN
Cc1ccc(C)c(S(=O)(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1	ZINC000247660685	402573839	/nfs/dbraw/zinc/57/38/39/402573839.db2.gz	XXKQUWQHZIUUFN-JKSUJKDBSA-N	0	3	322.474	2.408	10	0		DEAEHN
Cc1cccc(C)c1OCCNC(=O)N1CC[C@H](N(C)C)C1	ZINC000170831489	402530328	/nfs/dbraw/zinc/53/03/28/402530328.db2.gz	KOJKDHVRIVHAQI-HNNXBMFYSA-N	0	3	305.422	2.028	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000170863216	402534237	/nfs/dbraw/zinc/53/42/37/402534237.db2.gz	LNORVIIIHHMDNI-LLVKDONJSA-N	0	3	302.296	2.361	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Cc2ccc(Br)cc2)C1	ZINC000170863118	402534399	/nfs/dbraw/zinc/53/43/99/402534399.db2.gz	WCSQXVDLSJPWDP-CYBMUJFWSA-N	0	3	311.223	2.154	10	0		DEAEHN
CC1CCN(c2ccc(C(=O)N3CC[C@H](N(C)C)C3)cn2)CC1	ZINC000170868389	402535750	/nfs/dbraw/zinc/53/57/50/402535750.db2.gz	HXDTYEKSCLZSOD-INIZCTEOSA-N	0	3	316.449	2.094	10	0		DEAEHN
CC(C)C(=O)Nc1ccc(C(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170867014	402535996	/nfs/dbraw/zinc/53/59/96/402535996.db2.gz	KEORTSDXERSVKQ-OAHLLOKOSA-N	0	3	303.406	2.057	10	0		DEAEHN
CCCn1nc(C)c(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1C	ZINC000246600315	402538083	/nfs/dbraw/zinc/53/80/83/402538083.db2.gz	UJBDBCSHGZNPIC-SWLSCSKDSA-N	0	3	306.454	2.465	10	0		DEAEHN
Cc1noc(C)c1[C@@H](C)CNC(=O)N1CCCN(C2CC2)CC1	ZINC000179120322	402574276	/nfs/dbraw/zinc/57/42/76/402574276.db2.gz	JTPGJAOVNXZOBT-LBPRGKRZSA-N	0	3	320.437	2.275	10	0		DEAEHN
c1ccc(-c2nnc3ccc(N4CCN5CCC[C@@H]5C4)nn32)cc1	ZINC000171362647	402580949	/nfs/dbraw/zinc/58/09/49/402580949.db2.gz	FQPPHTZOJLJJHQ-OAHLLOKOSA-N	0	3	320.400	2.076	10	0		DEAEHN
Cc1nc(CCNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)sc1C	ZINC000248025827	402580969	/nfs/dbraw/zinc/58/09/69/402580969.db2.gz	OZKLBNWRHOOGKI-FZMZJTMJSA-N	0	3	324.494	2.427	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CCCO[C@@H]1C	ZINC000190290199	402590506	/nfs/dbraw/zinc/59/05/06/402590506.db2.gz	IUWWAFIGIPZNKV-AHCXZYCDSA-N	0	3	316.445	2.438	10	0		DEAEHN
CCOCCN1CCN(Cc2ccc3c[nH]nc3c2)C[C@@H]1C	ZINC000179510889	402593243	/nfs/dbraw/zinc/59/32/43/402593243.db2.gz	VWHYTZBWEFYAMM-AWEZNQCLSA-N	0	3	302.422	2.106	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H](C)c2nc(C)cs2)C1	ZINC000248580978	402597042	/nfs/dbraw/zinc/59/70/42/402597042.db2.gz	OPJBIQFZHYDFQX-AAEUAGOBSA-N	0	3	310.467	2.339	10	0		DEAEHN
Cc1c(C(=O)N2CCN3CCC[C@H]3C2)cnn1-c1ccccc1C	ZINC000171586287	402597811	/nfs/dbraw/zinc/59/78/11/402597811.db2.gz	RQFSTZNXBXJXNU-INIZCTEOSA-N	0	3	324.428	2.409	10	0		DEAEHN
O=C1C[C@H](c2ccccc2)N(C[C@H](O)C2CCCCC2)CCN1	ZINC000190499083	402605840	/nfs/dbraw/zinc/60/58/40/402605840.db2.gz	XYPNBXJHFGJJPW-MSOLQXFVSA-N	0	3	316.445	2.491	10	0		DEAEHN
C[C@@H]1CC(O)C[C@@H](C)N1C[C@@H](O)COc1ccccc1Cl	ZINC000248840466	402610742	/nfs/dbraw/zinc/61/07/42/402610742.db2.gz	PGOWTFVMUSSSET-YRGRVCCFSA-N	0	3	313.825	2.313	10	0		DEAEHN
C[C@H]1CN(CCCN2C(=O)c3ccccc3C2=O)CCS1	ZINC000171699004	402611276	/nfs/dbraw/zinc/61/12/76/402611276.db2.gz	RBHWLYSOHJKYGI-LBPRGKRZSA-N	0	3	304.415	2.110	10	0		DEAEHN
C[C@H](NC[C@@H](O)CN1CCCC1=O)c1cc2ccccc2o1	ZINC000180442684	402616910	/nfs/dbraw/zinc/61/69/10/402616910.db2.gz	BIBQOXROYDEVGC-GXTWGEPZSA-N	0	3	302.374	2.067	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)Nc2ccc(-c3ncon3)cc2)C1	ZINC000171738542	402617018	/nfs/dbraw/zinc/61/70/18/402617018.db2.gz	WCOAXHHCEXXLHE-GFCCVEGCSA-N	0	3	315.377	2.200	10	0		DEAEHN
CC(C)CNC(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190677144	402617777	/nfs/dbraw/zinc/61/77/77/402617777.db2.gz	IKZNJGIXPJILNZ-MRXNPFEDSA-N	0	3	304.438	2.201	10	0		DEAEHN
Cc1cc(F)ccc1NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000249146218	402622632	/nfs/dbraw/zinc/62/26/32/402622632.db2.gz	GITUDKJEWVFVEB-GXTWGEPZSA-N	0	3	321.396	2.014	10	0		DEAEHN
C[C@@H](CNC(=O)NC[C@H]1CCC(C)(C)O1)N1CCC[C@@H](C)C1	ZINC000249281672	402624912	/nfs/dbraw/zinc/62/49/12/402624912.db2.gz	PYNBIEFPDLDACD-QLFBSQMISA-N	0	3	311.470	2.364	10	0		DEAEHN
Cc1ccnc2c1NC(=O)CN2C(=O)c1cccc(CN(C)C)c1	ZINC000181031762	402633434	/nfs/dbraw/zinc/63/34/34/402633434.db2.gz	ZUWIMOFAXORFHC-UHFFFAOYSA-N	0	3	324.384	2.051	10	0		DEAEHN
COC(=O)CCN1CCC[C@@H](c2nc(-c3ccccc3)n[nH]2)C1	ZINC000181295641	402640387	/nfs/dbraw/zinc/64/03/87/402640387.db2.gz	RDNIRDCXMBYRKR-CQSZACIVSA-N	0	3	314.389	2.214	10	0		DEAEHN
COC(=O)CCCCC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000251852200	402650125	/nfs/dbraw/zinc/65/01/25/402650125.db2.gz	QLVIGIIABPHVMA-MAUKXSAKSA-N	0	3	318.417	2.281	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NC[C@@H](O)CC(C)(C)C	ZINC000172326700	402650242	/nfs/dbraw/zinc/65/02/42/402650242.db2.gz	FFFGZHHRPJKYQN-KGLIPLIRSA-N	0	3	301.475	2.059	10	0		DEAEHN
C[C@@H]1OCCC[C@H]1C(=O)NCCCN(C)Cc1ccccc1	ZINC000191312822	402660172	/nfs/dbraw/zinc/66/01/72/402660172.db2.gz	KQFUIBBSIQDEEL-DOTOQJQBSA-N	0	3	304.434	2.440	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)Cc1ccc(C)cc1F	ZINC000192013965	402704725	/nfs/dbraw/zinc/70/47/25/402704725.db2.gz	JDCOMDKDNMPEDI-ZDUSSCGKSA-N	0	3	316.442	2.284	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)CCc1ccccc1	ZINC000173828892	402714702	/nfs/dbraw/zinc/71/47/02/402714702.db2.gz	LZLYBIGJEWWLHH-IAGOWNOFSA-N	0	3	322.474	2.118	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CC[C@@]3(O)CCCC[C@@H]3C2)C1	ZINC000252696015	402660524	/nfs/dbraw/zinc/66/05/24/402660524.db2.gz	LQQFMKYKLGLPNK-CBZIJGRNSA-N	0	3	323.481	2.052	10	0		DEAEHN
CC(C)n1cc(CN2C[C@@H](c3ccncc3)[C@H](CO)C2)cn1	ZINC000253405240	402663624	/nfs/dbraw/zinc/66/36/24/402663624.db2.gz	IEJOCALHRKJXIK-IRXDYDNUSA-N	0	3	300.406	2.067	10	0		DEAEHN
Cc1cccc(NC(=O)CN[C@H](CC(N)=O)C2CCCCC2)c1	ZINC000182045789	402665469	/nfs/dbraw/zinc/66/54/69/402665469.db2.gz	WFAVMNBFCDLSDQ-MRXNPFEDSA-N	0	3	317.433	2.347	10	0		DEAEHN
O=C(C/C=C\c1ccc(F)cc1)NC[C@H](O)CN1CCCCC1	ZINC000255618102	402692977	/nfs/dbraw/zinc/69/29/77/402692977.db2.gz	QJMGGKDELKODSB-CHYADLBTSA-N	0	3	320.408	2.192	10	0		DEAEHN
CO[C@@H]1CC[C@@H]2OCCN(C[C@H](O)CCc3ccccc3)[C@@H]2C1	ZINC000182568087	402700127	/nfs/dbraw/zinc/70/01/27/402700127.db2.gz	KFBICOVQQYDEEV-MKXGPGLRSA-N	0	3	319.445	2.248	10	0		DEAEHN
C[C@H]1CN(C2CCN(Cc3cccc(Cl)n3)CC2)CCO1	ZINC000173559398	402703252	/nfs/dbraw/zinc/70/32/52/402703252.db2.gz	GSSXLSVXPVZKDD-ZDUSSCGKSA-N	0	3	309.841	2.420	10	0		DEAEHN
CCO[C@H](CCNC(=O)N1CC[C@H](N2CC=CC2)C1)C(C)C	ZINC000174324495	402736850	/nfs/dbraw/zinc/73/68/50/402736850.db2.gz	FREGVLPPANEOQL-JKSUJKDBSA-N	0	3	309.454	2.093	10	0		DEAEHN
C[C@@H](NCC(=O)NCc1ccc(Cl)s1)[C@H]1CCCO1	ZINC000183138332	402742411	/nfs/dbraw/zinc/74/24/11/402742411.db2.gz	RCXUDTLHKWNLCE-MWLCHTKSSA-N	0	3	302.827	2.175	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2nc3cccnc3s2)C1	ZINC000193984821	402780969	/nfs/dbraw/zinc/78/09/69/402780969.db2.gz	PENWNAMAVVCTGH-PWSUYJOCSA-N	0	3	304.419	2.150	10	0		DEAEHN
COc1ccc(NC(=O)CN[C@H](C)[C@H]2CCCO2)cc1Cl	ZINC000183222884	402748770	/nfs/dbraw/zinc/74/87/70/402748770.db2.gz	MOCWKKFZMJPRDK-ZWNOBZJWSA-N	0	3	312.797	2.444	10	0		DEAEHN
C[C@@H](Cc1nc([C@@H]2CNCCN2C)no1)c1ccccc1F	ZINC000263247484	402750109	/nfs/dbraw/zinc/75/01/09/402750109.db2.gz	PLSZMYOYGYYKIK-FZMZJTMJSA-N	0	3	304.369	2.131	10	0		DEAEHN
C[C@@H](Oc1ccc(F)c(F)c1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263248454	402750141	/nfs/dbraw/zinc/75/01/41/402750141.db2.gz	PPDJYMVHHJOJOQ-RNCFNFMXSA-N	0	3	324.331	2.064	10	0		DEAEHN
Cc1ccc(-c2cc(-c3nc([C@H]4CNCCN4C)no3)n[nH]2)cc1	ZINC000263269750	402752528	/nfs/dbraw/zinc/75/25/28/402752528.db2.gz	SBXGIPWBFIFBQZ-OAHLLOKOSA-N	0	3	324.388	2.011	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(CCc2ccccc2Cl)n1	ZINC000263301542	402755881	/nfs/dbraw/zinc/75/58/81/402755881.db2.gz	XBKLCXSNBVQQBR-ZDUSSCGKSA-N	0	3	306.797	2.084	10	0		DEAEHN
C[C@@H]1CCc2c(-c3nc([C@@H]4CNCCN4C)no3)csc2C1	ZINC000263312539	402757333	/nfs/dbraw/zinc/75/73/33/402757333.db2.gz	YXPISMVDXVUCEP-MFKMUULPSA-N	0	3	318.446	2.499	10	0		DEAEHN
Cc1cc(C)cc(C2(c3nc([C@H]4CNCCN4C)no3)CC2)c1	ZINC000263317367	402757886	/nfs/dbraw/zinc/75/78/86/402757886.db2.gz	ZSBAZCBOUBLMQQ-OAHLLOKOSA-N	0	3	312.417	2.342	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2C[C@@H]2c2c(F)cccc2F)n1	ZINC000263314725	402757905	/nfs/dbraw/zinc/75/79/05/402757905.db2.gz	ZIAFMXAONAANBI-OUJBWJOFSA-N	0	3	320.343	2.195	10	0		DEAEHN
COc1cccc(OC)c1C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000175104704	402779484	/nfs/dbraw/zinc/77/94/84/402779484.db2.gz	QUGAXLBULRNIMJ-QWHCGFSZSA-N	0	3	306.406	2.259	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)N(Cc1ccco1)C1CCN(C)CC1	ZINC000193944577	402779858	/nfs/dbraw/zinc/77/98/58/402779858.db2.gz	JNTDMWIRXMTJOT-PBHICJAKSA-N	0	3	320.433	2.375	10	0		DEAEHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)NCCOCC1CCC1	ZINC000566536169	292249686	/nfs/dbraw/zinc/24/96/86/292249686.db2.gz	NKGFJAHXKMLDAK-HUUCEWRRSA-N	0	3	311.470	2.223	10	0		DEAEHN
CCC[C@@H](C(=O)N1CC[C@@](C(=O)OCC)(C(C)C)C1)N(C)C	ZINC000194325156	402791928	/nfs/dbraw/zinc/79/19/28/402791928.db2.gz	NGVRSSIEFYHYTH-YOEHRIQHSA-N	0	3	312.454	2.155	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cc(C(=O)OC)ccc2F)C1	ZINC000194340993	402792824	/nfs/dbraw/zinc/79/28/24/402792824.db2.gz	CMNXTSYDQFQRLZ-GFCCVEGCSA-N	0	3	323.368	2.218	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)N(CCN(C)C)Cc1ccccc1F	ZINC000194353569	402793687	/nfs/dbraw/zinc/79/36/87/402793687.db2.gz	MWBKSMVEJMAIKJ-GDBMZVCRSA-N	0	3	322.424	2.389	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2nc(SC)n3ccccc23)C1	ZINC000194401166	402795789	/nfs/dbraw/zinc/79/57/89/402795789.db2.gz	UXMWZYHCMKKBKM-GFCCVEGCSA-N	0	3	318.446	2.270	10	0		DEAEHN
CC[C@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1ccncc1	ZINC000175311135	402796718	/nfs/dbraw/zinc/79/67/18/402796718.db2.gz	HAAXUJRIGGDVKW-CVEARBPZSA-N	0	3	300.406	2.188	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)N(C)Cc1ccccc1C	ZINC000175361848	402800000	/nfs/dbraw/zinc/80/00/00/402800000.db2.gz	TYNWCTIXAOHBLS-GOSISDBHSA-N	0	3	317.477	2.370	10	0		DEAEHN
CC(C)(C)OC(=O)CCN1CCCN(c2ccccn2)CC1	ZINC000183849441	402801392	/nfs/dbraw/zinc/80/13/92/402801392.db2.gz	CJUNBEKYVMVODC-UHFFFAOYSA-N	0	3	305.422	2.326	10	0		DEAEHN
O=C(c1c[nH]nc1-c1ccccc1)N1CCCN(C2CC2)CC1	ZINC000194534626	402802180	/nfs/dbraw/zinc/80/21/80/402802180.db2.gz	SYCJPBJEWHDBKZ-UHFFFAOYSA-N	0	3	310.401	2.387	10	0		DEAEHN
C[C@@H](NC(=O)NC[C@@H](O)CN1CCCCC1)C1CCCCC1	ZINC000175414677	402804687	/nfs/dbraw/zinc/80/46/87/402804687.db2.gz	IDPXQAJHNVOGSO-GDBMZVCRSA-N	0	3	311.470	2.101	10	0		DEAEHN
O=C(c1ccc(OCC2CC2)cc1)N1CCN2CCC[C@@H]2C1	ZINC000195337565	402842816	/nfs/dbraw/zinc/84/28/16/402842816.db2.gz	GXOSMCJMSULEKW-MRXNPFEDSA-N	0	3	300.402	2.396	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Cc2c(C)nn(C(F)F)c2C)C1	ZINC000194651079	402807891	/nfs/dbraw/zinc/80/78/91/402807891.db2.gz	PWMNOIKJNFYIDS-GFCCVEGCSA-N	0	3	314.380	2.038	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)Cc1ccc(C(F)(F)F)cc1	ZINC000194719953	402812251	/nfs/dbraw/zinc/81/22/51/402812251.db2.gz	NRINXQMWMJGOAG-ZDUSSCGKSA-N	0	3	300.324	2.458	10	0		DEAEHN
Cc1nc(-c2c[nH]c(C(=O)NC[C@@H]3CCCN3C)c2)cs1	ZINC000194721708	402812332	/nfs/dbraw/zinc/81/23/32/402812332.db2.gz	ISCGQSKLHMWNAW-LBPRGKRZSA-N	0	3	304.419	2.271	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)CCc1cccc2c1OCO2	ZINC000184097179	402817966	/nfs/dbraw/zinc/81/79/66/402817966.db2.gz	ISACGHKGZQOLSP-HNNXBMFYSA-N	0	3	320.433	2.440	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC[C@H](c2nnc(C3CC3)[nH]2)C1	ZINC000195206653	402836482	/nfs/dbraw/zinc/83/64/82/402836482.db2.gz	NAROCYUJUKZADN-LSDHHAIUSA-N	0	3	322.453	2.039	10	0		DEAEHN
C[C@H]1CCCN(CCNC(=O)N[C@@H]2COc3ccccc32)C1	ZINC000195197586	402836677	/nfs/dbraw/zinc/83/66/77/402836677.db2.gz	YHZZNSJJJRNQTJ-DZGCQCFKSA-N	0	3	303.406	2.151	10	0		DEAEHN
Cc1ccc(NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1C(N)=O	ZINC000175992056	402846228	/nfs/dbraw/zinc/84/62/28/402846228.db2.gz	RBUDKKAWKAWIBL-TZMCWYRMSA-N	0	3	318.421	2.040	10	0		DEAEHN
CC[C@@H](C)NC(=O)CN1CC[C@H](CNc2cccc(C)n2)C1	ZINC000195516103	402849494	/nfs/dbraw/zinc/84/94/94/402849494.db2.gz	IZNZTKDCPARKBS-UKRRQHHQSA-N	0	3	304.438	2.039	10	0		DEAEHN
Cc1ccc2ncnc(N3CCN(C[C@@H]4CCOC4)CC3)c2c1	ZINC000267435984	403038974	/nfs/dbraw/zinc/03/89/74/403038974.db2.gz	XVJVYMQVLKFYNH-HNNXBMFYSA-N	0	3	312.417	2.097	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@@H]1NCc1cc(F)cc(Br)c1	ZINC000282389872	403149262	/nfs/dbraw/zinc/14/92/62/403149262.db2.gz	OXAUHYSSTLHMFQ-PELKAZGASA-N	0	3	315.186	2.345	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)[C@H](C)N[C@H]2CCOC[C@H]2C)cc1	ZINC000277890527	403268208	/nfs/dbraw/zinc/26/82/08/403268208.db2.gz	OMXNVHMATHCWJD-WQGACYEGSA-N	0	3	304.390	2.231	10	0		DEAEHN
c1ccc(OC2CC2)c(CN2CC[C@H](CN3CCOCC3)C2)c1	ZINC000289023780	403810153	/nfs/dbraw/zinc/81/01/53/403810153.db2.gz	AWCWLCIEJLVECP-MRXNPFEDSA-N	0	3	316.445	2.382	10	0		DEAEHN
O=C1NCCC[C@H]1N[C@@H]1CCc2ccc(Br)cc21	ZINC000336785203	403917260	/nfs/dbraw/zinc/91/72/60/403917260.db2.gz	BVGATEDQXDNQQI-CHWSQXEVSA-N	0	3	309.207	2.305	10	0		DEAEHN
c1ccc(-n2nnnc2CCNC2(c3ccccc3)CC2)cc1	ZINC000341633469	404080627	/nfs/dbraw/zinc/08/06/27/404080627.db2.gz	FNRMTRHJMHKQHU-UHFFFAOYSA-N	0	3	305.385	2.484	10	0		DEAEHN
c1ccc([C@H]2N(C[C@H]3COCCO3)CC23CCOCC3)cc1	ZINC000412014882	404057262	/nfs/dbraw/zinc/05/72/62/404057262.db2.gz	RLAWGKNMSZOYTK-DLBZAZTESA-N	0	3	303.402	2.256	10	0		DEAEHN
C[C@@H]1CN(Cc2ncc(C3CC3)o2)CC[C@H]1N1CCN(C)CC1	ZINC000370149757	404350308	/nfs/dbraw/zinc/35/03/08/404350308.db2.gz	POUVJGJPQXWDOI-GDBMZVCRSA-N	0	3	318.465	2.010	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@@H]1CCC[C@H]2OCC[C@@H]21	ZINC000291895446	404570234	/nfs/dbraw/zinc/57/02/34/404570234.db2.gz	IKQIDISSUOPOGG-KZNAEPCWSA-N	0	3	312.417	2.374	10	0		DEAEHN
CN1CCC[C@H](N2CCN(C(=O)[C@@H]3CCCCC3(C)C)CC2)C1	ZINC000366059255	404749366	/nfs/dbraw/zinc/74/93/66/404749366.db2.gz	WLQLFTYSUNOTRZ-IRXDYDNUSA-N	0	3	321.509	2.441	10	0		DEAEHN
Cc1ccsc1[C@H](C)N[C@H]1CCN(C2CCOCC2)C1=O	ZINC000358208576	404756690	/nfs/dbraw/zinc/75/66/90/404756690.db2.gz	WGFXKXSBFIMFMU-JSGCOSHPSA-N	0	3	308.447	2.487	10	0		DEAEHN
OCCN[C@@H](Cc1ccc(F)cc1)[C@H]1COc2ccccc2O1	ZINC000366444583	404792186	/nfs/dbraw/zinc/79/21/86/404792186.db2.gz	RVLITGUENMARMJ-MAUKXSAKSA-N	0	3	317.360	2.159	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(C(=O)[C@@H]1C[C@H](C)CCN1)CC2	ZINC000423911908	404925671	/nfs/dbraw/zinc/92/56/71/404925671.db2.gz	SKAYKPJZJDJXEY-ACJLOTCBSA-N	0	3	314.429	2.205	10	0		DEAEHN
COc1ccc(CNC[C@@H]2[C@H]3COC[C@H]32)c(Br)c1	ZINC000367599751	405098788	/nfs/dbraw/zinc/09/87/88/405098788.db2.gz	BGXKIWGBIKUCJM-XYYAHUGASA-N	0	3	312.207	2.440	10	0		DEAEHN
c1cc2c(ncnc2NCCc2cc(-c3ccncc3)[nH]n2)[nH]1	ZINC000436425182	405080642	/nfs/dbraw/zinc/08/06/42/405080642.db2.gz	NMXOYJCPZNDWKX-UHFFFAOYSA-N	0	3	305.345	2.349	10	0		DEAEHN
Cn1nnc2cc(CN3CC[C@@]4(O)CCCC[C@@H]4C3)ccc21	ZINC000408073302	405105941	/nfs/dbraw/zinc/10/59/41/405105941.db2.gz	PZHKLUHRJLMVHY-PBHICJAKSA-N	0	3	300.406	2.095	10	0		DEAEHN
CN(C)c1ncc(CN(C[C@H]2CCCO2)C2CCCC2)n1C	ZINC000425333121	405274564	/nfs/dbraw/zinc/27/45/64/405274564.db2.gz	FIDBDYSNKSCVQD-MRXNPFEDSA-N	0	3	306.454	2.410	10	0		DEAEHN
CN(CC[C@@H]1CCOC1)[C@H]1CCN(c2ccccc2F)C1=O	ZINC000438118805	405232911	/nfs/dbraw/zinc/23/29/11/405232911.db2.gz	YBOWCKZCUXYVHL-CJNGLKHVSA-N	0	3	306.381	2.289	10	0		DEAEHN
Cc1c(C(=O)N2CCC[C@H]3CN(C)C[C@H]32)cnn1CC(C)C	ZINC000425048280	405236505	/nfs/dbraw/zinc/23/65/05/405236505.db2.gz	BDFZHHDTVDMGTB-GOEBONIOSA-N	0	3	304.438	2.014	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCc1csc([C@@H](C)OC)n1	ZINC000438411460	405245826	/nfs/dbraw/zinc/24/58/26/405245826.db2.gz	YRFZMHMISQHANB-DGCLKSJQSA-N	0	3	311.451	2.341	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)NC[C@@H](C)N1CCC[C@@H](C)C1	ZINC000454504157	405354820	/nfs/dbraw/zinc/35/48/20/405354820.db2.gz	JIBIYUPOHLFICL-CHWSQXEVSA-N	0	3	322.453	2.465	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)N(C)C[C@@H]2CCCN2C)c1	ZINC000421067298	405443506	/nfs/dbraw/zinc/44/35/06/405443506.db2.gz	MIOJJKFLDKBCEX-INIZCTEOSA-N	0	3	318.421	2.227	10	0		DEAEHN
COc1nsc(CNCC2CCOCC2)c1Br	ZINC000638487371	405501758	/nfs/dbraw/zinc/50/17/58/405501758.db2.gz	OJCJTGUMSDEWFJ-UHFFFAOYSA-N	0	3	321.240	2.430	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NCC[C@H]1CC=CCC1	ZINC000638597807	405564664	/nfs/dbraw/zinc/56/46/64/405564664.db2.gz	BEQWZQHHQQPHPL-FUHWJXTLSA-N	0	3	315.461	2.308	10	0		DEAEHN
CCOC(=O)[C@H]1CN(C/C=C\c2ccc(F)cc2)CC12COC2	ZINC000449366715	405527744	/nfs/dbraw/zinc/52/77/44/405527744.db2.gz	SEEXJJZYJOKNCG-MJSXRHKHSA-N	0	3	319.376	2.350	10	0		DEAEHN
COc1nsc(CN[C@@H](C)[C@H]2CCOC2)c1Br	ZINC000638692271	405620295	/nfs/dbraw/zinc/62/02/95/405620295.db2.gz	FVJKMZQFXNCYAU-YUMQZZPRSA-N	0	3	321.240	2.429	10	0		DEAEHN
CN(C[C@H]1CCCN1C)C(=O)c1ncsc1Br	ZINC000421710048	405602939	/nfs/dbraw/zinc/60/29/39/405602939.db2.gz	IMCKNQXVJROJIR-MRVPVSSYSA-N	0	3	318.240	2.072	10	0		DEAEHN
Cn1ccc(N2CCC[C@H](N[C@H]3CC[C@@H]3C3CCC3)C2=O)n1	ZINC000558696368	405691901	/nfs/dbraw/zinc/69/19/01/405691901.db2.gz	UHUGSZYLQONHLW-ILXRZTDVSA-N	0	3	302.422	2.084	10	0		DEAEHN
c1ccc(OCCCCN2CCN(C[C@@H]3CCOC3)CC2)cc1	ZINC000494690445	405747470	/nfs/dbraw/zinc/74/74/70/405747470.db2.gz	KVEQPTUEUWURSD-SFHVURJKSA-N	0	3	318.461	2.500	10	0		DEAEHN
C(N[C@@H]1CCCC[C@H]1[C@@H]1CCOC1)c1nnc2n1CCCC2	ZINC000530439932	405803135	/nfs/dbraw/zinc/80/31/35/405803135.db2.gz	RSZFEGZXCXNGAN-QLFBSQMISA-N	0	3	304.438	2.299	10	0		DEAEHN
COc1nsc(CNC[C@H]2CC[C@@H](O)C2)c1Br	ZINC000639096110	405879062	/nfs/dbraw/zinc/87/90/62/405879062.db2.gz	AOIYTGAAEPEHAB-JGVFFNPUSA-N	0	3	321.240	2.165	10	0		DEAEHN
c1nc2n(n1)[C@@H](CN(Cc1ccccc1)C[C@@H]1CCCO1)CC2	ZINC000639460035	406098306	/nfs/dbraw/zinc/09/83/06/406098306.db2.gz	QSAXDXQJHURARD-SJORKVTESA-N	0	3	312.417	2.447	10	0		DEAEHN
c1nc2n(n1)[C@H](CN1CCC(N3CCc4ccccc43)CC1)CC2	ZINC000639626597	406176329	/nfs/dbraw/zinc/17/63/29/406176329.db2.gz	UJEALFPMJYLVBX-KRWDZBQOSA-N	0	3	323.444	2.293	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000521253570	406340162	/nfs/dbraw/zinc/34/01/62/406340162.db2.gz	DBRJCVZPMGWSAN-AWEZNQCLSA-N	0	3	317.437	2.145	10	0		DEAEHN
COc1ccc(C[C@H](C)NC[C@@H]2CCCCS2(=O)=O)cc1	ZINC000545242410	406307019	/nfs/dbraw/zinc/30/70/19/406307019.db2.gz	JUIDDHJFOZQHAJ-BBRMVZONSA-N	0	3	311.447	2.183	10	0		DEAEHN
COc1ccc(C[C@@H](C)NC[C@@H]2CCCCS2(=O)=O)cc1	ZINC000545242411	406307065	/nfs/dbraw/zinc/30/70/65/406307065.db2.gz	JUIDDHJFOZQHAJ-CJNGLKHVSA-N	0	3	311.447	2.183	10	0		DEAEHN
CC(C)C[C@H]1CCCN1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637920001	406478545	/nfs/dbraw/zinc/47/85/45/406478545.db2.gz	KHGYWRYNEKQVEC-QZTJIDSGSA-N	0	3	317.477	2.483	10	0		DEAEHN
CC(C)CN(C(=O)[C@@H](N)CN(C)Cc1ccccc1)C(C)C	ZINC000637931678	406482125	/nfs/dbraw/zinc/48/21/25/406482125.db2.gz	GEJAHBHMOYSMLL-KRWDZBQOSA-N	0	3	305.466	2.339	10	0		DEAEHN
CN(Cc1cc(Cl)cc(Cl)c1)C(=O)[C@@H]1OCC[C@@H]1N	ZINC000637934306	406483460	/nfs/dbraw/zinc/48/34/60/406483460.db2.gz	UJNNSBFVOZJBMX-NWDGAFQWSA-N	0	3	303.189	2.068	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N(C)Cc1cccs1	ZINC000637880040	406460256	/nfs/dbraw/zinc/46/02/56/406460256.db2.gz	AEZSTJDZGTUHJZ-INIZCTEOSA-N	0	3	317.458	2.166	10	0		DEAEHN
Cn1nnc2cc(CN3CC[C@@H](c4nc(C5CC5)no4)C3)ccc21	ZINC000551927043	406654293	/nfs/dbraw/zinc/65/42/93/406654293.db2.gz	LKKVGYYJFHWZDW-CYBMUJFWSA-N	0	3	324.388	2.218	10	0		DEAEHN
C[C@H](CNC(=O)NCCOCC1CCC1)N1CCC[C@H](C)C1	ZINC000572452907	406670534	/nfs/dbraw/zinc/67/05/34/406670534.db2.gz	FUZFGYAGPKVLBT-LSDHHAIUSA-N	0	3	311.470	2.223	10	0		DEAEHN
c1sc(-c2ccc3c(c2)OCO3)nc1CNCC1COC1	ZINC000527819018	406762335	/nfs/dbraw/zinc/76/23/35/406762335.db2.gz	WSLCYUJKJHRUBW-UHFFFAOYSA-N	0	3	304.371	2.275	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)N2CCC(C3CCOCC3)CC2)CCN1C	ZINC000554587494	406814424	/nfs/dbraw/zinc/81/44/24/406814424.db2.gz	ARXMABWECISCFK-RHSMWYFYSA-N	0	3	323.481	2.317	10	0		DEAEHN
C[C@H](CN[C@@H]1CCCOc2cc(F)ccc21)N1CCOCC1	ZINC000181929818	298783136	/nfs/dbraw/zinc/78/31/36/298783136.db2.gz	HHRSXRMVUMYOTK-CZUORRHYSA-N	0	3	308.397	2.350	10	0		DEAEHN
CCOc1cc(C)ccc1CNC(=O)N1CC[C@@H](N(C)C)C1	ZINC000129152890	196023621	/nfs/dbraw/zinc/02/36/21/196023621.db2.gz	IFVSSGJDCXVISP-OAHLLOKOSA-N	0	3	305.422	2.239	10	0		DEAEHN
C[C@H](N)c1cccc(S(=O)(=O)NCCCC(F)(F)F)c1	ZINC000130865999	196118172	/nfs/dbraw/zinc/11/81/72/196118172.db2.gz	CQYRJPUENXKAEW-VIFPVBQESA-N	0	3	310.341	2.327	10	0		DEAEHN
CCN[C@@H](CCCS(C)(=O)=O)c1c(OC)cccc1OC	ZINC000131116800	196141433	/nfs/dbraw/zinc/14/14/33/196141433.db2.gz	QWGPMIHWPULCJY-LBPRGKRZSA-N	0	3	315.435	2.179	10	0		DEAEHN
CCc1nn(CCCS(=O)(=O)CC)c(CC)c1[C@H](C)NC	ZINC000131038628	196134857	/nfs/dbraw/zinc/13/48/57/196134857.db2.gz	OHFMHLCWOIJNJY-LBPRGKRZSA-N	0	3	315.483	2.113	10	0		DEAEHN
CS(=O)(=O)CCC[C@H](N)c1ccc(Br)c(F)c1	ZINC000131369827	196162769	/nfs/dbraw/zinc/16/27/69/196162769.db2.gz	VUXOOZKSIDHJNS-NSHDSACASA-N	0	3	324.215	2.413	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)N2CCC(c3cc[nH]n3)CC2)[C@@H](C)C1	ZINC000131630119	196185791	/nfs/dbraw/zinc/18/57/91/196185791.db2.gz	OUKWTNIVQJHJKF-BBRMVZONSA-N	0	3	319.453	2.027	10	0		DEAEHN
COc1ccc(C(N)=S)cc1CN(C)[C@H]1CCCC[C@@H]1O	ZINC000131721125	196193610	/nfs/dbraw/zinc/19/36/10/196193610.db2.gz	CBJLTKRPYZLGMJ-KBPBESRZSA-N	0	3	308.447	2.065	10	0		DEAEHN
CC[C@H](NC(=O)c1ccccc1OCCN(C)C)[C@@H]1CCCO1	ZINC000132341986	196246842	/nfs/dbraw/zinc/24/68/42/196246842.db2.gz	PSCXSALZZHKKQW-RDJZCZTQSA-N	0	3	320.433	2.314	10	0		DEAEHN
CCNc1ncc(Br)c(NC[C@@H](C)N(C)C)n1	ZINC000132223921	196236713	/nfs/dbraw/zinc/23/67/13/196236713.db2.gz	FWXLRQASKICHNO-MRVPVSSYSA-N	0	3	302.220	2.033	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1[C@@H](O)C1CCC1	ZINC000132856759	196291163	/nfs/dbraw/zinc/29/11/63/196291163.db2.gz	PSVMUWMIYYVMFI-LBPRGKRZSA-N	0	3	302.216	2.041	10	0		DEAEHN
CCNCc1sc(N2CCS(=O)CC2)nc1[C@H](C)CC	ZINC000133100885	196312083	/nfs/dbraw/zinc/31/20/83/196312083.db2.gz	UPCIDGOQEQLGFL-LLVKDONJSA-N	0	3	315.508	2.335	10	0		DEAEHN
COC(=O)C[C@H](NC(=O)[C@]1(C)CCCCN1)c1cccs1	ZINC000133171187	196317970	/nfs/dbraw/zinc/31/79/70/196317970.db2.gz	USKMLPUUZOAYNO-NHYWBVRUSA-N	0	3	310.419	2.001	10	0		DEAEHN
COC(=O)c1ccc(Cl)cc1N[C@@H](C)C[C@@H]1COCCN1	ZINC000133568561	196331150	/nfs/dbraw/zinc/33/11/50/196331150.db2.gz	QGEOEQBCVIYAOL-CMPLNLGQSA-N	0	3	312.797	2.306	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1cc(Br)c[nH]1	ZINC000134524866	196398081	/nfs/dbraw/zinc/39/80/81/196398081.db2.gz	ZEIGWRUXYXJRLX-UHFFFAOYSA-N	0	3	320.190	2.310	10	0		DEAEHN
Cc1cc(OCC(=O)N2CCN3CCC[C@@H]3C2)ccc1Cl	ZINC000195315971	225201673	/nfs/dbraw/zinc/20/16/73/225201673.db2.gz	UMNMHTGFFQSHFR-CYBMUJFWSA-N	0	3	308.809	2.334	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCCC[C@@H](n2ccc(N)n2)C1	ZINC000616629810	422516929	/nfs/dbraw/zinc/51/69/29/422516929.db2.gz	QLVMIHXWZWSCFJ-CYBMUJFWSA-N	0	3	323.441	2.017	10	0		DEAEHN
CCC(CC)NC(=O)[C@@H](C)N1CCC(Cc2nccn2C)CC1	ZINC000105876262	424849236	/nfs/dbraw/zinc/84/92/36/424849236.db2.gz	LYNOYHUVBZCXJA-CQSZACIVSA-N	0	3	320.481	2.368	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1	ZINC000105881208	424849634	/nfs/dbraw/zinc/84/96/34/424849634.db2.gz	CTZADLUNCCAMLM-CABCVRRESA-N	0	3	312.417	2.147	10	0		DEAEHN
COCCN(CCN(C)C)C(=O)NC[C@H]1C[C@@H]1c1ccccc1	ZINC000111890124	424852144	/nfs/dbraw/zinc/85/21/44/424852144.db2.gz	IYRSBKYKVKPVHD-IAGOWNOFSA-N	0	3	319.449	2.010	10	0		DEAEHN
Cc1nn(CC(C)C)c(C)c1CC(=O)N1CCN2CCC[C@H]2C1	ZINC000195321546	424882607	/nfs/dbraw/zinc/88/26/07/424882607.db2.gz	HZECQQLNFCFFOQ-INIZCTEOSA-N	0	3	318.465	2.005	10	0		DEAEHN
CN(Cc1ccc(Br)cc1F)C[C@@H]1CNCCO1	ZINC000125517928	424855912	/nfs/dbraw/zinc/85/59/12/424855912.db2.gz	CJQNNUVMQOFRSU-LBPRGKRZSA-N	0	3	317.202	2.008	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1nc(C)c(C)s1	ZINC000177559995	424863679	/nfs/dbraw/zinc/86/36/79/424863679.db2.gz	ZKSWXZZOTKNCTJ-CYBMUJFWSA-N	0	3	310.467	2.386	10	0		DEAEHN
Cc1nc(N)nc(N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)n1	ZINC000379686927	424907818	/nfs/dbraw/zinc/90/78/18/424907818.db2.gz	BYFJHDNUQYRWBW-IUODEOHRSA-N	0	3	312.421	2.227	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)c2nscc2Br)CCN1C	ZINC000404941999	424930491	/nfs/dbraw/zinc/93/04/91/424930491.db2.gz	MILOHDNXHOXTQR-JGVFFNPUSA-N	0	3	318.240	2.118	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)CN(C)[C@]1(CO)CC[C@@H](C)C1	ZINC000249573267	424887694	/nfs/dbraw/zinc/88/76/94/424887694.db2.gz	OTZWXAGASLCMRX-DNVCBOLYSA-N	0	3	318.461	2.436	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)s1	ZINC000085409800	267387691	/nfs/dbraw/zinc/38/76/91/267387691.db2.gz	MGOYTNFZTQGSOL-GXTWGEPZSA-N	0	3	324.494	2.230	10	0		DEAEHN
CCN1CCN(C[C@@H](C)CNC(=O)NCCC2CCCC2)CC1	ZINC000173914919	267485099	/nfs/dbraw/zinc/48/50/99/267485099.db2.gz	YHNNIIMASXJXIV-INIZCTEOSA-N	0	3	324.513	2.140	10	0		DEAEHN
NC[C@@H](NC(=O)CCOc1ccccc1Cl)C(F)(F)F	ZINC000655509432	425585762	/nfs/dbraw/zinc/58/57/62/425585762.db2.gz	NIRFTGKVDCXGBA-SNVBAGLBSA-N	0	3	310.703	2.115	10	0		DEAEHN
CN(C(=O)c1ccc(Br)o1)[C@@H](CN)C(F)(F)F	ZINC000662974977	425768605	/nfs/dbraw/zinc/76/86/05/425768605.db2.gz	CIWQSUCNUHCCHB-LURJTMIESA-N	0	3	315.089	2.004	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1C[C@@H]2CC[C@H](O)C[C@H]2C1	ZINC000398865686	269109709	/nfs/dbraw/zinc/10/97/09/269109709.db2.gz	SLABJUUSPZSMOD-BZSNNMDCSA-N	0	3	316.445	2.128	10	0		DEAEHN
CSc1nc2ncnc(N3CCN4CCC[C@@H]4C3)c2s1	ZINC000171939474	274190044	/nfs/dbraw/zinc/19/00/44/274190044.db2.gz	IABLCNFDLTZICH-SECBINFHSA-N	0	3	307.448	2.093	10	0		DEAEHN
C[C@@H](N[C@H]1CCc2ncnn2C1)c1ccc(-n2ccnc2)cc1	ZINC000180590692	274263615	/nfs/dbraw/zinc/26/36/15/274263615.db2.gz	STLHUCOQJXIMOD-HIFRSBDPSA-N	0	3	308.389	2.129	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)c2cccc(C(F)(F)F)n2)CCN1C	ZINC000449941310	274391342	/nfs/dbraw/zinc/39/13/42/274391342.db2.gz	PICFJDCYEDNAQF-ZJUUUORDSA-N	0	3	301.312	2.313	10	0		DEAEHN
C[C@H](NCC(=O)N1CCSc2ccccc21)[C@@H]1CCCO1	ZINC000183087014	274510552	/nfs/dbraw/zinc/51/05/52/274510552.db2.gz	WGLGVOSXLWHIEN-JSGCOSHPSA-N	0	3	306.431	2.282	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)Nc2cc(C)cc(C)c2)c1	ZINC000105881641	274829999	/nfs/dbraw/zinc/82/99/99/274829999.db2.gz	DLXGJWIOWQTOQD-HNNXBMFYSA-N	0	3	300.406	2.425	10	0		DEAEHN
CC(C)Cn1c(=O)c2sccc2nc1N1CCC[C@@H](N)C1	ZINC000057346569	275604183	/nfs/dbraw/zinc/60/41/83/275604183.db2.gz	QPMQPJWWWBBVMG-LLVKDONJSA-N	0	3	306.435	2.042	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCOC[C@H]2c2ccc(C)o2)C1	ZINC000247209031	276166594	/nfs/dbraw/zinc/16/65/94/276166594.db2.gz	ULNSNXMAGZRBLF-CABCVRRESA-N	0	3	321.421	2.155	10	0		DEAEHN
CCn1c2ccc(Br)cc2nc1NC(=O)[C@@H](C)N	ZINC000158163849	276711222	/nfs/dbraw/zinc/71/12/22/276711222.db2.gz	FKYRBLYJQABWDM-SSDOTTSWSA-N	0	3	311.183	2.104	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)N[C@H]2CCCOc3c(F)cccc32)C1	ZINC000183827687	276795344	/nfs/dbraw/zinc/79/53/44/276795344.db2.gz	MUWKKVZORDGMQN-WFASDCNBSA-N	0	3	321.396	2.385	10	0		DEAEHN
CC(=O)NCCCN1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)OC(C)(C)C	ZINC000249463075	277030995	/nfs/dbraw/zinc/03/09/95/277030995.db2.gz	ROGXHOPBABFTJR-XHSDSOJGSA-N	0	3	324.465	2.487	10	0		DEAEHN
CN1CC[C@@H](NC(=O)c2ccc(NC=O)cc2)[C@H]1c1ccccc1	ZINC000252801461	277137300	/nfs/dbraw/zinc/13/73/00/277137300.db2.gz	JOTUAVSWHCGFET-QZTJIDSGSA-N	0	3	323.396	2.430	10	0		DEAEHN
C/C(=C/c1ccccc1)CNC[C@@H]1CCCCN1S(C)(=O)=O	ZINC000353089467	277728766	/nfs/dbraw/zinc/72/87/66/277728766.db2.gz	MRRSPJSEVINTPA-KSVUCXBSSA-N	0	3	322.474	2.494	10	0		DEAEHN
COc1ccccc1N1CC[C@H](N[C@@H](C)c2cnn(C)c2)C1	ZINC000119665018	278055747	/nfs/dbraw/zinc/05/57/47/278055747.db2.gz	LJPTWPVWJAJBFV-ZFWWWQNUSA-N	0	3	300.406	2.358	10	0		DEAEHN
C[C@@H](CS(=O)(=O)c1ccccc1)NC[C@H]1CCC(C)(C)O1	ZINC000187850091	278292159	/nfs/dbraw/zinc/29/21/59/278292159.db2.gz	CTGVROXYRCAQJW-UONOGXRCSA-N	0	3	311.447	2.396	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1nc2ccccc2s1)[C@H]1CCCO1	ZINC000183130489	278339254	/nfs/dbraw/zinc/33/92/54/278339254.db2.gz	IDQIBHXGGSPKMB-ZYHUDNBSSA-N	0	3	305.403	2.392	10	0		DEAEHN
CC(C)C[C@H](C)S(=O)(=O)N1CCC(N2CCCC2)CC1	ZINC000118426698	279116771	/nfs/dbraw/zinc/11/67/71/279116771.db2.gz	UYKCNGDEKUFIBA-AWEZNQCLSA-N	0	3	302.484	2.311	10	0		DEAEHN
C[C@H](C(=O)N1CCC[C@H]1c1cnn(C)c1)N1CCCCCC1	ZINC000176000502	279196001	/nfs/dbraw/zinc/19/60/01/279196001.db2.gz	KHKXUTSPUROVSJ-ZBFHGGJFSA-N	0	3	304.438	2.348	10	0		DEAEHN
Cc1c2ccccc2oc(=O)c1C(=O)N1CCN2CCC[C@H]2C1	ZINC000177200517	280271324	/nfs/dbraw/zinc/27/13/24/280271324.db2.gz	BNFPQKUIOWYSDB-ZDUSSCGKSA-N	0	3	312.369	2.022	10	0		DEAEHN
O=C1Nc2ccccc2CC[C@H]1N1CCC[C@@H](C2OCCO2)C1	ZINC000248803843	280304047	/nfs/dbraw/zinc/30/40/47/280304047.db2.gz	ATMKARQLSOHICJ-GDBMZVCRSA-N	0	3	316.401	2.025	10	0		DEAEHN
CC[C@H](C(=O)NC[C@H](O)CN1CCCCC1)c1ccc(F)cc1	ZINC000184217693	280679769	/nfs/dbraw/zinc/67/97/69/280679769.db2.gz	SKZAEZRLAKKRKW-IRXDYDNUSA-N	0	3	322.424	2.282	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cccnc1C(F)(F)F	ZINC000252736435	297100423	/nfs/dbraw/zinc/10/04/23/297100423.db2.gz	VOFKMGOYHGFVSF-MNOVXSKESA-N	0	3	313.323	2.409	10	0		DEAEHN
C[C@@H]1OCC[C@@H]1N[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1	ZINC000245580960	297599426	/nfs/dbraw/zinc/59/94/26/297599426.db2.gz	HDHKMEPAJVGPNH-CFMVVWHZSA-N	0	3	308.809	2.379	10	0		DEAEHN
NC(=O)NC(=O)CN[C@@H](c1cccc(Cl)c1)C1CCCC1	ZINC000181045415	303271291	/nfs/dbraw/zinc/27/12/91/303271291.db2.gz	BLMLIVBFOWFXLL-CQSZACIVSA-N	0	3	309.797	2.356	10	0		DEAEHN
CC[C@H](C)n1ncc(C(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)c1C	ZINC000574690349	326178135	/nfs/dbraw/zinc/17/81/35/326178135.db2.gz	BSYGLMVMPYTGNM-BFQNTYOBSA-N	0	3	304.438	2.375	10	0		DEAEHN
C[C@H](N[C@H]1CCC(=O)N[C@@H]1C)c1ccc(Br)cn1	ZINC000584270789	332178442	/nfs/dbraw/zinc/17/84/42/332178442.db2.gz	BBZGZABVOXMDPL-SBMIAAHKSA-N	0	3	312.211	2.162	10	0		DEAEHN
COC[C@H](C)C[NH+]1CCC(C(=O)Nc2ccccc2[O-])CC1	ZINC000189588781	333150025	/nfs/dbraw/zinc/15/00/25/333150025.db2.gz	VUAQFSMWYIFODU-CYBMUJFWSA-N	0	3	306.406	2.325	10	0		DEAEHN
c1ncn(Cc2ccc(CNCc3ccc4c[nH]nc4c3)cc2)n1	ZINC000343919818	500689689	/nfs/dbraw/zinc/68/96/89/500689689.db2.gz	RVGDLVREMNKGLI-UHFFFAOYSA-N	0	3	318.384	2.493	10	0		DEAEHN
COc1ccc(C[C@H](C)CN2CCN(CCO)[C@H](C)C2)cc1F	ZINC000190239065	533777936	/nfs/dbraw/zinc/77/79/36/533777936.db2.gz	HMSYMDINFHLHNB-LSDHHAIUSA-N	0	3	324.440	2.011	10	0		DEAEHN
Cc1cc(C)nc(NC(=O)[C@@H]2CN(C)C[C@H]2C(F)(F)F)c1	ZINC000299743414	534138143	/nfs/dbraw/zinc/13/81/43/534138143.db2.gz	KZIMACZNVKQVHY-GHMZBOCLSA-N	0	3	301.312	2.377	10	0		DEAEHN
CC(C)N(C(=O)[C@H](C)N1CCC[C@H](Cn2cncn2)C1)C(C)C	ZINC000105883716	519573799	/nfs/dbraw/zinc/57/37/99/519573799.db2.gz	HOYLVLUKJFJZBJ-HOTGVXAUSA-N	0	3	321.469	2.024	10	0		DEAEHN
CCCCN(CCCC)C(=O)CN1C[C@H](C(N)=O)CC[C@@H]1C	ZINC000103286318	520488401	/nfs/dbraw/zinc/48/84/01/520488401.db2.gz	WFWHHNDZRZAACY-LSDHHAIUSA-N	0	3	311.470	2.001	10	0		DEAEHN
COc1cc(C)cc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1O	ZINC000247477585	522234828	/nfs/dbraw/zinc/23/48/28/522234828.db2.gz	UCFOPZREHDYVDU-STQMWFEESA-N	0	3	306.406	2.264	10	0		DEAEHN
CC[C@H]1CN(CCOc2ccc(F)cc2)CCN1CCOC	ZINC000105835862	523279210	/nfs/dbraw/zinc/27/92/10/523279210.db2.gz	YPWFVGUKENHUGV-INIZCTEOSA-N	0	3	310.413	2.247	10	0		DEAEHN
CO[C@H](C)CN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1	ZINC000365194834	523881771	/nfs/dbraw/zinc/88/17/71/523881771.db2.gz	CVRYSCQNNJVDPG-SUYBPPKGSA-N	0	3	305.422	2.411	10	0		DEAEHN
CC(=O)N(c1nnc(SC[C@@H](C)N(C)C)s1)C1CC1	ZINC000358863724	534751018	/nfs/dbraw/zinc/75/10/18/534751018.db2.gz	RJZPOHFKRSTQMT-MRVPVSSYSA-N	0	3	300.453	2.096	10	0		DEAEHN
Cc1ccc(N2CCCN(CCOCCC(C)C)CC2)nn1	ZINC000105909409	524947836	/nfs/dbraw/zinc/94/78/36/524947836.db2.gz	DTQZZUSSGPXVBI-UHFFFAOYSA-N	0	3	306.454	2.360	10	0		DEAEHN
C[C@@H](NC(C)(C)CNC(=O)[C@@H]1CSC(=O)N1)c1ccccc1	ZINC000155776180	525386531	/nfs/dbraw/zinc/38/65/31/525386531.db2.gz	FESGACUJDONZFV-YPMHNXCESA-N	0	3	321.446	2.057	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2ccc([S@@](C)=O)cc2)CCN1C	ZINC000245455804	525414338	/nfs/dbraw/zinc/41/43/38/525414338.db2.gz	AYBHQKOGDRAZCM-MZOGBMEOSA-N	0	3	323.462	2.370	10	0		DEAEHN
CSCC[C@H](N)C(=O)Nc1cccc(-c2nnc(C)o2)c1	ZINC000157361573	525585374	/nfs/dbraw/zinc/58/53/74/525585374.db2.gz	HMRSIUPIEAQQEY-LBPRGKRZSA-N	0	3	306.391	2.064	10	0		DEAEHN
N[C@H](CC(=O)NC[C@H]1COc2ccccc2O1)c1ccccc1	ZINC000237859739	527384335	/nfs/dbraw/zinc/38/43/35/527384335.db2.gz	MBEQPOALTHHUBO-LSDHHAIUSA-N	0	3	312.369	2.033	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)N1CCO[C@@H](c2cccc(O)c2)C1	ZINC000247019319	535494333	/nfs/dbraw/zinc/49/43/33/535494333.db2.gz	KSEMINFWWXTQOP-DLBZAZTESA-N	0	3	318.417	2.167	10	0		DEAEHN
CCCc1nc(CN2CCN(C[C@H](C)O)[C@H](CC)C2)cs1	ZINC000246646863	535525104	/nfs/dbraw/zinc/52/51/04/535525104.db2.gz	AZXVQWQUSHESHW-DZGCQCFKSA-N	0	3	311.495	2.373	10	0		DEAEHN
CCO[C@H](CCNC(=O)N1CCN2CCC[C@@H]2C1)C1CCCC1	ZINC000176512782	535604470	/nfs/dbraw/zinc/60/44/70/535604470.db2.gz	XPUHWEUUVQUSSR-IAGOWNOFSA-N	0	3	323.481	2.461	10	0		DEAEHN
CCN1CCN([C@@H](C)CNC(=O)[C@H](C)Cc2ccccc2)CC1	ZINC000358457987	535729017	/nfs/dbraw/zinc/72/90/17/535729017.db2.gz	SPXIYCMIQSJZAU-SJORKVTESA-N	0	3	317.477	2.007	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc(N(C)CC)nc2)CCN1CCOC	ZINC000191337501	535862009	/nfs/dbraw/zinc/86/20/09/535862009.db2.gz	NCDZFTXTZOFYIH-QGZVFWFLSA-N	0	3	320.481	2.080	10	0		DEAEHN
CN(C)C[C@H](NC(=O)N[C@@H]1C[C@H]2OCCC[C@@H]12)c1ccccc1	ZINC000251586906	535951383	/nfs/dbraw/zinc/95/13/83/535951383.db2.gz	FIYZYVNOGWBOLP-VVLHAWIVSA-N	0	3	317.433	2.156	10	0		DEAEHN
CCc1ccccc1NC(=O)[C@H](C)N1CCN2CCC[C@H]2C1	ZINC000247015220	535961979	/nfs/dbraw/zinc/96/19/79/535961979.db2.gz	CJQYGLCHHPZPTL-HOCLYGCPSA-N	0	3	301.434	2.356	10	0		DEAEHN
CNC(=O)c1ccc(CN(C)C[C@H](O)CC2CCCC2)cc1	ZINC000191267605	536421113	/nfs/dbraw/zinc/42/11/13/536421113.db2.gz	XYCAMJNWNVQOLU-QGZVFWFLSA-N	0	3	304.434	2.419	10	0		DEAEHN
COc1ccc(F)cc1[C@H](C)NCC1CCS(=O)(=O)CC1	ZINC000358353967	536638468	/nfs/dbraw/zinc/63/84/68/536638468.db2.gz	LGIJVFHAPSARQI-NSHDSACASA-N	0	3	315.410	2.310	10	0		DEAEHN
CO[C@H]1C[C@@H](CN(C)C(=O)c2ccc3ncccc3c2)N(C)C1	ZINC000346711291	536781787	/nfs/dbraw/zinc/78/17/87/536781787.db2.gz	YIXARQWHFVNSHQ-HOTGVXAUSA-N	0	3	313.401	2.026	10	0		DEAEHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@H]1CCCO[C@H]1C	ZINC000192197990	625564452	/nfs/dbraw/zinc/56/44/52/625564452.db2.gz	JTIFEBOVROEBMC-RWMBFGLXSA-N	0	3	316.357	2.158	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)S(=O)(=O)/C=C\c1ccccc1	ZINC000255435492	624724067	/nfs/dbraw/zinc/72/40/67/624724067.db2.gz	WNOISYXHFRIEGF-KVNDZABWSA-N	0	3	308.447	2.403	10	0		DEAEHN
CC[C@@H]1CCCC[C@@H]1OCC(=O)C(C#N)C(=O)N1CCCC1	ZINC000248622395	634452741	/nfs/dbraw/zinc/45/27/41/634452741.db2.gz	MHCFZXPEEXUQLV-YCPHGPKFSA-N	0	3	306.406	2.303	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)c2ncccn2)[C@@H]1c1cccs1	ZINC000743568494	638158096	/nfs/dbraw/zinc/15/80/96/638158096.db2.gz	WCCPCFFUMSEPNS-GXTWGEPZSA-N	0	3	316.430	2.351	10	0		DEAEHN
Cc1onc(-c2ccc(F)cc2)c1C(=O)N(C)CCN(C)C	ZINC000748406790	638552485	/nfs/dbraw/zinc/55/24/85/638552485.db2.gz	NJVKTYCOTQBLMC-UHFFFAOYSA-N	0	3	305.353	2.423	10	0		DEAEHN
C[Si](C)(C)c1ccc(CN2CCC(CC(N)=O)CC2)cc1	ZINC000801915633	645461516	/nfs/dbraw/zinc/46/15/16/645461516.db2.gz	UATJUFLNYVNAOO-UHFFFAOYSA-N	0	3	304.510	2.319	10	0		DEAEHN
CC(C)(C)OC(=O)N(C[C@@H]1CCCO1)c1ccc(CN)nc1	ZINC000757134214	645929090	/nfs/dbraw/zinc/92/90/90/645929090.db2.gz	LUEBGWWXPZTKJW-AWEZNQCLSA-N	0	3	307.394	2.461	10	0		DEAEHN
COC(=O)C[C@H](C)C(=O)O[C@H]1CCN(Cc2ccccc2)C1	ZINC000151558638	646921761	/nfs/dbraw/zinc/92/17/61/646921761.db2.gz	PURFPBDKMOZUHK-ZFWWWQNUSA-N	0	3	305.374	2.003	10	0		DEAEHN
CC(C)N1CCCN(C(=O)c2cc(Cl)nc(N(C)C)c2)CC1	ZINC000733146269	647892900	/nfs/dbraw/zinc/89/29/00/647892900.db2.gz	HSWBPSDCISCYCU-UHFFFAOYSA-N	0	3	324.856	2.357	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)/C=C/c1ccc(F)cc1	ZINC000175218079	648338858	/nfs/dbraw/zinc/33/88/58/648338858.db2.gz	NABSMXJIBMPTNT-NHAQELONSA-N	0	3	314.426	2.446	10	0		DEAEHN
Cn1cnc(CNC[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000390795821	685443071	/nfs/dbraw/zinc/44/30/71/685443071.db2.gz	JEUGLHFMZHYDLA-OLZOCXBDSA-N	0	3	308.426	2.203	10	0		DEAEHN
COCCc1nc(C)c([C@@H](C)NCC2(C)OCCCO2)s1	ZINC000190662304	684411209	/nfs/dbraw/zinc/41/12/09/684411209.db2.gz	ZHTHXLDEWKXYFD-LLVKDONJSA-N	0	3	314.451	2.444	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](C)C[C@@H](O)c2ccccc2)C1	ZINC000246817970	685136934	/nfs/dbraw/zinc/13/69/34/685136934.db2.gz	YXWQRFDHEHWJDV-BHYGNILZSA-N	0	3	319.449	2.282	10	0		DEAEHN
C[C@@](O)(CN1CCC[C@H](CCO)C1)C(F)(F)C(F)(F)F	ZINC000724041729	777228616	/nfs/dbraw/zinc/22/86/16/777228616.db2.gz	OLHCRSFGKOMWMR-NXEZZACHSA-N	0	3	305.287	2.029	10	0		DEAEHN
Cn1nccc1CN[C@H]1CN(C(=O)OC(C)(C)C)CC1(C)C	ZINC000721850172	787323324	/nfs/dbraw/zinc/32/33/24/787323324.db2.gz	RAPRXARDVSQSQG-ZDUSSCGKSA-N	0	3	308.426	2.155	10	0		DEAEHN
Cn1ncc(CNCCCNC(=O)OC(C)(C)C)c1Cl	ZINC000712400790	792185966	/nfs/dbraw/zinc/18/59/66/792185966.db2.gz	DRKBNWIJWKECAN-UHFFFAOYSA-N	0	3	302.806	2.078	10	0		DEAEHN
C[C@H](CNCc1cn(C)nc1Br)c1ccccn1	ZINC000712432312	792187277	/nfs/dbraw/zinc/18/72/77/792187277.db2.gz	ARBFPQALPHDONO-SNVBAGLBSA-N	0	3	309.211	2.471	10	0		DEAEHN
C[C@H](N[C@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C)c1cn(C)nn1	ZINC000715858048	792528126	/nfs/dbraw/zinc/52/81/26/792528126.db2.gz	VQGZSZCLYBTAGN-XQQFMLRXSA-N	0	3	323.441	2.159	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@H]1C[C@H](NCc2cncnc2)C12CCC2	ZINC000404634126	802026377	/nfs/dbraw/zinc/02/63/77/802026377.db2.gz	HKHSFWOURHNZKR-KBPBESRZSA-N	0	3	318.421	2.402	10	0		DEAEHN
c1ccc2c(c1)OC[C@H](CNCc1cccc3c1OCCO3)O2	ZINC000047495940	1078395111	/nfs/dbraw/zinc/39/51/11/1078395111.db2.gz	FXKLDODXNBAVGL-AWEZNQCLSA-N	0	3	313.353	2.387	10	0		DEAEHN
c1cc2c(c(CNCCOc3ccc4c(c3)OCO4)c1)OCO2	ZINC000048817270	1078427467	/nfs/dbraw/zinc/42/74/67/1078427467.db2.gz	RRYBJCPLHNAPBE-UHFFFAOYSA-N	0	3	315.325	2.313	10	0		DEAEHN
CN1CCC[C@@H]2[C@H]1CCN2C(=O)c1ccnc(Br)c1	ZINC000720828903	1086183720	/nfs/dbraw/zinc/18/37/20/1086183720.db2.gz	JVDSXZVCWUCPPP-VXGBXAGGSA-N	0	3	324.222	2.153	10	0		DEAEHN
CC1(C)CNCCN1C(=O)/C=C/c1ccc(Br)o1	ZINC000700608472	1086322132	/nfs/dbraw/zinc/32/21/32/1086322132.db2.gz	IGHGGBQYKSFTNE-GQCTYLIASA-N	0	3	313.195	2.266	10	0		DEAEHN
C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1NCCS(=O)(=O)C1CCCCC1	ZINC000701028027	1086348626	/nfs/dbraw/zinc/34/86/26/1086348626.db2.gz	VWIRHCTXLJWJFB-COMQUAJESA-N	0	3	303.468	2.135	10	0		DEAEHN
Cc1cc(CNC[C@@H]2COCCN2C(=O)OC(C)(C)C)ccn1	ZINC000703509178	1086499655	/nfs/dbraw/zinc/49/96/55/1086499655.db2.gz	XDFPYWIVVBHESZ-OAHLLOKOSA-N	0	3	321.421	2.116	10	0		DEAEHN
Cn1ncc(CN[C@@H]2CCCCCN(Cc3ccccc3)C2)n1	ZINC000709621425	1086683854	/nfs/dbraw/zinc/68/38/54/1086683854.db2.gz	VETBTTCHGWCIOB-QGZVFWFLSA-N	0	3	313.449	2.350	10	0		DEAEHN
C[C@H]1[C@H](NC(=O)c2cc(Br)ccc2F)CCN1C	ZINC000719388442	1089071106	/nfs/dbraw/zinc/07/11/06/1089071106.db2.gz	QGTQGMDXEAHDMH-QPUJVOFHSA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@@H]1[C@H](NC(=O)c2cc(Cl)c(N)c(Cl)c2)CCN1C	ZINC000719391754	1089081378	/nfs/dbraw/zinc/08/13/78/1089081378.db2.gz	IRFRERKUNJPENT-RDDDGLTNSA-N	0	3	302.205	2.398	10	0		DEAEHN
Cc1nc2ccccc2nc1NC[C@H](O)CN1CCCCC1	ZINC000174684936	282089463	/nfs/dbraw/zinc/08/94/63/282089463.db2.gz	DMMJVEMJVXBSQL-AWEZNQCLSA-N	0	3	300.406	2.197	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)C1CCN(C)CC1	ZINC000137316249	282095577	/nfs/dbraw/zinc/09/55/77/282095577.db2.gz	BONUOQDHDGUFDR-LBPRGKRZSA-N	0	3	306.454	2.466	10	0		DEAEHN
CCCOc1ccc(CNC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000139539169	282101738	/nfs/dbraw/zinc/10/17/38/282101738.db2.gz	PIVDRYBVUZHTJG-HNNXBMFYSA-N	0	3	305.422	2.369	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)Nc2cc(F)cc(Cl)c2)CCO1	ZINC000181239740	199269928	/nfs/dbraw/zinc/26/99/28/199269928.db2.gz	HXLABUAENSYFNY-CYBMUJFWSA-N	0	3	315.776	2.273	10	0		DEAEHN
CN[C@@H](CSCCC(=O)OC)c1ccc(OC)cc1OC	ZINC000081789044	192324198	/nfs/dbraw/zinc/32/41/98/192324198.db2.gz	BJIJDMZSIQPXCQ-ZDUSSCGKSA-N	0	3	313.419	2.261	10	0		DEAEHN
CN[C@H](CSCCC(=O)OC)c1ccc(OC)cc1OC	ZINC000081789047	192324902	/nfs/dbraw/zinc/32/49/02/192324902.db2.gz	BJIJDMZSIQPXCQ-CYBMUJFWSA-N	0	3	313.419	2.261	10	0		DEAEHN
CCC[C@H]1CCCN(C(=O)NC[C@H]2CCCN2CCOC)C1	ZINC000150887618	282107147	/nfs/dbraw/zinc/10/71/47/282107147.db2.gz	ILXSAYIESJIPJD-JKSUJKDBSA-N	0	3	311.470	2.319	10	0		DEAEHN
CCCN[C@@H]1c2ccccc2OC[C@@H]1Sc1nncn1C	ZINC000081866885	192332484	/nfs/dbraw/zinc/33/24/84/192332484.db2.gz	PVFZBLKJYUOFKE-UONOGXRCSA-N	0	3	304.419	2.409	10	0		DEAEHN
CCCNCc1cc(Cl)ccc1N(C)CCS(C)(=O)=O	ZINC000162886880	197598746	/nfs/dbraw/zinc/59/87/46/197598746.db2.gz	RBZSTKFYHXZKKC-UHFFFAOYSA-N	0	3	318.870	2.320	10	0		DEAEHN
CN[C@H]1CCC[C@@H]1S(=O)(=O)c1ccc(Br)cc1	ZINC000081933392	192341175	/nfs/dbraw/zinc/34/11/75/192341175.db2.gz	CERPDEJWLOIVLO-RYUDHWBXSA-N	0	3	318.236	2.363	10	0		DEAEHN
CCOC(=O)[C@@](C)(NCCN(C)C)c1ccc(F)cc1Cl	ZINC000078901561	185126375	/nfs/dbraw/zinc/12/63/75/185126375.db2.gz	ZFLNSDCOUGSNJD-HNNXBMFYSA-N	0	3	316.804	2.409	10	0		DEAEHN
CCC[C@H](N)[C@H](CC)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000081935479	192343333	/nfs/dbraw/zinc/34/33/33/192343333.db2.gz	ZAZNDKOFLTVCRH-WFASDCNBSA-N	0	3	313.419	2.138	10	0		DEAEHN
CC[C@H](NC)[C@@H](C)S(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000081936065	192343493	/nfs/dbraw/zinc/34/34/93/192343493.db2.gz	CTNATFLGWRTPKR-YPMHNXCESA-N	0	3	313.419	2.008	10	0		DEAEHN
COc1ccc([C@H](C)N[C@H](C(=O)N2CCOCC2)C(C)C)cc1	ZINC000164967899	197667963	/nfs/dbraw/zinc/66/79/63/197667963.db2.gz	HDTFRYVWHAWTIQ-YOEHRIQHSA-N	0	3	320.433	2.229	10	0		DEAEHN
CN[C@@H](c1ccc(Br)s1)[C@H]1CCS(=O)(=O)C1	ZINC000082998704	185210703	/nfs/dbraw/zinc/21/07/03/185210703.db2.gz	UUDBVQDGSACLHK-OIBJUYFYSA-N	0	3	324.265	2.206	10	0		DEAEHN
CCn1nccc1CN(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000328644077	231281429	/nfs/dbraw/zinc/28/14/29/231281429.db2.gz	RQCQTRSGOIYQQT-WMZOPIPTSA-N	0	3	313.449	2.423	10	0		DEAEHN
CCn1nccc1[C@@H]1OCC[C@H]1CNCc1ccc(C)cn1	ZINC000328654203	231289421	/nfs/dbraw/zinc/28/94/21/231289421.db2.gz	XHTZEADSHWYIIH-WMLDXEAASA-N	0	3	300.406	2.474	10	0		DEAEHN
Cn1cc([C@@H](CN)Oc2ccc(Br)c(F)c2)cn1	ZINC000087430491	185224464	/nfs/dbraw/zinc/22/44/64/185224464.db2.gz	CTVATAIWIHWOKD-GFCCVEGCSA-N	0	3	314.158	2.401	10	0		DEAEHN
CC(C)c1nnsc1C(=O)N1C[C@H](N)Cc2ccccc21	ZINC000087443037	185225136	/nfs/dbraw/zinc/22/51/36/185225136.db2.gz	VRLWGHTYJWBGSJ-LLVKDONJSA-N	0	3	302.403	2.192	10	0		DEAEHN
CC(C)[C@@H](N)CS(=O)(=O)c1cccc(Br)c1	ZINC000087540076	185228280	/nfs/dbraw/zinc/22/82/80/185228280.db2.gz	ZFPYMJVANOVOHS-NSHDSACASA-N	0	3	306.225	2.206	10	0		DEAEHN
CC(=O)c1csc(NC(=O)[C@H]2CNCc3ccccc32)n1	ZINC000087619950	185229306	/nfs/dbraw/zinc/22/93/06/185229306.db2.gz	VJYHNHPKVRFMPX-LBPRGKRZSA-N	0	3	301.371	2.171	10	0		DEAEHN
NCc1cc(S(=O)(=O)N2CCC[C@H]3CCC[C@@H]32)ccc1F	ZINC000087768771	185231395	/nfs/dbraw/zinc/23/13/95/185231395.db2.gz	SGNXZYZPWCPHBS-ABAIWWIYSA-N	0	3	312.410	2.238	10	0		DEAEHN
COc1ccc(Br)c(Cn2cc(CN)c(C)n2)c1	ZINC000087799457	185232683	/nfs/dbraw/zinc/23/26/83/185232683.db2.gz	OPWJOGATTZVOQP-UHFFFAOYSA-N	0	3	310.195	2.470	10	0		DEAEHN
CN(Cc1cccc(Br)c1)c1ccnc(=NN)[nH]1	ZINC000087864156	185233867	/nfs/dbraw/zinc/23/38/67/185233867.db2.gz	RKTAFUTVMDHPDA-UHFFFAOYSA-N	0	3	308.183	2.161	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(OC[C@H]2CCCCN2C)n1	ZINC000088165594	185240833	/nfs/dbraw/zinc/24/08/33/185240833.db2.gz	QLEBNKZXFMTAAI-LLVKDONJSA-N	0	3	313.833	2.234	10	0		DEAEHN
CCc1ccsc1CNCc1ccc(OCC(N)=O)cc1	ZINC000088290434	185244991	/nfs/dbraw/zinc/24/49/91/185244991.db2.gz	DOPVCOXSXSUMMO-UHFFFAOYSA-N	0	3	304.415	2.464	10	0		DEAEHN
CCOC(=O)[C@](C)(N)C[C@H](C)N1CCC[C@H](C(F)(F)F)C1	ZINC000088435076	185250060	/nfs/dbraw/zinc/25/00/60/185250060.db2.gz	DSQSXZXKTGTEEA-GMXVVIOVSA-N	0	3	310.360	2.320	10	0		DEAEHN
CCOC(=O)[C@@](C)(N)C[C@@H](C)N1CCC(C(F)(F)F)CC1	ZINC000088435422	185250361	/nfs/dbraw/zinc/25/03/61/185250361.db2.gz	PZGGVLMNQIUUBC-MFKMUULPSA-N	0	3	310.360	2.320	10	0		DEAEHN
CSC[C@@H](C)CNS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000088551154	185257495	/nfs/dbraw/zinc/25/74/95/185257495.db2.gz	NJASQZFPCJTXFU-NSHDSACASA-N	0	3	320.480	2.055	10	0		DEAEHN
CSC[C@@H](C)C[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000088551154	185257496	/nfs/dbraw/zinc/25/74/96/185257496.db2.gz	NJASQZFPCJTXFU-NSHDSACASA-N	0	3	320.480	2.055	10	0		DEAEHN
C[C@H]([N-]S(=O)(=O)c1ccc(C[NH2+]C(C)(C)C)o1)C1CC1	ZINC000088542323	185256212	/nfs/dbraw/zinc/25/62/12/185256212.db2.gz	HMBAXQOZQVXUQZ-JTQLQIEISA-N	0	3	300.424	2.245	10	0		DEAEHN
CCN[C@@H](c1ccc(C)cc1)[C@@H](C)S(=O)(=O)CCCOC	ZINC000081986149	192348828	/nfs/dbraw/zinc/34/88/28/192348828.db2.gz	NKAXFHLFHCLJNL-GDBMZVCRSA-N	0	3	313.463	2.485	10	0		DEAEHN
CC(C)[C@H]1CCCN1CC(=O)Nc1ccccc1C(N)=S	ZINC000088836966	185266890	/nfs/dbraw/zinc/26/68/90/185266890.db2.gz	XHOPBKGEULXBPC-CQSZACIVSA-N	0	3	305.447	2.380	10	0		DEAEHN
CCCN[C@H](CS(=O)(=O)CCCOC)c1ccc(C)cc1	ZINC000081985823	192349490	/nfs/dbraw/zinc/34/94/90/192349490.db2.gz	NRHLTUZWJSWXQC-MRXNPFEDSA-N	0	3	313.463	2.487	10	0		DEAEHN
CC[C@@H](NC[C@@](C)(O)CO)c1ccc(Br)cc1	ZINC000090284257	185289458	/nfs/dbraw/zinc/28/94/58/185289458.db2.gz	YARJWJNPZNEAKJ-CHWSQXEVSA-N	0	3	302.212	2.233	10	0		DEAEHN
N[C@H]1COC[C@H]1C(=O)Nc1ccccc1SCC(F)(F)F	ZINC000090380236	185293559	/nfs/dbraw/zinc/29/35/59/185293559.db2.gz	KGWLQTZXUIXIEL-BDAKNGLRSA-N	0	3	320.336	2.253	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1c1nc(Cc2c(F)cccc2Cl)no1	ZINC000090423960	185295525	/nfs/dbraw/zinc/29/55/25/185295525.db2.gz	PLTGEBPKYZERTP-JOYOIKCWSA-N	0	3	311.744	2.155	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1ccccc1SC(F)(F)F	ZINC000090432892	185296254	/nfs/dbraw/zinc/29/62/54/185296254.db2.gz	XOEDFDGKEVFALQ-PSASIEDQSA-N	0	3	320.336	2.471	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1ccc(C)c(C(F)(F)F)c1	ZINC000090436989	185296268	/nfs/dbraw/zinc/29/62/68/185296268.db2.gz	LWNHPBYDXFAOQU-PWSUYJOCSA-N	0	3	302.296	2.187	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1ccc(C)c(C(F)(F)F)c1	ZINC000090436992	185296308	/nfs/dbraw/zinc/29/63/08/185296308.db2.gz	LWNHPBYDXFAOQU-CMPLNLGQSA-N	0	3	302.296	2.187	10	0		DEAEHN
Cc1cc(Br)ccc1NC(=O)[C@@]1(C)COC[C@@H]1N	ZINC000090580357	185304967	/nfs/dbraw/zinc/30/49/67/185304967.db2.gz	SUWDLYOSKDVZDN-AAEUAGOBSA-N	0	3	313.195	2.060	10	0		DEAEHN
Cc1ccc(NC(=O)[C@]2(C)COC[C@@H]2N)cc1C(F)(F)F	ZINC000090601191	185306199	/nfs/dbraw/zinc/30/61/99/185306199.db2.gz	IKOCEQNUWKHGEL-WCQYABFASA-N	0	3	302.296	2.316	10	0		DEAEHN
CCn1c2ccc(Br)cc2nc1[C@@]1(C)COC[C@@H]1N	ZINC000090571761	185304475	/nfs/dbraw/zinc/30/44/75/185304475.db2.gz	SXEJPMZIKOSAKY-JSGCOSHPSA-N	0	3	324.222	2.434	10	0		DEAEHN
CC(C)[C@H](CO)NCc1cc2c(c(Br)c1)OCO2	ZINC000092392223	185315666	/nfs/dbraw/zinc/31/56/66/185315666.db2.gz	RNVJCNCNGMNOQM-NSHDSACASA-N	0	3	316.195	2.284	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(Cl)nc(NC)c1	ZINC000092674424	185333171	/nfs/dbraw/zinc/33/31/71/185333171.db2.gz	KKTRYBWJVZYLNH-LBPRGKRZSA-N	0	3	310.829	2.333	10	0		DEAEHN
Cn1cc(CN2CCN3CCCC[C@@H]3C2)c(-c2ccncc2)n1	ZINC000092616204	185329101	/nfs/dbraw/zinc/32/91/01/185329101.db2.gz	BUMGPZPLJMNECU-QGZVFWFLSA-N	0	3	311.433	2.152	10	0		DEAEHN
C[C@@H](CCN1CCN(C)CC1)NC(=O)C(C)(C)c1cccs1	ZINC000184316208	282252106	/nfs/dbraw/zinc/25/21/06/282252106.db2.gz	FVPNGBJXTPBGDJ-AWEZNQCLSA-N	0	3	323.506	2.168	10	0		DEAEHN
COCCNCc1cc2ccccc2nc1SC1COC1	ZINC000092712424	185335724	/nfs/dbraw/zinc/33/57/24/185335724.db2.gz	RNPPCMWTHBPRGK-UHFFFAOYSA-N	0	3	304.415	2.462	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2cnc3ccccn23)C12CCOCC2	ZINC000185663335	282264281	/nfs/dbraw/zinc/26/42/81/282264281.db2.gz	NKCGHIYWHBMHIR-JKSUJKDBSA-N	0	3	315.417	2.398	10	0		DEAEHN
COC(=O)CNC(=O)[C@@H](C)N[C@H](C)c1ccc(CC(C)C)cc1	ZINC000181406342	199291574	/nfs/dbraw/zinc/29/15/74/199291574.db2.gz	BPABCLFDQSBSEG-ZIAGYGMSSA-N	0	3	320.433	2.213	10	0		DEAEHN
COC(=O)CNC(=O)[C@H](C)N[C@@H](C)c1ccc2ccccc2c1	ZINC000181494970	199306431	/nfs/dbraw/zinc/30/64/31/199306431.db2.gz	PFGULCOGDLCTDE-STQMWFEESA-N	0	3	314.385	2.168	10	0		DEAEHN
CCCNC(=O)c1cccc(N2CCN[C@@H](c3ccccc3)C2)n1	ZINC000065256208	539344567	/nfs/dbraw/zinc/34/45/67/539344567.db2.gz	GMUNUKBPUXVCEJ-QGZVFWFLSA-N	0	3	324.428	2.372	10	0		DEAEHN
Clc1cc(Br)ccc1OC[C@@H]1CNCCO1	ZINC000070834125	539345364	/nfs/dbraw/zinc/34/53/64/539345364.db2.gz	XTCNDLPNAOWWQE-VIFPVBQESA-N	0	3	306.587	2.470	10	0		DEAEHN
C[C@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(CN)c1	ZINC000020546026	190646502	/nfs/dbraw/zinc/64/65/02/190646502.db2.gz	CQJWEYDYVYCYAD-LBPRGKRZSA-N	0	3	302.399	2.285	10	0		DEAEHN
CN1C[C@H](NCc2cccc(Br)c2F)CCC1=O	ZINC000294927624	529829609	/nfs/dbraw/zinc/82/96/09/529829609.db2.gz	BACBQSSTVSBDLO-SNVBAGLBSA-N	0	3	315.186	2.299	10	0		DEAEHN
CN(C)c1ccncc1C(=O)N1CCCN(C2CCCC2)CC1	ZINC000183691324	282306883	/nfs/dbraw/zinc/30/68/83/282306883.db2.gz	RFAWQAJUUOHTEX-UHFFFAOYSA-N	0	3	316.449	2.238	10	0		DEAEHN
CCOc1c(Cl)cccc1CC(=O)NC[C@@H]1CCCN1C	ZINC000191715365	282334611	/nfs/dbraw/zinc/33/46/11/282334611.db2.gz	DRRRBWSMMHTFNQ-ZDUSSCGKSA-N	0	3	310.825	2.492	10	0		DEAEHN
c1n[nH]cc1CN1CCN(C[C@@H]2CCc3ccccc3C2)CC1	ZINC000625475246	365802015	/nfs/dbraw/zinc/80/20/15/365802015.db2.gz	ZKBPHCNBQUTYAL-MRXNPFEDSA-N	0	3	310.445	2.332	10	0		DEAEHN
CCN(CCNC(=O)NC[C@@H]1CCCN1C)c1cccc(C)c1	ZINC000195122473	282368550	/nfs/dbraw/zinc/36/85/50/282368550.db2.gz	YMUNDBYDWNQJEQ-KRWDZBQOSA-N	0	3	318.465	2.215	10	0		DEAEHN
CCc1nc(CNC(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)cs1	ZINC000125405329	539472880	/nfs/dbraw/zinc/47/28/80/539472880.db2.gz	CXPMJHAFKAEJBS-GHMZBOCLSA-N	0	3	308.451	2.130	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)CCc2nc(C3CCCC3)no2)C1	ZINC000136742989	539518545	/nfs/dbraw/zinc/51/85/45/539518545.db2.gz	WQELVCJRNVJPPZ-AWEZNQCLSA-N	0	3	320.437	2.260	10	0		DEAEHN
COc1ccc(N)cc1NC(=O)CCN1CCSC[C@H]1C	ZINC000070219166	190873304	/nfs/dbraw/zinc/87/33/04/190873304.db2.gz	LHCNKVVFZZEJHH-LLVKDONJSA-N	0	3	309.435	2.043	10	0		DEAEHN
CCN1C(=O)C[C@@H](N)[C@H]1c1ccc(OC)c(Br)c1	ZINC000070293051	190877296	/nfs/dbraw/zinc/87/72/96/190877296.db2.gz	JHBWUZVUJCEITA-ZWNOBZJWSA-N	0	3	313.195	2.078	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCNC[C@@H]1c1cccc(F)c1	ZINC000616637199	362901902	/nfs/dbraw/zinc/90/19/02/362901902.db2.gz	SLOUDSGFPFOVKY-OAHLLOKOSA-N	0	3	323.412	2.297	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCN[C@H](c2cccc(F)c2)C1	ZINC000616634523	362901926	/nfs/dbraw/zinc/90/19/26/362901926.db2.gz	UTUJGMGQEVKHGX-HNNXBMFYSA-N	0	3	323.412	2.297	10	0		DEAEHN
CN(C)CCN(C)C(=O)COc1ccc(Cl)c2cccnc12	ZINC000080388464	192154160	/nfs/dbraw/zinc/15/41/60/192154160.db2.gz	VNPJYHFLAJHTHK-UHFFFAOYSA-N	0	3	321.808	2.287	10	0		DEAEHN
CCCN[C@H](C[S@](=O)CCOC)c1cc(C)ccc1OC	ZINC000084036271	192396136	/nfs/dbraw/zinc/39/61/36/192396136.db2.gz	GMGWRWOTMQSXRY-VFNWGFHPSA-N	0	3	313.463	2.439	10	0		DEAEHN
CCOc1ccc([C@@H](C[S@@](=O)C2CCOCC2)NC)cc1	ZINC000084054945	192397609	/nfs/dbraw/zinc/39/76/09/192397609.db2.gz	DHKPGLDBMXVFOK-IERDGZPVSA-N	0	3	311.447	2.274	10	0		DEAEHN
CCOc1ccc2[nH]c(CN(C)C3CCN(C)CC3)nc2c1	ZINC000071675478	191005357	/nfs/dbraw/zinc/00/53/57/191005357.db2.gz	FFHWELACNJNQKF-UHFFFAOYSA-N	0	3	302.422	2.488	10	0		DEAEHN
CCNCc1cc(F)c(F)c(S(=O)(=O)N(CC)CC)c1	ZINC000138254690	186015706	/nfs/dbraw/zinc/01/57/06/186015706.db2.gz	ITTZUNXWECDRMT-UHFFFAOYSA-N	0	3	306.378	2.105	10	0		DEAEHN
C[C@@H](N(C)S(=O)(=O)c1cc(CN)cc(F)c1F)C(C)(C)C	ZINC000138829242	186019034	/nfs/dbraw/zinc/01/90/34/186019034.db2.gz	KZFGYZXXDFNJES-SECBINFHSA-N	0	3	320.405	2.479	10	0		DEAEHN
CC(C)N(CC1CC1)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138814497	186019048	/nfs/dbraw/zinc/01/90/48/186019048.db2.gz	XKRSEAOGBKSJRE-UHFFFAOYSA-N	0	3	318.389	2.233	10	0		DEAEHN
C[C@@H]1[C@@H](C)CCCN1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138931102	186019578	/nfs/dbraw/zinc/01/95/78/186019578.db2.gz	XZFZHMGBIQSZHC-VHSXEESVSA-N	0	3	318.389	2.233	10	0		DEAEHN
CN(C)CCn1ncc(Cl)c1[C@@H](O)[C@@]1(C)CCCS1	ZINC000140178881	186025950	/nfs/dbraw/zinc/02/59/50/186025950.db2.gz	AIYNQFQWSDKOCZ-CHWSQXEVSA-N	0	3	303.859	2.417	10	0		DEAEHN
CN[C@@H](Cc1cccnc1N)c1ccc(Br)cn1	ZINC000140221266	186025970	/nfs/dbraw/zinc/02/59/70/186025970.db2.gz	OYTKLONYVAIRLN-LBPRGKRZSA-N	0	3	307.195	2.325	10	0		DEAEHN
O[C@]12CCCC[C@@H]1CN(Cc1ccc(-n3ccnc3)nc1)CC2	ZINC000140544698	186027168	/nfs/dbraw/zinc/02/71/68/186027168.db2.gz	RCMJQSZYPGNLDI-AEFFLSMTSA-N	0	3	312.417	2.394	10	0		DEAEHN
CCC(C)(C)N(C)[C@@]1(CN)CCS(=O)(=O)c2ccccc21	ZINC000147658000	186040537	/nfs/dbraw/zinc/04/05/37/186040537.db2.gz	ROQSZTAPEQRHDY-MRXNPFEDSA-N	0	3	310.463	2.138	10	0		DEAEHN
CCc1ccc([C@H](C)NC[C@H](O)COC[C@H]2CCCO2)cc1	ZINC000248498435	539774244	/nfs/dbraw/zinc/77/42/44/539774244.db2.gz	NWQCUBJYSTZQGE-JCGIZDLHSA-N	0	3	307.434	2.456	10	0		DEAEHN
Cc1cnc(NN)nc1OCc1ccc(Br)cc1	ZINC000147817716	186041931	/nfs/dbraw/zinc/04/19/31/186041931.db2.gz	RQYZXISVMLHBEB-UHFFFAOYSA-N	0	3	309.167	2.412	10	0		DEAEHN
O=C1N(CCN2CCCCC2)[C@H](c2ccsc2)NC12CC2	ZINC000144042891	186034398	/nfs/dbraw/zinc/03/43/98/186034398.db2.gz	XSUCEMUSLGZVSQ-CQSZACIVSA-N	0	3	305.447	2.197	10	0		DEAEHN
CN1CCCC[C@@H]1CN1C(=O)C2(CC2)N[C@H]1c1cccs1	ZINC000144370057	186034809	/nfs/dbraw/zinc/03/48/09/186034809.db2.gz	VSJBHIXGRMIAGV-TZMCWYRMSA-N	0	3	305.447	2.195	10	0		DEAEHN
CC(C)[C@H](CN(C)C)N1C(=O)C2(CC2)N[C@@H]1c1ccsc1	ZINC000145035678	186036322	/nfs/dbraw/zinc/03/63/22/186036322.db2.gz	FGMZJLZRFHTVOP-KBPBESRZSA-N	0	3	307.463	2.297	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@@H](C)C(=O)N2[C@@H](C)CN2CCCC2)s1	ZINC000145805386	186037880	/nfs/dbraw/zinc/03/78/80/186037880.db2.gz	NOJTZRQTHZJCAX-CORIIIEPSA-N	0	3	307.463	2.360	10	0		DEAEHN
C[C@H](c1cccc(Cl)c1)N(C)c1nc(N)nc(N(C)C)n1	ZINC000149601214	186051657	/nfs/dbraw/zinc/05/16/57/186051657.db2.gz	DOWVYPRXUBPKLO-SECBINFHSA-N	0	3	306.801	2.371	10	0		DEAEHN
CNCc1cc(S(=O)(=O)NCCCC(F)(F)F)cs1	ZINC000149982644	186054175	/nfs/dbraw/zinc/05/41/75/186054175.db2.gz	HGDNJQJZODBRRO-UHFFFAOYSA-N	0	3	316.370	2.088	10	0		DEAEHN
N[C@@H](Cc1csc([C@@H]2CCS(=O)(=O)C2)n1)c1ccccc1	ZINC000150260643	186056016	/nfs/dbraw/zinc/05/60/16/186056016.db2.gz	WPBIBYVLRYNNCF-OCCSQVGLSA-N	0	3	322.455	2.288	10	0		DEAEHN
C[C@H](Cc1cccs1)Nc1nc(N)nc(N2CCCC2)n1	ZINC000150237150	186056173	/nfs/dbraw/zinc/05/61/73/186056173.db2.gz	MKHAKOUQVRZONU-SNVBAGLBSA-N	0	3	304.423	2.159	10	0		DEAEHN
CC(C)Cc1ccc([C@H](NCC(=O)NC(N)=O)C2CC2)cc1	ZINC000152628576	186091109	/nfs/dbraw/zinc/09/11/09/186091109.db2.gz	RTTVTTRBLNCXGJ-INIZCTEOSA-N	0	3	303.406	2.121	10	0		DEAEHN
COC(=O)c1[nH]c(C)c(C(=O)N[C@@H](CC(C)C)CN(C)C)c1C	ZINC000155756561	186109713	/nfs/dbraw/zinc/10/97/13/186109713.db2.gz	FODUSZPFOACUED-ZDUSSCGKSA-N	0	3	323.437	2.124	10	0		DEAEHN
CC(C(=O)N[C@@H](C)Cc1ccc(Br)cc1)=C1CNC1	ZINC000164001632	186145513	/nfs/dbraw/zinc/14/55/13/186145513.db2.gz	RYBRNGUNIBOPQC-JTQLQIEISA-N	0	3	323.234	2.416	10	0		DEAEHN
O=C(Nc1ccc(C(F)(F)F)cc1)OC[C@@H]1CNCCO1	ZINC000164143577	186149678	/nfs/dbraw/zinc/14/96/78/186149678.db2.gz	PXRREYOVTWNMEE-NSHDSACASA-N	0	3	304.268	2.242	10	0		DEAEHN
CCN1CCN(c2ccc(C(F)(F)F)c(C(N)=S)c2)CC1	ZINC000164144911	186149824	/nfs/dbraw/zinc/14/98/24/186149824.db2.gz	KYFAXGGGQFKDHZ-UHFFFAOYSA-N	0	3	317.380	2.482	10	0		DEAEHN
COCC[C@@H](N)C(=O)Nc1c(C)cc(C)cc1Br	ZINC000159673554	186134558	/nfs/dbraw/zinc/13/45/58/186134558.db2.gz	CDEDHLDUEPFKKG-LLVKDONJSA-N	0	3	315.211	2.368	10	0		DEAEHN
COCCCN(C)CCNC(=O)Nc1ccc2oc(C)nc2c1	ZINC000175735929	186191634	/nfs/dbraw/zinc/19/16/34/186191634.db2.gz	DQZPRWJBISZLNX-UHFFFAOYSA-N	0	3	320.393	2.226	10	0		DEAEHN
CC(=O)c1ccc(CC(=O)NC[C@@H]2CCN2C(C)(C)C)cc1	ZINC000617017663	363001040	/nfs/dbraw/zinc/00/10/40/363001040.db2.gz	ZVIYBLYTBSMRBW-INIZCTEOSA-N	0	3	302.418	2.421	10	0		DEAEHN
COc1cccc(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000173188290	198193438	/nfs/dbraw/zinc/19/34/38/198193438.db2.gz	IBPFTBGWEVHBRF-ZFWWWQNUSA-N	0	3	305.422	2.319	10	0		DEAEHN
O=C(NCc1ccccc1Cl)N1CC[C@@H](N2CC=CC2)C1	ZINC000173226935	198197943	/nfs/dbraw/zinc/19/79/43/198197943.db2.gz	OVUVDBDLMZSVAM-CQSZACIVSA-N	0	3	305.809	2.496	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCCCNc2ccccn2)CCN1C	ZINC000173955075	198272907	/nfs/dbraw/zinc/27/29/07/198272907.db2.gz	HHFWIJJOOFECOF-HUUCEWRRSA-N	0	3	319.453	2.008	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCOC[C@H]1CC(C)C	ZINC000073203323	191291584	/nfs/dbraw/zinc/29/15/84/191291584.db2.gz	RNXFTCPGLMTBHC-JKSUJKDBSA-N	0	3	313.486	2.419	10	0		DEAEHN
CO[C@H](CNC(=O)c1ccccc1OCCN(C)C)C(C)(C)C	ZINC000073211137	191292411	/nfs/dbraw/zinc/29/24/11/191292411.db2.gz	BRZHNVDMAZTWJF-MRXNPFEDSA-N	0	3	322.449	2.418	10	0		DEAEHN
C[C@@H](CN(C)C)NC(=O)N1CC2(CCOCC2)c2ccccc21	ZINC000358503346	295882222	/nfs/dbraw/zinc/88/22/22/295882222.db2.gz	QCUJCHFOADZMGD-AWEZNQCLSA-N	0	3	317.433	2.215	10	0		DEAEHN
CN1CC[C@@H](NC(=O)CC2(O)CCCC2)[C@H]1c1ccccc1	ZINC000247981935	283047526	/nfs/dbraw/zinc/04/75/26/283047526.db2.gz	HOXYCRAIWHTRLL-NVXWUHKLSA-N	0	3	302.418	2.243	10	0		DEAEHN
COc1ccc(NC(=O)NC(=O)CN2CCCC23CCC3)cc1	ZINC000373100185	540116606	/nfs/dbraw/zinc/11/66/06/540116606.db2.gz	QPSMSYWFZVGVBO-UHFFFAOYSA-N	0	3	317.389	2.362	10	0		DEAEHN
COC(=O)c1cc(Br)ccc1OCCN(C)C	ZINC000073711429	191346993	/nfs/dbraw/zinc/34/69/93/191346993.db2.gz	BNECDBZHABJHCV-UHFFFAOYSA-N	0	3	302.168	2.176	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCC(C)(C)C[C@H](C)O	ZINC000073722213	191347392	/nfs/dbraw/zinc/34/73/92/191347392.db2.gz	ZSNABQNWBJRWEL-KBPBESRZSA-N	0	3	301.475	2.059	10	0		DEAEHN
C[C@H](CNC(=O)N[C@H](C)c1ccc2c(c1)OCO2)N(C)C1CC1	ZINC000105100121	355719876	/nfs/dbraw/zinc/71/98/76/355719876.db2.gz	XBPZVQBMDBKGLK-VXGBXAGGSA-N	0	3	319.405	2.258	10	0		DEAEHN
COCc1ccc(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)o1	ZINC000132202308	355851218	/nfs/dbraw/zinc/85/12/18/355851218.db2.gz	JJTRRRKSBAJYDY-HNNXBMFYSA-N	0	3	316.401	2.329	10	0		DEAEHN
CCN(CCNC(=O)N1CC[C@H](N(C)C)C1)c1cccc(C)c1	ZINC000170863155	355994335	/nfs/dbraw/zinc/99/43/35/355994335.db2.gz	LHWUOOCGCUBCNE-KRWDZBQOSA-N	0	3	318.465	2.167	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)CN[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000182032230	356105867	/nfs/dbraw/zinc/10/58/67/356105867.db2.gz	ICCOIINIWKHVET-UONOGXRCSA-N	0	3	315.421	2.079	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)C[C@@H](C)c2nccs2)C1	ZINC000182857840	356149324	/nfs/dbraw/zinc/14/93/24/356149324.db2.gz	JSQOHDSOZMXNOT-CHWSQXEVSA-N	0	3	310.467	2.372	10	0		DEAEHN
C[C@@H](NC(=O)N(C)CCN(C)C1CC1)c1ccc2c(c1)OCO2	ZINC000185104448	356201311	/nfs/dbraw/zinc/20/13/11/356201311.db2.gz	GFFHTKCBCZMISK-GFCCVEGCSA-N	0	3	319.405	2.212	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@H](C)NC(=O)CC2CCCCC2)C1	ZINC000195183563	356250844	/nfs/dbraw/zinc/25/08/44/356250844.db2.gz	IDTMJJLBBUEYRK-ZBFHGGJFSA-N	0	3	323.481	2.062	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2cc(F)cc(F)c2)C1	ZINC000194557455	356241306	/nfs/dbraw/zinc/24/13/06/356241306.db2.gz	COPHQTVAVCSMOE-HNNXBMFYSA-N	0	3	311.376	2.291	10	0		DEAEHN
CCC[C@@H](C)CN1CCC(S(=O)(=O)N2CCCC2)CC1	ZINC000374359805	535326375	/nfs/dbraw/zinc/32/63/75/535326375.db2.gz	LXVODOIWSIKIMZ-CQSZACIVSA-N	0	3	302.484	2.313	10	0		DEAEHN
CCCN[C@H](c1cc(F)ccc1OC)[C@@H]1CCS(=O)(=O)C1	ZINC000086021641	192544267	/nfs/dbraw/zinc/54/42/67/192544267.db2.gz	VENBRDGZMFGROL-ABAIWWIYSA-N	0	3	315.410	2.310	10	0		DEAEHN
COC[C@](C)(O)CNCc1ccc(Br)c(F)c1	ZINC000382537732	356676390	/nfs/dbraw/zinc/67/63/90/356676390.db2.gz	CCICONHFMQQHSO-GFCCVEGCSA-N	0	3	306.175	2.075	10	0		DEAEHN
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CSC2(C)C)c1	ZINC000578642549	356849945	/nfs/dbraw/zinc/84/99/45/356849945.db2.gz	PUDXGCMIIOCILF-UKRRQHHQSA-N	0	3	309.431	2.113	10	0		DEAEHN
Cc1noc(CCN[C@@H](C)c2cncc(Br)c2)n1	ZINC000581083604	357128816	/nfs/dbraw/zinc/12/88/16/357128816.db2.gz	VNBPQWGGYKKEGD-QMMMGPOBSA-N	0	3	311.183	2.429	10	0		DEAEHN
C[C@H](NC(=O)CN1CCN2CCC[C@@H]2C1)c1ccc(Cl)cc1	ZINC000178619568	198897723	/nfs/dbraw/zinc/89/77/23/198897723.db2.gz	XMEFICWUWBLAFF-XJKSGUPXSA-N	0	3	321.852	2.297	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCc2ccccn2)[C@@H]1c1ccccc1	ZINC000179274566	199008427	/nfs/dbraw/zinc/00/84/27/199008427.db2.gz	QIELEZYDGIIWDJ-SJORKVTESA-N	0	3	310.401	2.326	10	0		DEAEHN
c1[nH]nc2cc(CN3CCC(Nc4cccnn4)CC3)ccc12	ZINC000179497555	199045409	/nfs/dbraw/zinc/04/54/09/199045409.db2.gz	ONAIOFAEPYDKSP-UHFFFAOYSA-N	0	3	308.389	2.429	10	0		DEAEHN
CCC[C@@H](CN1CC[C@H](NS(C)(=O)=O)C1)c1ccccc1	ZINC000180334586	199147522	/nfs/dbraw/zinc/14/75/22/199147522.db2.gz	BNXJOHQOLBWNPG-HOTGVXAUSA-N	0	3	310.463	2.194	10	0		DEAEHN
C[C@H](N[C@@H]1CCc2ncnn2C1)c1ccc(-n2ccnc2)cc1	ZINC000180590624	199180429	/nfs/dbraw/zinc/18/04/29/199180429.db2.gz	STLHUCOQJXIMOD-DZGCQCFKSA-N	0	3	308.389	2.129	10	0		DEAEHN
CCCn1cc(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)cn1	ZINC000180751328	199204312	/nfs/dbraw/zinc/20/43/12/199204312.db2.gz	UQEHSRSYIFWBNL-KRWDZBQOSA-N	0	3	314.433	2.196	10	0		DEAEHN
Cc1ccc2ncnc(N3CCN(CC(C)(C)O)[C@H](C)C3)c2c1	ZINC000186812311	200015255	/nfs/dbraw/zinc/01/52/55/200015255.db2.gz	TYGSKZROYKVXDI-CQSZACIVSA-N	0	3	314.433	2.220	10	0		DEAEHN
CC[C@@H](CO)N1CCN(Cc2ccc3nc(C)ccc3c2)CC1	ZINC000187386281	200105383	/nfs/dbraw/zinc/10/53/83/200105383.db2.gz	IROKIMYRHVDNSK-SFHVURJKSA-N	0	3	313.445	2.432	10	0		DEAEHN
Cc1nccnc1[C@@H](C)NC1CCN(Cc2ccncc2)CC1	ZINC000187795942	200157594	/nfs/dbraw/zinc/15/75/94/200157594.db2.gz	DXBDMFAUKWNXHS-OAHLLOKOSA-N	0	3	311.433	2.495	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)CC(=O)N(C)Cc2ccc(F)cc2)C1	ZINC000187923925	200177538	/nfs/dbraw/zinc/17/75/38/200177538.db2.gz	FRTGOALJEYEQDQ-KDOFPFPSSA-N	0	3	322.424	2.267	10	0		DEAEHN
C[C@H]1CC[C@](CO)(N(C)CC(=O)N(C)Cc2ccc(F)cc2)C1	ZINC000187923949	200177595	/nfs/dbraw/zinc/17/75/95/200177595.db2.gz	FRTGOALJEYEQDQ-KSSFIOAISA-N	0	3	322.424	2.267	10	0		DEAEHN
COC(=O)CCCCC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000188965212	200328047	/nfs/dbraw/zinc/32/80/47/200328047.db2.gz	QLVIGIIABPHVMA-QAPCUYQASA-N	0	3	318.417	2.281	10	0		DEAEHN
COc1ccc(F)cc1CNC1CCN(C(=O)N(C)C)CC1	ZINC000189202925	200363566	/nfs/dbraw/zinc/36/35/66/200363566.db2.gz	WLIMURNMYQSNHL-UHFFFAOYSA-N	0	3	309.385	2.070	10	0		DEAEHN
Cn1cc(-c2cc(CN3CCC([C@@H]4CCCO4)CC3)on2)cn1	ZINC000189217552	200365616	/nfs/dbraw/zinc/36/56/16/200365616.db2.gz	KOBWBWISXULGLO-KRWDZBQOSA-N	0	3	316.405	2.466	10	0		DEAEHN
CCOC[C@@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)C(C)C	ZINC000189363986	200387501	/nfs/dbraw/zinc/38/75/01/200387501.db2.gz	AFNRKVSPOYBUBP-IUODEOHRSA-N	0	3	314.451	2.046	10	0		DEAEHN
CCSCC[C@@H](C)NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000602457887	360382920	/nfs/dbraw/zinc/38/29/20/360382920.db2.gz	JIRGVGRCMSDVPQ-GDBMZVCRSA-N	0	3	323.506	2.094	10	0		DEAEHN
O=C(Nc1ccc2nccn2c1)N1CCN(C2CCCC2)CC1	ZINC000606582222	361022828	/nfs/dbraw/zinc/02/28/28/361022828.db2.gz	HMCUWAQBLZOPGL-UHFFFAOYSA-N	0	3	313.405	2.426	10	0		DEAEHN
Cc1ncc(CNC(=O)NCCN2CCCC(C)(C)C2)s1	ZINC000444980156	238378124	/nfs/dbraw/zinc/37/81/24/238378124.db2.gz	AYCZAXXTIIKWNZ-UHFFFAOYSA-N	0	3	310.467	2.373	10	0		DEAEHN
CN(C(=O)c1ccc2c(c1)NC(=O)C2(C)C)C1CCN(C)CC1	ZINC000292816328	223258712	/nfs/dbraw/zinc/25/87/12/223258712.db2.gz	XORGCHILPXCLIW-UHFFFAOYSA-N	0	3	315.417	2.083	10	0		DEAEHN
COC(=O)[C@@H](C1CC1)N1CC[C@H](N(C)Cc2ccccc2)C1	ZINC000611668756	361655211	/nfs/dbraw/zinc/65/52/11/361655211.db2.gz	QQOQFPALOBGAGW-DLBZAZTESA-N	0	3	302.418	2.144	10	0		DEAEHN
COC(=O)c1ccc(C(=O)NC2CC(N3CCCCC3)C2)s1	ZINC000619451625	363799900	/nfs/dbraw/zinc/79/99/00/363799900.db2.gz	FLOTWCRUDCUWAH-UHFFFAOYSA-N	0	3	322.430	2.281	10	0		DEAEHN
CCOC(=O)c1cc(CNCCc2cccc(OC)n2)[nH]c1C	ZINC000449193667	240169908	/nfs/dbraw/zinc/16/99/08/240169908.db2.gz	WLVNOUDAGNVDEO-UHFFFAOYSA-N	0	3	317.389	2.236	10	0		DEAEHN
c1ncn(-c2ccc(CNC[C@@H]3Cc4ccccc4CO3)cc2)n1	ZINC000623601966	365096268	/nfs/dbraw/zinc/09/62/68/365096268.db2.gz	XRTJROKEOJJBBH-IBGZPJMESA-N	0	3	320.396	2.498	10	0		DEAEHN
COc1ccccc1[C@@H](C)N(C)C(=O)C[C@H]1CSCCN1	ZINC000091136087	193000960	/nfs/dbraw/zinc/00/09/60/193000960.db2.gz	WUCUPCYSYPIWGI-OLZOCXBDSA-N	0	3	308.447	2.310	10	0		DEAEHN
CN(C(=O)NCC1CCN(c2ccncc2)CC1)C1CCC1	ZINC000091233209	193024655	/nfs/dbraw/zinc/02/46/55/193024655.db2.gz	XZHICHZHPQQISG-UHFFFAOYSA-N	0	3	302.422	2.492	10	0		DEAEHN
COc1cc(CNC2CC(O)C2)cc(Br)c1OC	ZINC000091430517	193054718	/nfs/dbraw/zinc/05/47/18/193054718.db2.gz	VYDHCJSMEIGQMO-UHFFFAOYSA-N	0	3	316.195	2.079	10	0		DEAEHN
Cc1cc([C@H](N)[C@H]2CCS(=O)(=O)C2)ccc1Br	ZINC000091474289	193061073	/nfs/dbraw/zinc/06/10/73/193061073.db2.gz	GHIDKBRZSYKJKC-JQWIXIFHSA-N	0	3	318.236	2.192	10	0		DEAEHN
C[C@@H]1CC[C@@H]([N-]S(=O)(=O)c2c(Cl)cccc2Cl)C[NH2+]1	ZINC000624407016	365413464	/nfs/dbraw/zinc/41/34/64/365413464.db2.gz	RGSYOJGKTRSFGD-RKDXNWHRSA-N	0	3	323.245	2.412	10	0		DEAEHN
CCOC[C@@H](C)NCc1cnc2cnc(Br)cn12	ZINC000092049816	193147920	/nfs/dbraw/zinc/14/79/20/193147920.db2.gz	SGRNDWDOIHSVLF-SECBINFHSA-N	0	3	313.199	2.006	10	0		DEAEHN
C[C@H](N[C@@H]1CCC(=O)N[C@@H]1C1CC1)C(=O)N1C[C@H](C)C[C@H](C)C1	ZINC000328861357	299363094	/nfs/dbraw/zinc/36/30/94/299363094.db2.gz	ARWLBJJDZYVCNF-BFTSITSZSA-N	0	3	321.465	2.367	10	0		DEAEHN
CNCc1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)c1	ZINC000092113520	193161034	/nfs/dbraw/zinc/16/10/34/193161034.db2.gz	XIRHDGPGQNHHOD-QWRGUYRKSA-N	0	3	316.854	2.336	10	0		DEAEHN
CNCc1cc(F)c(C)c(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)c1	ZINC000092113969	193161080	/nfs/dbraw/zinc/16/10/80/193161080.db2.gz	SZQBFOIMIMJARL-PHIMTYICSA-N	0	3	314.426	2.130	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCC[C@@H]2CC)c(F)c1	ZINC000092115745	193163296	/nfs/dbraw/zinc/16/32/96/193163296.db2.gz	TYKMQVXOBNJYKF-ZDUSSCGKSA-N	0	3	314.426	2.498	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@H](C)CC)c(F)c1	ZINC000092115797	193163487	/nfs/dbraw/zinc/16/34/87/193163487.db2.gz	VJELWCQPKSWSOQ-LLVKDONJSA-N	0	3	302.415	2.402	10	0		DEAEHN
CCCC[C@@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]C)cc1F	ZINC000092116055	193164398	/nfs/dbraw/zinc/16/43/98/193164398.db2.gz	PCPXYSFGCUHLNL-LLVKDONJSA-N	0	3	302.415	2.402	10	0		DEAEHN
c1c(CNC[C@@H]2CCC[C@@H]2C2CC2)nnn1C[C@H]1CCOC1	ZINC000631162432	368053539	/nfs/dbraw/zinc/05/35/39/368053539.db2.gz	VYOJPBQABWJAKS-UKPHBRMFSA-N	0	3	304.438	2.231	10	0		DEAEHN
c1c(CNC[C@H]2C[C@@H]2c2ccccc2)nnn1C[C@H]1CCOC1	ZINC000631165572	368056857	/nfs/dbraw/zinc/05/68/57/368056857.db2.gz	NWKOKQDUKWNBHK-QGPMSJSTSA-N	0	3	312.417	2.208	10	0		DEAEHN
[O-]c1cccc(C[NH2+]CC[C@H](O)C(F)F)c1Br	ZINC000631216124	368085356	/nfs/dbraw/zinc/08/53/56/368085356.db2.gz	KGACUVFYZXQVKH-VIFPVBQESA-N	0	3	310.138	2.260	10	0		DEAEHN
CO[C@@H]1[C@H](C)[C@H](NCC(=O)Nc2ccc3c(c2)OCO3)C1(C)C	ZINC000451502440	243041783	/nfs/dbraw/zinc/04/17/83/243041783.db2.gz	PNUXXAMAXMINKR-HPEXNQPKSA-N	0	3	320.389	2.003	10	0		DEAEHN
CC(C)c1nc(N2CCN(CC(F)(F)F)CC2)sc1CN	ZINC000093000260	193192407	/nfs/dbraw/zinc/19/24/07/193192407.db2.gz	BKLFVUZOXGXHSM-UHFFFAOYSA-N	0	3	322.400	2.410	10	0		DEAEHN
COc1ccc(CN2CCCC[C@@H]2CN2CCOCC2)cc1	ZINC000093012068	193193109	/nfs/dbraw/zinc/19/31/09/193193109.db2.gz	KALHRPXHGSBXTQ-QGZVFWFLSA-N	0	3	304.434	2.382	10	0		DEAEHN
C[C@@H]1CN(CC(C)(C)O)CCN1c1nc2c(cccc2F)o1	ZINC000582157252	335012577	/nfs/dbraw/zinc/01/25/77/335012577.db2.gz	XPTXDGHGHDGIHF-LLVKDONJSA-N	0	3	307.369	2.248	10	0		DEAEHN
CC[C@H](C)CN(CC)S(=O)(=O)c1ccc(OC)c(CN)c1	ZINC000093265710	193222361	/nfs/dbraw/zinc/22/23/61/193222361.db2.gz	SHQIIRWFNCEAJH-LBPRGKRZSA-N	0	3	314.451	2.211	10	0		DEAEHN
CCN[C@@H](Cc1c(Cl)c(CC)nn1CC)C(OC)OC	ZINC000093305315	193227440	/nfs/dbraw/zinc/22/74/40/193227440.db2.gz	ZQZLUDNBUCQKSQ-NSHDSACASA-N	0	3	303.834	2.258	10	0		DEAEHN
CCCN[C@H](Cc1c(Cl)c(CC)nn1C)C(OC)OC	ZINC000093305490	193227676	/nfs/dbraw/zinc/22/76/76/193227676.db2.gz	ZIKXBKMSGMWFNP-LLVKDONJSA-N	0	3	303.834	2.166	10	0		DEAEHN
CCOC(OCC)[C@H](Cc1c(Cl)c(CC)nn1C)NC	ZINC000093306795	193228115	/nfs/dbraw/zinc/22/81/15/193228115.db2.gz	KEYQXKVOBCPKSL-NSHDSACASA-N	0	3	303.834	2.166	10	0		DEAEHN
CC(C)N[C@]1(C(N)=O)CC[C@H](N(CC(F)(F)F)C(C)C)C1	ZINC000093826238	193312700	/nfs/dbraw/zinc/31/27/00/193312700.db2.gz	RVVDAKLZZZFQGD-WCQYABFASA-N	0	3	309.376	2.034	10	0		DEAEHN
NC(=O)[C@@]1(N)CC[C@H](Sc2ccccc2Br)C1	ZINC000093849006	193317707	/nfs/dbraw/zinc/31/77/07/193317707.db2.gz	MYDLRLCXMAGURA-QPUJVOFHSA-N	0	3	315.236	2.277	10	0		DEAEHN
NCc1ccc(C(F)(F)F)nc1N1CCO[C@@H]2CCC[C@@H]21	ZINC000094334240	193360086	/nfs/dbraw/zinc/36/00/86/193360086.db2.gz	SZASFRRNBSNXEG-WDEREUQCSA-N	0	3	301.312	2.317	10	0		DEAEHN
CCCN[C@H](c1cnccn1)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094641834	193388789	/nfs/dbraw/zinc/38/87/89/193388789.db2.gz	NKAXDFXMYHNOKM-YDHLFZDLSA-N	0	3	311.451	2.121	10	0		DEAEHN
Cc1cc(C(=O)NC[C@H](C)N(C)C)sc1Br	ZINC000094494331	193373615	/nfs/dbraw/zinc/37/36/15/193373615.db2.gz	VXTNMSHGLVMGEU-QMMMGPOBSA-N	0	3	305.241	2.499	10	0		DEAEHN
C[C@H](CN1CCCC1)Nc1nc2ccc(Br)cn2n1	ZINC000094604218	193384262	/nfs/dbraw/zinc/38/42/62/193384262.db2.gz	BZBDOAZHHVRTSE-SNVBAGLBSA-N	0	3	324.226	2.388	10	0		DEAEHN
Cc1nn(C)c(C[C@H](N)c2cc(C)nnc2C)c1Br	ZINC000097278855	193703626	/nfs/dbraw/zinc/70/36/26/193703626.db2.gz	GPXODNMKUDZNSL-NSHDSACASA-N	0	3	324.226	2.140	10	0		DEAEHN
COC(=O)c1ccc(C(=O)NC2C[C@H]3CCC[C@@H](C2)N3C)s1	ZINC000266388669	205311347	/nfs/dbraw/zinc/31/13/47/205311347.db2.gz	VLBKCWSGUVNSEH-YOGCLGLASA-N	0	3	322.430	2.280	10	0		DEAEHN
CN1CCCN([C@@H](CN)c2ccc(Br)s2)CC1	ZINC000020217710	182198149	/nfs/dbraw/zinc/19/81/49/182198149.db2.gz	ZEGANCFQYMNZMZ-JTQLQIEISA-N	0	3	318.284	2.148	10	0		DEAEHN
NS(=O)(=O)c1ccc(CN[C@H]2CCc3ccccc32)cc1	ZINC000021007743	182259603	/nfs/dbraw/zinc/25/96/03/182259603.db2.gz	KVHHVADQDMVHGE-INIZCTEOSA-N	0	3	302.399	2.111	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1ccc(NC(=O)C2CC2)cc1	ZINC000267452356	206077674	/nfs/dbraw/zinc/07/76/74/206077674.db2.gz	FQCNBHORNPELGU-INIZCTEOSA-N	0	3	315.417	2.201	10	0		DEAEHN
CC(=O)c1cccc(O[C@@H](C)C(=O)N2CCC[C@@H]2CN(C)C)c1	ZINC000267504769	206112484	/nfs/dbraw/zinc/11/24/84/206112484.db2.gz	HCJCQKBRHCQDTJ-GOEBONIOSA-N	0	3	318.417	2.209	10	0		DEAEHN
CC[C@@H](C)NC(=O)CCNCc1cc2c(c(Cl)c1)OCO2	ZINC000038013949	182963648	/nfs/dbraw/zinc/96/36/48/182963648.db2.gz	XNNMALSAPIKDHB-SNVBAGLBSA-N	0	3	312.797	2.463	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2ccc(Cl)c3ncccc23)C1	ZINC000040633637	183111888	/nfs/dbraw/zinc/11/18/88/183111888.db2.gz	CLFBUXYQEIRTAH-ZANVPECISA-N	0	3	305.765	2.204	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2nc3ccc(Cl)cc3s2)C1	ZINC000040629932	183111143	/nfs/dbraw/zinc/11/11/43/183111143.db2.gz	GTHKXZBECWMHFH-WPRPVWTQSA-N	0	3	311.794	2.265	10	0		DEAEHN
OC[C@H](NC[C@@H]1CCCO1)c1ccc(Br)s1	ZINC000041703003	183218330	/nfs/dbraw/zinc/21/83/30/183218330.db2.gz	WVBWCCWHGDATHO-IUCAKERBSA-N	0	3	306.225	2.313	10	0		DEAEHN
CCc1nnc(COc2c(Br)cccc2CN)o1	ZINC000042411403	183265361	/nfs/dbraw/zinc/26/53/61/183265361.db2.gz	SVPCXVCLZYUGRT-UHFFFAOYSA-N	0	3	312.167	2.432	10	0		DEAEHN
CCNCc1cccc(Br)c1OC[C@H](C)C(N)=O	ZINC000042411670	183266267	/nfs/dbraw/zinc/26/62/67/183266267.db2.gz	ICTOBJOSMVYOFV-VIFPVBQESA-N	0	3	315.211	2.059	10	0		DEAEHN
COCCN(C)[C@@H](CN)c1ccc(OC)c(Br)c1	ZINC000042458584	183272620	/nfs/dbraw/zinc/27/26/20/183272620.db2.gz	PYYFHZMBGBTBCC-LBPRGKRZSA-N	0	3	317.227	2.036	10	0		DEAEHN
CCCN(CC(=O)NC)c1ccc(C(F)(F)F)cc1CN	ZINC000042403530	183264062	/nfs/dbraw/zinc/26/40/62/183264062.db2.gz	OAHZPAFDKRPNEL-UHFFFAOYSA-N	0	3	303.328	2.127	10	0		DEAEHN
CC(C)CN(CCN(C)C)Cc1ccc(C(N)=S)cc1F	ZINC000042766125	183306048	/nfs/dbraw/zinc/30/60/48/183306048.db2.gz	KKEBKAXJVVGGJM-UHFFFAOYSA-N	0	3	311.470	2.480	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccc(Cl)cc1)N(CC(N)=O)C1CCCC1	ZINC000042946609	183321064	/nfs/dbraw/zinc/32/10/64/183321064.db2.gz	WRUJCHVBHJWURL-BDJLRTHQSA-N	0	3	309.841	2.458	10	0		DEAEHN
Cc1cccc([C@H](CN)Oc2cccc(S(C)(=O)=O)c2)c1	ZINC000042969281	183324468	/nfs/dbraw/zinc/32/44/68/183324468.db2.gz	DDJIVHNBPBHCHJ-INIZCTEOSA-N	0	3	305.399	2.477	10	0		DEAEHN
CCCN[C@H](c1ccc(F)cc1F)[C@@H]1CCS(=O)(=O)C1	ZINC000043301237	183351917	/nfs/dbraw/zinc/35/19/17/183351917.db2.gz	MCAYHRALHRHKHE-YGRLFVJLSA-N	0	3	303.374	2.440	10	0		DEAEHN
CN[C@@H](c1ccccc1OC(F)(F)F)[C@H]1CCS(=O)(=O)C1	ZINC000043300632	183352466	/nfs/dbraw/zinc/35/24/66/183352466.db2.gz	BNFHYUBZMDNYNK-JOYOIKCWSA-N	0	3	323.336	2.280	10	0		DEAEHN
Cc1ccc([C@@H](Oc2cccc(S(C)(=O)=O)c2)[C@H](C)N)o1	ZINC000043366998	183357305	/nfs/dbraw/zinc/35/73/05/183357305.db2.gz	LTOFSEPSVKDLHS-NHYWBVRUSA-N	0	3	309.387	2.459	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000043066827	183333723	/nfs/dbraw/zinc/33/37/23/183333723.db2.gz	NMWQUOMXHYVWHL-CQSZACIVSA-N	0	3	307.438	2.471	10	0		DEAEHN
CCCCCNC(=O)[C@@H](C)N(CCC(N)=S)CC(C)C	ZINC000043418424	183360705	/nfs/dbraw/zinc/36/07/05/183360705.db2.gz	YRRBUYXDYYCTHS-CYBMUJFWSA-N	0	3	301.500	2.316	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)[C@H](C)C(N)=S)c1ccccc1	ZINC000044829602	183440415	/nfs/dbraw/zinc/44/04/15/183440415.db2.gz	YKKZBERDSQNKJZ-OCCSQVGLSA-N	0	3	307.463	2.108	10	0		DEAEHN
COC[C@@H]1C[C@H](OC)CN1Cc1cnc(-c2ccccc2)[nH]1	ZINC000284511756	218059001	/nfs/dbraw/zinc/05/90/01/218059001.db2.gz	ICUSFWNPOXJNQR-HOTGVXAUSA-N	0	3	301.390	2.312	10	0		DEAEHN
CC(C)c1cc(C(=O)NC[C@@H]2CCN(C)C2)nn1C(C)(C)C	ZINC000105566237	194110487	/nfs/dbraw/zinc/11/04/87/194110487.db2.gz	RFNNYCOGIYZBFG-ZDUSSCGKSA-N	0	3	306.454	2.443	10	0		DEAEHN
C[C@](O)(CN1CCC(Nc2cccnn2)CC1)c1ccccc1	ZINC000105805954	194133815	/nfs/dbraw/zinc/13/38/15/194133815.db2.gz	KDPXRSBBMHPAJA-SFHVURJKSA-N	0	3	312.417	2.261	10	0		DEAEHN
C[C@H]1CCCN(CCNC(=O)[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000106458432	194216975	/nfs/dbraw/zinc/21/69/75/194216975.db2.gz	YUCFDCOSKSMKLR-FUHWJXTLSA-N	0	3	317.477	2.007	10	0		DEAEHN
CCOCCN(CC)[C@H](CN)c1cc2c(c(Cl)c1)OCO2	ZINC000111117271	194392281	/nfs/dbraw/zinc/39/22/81/194392281.db2.gz	LYBDZKBRTTXPIX-CYBMUJFWSA-N	0	3	314.813	2.427	10	0		DEAEHN
CCOCCN(CC)S(=O)(=O)c1cccc([C@@H](C)NC)c1	ZINC000111125609	194393451	/nfs/dbraw/zinc/39/34/51/194393451.db2.gz	CGEKEFQBUSNEDK-CYBMUJFWSA-N	0	3	314.451	2.014	10	0		DEAEHN
COC(=O)[C@H](NC1CCN([C@H](C)c2ccncc2)CC1)C1CC1	ZINC000358844663	291765210	/nfs/dbraw/zinc/76/52/10/291765210.db2.gz	DTDUBDYHLNNVDS-CXAGYDPISA-N	0	3	317.433	2.148	10	0		DEAEHN
CC1CC[NH+](CCCNc2nc(C(F)(F)F)cc(=O)[n-]2)CC1	ZINC000057342491	184034120	/nfs/dbraw/zinc/03/41/20/184034120.db2.gz	BYRLZEFGJMGIFU-UHFFFAOYSA-N	0	3	318.343	2.323	10	0		DEAEHN
CCN[C@H](Cc1cccc(C(F)(F)F)c1)CS(C)(=O)=O	ZINC000060705869	184154489	/nfs/dbraw/zinc/15/44/89/184154489.db2.gz	WTXSWIRAHSDPHL-GFCCVEGCSA-N	0	3	309.353	2.271	10	0		DEAEHN
CCNC(C)(C)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000061290966	184167933	/nfs/dbraw/zinc/16/79/33/184167933.db2.gz	VJMLAWRYEYIAKT-UHFFFAOYSA-N	0	3	320.361	2.010	10	0		DEAEHN
CCNc1cc(C(=O)N2CCC[C@H]2CN(C)C)cc(Cl)n1	ZINC000061656052	184181317	/nfs/dbraw/zinc/18/13/17/184181317.db2.gz	CJUGZNSINQBDCV-LBPRGKRZSA-N	0	3	310.829	2.333	10	0		DEAEHN
NC[C@@H](c1cc(Br)ccc1F)N1CCCOCC1	ZINC000061916545	184195226	/nfs/dbraw/zinc/19/52/26/184195226.db2.gz	DMINLJVMWXPWRK-ZDUSSCGKSA-N	0	3	317.202	2.310	10	0		DEAEHN
C[C@@H]([C@@H](N)c1ccccc1)N1CCN(CC(F)(F)F)CC1	ZINC000061941122	184197571	/nfs/dbraw/zinc/19/75/71/184197571.db2.gz	XZULCUSBCSEWFZ-GXTWGEPZSA-N	0	3	301.356	2.255	10	0		DEAEHN
Cc1nc(N2CCN(CC(F)(F)F)CC2)sc1[C@H](C)N	ZINC000061948530	184198059	/nfs/dbraw/zinc/19/80/59/184198059.db2.gz	FMTVJXLDBQKLGE-QMMMGPOBSA-N	0	3	308.373	2.156	10	0		DEAEHN
C[C@@H](C(=O)N(C)[C@@H](C)c1ccccc1Cl)N1CCNCC1	ZINC000062028182	184202472	/nfs/dbraw/zinc/20/24/72/184202472.db2.gz	NVXFJIJOBXMQLB-STQMWFEESA-N	0	3	309.841	2.153	10	0		DEAEHN
CN(Cc1nccn1C)[C@@H](CN)c1cccc(Br)c1	ZINC000062247656	184225255	/nfs/dbraw/zinc/22/52/55/184225255.db2.gz	VTURPMMHDXDOSQ-ZDUSSCGKSA-N	0	3	323.238	2.314	10	0		DEAEHN
CCOCCOc1c(Cl)cc(CNCCOC)cc1OC	ZINC000062727876	184250586	/nfs/dbraw/zinc/25/05/86/184250586.db2.gz	JVJWPBUEXLPFPE-UHFFFAOYSA-N	0	3	317.813	2.500	10	0		DEAEHN
COc1cnn(C)c1[C@@H](N)Cc1cccc(Br)c1	ZINC000158477011	197276521	/nfs/dbraw/zinc/27/65/21/197276521.db2.gz	DKAJMGVMQYBQSG-NSHDSACASA-N	0	3	310.195	2.434	10	0		DEAEHN
O=Cc1c(N2CC[C@H](N3CCCCC3)C2)nc2sccn12	ZINC000062980981	184264210	/nfs/dbraw/zinc/26/42/10/184264210.db2.gz	WIPOOYHLSLAGJJ-LBPRGKRZSA-N	0	3	304.419	2.273	10	0		DEAEHN
CNc1ncc(C(=O)N2CC[C@H](N3CCCC3)C2)cc1Cl	ZINC000062984906	184264777	/nfs/dbraw/zinc/26/47/77/184264777.db2.gz	DGDUTMWVWQBHHJ-LBPRGKRZSA-N	0	3	308.813	2.087	10	0		DEAEHN
CC[C@@H](C)N(CC)S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159067068	197323929	/nfs/dbraw/zinc/32/39/29/197323929.db2.gz	XPJDHUXPCSNMKY-LLVKDONJSA-N	0	3	302.415	2.402	10	0		DEAEHN
COc1cc(CN[C@H](C)CC(N)=O)ccc1OCCC(C)C	ZINC000066147806	184392922	/nfs/dbraw/zinc/39/29/22/184392922.db2.gz	MBRVZCPHGDRDAZ-CYBMUJFWSA-N	0	3	308.422	2.474	10	0		DEAEHN
C[C@H](CN1CCCCCC1)NC(=O)c1cccc2c1OCO2	ZINC000185419437	207365619	/nfs/dbraw/zinc/36/56/19/207365619.db2.gz	XIVSRWUBVOKYSR-CYBMUJFWSA-N	0	3	304.390	2.410	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)CC(C)(C)c2ccccc2)CCO1	ZINC000116785317	194770461	/nfs/dbraw/zinc/77/04/61/194770461.db2.gz	VGRRPSFRUNFVJO-INIZCTEOSA-N	0	3	304.434	2.143	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C	ZINC000247656931	285024315	/nfs/dbraw/zinc/02/43/15/285024315.db2.gz	YQTUOXZRDHBDSA-KLHDSHLOSA-N	0	3	311.470	2.221	10	0		DEAEHN
O=C(C1CCN(CC[C@H]2CCOC2=O)CC1)N1CCCCCC1	ZINC000120055745	195088851	/nfs/dbraw/zinc/08/88/51/195088851.db2.gz	GQOYNQKTWBUXJR-INIZCTEOSA-N	0	3	322.449	2.054	10	0		DEAEHN
Cc1ccc(N2CCCN(Cc3ccc4c[nH]nc4c3)CC2)nn1	ZINC000120144223	195106042	/nfs/dbraw/zinc/10/60/42/195106042.db2.gz	SRAFFTFXZCNHPL-UHFFFAOYSA-N	0	3	322.416	2.374	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)c2sc3cccnc3c2N)CCN1C	ZINC000159160716	197332091	/nfs/dbraw/zinc/33/20/91/197332091.db2.gz	XYIHBEQQYLHICU-UWVGGRQHSA-N	0	3	304.419	2.091	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CC[C@@H](C)C[C@@H]2C)cc(CN)c1F	ZINC000159105527	197327680	/nfs/dbraw/zinc/32/76/80/197327680.db2.gz	HTEHKVOVRNQHNF-PWSUYJOCSA-N	0	3	314.426	2.402	10	0		DEAEHN
CC[C@H](C)CN(C)S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159068122	197323598	/nfs/dbraw/zinc/32/35/98/197323598.db2.gz	RZCDXPWGWLSPTD-JTQLQIEISA-N	0	3	302.415	2.259	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000158877303	197308842	/nfs/dbraw/zinc/30/88/42/197308842.db2.gz	VHNGWBXSNPEKPH-BPQIPLTHSA-N	0	3	317.477	2.004	10	0		DEAEHN
COc1cccc(C[C@@H](N)c2c(Br)cnn2C)c1	ZINC000158873992	197308167	/nfs/dbraw/zinc/30/81/67/197308167.db2.gz	LNYVOTDDASJQSC-GFCCVEGCSA-N	0	3	310.195	2.434	10	0		DEAEHN
Cc1c(F)cc(CN)cc1S(=O)(=O)N1C[C@@H]2CCC[C@H]2C1	ZINC000158767689	197300210	/nfs/dbraw/zinc/30/02/10/197300210.db2.gz	RZQHMLIQEXUZMY-STQMWFEESA-N	0	3	312.410	2.013	10	0		DEAEHN
CCN[C@H](CS(=O)(=O)c1ccc(C)c(C)c1)[C@@H]1CCOC1	ZINC000158731251	197297481	/nfs/dbraw/zinc/29/74/81/197297481.db2.gz	OJNUVCHBUKRZMB-GDBMZVCRSA-N	0	3	311.447	2.092	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)c1ncsc1Br	ZINC000288670187	220338172	/nfs/dbraw/zinc/33/81/72/220338172.db2.gz	PNPYPFSHSNQQRY-QMMMGPOBSA-N	0	3	318.240	2.120	10	0		DEAEHN
CC(C)Oc1cncc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000158446624	197273086	/nfs/dbraw/zinc/27/30/86/197273086.db2.gz	OFERCINPTFGVCE-HIFRSBDPSA-N	0	3	305.422	2.424	10	0		DEAEHN
CCNC(=O)NC(=O)CN[C@@H](C)c1ccc(CC(C)C)cc1	ZINC000120300415	195139462	/nfs/dbraw/zinc/13/94/62/195139462.db2.gz	QAGVOTPNIURCHZ-ZDUSSCGKSA-N	0	3	305.422	2.381	10	0		DEAEHN
CCC(C)(C)C1CCC(O)([C@@]2(CN)CCS(=O)(=O)C2)CC1	ZINC000157666175	197205810	/nfs/dbraw/zinc/20/58/10/197205810.db2.gz	QAOXOOAKSQYMAC-OGVSOVDVSA-N	0	3	317.495	2.108	10	0		DEAEHN
CCO[C@H]1C[C@@](N)(C(=O)N(CC(F)(F)F)C2CC2)C1(C)C	ZINC000157137930	197164443	/nfs/dbraw/zinc/16/44/43/197164443.db2.gz	KWEXSKVLRJAIFF-GXFFZTMASA-N	0	3	308.344	2.072	10	0		DEAEHN
CCOCCN(C)[C@H](CN)c1ccc(OC)c(OC)c1Cl	ZINC000157117961	197163365	/nfs/dbraw/zinc/16/33/65/197163365.db2.gz	OHDFVWRNFDGLSU-GFCCVEGCSA-N	0	3	316.829	2.325	10	0		DEAEHN
CCNc1nc(N[C@H](CC)c2nccs2)nc(N(C)C)n1	ZINC000156139346	197088889	/nfs/dbraw/zinc/08/88/89/197088889.db2.gz	WVBWEQYMHPPSPE-SECBINFHSA-N	0	3	307.427	2.389	10	0		DEAEHN
C[C@H](c1ccccc1)N1CCC(NC(=O)CC[S@](C)=O)CC1	ZINC000156012417	197080286	/nfs/dbraw/zinc/08/02/86/197080286.db2.gz	XVGQGFQKONAVDN-JLCFBVMHSA-N	0	3	322.474	2.097	10	0		DEAEHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)CC[S@](C)=O)CC1	ZINC000156012321	197080306	/nfs/dbraw/zinc/08/03/06/197080306.db2.gz	XVGQGFQKONAVDN-RCDICMHDSA-N	0	3	322.474	2.097	10	0		DEAEHN
C[C@H]1C[C@@H](Nc2ccc(F)c([N-]S(C)(=O)=O)c2)CC[N@@H+]1C	ZINC000155963183	197077113	/nfs/dbraw/zinc/07/71/13/197077113.db2.gz	YBCBYQRJWONPDP-JQWIXIFHSA-N	0	3	315.414	2.092	10	0		DEAEHN
C[C@H]1C[C@@H](Nc2ccc(F)c([N-]S(C)(=O)=O)c2)CC[N@H+]1C	ZINC000155963183	197077114	/nfs/dbraw/zinc/07/71/14/197077114.db2.gz	YBCBYQRJWONPDP-JQWIXIFHSA-N	0	3	315.414	2.092	10	0		DEAEHN
COc1ccc([C@H]2CCCN2C(=O)[C@]2(F)CCNC2)c(OC)c1	ZINC000408513562	533203234	/nfs/dbraw/zinc/20/32/34/533203234.db2.gz	QDDFDIWNRVQSPV-PBHICJAKSA-N	0	3	322.380	2.069	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c(F)c1	ZINC000120541650	195186892	/nfs/dbraw/zinc/18/68/92/195186892.db2.gz	HSYKRWWVGPVSNM-OLZOCXBDSA-N	0	3	321.396	2.014	10	0		DEAEHN
O=C([C@@H]1CN(Cc2cccs2)C[C@@H]2OCC[C@@H]21)N1CCCC1	ZINC000247797435	257117456	/nfs/dbraw/zinc/11/74/56/257117456.db2.gz	SCABSYODHHFRMH-OAGGEKHMSA-N	0	3	320.458	2.207	10	0		DEAEHN
O=C([C@@H]1C[C@@H]2OCC[C@@H]2N(Cc2ccsc2)C1)N1CCCC1	ZINC000247756160	257118485	/nfs/dbraw/zinc/11/84/85/257118485.db2.gz	DOBJOPKMQYKKPZ-PMPSAXMXSA-N	0	3	320.458	2.350	10	0		DEAEHN
CC[C@H]1CN(Cc2cnn(C(C)(C)C)c2)CCN1CCOC	ZINC000120976587	195275157	/nfs/dbraw/zinc/27/51/57/195275157.db2.gz	IIBDHUIAWZPOFJ-INIZCTEOSA-N	0	3	308.470	2.181	10	0		DEAEHN
Cc1nc(CN(C)C(=O)c2ccc3c(c2)CNCC3)cs1	ZINC000121054564	195288051	/nfs/dbraw/zinc/28/80/51/195288051.db2.gz	BLBDFPLMEYCICU-UHFFFAOYSA-N	0	3	301.415	2.369	10	0		DEAEHN
Cc1ccccc1NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000121813017	195352745	/nfs/dbraw/zinc/35/27/45/195352745.db2.gz	FOYNSOLUDCMQCI-CQSZACIVSA-N	0	3	305.422	2.026	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C)cc1	ZINC000121820469	195354049	/nfs/dbraw/zinc/35/40/49/195354049.db2.gz	HTQVFQKACROSPI-MRXNPFEDSA-N	0	3	319.449	2.280	10	0		DEAEHN
O=C(c1ccc(OCC2CC2)cc1)N1CCN2CCC[C@H]2C1	ZINC000195337576	132547131	/nfs/dbraw/zinc/54/71/31/132547131.db2.gz	GXOSMCJMSULEKW-INIZCTEOSA-N	0	3	300.402	2.396	10	0		DEAEHN
Cc1cccc(O[C@@H](C)c2nc([C@H]3CNCCN3C)no2)c1	ZINC000263263009	132579902	/nfs/dbraw/zinc/57/99/02/132579902.db2.gz	RECJTIYTFDRTFW-GXTWGEPZSA-N	0	3	302.378	2.094	10	0		DEAEHN
CC(C)[C@@H](NC(=O)OC(C)(C)C)[C@@]1(C)NCCc2nc[nH]c21	ZINC000725242526	542770073	/nfs/dbraw/zinc/77/00/73/542770073.db2.gz	CCJUOAKBVXDUBX-MLGOLLRUSA-N	0	3	308.426	2.320	10	0		DEAEHN
CC1CCN(CCN2CCO[C@H](COc3ccccc3)C2)CC1	ZINC000361989958	133203735	/nfs/dbraw/zinc/20/37/35/133203735.db2.gz	ZGLWUPGVNCCUIQ-IBGZPJMESA-N	0	3	318.461	2.498	10	0		DEAEHN
c1nc2c([nH]1)C[C@H](NCc1cnc([C@@H]3CCCO3)s1)CC2	ZINC000368258170	133266709	/nfs/dbraw/zinc/26/67/09/133266709.db2.gz	IYHMZRVRQWUCRA-YGRLFVJLSA-N	0	3	304.419	2.365	10	0		DEAEHN
Cn1cc(C(=O)NC[C@@H]2CCCN(C)C2)c2cc(F)ccc21	ZINC000563768756	292072572	/nfs/dbraw/zinc/07/25/72/292072572.db2.gz	WPCVQVIPOLKAPU-LBPRGKRZSA-N	0	3	303.381	2.389	10	0		DEAEHN
CC[C@]1(CO)CCCN(Cc2cc(-c3cnn(C)c3)no2)C1	ZINC000187602536	145001732	/nfs/dbraw/zinc/00/17/32/145001732.db2.gz	SOIIXXXJRJGJPQ-INIZCTEOSA-N	0	3	304.394	2.060	10	0		DEAEHN
COC(=O)C1(CNCc2cnc3c(cnn3C(C)C)c2)CC1	ZINC000188669023	145015384	/nfs/dbraw/zinc/01/53/84/145015384.db2.gz	ZPAWZGUAXJJBQN-UHFFFAOYSA-N	0	3	302.378	2.055	10	0		DEAEHN
Cc1cccc2c1OCC[C@H]2NC(=O)NC1CCN(C)CC1	ZINC000189741554	145033009	/nfs/dbraw/zinc/03/30/09/145033009.db2.gz	LFBFLDPJKAYBTQ-OAHLLOKOSA-N	0	3	303.406	2.212	10	0		DEAEHN
CCOC1CC(CCNC(=O)NCCN2CCCC[C@@H]2C)C1	ZINC000190047000	145037769	/nfs/dbraw/zinc/03/77/69/145037769.db2.gz	FZMUHCIHOYAVRJ-FHERZECASA-N	0	3	311.470	2.365	10	0		DEAEHN
CCC(=O)CCN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000190290932	145039740	/nfs/dbraw/zinc/03/97/40/145039740.db2.gz	NBVSNMPMJGFZBB-CQSZACIVSA-N	0	3	303.406	2.410	10	0		DEAEHN
CCCOc1cc(OC)ccc1C(=O)N1CCN2CCC[C@H]2C1	ZINC000191584261	145061049	/nfs/dbraw/zinc/06/10/49/145061049.db2.gz	FQGUEKMMMOLILE-AWEZNQCLSA-N	0	3	318.417	2.404	10	0		DEAEHN
COc1cccc(CN[C@@H]2CCCN(c3cnn(C)c3)C2)c1F	ZINC000192689005	145077088	/nfs/dbraw/zinc/07/70/88/145077088.db2.gz	WWKODHPYICJFPP-CQSZACIVSA-N	0	3	318.396	2.326	10	0		DEAEHN
COc1cccc(CN[C@H]2CCCN(c3cccnn3)C2)c1F	ZINC000192680651	145077301	/nfs/dbraw/zinc/07/73/01/145077301.db2.gz	ZFYHETKORYGMQD-AWEZNQCLSA-N	0	3	316.380	2.383	10	0		DEAEHN
C[C@@H]1CN(C2CCN(Cc3cn4ccccc4n3)CC2)CCO1	ZINC000193430417	145085709	/nfs/dbraw/zinc/08/57/09/145085709.db2.gz	MEEDCJJJTPTTAT-OAHLLOKOSA-N	0	3	314.433	2.019	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)N[C@@H]2CCCC[C@H]2n2cccn2)C1	ZINC000245441665	145092604	/nfs/dbraw/zinc/09/26/04/145092604.db2.gz	VPJGTZBWWXDDIC-BZUAXINKSA-N	0	3	319.453	2.102	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)[C@@H]1OCCc2ccccc21	ZINC000246285409	145097199	/nfs/dbraw/zinc/09/71/99/145097199.db2.gz	OANVQDWGOWCYLI-RHSMWYFYSA-N	0	3	302.418	2.291	10	0		DEAEHN
C[C@H](CCc1cccn1C)NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000246399239	145101659	/nfs/dbraw/zinc/10/16/59/145101659.db2.gz	RKOKKDGDHZQEKN-VYDXJSESSA-N	0	3	320.481	2.470	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N2CCC[C@H](c3cc[nH]n3)C2)C1	ZINC000246434793	145103044	/nfs/dbraw/zinc/10/30/44/145103044.db2.gz	NLYZWYQRIDYRPW-IJEWVQPXSA-N	0	3	319.453	2.027	10	0		DEAEHN
C[C@H](NC(=O)N1CCC[C@H]1CN1CCCCC1)[C@@H]1CCCO1	ZINC000246484189	145104017	/nfs/dbraw/zinc/10/40/17/145104017.db2.gz	RUZJGLVQZKBYRY-JYJNAYRXSA-N	0	3	309.454	2.214	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cn(C)nc1-c1ccccc1	ZINC000246519672	145105336	/nfs/dbraw/zinc/10/53/36/145105336.db2.gz	UOQOAMLEGYOXGT-ZBFHGGJFSA-N	0	3	324.428	2.396	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(OC)cc1OC	ZINC000246894804	145118182	/nfs/dbraw/zinc/11/81/82/145118182.db2.gz	HBAMQGQWYCNSKI-KGLIPLIRSA-N	0	3	318.417	2.403	10	0		DEAEHN
CSc1ccc(O[C@H](C)C(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000247056631	145125296	/nfs/dbraw/zinc/12/52/96/145125296.db2.gz	RCVHAWMMMMHXKC-KGLIPLIRSA-N	0	3	320.458	2.482	10	0		DEAEHN
O=C(N[C@H](Cc1ccccc1)C1CC1)N1CCN2CCC[C@H]2C1	ZINC000247086848	145126599	/nfs/dbraw/zinc/12/65/99/145126599.db2.gz	ZVXZVIRHZQNKKU-ZWKOTPCHSA-N	0	3	313.445	2.497	10	0		DEAEHN
Cc1ccc(OCC(=O)N2C[C@@H]3CCCN3C[C@H]2C)c(C)c1	ZINC000247142716	145127517	/nfs/dbraw/zinc/12/75/17/145127517.db2.gz	JUYCSCGXXLMNFU-CVEARBPZSA-N	0	3	302.418	2.377	10	0		DEAEHN
Cc1nn(C)c2sc(C(=O)N(C)[C@@H]3CCN(C)[C@@H](C)C3)cc12	ZINC000247259614	145130656	/nfs/dbraw/zinc/13/06/56/145130656.db2.gz	DYIRFKMRBLOPJQ-CMPLNLGQSA-N	0	3	320.462	2.498	10	0		DEAEHN
c1cc(-c2nc(CN3CCN4CCCC[C@H]4C3)no2)cs1	ZINC000247441052	145137288	/nfs/dbraw/zinc/13/72/88/145137288.db2.gz	WURBMUMGUGACTA-ZDUSSCGKSA-N	0	3	304.419	2.468	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](N[C@H](Cc2ccc(Cl)cc2)C(N)=O)C1	ZINC000248706584	145164467	/nfs/dbraw/zinc/16/44/67/145164467.db2.gz	ABYGCGGRDMUVKX-WQVCFCJDSA-N	0	3	323.868	2.055	10	0		DEAEHN
CCN1CC[C@H](N(C)C(=O)c2nc3cccnc3s2)[C@@H](C)C1	ZINC000248738372	145165651	/nfs/dbraw/zinc/16/56/51/145165651.db2.gz	OJKZUSUIXHAICE-AAEUAGOBSA-N	0	3	318.446	2.494	10	0		DEAEHN
CCOCCN1CCN(C[C@@H](O)C2CCCCC2)C[C@@H]1CC	ZINC000248988401	145175443	/nfs/dbraw/zinc/17/54/43/145175443.db2.gz	XOEHZBBZFAVTOS-ZWKOTPCHSA-N	0	3	312.498	2.360	10	0		DEAEHN
COc1ccc(OC)c(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1	ZINC000252656855	145199742	/nfs/dbraw/zinc/19/97/42/145199742.db2.gz	WGPVLNMRXNJSNH-XJKSGUPXSA-N	0	3	318.417	2.260	10	0		DEAEHN
CO[C@@H]1CC[C@H]2OCCN(CCCCCn3cccn3)[C@H]2C1	ZINC000252801605	145201032	/nfs/dbraw/zinc/20/10/32/145201032.db2.gz	CPEKPVBJMRTZER-IXDOHACOSA-N	0	3	307.438	2.322	10	0		DEAEHN
Cc1nc2ccccn2c1CN1CCNC[C@H]1c1cccnc1	ZINC000261638236	145212608	/nfs/dbraw/zinc/21/26/08/145212608.db2.gz	FKLXXARZVANWCO-INIZCTEOSA-N	0	3	307.401	2.184	10	0		DEAEHN
NC1(C(=O)Nc2nc3c(s2)CCCCCC3)CCOCC1	ZINC000261673362	145215463	/nfs/dbraw/zinc/21/54/63/145215463.db2.gz	CCTDKIUJKMFFNX-UHFFFAOYSA-N	0	3	309.435	2.249	10	0		DEAEHN
Nc1ncc(CN2CCC[C@](CO)(c3ccccc3)C2)s1	ZINC000261682488	145216398	/nfs/dbraw/zinc/21/63/98/145216398.db2.gz	QSHHBKFYAYVNDQ-INIZCTEOSA-N	0	3	303.431	2.251	10	0		DEAEHN
CCCn1cc(CN2CCNC[C@@H]2c2ccccc2OC)cn1	ZINC000261784122	145226055	/nfs/dbraw/zinc/22/60/55/145226055.db2.gz	KJWXGORHQKLLDC-QGZVFWFLSA-N	0	3	314.433	2.448	10	0		DEAEHN
Cc1cc(C)c(CCNC(=O)[C@@H](N)C2CCOCC2)c(C)c1	ZINC000261799449	145227273	/nfs/dbraw/zinc/22/72/73/145227273.db2.gz	GYRYOFHNIGVZGW-KRWDZBQOSA-N	0	3	304.434	2.024	10	0		DEAEHN
COCc1cccc(NC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000261810778	145228694	/nfs/dbraw/zinc/22/86/94/145228694.db2.gz	GMSVMCHRHVQCCD-RLFYNMQTSA-N	0	3	318.417	2.304	10	0		DEAEHN
Cc1ccc(CN(C)C(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)cc1	ZINC000261885625	145237961	/nfs/dbraw/zinc/23/79/61/145237961.db2.gz	NCMAADOLZHEIQV-GPMSIDNRSA-N	0	3	316.445	2.486	10	0		DEAEHN
N[C@H](C(=O)Nc1ccc(OCC(F)F)cc1)C1CCOCC1	ZINC000261901792	145239406	/nfs/dbraw/zinc/23/94/06/145239406.db2.gz	WNCUMUIUTLCRPJ-AWEZNQCLSA-N	0	3	314.332	2.023	10	0		DEAEHN
Cn1cnnc1-c1cccc(NC(=O)[C@@H]2NCCCC2(C)C)c1	ZINC000261932765	145244214	/nfs/dbraw/zinc/24/42/14/145244214.db2.gz	SYOLFSRLIWXJEP-AWEZNQCLSA-N	0	3	313.405	2.199	10	0		DEAEHN
COc1cc(NC(=O)[C@@H]2NCCCC2(C)C)ccc1NC(C)=O	ZINC000261947146	145245520	/nfs/dbraw/zinc/24/55/20/145245520.db2.gz	VUTYZOCLMYSVOX-HNNXBMFYSA-N	0	3	319.405	2.370	10	0		DEAEHN
COC(=O)c1cccc(CN2CCNC[C@@H]2c2cccnc2)c1	ZINC000262041899	145255888	/nfs/dbraw/zinc/25/58/88/145255888.db2.gz	YLQPSEHLGVTDFI-QGZVFWFLSA-N	0	3	311.385	2.015	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)Nc1nc(C2CC2)cs1	ZINC000262530300	145290797	/nfs/dbraw/zinc/29/07/97/145290797.db2.gz	PLIFECKXOCSYGB-SIVJFFJCSA-N	0	3	321.446	2.492	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(COc2cccc3ccccc32)n1	ZINC000263155838	145330140	/nfs/dbraw/zinc/33/01/40/145330140.db2.gz	DMJVATRLLDNXSY-OAHLLOKOSA-N	0	3	324.384	2.378	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@H]2c2ccc(F)cc2F)n1	ZINC000263210830	145336601	/nfs/dbraw/zinc/33/66/01/145336601.db2.gz	KFYAPPXUZXXHQQ-OUCADQQQSA-N	0	3	320.343	2.195	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2cccc(C(F)(F)F)c2)n1	ZINC000263210916	145336877	/nfs/dbraw/zinc/33/68/77/145336877.db2.gz	KHXHLDIZGGCSHK-NSHDSACASA-N	0	3	312.295	2.332	10	0		DEAEHN
Cc1cc(-c2nc([C@H]3CNCCN3C)no2)c(C)n1C(C)C	ZINC000263224605	145338441	/nfs/dbraw/zinc/33/84/41/145338441.db2.gz	MOLHXQFXTYLWGM-CQSZACIVSA-N	0	3	303.410	2.312	10	0		DEAEHN
C[C@H](OC[C@H]1CCCCO1)C(=O)N[C@@H]1CCN(C2CCCC2)C1	ZINC000332798500	145388619	/nfs/dbraw/zinc/38/86/19/145388619.db2.gz	NSGSWJGBSAZQCT-ZMSDIMECSA-N	0	3	324.465	2.094	10	0		DEAEHN
C[C@@H](NCCC1(F)CCC1)c1cccc(S(N)(=O)=O)c1	ZINC000348407914	146267287	/nfs/dbraw/zinc/26/72/87/146267287.db2.gz	NLBUZWMXBFGUHO-LLVKDONJSA-N	0	3	300.399	2.267	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)N1CC(C)(CCOC)C1	ZINC000358758661	147197836	/nfs/dbraw/zinc/19/78/36/147197836.db2.gz	ADLWKBQIFVEVTP-HNNXBMFYSA-N	0	3	311.470	2.319	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cc1	ZINC000247517681	292174688	/nfs/dbraw/zinc/17/46/88/292174688.db2.gz	NTJFYRAZTGXNHH-GOEBONIOSA-N	0	3	308.447	2.100	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H](C)c1ccc(C)cc1	ZINC000111833642	401725488	/nfs/dbraw/zinc/72/54/88/401725488.db2.gz	JMZFEBAAASMREB-DOTOQJQBSA-N	0	3	319.449	2.466	10	0		DEAEHN
CS(=O)(=O)CCCNCc1ccc(Br)c(F)c1	ZINC000127442714	401735054	/nfs/dbraw/zinc/73/50/54/401735054.db2.gz	CUYWDMGPEHLYHJ-UHFFFAOYSA-N	0	3	324.215	2.113	10	0		DEAEHN
CC(C)N(CC(=O)NCc1ccc(F)cc1)C1CCOCC1	ZINC000077323274	401810115	/nfs/dbraw/zinc/81/01/15/401810115.db2.gz	YQKCJLUDRJJASA-UHFFFAOYSA-N	0	3	308.397	2.331	10	0		DEAEHN
CC(C)(C)NC(=O)CN1CC[C@H](COCc2ccccc2)C1	ZINC000075866104	401772331	/nfs/dbraw/zinc/77/23/31/401772331.db2.gz	AMANBYDODNLHDN-INIZCTEOSA-N	0	3	304.434	2.440	10	0		DEAEHN
O=C(CN[C@@H]1CCCC[C@@H]1n1cccn1)NCc1cccs1	ZINC000128356845	401772709	/nfs/dbraw/zinc/77/27/09/401772709.db2.gz	FLVIBDCMXXELSA-CABCVRRESA-N	0	3	318.446	2.334	10	0		DEAEHN
Cn1cc([C@@H]2CCN(Cc3cn(C)nc3-c3cccnc3)C2)cn1	ZINC000128417664	401776187	/nfs/dbraw/zinc/77/61/87/401776187.db2.gz	XPSUZADJROTJHH-OAHLLOKOSA-N	0	3	322.416	2.205	10	0		DEAEHN
CC(=O)Nc1ccc(CN2CCC[C@@H](Cn3cncn3)C2)cc1	ZINC000128522456	401780733	/nfs/dbraw/zinc/78/07/33/401780733.db2.gz	HIGWOBONMBZPGE-MRXNPFEDSA-N	0	3	313.405	2.149	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)CCc1nc(C(C)(C)C)no1	ZINC000077729472	401827983	/nfs/dbraw/zinc/82/79/83/401827983.db2.gz	OUVZGMHFCABSES-ZDUSSCGKSA-N	0	3	324.469	2.392	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)C[C@@H]2CCCN(C)C2)c(C)s1	ZINC000115585405	401832363	/nfs/dbraw/zinc/83/23/63/401832363.db2.gz	RWROHVIWLRGYPJ-CYBMUJFWSA-N	0	3	316.492	2.327	10	0		DEAEHN
CN1C[C@H](NCc2csc(Br)c2)CCC1=O	ZINC000077900138	401835918	/nfs/dbraw/zinc/83/59/18/401835918.db2.gz	XFQXVTAURDOINL-SECBINFHSA-N	0	3	303.225	2.221	10	0		DEAEHN
C[C@H]1CC(NC(=O)c2ccccc2OCCN(C)C)C[C@H](C)O1	ZINC000130675972	401837147	/nfs/dbraw/zinc/83/71/47/401837147.db2.gz	BNDYGGWRJBTLBC-KBPBESRZSA-N	0	3	320.433	2.313	10	0		DEAEHN
CC(C)N1CCCC[C@@H]1C(=O)N1CCCN(CC(F)F)CC1	ZINC000130746524	401837799	/nfs/dbraw/zinc/83/77/99/401837799.db2.gz	ZZJIDQDEMBGNHO-CQSZACIVSA-N	0	3	317.424	2.049	10	0		DEAEHN
COc1ccc(CNC(=O)N[C@H](CC(C)C)CN(C)C)cc1	ZINC000078377787	401848502	/nfs/dbraw/zinc/84/85/02/401848502.db2.gz	GSDPPHOSAQEWOC-OAHLLOKOSA-N	0	3	307.438	2.471	10	0		DEAEHN
CC(C)[C@@H]1CCC[C@H](NC(=O)N2CCO[C@H](CN(C)C)C2)C1	ZINC000117045661	401867888	/nfs/dbraw/zinc/86/78/88/401867888.db2.gz	ZQUOHACUABOASH-OWCLPIDISA-N	0	3	311.470	2.173	10	0		DEAEHN
CCOc1ccc(OCCNC(=O)CN2CCCC2(C)C)cc1	ZINC000077382522	401812945	/nfs/dbraw/zinc/81/29/45/401812945.db2.gz	IJONAQKJBKJBRT-UHFFFAOYSA-N	0	3	320.433	2.455	10	0		DEAEHN
COc1ccccc1/C=C/CN1CCN(CC(C)(C)O)CC1	ZINC000129984432	401814248	/nfs/dbraw/zinc/81/42/48/401814248.db2.gz	VBVCUUCOTRNMQS-SOFGYWHQSA-N	0	3	304.434	2.097	10	0		DEAEHN
CC(C)OC(=O)c1ccc(CN2C[C@@H](C(N)=O)CC[C@H]2C)cc1	ZINC000135040963	401925172	/nfs/dbraw/zinc/92/51/72/401925172.db2.gz	QAVLMHYCGDEWTL-CJNGLKHVSA-N	0	3	318.417	2.338	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)C[C@@H]1CCCCO1	ZINC000087159800	401928391	/nfs/dbraw/zinc/92/83/91/401928391.db2.gz	OUBIBHDXYXHJBL-IRXDYDNUSA-N	0	3	304.434	2.235	10	0		DEAEHN
COc1cccc(N2CCC[C@@H](NCc3cncn3C)C2)c1	ZINC000117390220	401875608	/nfs/dbraw/zinc/87/56/08/401875608.db2.gz	ODSGPODYOBCROK-CQSZACIVSA-N	0	3	300.406	2.187	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)CCc1cccc(OC(C)(C)C)n1	ZINC000133333301	401882077	/nfs/dbraw/zinc/88/20/77/401882077.db2.gz	HHQZSRYOLWUAOG-HNNXBMFYSA-N	0	3	319.449	2.402	10	0		DEAEHN
CCCC(=O)OC[C@H](O)CN(Cc1cccc(OC)c1)C1CC1	ZINC000036031011	401901516	/nfs/dbraw/zinc/90/15/16/401901516.db2.gz	NBDKODUBPGHYJN-MRXNPFEDSA-N	0	3	321.417	2.364	10	0		DEAEHN
CC[C@@H](NC(=O)c1oc2ccccc2c1CN(C)C)C(=O)OC	ZINC000084371774	401905482	/nfs/dbraw/zinc/90/54/82/401905482.db2.gz	BGYJJLUBFAEYSX-CYBMUJFWSA-N	0	3	318.373	2.176	10	0		DEAEHN
CCCOc1cccc(NC(=O)N2CCO[C@@H](CN(C)C)C2)c1	ZINC000118800538	401908377	/nfs/dbraw/zinc/90/83/77/401908377.db2.gz	HMLJLZRAPNYCFI-INIZCTEOSA-N	0	3	321.421	2.270	10	0		DEAEHN
CCOc1cc(C)ccc1NC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000118807169	401909014	/nfs/dbraw/zinc/90/90/14/401909014.db2.gz	BSCDPPUXYPMNLF-AWEZNQCLSA-N	0	3	321.421	2.188	10	0		DEAEHN
CC[C@H](C(=O)N1CCO[C@H](c2ccc(F)c(C)c2)C1)N(C)C	ZINC000134798538	401915066	/nfs/dbraw/zinc/91/50/66/401915066.db2.gz	OMGTUYVNUBIPHF-CVEARBPZSA-N	0	3	308.397	2.374	10	0		DEAEHN
CCC(C)(C)NC(=O)CN1CC[C@H]2[C@H](CCCN2C2CC2)C1	ZINC000134879661	401917985	/nfs/dbraw/zinc/91/79/85/401917985.db2.gz	ZOTXLGHWNPFLES-ZBFHGGJFSA-N	0	3	307.482	2.240	10	0		DEAEHN
COCCc1nc(C)c([C@@H](C)NCCc2nc(C)no2)s1	ZINC000089519005	401950671	/nfs/dbraw/zinc/95/06/71/401950671.db2.gz	KTSAIKXMHPICJE-SECBINFHSA-N	0	3	310.423	2.225	10	0		DEAEHN
COc1cc([C@H](C)NCCc2nc(C)no2)cc(OC)c1OC	ZINC000089518810	401950704	/nfs/dbraw/zinc/95/07/04/401950704.db2.gz	JHQMAZLLLXHFQN-JTQLQIEISA-N	0	3	321.377	2.297	10	0		DEAEHN
C[C@H](N[C@@H]1CCCN(c2cccnn2)C1)c1cncc(F)c1	ZINC000089732200	401959384	/nfs/dbraw/zinc/95/93/84/401959384.db2.gz	UWCHAPMSUQTHGJ-SWLSCSKDSA-N	0	3	301.369	2.330	10	0		DEAEHN
COc1cc(C)cc(C(=O)N[C@H](CC(C)C)CN(C)C)c1O	ZINC000137106864	401979054	/nfs/dbraw/zinc/97/90/54/401979054.db2.gz	XLPIWWAAJCHOCF-CYBMUJFWSA-N	0	3	308.422	2.415	10	0		DEAEHN
C[C@@H]1CCC[C@@H](NC(=O)CN2CCCN(C3CC3)CC2)[C@@H]1C	ZINC000145754582	401991655	/nfs/dbraw/zinc/99/16/55/401991655.db2.gz	MXGIERQLMWWQQY-BFYDXBDKSA-N	0	3	307.482	2.097	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H](C)N1CCc2ccccc21)N(C)C	ZINC000135650087	401949397	/nfs/dbraw/zinc/94/93/97/401949397.db2.gz	UIUVYLJMDUHCMU-WMLDXEAASA-N	0	3	303.450	2.284	10	0		DEAEHN
COc1ccccc1/C=C/CN1CC[C@H](N2CCOCC2)C1	ZINC000121025924	402011521	/nfs/dbraw/zinc/01/15/21/402011521.db2.gz	SSJUCUIROSFXSB-YXMMZVCTSA-N	0	3	302.418	2.115	10	0		DEAEHN
CC(C)n1cnnc1[C@H]1CCCN(C[C@H](O)COC(C)(C)C)C1	ZINC000093200972	402012743	/nfs/dbraw/zinc/01/27/43/402012743.db2.gz	QECRSEDGJMACFK-GJZGRUSLSA-N	0	3	324.469	2.214	10	0		DEAEHN
Cc1ccccc1[C@H](C)NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000049172804	402013705	/nfs/dbraw/zinc/01/37/05/402013705.db2.gz	DEKSCPILBCYQFF-HOTGVXAUSA-N	0	3	319.449	2.202	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H](C)Oc1cccc(OC)c1)N(C)C	ZINC000121194047	402019168	/nfs/dbraw/zinc/01/91/68/402019168.db2.gz	MEYKZTWDOJDOCB-BBRMVZONSA-N	0	3	308.422	2.309	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(N(C)C)cc1F	ZINC000151314179	402029104	/nfs/dbraw/zinc/02/91/04/402029104.db2.gz	HMBMYJQFTILHQX-TZMCWYRMSA-N	0	3	305.397	2.200	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCCN(C)c2ccccc2)C1	ZINC000052500090	402042991	/nfs/dbraw/zinc/04/29/91/402042991.db2.gz	RKFQHIWOHNOFRM-INIZCTEOSA-N	0	3	318.465	2.296	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cccc(OC(F)(F)F)c2)C1	ZINC000152149994	402078319	/nfs/dbraw/zinc/07/83/19/402078319.db2.gz	IGIXJSIZQBHQBU-LLVKDONJSA-N	0	3	302.296	2.361	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NC1CCN(c2cccs2)CC1	ZINC000122610459	402087149	/nfs/dbraw/zinc/08/71/49/402087149.db2.gz	QPPGICKVPXYWEO-AWEZNQCLSA-N	0	3	322.478	2.110	10	0		DEAEHN
Cc1[nH]nc2ncc(C(=O)N[C@@H](CN(C)C)c3ccccc3)cc12	ZINC000122723268	402091890	/nfs/dbraw/zinc/09/18/90/402091890.db2.gz	YZUWWBMFPYXKRK-INIZCTEOSA-N	0	3	323.400	2.299	10	0		DEAEHN
C[C@H]1CCCC[C@@H]1OCCNC(=O)N1CCCN(C2CC2)CC1	ZINC000057777162	402096945	/nfs/dbraw/zinc/09/69/45/402096945.db2.gz	CIPCDMIVPLZEFE-RDJZCZTQSA-N	0	3	323.481	2.461	10	0		DEAEHN
CC[C@@](C)(O)CN1CCN(Cc2cc(F)ccc2OC)CC1	ZINC000123045113	402107709	/nfs/dbraw/zinc/10/77/09/402107709.db2.gz	JTEGUDQKVDBQJB-QGZVFWFLSA-N	0	3	310.413	2.113	10	0		DEAEHN
COC(=O)c1[nH]c(C)c(C(=O)NCCN2CCCC[C@@H]2C)c1C	ZINC000153015651	402122401	/nfs/dbraw/zinc/12/24/01/402122401.db2.gz	PTELHMVVMKRKCL-NSHDSACASA-N	0	3	321.421	2.022	10	0		DEAEHN
CSc1ccc(O[C@H](C)C(=O)NC[C@@H]2CCCN2C)cc1	ZINC000151930611	402066566	/nfs/dbraw/zinc/06/65/66/402066566.db2.gz	NUIUFHLKWFEIJC-OLZOCXBDSA-N	0	3	308.447	2.386	10	0		DEAEHN
CC[C@@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1c(C)noc1C	ZINC000123370087	402124510	/nfs/dbraw/zinc/12/45/10/402124510.db2.gz	LXFQHULINMYVCL-LSDHHAIUSA-N	0	3	318.421	2.398	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Cc2c(C)nn(C(F)F)c2C)C1	ZINC000065619211	402126771	/nfs/dbraw/zinc/12/67/71/402126771.db2.gz	PWMNOIKJNFYIDS-LBPRGKRZSA-N	0	3	314.380	2.038	10	0		DEAEHN
Cc1cc(F)cc(NC(=O)C(=O)NCCN2CCCC[C@H]2C)c1	ZINC000153134152	402129008	/nfs/dbraw/zinc/12/90/08/402129008.db2.gz	GYKGWXDQOKKGSI-CYBMUJFWSA-N	0	3	321.396	2.063	10	0		DEAEHN
Cc1cccc(NC(=O)N2CCO[C@@H](CN(C)C)C2)c1Cl	ZINC000153444383	402145646	/nfs/dbraw/zinc/14/56/46/402145646.db2.gz	LEYLJSZFKMNKBQ-LBPRGKRZSA-N	0	3	311.813	2.443	10	0		DEAEHN
COc1ccccc1OCC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000123710603	402142674	/nfs/dbraw/zinc/14/26/74/402142674.db2.gz	CLDDLDHZBDBSDA-KBPBESRZSA-N	0	3	306.406	2.015	10	0		DEAEHN
COc1ccc2c(c1)CCN2C(=O)C1(N)Cc2ccccc2C1	ZINC000154058150	402189586	/nfs/dbraw/zinc/18/95/86/402189586.db2.gz	XAHZJWIVGOFBRU-UHFFFAOYSA-N	0	3	308.381	2.081	10	0		DEAEHN
C[C@@H](NC(=O)[C@H](C)N(C)CCCn1ccnc1)c1ccccc1	ZINC000124319731	402174561	/nfs/dbraw/zinc/17/45/61/402174561.db2.gz	ZDMATJKRADKLBF-CVEARBPZSA-N	0	3	314.433	2.471	10	0		DEAEHN
CCOC[C@@H](O)CN[C@@H](C)c1cccc(Br)c1	ZINC000069277660	402217765	/nfs/dbraw/zinc/21/77/65/402217765.db2.gz	BASMUZNWSLHJTQ-GWCFXTLKSA-N	0	3	302.212	2.497	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@@](C)(c2ccccc2)C1)N(C)C	ZINC000154567038	402219115	/nfs/dbraw/zinc/21/91/15/402219115.db2.gz	VJABEEXVDGZRCS-FUHWJXTLSA-N	0	3	304.434	2.491	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)c1ccc(-c2ncon2)cc1	ZINC000107219988	402228405	/nfs/dbraw/zinc/22/84/05/402228405.db2.gz	ZATBJVSLCIXVAF-CYBMUJFWSA-N	0	3	314.389	2.341	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H](C)N(C)Cc1ccccc1)N(C)C	ZINC000154878328	402236999	/nfs/dbraw/zinc/23/69/99/402236999.db2.gz	CRTALKUFTSYMPK-RDJZCZTQSA-N	0	3	305.466	2.353	10	0		DEAEHN
CC(C)[C@@H](O)CC(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000155400113	402255749	/nfs/dbraw/zinc/25/57/49/402255749.db2.gz	TXPURNLBYRCFSY-IRXDYDNUSA-N	0	3	304.434	2.347	10	0		DEAEHN
CCCO[C@@H]1CCCN(C(=O)N[C@H]2CCCN(CC)C2)CC1	ZINC000108562005	402257209	/nfs/dbraw/zinc/25/72/09/402257209.db2.gz	YISSUMHUPKKDFZ-JKSUJKDBSA-N	0	3	311.470	2.461	10	0		DEAEHN
c1ccc(-c2cc(N3CCNCC3)nc(-c3cnccn3)n2)cc1	ZINC000070451648	402260355	/nfs/dbraw/zinc/26/03/55/402260355.db2.gz	HAMVTJNZMBRMMG-UHFFFAOYSA-N	0	3	318.384	2.010	10	0		DEAEHN
CC[C@H](C(=O)NC[C@H]1CCCCN1Cc1ccccc1)N(C)C	ZINC000124995254	402208216	/nfs/dbraw/zinc/20/82/16/402208216.db2.gz	IUGJUZPVNPXGEZ-QZTJIDSGSA-N	0	3	317.477	2.498	10	0		DEAEHN
CC(C)N1CCO[C@H](CN2CCN(CC3CCCCC3)CC2)C1	ZINC000105845691	402209965	/nfs/dbraw/zinc/20/99/65/402209965.db2.gz	XYXVHYSTWKJKBB-LJQANCHMSA-N	0	3	323.525	2.294	10	0		DEAEHN
COc1ccccc1N1CC[C@H](NCc2ccc(CO)o2)C1	ZINC000154415138	402211388	/nfs/dbraw/zinc/21/13/88/402211388.db2.gz	SPBYDOHEYCCFOF-ZDUSSCGKSA-N	0	3	302.374	2.149	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2csc(Br)c2)C1	ZINC000070916229	402266959	/nfs/dbraw/zinc/26/69/59/402266959.db2.gz	TVGQIZUFFRKUGX-SECBINFHSA-N	0	3	303.225	2.287	10	0		DEAEHN
CCOc1cccc(NC(=O)NC[C@H]2CCCN2CCOC)c1	ZINC000110090845	402281338	/nfs/dbraw/zinc/28/13/38/402281338.db2.gz	QKDZYKITBJCEEI-OAHLLOKOSA-N	0	3	321.421	2.318	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@@H]1CCCN1c1nccs1	ZINC000156685244	402286982	/nfs/dbraw/zinc/28/69/82/402286982.db2.gz	WGXHWOAFBQFIMN-KBPBESRZSA-N	0	3	324.494	2.204	10	0		DEAEHN
Cc1ccc(C[C@@H](C)N(C)CCN2C(=O)NC(C)(C)C2=O)cc1	ZINC000156879274	402289464	/nfs/dbraw/zinc/28/94/64/402289464.db2.gz	WBQURTNBSUOWGR-CQSZACIVSA-N	0	3	317.433	2.188	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCCOCc1ccccc1	ZINC000176226891	402292414	/nfs/dbraw/zinc/29/24/14/402292414.db2.gz	QIYIFOOTNOBBEV-KRWDZBQOSA-N	0	3	321.465	2.479	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1ccc(OC)c(O)c1	ZINC000176236904	402292999	/nfs/dbraw/zinc/29/29/99/402292999.db2.gz	HNZWJWRVWGPGSO-AWEZNQCLSA-N	0	3	321.421	2.027	10	0		DEAEHN
CCC[C@H](C(=O)N1CCN(Cc2cccc(F)c2)CC1)N(C)C	ZINC000157999818	402300686	/nfs/dbraw/zinc/30/06/86/402300686.db2.gz	VQHKZORLGKVAGA-QGZVFWFLSA-N	0	3	321.440	2.200	10	0		DEAEHN
CC[C@@H](Oc1ccccc1C)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000176520194	402316622	/nfs/dbraw/zinc/31/66/22/402316622.db2.gz	FCIZZGKHUHZTGH-HZPDHXFCSA-N	0	3	302.418	2.459	10	0		DEAEHN
COc1cccc(C(=O)N[C@H](C)C[NH+]2CCCCCC2)c1[O-]	ZINC000185431450	402351745	/nfs/dbraw/zinc/35/17/45/402351745.db2.gz	ZZXXYFYPVYYELL-CYBMUJFWSA-N	0	3	306.406	2.395	10	0		DEAEHN
CN(C)S(=O)(=O)CCN[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000230992903	402354017	/nfs/dbraw/zinc/35/40/17/402354017.db2.gz	WNLUESQGJRCTRN-AWEZNQCLSA-N	0	3	316.854	2.272	10	0		DEAEHN
CCCC(=O)N1CCCC[C@H]1C(=O)N(C)C[C@@H]1CCCN1CC	ZINC000176990255	402357431	/nfs/dbraw/zinc/35/74/31/402357431.db2.gz	CEIGFYXRECFQNG-HOTGVXAUSA-N	0	3	323.481	2.110	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)[C@@H]1CSCCS1	ZINC000177009679	402359408	/nfs/dbraw/zinc/35/94/08/402359408.db2.gz	RABRVZAASNOWPP-GJZGRUSLSA-N	0	3	324.515	2.124	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1cccc(OC)c1	ZINC000177024523	402360250	/nfs/dbraw/zinc/36/02/50/402360250.db2.gz	LWOOMRUFKRMKQD-HNNXBMFYSA-N	0	3	305.422	2.321	10	0		DEAEHN
COC[C@@H](C)OC[C@@H](O)CN(C)Cc1ccc(Cl)cc1	ZINC000234745870	402361076	/nfs/dbraw/zinc/36/10/76/402361076.db2.gz	GPJKYYCXCRTLCX-DOMZBBRYSA-N	0	3	301.814	2.184	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](N[C@H](C(=O)N(C)C)c2ccccc2)C1	ZINC000177126113	402372289	/nfs/dbraw/zinc/37/22/89/402372289.db2.gz	RJFAEWQZLQIZMM-PVAVHDDUSA-N	0	3	303.450	2.134	10	0		DEAEHN
COCCC(C)(C)CNC(=O)c1ccccc1OCCN(C)C	ZINC000185860195	402383392	/nfs/dbraw/zinc/38/33/92/402383392.db2.gz	SMYFOGGEBWZIDM-UHFFFAOYSA-N	0	3	322.449	2.420	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1C(=O)[C@H](C)N1CCCCCC1	ZINC000177222583	402383443	/nfs/dbraw/zinc/38/34/43/402383443.db2.gz	LTOSSVRDPHXDHS-DOTOQJQBSA-N	0	3	318.465	2.447	10	0		DEAEHN
C[C@H]1CN(c2ccc(CNCc3cccn3C)cn2)C[C@H](C)O1	ZINC000161657207	402394658	/nfs/dbraw/zinc/39/46/58/402394658.db2.gz	XPBUOONJQKHXHI-GJZGRUSLSA-N	0	3	314.433	2.324	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccc(-n2ccnc2)c(F)c1)N(C)C	ZINC000161774184	402398699	/nfs/dbraw/zinc/39/86/99/402398699.db2.gz	UQUKTGCIJMHBQK-MRXNPFEDSA-N	0	3	318.396	2.358	10	0		DEAEHN
Cc1ccc2ncnc(N3CCN(CC(C)(C)O)C[C@@H]3C)c2c1	ZINC000186633287	402449437	/nfs/dbraw/zinc/44/94/37/402449437.db2.gz	IEDUGODNHBJSMX-AWEZNQCLSA-N	0	3	314.433	2.220	10	0		DEAEHN
CCC[C@H](N)C(=O)NC[C@@H](O)c1c(Cl)cccc1Cl	ZINC000161796296	402399753	/nfs/dbraw/zinc/39/97/53/402399753.db2.gz	JUJHLHSCVFZSKD-WDEREUQCSA-N	0	3	305.205	2.270	10	0		DEAEHN
CCO[C@H]1C[C@@H](NCc2ccc(OC)c(O)c2)C12CCOCC2	ZINC000186306546	402419302	/nfs/dbraw/zinc/41/93/02/402419302.db2.gz	OPCWSDMCBCCOFI-SJORKVTESA-N	0	3	321.417	2.465	10	0		DEAEHN
COCCC1(CNC(=O)N2CCCN(C3CC3)CC2)CCCC1	ZINC000177618238	402421107	/nfs/dbraw/zinc/42/11/07/402421107.db2.gz	UWFHBLBIHUUVCJ-UHFFFAOYSA-N	0	3	323.481	2.463	10	0		DEAEHN
COCCC1(CNC(=O)N2CCN3CCC[C@H]3C2)CCCC1	ZINC000177618105	402421190	/nfs/dbraw/zinc/42/11/90/402421190.db2.gz	MRHLJFNHCMJAOA-HNNXBMFYSA-N	0	3	309.454	2.073	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)Nc1ccc(F)c(F)c1	ZINC000177699921	402427981	/nfs/dbraw/zinc/42/79/81/402427981.db2.gz	SWRMKKGGAMHCQN-CYBMUJFWSA-N	0	3	311.376	2.319	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)Nc1ccc(Cl)cn1	ZINC000177709499	402429152	/nfs/dbraw/zinc/42/91/52/402429152.db2.gz	NWXQRYMEDAPJFF-GXTWGEPZSA-N	0	3	324.856	2.478	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1cccc(-c2nc[nH]n2)c1	ZINC000162771351	402431126	/nfs/dbraw/zinc/43/11/26/402431126.db2.gz	RZIQKDAREUAHDG-OAHLLOKOSA-N	0	3	315.421	2.178	10	0		DEAEHN
COc1ccc([C@H](C)NCCC(=O)NC(C)C)cc1NC(C)=O	ZINC000177867967	402441989	/nfs/dbraw/zinc/44/19/89/402441989.db2.gz	PQVCKOXRTXCHNG-LBPRGKRZSA-N	0	3	321.421	2.219	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1ccc2c(c1)COC(C)(C)O2	ZINC000186625857	402449014	/nfs/dbraw/zinc/44/90/14/402449014.db2.gz	KWLRQSPOAYVIJY-TZMCWYRMSA-N	0	3	318.417	2.418	10	0		DEAEHN
Cc1csc([C@@H]2CCCN([C@H](C)CN3CCOCC3)C2)n1	ZINC000246098998	402510159	/nfs/dbraw/zinc/51/01/59/402510159.db2.gz	OJQJBFMXZLLYAW-HUUCEWRRSA-N	0	3	309.479	2.352	10	0		DEAEHN
CCOC(=O)C[C@@](C)(NCC(=O)NC(C)(C)CC)C(C)C	ZINC000186677155	402454617	/nfs/dbraw/zinc/45/46/17/402454617.db2.gz	KNQXBPISZQPVCZ-MRXNPFEDSA-N	0	3	300.443	2.249	10	0		DEAEHN
COc1ccc2c(c1)[C@H](NCc1cccnc1-n1cncn1)CC2	ZINC000178050849	402455532	/nfs/dbraw/zinc/45/55/32/402455532.db2.gz	BZCJEOUTKXYXET-QGZVFWFLSA-N	0	3	321.384	2.448	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)c1cnc(-c2ccncc2)s1	ZINC000186725332	402460145	/nfs/dbraw/zinc/46/01/45/402460145.db2.gz	OCKVIRDRPHXTDO-UHFFFAOYSA-N	0	3	316.430	2.371	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)[C@@H](C)N1CCN2CCC[C@H]2C1	ZINC000245482710	402464988	/nfs/dbraw/zinc/46/49/88/402464988.db2.gz	ZLANQJROUSNXFN-AEFFLSMTSA-N	0	3	315.461	2.122	10	0		DEAEHN
CS[C@H](C)CNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245629511	402475017	/nfs/dbraw/zinc/47/50/17/402475017.db2.gz	HIZKFQBDCKMSLW-SNPRPXQTSA-N	0	3	307.463	2.483	10	0		DEAEHN
Cc1nn(C)c2ncc(CN3CCC[C@H]3Cn3ccnc3C)cc12	ZINC000178303560	402482992	/nfs/dbraw/zinc/48/29/92/402482992.db2.gz	XWWXDJQWFVOTEC-INIZCTEOSA-N	0	3	324.432	2.446	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000245746615	402484651	/nfs/dbraw/zinc/48/46/51/402484651.db2.gz	CSSDRXKNVHYXKH-KGLIPLIRSA-N	0	3	324.494	2.446	10	0		DEAEHN
COc1ccc([C@H](C)CN2CCN(C[C@H](C)O)[C@@H](C)C2)cc1	ZINC000245867695	402492576	/nfs/dbraw/zinc/49/25/76/402492576.db2.gz	QRVXRWLDQARHTO-PMPSAXMXSA-N	0	3	306.450	2.186	10	0		DEAEHN
C[C@@H]1CN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)[C@H](C)CO1	ZINC000246048241	402505626	/nfs/dbraw/zinc/50/56/26/402505626.db2.gz	XUCRRNSRTIHMJS-SRABZTEZSA-N	0	3	317.433	2.251	10	0		DEAEHN
C[C@H](O)CCN(C)C[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000246726725	402542511	/nfs/dbraw/zinc/54/25/11/402542511.db2.gz	MONFQVMHKPWQNC-WDEREUQCSA-N	0	3	322.232	2.436	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(F)cc2nccnc21	ZINC000246995528	402553059	/nfs/dbraw/zinc/55/30/59/402553059.db2.gz	FIMHAGMBDUYWTM-YPMHNXCESA-N	0	3	314.364	2.078	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2ccc(NC(=O)C3CC3)cc2)C1	ZINC000171074266	402554840	/nfs/dbraw/zinc/55/48/40/402554840.db2.gz	QTKWJVDSCUDADF-HNNXBMFYSA-N	0	3	316.405	2.203	10	0		DEAEHN
CC(C)c1ccc([C@H](C)NC(=O)NC[C@](C)(O)CN(C)C)cc1	ZINC000178920627	402555695	/nfs/dbraw/zinc/55/56/95/402555695.db2.gz	RIVMTPVXSKRFGZ-KSSFIOAISA-N	0	3	321.465	2.483	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(Br)o1	ZINC000247492824	402569602	/nfs/dbraw/zinc/56/96/02/402569602.db2.gz	UISOAWGHZJELHW-ZJUUUORDSA-N	0	3	313.195	2.351	10	0		DEAEHN
CN(C)Cc1ccccc1CNC(=O)c1cnn2c1CCCC2	ZINC000179082279	402571271	/nfs/dbraw/zinc/57/12/71/402571271.db2.gz	ATGYOOLICNMXLO-UHFFFAOYSA-N	0	3	312.417	2.211	10	0		DEAEHN
C[C@@H](C(=O)N1C[C@H](C)C[C@H](C)C1)N1CCCN(C2CC2)CC1	ZINC000246181065	402516297	/nfs/dbraw/zinc/51/62/97/402516297.db2.gz	RLPOOSGROQRZRC-XHSDSOJGSA-N	0	3	307.482	2.050	10	0		DEAEHN
CCN(CC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)C1CC1	ZINC000246195972	402517786	/nfs/dbraw/zinc/51/77/86/402517786.db2.gz	ACTYOUVBBRAXNR-WBVHZDCISA-N	0	3	315.461	2.250	10	0		DEAEHN
C[C@H](C(=O)Nc1cccc2ncccc21)N1CCN2CCC[C@@H]2C1	ZINC000178625145	402519064	/nfs/dbraw/zinc/51/90/64/402519064.db2.gz	UWZOKVBHIUXRFI-HUUCEWRRSA-N	0	3	324.428	2.342	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H](c2ccccc2)CN(Cc2cncn2C)C1	ZINC000246248768	402520509	/nfs/dbraw/zinc/52/05/09/402520509.db2.gz	IZTUDPUKWSWPPB-HZPDHXFCSA-N	0	3	313.401	2.199	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)[C@@H](C)N2CCN3CCC[C@@H]3C2)c1	ZINC000178637847	402520969	/nfs/dbraw/zinc/52/09/69/402520969.db2.gz	SRZXZJPBWZPPHB-NVXWUHKLSA-N	0	3	301.434	2.410	10	0		DEAEHN
Cc1ccc(OCCCNC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170836126	402531351	/nfs/dbraw/zinc/53/13/51/402531351.db2.gz	HDGIUMPMMZAFQH-HNNXBMFYSA-N	0	3	305.422	2.109	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCc2nc3ccccc3s2)C1	ZINC000170861279	402534411	/nfs/dbraw/zinc/53/44/11/402534411.db2.gz	WMAFRDNVRAPCHQ-NSHDSACASA-N	0	3	304.419	2.142	10	0		DEAEHN
COC(=O)c1ccc(NC(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1	ZINC000246523566	402535435	/nfs/dbraw/zinc/53/54/35/402535435.db2.gz	ULMHOIYPQUKFNN-SWLSCSKDSA-N	0	3	319.405	2.323	10	0		DEAEHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)NCCCc1ccccn1	ZINC000179185034	402578830	/nfs/dbraw/zinc/57/88/30/402578830.db2.gz	KAGUVIIPBBFHAV-JKSUJKDBSA-N	0	3	318.465	2.434	10	0		DEAEHN
CN1CC[C@H](NC(=O)N2CCOC(C)(C)C2)[C@H]1c1ccccc1	ZINC000179276404	402583663	/nfs/dbraw/zinc/58/36/63/402583663.db2.gz	SJPDDIOABZMFNI-JKSUJKDBSA-N	0	3	317.433	2.252	10	0		DEAEHN
C[C@@H]1CN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CCS1	ZINC000171429942	402587258	/nfs/dbraw/zinc/58/72/58/402587258.db2.gz	RSFRYGRTVUCZAK-ZBFHGGJFSA-N	0	3	321.490	2.306	10	0		DEAEHN
C[C@@]1(O)CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000248370873	402587887	/nfs/dbraw/zinc/58/78/87/402587887.db2.gz	YAXJUEFJVQIWKL-QMTHXVAHSA-N	0	3	320.216	2.190	10	0		DEAEHN
CC(C)[C@@H](CO)N(Cc1ccccc1)C[C@@H](O)C(F)(F)F	ZINC000248400082	402589039	/nfs/dbraw/zinc/58/90/39/402589039.db2.gz	WVMOPILJSDRPME-ZIAGYGMSSA-N	0	3	305.340	2.429	10	0		DEAEHN
O=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCOC1	ZINC000171551352	402593312	/nfs/dbraw/zinc/59/33/12/402593312.db2.gz	PSXOPPMGPCZGSG-KRWDZBQOSA-N	0	3	317.433	2.129	10	0		DEAEHN
C[C@@H](Nc1ccc(OC2CCN(C)CC2)nc1)[C@H]1CCOC1	ZINC000179743354	402599749	/nfs/dbraw/zinc/59/97/49/402599749.db2.gz	PMTGHRHQSFDFQN-KGLIPLIRSA-N	0	3	305.422	2.392	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(Cc2cscn2)C1	ZINC000190477583	402604106	/nfs/dbraw/zinc/60/41/06/402604106.db2.gz	CXLVCEXTEMUEFF-HNNXBMFYSA-N	0	3	302.447	2.492	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)Nc2ccon2)C1	ZINC000190509801	402606223	/nfs/dbraw/zinc/60/62/23/402606223.db2.gz	QKVBIFPLIJCVSO-AWEZNQCLSA-N	0	3	315.377	2.055	10	0		DEAEHN
Cc1cccc(C)c1OC[C@H](O)CN1[C@H](C)CC(O)C[C@H]1C	ZINC000248823200	402609872	/nfs/dbraw/zinc/60/98/72/402609872.db2.gz	JMXOSSFRTCNOQU-BFYDXBDKSA-N	0	3	307.434	2.277	10	0		DEAEHN
Cc1cc(C(=O)N2CCN3CCC[C@@H]3C2)nn1-c1ccc(C)cc1	ZINC000180284932	402612196	/nfs/dbraw/zinc/61/21/96/402612196.db2.gz	ATVXAFCOKGJFAG-QGZVFWFLSA-N	0	3	324.428	2.409	10	0		DEAEHN
CSC[C@H](C)C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190604586	402613143	/nfs/dbraw/zinc/61/31/43/402613143.db2.gz	XLOYVIYGNNMHQE-HOCLYGCPSA-N	0	3	321.490	2.361	10	0		DEAEHN
COc1ccnc(CN2CCC[C@@H]2Cn2ccnc2C)c1OC	ZINC000190641261	402615510	/nfs/dbraw/zinc/61/55/10/402615510.db2.gz	BFKQNWVRMPFPGP-CQSZACIVSA-N	0	3	316.405	2.268	10	0		DEAEHN
COc1ccc(O)cc1C(=O)NC[C@@H](C)N1CCC[C@@H](C)C1	ZINC000249114895	402621232	/nfs/dbraw/zinc/62/12/32/402621232.db2.gz	NQPAATHCTHFZPQ-CHWSQXEVSA-N	0	3	306.406	2.251	10	0		DEAEHN
CCc1cc(NC(=O)C(=O)NCCN(C)[C@H](C)CC)ccc1C	ZINC000180598820	402621607	/nfs/dbraw/zinc/62/16/07/402621607.db2.gz	VOUCEKAFLVMRJY-CQSZACIVSA-N	0	3	319.449	2.342	10	0		DEAEHN
C[C@@H](NCC(=O)NCc1ccco1)c1cccc(-n2ccnc2)c1	ZINC000180659321	402622528	/nfs/dbraw/zinc/62/25/28/402622528.db2.gz	ULRXETIXQLSRJI-CQSZACIVSA-N	0	3	324.384	2.432	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)CC(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)C1	ZINC000249606407	402636507	/nfs/dbraw/zinc/63/65/07/402636507.db2.gz	ZUEWPODXDNTQRO-DXWTWGPWSA-N	0	3	310.482	2.410	10	0		DEAEHN
CCN1CCN(CCCCNC(=O)N[C@H](C)C2CCCC2)CC1	ZINC000172182756	402643959	/nfs/dbraw/zinc/64/39/59/402643959.db2.gz	GOOPRMNZCIGCRG-MRXNPFEDSA-N	0	3	324.513	2.282	10	0		DEAEHN
O=C(C[C@H]1OCCc2ccccc21)N1CCCN(C2CC2)CC1	ZINC000172207351	402645312	/nfs/dbraw/zinc/64/53/12/402645312.db2.gz	WXVBBPHQOWDITC-GOSISDBHSA-N	0	3	314.429	2.387	10	0		DEAEHN
CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000172480142	402658479	/nfs/dbraw/zinc/65/84/79/402658479.db2.gz	RUGIDPFRDVUZGY-ARFHVFGLSA-N	0	3	323.481	2.317	10	0		DEAEHN
CCO[C@H]1C[C@@H](NCc2cccnc2-n2cncn2)C12CCC2	ZINC000181504922	402648059	/nfs/dbraw/zinc/64/80/59/402648059.db2.gz	OZSASDDBKIFKJE-CABCVRRESA-N	0	3	313.405	2.100	10	0		DEAEHN
C[C@@H]1C[C@H](C)CN(C(=O)CN[C@@H]2CCCC[C@H]2n2cccn2)C1	ZINC000251687242	402648729	/nfs/dbraw/zinc/64/87/29/402648729.db2.gz	ONIUKKUFJMMNJC-YYIAUSFCSA-N	0	3	318.465	2.461	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COc2c(C)cccc2C)CC[C@H]1C	ZINC000251887170	402650672	/nfs/dbraw/zinc/65/06/72/402650672.db2.gz	QBEMHJPJZMDPEN-XOKHGSTOSA-N	0	3	307.434	2.400	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NC[C@H](C)N2CCC[C@@H](C)C2)CC[C@H]1C	ZINC000251871163	402650841	/nfs/dbraw/zinc/65/08/41/402650841.db2.gz	PAFHNRGQJPDBBW-LVQVYYBASA-N	0	3	311.470	2.173	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NC[C@H](C)N2CCC[C@H](C)C2)CC[C@H]1C	ZINC000251871167	402650936	/nfs/dbraw/zinc/65/09/36/402650936.db2.gz	PAFHNRGQJPDBBW-XUWVNRHRSA-N	0	3	311.470	2.173	10	0		DEAEHN
C[C@H](C(=O)NCc1ccccc1F)N1CCCN(C2CC2)CC1	ZINC000172346891	402651478	/nfs/dbraw/zinc/65/14/78/402651478.db2.gz	MIZRYNHOAGIPGC-CQSZACIVSA-N	0	3	319.424	2.001	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H](CCO)C2CCCCC2)C1	ZINC000252653258	402659974	/nfs/dbraw/zinc/65/99/74/402659974.db2.gz	RMSFBNJZWHOOLP-HZPDHXFCSA-N	0	3	311.470	2.101	10	0		DEAEHN
CNC(=O)c1ccc(CN(C)C[C@H](O)C2CCCCC2)cc1	ZINC000191267648	402655501	/nfs/dbraw/zinc/65/55/01/402655501.db2.gz	KOCBUTVBTXIFBV-KRWDZBQOSA-N	0	3	304.434	2.419	10	0		DEAEHN
CCOCCN1CCN(Cc2ccc(CO)cc2)C[C@H]1CC	ZINC000182751997	402714216	/nfs/dbraw/zinc/71/42/16/402714216.db2.gz	LGVDTJJKKOJYHM-GOSISDBHSA-N	0	3	306.450	2.112	10	0		DEAEHN
Cc1cc(S(=O)(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)ccc1F	ZINC000173886428	402716840	/nfs/dbraw/zinc/71/68/40/402716840.db2.gz	XJIJKOCGFHLKOG-WFASDCNBSA-N	0	3	314.426	2.141	10	0		DEAEHN
COC(=O)c1ccc(F)c(CN2CCCN(C3CC3)CC2)c1	ZINC000181903817	402660403	/nfs/dbraw/zinc/66/04/03/402660403.db2.gz	ZCCTWXUBWUDRDK-UHFFFAOYSA-N	0	3	306.381	2.282	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N(C)[C@@H]1CCN(C)C[C@@H]1C	ZINC000253202727	402661854	/nfs/dbraw/zinc/66/18/54/402661854.db2.gz	CSKJYRJADICPIT-SWLSCSKDSA-N	0	3	323.412	2.316	10	0		DEAEHN
Cc1c([C@@H](C)NC[C@@]2(CCO)CCOC2)cnn1C(C)(C)C	ZINC000191344693	402662713	/nfs/dbraw/zinc/66/27/13/402662713.db2.gz	CBBDVMLUNLYIIY-CXAGYDPISA-N	0	3	309.454	2.386	10	0		DEAEHN
CC(C)OC(=O)CCN[C@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000182195401	402671563	/nfs/dbraw/zinc/67/15/63/402671563.db2.gz	ALDMZVYVUHAHMW-GFCCVEGCSA-N	0	3	313.419	2.082	10	0		DEAEHN
COCCN1CCC(NC(=O)NC/C=C\c2ccccc2)CC1	ZINC000254981204	402674321	/nfs/dbraw/zinc/67/43/21/402674321.db2.gz	PPWPOEWRNLYEGW-YVMONPNESA-N	0	3	317.433	2.110	10	0		DEAEHN
CCOc1cc(/C=C/C(=O)N[C@H]2CCCN(CC)C2)ccc1O	ZINC000182388886	402685806	/nfs/dbraw/zinc/68/58/06/402685806.db2.gz	BFDOBEIPTUMTPA-HQPKTYMTSA-N	0	3	318.417	2.405	10	0		DEAEHN
CCOc1cc(/C=C/C(=O)N2CCN3CCC[C@H]3C2)ccc1O	ZINC000182391073	402686319	/nfs/dbraw/zinc/68/63/19/402686319.db2.gz	LEFQQOKKIRKCQL-VFADXPBXSA-N	0	3	316.401	2.111	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	ZINC000191691565	402686476	/nfs/dbraw/zinc/68/64/76/402686476.db2.gz	XBQAUXDYFFCJHB-BYCMXARLSA-N	0	3	308.809	2.460	10	0		DEAEHN
Fc1cc2cccnc2c(CN2CC[C@@H](N3CCOCC3)C2)c1	ZINC000173932459	402720263	/nfs/dbraw/zinc/72/02/63/402720263.db2.gz	ZMQNUSSGTTZPFJ-QGZVFWFLSA-N	0	3	315.392	2.280	10	0		DEAEHN
Cc1cc(C)cc(OCCCN2CC[C@@H](N3CCOCC3)C2)c1	ZINC000173944456	402720707	/nfs/dbraw/zinc/72/07/07/402720707.db2.gz	AHPVXZKOVWHVBB-GOSISDBHSA-N	0	3	318.461	2.479	10	0		DEAEHN
CC(C)c1ccc([C@H](C)N(C)CC(=O)N2CCNCC2)cc1	ZINC000261969970	402720876	/nfs/dbraw/zinc/72/08/76/402720876.db2.gz	PYAFPQCNGGDNGC-HNNXBMFYSA-N	0	3	303.450	2.235	10	0		DEAEHN
C[C@@H](C(=O)N[C@@H](Cc1ccccc1)CN(C)C)c1cccnc1	ZINC000174171093	402730114	/nfs/dbraw/zinc/73/01/14/402730114.db2.gz	OHESIYXNOXXJKO-QAPCUYQASA-N	0	3	311.429	2.474	10	0		DEAEHN
CC(C)CCn1cc(C(=O)NC2C[C@H]3CCC[C@@H](C2)N3C)nn1	ZINC000174254981	402733811	/nfs/dbraw/zinc/73/38/11/402733811.db2.gz	UJNLAIIHKYNIDH-GOOCMWNKSA-N	0	3	319.453	2.069	10	0		DEAEHN
COc1ccc2c(c1)CCCN2C(=O)CN[C@@H](C)[C@@H]1CCCO1	ZINC000183119926	402740690	/nfs/dbraw/zinc/74/06/90/402740690.db2.gz	MCNVJFMSOAALKV-GUYCJALGSA-N	0	3	318.417	2.132	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)Nc1cnn(CC2CC2)c1	ZINC000174481752	402743492	/nfs/dbraw/zinc/74/34/92/402743492.db2.gz	RGAGMKCZLVQONL-CYBMUJFWSA-N	0	3	305.426	2.289	10	0		DEAEHN
Cc1cccc(OCCNC(=O)[C@H](C)N[C@@H](C)[C@@H]2CCCO2)c1	ZINC000183193736	402746462	/nfs/dbraw/zinc/74/64/62/402746462.db2.gz	JJPOIBKEVTXLBW-ZOBUZTSGSA-N	0	3	320.433	2.036	10	0		DEAEHN
Cc1ccc(CSCc2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263283907	402754378	/nfs/dbraw/zinc/75/43/78/402754378.db2.gz	USIJVZXTMABJEP-CQSZACIVSA-N	0	3	318.446	2.388	10	0		DEAEHN
C[C@@H](CNC(=O)N1CC[C@@H](N2CC=CC2)C1)Oc1ccccc1	ZINC000174916107	402762691	/nfs/dbraw/zinc/76/26/91/402762691.db2.gz	AEKKXJYEWSFKIX-JKSUJKDBSA-N	0	3	315.417	2.110	10	0		DEAEHN
C[C@H](CNC(=O)N1CC[C@@H](N2CC=CC2)C1)Oc1ccccc1	ZINC000174916127	402762836	/nfs/dbraw/zinc/76/28/36/402762836.db2.gz	AEKKXJYEWSFKIX-HZPDHXFCSA-N	0	3	315.417	2.110	10	0		DEAEHN
C[C@@H]1CN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)[C@H](C)CO1	ZINC000183395678	402762987	/nfs/dbraw/zinc/76/29/87/402762987.db2.gz	XUCRRNSRTIHMJS-MUIFIZLQSA-N	0	3	317.433	2.251	10	0		DEAEHN
Cc1cc(C)cc([C@@H]2CCN(C[C@H](O)CN3CCCC3=O)C2)c1	ZINC000183473592	402770349	/nfs/dbraw/zinc/77/03/49/402770349.db2.gz	RHWNSCAWMYFDSF-AEFFLSMTSA-N	0	3	316.445	2.076	10	0		DEAEHN
CCc1ccc([C@H]2CNCCN2C(=O)CN(CC)CC)cc1	ZINC000262055388	402722055	/nfs/dbraw/zinc/72/20/55/402722055.db2.gz	VHXPMVPRLMDLCG-QGZVFWFLSA-N	0	3	303.450	2.064	10	0		DEAEHN
CCc1cnc(CCNC(=O)NCCN2CCCC[C@@H]2C)s1	ZINC000173991030	402723101	/nfs/dbraw/zinc/72/31/01/402723101.db2.gz	NAUMNQDUBOVRSA-ZDUSSCGKSA-N	0	3	324.494	2.422	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2CCCc3cccnc32)CCN1C	ZINC000194450925	402798218	/nfs/dbraw/zinc/79/82/18/402798218.db2.gz	WDAUDRHNOZRJGQ-VNQPRFMTSA-N	0	3	301.434	2.443	10	0		DEAEHN
O=C(CCn1cnc2ccccc21)N1CCCN(C2CC2)CC1	ZINC000194506431	402800940	/nfs/dbraw/zinc/80/09/40/402800940.db2.gz	BPCRTQXEVYBAKK-UHFFFAOYSA-N	0	3	312.417	2.123	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)S(=O)(=O)c1ccc(C)cc1C	ZINC000175398856	402803032	/nfs/dbraw/zinc/80/30/32/402803032.db2.gz	MSZDWWUXANSKPV-HNNXBMFYSA-N	0	3	310.463	2.408	10	0		DEAEHN
OC[C@@H](NCCOCC1CC1)c1cccc(Br)c1	ZINC000183888330	402803548	/nfs/dbraw/zinc/80/35/48/402803548.db2.gz	BOXAQUHPDYZJAQ-CQSZACIVSA-N	0	3	314.223	2.499	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1nn(-c2ccccc2)c2c1CCC2	ZINC000194715349	402812203	/nfs/dbraw/zinc/81/22/03/402812203.db2.gz	ADCXGFIERRYXEF-HNNXBMFYSA-N	0	3	324.428	2.185	10	0		DEAEHN
COc1ccc2cc(C(=O)NC[C@@H]3CCCN3C)c(C)nc2c1	ZINC000194717333	402812759	/nfs/dbraw/zinc/81/27/59/402812759.db2.gz	WBIFORAEQCIUEE-AWEZNQCLSA-N	0	3	313.401	2.376	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)Cc1cccc(Br)c1	ZINC000194834235	402817649	/nfs/dbraw/zinc/81/76/49/402817649.db2.gz	XNIPXMCOPZKTLH-ZDUSSCGKSA-N	0	3	311.223	2.202	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(C[C@@H](O)COC(C)C)C2)c1	ZINC000175598001	402820670	/nfs/dbraw/zinc/82/06/70/402820670.db2.gz	VJZXZTSRQZXGQO-GOEBONIOSA-N	0	3	323.433	2.279	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1cc(F)cc2nccnc21	ZINC000194920075	402822970	/nfs/dbraw/zinc/82/29/70/402822970.db2.gz	FFHGPZZDFNIPMC-CYBMUJFWSA-N	0	3	318.396	2.475	10	0		DEAEHN
C[C@H](O)c1ccc(CNC(=O)N2CCCN(C3CC3)CC2)cc1	ZINC000195090212	402831228	/nfs/dbraw/zinc/83/12/28/402831228.db2.gz	XWJKKXGHWLURRG-AWEZNQCLSA-N	0	3	317.433	2.120	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC[C@@H]1C[C@H](O)c1ccco1	ZINC000195183696	402835219	/nfs/dbraw/zinc/83/52/19/402835219.db2.gz	UZMAAVFXEXYUEM-OAGGEKHMSA-N	0	3	311.422	2.345	10	0		DEAEHN
CCN1CCN(C[C@@H](C)CNC(=O)N2CCCC(C)(C)C2)CC1	ZINC000175818486	402835232	/nfs/dbraw/zinc/83/52/32/402835232.db2.gz	CKHIYJMMBIYBBM-INIZCTEOSA-N	0	3	324.513	2.092	10	0		DEAEHN
CC1CCN(CCNC(=O)N[C@H]2COc3ccccc32)CC1	ZINC000195197561	402835992	/nfs/dbraw/zinc/83/59/92/402835992.db2.gz	WNGHVNRCKVKALF-HNNXBMFYSA-N	0	3	303.406	2.151	10	0		DEAEHN
CCCCCS(=O)(=O)N1CCCC[C@H](N2CCCC2)C1	ZINC000184448845	402844382	/nfs/dbraw/zinc/84/43/82/402844382.db2.gz	QRLLFNMKWJWQSG-HNNXBMFYSA-N	0	3	302.484	2.457	10	0		DEAEHN
C[C@H](NC[C@@H]1CN(C)CCO1)c1cc(Br)cs1	ZINC000194091854	402784111	/nfs/dbraw/zinc/78/41/11/402784111.db2.gz	LPPYRBFTWYWLNW-GXSJLCMTSA-N	0	3	319.268	2.492	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@@H](C)N1CC[C@H](CNc2cccc(C)n2)C1	ZINC000195516250	402849339	/nfs/dbraw/zinc/84/93/39/402849339.db2.gz	GSFDMQXPJKZFEL-NUEKZKHPSA-N	0	3	318.465	2.427	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cccnc1F	ZINC000279290731	402927404	/nfs/dbraw/zinc/92/74/04/402927404.db2.gz	YOUAGRZDDVXBLO-ZDUSSCGKSA-N	0	3	301.365	2.471	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1Nc1cn[nH]c(=O)c1Cl	ZINC000274128248	403029508	/nfs/dbraw/zinc/02/95/08/403029508.db2.gz	DQDTWUJPTJNRMX-SMDDNHRTSA-N	0	3	318.808	2.356	10	0		DEAEHN
COc1ccc(NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(C)n1	ZINC000268344811	403075239	/nfs/dbraw/zinc/07/52/39/403075239.db2.gz	HISTYSPYGCULTO-WCQYABFASA-N	0	3	306.410	2.345	10	0		DEAEHN
COCCN1CC[C@H](NCc2ccsc2Br)C1	ZINC000282316327	403142952	/nfs/dbraw/zinc/14/29/52/403142952.db2.gz	SYEXCFITZTUMPS-NSHDSACASA-N	0	3	319.268	2.321	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)[C@H](C)N[C@@H]2CCOC[C@@H]2C)cc1	ZINC000277890523	403268204	/nfs/dbraw/zinc/26/82/04/403268204.db2.gz	OMXNVHMATHCWJD-MQIPJXDCSA-N	0	3	304.390	2.231	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)c2ncnc3c2ncn3C2CC2)CCN1C	ZINC000292665060	403374132	/nfs/dbraw/zinc/37/41/32/403374132.db2.gz	HKPMGIKHCCZAAZ-DGCLKSJQSA-N	0	3	300.410	2.080	10	0		DEAEHN
CNC(=O)c1cccnc1NC[C@@H](c1ccc(F)cc1)N(C)C	ZINC000301339457	403617870	/nfs/dbraw/zinc/61/78/70/403617870.db2.gz	FBVJTGYDPNEALJ-HNNXBMFYSA-N	0	3	316.380	2.295	10	0		DEAEHN
Cc1cc(N2C[C@@H]3[C@H](C2)OCCN3C)c2cc(F)ccc2n1	ZINC000301717893	403669093	/nfs/dbraw/zinc/66/90/93/403669093.db2.gz	OGCUVRDVLSXOSR-SJORKVTESA-N	0	3	301.365	2.202	10	0		DEAEHN
NCc1cccnc1NC(=O)N1CCO[C@H](C2CCCCC2)C1	ZINC000333390108	403741356	/nfs/dbraw/zinc/74/13/56/403741356.db2.gz	XHWPCJJYDBTSLG-HNNXBMFYSA-N	0	3	318.421	2.353	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@H]2CN1C[C@H](O)COCc1ccccc1	ZINC000303080315	403747110	/nfs/dbraw/zinc/74/71/10/403747110.db2.gz	MKNIMTXDOGQCET-NEWSRXKRSA-N	0	3	318.461	2.123	10	0		DEAEHN
C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)NCCNc1ccncc1	ZINC000361915047	403910388	/nfs/dbraw/zinc/91/03/88/403910388.db2.gz	GZVZVUZOZDAWOM-UKRRQHHQSA-N	0	3	304.438	2.429	10	0		DEAEHN
CO[C@H]1C[C@@H](CO)N(CCOc2ccc(C(F)(F)F)cc2)C1	ZINC000344683467	404304477	/nfs/dbraw/zinc/30/44/77/404304477.db2.gz	UWQHQAUHNRKKAZ-JSGCOSHPSA-N	0	3	319.323	2.166	10	0		DEAEHN
Cc1nc([C@@H](C)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)no1	ZINC000330251721	404600627	/nfs/dbraw/zinc/60/06/27/404600627.db2.gz	NRIGRMXAVJHSJA-HZSPNIEDSA-N	0	3	322.453	2.260	10	0		DEAEHN
COC(=O)c1cncc(NC[C@H](C)N(C)Cc2ccccc2)n1	ZINC000360119494	404819043	/nfs/dbraw/zinc/81/90/43/404819043.db2.gz	VNKLBCGXVYRAIP-ZDUSSCGKSA-N	0	3	314.389	2.196	10	0		DEAEHN
COC[C@@H](CCO)NCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000360955302	404861050	/nfs/dbraw/zinc/86/10/50/404861050.db2.gz	QRHOZAMGLXQYCS-OAHLLOKOSA-N	0	3	309.406	2.129	10	0		DEAEHN
CN(CCCNC(=O)C1CCC1)Cc1ccc(-c2cc[nH]n2)o1	ZINC000434980384	404948309	/nfs/dbraw/zinc/94/83/09/404948309.db2.gz	DJYGZUYTJSLNTK-UHFFFAOYSA-N	0	3	316.405	2.408	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)N1CCC(OCC2CCCC2)CC1	ZINC000435610093	404994279	/nfs/dbraw/zinc/99/42/79/404994279.db2.gz	GDFIMTKMTFUBEC-INIZCTEOSA-N	0	3	323.481	2.461	10	0		DEAEHN
C[C@H](C(=O)NCCNc1ccncc1)c1cn(C)c2ccccc12	ZINC000361363402	405040505	/nfs/dbraw/zinc/04/05/05/405040505.db2.gz	YNTJQORCXQWZGP-AWEZNQCLSA-N	0	3	322.412	2.327	10	0		DEAEHN
CC(C)C(=O)N[C@@H]1CCCN(C(=O)[C@@H](C)N2[C@H](C)CC[C@@H]2C)C1	ZINC000407978999	405082451	/nfs/dbraw/zinc/08/24/51/405082451.db2.gz	MTDQUMQSFXNXNU-QKPAOTATSA-N	0	3	323.481	2.011	10	0		DEAEHN
C/C=C/C[C@H](NC(=O)[C@@H](C)N1CCCCCC1)C(=O)OCC	ZINC000361548611	405126717	/nfs/dbraw/zinc/12/67/17/405126717.db2.gz	GWLWBSWVRWQDEU-WBNAFJIESA-N	0	3	310.438	2.265	10	0		DEAEHN
C[C@H]1CN2CCCC[C@@H]2CN1Cc1nc(-c2ccoc2)no1	ZINC000408183446	405132860	/nfs/dbraw/zinc/13/28/60/405132860.db2.gz	RTOAQGGBSXEMEB-GXTWGEPZSA-N	0	3	302.378	2.388	10	0		DEAEHN
C[C@H]1CC(CCN2CCC[C@@H]2CS(N)(=O)=O)C[C@H](C)C1	ZINC000408245658	405151631	/nfs/dbraw/zinc/15/16/31/405151631.db2.gz	HURSBFPHAIJYDK-UMVBOHGHSA-N	0	3	302.484	2.202	10	0		DEAEHN
CO[C@@H]1C[C@H](NCc2ccc(CS(C)(=O)=O)cc2)C12CCC2	ZINC000453064643	405280574	/nfs/dbraw/zinc/28/05/74/405280574.db2.gz	SEOPFKWTRUZOQV-JKSUJKDBSA-N	0	3	323.458	2.278	10	0		DEAEHN
c1cc(CN2C[C@@H]3C[C@H]2CS3)cc(CN2CCOCC2)c1	ZINC000420981026	405420714	/nfs/dbraw/zinc/42/07/14/405420714.db2.gz	XSSOZOSUGMZKNA-IRXDYDNUSA-N	0	3	304.459	2.209	10	0		DEAEHN
c1ccc2c(c1)CCN2CC1CCN(C[C@@H]2COCCO2)CC1	ZINC000431002532	405557300	/nfs/dbraw/zinc/55/73/00/405557300.db2.gz	CWMMPLSQWMZKNU-GOSISDBHSA-N	0	3	316.445	2.177	10	0		DEAEHN
CN(CC[C@@H]1CCCCN1C)Cc1cccc(S(C)(=O)=O)c1	ZINC000449032309	405508487	/nfs/dbraw/zinc/50/84/87/405508487.db2.gz	XACXYWAFFYUMRA-INIZCTEOSA-N	0	3	324.490	2.396	10	0		DEAEHN
C[C@@H](CN(C)C)NC(=O)N1CCc2c(Cl)cc(F)cc2C1	ZINC000458768606	405580104	/nfs/dbraw/zinc/58/01/04/405580104.db2.gz	VKUFDFHQPQWGNN-JTQLQIEISA-N	0	3	313.804	2.497	10	0		DEAEHN
COC(=O)CC1(CC(=O)N(C)[C@H]2CCN(C(C)C)C2)CCCC1	ZINC000457085418	405688616	/nfs/dbraw/zinc/68/86/16/405688616.db2.gz	HFLPEUVWJFJYJO-HNNXBMFYSA-N	0	3	324.465	2.441	10	0		DEAEHN
Cn1ccc(N2CCC[C@H](N[C@@H]3CC[C@@H]3C3CCC3)C2=O)n1	ZINC000558696369	405692067	/nfs/dbraw/zinc/69/20/67/405692067.db2.gz	UHUGSZYLQONHLW-KFWWJZLASA-N	0	3	302.422	2.084	10	0		DEAEHN
CC[C@@](C)(NC(=O)[C@@H](N)CN(C)Cc1ccccc1)C1CC1	ZINC000638858132	405720639	/nfs/dbraw/zinc/72/06/39/405720639.db2.gz	LQRUNFSHGNDQCV-FUHWJXTLSA-N	0	3	303.450	2.141	10	0		DEAEHN
CN(Cc1cccc(Br)c1)C[C@@H]1COCCO1	ZINC000450280998	405814880	/nfs/dbraw/zinc/81/48/80/405814880.db2.gz	AFKVYDGVVUZXDE-CYBMUJFWSA-N	0	3	300.196	2.296	10	0		DEAEHN
CC(C)(O)C(=O)N[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000633888084	405890777	/nfs/dbraw/zinc/89/07/77/405890777.db2.gz	KOQNHZIGQTYNQK-INIZCTEOSA-N	0	3	304.434	2.318	10	0		DEAEHN
COc1nsc(CNCC[C@@H]2CCOC2)c1Br	ZINC000639038386	405836408	/nfs/dbraw/zinc/83/64/08/405836408.db2.gz	RXBAGIRDXBXZQB-MRVPVSSYSA-N	0	3	321.240	2.430	10	0		DEAEHN
COC[C@@H](NC(=O)NC[C@@H]1CCCN(C)C1)c1ccc(F)cc1	ZINC000530768859	405858645	/nfs/dbraw/zinc/85/86/45/405858645.db2.gz	DNSSEZZNLJDYAR-XJKSGUPXSA-N	0	3	323.412	2.154	10	0		DEAEHN
COc1ccc([C@H](CO)CNCc2cnn3ccccc23)cc1	ZINC000459727447	406023052	/nfs/dbraw/zinc/02/30/52/406023052.db2.gz	FFIHLSSKQLAJJG-INIZCTEOSA-N	0	3	311.385	2.209	10	0		DEAEHN
c1nc(CN[C@@H](C2CC2)[C@H]2CCCCO2)cc2c1OCCO2	ZINC000639297282	406028466	/nfs/dbraw/zinc/02/84/66/406028466.db2.gz	RHMYQBJMDLVJLR-PBHICJAKSA-N	0	3	304.390	2.290	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(-n2cccn2)c(F)c1	ZINC000451065450	406036646	/nfs/dbraw/zinc/03/66/46/406036646.db2.gz	AIZDFFOWGYVSHX-BZNIZROVSA-N	0	3	305.353	2.002	10	0		DEAEHN
COc1cc(CNC2CCN(Cc3ccccc3)CC2)on1	ZINC000639323359	406046056	/nfs/dbraw/zinc/04/60/56/406046056.db2.gz	BCZDVKLEWQCDDB-UHFFFAOYSA-N	0	3	301.390	2.437	10	0		DEAEHN
c1nc(CNC[C@@H]2CCN2C2CCCCC2)cc2c1OCCO2	ZINC000639344715	406057901	/nfs/dbraw/zinc/05/79/01/406057901.db2.gz	BFIVYJFUHXRXAD-INIZCTEOSA-N	0	3	317.433	2.349	10	0		DEAEHN
c1nc(CN[C@H](C2CCC2)[C@H]2CCCO2)cc2c1OCCO2	ZINC000639388785	406076333	/nfs/dbraw/zinc/07/63/33/406076333.db2.gz	BGYUWWYWKXNUPE-RHSMWYFYSA-N	0	3	304.390	2.290	10	0		DEAEHN
CO[C@@H](C)[C@H](C)N[C@@H](C)c1cc(S(N)(=O)=O)c(C)cc1C	ZINC000479440642	406165535	/nfs/dbraw/zinc/16/55/35/406165535.db2.gz	XDJYOMPTPWKHLK-AVGNSLFASA-N	0	3	314.451	2.025	10	0		DEAEHN
CC(=O)c1cc(NC(=O)N[C@H]2CNCCC2(F)F)ccc1C	ZINC000519834283	406262070	/nfs/dbraw/zinc/26/20/70/406262070.db2.gz	JLMDYHYHTWICCS-ZDUSSCGKSA-N	0	3	311.332	2.316	10	0		DEAEHN
CC(=O)N1CCC(CNCc2nc3cc(F)ccc3o2)CC1	ZINC000634960669	406371987	/nfs/dbraw/zinc/37/19/87/406371987.db2.gz	ZEVNXEYTPDJDKF-UHFFFAOYSA-N	0	3	305.353	2.315	10	0		DEAEHN
CN(Cc1cnn(C)c1)C(=O)CN1CCC2(C1)CCCCC2	ZINC000525123133	406469155	/nfs/dbraw/zinc/46/91/55/406469155.db2.gz	WQAKGUCIKZHNTN-UHFFFAOYSA-N	0	3	304.438	2.035	10	0		DEAEHN
CC(=O)N(C)c1ccccc1NC(=O)[C@@H]1CNCc2ccccc21	ZINC000570925448	406456157	/nfs/dbraw/zinc/45/61/57/406456157.db2.gz	ZYIIZSIXCCOFPL-MRXNPFEDSA-N	0	3	323.396	2.495	10	0		DEAEHN
CC(C)CC[C@H](C)NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637873531	406456362	/nfs/dbraw/zinc/45/63/62/406456362.db2.gz	PCMHLDDPPSNJNF-DOTOQJQBSA-N	0	3	305.466	2.387	10	0		DEAEHN
CCC1(CNC(=O)[C@@H](N)CN(C)Cc2ccccc2)CCC1	ZINC000637991814	406512787	/nfs/dbraw/zinc/51/27/87/406512787.db2.gz	SYHQKDWHMMLFIH-INIZCTEOSA-N	0	3	303.450	2.142	10	0		DEAEHN
Cc1ccc(O)c(NC(=O)[C@H](N)CN(C)Cc2ccccc2)c1	ZINC000638200223	406619157	/nfs/dbraw/zinc/61/91/57/406619157.db2.gz	CKEIXJWLANRNTA-OAHLLOKOSA-N	0	3	313.401	2.098	10	0		DEAEHN
C[C@@H](CNC(=O)NCCOCC1CCC1)N1CCC[C@H](C)C1	ZINC000572452905	406669821	/nfs/dbraw/zinc/66/98/21/406669821.db2.gz	FUZFGYAGPKVLBT-GJZGRUSLSA-N	0	3	311.470	2.223	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NCC1(C2CC2)CCC1	ZINC000638310166	406690478	/nfs/dbraw/zinc/69/04/78/406690478.db2.gz	OKHIGEMCGNFSEE-KRWDZBQOSA-N	0	3	315.461	2.142	10	0		DEAEHN
CC[C@@H](C(=O)N1CC[C@@H](c2cc(OC)cc(OC)c2)C1)N(C)C	ZINC000133822960	286734516	/nfs/dbraw/zinc/73/45/16/286734516.db2.gz	PPAMIYXMMYHEID-DYVFJYSZSA-N	0	3	320.433	2.360	10	0		DEAEHN
C[C@@H]1C[C@H](c2cccnc2)N(C[C@@H](O)COC[C@H]2CCCO2)C1	ZINC000554264188	406789744	/nfs/dbraw/zinc/78/97/44/406789744.db2.gz	NGNAAIGUDLZANV-VDHUWJSZSA-N	0	3	320.433	2.021	10	0		DEAEHN
O=C1C[C@H](NCCCC(F)(F)F)C(=O)N1C1CCCCC1	ZINC000130546155	196089933	/nfs/dbraw/zinc/08/99/33/196089933.db2.gz	QJSJXDYRJYCDDE-NSHDSACASA-N	0	3	306.328	2.379	10	0		DEAEHN
O=C(c1cccc(F)c1Br)N1CCCNCC1	ZINC000130910958	196122289	/nfs/dbraw/zinc/12/22/89/196122289.db2.gz	QWWUFLUSXYRHOR-UHFFFAOYSA-N	0	3	301.159	2.024	10	0		DEAEHN
C[C@@]1(NC2=NCC3(CCCCC3)CS2)CCS(=O)(=O)C1	ZINC000131138067	196143512	/nfs/dbraw/zinc/14/35/12/196143512.db2.gz	GIAJFLNLSUWRDG-CYBMUJFWSA-N	0	3	316.492	2.207	10	0		DEAEHN
CCN[C@H](C)c1cccc(S(=O)(=O)NC[C@H](C)OCC)c1	ZINC000131230244	196152065	/nfs/dbraw/zinc/15/20/65/196152065.db2.gz	CMAVAVVKOGXHNJ-QWHCGFSZSA-N	0	3	314.451	2.060	10	0		DEAEHN
CCNc1nc(Cl)nc(N[C@H](CC(C)C)CN(C)C)n1	ZINC000131582979	196181880	/nfs/dbraw/zinc/18/18/80/196181880.db2.gz	OOBKLPPXVUPVJK-SNVBAGLBSA-N	0	3	300.838	2.345	10	0		DEAEHN
C[C@@H]1C[C@@H](N2C(=O)C3(CC3)N[C@H]2c2cccs2)CCN1C	ZINC000131488897	196173235	/nfs/dbraw/zinc/17/32/35/196173235.db2.gz	UPDQGJUCLDMSMH-MBNYWOFBSA-N	0	3	305.447	2.194	10	0		DEAEHN
[NH3+]CC1(C[N-]S(=O)(=O)c2ccc(F)cc2F)CCCCC1	ZINC000131562008	196180080	/nfs/dbraw/zinc/18/00/80/196180080.db2.gz	ANUKWMLPLJCMFA-UHFFFAOYSA-N	0	3	318.389	2.152	10	0		DEAEHN
CNCc1ccc(F)c(S(=O)(=O)N2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000131765166	196197719	/nfs/dbraw/zinc/19/77/19/196197719.db2.gz	ZIXGVJXDEZBOEQ-NEPJUHHUSA-N	0	3	314.426	2.212	10	0		DEAEHN
CSc1nc2ccc(NC(=O)C3(N)CCOCC3)cc2s1	ZINC000132093972	196225528	/nfs/dbraw/zinc/22/55/28/196225528.db2.gz	XLCHEGIVKGVTJN-UHFFFAOYSA-N	0	3	323.443	2.465	10	0		DEAEHN
CC(C)[C@H](CN(C)C)NC(=O)c1sc2cccnc2c1N	ZINC000132216436	196236107	/nfs/dbraw/zinc/23/61/07/196236107.db2.gz	XLTQGLWWCIATDD-JTQLQIEISA-N	0	3	306.435	2.195	10	0		DEAEHN
C[C@@H]1CNC[C@@H](COCc2ccc(Br)cc2F)O1	ZINC000132703628	196277574	/nfs/dbraw/zinc/27/75/74/196277574.db2.gz	OGJDLLQLAPFXAI-SKDRFNHKSA-N	0	3	318.186	2.482	10	0		DEAEHN
CCNc1ncc(Br)c(NCCN(C)CC)n1	ZINC000132837483	196289228	/nfs/dbraw/zinc/28/92/28/196289228.db2.gz	MWKSQJOQWQWRRU-UHFFFAOYSA-N	0	3	302.220	2.035	10	0		DEAEHN
COCc1nc(NN)cc(Nc2cccc(Br)c2)n1	ZINC000133082733	196309995	/nfs/dbraw/zinc/30/99/95/196309995.db2.gz	GXGSXDOSCFXGHT-UHFFFAOYSA-N	0	3	324.182	2.415	10	0		DEAEHN
CC[C@@H](C(=O)N1CC[C@H](c2cc(OC)cc(OC)c2)C1)N(C)C	ZINC000133822561	196338665	/nfs/dbraw/zinc/33/86/65/196338665.db2.gz	PPAMIYXMMYHEID-GUYCJALGSA-N	0	3	320.433	2.360	10	0		DEAEHN
Cc1cc(C)cc(CCC(=O)N2CCO[C@@H](CN(C)C)C2)c1	ZINC000134038633	196355540	/nfs/dbraw/zinc/35/55/40/196355540.db2.gz	XBOGQBUSQAXCTH-KRWDZBQOSA-N	0	3	304.434	2.025	10	0		DEAEHN
CCN[C@H](c1c(Cl)cnn1CCOC)[C@H]1CCO[C@@H]1C	ZINC000134048171	196357044	/nfs/dbraw/zinc/35/70/44/196357044.db2.gz	NPAJHRDUXAIPFA-MDZLAQPJSA-N	0	3	301.818	2.259	10	0		DEAEHN
CC(C)CCCNc1cnn(CCN(C)C)c(=O)c1Cl	ZINC000134088218	196360134	/nfs/dbraw/zinc/36/01/34/196360134.db2.gz	XIIKCVGIDCNQGS-UHFFFAOYSA-N	0	3	300.834	2.306	10	0		DEAEHN
CCN(CC)CCC(=O)c1c(Cl)cnn1CCN(C)C	ZINC000134158042	196366723	/nfs/dbraw/zinc/36/67/23/196366723.db2.gz	APHHIBZRVOXCAA-UHFFFAOYSA-N	0	3	300.834	2.013	10	0		DEAEHN
COc1ccc([C@H](C)NCC2(CCO)CC2)cc1NC(C)=O	ZINC000188076629	225008084	/nfs/dbraw/zinc/00/80/84/225008084.db2.gz	FCXDZWBKIZBIRQ-LBPRGKRZSA-N	0	3	306.406	2.467	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)S(=O)(=O)CCc2cccs2)CCN1C	ZINC000195384112	225203959	/nfs/dbraw/zinc/20/39/59/225203959.db2.gz	ZCPWSSPSNHCOFM-OLZOCXBDSA-N	0	3	316.492	2.035	10	0		DEAEHN
Cc1cccc2c1OCC[C@H]2NC(=O)N1CC[C@H](N(C)C)C1	ZINC000191895753	292605473	/nfs/dbraw/zinc/60/54/73/292605473.db2.gz	LCXXZOFBUBGHNA-DZGCQCFKSA-N	0	3	303.406	2.164	10	0		DEAEHN
C[C@@H](CNC(=O)c1coc(Br)c1)N1CCCC1	ZINC000061423588	424841005	/nfs/dbraw/zinc/84/10/05/424841005.db2.gz	SMPCURWEUPMJDE-VIFPVBQESA-N	0	3	301.184	2.256	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)Nc2cc(C)ccc2C)c1	ZINC000105881395	424849596	/nfs/dbraw/zinc/84/95/96/424849596.db2.gz	RHTISLZSBHNXHM-OAHLLOKOSA-N	0	3	300.406	2.425	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)Nc2cc(C)ccc2C)c1	ZINC000105881396	424849701	/nfs/dbraw/zinc/84/97/01/424849701.db2.gz	RHTISLZSBHNXHM-HNNXBMFYSA-N	0	3	300.406	2.425	10	0		DEAEHN
c1ccc2c(c1)oc1c2ncnc1NC[C@H]1CN2CCC[C@H]2CO1	ZINC000363197133	424854674	/nfs/dbraw/zinc/85/46/74/424854674.db2.gz	HWTZBUIQVFSLFA-STQMWFEESA-N	0	3	324.384	2.651	10	0		DEAEHN
Cc1c(C(=O)NC[C@@H]2CCCN2C)cnn1-c1ccc(F)cc1	ZINC000194706745	424877965	/nfs/dbraw/zinc/87/79/65/424877965.db2.gz	KMTFHKWJNMQSPL-HNNXBMFYSA-N	0	3	316.380	2.144	10	0		DEAEHN
C[C@]1(CNC(=O)C2CC(=O)C2)CCCN1Cc1ccccc1	ZINC000153798798	424859781	/nfs/dbraw/zinc/85/97/81/424859781.db2.gz	UGQXRRIWGVWDAN-GOSISDBHSA-N	0	3	300.402	2.136	10	0		DEAEHN
Cc1nc(N)nc(N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)n1	ZINC000379686928	424908168	/nfs/dbraw/zinc/90/81/68/424908168.db2.gz	BYFJHDNUQYRWBW-SWLSCSKDSA-N	0	3	312.421	2.227	10	0		DEAEHN
C[C@H](O)CCCN1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21	ZINC000404219067	424925920	/nfs/dbraw/zinc/92/59/20/424925920.db2.gz	WGUITJKECAIZRJ-YTQUADARSA-N	0	3	318.461	2.123	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@H](C)c1ccncc1OC	ZINC000249000759	424886683	/nfs/dbraw/zinc/88/66/83/424886683.db2.gz	ONCRASLXUBMDLI-ZIAGYGMSSA-N	0	3	320.437	2.277	10	0		DEAEHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2ccco2)c(C)n1	ZINC000088250655	267397794	/nfs/dbraw/zinc/39/77/94/267397794.db2.gz	FEMLWMVKYXVMJQ-UHFFFAOYSA-N	0	3	301.390	2.495	10	0		DEAEHN
CCn1ccnc1[C@@H]1OCC[C@H]1CNCc1cccc(OC)n1	ZINC000657651613	425382848	/nfs/dbraw/zinc/38/28/48/425382848.db2.gz	JHLTVZPBTJZHGH-XJKSGUPXSA-N	0	3	316.405	2.174	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)Nc2c(C)cccc2C)c1	ZINC000105881495	274829898	/nfs/dbraw/zinc/82/98/98/274829898.db2.gz	UKURSBFBWMONIQ-HNNXBMFYSA-N	0	3	300.406	2.425	10	0		DEAEHN
CC1(C)CN(CCC(=O)N2CCOCC2)CC[C@@H]1C(F)(F)F	ZINC000190203478	276131993	/nfs/dbraw/zinc/13/19/93/276131993.db2.gz	FKWDGFLYBIZZCC-LBPRGKRZSA-N	0	3	322.371	2.146	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCOC3(CCCCC3)C2)C1	ZINC000174237834	276177162	/nfs/dbraw/zinc/17/71/62/276177162.db2.gz	UNQIVZBYFAQOHW-HNNXBMFYSA-N	0	3	309.454	2.215	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc2c(c1)CCC(=O)N2	ZINC000177011452	276182123	/nfs/dbraw/zinc/18/21/23/276182123.db2.gz	KJIXORKUNAGTMH-HNNXBMFYSA-N	0	3	315.417	2.128	10	0		DEAEHN
CN(C)C[C@H](NC(=O)Nc1nc2ccccn2n1)c1ccccc1	ZINC000184408636	276767880	/nfs/dbraw/zinc/76/78/80/276767880.db2.gz	QZBXDMVUHJMMJC-AWEZNQCLSA-N	0	3	324.388	2.154	10	0		DEAEHN
COC(=O)[C@@]1(C)CCCN1CCN(C)Cc1ccc(F)cc1	ZINC000186356408	277377167	/nfs/dbraw/zinc/37/71/67/277377167.db2.gz	LHEKJDDLEOFFCG-QGZVFWFLSA-N	0	3	308.397	2.285	10	0		DEAEHN
COC[C@@H](N[C@H]1CCc2ncnn2C1)c1ccc(Cl)cc1	ZINC000194094697	277571697	/nfs/dbraw/zinc/57/16/97/277571697.db2.gz	VEBWEWBDZWCNLD-UONOGXRCSA-N	0	3	306.797	2.224	10	0		DEAEHN
CO[C@@H]1CC[C@@H](NC(=O)NC[C@H](Cc2ccccc2)N(C)C)C1	ZINC000471825254	277660330	/nfs/dbraw/zinc/66/03/30/277660330.db2.gz	KBTSHBUQXKWRIJ-IXDOHACOSA-N	0	3	319.449	2.026	10	0		DEAEHN
C[C@@H](CNC(=O)N(C)CCc1ccc(F)cc1)N(C)C1CC1	ZINC000105270173	278270125	/nfs/dbraw/zinc/27/01/25/278270125.db2.gz	GJEKIEPWRYETCE-ZDUSSCGKSA-N	0	3	307.413	2.492	10	0		DEAEHN
C[C@H](CNC(=O)c1cnc(-c2ccncc2)s1)N(C)C1CC1	ZINC000172897269	279346105	/nfs/dbraw/zinc/34/61/05/279346105.db2.gz	NVOMSOPCGMJJSJ-LLVKDONJSA-N	0	3	316.430	2.418	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cccc(C)c1	ZINC000246246143	281199799	/nfs/dbraw/zinc/19/97/99/281199799.db2.gz	SDFIIZGZZWAKPF-GJZGRUSLSA-N	0	3	308.447	2.242	10	0		DEAEHN
Cc1ccc(NC(=O)NC[C@H](O)CN2CCCCC2)c(C)c1	ZINC000043142064	281434803	/nfs/dbraw/zinc/43/48/03/281434803.db2.gz	RSIQRYBOXREHGP-HNNXBMFYSA-N	0	3	305.422	2.272	10	0		DEAEHN
CCC[C@H](C(=O)NCCCN1CCc2ccccc21)N(C)C	ZINC000135008169	282058240	/nfs/dbraw/zinc/05/82/40/282058240.db2.gz	KTEUAVQQSIZRLL-QGZVFWFLSA-N	0	3	303.450	2.286	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@H]1C(=O)N1CCCC[C@H]1CN(C)C	ZINC000246660329	289086407	/nfs/dbraw/zinc/08/64/07/289086407.db2.gz	GRTSPARGCTUILT-JKIFEVAISA-N	0	3	302.418	2.494	10	0		DEAEHN
C[C@H](N[C@@H]1CCC(=O)N[C@@H]1C1CC1)C(=O)N1CCCCCC1	ZINC000328844986	290003137	/nfs/dbraw/zinc/00/31/37/290003137.db2.gz	RJVKKTPDCSNLNX-JGGQBBKZSA-N	0	3	307.438	2.265	10	0		DEAEHN
O=C(CN[C@@H]1CCCC[C@H]1n1cccn1)NC(C1CC1)C1CC1	ZINC000129090086	295521381	/nfs/dbraw/zinc/52/13/81/295521381.db2.gz	UPIBLYFFJQQDPB-HZPDHXFCSA-N	0	3	316.449	2.261	10	0		DEAEHN
CC(C)N1CCC[C@@H](N[C@H](C)c2ccc3c(c2)OCO3)C1=O	ZINC000174986869	325742733	/nfs/dbraw/zinc/74/27/33/325742733.db2.gz	KKKIYKKKQKWWTD-TZMCWYRMSA-N	0	3	304.390	2.465	10	0		DEAEHN
Brc1sccc1CNCCCn1ccnn1	ZINC000388841635	335125964	/nfs/dbraw/zinc/12/59/64/335125964.db2.gz	WLSXNFSHIUBUBL-UHFFFAOYSA-N	0	3	301.213	2.282	10	0		DEAEHN
COc1cccc2c1CC[C@H](NCc1cc(C(N)=O)co1)C2	ZINC000192448245	533870791	/nfs/dbraw/zinc/87/07/91/533870791.db2.gz	DVRGZZIEBDUNKE-ZDUSSCGKSA-N	0	3	300.358	2.034	10	0		DEAEHN
Cn1nccc1C1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000195502047	518195675	/nfs/dbraw/zinc/19/56/75/518195675.db2.gz	UXMJCQVUNQBBSF-INIZCTEOSA-N	0	3	315.417	2.039	10	0		DEAEHN
CC(C)c1ccccc1OC[C@H](O)CN1CC[C@@H](O)[C@H](C)C1	ZINC000249596475	519847297	/nfs/dbraw/zinc/84/72/97/519847297.db2.gz	WZNVDNAYTPCQEH-BFYDXBDKSA-N	0	3	307.434	2.252	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)N1CCC[C@@H]1c1cnn(C)c1	ZINC000111511565	521600570	/nfs/dbraw/zinc/60/05/70/521600570.db2.gz	HBBZCHXAFUAJRY-JKSUJKDBSA-N	0	3	319.453	2.141	10	0		DEAEHN
CC[C@@H]1CN(CCOc2ccc(F)cc2)CCN1CCOC	ZINC000105835860	523440687	/nfs/dbraw/zinc/44/06/87/523440687.db2.gz	YPWFVGUKENHUGV-MRXNPFEDSA-N	0	3	310.413	2.247	10	0		DEAEHN
COc1ccc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c(OC)c1	ZINC000247273575	523728083	/nfs/dbraw/zinc/72/80/83/523728083.db2.gz	JZXSSNUQUJDGGR-SWLSCSKDSA-N	0	3	306.406	2.162	10	0		DEAEHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)N(C)[C@H](C)c1cnn(C)c1	ZINC000245927220	524337806	/nfs/dbraw/zinc/33/78/06/524337806.db2.gz	SXXGBAFEYIACAK-RBSFLKMASA-N	0	3	321.469	2.243	10	0		DEAEHN
C[C@@H](CNC(=O)NCc1cscn1)N(C)Cc1ccccc1	ZINC000111482768	524685029	/nfs/dbraw/zinc/68/50/29/524685029.db2.gz	RIRWZWAIZCBOFH-ZDUSSCGKSA-N	0	3	318.446	2.463	10	0		DEAEHN
Cc1nc(CN(C)C(=O)[C@@H]2CCCCN2C2CCCC2)no1	ZINC000365981526	526835101	/nfs/dbraw/zinc/83/51/01/526835101.db2.gz	URGJKEODYXJIDS-AWEZNQCLSA-N	0	3	306.410	2.134	10	0		DEAEHN
[NH3+]CCC[N-]S(=O)(=O)c1cc2cc(Cl)ccc2s1	ZINC000237814469	527180607	/nfs/dbraw/zinc/18/06/07/527180607.db2.gz	MDKFVPGBWDXPBW-UHFFFAOYSA-N	0	3	304.824	2.182	10	0		DEAEHN
CC(C)c1nc(N[C@@H]2CN(C(C)C)C[C@H]2C)nc(N(C)C)n1	ZINC000301968656	528296375	/nfs/dbraw/zinc/29/63/75/528296375.db2.gz	PSWMWQOOYDIJRK-CHWSQXEVSA-N	0	3	306.458	2.202	10	0		DEAEHN
CC(C)COc1ccc([C@H](C)NC(=O)C2(N)CCOCC2)cc1	ZINC000261927035	535235515	/nfs/dbraw/zinc/23/55/15/535235515.db2.gz	VUZWJKKOSYUVLI-AWEZNQCLSA-N	0	3	320.433	2.407	10	0		DEAEHN
CCN(C(C)=O)c1nc(CN2CCN3CCCC[C@H]3C2)cs1	ZINC000248359103	535704867	/nfs/dbraw/zinc/70/48/67/535704867.db2.gz	ROCLYQRGKANYGQ-HNNXBMFYSA-N	0	3	322.478	2.186	10	0		DEAEHN
CCN(C)C(=O)CCN[C@H](C)c1ccccc1-n1cccn1	ZINC000183158729	535711491	/nfs/dbraw/zinc/71/14/91/535711491.db2.gz	VTXZALUYFHUPMJ-CQSZACIVSA-N	0	3	300.406	2.391	10	0		DEAEHN
CN(C)C[C@H]1CN(CCOc2ccc(Cl)c(F)c2)CCO1	ZINC000192010244	535969001	/nfs/dbraw/zinc/96/90/01/535969001.db2.gz	CXTIVFGMJVDHBR-ZDUSSCGKSA-N	0	3	316.804	2.120	10	0		DEAEHN
CC[C@H](C(=O)N1C[C@H](C)O[C@@H](c2ccc(F)cc2)C1)N(C)C	ZINC000247115864	536090960	/nfs/dbraw/zinc/09/09/60/536090960.db2.gz	UERCIXGZUAHWHM-APHBMKBZSA-N	0	3	308.397	2.454	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(C[C@@H](O)CC(F)(F)F)C1	ZINC000248867179	536173691	/nfs/dbraw/zinc/17/36/91/536173691.db2.gz	BCIAMICAYRAERD-NEPJUHHUSA-N	0	3	305.344	2.396	10	0		DEAEHN
CNC(=O)c1ccc(CN2CC[C@@]3(O)CCCC[C@H]3C2)cc1	ZINC000247966327	536423646	/nfs/dbraw/zinc/42/36/46/536423646.db2.gz	GVRPPDRGYPHNAR-WMZOPIPTSA-N	0	3	302.418	2.173	10	0		DEAEHN
COC1CCC(N(C)CC(=O)Nc2ccc3c(c2)OCO3)CC1	ZINC000360308996	536730971	/nfs/dbraw/zinc/73/09/71/536730971.db2.gz	RWWOPQIXNUOCSF-UHFFFAOYSA-N	0	3	320.389	2.243	10	0		DEAEHN
COC[C@H](NC(=O)N(C)[C@H]1CCN(C(C)C)C1)c1ccccc1	ZINC000458247538	536869813	/nfs/dbraw/zinc/86/98/13/536869813.db2.gz	XPSMDMGDAPSMOC-IRXDYDNUSA-N	0	3	319.449	2.498	10	0		DEAEHN
COc1ccccc1N1CCC(NCc2cnc(N)s2)CC1	ZINC000261840399	537062247	/nfs/dbraw/zinc/06/22/47/537062247.db2.gz	KUAMJLMOQJOZRG-UHFFFAOYSA-N	0	3	318.446	2.493	10	0		DEAEHN
COc1cccc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1OC	ZINC000247126436	537081653	/nfs/dbraw/zinc/08/16/53/537081653.db2.gz	NDTHPWJKCOIYJT-DZGCQCFKSA-N	0	3	318.417	2.260	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCC[C@@]2(CC1)NCCc1nc[nH]c12	ZINC000704098766	568414282	/nfs/dbraw/zinc/41/42/82/568414282.db2.gz	ZJLRDEOATYZFGD-INIZCTEOSA-N	0	3	306.410	2.172	10	0		DEAEHN
Cc1cc(C)c(N2CC[C@H](N[C@@H]3CCCOC3)C2=O)c(C)c1	ZINC000189457631	625433961	/nfs/dbraw/zinc/43/39/61/625433961.db2.gz	UCWNUXRAFUMXTG-CVEARBPZSA-N	0	3	302.418	2.486	10	0		DEAEHN
CN(CCNS(=O)(=O)/C=C\c1ccccc1)C1CCCC1	ZINC000255376738	624499409	/nfs/dbraw/zinc/49/94/09/624499409.db2.gz	MJVLGHKHEZGNCH-KAMYIIQDSA-N	0	3	308.447	2.451	10	0		DEAEHN
Cc1ccc2c(c1)CC[C@@H]2N[C@@H]1CCN(C2CCOCC2)C1=O	ZINC000747816183	638480113	/nfs/dbraw/zinc/48/01/13/638480113.db2.gz	UUUPRFDYBYHUNF-ZWKOTPCHSA-N	0	3	314.429	2.352	10	0		DEAEHN
CCN(CC)C(=O)C1(NC/C=C(/C)C(=O)OC)CCCCC1	ZINC000748818355	638594449	/nfs/dbraw/zinc/59/44/49/638594449.db2.gz	UFXBQRJEKCKXKY-UVTDQMKNSA-N	0	3	310.438	2.267	10	0		DEAEHN
O=C(CN1C[C@@H]2CCCC[C@H]2C1)Nc1ccc2[nH]c(=O)[nH]c2c1	ZINC000750062897	638707794	/nfs/dbraw/zinc/70/77/94/638707794.db2.gz	SQJKGBSXBSKTTC-RYUDHWBXSA-N	0	3	314.389	2.329	10	0		DEAEHN
CCOC(=O)[C@H](CC1CC1)NC(=O)[C@@H](C)N1CCCCCC1	ZINC000752385047	639178785	/nfs/dbraw/zinc/17/87/85/639178785.db2.gz	DWKZCBYOIFOBEW-HIFRSBDPSA-N	0	3	310.438	2.099	10	0		DEAEHN
CC(C)(C)OC(=O)N(Cc1ccon1)c1ccc(CN)nc1	ZINC000757135586	645928887	/nfs/dbraw/zinc/92/88/87/645928887.db2.gz	WNDYFDQPBHINJC-UHFFFAOYSA-N	0	3	304.350	2.470	10	0		DEAEHN
C[C@H](NC[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1nccn1C	ZINC000230412499	646728964	/nfs/dbraw/zinc/72/89/64/646728964.db2.gz	BWBFQSVZBXGIEJ-QWHCGFSZSA-N	0	3	308.426	2.328	10	0		DEAEHN
O=C(CN1CCC2(CCCC2)C1)N1CCO[C@H]2CCCC[C@@H]21	ZINC000174276917	646802817	/nfs/dbraw/zinc/80/28/17/646802817.db2.gz	BNAUSICILHDISS-HOTGVXAUSA-N	0	3	306.450	2.423	10	0		DEAEHN
C[C@H](CNC(=O)c1cc(Cl)nc(N(C)C)c1)N1CCCCC1	ZINC000733135188	647891923	/nfs/dbraw/zinc/89/19/23/647891923.db2.gz	RUYQGQUTTSFLGM-GFCCVEGCSA-N	0	3	324.856	2.405	10	0		DEAEHN
COC(=O)C[C@@H](C)C(=O)O[C@H]1CCCN(Cc2ccccc2)C1	ZINC000183173286	649045611	/nfs/dbraw/zinc/04/56/11/649045611.db2.gz	FXUMJHXPOVBBTG-ZBFHGGJFSA-N	0	3	319.401	2.393	10	0		DEAEHN
CCc1nn(C)cc1CN[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000381596685	685401219	/nfs/dbraw/zinc/40/12/19/685401219.db2.gz	KGEHXNYHRCNYQD-RYUDHWBXSA-N	0	3	310.442	2.374	10	0		DEAEHN
C[C@@H]1[C@@H](NCc2cncnc2)CCCN1C(=O)OC(C)(C)C	ZINC000189531094	684383169	/nfs/dbraw/zinc/38/31/69/684383169.db2.gz	CBLWVEFYGDKFIC-OCCSQVGLSA-N	0	3	306.410	2.354	10	0		DEAEHN
CC(C)Nc1ncnc2c1ncn2CN1CCS[C@H](C)CC1	ZINC000191668553	684434330	/nfs/dbraw/zinc/43/43/30/684434330.db2.gz	VBQYVCNMFPWKOM-GFCCVEGCSA-N	0	3	320.466	2.432	10	0		DEAEHN
C[C@@](O)(CN1CC[C@]2(CCOC2)C1)C(F)(F)C(F)(F)F	ZINC000724109856	777242296	/nfs/dbraw/zinc/24/22/96/777242296.db2.gz	PQPRKSLQWITOLJ-ZJUUUORDSA-N	0	3	303.271	2.047	10	0		DEAEHN
C[C@H](N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C)c1cnn(C)c1	ZINC000721863103	780405634	/nfs/dbraw/zinc/40/56/34/780405634.db2.gz	HXPMLMIPCNAVQY-MBNYWOFBSA-N	0	3	308.426	2.326	10	0		DEAEHN
CC(C)c1nnc2n1CCN(C(=O)CN1[C@H](C)CC[C@@H]1C)[C@H]2C	ZINC000439776384	781808299	/nfs/dbraw/zinc/80/82/99/781808299.db2.gz	VUKFIFOTRNULKK-MJBXVCDLSA-N	0	3	319.453	2.178	10	0		DEAEHN
CCn1cc(CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)cn1	ZINC000721866815	787323637	/nfs/dbraw/zinc/32/36/37/787323637.db2.gz	QYCVMYGBBCRUGH-TZMCWYRMSA-N	0	3	308.426	2.248	10	0		DEAEHN
C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CN[C@H]1CCn2ccnc21	ZINC000723819088	787345445	/nfs/dbraw/zinc/34/54/45/787345445.db2.gz	DSMPQLBSKOUGPI-MCIONIFRSA-N	0	3	320.437	2.421	10	0		DEAEHN
Cn1cc(CNC[C@@H]2CCN2C(C)(C)C)c(Br)n1	ZINC000712460398	792189310	/nfs/dbraw/zinc/18/93/10/792189310.db2.gz	UATAXCPAHVKLES-NSHDSACASA-N	0	3	315.259	2.145	10	0		DEAEHN
Cc1nc(C)c([C@@H](C)NCC[C@H]2CCCS2(=O)=O)s1	ZINC000714335092	792309241	/nfs/dbraw/zinc/30/92/41/792309241.db2.gz	OXMXQZYXOQFAMD-BXKDBHETSA-N	0	3	302.465	2.378	10	0		DEAEHN
Cc1nc([C@H](C)N[C@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)n[nH]1	ZINC000401853357	801854693	/nfs/dbraw/zinc/85/46/93/801854693.db2.gz	ULJIKEDIUFCRBK-MDZLAQPJSA-N	0	3	323.441	2.409	10	0		DEAEHN
CN1CCC[C@H]2[C@H]1CCN2C(=O)c1cccc(Br)n1	ZINC000720829367	1086185578	/nfs/dbraw/zinc/18/55/78/1086185578.db2.gz	MBYXZIBDHZXNEQ-NEPJUHHUSA-N	0	3	324.222	2.153	10	0		DEAEHN
COc1cc(CNCC2SCCS2)cc2c1OCCO2	ZINC000703131311	1086484553	/nfs/dbraw/zinc/48/45/53/1086484553.db2.gz	CPIVDGXXLVBZLG-UHFFFAOYSA-N	0	3	313.444	2.362	10	0		DEAEHN
COc1ccncc1CNCC1CN(C(=O)OC(C)(C)C)C1	ZINC000710873730	1086689910	/nfs/dbraw/zinc/68/99/10/1086689910.db2.gz	GEBYDGQOOMFFIZ-UHFFFAOYSA-N	0	3	307.394	2.047	10	0		DEAEHN
COc1cc(CN[C@]23C[C@H]2COC3)cc(Br)c1O	ZINC000718061231	1087795728	/nfs/dbraw/zinc/79/57/28/1087795728.db2.gz	ILHHGCVCWRBSBG-ZANVPECISA-N	0	3	314.179	2.042	10	0		DEAEHN
COC[C@@H](CO)NCc1ccc(C)c(Br)c1C	ZINC000719541222	1089289546	/nfs/dbraw/zinc/28/95/46/1089289546.db2.gz	XKNRBNFYBDVDJH-GFCCVEGCSA-N	0	3	302.212	2.163	10	0		DEAEHN
CN[C@@H](CSCCC(=O)OC)c1ccc2c(c1)OCCO2	ZINC000081791370	192324411	/nfs/dbraw/zinc/32/44/11/192324411.db2.gz	IVSMHSCEQAFTKF-LBPRGKRZSA-N	0	3	311.403	2.015	10	0		DEAEHN
CN[C@H](CS(=O)(=O)c1ccc(Br)cc1)C1CC1	ZINC000081933348	192341212	/nfs/dbraw/zinc/34/12/12/192341212.db2.gz	LKDUQMUKIITORP-GFCCVEGCSA-N	0	3	318.236	2.221	10	0		DEAEHN
CCN[C@@H](C)[C@H](C)S(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000081936149	192342120	/nfs/dbraw/zinc/34/21/20/192342120.db2.gz	YYHVNYYOKMGJPU-RYUDHWBXSA-N	0	3	313.419	2.008	10	0		DEAEHN
CCN[C@@H](C)[C@@H](C)S(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000081936144	192342836	/nfs/dbraw/zinc/34/28/36/192342836.db2.gz	YYHVNYYOKMGJPU-NWDGAFQWSA-N	0	3	313.419	2.008	10	0		DEAEHN
CCN[C@H](CC)[C@@H](C)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000081935448	192343454	/nfs/dbraw/zinc/34/34/54/192343454.db2.gz	JXJKRZJZAPGQPN-DGCLKSJQSA-N	0	3	313.419	2.008	10	0		DEAEHN
COCCNCCCS(=O)(=O)c1ccc2ccccc2c1	ZINC000081945633	192345189	/nfs/dbraw/zinc/34/51/89/192345189.db2.gz	WTXCHWCOMNTZEP-UHFFFAOYSA-N	0	3	307.415	2.240	10	0		DEAEHN
CN[C@H](c1ccc(Br)s1)[C@H]1CCS(=O)(=O)C1	ZINC000082998705	185210782	/nfs/dbraw/zinc/21/07/82/185210782.db2.gz	UUDBVQDGSACLHK-XVKPBYJWSA-N	0	3	324.265	2.206	10	0		DEAEHN
CCC[C@@H](C[NH3+])[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000087403979	185223819	/nfs/dbraw/zinc/22/38/19/185223819.db2.gz	XYPSSRAOMJFEIB-JTQLQIEISA-N	0	3	311.234	2.399	10	0		DEAEHN
COCCNCc1cccc(Br)c1OCOC	ZINC000087888249	185234719	/nfs/dbraw/zinc/23/47/19/185234719.db2.gz	JKCQTYTZFZLVQO-UHFFFAOYSA-N	0	3	304.184	2.168	10	0		DEAEHN
O=C1[C@@H](NC2CC2)CCN1c1c2nsnc2ccc1Cl	ZINC000088128044	185240346	/nfs/dbraw/zinc/24/03/46/185240346.db2.gz	RLBIORWAPOKPDH-JTQLQIEISA-N	0	3	308.794	2.202	10	0		DEAEHN
NC1(C(=O)Nc2c3nsnc3c(Cl)cc2Cl)CC1	ZINC000088130101	185240421	/nfs/dbraw/zinc/24/04/21/185240421.db2.gz	YAQUGWBJDDETRG-UHFFFAOYSA-N	0	3	303.174	2.428	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2ccc3c(c2)OC(C)(C)O3)C1	ZINC000171082005	282199222	/nfs/dbraw/zinc/19/92/22/282199222.db2.gz	LLJFPENKRMPYPW-GFCCVEGCSA-N	0	3	305.378	2.362	10	0		DEAEHN
CN[C@H]1CCOC[C@@H]1S(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000088312120	185245223	/nfs/dbraw/zinc/24/52/23/185245223.db2.gz	FWONNEGZAKHQRP-RYUDHWBXSA-N	0	3	324.229	2.144	10	0		DEAEHN
CC1CCC(NCc2ccc(S(=O)(=O)N(C)C)o2)CC1	ZINC000088539781	185255361	/nfs/dbraw/zinc/25/53/61/185255361.db2.gz	VUSLPBPCSJBOPQ-UHFFFAOYSA-N	0	3	300.424	2.198	10	0		DEAEHN
CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(S(=O)(=O)[N-]C)o1	ZINC000088540203	185255725	/nfs/dbraw/zinc/25/57/25/185255725.db2.gz	NJCSLEOPHBJAAP-YPMHNXCESA-N	0	3	300.424	2.246	10	0		DEAEHN
C[N-]S(=O)(=O)c1ccc(C[NH2+]C2CCC(C)(C)CC2)o1	ZINC000088540846	185255812	/nfs/dbraw/zinc/25/58/12/185255812.db2.gz	RAEDJAGNUTUBQS-UHFFFAOYSA-N	0	3	300.424	2.246	10	0		DEAEHN
CC[C@@H](C)[C@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000088542942	185256071	/nfs/dbraw/zinc/25/60/71/185256071.db2.gz	AJTHHDFXRQWKJC-NEPJUHHUSA-N	0	3	302.440	2.491	10	0		DEAEHN
CC[C@@H](C)[C@H](C)NS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000088542942	185256072	/nfs/dbraw/zinc/25/60/72/185256072.db2.gz	AJTHHDFXRQWKJC-NEPJUHHUSA-N	0	3	302.440	2.491	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)N(C)Cc1ccc(Cl)cc1Cl	ZINC000090434848	185296252	/nfs/dbraw/zinc/29/62/52/185296252.db2.gz	UHKJUOKRHNJBBQ-YPMHNXCESA-N	0	3	317.216	2.186	10	0		DEAEHN
C[C@]1(C(=O)Nc2ccc(-c3nccs3)cc2)COC[C@@H]1N	ZINC000090589666	185305356	/nfs/dbraw/zinc/30/53/56/185305356.db2.gz	LMBFDXQGFXLJSV-WFASDCNBSA-N	0	3	303.387	2.112	10	0		DEAEHN
CN(C)C[C@H]1CSCCCN1C(=O)c1ccc(F)c(F)c1	ZINC000090699867	185310337	/nfs/dbraw/zinc/31/03/37/185310337.db2.gz	DURZPAFHGSDVEC-LBPRGKRZSA-N	0	3	314.401	2.474	10	0		DEAEHN
C[C@H](NC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1)C(C)(C)C	ZINC000091855227	299090338	/nfs/dbraw/zinc/09/03/38/299090338.db2.gz	RHZKTHUFIWSLAK-HOTGVXAUSA-N	0	3	324.513	2.233	10	0		DEAEHN
CNCc1ccc(C)c(S(=O)(=O)NC2C(C)(C)C2(C)C)c1	ZINC000092833198	185344873	/nfs/dbraw/zinc/34/48/73/185344873.db2.gz	PJGSLIPNLFSHIF-UHFFFAOYSA-N	0	3	310.463	2.427	10	0		DEAEHN
CCN[C@@H](Cc1cccc(Br)c1)c1cnnn1C	ZINC000168422820	197722754	/nfs/dbraw/zinc/72/27/54/197722754.db2.gz	KNZNELZEVAHZEU-LBPRGKRZSA-N	0	3	309.211	2.471	10	0		DEAEHN
CCN[C@@H](Cc1c(F)cccc1Cl)[C@@H](C)S(C)(=O)=O	ZINC000168588824	197725607	/nfs/dbraw/zinc/72/56/07/197725607.db2.gz	SNWAECZYKMFEIU-RNCFNFMXSA-N	0	3	307.818	2.433	10	0		DEAEHN
CCN[C@H](C)c1ccccc1NC(=O)C(C)(C)S(C)(=O)=O	ZINC000070127975	190860177	/nfs/dbraw/zinc/86/01/77/190860177.db2.gz	HWCPIGULQLESNJ-LLVKDONJSA-N	0	3	312.435	2.119	10	0		DEAEHN
O=C1NCCN1C1CCN(Cc2cccc3cnccc32)CC1	ZINC000182921692	539658573	/nfs/dbraw/zinc/65/85/73/539658573.db2.gz	RZUFZGAUTMAHFF-UHFFFAOYSA-N	0	3	310.401	2.224	10	0		DEAEHN
Cc1ccc(CN(C(=O)CN[C@@H](C)[C@@H]2CCCO2)C2CC2)o1	ZINC000183124807	539659604	/nfs/dbraw/zinc/65/96/04/539659604.db2.gz	QTIRVYKXURMFFM-BBRMVZONSA-N	0	3	306.406	2.236	10	0		DEAEHN
COc1cc(CN2CCC[C@H]2Cn2ccnc2)cc2c1OCO2	ZINC000188415171	539682335	/nfs/dbraw/zinc/68/23/35/539682335.db2.gz	IRMPPCCTXDCQMQ-AWEZNQCLSA-N	0	3	315.373	2.285	10	0		DEAEHN
C[C@H](NCc1cc(=O)n(C)c(=O)n1C)c1ccc2ccccc2c1	ZINC000192479752	539707170	/nfs/dbraw/zinc/70/71/70/539707170.db2.gz	ZJBZUVBAHDLHNO-ZDUSSCGKSA-N	0	3	323.396	2.088	10	0		DEAEHN
CSCC[C@@H](N)c1nnc2ccc(Br)cn21	ZINC000083739813	192380248	/nfs/dbraw/zinc/38/02/48/192380248.db2.gz	IRXLURJCLIOZLH-MRVPVSSYSA-N	0	3	301.213	2.245	10	0		DEAEHN
O=C1[C@H](NC2CC2)CCN1Cc1cc(Br)cs1	ZINC000071321655	190957372	/nfs/dbraw/zinc/95/73/72/190957372.db2.gz	BQKQPRRTBJDEHT-LLVKDONJSA-N	0	3	315.236	2.364	10	0		DEAEHN
CCCN[C@@H](C[S@@](=O)CCOC)c1cc(C)ccc1OC	ZINC000084036266	192397045	/nfs/dbraw/zinc/39/70/45/192397045.db2.gz	GMGWRWOTMQSXRY-YCRPNKLZSA-N	0	3	313.463	2.439	10	0		DEAEHN
COC(=O)COC[C@H](N)c1cc(Br)sc1C	ZINC000084007044	192394818	/nfs/dbraw/zinc/39/48/18/192394818.db2.gz	OHSVCFAADIPVIM-QMMMGPOBSA-N	0	3	308.197	2.008	10	0		DEAEHN
COc1ccc(Cl)c2c1CN(Cc1cnn(C)c1)[C@H]2CN	ZINC000071684014	191008219	/nfs/dbraw/zinc/00/82/19/191008219.db2.gz	KHROYPXGCOHSDQ-ZDUSSCGKSA-N	0	3	306.797	2.098	10	0		DEAEHN
NCc1ccccc1C(=O)NC[C@@H](O)c1ccc(Cl)cc1	ZINC000071699878	191010254	/nfs/dbraw/zinc/01/02/54/191010254.db2.gz	OHFDGVNRWGRBSZ-OAHLLOKOSA-N	0	3	304.777	2.262	10	0		DEAEHN
CCOc1cc2c(cc1CN1CCC[C@@](O)(CO)CC1)CCC2	ZINC000072143653	191049728	/nfs/dbraw/zinc/04/97/28/191049728.db2.gz	BGQSIIXACYEPNN-IBGZPJMESA-N	0	3	319.445	2.283	10	0		DEAEHN
Brc1cc(CNCCc2ncc[nH]2)cc2c1OCO2	ZINC000139125211	186020037	/nfs/dbraw/zinc/02/00/37/186020037.db2.gz	UDCHJNGQGKTQHQ-UHFFFAOYSA-N	0	3	324.178	2.233	10	0		DEAEHN
CCc1cc(C[C@H](N)c2ncccc2Br)n(C)n1	ZINC000140322204	186025933	/nfs/dbraw/zinc/02/59/33/186025933.db2.gz	HHBMFRHJFQDFNH-LBPRGKRZSA-N	0	3	309.211	2.383	10	0		DEAEHN
CCC[C@@H]1N[C@@H](c2cccs2)N(C2CCN(C)CC2)C1=O	ZINC000141176770	186029185	/nfs/dbraw/zinc/02/91/85/186029185.db2.gz	RVLGCZMRKVNYLT-DZGCQCFKSA-N	0	3	307.463	2.441	10	0		DEAEHN
CC[C@@]1(C)N[C@H](c2ccsc2)N(C2CCN(C)CC2)C1=O	ZINC000141183660	186029387	/nfs/dbraw/zinc/02/93/87/186029387.db2.gz	LOMNBZVVILAQPF-GOEBONIOSA-N	0	3	307.463	2.441	10	0		DEAEHN
Cc1ccc([C@H]2NCC(=O)N2[C@@H](CC(C)C)CN(C)C)s1	ZINC000143962326	186034427	/nfs/dbraw/zinc/03/44/27/186034427.db2.gz	CCMQFIGKVRXNBI-BBRMVZONSA-N	0	3	309.479	2.463	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2ccsc2)N(C[C@@H]2CCCN(C)C2)C1=O	ZINC000144252438	186035387	/nfs/dbraw/zinc/03/53/87/186035387.db2.gz	QRWMOSUDKLTOHD-VHDGCEQUSA-N	0	3	307.463	2.299	10	0		DEAEHN
CCNc1cc(N2CCN(CC(C)C)CC2)nc(SC)n1	ZINC000149168358	186048019	/nfs/dbraw/zinc/04/80/19/186048019.db2.gz	BZTPAAOGCFAPFS-UHFFFAOYSA-N	0	3	309.483	2.408	10	0		DEAEHN
C[C@H]1OCC[C@@H]1NCc1cccc(NC(=O)C(F)(F)F)c1	ZINC000149414531	186049764	/nfs/dbraw/zinc/04/97/64/186049764.db2.gz	XXQWZROUCWRFKP-SKDRFNHKSA-N	0	3	302.296	2.454	10	0		DEAEHN
NCc1cc2c(cc1OCc1cn3ccsc3n1)OCO2	ZINC000148642087	186045783	/nfs/dbraw/zinc/04/57/83/186045783.db2.gz	SQWPAQNDJCTBGI-UHFFFAOYSA-N	0	3	303.343	2.162	10	0		DEAEHN
N[C@@H](Cc1csc([C@H]2CCS(=O)(=O)C2)n1)c1ccccc1	ZINC000150261024	186055881	/nfs/dbraw/zinc/05/58/81/186055881.db2.gz	WPBIBYVLRYNNCF-JSGCOSHPSA-N	0	3	322.455	2.288	10	0		DEAEHN
CCCN[C@H]1CCCc2nc([C@H]3CCS(=O)(=O)C3)sc21	ZINC000150258448	186056390	/nfs/dbraw/zinc/05/63/90/186056390.db2.gz	CYDLNXBLKFDMJS-QWRGUYRKSA-N	0	3	314.476	2.422	10	0		DEAEHN
COc1cccc(C(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)c1[O-]	ZINC000155669069	186101222	/nfs/dbraw/zinc/10/12/22/186101222.db2.gz	YIIISOISNALLIN-CYBMUJFWSA-N	0	3	306.406	2.109	10	0		DEAEHN
COc1cccc(C(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)c1[O-]	ZINC000155669069	186101224	/nfs/dbraw/zinc/10/12/24/186101224.db2.gz	YIIISOISNALLIN-CYBMUJFWSA-N	0	3	306.406	2.109	10	0		DEAEHN
NCc1cccc(NC(=O)C[S@@](=O)c2ccc(F)cc2)c1	ZINC000155920100	186123344	/nfs/dbraw/zinc/12/33/44/186123344.db2.gz	OSTOEIAQMIRSPY-NRFANRHFSA-N	0	3	306.362	2.031	10	0		DEAEHN
COc1ccc(CNC[C@@H](C)[S@](C)=O)cc1OC(F)F	ZINC000159644659	186132699	/nfs/dbraw/zinc/13/26/99/186132699.db2.gz	XYTHRWYYNHRCEQ-GSDQLPOLSA-N	0	3	307.362	2.153	10	0		DEAEHN
COc1ccc(Br)cc1CNC[C@H](C)[S@@](C)=O	ZINC000159653659	186133233	/nfs/dbraw/zinc/13/32/33/186133233.db2.gz	JUNMBZMVIRUHGF-XYZCENFISA-N	0	3	320.252	2.314	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(-n3cccc3)c(F)c2)C1	ZINC000171508380	186170485	/nfs/dbraw/zinc/17/04/85/186170485.db2.gz	FLTSYFQPDPSPDQ-AWEZNQCLSA-N	0	3	301.365	2.393	10	0		DEAEHN
COc1ccc(CCNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1	ZINC000173285107	186172441	/nfs/dbraw/zinc/17/24/41/186172441.db2.gz	KNGPVWPRSCSODL-ZBFHGGJFSA-N	0	3	319.449	2.362	10	0		DEAEHN
C[C@H]1C[C@H](C)N(S(=O)(=O)c2ccc(CN)cc2Cl)C1	ZINC000164242660	186153403	/nfs/dbraw/zinc/15/34/03/186153403.db2.gz	ZOVZLLKLLPCOPV-UWVGGRQHSA-N	0	3	302.827	2.218	10	0		DEAEHN
CC(C)OC(=O)CCN[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000181903384	186217382	/nfs/dbraw/zinc/21/73/82/186217382.db2.gz	IPLQJDHAQVLMCX-ZDUSSCGKSA-N	0	3	302.378	2.260	10	0		DEAEHN
O=C(NCCSc1ccccc1)N1CCN2CCC[C@@H]2C1	ZINC000171898859	198004010	/nfs/dbraw/zinc/00/40/10/198004010.db2.gz	WHWCVDQXYGQMNC-CQSZACIVSA-N	0	3	305.447	2.268	10	0		DEAEHN
CC(=O)c1ccccc1OCCN1C[C@H]2CCC[C@@H](C1)C2O	ZINC000172041804	198030794	/nfs/dbraw/zinc/03/07/94/198030794.db2.gz	MUUTTWXIPONWGS-MVVMVCHASA-N	0	3	303.402	2.361	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1Cc1nc(-c2cccs2)no1	ZINC000172082711	198037096	/nfs/dbraw/zinc/03/70/96/198037096.db2.gz	CIJAMAFPAMEPRC-NWDGAFQWSA-N	0	3	304.419	2.467	10	0		DEAEHN
CCC[C@H](NC(=O)N1CCO[C@@H](CN(C)C)C1)c1ccccc1	ZINC000172116227	198041664	/nfs/dbraw/zinc/04/16/64/198041664.db2.gz	HGKYBWDBUOKYQE-IRXDYDNUSA-N	0	3	319.449	2.500	10	0		DEAEHN
Cc1ccc(NC(=O)N[C@@H]2CCCOC2)c(OCCN(C)C)c1	ZINC000172502050	198107048	/nfs/dbraw/zinc/10/70/48/198107048.db2.gz	PTRZUUKHJNDAMD-CQSZACIVSA-N	0	3	321.421	2.236	10	0		DEAEHN
Cc1nc(C)c(Br)c(N2CCC[C@H]2CN(C)C)n1	ZINC000323190583	539905309	/nfs/dbraw/zinc/90/53/09/539905309.db2.gz	MGYDWFGFGMXXTF-NSHDSACASA-N	0	3	313.243	2.386	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cc3ccccc3[nH]c2=O)CCN1C	ZINC000172995215	198174736	/nfs/dbraw/zinc/17/47/36/198174736.db2.gz	YHQUGBQSEGAYIW-GXTWGEPZSA-N	0	3	313.401	2.083	10	0		DEAEHN
O=S(=O)(NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)C1CC1	ZINC000173136922	198187821	/nfs/dbraw/zinc/18/78/21/198187821.db2.gz	RXSDVOQZPHNOMT-MQVJKMGUSA-N	0	3	320.458	2.264	10	0		DEAEHN
Cc1ccccc1O[C@@H](C)CNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000173209469	198196474	/nfs/dbraw/zinc/19/64/74/198196474.db2.gz	RMORKUUJKDPKNQ-JKSUJKDBSA-N	0	3	317.433	2.252	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)c2cccc(F)c2)[C@H](C)C1	ZINC000173256340	198202266	/nfs/dbraw/zinc/20/22/66/198202266.db2.gz	RYOLLJHINLBBSO-IUODEOHRSA-N	0	3	314.426	2.177	10	0		DEAEHN
C[C@H](C(=O)N1CCO[C@@H](c2nccs2)C1)N1CCCCCC1	ZINC000173271747	198204510	/nfs/dbraw/zinc/20/45/10/198204510.db2.gz	VWIUVSLIZUPZPT-ZIAGYGMSSA-N	0	3	323.462	2.308	10	0		DEAEHN
O=C(CN1CCC[C@@H]2CCCC[C@H]21)NC(=O)NCC(F)(F)F	ZINC000007588415	354004688	/nfs/dbraw/zinc/00/46/88/354004688.db2.gz	PLJKDJJXFLRQDB-WDEREUQCSA-N	0	3	321.343	2.029	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)C[C@@H](C)NC(=O)C2CCCCC2)C1	ZINC000067156327	354749994	/nfs/dbraw/zinc/74/99/94/354749994.db2.gz	DVOXMFMKDZMUAE-GDBMZVCRSA-N	0	3	323.481	2.062	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)NCc1nccs1	ZINC000079732790	355327396	/nfs/dbraw/zinc/32/73/96/355327396.db2.gz	NOJSPMMWLCOHPW-AWEZNQCLSA-N	0	3	318.446	2.115	10	0		DEAEHN
CCN1CCO[C@@H](CNCc2cccc(Br)c2)C1	ZINC000113266824	355758359	/nfs/dbraw/zinc/75/83/59/355758359.db2.gz	BCNMGFCLCNCAMK-AWEZNQCLSA-N	0	3	313.239	2.259	10	0		DEAEHN
CCN1CCO[C@H](CNCc2cccc(Br)c2)C1	ZINC000113266822	355759084	/nfs/dbraw/zinc/75/90/84/355759084.db2.gz	BCNMGFCLCNCAMK-CQSZACIVSA-N	0	3	313.239	2.259	10	0		DEAEHN
CCC[C@H](C)CN(C)CC(=O)N1CCC[C@H](C(=O)OCC)C1	ZINC000180012709	356039399	/nfs/dbraw/zinc/03/93/99/356039399.db2.gz	WGGSMOYHWMFYIM-GJZGRUSLSA-N	0	3	312.454	2.156	10	0		DEAEHN
NC(=O)C[C@@H](NCc1cn2ccsc2n1)C1CCCCC1	ZINC000182062370	356108248	/nfs/dbraw/zinc/10/82/48/356108248.db2.gz	KEFSXHHRHXWIKQ-CYBMUJFWSA-N	0	3	306.435	2.310	10	0		DEAEHN
Cc1cccc(CNC(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)n1	ZINC000182419739	356125780	/nfs/dbraw/zinc/12/57/80/356125780.db2.gz	VILJLPLTPLSXRT-GDBMZVCRSA-N	0	3	302.422	2.016	10	0		DEAEHN
COc1cc(F)ccc1N1CCN(CCCn2ccnc2)CC1	ZINC000183179181	356162259	/nfs/dbraw/zinc/16/22/59/356162259.db2.gz	RELNIGPJVHCTRY-UHFFFAOYSA-N	0	3	318.396	2.243	10	0		DEAEHN
Cc1nn(C)c(C)c1CCCN[C@@H](c1nccn1C)C1CC1	ZINC000183368346	356169260	/nfs/dbraw/zinc/16/92/60/356169260.db2.gz	QXGYRFOCUKAIJL-MRXNPFEDSA-N	0	3	301.438	2.444	10	0		DEAEHN
COC[C@H](NCc1cccc2c1OCCCO2)C1CCOCC1	ZINC000188248746	356214623	/nfs/dbraw/zinc/21/46/23/356214623.db2.gz	LATDXGLEMGCROJ-INIZCTEOSA-N	0	3	321.417	2.379	10	0		DEAEHN
CCc1cnccc1C(=O)N(CCN(C)C)Cc1ccco1	ZINC000184846122	356199080	/nfs/dbraw/zinc/19/90/80/356199080.db2.gz	KEMZGLVDYHYRIN-UHFFFAOYSA-N	0	3	301.390	2.441	10	0		DEAEHN
C[C@H](NCc1cc(=O)n2ccccc2n1)[C@@H]1COc2ccccc21	ZINC000185620452	356208578	/nfs/dbraw/zinc/20/85/78/356208578.db2.gz	YGCGPOSJZZTGCU-BBRMVZONSA-N	0	3	321.380	2.349	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@H]1[C@@H](NCc2ccccc2)[C@H]2OCC[C@@H]12	ZINC000227795342	356280257	/nfs/dbraw/zinc/28/02/57/356280257.db2.gz	ZVXRDYBDPDMHIX-JJXSEGSLSA-N	0	3	318.417	2.457	10	0		DEAEHN
NCc1cc(OC(F)(F)F)c(I)cn1	ZINC000238674838	356305269	/nfs/dbraw/zinc/30/52/69/356305269.db2.gz	PYPAPHHPTUMNNF-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
CC[C@@]1(CO)CCCN(C[C@@H](O)COc2ccc(C)cc2)C1	ZINC000249581439	356330549	/nfs/dbraw/zinc/33/05/49/356330549.db2.gz	RGQYUUZINJPGFK-SJLPKXTDSA-N	0	3	307.434	2.219	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)NCc1ccc(N2CCCCC2=O)cc1	ZINC000236989332	202110776	/nfs/dbraw/zinc/11/07/76/202110776.db2.gz	NDYYKZZVMAOSDQ-CXAGYDPISA-N	0	3	317.433	2.193	10	0		DEAEHN
COCC[C@@](C)(O)CNCc1ccsc1Br	ZINC000388728826	356706647	/nfs/dbraw/zinc/70/66/47/356706647.db2.gz	CLRKSMKZXUBRET-LLVKDONJSA-N	0	3	308.241	2.388	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N(CC)C(C)C)ccc1F	ZINC000088942098	192662257	/nfs/dbraw/zinc/66/22/57/192662257.db2.gz	PABIOVRMSBQQSF-UHFFFAOYSA-N	0	3	302.415	2.354	10	0		DEAEHN
CN(CC(=O)N1CCN(c2ccccc2)CC1)CC(C)(C)C	ZINC000588902120	357433646	/nfs/dbraw/zinc/43/36/46/357433646.db2.gz	QWWZNOJDYKRQKW-UHFFFAOYSA-N	0	3	303.450	2.313	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)NCc2ccc(Cl)cn2)CN1C1CC1	ZINC000180916942	199227835	/nfs/dbraw/zinc/22/78/35/199227835.db2.gz	JYWJESMDMSIBLQ-MFKMUULPSA-N	0	3	308.813	2.159	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)Nc2ccc3scnc3c2)CCO1	ZINC000181192985	199263746	/nfs/dbraw/zinc/26/37/46/199263746.db2.gz	QZBVARMWNVEDEI-LBPRGKRZSA-N	0	3	320.418	2.091	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N(C)C[C@@H]1CCCN(C)C1	ZINC000187484239	200118081	/nfs/dbraw/zinc/11/80/81/200118081.db2.gz	CGWOBPILTOMMPQ-UONOGXRCSA-N	0	3	320.437	2.134	10	0		DEAEHN
COc1ccc(F)c(C(=O)NCCN2CCCC[C@H]2C)c1OC	ZINC000188235055	200213754	/nfs/dbraw/zinc/21/37/54/200213754.db2.gz	IZMKXZYUNXZSGI-GFCCVEGCSA-N	0	3	324.396	2.447	10	0		DEAEHN
Fc1ccc(-c2nc(CN3CCN4CCC[C@@H]4C3)no2)c(F)c1	ZINC000189014640	200335656	/nfs/dbraw/zinc/33/56/56/200335656.db2.gz	FOVBVRBCIZTHBX-GFCCVEGCSA-N	0	3	320.343	2.295	10	0		DEAEHN
CO[C@H]1CN(CCCN2C(=O)c3ccccc3C2=O)CC[C@@H]1C	ZINC000189353385	200387140	/nfs/dbraw/zinc/38/71/40/200387140.db2.gz	RXOABZFIGBJNNS-BBRMVZONSA-N	0	3	316.401	2.030	10	0		DEAEHN
CSCC[C@@H](C)N(C)C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000602455400	360381083	/nfs/dbraw/zinc/38/10/83/360381083.db2.gz	RXZYOLMGTTUNNB-ZBFHGGJFSA-N	0	3	323.506	2.046	10	0		DEAEHN
OC[C@@H]1CCCCN1C[C@H](O)Cc1ccccc1C(F)(F)F	ZINC000443619210	238116811	/nfs/dbraw/zinc/11/68/11/238116811.db2.gz	BPQIFVZNBGPPIN-UONOGXRCSA-N	0	3	317.351	2.456	10	0		DEAEHN
CC(C)Cc1ccc(S(=O)(=O)N[C@H]2CNCC[C@H]2C)cc1	ZINC000193400648	201046003	/nfs/dbraw/zinc/04/60/03/201046003.db2.gz	AMIADQFTSHZNGA-CJNGLKHVSA-N	0	3	310.463	2.161	10	0		DEAEHN
CCSCC[C@@H](C)NC(=O)Nc1cnn(CCN(C)C)c1	ZINC000610478316	361405296	/nfs/dbraw/zinc/40/52/96/361405296.db2.gz	TZXPUBIETYDXAC-GFCCVEGCSA-N	0	3	313.471	2.098	10	0		DEAEHN
Cc1ncc(CN(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)o1	ZINC000628242577	366780628	/nfs/dbraw/zinc/78/06/28/366780628.db2.gz	KKJWQOLYRHKJDH-SFHVURJKSA-N	0	3	315.417	2.052	10	0		DEAEHN
Cc1ccc([C@H](O)CNC(=O)N[C@@H](CC(C)C)CN(C)C)cc1	ZINC000194190968	201196106	/nfs/dbraw/zinc/19/61/06/201196106.db2.gz	BNYPVMCCKPQVRB-DLBZAZTESA-N	0	3	321.465	2.304	10	0		DEAEHN
COC(=O)C(C)(C)[C@@H](NCCN1CCCC1=O)c1ccccc1	ZINC000611405509	361593505	/nfs/dbraw/zinc/59/35/05/361593505.db2.gz	FYXMGYWHSJGGPD-INIZCTEOSA-N	0	3	318.417	2.139	10	0		DEAEHN
O=C1[C@@H](NC[C@H]2CCC=CO2)CCN1Cc1ccc(F)cc1	ZINC000194885897	201305573	/nfs/dbraw/zinc/30/55/73/201305573.db2.gz	LYDMSNLWVFWHFY-CVEARBPZSA-N	0	3	304.365	2.209	10	0		DEAEHN
CCn1cc([C@H](C)N[C@H]2CCCN(c3ncccn3)C2)cn1	ZINC000194984004	201321540	/nfs/dbraw/zinc/32/15/40/201321540.db2.gz	AEKJFPTWCLXBFL-ZFWWWQNUSA-N	0	3	300.410	2.013	10	0		DEAEHN
NC(=O)c1csc(CN[C@H]2CCCO[C@@H]2c2ccncc2)c1	ZINC000275468007	212354010	/nfs/dbraw/zinc/35/40/10/212354010.db2.gz	HOPWKMTTYBPMDB-LSDHHAIUSA-N	0	3	317.414	2.252	10	0		DEAEHN
Cn1ccnc1[C@@H]1OCC[C@H]1NCc1cnc(C2CC2)s1	ZINC000623084426	364879496	/nfs/dbraw/zinc/87/94/96/364879496.db2.gz	ATWQTZXASDCCHC-CHWSQXEVSA-N	0	3	304.419	2.374	10	0		DEAEHN
Cc1noc([C@H]2CC[C@@H](CNCc3cn(C(C)C)nc3C)O2)n1	ZINC000623164200	364905321	/nfs/dbraw/zinc/90/53/21/364905321.db2.gz	PAJINTJPCOCISP-LSDHHAIUSA-N	0	3	319.409	2.474	10	0		DEAEHN
CCOC(=O)c1cc(CNCCN2CC=C(C)CC2)[nH]c1C	ZINC000449244987	240246658	/nfs/dbraw/zinc/24/66/58/240246658.db2.gz	XKDCLAAAYRNMAL-UHFFFAOYSA-N	0	3	305.422	2.241	10	0		DEAEHN
CCOC(=O)[C@H]1CN(C/C=C/c2ccccc2)CC12COC2	ZINC000449361252	240392379	/nfs/dbraw/zinc/39/23/79/240392379.db2.gz	JAJOTASDOPTNGN-YXMGTMDOSA-N	0	3	301.386	2.211	10	0		DEAEHN
COc1ccccc1[C@H](C)N(C)C(=O)C[C@@H]1CSCCN1	ZINC000091136080	193001410	/nfs/dbraw/zinc/00/14/10/193001410.db2.gz	WUCUPCYSYPIWGI-QWHCGFSZSA-N	0	3	308.447	2.310	10	0		DEAEHN
CCN(Cc1ccc(F)c(F)c1)C(=O)C[C@@H]1CSCCN1	ZINC000091136522	193002707	/nfs/dbraw/zinc/00/27/07/193002707.db2.gz	PVOPRPVMRMTXRC-GFCCVEGCSA-N	0	3	314.401	2.408	10	0		DEAEHN
CCC(=O)Nc1cccc(NC(=O)C[C@H]2CSCCN2)c1	ZINC000091138022	193002721	/nfs/dbraw/zinc/00/27/21/193002721.db2.gz	JUTPNIJIVOOYGY-ZDUSSCGKSA-N	0	3	307.419	2.069	10	0		DEAEHN
COc1cc(C[NH2+][C@H]2C[C@H](OC)C2)cc(Br)c1[O-]	ZINC000623807159	365180575	/nfs/dbraw/zinc/18/05/75/365180575.db2.gz	UTMRQRAJYCSFPK-MGCOHNPYSA-N	0	3	316.195	2.430	10	0		DEAEHN
CO[C@@H](CN[C@H](C)c1ccc(S(N)(=O)=O)cc1)C(C)(C)C	ZINC000091350123	193044821	/nfs/dbraw/zinc/04/48/21/193044821.db2.gz	OGBJXBGYILJCKG-RISCZKNCSA-N	0	3	314.451	2.046	10	0		DEAEHN
CCN[C@H](c1cc(Cl)cnc1N)C(C)(C)N1CCOCC1	ZINC000091566827	193073269	/nfs/dbraw/zinc/07/32/69/193073269.db2.gz	DBYCZDWIWBIPJQ-CYBMUJFWSA-N	0	3	312.845	2.079	10	0		DEAEHN
COCCN(C)[C@H](CN)c1ccc(Br)c(C)c1	ZINC000091470754	193060508	/nfs/dbraw/zinc/06/05/08/193060508.db2.gz	BMXAPCFILAQHFV-CYBMUJFWSA-N	0	3	301.228	2.336	10	0		DEAEHN
CN[C@@H](c1cccc(OC(F)(F)F)c1)[C@H]1CN(C)CCO1	ZINC000091717593	193096624	/nfs/dbraw/zinc/09/66/24/193096624.db2.gz	GPYQVAQNJUNBKB-OLZOCXBDSA-N	0	3	304.312	2.176	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N(CC)C2CC2)c(F)c1	ZINC000092115577	193162906	/nfs/dbraw/zinc/16/29/06/193162906.db2.gz	DDGQFAVZCJBSPS-UHFFFAOYSA-N	0	3	300.399	2.108	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N(C)CC(C)C)c(F)c1	ZINC000092115620	193163150	/nfs/dbraw/zinc/16/31/50/193163150.db2.gz	CRFIOFOSVSDNDX-UHFFFAOYSA-N	0	3	302.415	2.212	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)CN[C@H]2[C@@H](C)[C@@H](C)O[C@H]2C)c1	ZINC000528757633	284001606	/nfs/dbraw/zinc/00/16/06/284001606.db2.gz	NDUSDBSOKGHRKA-IMODNSLOSA-N	0	3	304.390	2.229	10	0		DEAEHN
CC[C@@H](C)CN(CC)S(=O)(=O)c1cccc2c1CCNC2	ZINC000093255305	193221164	/nfs/dbraw/zinc/22/11/64/193221164.db2.gz	FPQMPXXELJXVER-CYBMUJFWSA-N	0	3	310.463	2.389	10	0		DEAEHN
CC[C@@H](C)CN(CC)S(=O)(=O)c1ccc(CN)cc1F	ZINC000093265948	193222572	/nfs/dbraw/zinc/22/25/72/193222572.db2.gz	CYSNIJUMZDRSPE-LLVKDONJSA-N	0	3	302.415	2.341	10	0		DEAEHN
CC[C@H](C)CN(CC)S(=O)(=O)c1cc(CN)ccc1OC	ZINC000093265824	193223157	/nfs/dbraw/zinc/22/31/57/193223157.db2.gz	GJOIPZDAPJRDBK-LBPRGKRZSA-N	0	3	314.451	2.211	10	0		DEAEHN
CCOC(OCC)[C@H](N)Cc1c(Cl)c(CC)nn1CC	ZINC000093306622	193227938	/nfs/dbraw/zinc/22/79/38/193227938.db2.gz	OBISZWJDKNWATB-SNVBAGLBSA-N	0	3	303.834	2.388	10	0		DEAEHN
CCOC(OCC)[C@@H](Cc1c(Cl)c(CC)nn1C)NC	ZINC000093306796	193228273	/nfs/dbraw/zinc/22/82/73/193228273.db2.gz	KEYQXKVOBCPKSL-LLVKDONJSA-N	0	3	303.834	2.166	10	0		DEAEHN
CC[C@@H](NCC(C)(C)S(C)(=O)=O)c1ccc2c(c1)CCO2	ZINC000093522788	193263132	/nfs/dbraw/zinc/26/31/32/193263132.db2.gz	AQHNIKIPADCPGJ-CQSZACIVSA-N	0	3	311.447	2.485	10	0		DEAEHN
NC(=O)[C@]1(N)CCC[C@H]1CCSc1ccc(F)c(F)c1	ZINC000093627221	193276431	/nfs/dbraw/zinc/27/64/31/193276431.db2.gz	OSKMJLQLSFGUIP-XPTSAGLGSA-N	0	3	300.374	2.430	10	0		DEAEHN
Fc1cc2[nH]c([C@H]3CNCCO3)nc2cc1Br	ZINC000093728789	193298446	/nfs/dbraw/zinc/29/84/46/193298446.db2.gz	PSUZNWSHVBDEBM-SNVBAGLBSA-N	0	3	300.131	2.125	10	0		DEAEHN
N[C@H](Cc1nc2ccccc2s1)[C@@H]1CN2CCC[C@@H]2CO1	ZINC000094251529	193355086	/nfs/dbraw/zinc/35/50/86/193355086.db2.gz	SNEWBGROWTUJNA-BZPMIXESSA-N	0	3	303.431	2.029	10	0		DEAEHN
Cc1nnc(Sc2nc(C(F)(F)F)ccc2CN)n1C	ZINC000094337289	193361007	/nfs/dbraw/zinc/36/10/07/193361007.db2.gz	LZVYTZFEGKSHDU-UHFFFAOYSA-N	0	3	303.313	2.147	10	0		DEAEHN
CC(C)NCc1cc(F)c(O[C@H](C)C(=O)N(C)C)c(F)c1	ZINC000094347510	193363637	/nfs/dbraw/zinc/36/36/37/193363637.db2.gz	MSLIVEILFWQNAK-SNVBAGLBSA-N	0	3	300.349	2.318	10	0		DEAEHN
CN[C@H](c1cc(Br)ccc1F)[C@H]1COCCO1	ZINC000094108716	193345546	/nfs/dbraw/zinc/34/55/46/193345546.db2.gz	WSOKDRLTDBBFHU-VXGBXAGGSA-N	0	3	304.159	2.264	10	0		DEAEHN
CCC(N)(CC)C(=O)Nc1sc2c(c1C(=O)OC)CCC2	ZINC000094245237	193354427	/nfs/dbraw/zinc/35/44/27/193354427.db2.gz	SYRQIZMJPNKCIP-UHFFFAOYSA-N	0	3	310.419	2.479	10	0		DEAEHN
CN[C@H](C)c1c(C)nn([C@@H]2CCC[C@H](S(C)(=O)=O)C2)c1C	ZINC000094643985	193389857	/nfs/dbraw/zinc/38/98/57/193389857.db2.gz	IMSHDHNJSMPGKM-HONMWMINSA-N	0	3	313.467	2.309	10	0		DEAEHN
CCS(=O)(=O)c1ccccc1NC(=O)[C@H](CN)CC(C)C	ZINC000094697379	193391390	/nfs/dbraw/zinc/39/13/90/193391390.db2.gz	RYFUUKPQEJLGIB-LBPRGKRZSA-N	0	3	312.435	2.040	10	0		DEAEHN
CCOC(=O)[C@]1(NCCN(CC)CC)CSCC(C)(C)C1	ZINC000094490019	193373611	/nfs/dbraw/zinc/37/36/11/193373611.db2.gz	QUEGDVXFXPWMIH-MRXNPFEDSA-N	0	3	316.511	2.383	10	0		DEAEHN
C[C@@H](CN1CCCC1)Nc1nc(Br)cn2ccnc12	ZINC000094488886	193373830	/nfs/dbraw/zinc/37/38/30/193373830.db2.gz	DOCNJKAAWZETCJ-JTQLQIEISA-N	0	3	324.226	2.388	10	0		DEAEHN
CN(C)C[C@H]1CCCN1c1nc(Br)cn2ccnc12	ZINC000094490622	193374022	/nfs/dbraw/zinc/37/40/22/193374022.db2.gz	KYBHDDOQYLNAAM-SNVBAGLBSA-N	0	3	324.226	2.022	10	0		DEAEHN
c1ccc2c(c1)CNC[C@@H]2c1nc([C@@H]2CSCCO2)no1	ZINC000094501786	193374998	/nfs/dbraw/zinc/37/49/98/193374998.db2.gz	WKQHFVXXMOCLCI-STQMWFEESA-N	0	3	303.387	2.109	10	0		DEAEHN
CN[C@H](C)c1cc(F)c(C)cc1N(C)[C@@H]1CCS(=O)(=O)C1	ZINC000094765850	193396700	/nfs/dbraw/zinc/39/67/00/193396700.db2.gz	OHNDBKLYYAWOGJ-VXGBXAGGSA-N	0	3	314.426	2.038	10	0		DEAEHN
C[C@@H](C1CC1)n1nccc1NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000274917108	212031922	/nfs/dbraw/zinc/03/19/22/212031922.db2.gz	LHRQFMKSYKEXPP-GXTWGEPZSA-N	0	3	303.410	2.166	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cc3ccccc3c(=O)[nH]2)CCN1C	ZINC000266124451	205117721	/nfs/dbraw/zinc/11/77/21/205117721.db2.gz	YNCKZOYHQHODRP-GXTWGEPZSA-N	0	3	313.401	2.495	10	0		DEAEHN
C[C@@H]1CN([C@H](CN)c2ccc(OC(F)F)cc2)C[C@@H](C)O1	ZINC000020081638	182185155	/nfs/dbraw/zinc/18/51/55/182185155.db2.gz	ZUOUGDPMBANCCL-JTNHKYCSSA-N	0	3	300.349	2.397	10	0		DEAEHN
NCc1cc(S(=O)(=O)Nc2ccc(F)cc2F)ccc1F	ZINC000020189314	182195453	/nfs/dbraw/zinc/19/54/53/182195453.db2.gz	SDKMKHYCCHESCT-UHFFFAOYSA-N	0	3	316.304	2.363	10	0		DEAEHN
CCCOc1c(Cl)cc(CNCCOCCO)cc1OC	ZINC000020931675	182255100	/nfs/dbraw/zinc/25/51/00/182255100.db2.gz	PJUCQEWYVRZXEH-UHFFFAOYSA-N	0	3	317.813	2.236	10	0		DEAEHN
Cc1ccccc1C(=O)N1C[C@@H](C)N(CCN(C)C)[C@H](C)C1	ZINC000036126154	182804453	/nfs/dbraw/zinc/80/44/53/182804453.db2.gz	IJPUSTKVYXIRHS-HZPDHXFCSA-N	0	3	303.450	2.091	10	0		DEAEHN
Cc1ccc(C(=O)N2C[C@@H](C)N(CCN(C)C)[C@H](C)C2)cc1C	ZINC000036126199	182804647	/nfs/dbraw/zinc/80/46/47/182804647.db2.gz	LRAPAIKGJVUJNI-IAGOWNOFSA-N	0	3	317.477	2.400	10	0		DEAEHN
CC[C@@H](C)NCC(=O)Nc1cc(S(C)(=O)=O)ccc1Cl	ZINC000037387104	182885567	/nfs/dbraw/zinc/88/55/67/182885567.db2.gz	VUTALJNYCURFKI-SECBINFHSA-N	0	3	318.826	2.070	10	0		DEAEHN
COC(=O)CC[C@@H](N)c1cc(Br)ccc1OC	ZINC000037636667	182915264	/nfs/dbraw/zinc/91/52/64/182915264.db2.gz	MEVCQBKYNKSAIY-SNVBAGLBSA-N	0	3	302.168	2.411	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cc(Br)cn2C)C1	ZINC000040503698	183084240	/nfs/dbraw/zinc/08/42/40/183084240.db2.gz	QHVVIPIUUAWPQT-LLVKDONJSA-N	0	3	314.227	2.002	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2nc3ccc(Cl)cc3s2)C1	ZINC000040629923	183110827	/nfs/dbraw/zinc/11/08/27/183110827.db2.gz	GTHKXZBECWMHFH-PSASIEDQSA-N	0	3	311.794	2.265	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2ccc(Br)c(C)c2)C1	ZINC000040630130	183110909	/nfs/dbraw/zinc/11/09/09/183110909.db2.gz	RFYJZWZTFPZQRK-ZYHUDNBSSA-N	0	3	313.195	2.073	10	0		DEAEHN
CNCc1cccc(Br)c1OCc1nnc(C)o1	ZINC000042411577	183265928	/nfs/dbraw/zinc/26/59/28/183265928.db2.gz	RQGPBQGWKYPYIW-UHFFFAOYSA-N	0	3	312.167	2.439	10	0		DEAEHN
COCCCN(CCOC)[C@@H](CN)c1cc(C)sc1C	ZINC000042420835	183268166	/nfs/dbraw/zinc/26/81/66/183268166.db2.gz	BPHDXFPXHOWFDJ-HNNXBMFYSA-N	0	3	300.468	2.350	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)s1)N(C)CC(=O)N(C)C	ZINC000043252477	183346555	/nfs/dbraw/zinc/34/65/55/183346555.db2.gz	PPLMIWKALMMJBZ-NOZJJQNGSA-N	0	3	303.859	2.200	10	0		DEAEHN
C[C@@H](N)[C@H](c1cc(Br)cs1)N1CCC[C@@H]1CO	ZINC000043286385	183350590	/nfs/dbraw/zinc/35/05/90/183350590.db2.gz	UIPKCNWWYZFGEY-HLUHBDAQSA-N	0	3	319.268	2.356	10	0		DEAEHN
CC(C)CN(CCC(N)=S)CC(=O)Nc1cccc(F)c1	ZINC000043418573	183361255	/nfs/dbraw/zinc/36/12/55/183361255.db2.gz	HGVRRIMRZQBYQB-UHFFFAOYSA-N	0	3	311.426	2.398	10	0		DEAEHN
CN[C@H](CN(C)CC(F)(F)F)c1ccc(OC)cc1OC	ZINC000043900466	183389365	/nfs/dbraw/zinc/38/93/65/183389365.db2.gz	FLDOFWBUTFNVSK-GFCCVEGCSA-N	0	3	306.328	2.458	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)Cc1ccccc1Br	ZINC000104867016	194048507	/nfs/dbraw/zinc/04/85/07/194048507.db2.gz	AHXVIWLDPAPZFL-LBPRGKRZSA-N	0	3	311.223	2.202	10	0		DEAEHN
CCOc1ccc(OC)cc1NC(=O)N1CC[C@H](N(C)C)C1	ZINC000105044230	194067102	/nfs/dbraw/zinc/06/71/02/194067102.db2.gz	REHFKKXJAVCGBL-LBPRGKRZSA-N	0	3	307.394	2.262	10	0		DEAEHN
CO[C@@H]1C[C@@H](CO)N(CCc2cccc(OC(F)(F)F)c2)C1	ZINC000284696878	218136862	/nfs/dbraw/zinc/13/68/62/218136862.db2.gz	SYICTKNCGDZTMC-GXTWGEPZSA-N	0	3	319.323	2.209	10	0		DEAEHN
CC[C@H]1CN(CCOc2cc(C)ccc2C)CCN1C[C@@H](C)O	ZINC000105825100	194138692	/nfs/dbraw/zinc/13/86/92/194138692.db2.gz	BANJITCMRSCZSM-MSOLQXFVSA-N	0	3	320.477	2.459	10	0		DEAEHN
CCOCCN1CCN(C[C@](C)(O)c2ccccc2)C[C@H]1CC	ZINC000105838585	194144159	/nfs/dbraw/zinc/14/41/59/194144159.db2.gz	MXQSDVOPZYBRJH-MOPGFXCFSA-N	0	3	320.477	2.327	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)Nc2cccc(Cl)c2)c1	ZINC000105881292	194155364	/nfs/dbraw/zinc/15/53/64/194155364.db2.gz	FNELSQIMUOCXKU-LBPRGKRZSA-N	0	3	306.797	2.462	10	0		DEAEHN
COc1ccc(OC)c(CN2CCC[C@H](Cn3cncn3)C2)c1	ZINC000105883543	194158181	/nfs/dbraw/zinc/15/81/81/194158181.db2.gz	HIXRQGTXFMJADT-AWEZNQCLSA-N	0	3	316.405	2.208	10	0		DEAEHN
COc1cc(CN2CCN(C[C@@H](C)O)[C@H](C)C2)ccc1SC	ZINC000109328811	194258464	/nfs/dbraw/zinc/25/84/64/194258464.db2.gz	HMFPXKGVXLWYNX-ZIAGYGMSSA-N	0	3	324.490	2.304	10	0		DEAEHN
Cc1nc(C)n(-c2ncc(Br)cc2CNC2CC2)n1	ZINC000051488609	183828180	/nfs/dbraw/zinc/82/81/80/183828180.db2.gz	QHANZIMQRWASNJ-UHFFFAOYSA-N	0	3	322.210	2.294	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)cc1)N1CCNC(=O)C1(C)C	ZINC000110653190	194347153	/nfs/dbraw/zinc/34/71/53/194347153.db2.gz	UYJGPXDCKQIJAF-UONOGXRCSA-N	0	3	309.841	2.329	10	0		DEAEHN
C[C@H]1CN(c2c(C(N)=S)cnc3ccccc32)CCN1C	ZINC000110755781	194357395	/nfs/dbraw/zinc/35/73/95/194357395.db2.gz	BKKGSFOYPIHVSG-NSHDSACASA-N	0	3	300.431	2.009	10	0		DEAEHN
CCc1ccc(S(=O)(=O)N(CC)[C@H]2CCCNC2)s1	ZINC000110941616	194372017	/nfs/dbraw/zinc/37/20/17/194372017.db2.gz	BWCITZYWLXXWNK-NSHDSACASA-N	0	3	302.465	2.073	10	0		DEAEHN
CCCN([C@@H]1CCCNC1)S(=O)(=O)c1cc(C)cc(C)c1	ZINC000110942104	194372495	/nfs/dbraw/zinc/37/24/95/194372495.db2.gz	OOPQSHMEBXFFCO-OAHLLOKOSA-N	0	3	310.463	2.456	10	0		DEAEHN
CCCN(CC(F)(F)F)C(=O)[C@]1(N)C[C@@H](OCC)C1(C)C	ZINC000156946125	197152100	/nfs/dbraw/zinc/15/21/00/197152100.db2.gz	LOMJMCXZOKAVRO-ZWNOBZJWSA-N	0	3	310.360	2.320	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2nnc(C(F)F)s2)C1	ZINC000057292758	184032668	/nfs/dbraw/zinc/03/26/68/184032668.db2.gz	DECWBLZNPBOXQU-SSDOTTSWSA-N	0	3	305.354	2.082	10	0		DEAEHN
Cc1ccc(NC(=O)CN2CCCN(C3CC3)CC2)c(C)c1	ZINC000061040952	184160368	/nfs/dbraw/zinc/16/03/68/184160368.db2.gz	VCBRRTCDYCWMGE-UHFFFAOYSA-N	0	3	301.434	2.412	10	0		DEAEHN
O=S(=O)(CC[C@H]1CCCC[NH2+]1)[N-]c1cc(F)c(F)c(F)c1	ZINC000061120356	184162517	/nfs/dbraw/zinc/16/25/17/184162517.db2.gz	WGULEKQWSVWLBI-SECBINFHSA-N	0	3	322.352	2.378	10	0		DEAEHN
CCCN[C@H](C)c1c(F)cccc1Sc1n[nH]c(=O)n1C	ZINC000061592952	184175896	/nfs/dbraw/zinc/17/58/96/184175896.db2.gz	WNNLVSHNHUGZJW-SECBINFHSA-N	0	3	310.398	2.459	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1ccc(Br)o1	ZINC000061652039	184181454	/nfs/dbraw/zinc/18/14/54/184181454.db2.gz	RKOULDOXVCVWCR-VIFPVBQESA-N	0	3	301.184	2.208	10	0		DEAEHN
CC(C)(CC(N)=O)C[C@H](N)c1cc2c(cc1Cl)OCCO2	ZINC000061825432	184188817	/nfs/dbraw/zinc/18/88/17/184188817.db2.gz	VDDKLNGKTPKHIQ-NSHDSACASA-N	0	3	312.797	2.403	10	0		DEAEHN
NC[C@@H](c1ccc(Br)cc1F)N1CCCOCC1	ZINC000061916420	184195256	/nfs/dbraw/zinc/19/52/56/184195256.db2.gz	JFNJSQYAIABTKJ-ZDUSSCGKSA-N	0	3	317.202	2.310	10	0		DEAEHN
C[C@@H](CCNS(=O)(=O)C[C@@H]1CCCCN1)c1ccccc1	ZINC000061911526	184195283	/nfs/dbraw/zinc/19/52/83/184195283.db2.gz	IIQZNNVKIAPSQF-HOCLYGCPSA-N	0	3	310.463	2.242	10	0		DEAEHN
CN1CC[C@@H](Nc2ccc(I)cc2)C1	ZINC000061984926	184199781	/nfs/dbraw/zinc/19/97/81/184199781.db2.gz	FUHAHKUGMJQXOO-LLVKDONJSA-N	0	3	302.159	2.407	10	0		DEAEHN
CS(=O)(=O)N1CCC(c2ccccc2)(N2CCCC2)CC1	ZINC000062554752	184242370	/nfs/dbraw/zinc/24/23/70/184242370.db2.gz	VRUKNZVXENBUCP-UHFFFAOYSA-N	0	3	308.447	2.033	10	0		DEAEHN
O=C(COc1ccc(OCCN2CCCCC2)cc1)NC1CC1	ZINC000063457441	184282097	/nfs/dbraw/zinc/28/20/97/184282097.db2.gz	VNUIAPVQPDNDHZ-UHFFFAOYSA-N	0	3	318.417	2.209	10	0		DEAEHN
C[C@H](NCCc1nccs1)c1ccc2c(c1)NC(=O)CO2	ZINC000063133623	184272814	/nfs/dbraw/zinc/27/28/14/184272814.db2.gz	ZXSCNLWCCVGTRE-JTQLQIEISA-N	0	3	303.387	2.367	10	0		DEAEHN
CC[NH2+][C@@H](C)c1ccccc1[N-]S(=O)(=O)CCOCC	ZINC000063153869	184274092	/nfs/dbraw/zinc/27/40/92/184274092.db2.gz	AODSELAYPBKHBX-LBPRGKRZSA-N	0	3	300.424	2.135	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@@H]1CSc2ccccc21	ZINC000536016301	284929459	/nfs/dbraw/zinc/92/94/59/284929459.db2.gz	CBLCZQUQWFHFNZ-CQSZACIVSA-N	0	3	314.414	2.062	10	0		DEAEHN
COCOc1ccc(OC)cc1CN[C@@H]1CCCC[C@H]1CO	ZINC000120010021	195080635	/nfs/dbraw/zinc/08/06/35/195080635.db2.gz	NZNQCEZKNRSUMP-XJKSGUPXSA-N	0	3	309.406	2.319	10	0		DEAEHN
O=C1NC(=O)[C@@]2(CCCN([C@@H]3CCc4c3cccc4Cl)C2)N1	ZINC000248689594	296358224	/nfs/dbraw/zinc/35/82/24/296358224.db2.gz	XJYSJDUSVAFKKK-CJNGLKHVSA-N	0	3	319.792	2.001	10	0		DEAEHN
C[C@@H]1C[C@@H]1NS(=O)(=O)c1ccc(F)c(CNC(C)(C)C)c1	ZINC000159109514	197328446	/nfs/dbraw/zinc/32/84/46/197328446.db2.gz	NUIWRCSDVBIPLI-YGRLFVJLSA-N	0	3	314.426	2.401	10	0		DEAEHN
CCN(CCNC(=O)N1CCO[C@@H](c2cccs2)C1)C1CC1	ZINC000159060173	197324090	/nfs/dbraw/zinc/32/40/90/197324090.db2.gz	LOLPJSFJJKNHRJ-CQSZACIVSA-N	0	3	323.462	2.315	10	0		DEAEHN
Cc1cc(CN)cc(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)c1C	ZINC000158764956	197300393	/nfs/dbraw/zinc/30/03/93/197300393.db2.gz	ZWTMZIFYIQXWCH-GASCZTMLSA-N	0	3	308.447	2.183	10	0		DEAEHN
COc1cnn(CCN(C)C)c1[C@@H](O)c1sccc1Cl	ZINC000158761091	197299323	/nfs/dbraw/zinc/29/93/23/197299323.db2.gz	NNXZEMTUQVIDJW-GFCCVEGCSA-N	0	3	315.826	2.250	10	0		DEAEHN
CNc1ncnc2c1cnn2CCN(C)Cc1ccc(F)cc1	ZINC000194429038	533089671	/nfs/dbraw/zinc/08/96/71/533089671.db2.gz	JRDJNDMLANJLBE-UHFFFAOYSA-N	0	3	314.368	2.139	10	0		DEAEHN
Cc1nn(C)c(C)c1CN1CCC(C(=O)N[C@@H](C)C(C)C)CC1	ZINC000157612001	197201565	/nfs/dbraw/zinc/20/15/65/197201565.db2.gz	WQLYHCWCYQBRGR-ZDUSSCGKSA-N	0	3	320.481	2.410	10	0		DEAEHN
Cc1cccc([C@H](O)CN(Cc2ccccc2)C(=O)[C@@H](C)N)c1	ZINC000157655144	197205634	/nfs/dbraw/zinc/20/56/34/197205634.db2.gz	YCYCGQAFCUKWGK-CRAIPNDOSA-N	0	3	312.413	2.404	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000247962102	285194635	/nfs/dbraw/zinc/19/46/35/285194635.db2.gz	CYDGGGTXMQTSBC-KSZLIROESA-N	0	3	315.461	2.422	10	0		DEAEHN
Cc1ccc2ncc(CN3CCC[C@@H](Cn4cncn4)C3)n2c1	ZINC000156676532	197132144	/nfs/dbraw/zinc/13/21/44/197132144.db2.gz	YJBQYHDFMMSUIY-OAHLLOKOSA-N	0	3	310.405	2.146	10	0		DEAEHN
CCS(=O)(=O)CCC[C@H](NC)c1c(F)cccc1OC	ZINC000156111771	197088016	/nfs/dbraw/zinc/08/80/16/197088016.db2.gz	RALXRULSLVGBDN-LBPRGKRZSA-N	0	3	303.399	2.310	10	0		DEAEHN
CC[C@@H](Nc1nc(N)nc(N2CCCC2)n1)c1nccs1	ZINC000156141173	197088931	/nfs/dbraw/zinc/08/89/31/197088931.db2.gz	FMOKIFXCLJBBOE-SECBINFHSA-N	0	3	305.411	2.074	10	0		DEAEHN
Cc1c(N)cccc1CNCc1ccc(S(C)(=O)=O)cc1	ZINC000155577876	197068146	/nfs/dbraw/zinc/06/81/46/197068146.db2.gz	RWGDTKSLDPFZBQ-UHFFFAOYSA-N	0	3	304.415	2.271	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2ccccc2OCC(F)F)C1	ZINC000120390893	195157219	/nfs/dbraw/zinc/15/72/19/195157219.db2.gz	VDQNORYQNWWCIK-LLVKDONJSA-N	0	3	313.348	2.498	10	0		DEAEHN
O=C(NCCNc1ccncc1)Nc1cnc2c(c1)CCCC2	ZINC000560365256	291929651	/nfs/dbraw/zinc/92/96/51/291929651.db2.gz	HUSLMCDTOHFIGT-UHFFFAOYSA-N	0	3	311.389	2.011	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2ccc(Cl)c(F)c2)C[C@H]1C	ZINC000120665900	195212235	/nfs/dbraw/zinc/21/22/35/195212235.db2.gz	ANWFWOUESWAPAI-VXGBXAGGSA-N	0	3	300.805	2.366	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc(COC)cc2)CCN1CCOC	ZINC000120931625	195266713	/nfs/dbraw/zinc/26/67/13/195266713.db2.gz	WSECATNXXAVLHO-GOSISDBHSA-N	0	3	306.450	2.376	10	0		DEAEHN
c1ccc(OC2CC2)c(CN2CCN(C[C@H]3CCOC3)CC2)c1	ZINC000289978431	221356896	/nfs/dbraw/zinc/35/68/96/221356896.db2.gz	JNGVUVULKKJLBB-MRXNPFEDSA-N	0	3	316.445	2.382	10	0		DEAEHN
O=C(c1ccoc1)N1C[C@H]2CCN(Cc3ccncc3)C[C@H]2C1	ZINC000247887354	257114982	/nfs/dbraw/zinc/11/49/82/257114982.db2.gz	XMESQTDUZAFOIG-WBVHZDCISA-N	0	3	311.385	2.269	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1cc(-c2ccncc2)on1	ZINC000120964685	195273469	/nfs/dbraw/zinc/27/34/69/195273469.db2.gz	UPDGNIXFQGUBEY-CQSZACIVSA-N	0	3	316.405	2.443	10	0		DEAEHN
C[C@@H](NC(=O)C1CCN(C)CC1)c1ccccc1-n1cccn1	ZINC000121611436	195316118	/nfs/dbraw/zinc/31/61/18/195316118.db2.gz	DTERSSXRZOUIBN-CQSZACIVSA-N	0	3	312.417	2.391	10	0		DEAEHN
C[C@H]1CC[C@@H](C(=O)NC2CCN(Cc3ccccc3)CC2)O1	ZINC000122022153	195391316	/nfs/dbraw/zinc/39/13/16/195391316.db2.gz	GWPBOVMLBYQMHB-YOEHRIQHSA-N	0	3	302.418	2.335	10	0		DEAEHN
Cc1cc2c(cc1C)O[C@H](C(=O)N1C[C@@H]3CCCN3C[C@H]1C)C2	ZINC000246815865	292005620	/nfs/dbraw/zinc/00/56/20/292005620.db2.gz	KYTLEDRGIZDUEO-HFTRVMKXSA-N	0	3	314.429	2.302	10	0		DEAEHN
CC(C)NC(=O)CCN[C@H](C)c1ccccc1-n1cccn1	ZINC000177206476	132525646	/nfs/dbraw/zinc/52/56/46/132525646.db2.gz	SCCVGTGMXWUKIV-CQSZACIVSA-N	0	3	300.406	2.438	10	0		DEAEHN
CNC(=O)c1cccc(CN[C@@H]2[C@H]3CCCO[C@H]3C2(C)C)c1	ZINC000245956934	132574154	/nfs/dbraw/zinc/57/41/54/132574154.db2.gz	XKONNVWLDOUZDJ-BZUAXINKSA-N	0	3	302.418	2.339	10	0		DEAEHN
c1ccc(OC[C@@H]2CN(CCN3CCCCC3)CCO2)cc1	ZINC000361987712	133203321	/nfs/dbraw/zinc/20/33/21/133203321.db2.gz	UJBDWSWZRYOFAE-SFHVURJKSA-N	0	3	304.434	2.252	10	0		DEAEHN
O[C@]1(C2CC2)CCN(Cc2cnn(Cc3ccc(F)cc3)c2)C1	ZINC000373271139	133384701	/nfs/dbraw/zinc/38/47/01/133384701.db2.gz	PEFUFXOVSPONPL-GOSISDBHSA-N	0	3	315.392	2.417	10	0		DEAEHN
CCN1CCN(c2cccc(Nc3ccncc3C#N)c2)CC1	ZINC000547504479	285593155	/nfs/dbraw/zinc/59/31/55/285593155.db2.gz	BQOYHDLJFQZHAS-UHFFFAOYSA-N	0	3	307.401	2.261	10	0		DEAEHN
O=C(N[C@H]1CCn2ccnc2C1)c1cccc(CN2CCCC2)c1	ZINC000548310886	285716164	/nfs/dbraw/zinc/71/61/64/285716164.db2.gz	ZJJSGOZDYOQYSQ-KRWDZBQOSA-N	0	3	324.428	2.224	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)NCCN1CCCCC1)CC2	ZINC000364627966	404477110	/nfs/dbraw/zinc/47/71/10/404477110.db2.gz	ANNSAQICKXDEIC-CQSZACIVSA-N	0	3	318.465	2.240	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NCCN1CCCCC1)C2	ZINC000364627966	404477114	/nfs/dbraw/zinc/47/71/14/404477114.db2.gz	ANNSAQICKXDEIC-CQSZACIVSA-N	0	3	318.465	2.240	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NCCN1CCCCC1)CC2	ZINC000364627965	404477193	/nfs/dbraw/zinc/47/71/93/404477193.db2.gz	ANNSAQICKXDEIC-AWEZNQCLSA-N	0	3	318.465	2.240	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NCCN1CCCCC1)C2	ZINC000364627965	404477198	/nfs/dbraw/zinc/47/71/98/404477198.db2.gz	ANNSAQICKXDEIC-AWEZNQCLSA-N	0	3	318.465	2.240	10	0		DEAEHN
CO[C@@H](C)[C@@H](C)N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1	ZINC000564760385	292108916	/nfs/dbraw/zinc/10/89/16/292108916.db2.gz	HHVAIXXYCQXWND-UPJWGTAASA-N	0	3	314.451	2.011	10	0		DEAEHN
Cc1nccn1C[C@H](C)CNC(=O)NCCN1CCCC[C@@H]1C	ZINC000124114693	144706691	/nfs/dbraw/zinc/70/66/91/144706691.db2.gz	UMFBKHNMZYDPEX-CABCVRRESA-N	0	3	321.469	2.001	10	0		DEAEHN
Cn1cnc(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)c1	ZINC000188253030	145009504	/nfs/dbraw/zinc/00/95/04/145009504.db2.gz	PWIVHJAOAKVZJJ-SFHVURJKSA-N	0	3	312.417	2.205	10	0		DEAEHN
O=C([C@@H]1CCCO[C@@H]1c1ccccc1)N1CCN2CCC1CC2	ZINC000188624101	145014574	/nfs/dbraw/zinc/01/45/74/145014574.db2.gz	QTXAOLDTFAJWMG-QZTJIDSGSA-N	0	3	314.429	2.461	10	0		DEAEHN
CCN(CC)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000188956802	145020084	/nfs/dbraw/zinc/02/00/84/145020084.db2.gz	HMXURWAAFKYAMQ-GOSISDBHSA-N	0	3	319.449	2.017	10	0		DEAEHN
COc1ccc(O)cc1C(=O)N[C@H](C)CN1CCCCCC1	ZINC000189187828	145024144	/nfs/dbraw/zinc/02/41/44/145024144.db2.gz	UIXPZLPTZLYGEE-CYBMUJFWSA-N	0	3	306.406	2.395	10	0		DEAEHN
CC1CCN(CC(=O)N2CCC(Nc3nccs3)CC2)CC1	ZINC000190421043	145042262	/nfs/dbraw/zinc/04/22/62/145042262.db2.gz	UJMNOZHPCFNDLS-UHFFFAOYSA-N	0	3	322.478	2.278	10	0		DEAEHN
CN(CC(=O)OC(C)(C)C)[C@H]1CCCN(Cc2c[nH]cn2)CC1	ZINC000190853852	145048849	/nfs/dbraw/zinc/04/88/49/145048849.db2.gz	BOGISQZDBWRLDA-HNNXBMFYSA-N	0	3	322.453	2.038	10	0		DEAEHN
CN(CC(=O)OC(C)(C)C)[C@H]1CCCN(Cc2cnc[nH]2)CC1	ZINC000190853852	145048850	/nfs/dbraw/zinc/04/88/50/145048850.db2.gz	BOGISQZDBWRLDA-HNNXBMFYSA-N	0	3	322.453	2.038	10	0		DEAEHN
Oc1ccc(N2CCN(C[C@H](O)CC3CCCC3)CC2)cc1	ZINC000191221611	145054555	/nfs/dbraw/zinc/05/45/55/145054555.db2.gz	KXAHDTKNLSVAMA-GOSISDBHSA-N	0	3	304.434	2.455	10	0		DEAEHN
CC[C@H](CO)N1CCN(Cc2ccc(OCC3CC3)cc2)CC1	ZINC000191414445	145057530	/nfs/dbraw/zinc/05/75/30/145057530.db2.gz	FLDFVCBJZVAZJU-GOSISDBHSA-N	0	3	318.461	2.364	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)CCC(=O)OC(C)(C)C	ZINC000191913014	145067562	/nfs/dbraw/zinc/06/75/62/145067562.db2.gz	GIVBLONRQASLDZ-ZDUSSCGKSA-N	0	3	300.443	2.201	10	0		DEAEHN
Cn1c2ccc(CN3CCC[C@@H]3C(C)(C)O)cc2sc1=O	ZINC000192720216	145077657	/nfs/dbraw/zinc/07/76/57/145077657.db2.gz	FWQMHIRHLCKPRG-CQSZACIVSA-N	0	3	306.431	2.335	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@H](C)N2CCN3CCC[C@H]3C2)cc1F	ZINC000246207140	145094718	/nfs/dbraw/zinc/09/47/18/145094718.db2.gz	ADERNTFZOXHYQI-HIFRSBDPSA-N	0	3	305.397	2.241	10	0		DEAEHN
C[C@@H](C(=O)N1CCCc2ccccc21)N1CCN2CCC[C@H]2C1	ZINC000246239190	145095754	/nfs/dbraw/zinc/09/57/54/145095754.db2.gz	DCQCTJWPGQFQDX-RDJZCZTQSA-N	0	3	313.445	2.134	10	0		DEAEHN
CCc1cc(N2CCC[C@H](N[C@H](C)c3cnn(C)c3)C2)ncn1	ZINC000246284276	145097381	/nfs/dbraw/zinc/09/73/81/145097381.db2.gz	BUAUGGVFVNVEIJ-CJNGLKHVSA-N	0	3	314.437	2.092	10	0		DEAEHN
C[C@@H]1CN(C[C@@H](O)c2ccccc2Cl)C[C@@H]1N1CCOCC1	ZINC000246325133	145098830	/nfs/dbraw/zinc/09/88/30/145098830.db2.gz	DIGOKKVIXAKSTA-XOKHGSTOSA-N	0	3	324.852	2.026	10	0		DEAEHN
COC(=O)[C@@H]1C[C@H](c2ccccc2)CN(Cc2cnn(C)c2)C1	ZINC000246315062	145098922	/nfs/dbraw/zinc/09/89/22/145098922.db2.gz	RBBFZGSUGVVROE-DLBZAZTESA-N	0	3	313.401	2.199	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1	ZINC000246331906	145099527	/nfs/dbraw/zinc/09/95/27/145099527.db2.gz	GHTNVNBTGWJNEE-CJNGLKHVSA-N	0	3	317.433	2.032	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)c2cccc(C)c2)[C@@H](C)C1	ZINC000246685601	145110524	/nfs/dbraw/zinc/11/05/24/145110524.db2.gz	YLPZDBAJDKJMTQ-GOEBONIOSA-N	0	3	310.463	2.346	10	0		DEAEHN
CCN(Cc1ccccn1)C(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000246718340	145111741	/nfs/dbraw/zinc/11/17/41/145111741.db2.gz	ABFQFQUMBHISDN-GDBMZVCRSA-N	0	3	304.438	2.342	10	0		DEAEHN
CS(=O)(=O)N1CCC[C@H](CN2CCC[C@H]2c2ccco2)C1	ZINC000246750083	145112411	/nfs/dbraw/zinc/11/24/11/145112411.db2.gz	ZGECPXWPRQDHTE-KGLIPLIRSA-N	0	3	312.435	2.088	10	0		DEAEHN
O[C@H](COCc1ccco1)CN1CCCC[C@H]1c1cn[nH]c1	ZINC000246797153	145114735	/nfs/dbraw/zinc/11/47/35/145114735.db2.gz	MQHSADRALMVEME-HOCLYGCPSA-N	0	3	305.378	2.107	10	0		DEAEHN
CSc1cc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)ccn1	ZINC000246853203	145117304	/nfs/dbraw/zinc/11/73/04/145117304.db2.gz	UARCCBJBENRCNX-UONOGXRCSA-N	0	3	305.447	2.360	10	0		DEAEHN
CC[C@@H]1CN(CCCOc2ccc(F)cc2)CCN1C[C@H](C)O	ZINC000247080717	145125559	/nfs/dbraw/zinc/12/55/59/145125559.db2.gz	HBDTVUCCYVGAOI-DOTOQJQBSA-N	0	3	324.440	2.372	10	0		DEAEHN
C[C@@H](c1ccc(F)cc1)N(C)C(=O)CN1CCN2CCC[C@H]2C1	ZINC000247101572	145126532	/nfs/dbraw/zinc/12/65/32/145126532.db2.gz	IFBLTKNAWBICKX-YOEHRIQHSA-N	0	3	319.424	2.125	10	0		DEAEHN
O=C([C@@H]1C[C@@H]1c1cc(F)ccc1F)N1CCN2CCC[C@H]2C1	ZINC000247517683	145140539	/nfs/dbraw/zinc/14/05/39/145140539.db2.gz	WFEUCGRNPOLRHD-GZBFAFLISA-N	0	3	306.356	2.375	10	0		DEAEHN
Cc1noc(C)c1CC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248122658	145148852	/nfs/dbraw/zinc/14/88/52/145148852.db2.gz	URMFXSZWTSTRJL-WMZOPIPTSA-N	0	3	313.401	2.396	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1nncs1	ZINC000248396350	145152739	/nfs/dbraw/zinc/15/27/39/145152739.db2.gz	PVQVQAYBXBLLPS-WCQYABFASA-N	0	3	317.418	2.180	10	0		DEAEHN
CCCN(CCN(CC)CC)S(=O)(=O)N1CCC[C@@H](C)C1	ZINC000248403606	145153279	/nfs/dbraw/zinc/15/32/79/145153279.db2.gz	YRZKWTKOQDRTMU-OAHLLOKOSA-N	0	3	319.515	2.017	10	0		DEAEHN
CC[C@@H]1CN(c2ccccc2)CCN1C[C@@H](O)COC(C)C	ZINC000248400652	145153672	/nfs/dbraw/zinc/15/36/72/145153672.db2.gz	XVBPLXSFVSFFMF-SJLPKXTDSA-N	0	3	306.450	2.373	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1CCCCCS(=O)(=O)CC	ZINC000248967181	145174344	/nfs/dbraw/zinc/17/43/44/145174344.db2.gz	BUZFWIXPKQLPLW-CVEARBPZSA-N	0	3	316.511	2.150	10	0		DEAEHN
C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NC[C@H]2CCCN2C)cc1	ZINC000249741859	145188973	/nfs/dbraw/zinc/18/89/73/145188973.db2.gz	IVDGPBVMQZXLJM-WQVCFCJDSA-N	0	3	315.417	2.105	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)NC[C@H]2CCCN2C)cc1	ZINC000249741856	145189268	/nfs/dbraw/zinc/18/92/68/145189268.db2.gz	IVDGPBVMQZXLJM-DAXOMENPSA-N	0	3	315.417	2.105	10	0		DEAEHN
CN1CC[C@H](NC(=O)c2ccc(NC=O)cc2)[C@H]1c1ccccc1	ZINC000252801462	145201097	/nfs/dbraw/zinc/20/10/97/145201097.db2.gz	JOTUAVSWHCGFET-ZWKOTPCHSA-N	0	3	323.396	2.430	10	0		DEAEHN
Fc1ccc(OCCN2CCNC[C@H]2c2cccnc2)cc1	ZINC000261602003	145208950	/nfs/dbraw/zinc/20/89/50/145208950.db2.gz	AMKTVQRZNRSKDP-KRWDZBQOSA-N	0	3	301.365	2.246	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)Nc1ccc(-n2cncn2)c(F)c1	ZINC000261626167	145211590	/nfs/dbraw/zinc/21/15/90/145211590.db2.gz	COXLXOORYUGLIG-AWEZNQCLSA-N	0	3	317.368	2.123	10	0		DEAEHN
COc1ccccc1[C@H]1CNCCN1CCOCC(F)(F)F	ZINC000261647854	145213074	/nfs/dbraw/zinc/21/30/74/145213074.db2.gz	GCJAMIISNRVVBE-CYBMUJFWSA-N	0	3	318.339	2.220	10	0		DEAEHN
CN(Cc1ccc(F)cc1Cl)C(=O)[C@H](N)C1CCOCC1	ZINC000261770078	145224386	/nfs/dbraw/zinc/22/43/86/145224386.db2.gz	MFIBDIWQUTZLNV-CQSZACIVSA-N	0	3	314.788	2.191	10	0		DEAEHN
COc1cc(N[C@@H]2CCC[C@@H]2[C@@H]2COCCN2)cc(OC)c1	ZINC000261888054	145238112	/nfs/dbraw/zinc/23/81/12/145238112.db2.gz	GDQMBRSSCRDPSK-BBWFWOEESA-N	0	3	306.406	2.273	10	0		DEAEHN
N[C@@H](C(=O)NCCCCCc1ccccc1)C1CCOCC1	ZINC000261901862	145239677	/nfs/dbraw/zinc/23/96/77/145239677.db2.gz	WPXJSCWBBPVNFO-QGZVFWFLSA-N	0	3	304.434	2.270	10	0		DEAEHN
CCn1cc(CN2CCNC[C@H]2c2ccccc2OC)cn1	ZINC000261898584	145239730	/nfs/dbraw/zinc/23/97/30/145239730.db2.gz	WILJIYKDLHFQLQ-INIZCTEOSA-N	0	3	300.406	2.058	10	0		DEAEHN
NC1(C(=O)N(Cc2ccc(F)cc2)CC2CC2)CCOCC1	ZINC000261914987	145240684	/nfs/dbraw/zinc/24/06/84/145240684.db2.gz	UEYJSQWHSPHRMJ-UHFFFAOYSA-N	0	3	306.381	2.072	10	0		DEAEHN
CCCN(CCc1cccc(F)c1)C(=O)C1(N)CCOCC1	ZINC000261922495	145242530	/nfs/dbraw/zinc/24/25/30/145242530.db2.gz	VCZXESHTPZDMEL-UHFFFAOYSA-N	0	3	308.397	2.115	10	0		DEAEHN
COc1ccc(NC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)cc1F	ZINC000261956886	145247319	/nfs/dbraw/zinc/24/73/19/145247319.db2.gz	XGLMHRZWPRDUNM-PZSREKOKSA-N	0	3	322.380	2.305	10	0		DEAEHN
C[C@H](C(=O)NCc1ccc(CO)c(F)c1)[C@H](N)c1ccccc1	ZINC000262305628	145275297	/nfs/dbraw/zinc/27/52/97/145275297.db2.gz	OPMCOXCQVYIASF-SJCJKPOMSA-N	0	3	316.376	2.270	10	0		DEAEHN
Cc1cccc(N(C)C(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)c1	ZINC000262412805	145282308	/nfs/dbraw/zinc/28/23/08/145282308.db2.gz	DHKLPTNHSQISPW-HDMKZQKVSA-N	0	3	302.418	2.490	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)Nc1cc(F)cc(F)c1	ZINC000262460104	145285384	/nfs/dbraw/zinc/28/53/84/145285384.db2.gz	ILCKKAIJFZAFCQ-IOASZLSFSA-N	0	3	310.344	2.436	10	0		DEAEHN
COc1cc(-c2noc([C@@H]3C[C@H]4CCCC[C@H]4N3)n2)ncn1	ZINC000262516572	145290037	/nfs/dbraw/zinc/29/00/37/145290037.db2.gz	NPWRDKKULXRKJY-FOGDFJRCSA-N	0	3	301.350	2.128	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H]2CC[NH2+]C[C@H]2C)c(Cl)cc1F	ZINC000262787401	145304732	/nfs/dbraw/zinc/30/47/32/145304732.db2.gz	QRIYRDBKKLOHQM-BXKDBHETSA-N	0	3	320.817	2.064	10	0		DEAEHN
NC[C@@H](NS(=O)(=O)CC1CC1)c1ccc2ccccc2c1	ZINC000262802356	145305911	/nfs/dbraw/zinc/30/59/11/145305911.db2.gz	RESOBGAHRRAZCY-MRXNPFEDSA-N	0	3	304.415	2.169	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2ccccc2Br)n1	ZINC000263112083	145326497	/nfs/dbraw/zinc/32/64/97/145326497.db2.gz	AJEWSSHVWDPGGZ-LLVKDONJSA-N	0	3	323.194	2.075	10	0		DEAEHN
Cc1ccc(C(C)(C)c2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263169253	145331684	/nfs/dbraw/zinc/33/16/84/145331684.db2.gz	FNYMMRQFANEVKQ-CQSZACIVSA-N	0	3	300.406	2.280	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2c[nH]cc2-c2ccccc2)n1	ZINC000263164862	145331836	/nfs/dbraw/zinc/33/18/36/145331836.db2.gz	FDDJGSQQLQEPBG-HNNXBMFYSA-N	0	3	309.373	2.308	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2csc(-c3ccoc3)n2)n1	ZINC000263191477	145334238	/nfs/dbraw/zinc/33/42/38/145334238.db2.gz	HXOQEXWVUQRZSA-NSHDSACASA-N	0	3	317.374	2.029	10	0		DEAEHN
C[C@@H](Cc1nc([C@@H]2CNCCN2C)no1)c1ccc(F)cc1	ZINC000263222204	145337818	/nfs/dbraw/zinc/33/78/18/145337818.db2.gz	MCHSZQIDWKMCDH-FZMZJTMJSA-N	0	3	304.369	2.131	10	0		DEAEHN
Cc1cc2cc(CNC(=O)NCCNc3ccncc3)ccc2[nH]1	ZINC000358412004	147128450	/nfs/dbraw/zinc/12/84/50/147128450.db2.gz	MRTJYTBYEKVQEC-UHFFFAOYSA-N	0	3	323.400	2.205	10	0		DEAEHN
C[C@@H](Cn1nnc(-c2ccc(Br)cc2)n1)N(C)C	ZINC000358853989	147219271	/nfs/dbraw/zinc/21/92/71/147219271.db2.gz	NVQGCUOJMGWFJJ-VIFPVBQESA-N	0	3	310.199	2.053	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)NC[C@](C)(O)C2CCCCC2)CCN1C	ZINC000358924188	147232553	/nfs/dbraw/zinc/23/25/53/147232553.db2.gz	DCCSANPGIXERQH-KMFMINBZSA-N	0	3	311.470	2.100	10	0		DEAEHN
CO[C@H](C)[C@H](C)NC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000359530579	147344950	/nfs/dbraw/zinc/34/49/50/147344950.db2.gz	QZYBFHWKWQZYAP-LSDHHAIUSA-N	0	3	304.434	2.438	10	0		DEAEHN
C[C@@H](c1cccnc1)N1CCC(c2ccnn2CCO)CC1	ZINC000371488520	148109265	/nfs/dbraw/zinc/10/92/65/148109265.db2.gz	QWIRHJUFRISKQP-AWEZNQCLSA-N	0	3	300.406	2.211	10	0		DEAEHN
CC(C)CC[C@H](NC(=O)NC[C@](C)(O)CN(C)C)C(C)(C)C	ZINC000127132189	401721510	/nfs/dbraw/zinc/72/15/10/401721510.db2.gz	YZVYENJQUSOWRT-YOEHRIQHSA-N	0	3	315.502	2.449	10	0		DEAEHN
C[C@@H](C(=O)N(C)C)N1CCC(CN2CCc3ccccc32)CC1	ZINC000111696909	401721555	/nfs/dbraw/zinc/72/15/55/401721555.db2.gz	NXJALIXQXUBTES-HNNXBMFYSA-N	0	3	315.461	2.238	10	0		DEAEHN
Brc1cnc(NCCCNCc2cccnc2)nc1	ZINC000111751188	401722759	/nfs/dbraw/zinc/72/27/59/401722759.db2.gz	JRARFOPVOKYUTQ-UHFFFAOYSA-N	0	3	322.210	2.226	10	0		DEAEHN
CCC1CCC(NC(=O)NC[C@@H]2CCCN2CCOC)CC1	ZINC000111833782	401725409	/nfs/dbraw/zinc/72/54/09/401725409.db2.gz	AETRJYLGZSLYPY-GPANFISMSA-N	0	3	311.470	2.365	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CCc2c1cccc2C	ZINC000111865111	401726451	/nfs/dbraw/zinc/72/64/51/401726451.db2.gz	XCINHWROYQLGEE-HNNXBMFYSA-N	0	3	317.433	2.178	10	0		DEAEHN
C[C@@H](CNC(=O)N(C)C[C@@H]1CCCO1)N(C)Cc1ccccc1	ZINC000111875817	401726854	/nfs/dbraw/zinc/72/68/54/401726854.db2.gz	DYWWVGHMCMHJDF-RDJZCZTQSA-N	0	3	319.449	2.327	10	0		DEAEHN
NC1(C(=O)Nc2cc(Br)ccc2F)CCOCC1	ZINC000127752339	401748761	/nfs/dbraw/zinc/74/87/61/401748761.db2.gz	XIUVRGYNULTOAM-UHFFFAOYSA-N	0	3	317.158	2.035	10	0		DEAEHN
CC(C)C[C@H](C)S(=O)(=O)N1CCC[C@@H]1CN1CCCC1	ZINC000074370045	401737039	/nfs/dbraw/zinc/73/70/39/401737039.db2.gz	FXLNARXQJUMJAH-LSDHHAIUSA-N	0	3	302.484	2.311	10	0		DEAEHN
CC[C@H](NC(=O)N1CCCN(C2CC2)CC1)c1ccncc1	ZINC000074470119	401739850	/nfs/dbraw/zinc/73/98/50/401739850.db2.gz	YLUOQSBIFJUHER-INIZCTEOSA-N	0	3	302.422	2.412	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N(C)C1CCC(CO)CC1	ZINC000126425938	401693860	/nfs/dbraw/zinc/69/38/60/401693860.db2.gz	SDNWEHGEFSRXTH-HWOWSKLDSA-N	0	3	313.486	2.155	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H](C)c1ccc(-n2ccnn2)cc1)N(C)C	ZINC000126545874	401699380	/nfs/dbraw/zinc/69/93/80/401699380.db2.gz	IGQUVRAVARLAIC-BBRMVZONSA-N	0	3	315.421	2.175	10	0		DEAEHN
Nc1c(Cl)cc(C(=O)N2CCN3CCC[C@H]3C2)cc1Cl	ZINC000126644179	401703151	/nfs/dbraw/zinc/70/31/51/401703151.db2.gz	JQZISKUVMKEIGV-JTQLQIEISA-N	0	3	314.216	2.496	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCO[C@@H](c2ccco2)C1	ZINC000126731911	401706273	/nfs/dbraw/zinc/70/62/73/401706273.db2.gz	KWOCMUOAFTUUGF-GDBMZVCRSA-N	0	3	323.437	2.339	10	0		DEAEHN
CC(C)(CNC(=O)c1cnn2c1CCCC2)N1CCCCC1	ZINC000126989261	401715875	/nfs/dbraw/zinc/71/58/75/401715875.db2.gz	OQPPMZVHQFNJII-UHFFFAOYSA-N	0	3	304.438	2.214	10	0		DEAEHN
Cc1ncc(CNCC[C@@H](C)[S@@](C)=O)n1-c1ccccc1	ZINC000129318096	401802439	/nfs/dbraw/zinc/80/24/39/401802439.db2.gz	GMESAEGRBBTVBC-ASSNKEHSSA-N	0	3	305.447	2.427	10	0		DEAEHN
COCCN(C)CCNC(=O)N1CCC[C@]2(CC=CCC2)C1	ZINC000114526804	401802944	/nfs/dbraw/zinc/80/29/44/401802944.db2.gz	IXIOUYLZXXQZQW-QGZVFWFLSA-N	0	3	309.454	2.097	10	0		DEAEHN
C[C@@H](CCNCc1cc(Cl)c2c(c1)OCCO2)[S@](C)=O	ZINC000129384258	401803583	/nfs/dbraw/zinc/80/35/83/401803583.db2.gz	AEPYPICSRUVAPJ-WVDJIFEKSA-N	0	3	317.838	2.358	10	0		DEAEHN
Cc1cccc(-c2n[nH]cc2CN2CCO[C@@H](CN(C)C)C2)c1	ZINC000128154234	401765283	/nfs/dbraw/zinc/76/52/83/401765283.db2.gz	HQMANQVAUNKNGD-KRWDZBQOSA-N	0	3	314.433	2.148	10	0		DEAEHN
O=C(Nc1ccccc1)[C@H]1CCCN([C@@H]2CCCCNC2=O)C1	ZINC000011165752	401773717	/nfs/dbraw/zinc/77/37/17/401773717.db2.gz	AUUMVKPVEAHHES-GOEBONIOSA-N	0	3	315.417	2.006	10	0		DEAEHN
COc1cc(C)cc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1O	ZINC000113444821	401779326	/nfs/dbraw/zinc/77/93/26/401779326.db2.gz	VGHOAKQKZHPINU-QWHCGFSZSA-N	0	3	304.390	2.018	10	0		DEAEHN
COc1ccc2c(c1)CCN2C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1	ZINC000130312643	401827170	/nfs/dbraw/zinc/82/71/70/401827170.db2.gz	NKJXGOLFOZWSFF-OCCSQVGLSA-N	0	3	315.417	2.393	10	0		DEAEHN
Cc1ccc(NC(=O)N[C@@H](C)[C@@H](C)CO)c(OCCN(C)C)c1	ZINC000077722776	401827277	/nfs/dbraw/zinc/82/72/77/401827277.db2.gz	NIHPOIDGJCHVIB-KBPBESRZSA-N	0	3	323.437	2.074	10	0		DEAEHN
CN(C[C@H]1CCCN(C)C1)C(=O)N[C@@H]1COc2ccccc21	ZINC000115813422	401837782	/nfs/dbraw/zinc/83/77/82/401837782.db2.gz	BFDYWODVYOLMRM-DZGCQCFKSA-N	0	3	303.406	2.103	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000115837862	401838277	/nfs/dbraw/zinc/83/82/77/401838277.db2.gz	UBXUSRFVGBSYLM-DOTOQJQBSA-N	0	3	316.449	2.001	10	0		DEAEHN
CC1(C)CCCN1CC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000077382691	401812641	/nfs/dbraw/zinc/81/26/41/401812641.db2.gz	UBRPRVDVKQQDCP-UHFFFAOYSA-N	0	3	317.433	2.336	10	0		DEAEHN
COC(=O)[C@H](O)C1CCN([C@@H](C)c2cccc(OC)c2)CC1	ZINC000135352540	401937204	/nfs/dbraw/zinc/93/72/04/401937204.db2.gz	RTZQKDMHUVXJMB-BLLLJJGKSA-N	0	3	307.390	2.002	10	0		DEAEHN
CC[C@](C)(O)C[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000087013607	401925918	/nfs/dbraw/zinc/92/59/18/401925918.db2.gz	RRPUFAYFIFFRCF-ZDUSSCGKSA-N	0	3	318.211	2.414	10	0		DEAEHN
CCOCCC1(CNC(=O)N2CC[C@H](N(C)C)C2)CCCC1	ZINC000119167008	401930674	/nfs/dbraw/zinc/93/06/74/401930674.db2.gz	VMCSYFAQLZXCJN-HNNXBMFYSA-N	0	3	311.470	2.319	10	0		DEAEHN
CCN1CCC[C@H](Nc2ccc(-n3nc(C)cc3C)nn2)C1	ZINC000133442207	401886259	/nfs/dbraw/zinc/88/62/59/401886259.db2.gz	VRFYMPMDJYRRAE-AWEZNQCLSA-N	0	3	300.410	2.175	10	0		DEAEHN
C[C@@H](O)C1CCN(C(=O)[C@H]2CCCN2Cc2ccccc2)CC1	ZINC000118729370	401905781	/nfs/dbraw/zinc/90/57/81/401905781.db2.gz	QYJSIMBSNCHAJX-CRAIPNDOSA-N	0	3	316.445	2.270	10	0		DEAEHN
CNCC(=O)Nc1ccc(I)cc1Cl	ZINC000037045446	401909992	/nfs/dbraw/zinc/90/99/92/401909992.db2.gz	LVEYNOCXQLCOJT-UHFFFAOYSA-N	0	3	324.549	2.103	10	0		DEAEHN
CC[C@@H](c1ccc(Cl)cc1)N(C)CC(=O)N1CCNCC1	ZINC000038030932	401920419	/nfs/dbraw/zinc/92/04/19/401920419.db2.gz	YFDSSODRPMSNPT-HNNXBMFYSA-N	0	3	309.841	2.155	10	0		DEAEHN
C[C@](CO)(NC[C@H]1CCCO1)c1ccc(Br)cc1	ZINC000038114610	401923199	/nfs/dbraw/zinc/92/31/99/401923199.db2.gz	ORHDUHOOOVTKFM-ZIAGYGMSSA-N	0	3	314.223	2.425	10	0		DEAEHN
COCCOc1ccc(CN2CCC[C@@H](n3cncn3)C2)cc1	ZINC000119524566	401956644	/nfs/dbraw/zinc/95/66/44/401956644.db2.gz	SGHAEXVIDBNPBH-MRXNPFEDSA-N	0	3	316.405	2.140	10	0		DEAEHN
CC(=O)CCN1CCC(C(=O)NCCc2cccs2)CC1	ZINC000119676568	401962719	/nfs/dbraw/zinc/96/27/19/401962719.db2.gz	UEESQGKLINOJFS-UHFFFAOYSA-N	0	3	308.447	2.098	10	0		DEAEHN
CCN(C[C@H](O)COC(C)(C)C)C[C@@H]1COc2ccccc2O1	ZINC000046704969	401971777	/nfs/dbraw/zinc/97/17/77/401971777.db2.gz	DCORKMQWYRVKEN-LSDHHAIUSA-N	0	3	323.433	2.324	10	0		DEAEHN
C[C@H](NC(=O)N1CCN(C2CCCCC2)CC1)[C@@H]1CCCO1	ZINC000136968627	401977040	/nfs/dbraw/zinc/97/70/40/401977040.db2.gz	ZUTWQXQXXWZFRH-HOCLYGCPSA-N	0	3	309.454	2.214	10	0		DEAEHN
CC(C)C[C@@H](C)NC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000091889030	401998715	/nfs/dbraw/zinc/99/87/15/401998715.db2.gz	OSLUCVNOGMFLAW-IAGOWNOFSA-N	0	3	324.513	2.233	10	0		DEAEHN
CC(C)(C)OC(=O)N1C[C@H](N)[C@@H](c2nccc3[nH]ccc32)C1	ZINC000089220769	401938621	/nfs/dbraw/zinc/93/86/21/401938621.db2.gz	VCNPCIVVKYWICT-RYUDHWBXSA-N	0	3	302.378	2.225	10	0		DEAEHN
CCC[C@@H](C)NC(=O)C(C)S(=O)(=O)Cc1ccccc1F	ZINC000044640639	401946229	/nfs/dbraw/zinc/94/62/29/401946229.db2.gz	DPNYTWCPFBTFSY-VXGBXAGGSA-N	0	3	315.410	2.434	10	0		DEAEHN
COCc1nc(C)c(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)s1	ZINC000135656971	401949997	/nfs/dbraw/zinc/94/99/97/401949997.db2.gz	GJUCSFOJYRZXBX-ZYHUDNBSSA-N	0	3	311.451	2.153	10	0		DEAEHN
C[C@@H](NCCc1ccsc1)c1cccc(S(N)(=O)=O)c1	ZINC000049153417	402013346	/nfs/dbraw/zinc/01/33/46/402013346.db2.gz	GPQMXAAIMQQOGP-LLVKDONJSA-N	0	3	310.444	2.289	10	0		DEAEHN
COc1ccccc1/C=C/CN1CC[C@H](CN2CCOCC2)C1	ZINC000093664725	402018599	/nfs/dbraw/zinc/01/85/99/402018599.db2.gz	ROUXVKOZFKLDMQ-YXMMZVCTSA-N	0	3	316.445	2.363	10	0		DEAEHN
CC(C)Oc1cncc(C(=O)NCCN2CCCC[C@@H]2C)c1	ZINC000151295530	402027933	/nfs/dbraw/zinc/02/79/33/402027933.db2.gz	JLDPUELMOVDCES-AWEZNQCLSA-N	0	3	305.422	2.473	10	0		DEAEHN
C[C@H]1CCCCN1CC(=O)NCCN1CCc2ccccc21	ZINC000051228064	402032865	/nfs/dbraw/zinc/03/28/65/402032865.db2.gz	FDELSGKDXAXILJ-HNNXBMFYSA-N	0	3	301.434	2.040	10	0		DEAEHN
Cc1cc2ncn(C[C@H](O)CN(C)C[C@@H]3CCCO3)c2cc1C	ZINC000052103363	402039492	/nfs/dbraw/zinc/03/94/92/402039492.db2.gz	LBVVVBIGAGAEFM-CVEARBPZSA-N	0	3	317.433	2.125	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCCOc2ccccc2)C1	ZINC000052519358	402043137	/nfs/dbraw/zinc/04/31/37/402043137.db2.gz	PRHXFDHUVJZEIB-HNNXBMFYSA-N	0	3	305.422	2.239	10	0		DEAEHN
CC(C)c1cc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc(=O)[nH]1	ZINC000121548079	402043381	/nfs/dbraw/zinc/04/33/81/402043381.db2.gz	KAOVIWPIRUHZKA-GXTWGEPZSA-N	0	3	305.422	2.465	10	0		DEAEHN
CCOc1cccc(CNC(=O)N[C@H]2CCCN(CC)C2)c1	ZINC000052523998	402043551	/nfs/dbraw/zinc/04/35/51/402043551.db2.gz	ZYTAJJKEYRAROS-HNNXBMFYSA-N	0	3	305.422	2.369	10	0		DEAEHN
O=C(NCCCN1CCC(O)CC1)[C@@H]1C[C@@H]1C1CCCCC1	ZINC000121626571	402046908	/nfs/dbraw/zinc/04/69/08/402046908.db2.gz	IFEJKSIAGVFWEY-IAGOWNOFSA-N	0	3	308.466	2.166	10	0		DEAEHN
O[C@@H](COCc1ccco1)CN1CCCC[C@@H]1c1cn[nH]c1	ZINC000121826141	402054330	/nfs/dbraw/zinc/05/43/30/402054330.db2.gz	MQHSADRALMVEME-GDBMZVCRSA-N	0	3	305.378	2.107	10	0		DEAEHN
COCCN1CCN(C/C=C/c2ccccc2OC)C[C@H]1C	ZINC000120820334	402003621	/nfs/dbraw/zinc/00/36/21/402003621.db2.gz	WZSYZNHXOFJEDF-IQIBNGDESA-N	0	3	304.434	2.361	10	0		DEAEHN
COC[C@H](C)C(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000092515700	402005123	/nfs/dbraw/zinc/00/51/23/402005123.db2.gz	UJHGUPKWOIPJOY-HNNXBMFYSA-N	0	3	319.449	2.429	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)NCC(C)(C)C2CCCC2)CCO1	ZINC000152009954	402070797	/nfs/dbraw/zinc/07/07/97/402070797.db2.gz	CQXKOIGQCITQFR-OAHLLOKOSA-N	0	3	311.470	2.175	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N(C)CCc1nccs1	ZINC000122437025	402078137	/nfs/dbraw/zinc/07/81/37/402078137.db2.gz	JRIAMAYBTLCTFI-ZDUSSCGKSA-N	0	3	312.483	2.303	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cc(F)cc3nccnc32)CCN1C	ZINC000122754682	402093019	/nfs/dbraw/zinc/09/30/19/402093019.db2.gz	SARKSJBCRGFBHO-YPMHNXCESA-N	0	3	316.380	2.324	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CC[C@]3(O)CCCC[C@@H]3C2)C1	ZINC000152390776	402094333	/nfs/dbraw/zinc/09/43/33/402094333.db2.gz	LQQFMKYKLGLPNK-XLMAVXFVSA-N	0	3	323.481	2.052	10	0		DEAEHN
COc1ccc2oc(CNC[C@H](C)N3CCOCC3)cc2c1	ZINC000123053139	402107924	/nfs/dbraw/zinc/10/79/24/402107924.db2.gz	YEASJSPNRPSYNO-ZDUSSCGKSA-N	0	3	304.390	2.252	10	0		DEAEHN
CCOC[C@@H]1CCCN(C(=O)N[C@@H](CC(C)C)CN(C)C)C1	ZINC000073203343	286148736	/nfs/dbraw/zinc/14/87/36/286148736.db2.gz	ALICMFHHAIKYAD-CVEARBPZSA-N	0	3	313.486	2.421	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)c2ccc(N(C)C)cc2F)[C@@H](C)C1	ZINC000122137212	402062980	/nfs/dbraw/zinc/06/29/80/402062980.db2.gz	ZIAMDDISNFUSFB-LRDDRELGSA-N	0	3	307.413	2.350	10	0		DEAEHN
CC[C@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1c(C)noc1C	ZINC000123370300	402124548	/nfs/dbraw/zinc/12/45/48/402124548.db2.gz	LXFQHULINMYVCL-CABCVRRESA-N	0	3	318.421	2.398	10	0		DEAEHN
CC[C@@H](O)CN1CCN(C/C=C/c2ccccc2OC)CC1	ZINC000123553741	402134542	/nfs/dbraw/zinc/13/45/42/402134542.db2.gz	FJOKTHNIZFOPJW-DBWMJRBXSA-N	0	3	304.434	2.097	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1C	ZINC000123673437	402140828	/nfs/dbraw/zinc/14/08/28/402140828.db2.gz	FSNDEOQXYLAUMP-YGRLFVJLSA-N	0	3	305.422	2.389	10	0		DEAEHN
CC[C@](C)(O)CN1CCCN(C(=O)c2ccccc2F)CC1	ZINC000123349165	402123249	/nfs/dbraw/zinc/12/32/49/402123249.db2.gz	AQVSVVOXOZLHGK-KRWDZBQOSA-N	0	3	308.397	2.135	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC[C@H](c2nncn2C2CC2)C1)N(C)C	ZINC000153482650	402148126	/nfs/dbraw/zinc/14/81/26/402148126.db2.gz	LERCNROIMOJKPA-ZFWWWQNUSA-N	0	3	319.453	2.049	10	0		DEAEHN
COc1cc([C@@H](C)N[C@H]2CCc3nc(C)nn3C2)ccc1F	ZINC000153529168	402151171	/nfs/dbraw/zinc/15/11/71/402151171.db2.gz	HGORAFGGDJLJBG-MFKMUULPSA-N	0	3	304.369	2.400	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)Cc2noc3ccccc32)CCN1C	ZINC000124465828	402181100	/nfs/dbraw/zinc/18/11/00/402181100.db2.gz	NILYDXHGEHLFCA-CHWSQXEVSA-N	0	3	301.390	2.311	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H]1CCN(c2ncccc2Cl)C1)N(C)C	ZINC000154081163	402191718	/nfs/dbraw/zinc/19/17/18/402191718.db2.gz	VQQOQOIUSCWUPJ-JSGCOSHPSA-N	0	3	324.856	2.160	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCc1nc(C(F)(F)F)cs1	ZINC000154146658	402195510	/nfs/dbraw/zinc/19/55/10/402195510.db2.gz	LWYMQSRWRKOPQQ-QMMMGPOBSA-N	0	3	322.356	2.055	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC2(C)Cc3ccccc3C2)C1	ZINC000124835408	402199934	/nfs/dbraw/zinc/19/99/34/402199934.db2.gz	LKPZWOXJWXYGFW-MRXNPFEDSA-N	0	3	301.434	2.327	10	0		DEAEHN
CN(C)Cc1cccc(CNC(=O)N(C)C[C@@H]2CCCO2)c1	ZINC000102903628	402174402	/nfs/dbraw/zinc/17/44/02/402174402.db2.gz	JILAIDFAEAFKCA-INIZCTEOSA-N	0	3	305.422	2.069	10	0		DEAEHN
C[C@@H](NC(=O)N(C)CCN(C)C)c1ccccc1-n1cccn1	ZINC000154532548	402217016	/nfs/dbraw/zinc/21/70/16/402217016.db2.gz	QPSWEQNSUQMHKB-CQSZACIVSA-N	0	3	315.421	2.136	10	0		DEAEHN
CC(C)COc1ccc(CC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000106911503	402221943	/nfs/dbraw/zinc/22/19/43/402221943.db2.gz	DBMGRZMCOVVTRC-INIZCTEOSA-N	0	3	304.434	2.474	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(=O)N(Cc2ccco2)C2CCN(C)CC2)O1	ZINC000154622225	402221981	/nfs/dbraw/zinc/22/19/81/402221981.db2.gz	LPNGGWKXPUUQEC-CJNGLKHVSA-N	0	3	306.406	2.270	10	0		DEAEHN
COc1ccccc1C[C@H](C)CC(=O)N1CC[C@@H](N(C)C)C1	ZINC000107246903	402228521	/nfs/dbraw/zinc/22/85/21/402228521.db2.gz	MOESILUBBVKFAJ-GOEBONIOSA-N	0	3	304.434	2.426	10	0		DEAEHN
CC[C@@H](C(=O)NC[C@]1(C)CCCN1Cc1ccccc1)N(C)C	ZINC000154841865	402235182	/nfs/dbraw/zinc/23/51/82/402235182.db2.gz	KRGZTAWFVDPKHH-HKUYNNGSSA-N	0	3	317.477	2.498	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)c2coc(Br)c2)C1	ZINC000108334278	402250853	/nfs/dbraw/zinc/25/08/53/402250853.db2.gz	IIBYOSRXWLQAMW-SECBINFHSA-N	0	3	301.184	2.114	10	0		DEAEHN
CCCOc1ccc(OCCN2CCO[C@H](CN(C)C)C2)cc1	ZINC000155299958	402251816	/nfs/dbraw/zinc/25/18/16/402251816.db2.gz	IWFRMVTWFMLJGM-GOSISDBHSA-N	0	3	322.449	2.117	10	0		DEAEHN
CCCN(C[C@H]1CCCCO1)C(=O)NC[C@@H]1CCCN(C)C1	ZINC000108590352	402258016	/nfs/dbraw/zinc/25/80/16/402258016.db2.gz	KTQLUNPRWJSTSK-JKSUJKDBSA-N	0	3	311.470	2.319	10	0		DEAEHN
c1ccc(-c2cc(N3CCNCC3)nc(-c3cccnc3)n2)nc1	ZINC000070451645	402260421	/nfs/dbraw/zinc/26/04/21/402260421.db2.gz	CXYKHRYIGYRAGX-UHFFFAOYSA-N	0	3	318.384	2.010	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cc(Br)ccc2F)C1	ZINC000071139982	402270407	/nfs/dbraw/zinc/27/04/07/402270407.db2.gz	POLISWKHPVGUKY-JTQLQIEISA-N	0	3	315.186	2.364	10	0		DEAEHN
CCn1nccc1CCN1C[C@H](O)C[C@@H]1c1cccc(F)c1	ZINC000225787110	402323872	/nfs/dbraw/zinc/32/38/72/402323872.db2.gz	NWPKKTRWXIBBBQ-IAGOWNOFSA-N	0	3	303.381	2.393	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(C)c(F)c1	ZINC000110085527	402281099	/nfs/dbraw/zinc/28/10/99/402281099.db2.gz	RSQNCFWXLZAYES-CQSZACIVSA-N	0	3	309.385	2.366	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@@H](COC)c1ccccc1	ZINC000176311030	402299062	/nfs/dbraw/zinc/29/90/62/402299062.db2.gz	KOQKWWQUYONUTH-IRXDYDNUSA-N	0	3	319.449	2.500	10	0		DEAEHN
CCOC(CN1CCC(c2nnc3ccccn32)CC1)OCC	ZINC000184970196	402313607	/nfs/dbraw/zinc/31/36/07/402313607.db2.gz	GQPXVLZGINGRSO-UHFFFAOYSA-N	0	3	318.421	2.308	10	0		DEAEHN
CC[C@@H](CNC(=O)N1CC[C@H](N(C)C)C1)Oc1cccc(C)c1	ZINC000176841381	402341864	/nfs/dbraw/zinc/34/18/64/402341864.db2.gz	DMJRWWCCRCLJGH-HOTGVXAUSA-N	0	3	319.449	2.498	10	0		DEAEHN
Cc1c(CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cnn1C	ZINC000229809431	402345223	/nfs/dbraw/zinc/34/52/23/402345223.db2.gz	STZAGZOSGCAWPF-CQSZACIVSA-N	0	3	322.453	2.465	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1cc(C)ccc1C	ZINC000176889099	402347126	/nfs/dbraw/zinc/34/71/26/402347126.db2.gz	LKAMDYHNRBTKGF-HNNXBMFYSA-N	0	3	317.433	2.185	10	0		DEAEHN
CCc1cccc(S(=O)(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000176922564	402350272	/nfs/dbraw/zinc/35/02/72/402350272.db2.gz	SQUYKJDZJQQMFG-ZFWWWQNUSA-N	0	3	308.447	2.106	10	0		DEAEHN
C[C@@H](CN1CCCCCC1)NC(=O)c1cccc(NC(N)=O)c1	ZINC000185434679	402351991	/nfs/dbraw/zinc/35/19/91/402351991.db2.gz	RBMOARFKYFIPOR-ZDUSSCGKSA-N	0	3	318.421	2.172	10	0		DEAEHN
COC1(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)CCCCC1	ZINC000185897414	402387657	/nfs/dbraw/zinc/38/76/57/402387657.db2.gz	MKYRSROJPTURKX-HUUCEWRRSA-N	0	3	311.470	2.460	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@@H]1CCOc2ccccc21	ZINC000177003714	402358306	/nfs/dbraw/zinc/35/83/06/402358306.db2.gz	INMBNWOTYLCQHK-GDBMZVCRSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc2c(c1)CCC(=O)N2	ZINC000177011435	402359133	/nfs/dbraw/zinc/35/91/33/402359133.db2.gz	KJIXORKUNAGTMH-OAHLLOKOSA-N	0	3	315.417	2.128	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(F)cc2nccnc21	ZINC000177013162	402359306	/nfs/dbraw/zinc/35/93/06/402359306.db2.gz	RJZUMKVLHRYTHK-CYBMUJFWSA-N	0	3	316.380	2.325	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)COc1cccc(OC)c1	ZINC000177010780	402359359	/nfs/dbraw/zinc/35/93/59/402359359.db2.gz	VIZQEODSAWBFHW-AWEZNQCLSA-N	0	3	306.406	2.017	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)COc2ccc(F)cc2F)[C@@H](C)C1	ZINC000177065715	402366218	/nfs/dbraw/zinc/36/62/18/402366218.db2.gz	OKHHBEKPWZNULA-FZMZJTMJSA-N	0	3	312.360	2.189	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCOc1ccc(C)cc1	ZINC000177295606	402388766	/nfs/dbraw/zinc/38/87/66/402388766.db2.gz	ZOGRAHNNSUBWTR-MRXNPFEDSA-N	0	3	319.449	2.500	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc(-c2nc[nH]n2)cc1	ZINC000186005026	402396573	/nfs/dbraw/zinc/39/65/73/402396573.db2.gz	GWLKXUNNWPXBFD-HNNXBMFYSA-N	0	3	313.405	2.028	10	0		DEAEHN
Cc1ccc(NC(=O)N[C@@H](C)CCN2CCN(C)CC2)s1	ZINC000186037446	402397656	/nfs/dbraw/zinc/39/76/56/402397656.db2.gz	XKJLUKLLQMSDIO-LBPRGKRZSA-N	0	3	310.467	2.204	10	0		DEAEHN
CCC[C@H](C(=O)NCCc1nc2cc(F)ccc2n1C)N(C)C	ZINC000162050789	402408002	/nfs/dbraw/zinc/40/80/02/402408002.db2.gz	YAFWMIHHQAGNES-OAHLLOKOSA-N	0	3	320.412	2.101	10	0		DEAEHN
CC(C)(C)OC(=O)c1ccc(CNC(C)(C)CC(N)=O)cc1	ZINC000186219188	402411928	/nfs/dbraw/zinc/41/19/28/402411928.db2.gz	JCFUVXDGQWMASE-UHFFFAOYSA-N	0	3	306.406	2.386	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H](N)C(C)(C)C)c1ccccc1-n1cccn1	ZINC000237658530	402417101	/nfs/dbraw/zinc/41/71/01/402417101.db2.gz	DWQPYWRRQTWZEG-IUODEOHRSA-N	0	3	300.406	2.423	10	0		DEAEHN
CCO[C@H]1C[C@H](NCc2ccc(OC)c(O)c2)C12CCOCC2	ZINC000186306514	402419435	/nfs/dbraw/zinc/41/94/35/402419435.db2.gz	OPCWSDMCBCCOFI-IRXDYDNUSA-N	0	3	321.417	2.465	10	0		DEAEHN
Cc1cccc2[nH]cc(CCNC(=O)C[C@H]3CSCCN3)c21	ZINC000237739924	402419715	/nfs/dbraw/zinc/41/97/15/402419715.db2.gz	UJXHISYNWZDEKP-AWEZNQCLSA-N	0	3	317.458	2.230	10	0		DEAEHN
CCC[C@@H]1CN(c2ccnc(C3CC3)n2)CCN1CCOC	ZINC000162478781	402421346	/nfs/dbraw/zinc/42/13/46/402421346.db2.gz	GIGWWDALJZCNQD-OAHLLOKOSA-N	0	3	304.438	2.291	10	0		DEAEHN
Cc1c(CNC[C@@H](NC(=O)OC(C)(C)C)C(C)C)cnn1C	ZINC000162615922	402426387	/nfs/dbraw/zinc/42/63/87/402426387.db2.gz	OPDFNECQZWLFJU-CQSZACIVSA-N	0	3	310.442	2.367	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1cccc(-c2nc[nH]n2)c1	ZINC000162771257	402431170	/nfs/dbraw/zinc/43/11/70/402431170.db2.gz	RZIQKDAREUAHDG-HNNXBMFYSA-N	0	3	315.421	2.178	10	0		DEAEHN
COc1ccc([C@@H](C)CC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000246108263	402510415	/nfs/dbraw/zinc/51/04/15/402510415.db2.gz	BRGQQHPIHYECBT-HOCLYGCPSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C)C(=O)NCc1ccccc1C	ZINC000245463884	402463107	/nfs/dbraw/zinc/46/31/07/402463107.db2.gz	HLTJSZOGULQDJK-AEFFLSMTSA-N	0	3	317.477	2.416	10	0		DEAEHN
COC(=O)[C@@H](C)Oc1ccc(CN(C)C[C@H]2CCCO2)cc1	ZINC000245501476	402466493	/nfs/dbraw/zinc/46/64/93/402466493.db2.gz	CVTBRJZVSRWBME-CZUORRHYSA-N	0	3	307.390	2.238	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(C(=O)C3(N)CCCC3)C2)c1	ZINC000178167408	402467045	/nfs/dbraw/zinc/46/70/45/402467045.db2.gz	HCHMZVNTHYFJSF-ZDUSSCGKSA-N	0	3	318.417	2.291	10	0		DEAEHN
CCS(=O)(=O)NCCCN1CC[C@@H](c2ccccc2)[C@H]1C	ZINC000245515306	402467134	/nfs/dbraw/zinc/46/71/34/402467134.db2.gz	PYRZHEOCQNGUND-GDBMZVCRSA-N	0	3	310.463	2.194	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)CSCc2cscn2)C1	ZINC000246145895	402512572	/nfs/dbraw/zinc/51/25/72/402512572.db2.gz	UGEUSLDPPNLIBM-WCQYABFASA-N	0	3	313.492	2.221	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCc2cscn2)[C@H]1c1ccccc1	ZINC000245648760	402476769	/nfs/dbraw/zinc/47/67/69/402476769.db2.gz	MFUGWOWUHVGXES-LSDHHAIUSA-N	0	3	316.430	2.388	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCC2CCOCC2)[C@H]1c1ccccc1	ZINC000245656938	402477197	/nfs/dbraw/zinc/47/71/97/402477197.db2.gz	OMPVQDHBBIBCHM-DLBZAZTESA-N	0	3	317.433	2.158	10	0		DEAEHN
Cc1nccn1CCCCNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000245675992	402478384	/nfs/dbraw/zinc/47/83/84/402478384.db2.gz	FWBNNTQIMUKUAH-HOCLYGCPSA-N	0	3	321.469	2.096	10	0		DEAEHN
CC[C@@H]1CN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CCO1	ZINC000245681495	402479195	/nfs/dbraw/zinc/47/91/95/402479195.db2.gz	VJQGXCFAPMPSKQ-ZACQAIPSSA-N	0	3	317.433	2.252	10	0		DEAEHN
COc1ccc(C[C@@H](C)C(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000245699513	402480971	/nfs/dbraw/zinc/48/09/71/402480971.db2.gz	YVUOMNVHYPYFHC-ZBFHGGJFSA-N	0	3	302.418	2.180	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CC(=O)N(CC(C)C)C1CC1	ZINC000178295082	402481243	/nfs/dbraw/zinc/48/12/43/402481243.db2.gz	CEKKVCHIVDERSU-QGZVFWFLSA-N	0	3	318.465	2.303	10	0		DEAEHN
COc1ccc([C@@H](C)NCCN2CCCC2)cc1NC(C)=O	ZINC000178310631	402483264	/nfs/dbraw/zinc/48/32/64/402483264.db2.gz	VPISQOXREQVZEE-CYBMUJFWSA-N	0	3	305.422	2.400	10	0		DEAEHN
O=C([C@H]1C[C@@H]1c1cccc(Br)c1)N1CCCNCC1	ZINC000178362778	402489794	/nfs/dbraw/zinc/48/97/94/402489794.db2.gz	JOYZGSPRQKUPCW-KGLIPLIRSA-N	0	3	323.234	2.375	10	0		DEAEHN
COCC[C@](C)(O)CN[C@H](C)c1ccc(OC)c(NC(C)=O)c1	ZINC000178380786	402491622	/nfs/dbraw/zinc/49/16/22/402491622.db2.gz	DMZBSGQCKHOCJB-PXAZEXFGSA-N	0	3	324.421	2.092	10	0		DEAEHN
CCC[C@@H]1CN(C[C@@](C)(O)c2ccccc2)CCN1CCOC	ZINC000245877003	402493407	/nfs/dbraw/zinc/49/34/07/402493407.db2.gz	HQVCQAOZQCBYTB-RTBURBONSA-N	0	3	320.477	2.327	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)NCCc2ccccc2)C1	ZINC000245954700	402500394	/nfs/dbraw/zinc/50/03/94/402500394.db2.gz	TULBZDPYSYUYMJ-IRXDYDNUSA-N	0	3	301.434	2.355	10	0		DEAEHN
CCOc1cccc(CCNC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000178460933	402501241	/nfs/dbraw/zinc/50/12/41/402501241.db2.gz	SNJGDKGBZHSKHB-MRXNPFEDSA-N	0	3	317.433	2.117	10	0		DEAEHN
CC(C)[C@H](O)CC(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1	ZINC000187456018	402501852	/nfs/dbraw/zinc/50/18/52/402501852.db2.gz	YWQKCQGQRAXPOT-QZTJIDSGSA-N	0	3	318.461	2.420	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@H](C)N1CCC[C@@H](Cc2nccn2C)C1	ZINC000246013578	402503456	/nfs/dbraw/zinc/50/34/56/402503456.db2.gz	ZVHDNHWBENUSQJ-JYJNAYRXSA-N	0	3	320.481	2.368	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c(C)c1	ZINC000246040084	402504640	/nfs/dbraw/zinc/50/46/40/402504640.db2.gz	BDKHDFPSAZOYCO-GJZGRUSLSA-N	0	3	310.463	2.407	10	0		DEAEHN
CCC(CC)[C@@H]1C[C@H](NC(=O)N2CCN3CCC[C@H]3C2)CCO1	ZINC000246040648	402504665	/nfs/dbraw/zinc/50/46/65/402504665.db2.gz	XAWPCHHSLIJACJ-IKGGRYGDSA-N	0	3	323.481	2.460	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)[C@@H](C)[C@H](N)c1ccccc1	ZINC000178809705	402542239	/nfs/dbraw/zinc/54/22/39/402542239.db2.gz	QMHDGIIYCMXBAT-YOEHRIQHSA-N	0	3	314.433	2.491	10	0		DEAEHN
C[C@@H](C(=O)N1C[C@H](C)C[C@H](C)C1)N1CC[C@@H]2OCCC[C@H]2C1	ZINC000246762317	402544123	/nfs/dbraw/zinc/54/41/23/402544123.db2.gz	QCSVAFAALGVPDZ-QEOTZNIISA-N	0	3	308.466	2.380	10	0		DEAEHN
COc1cccc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1OC	ZINC000246774196	402544404	/nfs/dbraw/zinc/54/44/04/402544404.db2.gz	AYKGCWKLOQRWSC-STQMWFEESA-N	0	3	304.390	2.013	10	0		DEAEHN
CC(C)C(=O)Nc1cccc(NC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000171075103	402554700	/nfs/dbraw/zinc/55/47/00/402554700.db2.gz	KLFFHSDAVGVOPW-HNNXBMFYSA-N	0	3	318.421	2.449	10	0		DEAEHN
COCCOc1cc(C)ccc1NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000171079144	402555441	/nfs/dbraw/zinc/55/54/41/402555441.db2.gz	DIAVUQHDFNSMSL-CQSZACIVSA-N	0	3	321.421	2.188	10	0		DEAEHN
COC(=O)CCNC(=O)CN[C@H](C)c1ccc(C(C)C)cc1	ZINC000171108849	402558751	/nfs/dbraw/zinc/55/87/51/402558751.db2.gz	GLTGECWQDPBNFF-CYBMUJFWSA-N	0	3	306.406	2.140	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CCOc3ccccc32)CCN1C	ZINC000247296530	402562793	/nfs/dbraw/zinc/56/27/93/402562793.db2.gz	GRZSSJKJGHBQSE-YCPHGPKFSA-N	0	3	302.418	2.494	10	0		DEAEHN
COCCN(C)CCCNC(=O)Nc1cccc([C@H](C)OC)c1	ZINC000171176409	402563504	/nfs/dbraw/zinc/56/35/04/402563504.db2.gz	JHPUVOONJMXWNI-AWEZNQCLSA-N	0	3	323.437	2.484	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)N2CCOC3(CCCCC3)C2)C1	ZINC000247466740	402568389	/nfs/dbraw/zinc/56/83/89/402568389.db2.gz	UVUHOSAREOMBQS-JKSUJKDBSA-N	0	3	323.481	2.460	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)CCc1ccccc1	ZINC000246162896	402514675	/nfs/dbraw/zinc/51/46/75/402514675.db2.gz	LZLYBIGJEWWLHH-IRXDYDNUSA-N	0	3	322.474	2.118	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@H](C)N2CCN3CCC[C@@H]3C2)cc1F	ZINC000178620230	402518492	/nfs/dbraw/zinc/51/84/92/402518492.db2.gz	ADERNTFZOXHYQI-UKRRQHHQSA-N	0	3	305.397	2.241	10	0		DEAEHN
CCN(C(=O)[C@@H](C)N1CCN2CCC[C@@H]2C1)C1CCCCC1	ZINC000178634581	402520231	/nfs/dbraw/zinc/52/02/31/402520231.db2.gz	CDBVHTGCRIJGIL-NVXWUHKLSA-N	0	3	307.482	2.336	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)N[C@H]2CCCOC2)CN1Cc1ccccc1	ZINC000246400589	402529492	/nfs/dbraw/zinc/52/94/92/402529492.db2.gz	ABSXIIYWOSTPGI-HYVNUMGLSA-N	0	3	317.433	2.128	10	0		DEAEHN
CC(C)N(CCN(C)C)C(=O)N[C@@H](C)c1ccc2c(c1)OCO2	ZINC000178715412	402529778	/nfs/dbraw/zinc/52/97/78/402529778.db2.gz	UQNRKUOENICFNG-ZDUSSCGKSA-N	0	3	321.421	2.458	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCCc2ccc(Cl)s2)C1	ZINC000170831630	402530303	/nfs/dbraw/zinc/53/03/03/402530303.db2.gz	ULPLRTDTIYYHJM-JTQLQIEISA-N	0	3	301.843	2.290	10	0		DEAEHN
CCn1nc(C)c(NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1C	ZINC000246425304	402530587	/nfs/dbraw/zinc/53/05/87/402530587.db2.gz	NLWUJOVRPIDZFI-SMDDNHRTSA-N	0	3	307.442	2.466	10	0		DEAEHN
CCOc1cccc([C@@H](C)NC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000170835088	402530942	/nfs/dbraw/zinc/53/09/42/402530942.db2.gz	AHGXKQUHWBUKPX-HIFRSBDPSA-N	0	3	305.422	2.492	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NC[C@@H](O)C1CCCCC1	ZINC000170840179	402532110	/nfs/dbraw/zinc/53/21/10/402532110.db2.gz	YQUJCJSZPDCVBY-JKSUJKDBSA-N	0	3	313.486	2.203	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)c1n[nH]c2c1CCCCC2	ZINC000190256851	402587583	/nfs/dbraw/zinc/58/75/83/402587583.db2.gz	FAGKMKAWIFORSB-CYBMUJFWSA-N	0	3	304.438	2.283	10	0		DEAEHN
O[C@H](CN1CC[C@@H](COCc2ccccc2)C1)C(F)(F)F	ZINC000248390276	402588874	/nfs/dbraw/zinc/58/88/74/402588874.db2.gz	HVQGVJNITXBJSQ-ZIAGYGMSSA-N	0	3	303.324	2.448	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)C(=O)Nc1ccccc1C	ZINC000190342199	402594097	/nfs/dbraw/zinc/59/40/97/402594097.db2.gz	IGVIQGWWWYWDGP-HUUCEWRRSA-N	0	3	315.417	2.019	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@H](C)c2nc(C)cs2)C1	ZINC000248580980	402596643	/nfs/dbraw/zinc/59/66/43/402596643.db2.gz	OPJBIQFZHYDFQX-WCQYABFASA-N	0	3	310.467	2.339	10	0		DEAEHN
CC[C@H](NCC(=O)N1CCC[C@@H](C(F)(F)F)C1)[C@H]1CCCO1	ZINC000248579299	402597037	/nfs/dbraw/zinc/59/70/37/402597037.db2.gz	ICHISXGYVYVYRF-FRRDWIJNSA-N	0	3	322.371	2.335	10	0		DEAEHN
COC(=O)c1ccc(CN2CCC(Cc3nccn3C)CC2)o1	ZINC000171599365	402599763	/nfs/dbraw/zinc/59/97/63/402599763.db2.gz	ZVIREJHYSQYONA-UHFFFAOYSA-N	0	3	317.389	2.254	10	0		DEAEHN
C[C@@H](Nc1ccc(OC2CCN(C)CC2)nc1)c1nccn1C	ZINC000179741997	402599868	/nfs/dbraw/zinc/59/98/68/402599868.db2.gz	SJBWSTFHBSBOTR-CYBMUJFWSA-N	0	3	315.421	2.461	10	0		DEAEHN
C[C@@H](c1cnccn1)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000248662298	402602372	/nfs/dbraw/zinc/60/23/72/402602372.db2.gz	YHIWDYRYLWGDOZ-RDJZCZTQSA-N	0	3	311.433	2.387	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000171641034	402605252	/nfs/dbraw/zinc/60/52/52/402605252.db2.gz	BENTYPUMPWCUCO-YQQAZPJKSA-N	0	3	301.434	2.032	10	0		DEAEHN
CN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000171738467	402616859	/nfs/dbraw/zinc/61/68/59/402616859.db2.gz	XOSSJWCTEQNFBG-MRXNPFEDSA-N	0	3	317.433	2.493	10	0		DEAEHN
CC[C@@H](N[C@@H]1CCc2ncnn2C1)c1ccc2c(c1)OCCO2	ZINC000180595763	402620977	/nfs/dbraw/zinc/62/09/77/402620977.db2.gz	JDFNGGCAKQIOGL-ZIAGYGMSSA-N	0	3	314.389	2.105	10	0		DEAEHN
Cc1ccc(NC(=O)CNC(=O)[C@@]2(C)CCCCN2)c(Cl)c1	ZINC000180941584	402630997	/nfs/dbraw/zinc/63/09/97/402630997.db2.gz	HKXDJXULLUHRFW-MRXNPFEDSA-N	0	3	323.824	2.235	10	0		DEAEHN
Cc1ccccc1OCCCNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171907390	402633196	/nfs/dbraw/zinc/63/31/96/402633196.db2.gz	QUOLAXMRSBVSFQ-MRXNPFEDSA-N	0	3	317.433	2.254	10	0		DEAEHN
O=C1[C@H](N2CCN3CCC[C@@H]3C2)CCN1c1ccccc1Cl	ZINC000171930626	402633956	/nfs/dbraw/zinc/63/39/56/402633956.db2.gz	GBTWDLDCAIEKIH-CZUORRHYSA-N	0	3	319.836	2.225	10	0		DEAEHN
COc1cccc2[nH]cc(CC(=O)N3CCN4CCC[C@@H]4C3)c21	ZINC000181215087	402638144	/nfs/dbraw/zinc/63/81/44/402638144.db2.gz	HLBCFKDEHMMEQP-CQSZACIVSA-N	0	3	313.401	2.026	10	0		DEAEHN
C[C@H](C(=O)Nc1ccc(F)cc1F)N1CCCN(C2CC2)CC1	ZINC000172345990	402651519	/nfs/dbraw/zinc/65/15/19/402651519.db2.gz	XACSCHBKUGQVOB-GFCCVEGCSA-N	0	3	323.387	2.462	10	0		DEAEHN
C[C@H](NCC(=O)N1CCNC1=O)c1ccc(C(C)(C)C)cc1	ZINC000182608678	402703818	/nfs/dbraw/zinc/70/38/18/402703818.db2.gz	YMLREEJWZOPWKX-LBPRGKRZSA-N	0	3	303.406	2.187	10	0		DEAEHN
CC[C@H]1CN(Cc2ccccc2N(C)C)CCN1CCOC	ZINC000173680632	402708001	/nfs/dbraw/zinc/70/80/01/402708001.db2.gz	PJECSFAHKLQJHD-KRWDZBQOSA-N	0	3	305.466	2.295	10	0		DEAEHN
CCc1nc(CNC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)cs1	ZINC000182766200	402714621	/nfs/dbraw/zinc/71/46/21/402714621.db2.gz	QRXBOWNELLXJMS-JSGCOSHPSA-N	0	3	322.478	2.331	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)Cc1cccc(C)c1	ZINC000173830301	402714805	/nfs/dbraw/zinc/71/48/05/402714805.db2.gz	VGNJBEXCDAMWCV-IAGOWNOFSA-N	0	3	322.474	2.383	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NS(=O)(=O)CC2CCCCC2)C1	ZINC000173886184	402716986	/nfs/dbraw/zinc/71/69/86/402716986.db2.gz	WVZDNLZMOXSLDX-HIFRSBDPSA-N	0	3	302.484	2.215	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cccc(Br)n1	ZINC000252736575	402660803	/nfs/dbraw/zinc/66/08/03/402660803.db2.gz	XEGWPBNZYPIHHV-QWRGUYRKSA-N	0	3	324.222	2.153	10	0		DEAEHN
CC[C@H](CCO)CNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000252801546	402661358	/nfs/dbraw/zinc/66/13/58/402661358.db2.gz	UBJHDMRLAXOOBL-OIISXLGYSA-N	0	3	319.449	2.140	10	0		DEAEHN
COc1ccnc(N2CCN(C[C@@H](O)C3CCCCC3)CC2)c1	ZINC000191333318	402661578	/nfs/dbraw/zinc/66/15/78/402661578.db2.gz	JIHOMFHRPMIQHP-QGZVFWFLSA-N	0	3	319.449	2.153	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)C/C=C\c1cccc(F)c1	ZINC000255006660	402675381	/nfs/dbraw/zinc/67/53/81/402675381.db2.gz	QLHVRGCHABGJNQ-SVEBXFOSSA-N	0	3	320.408	2.456	10	0		DEAEHN
Cc1ccc(/C=C\CC(=O)NC[C@H](O)CN2CCCCC2)cc1	ZINC000255382558	402686044	/nfs/dbraw/zinc/68/60/44/402686044.db2.gz	ORJVMCIUHFYWFK-XFHJGTJQSA-N	0	3	316.445	2.361	10	0		DEAEHN
Cc1ccc(CNC(=O)N2CC[C@H](N3CC=CC3)C2)cc1F	ZINC000173227408	402688594	/nfs/dbraw/zinc/68/85/94/402688594.db2.gz	HFHLAANWTYCUFV-HNNXBMFYSA-N	0	3	303.381	2.290	10	0		DEAEHN
O=C(NC1C2CC3CC(C2)CC1C3)N1CC[C@@H](N2CC=CC2)C1	ZINC000173448170	402697923	/nfs/dbraw/zinc/69/79/23/402697923.db2.gz	MFIKZSMDNGKJEF-SVXFNXITSA-N	0	3	315.461	2.467	10	0		DEAEHN
COCCO[C@@H]1CCC12CCN(Cc1c(C)n[nH]c1C)CC2	ZINC000257192493	402701651	/nfs/dbraw/zinc/70/16/51/402701651.db2.gz	UOOGZLLWZKZBRW-MRXNPFEDSA-N	0	3	307.438	2.434	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N1C[C@H]2CCCC[C@@H]2C1	ZINC000262587033	402727808	/nfs/dbraw/zinc/72/78/08/402727808.db2.gz	ZVLUSPSITUUGJE-NSIVTLKISA-N	0	3	306.450	2.168	10	0		DEAEHN
COc1ccc(CNC[C@@H]2CN(C3CC3)CCO2)cc1Cl	ZINC000174364576	402737946	/nfs/dbraw/zinc/73/79/46/402737946.db2.gz	SIWOOZBTFLTVSR-CQSZACIVSA-N	0	3	310.825	2.301	10	0		DEAEHN
Cc1ccccc1C(C)(C)c1nc([C@@H]2CNCCN2C)no1	ZINC000263135176	402745042	/nfs/dbraw/zinc/74/50/42/402745042.db2.gz	BZPDGUKMUJDZIN-AWEZNQCLSA-N	0	3	300.406	2.280	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)c1cc(F)cc2nccnc21	ZINC000193992010	402781410	/nfs/dbraw/zinc/78/14/10/402781410.db2.gz	ZRHWKQXEIVGBGB-LBPRGKRZSA-N	0	3	316.380	2.373	10	0		DEAEHN
CCCCOC[C@@H](O)CN[C@H](C)c1cccc(NC(C)=O)c1	ZINC000193241434	402768692	/nfs/dbraw/zinc/76/86/92/402768692.db2.gz	XBUVLGQNZJJECO-DYVFJYSZSA-N	0	3	308.422	2.473	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc(F)c(NC(C)=O)c2)C1	ZINC000194331930	402793046	/nfs/dbraw/zinc/79/30/46/402793046.db2.gz	RZBFHPBZKFXKID-ZDUSSCGKSA-N	0	3	322.384	2.390	10	0		DEAEHN
COc1cccc([C@H](C)CC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000175385309	402802009	/nfs/dbraw/zinc/80/20/09/402802009.db2.gz	SGFUXVNEYHYBBO-GDBMZVCRSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)S(=O)(=O)c1ccc(C)cc1C	ZINC000175398835	402802959	/nfs/dbraw/zinc/80/29/59/402802959.db2.gz	MSZDWWUXANSKPV-OAHLLOKOSA-N	0	3	310.463	2.408	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)S(=O)(=O)c1ccc(C)c(C)c1	ZINC000175398176	402803226	/nfs/dbraw/zinc/80/32/26/402803226.db2.gz	UXOITHIRKPWOQK-OAHLLOKOSA-N	0	3	310.463	2.408	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)Nc2cccc3c2OCCO3)CCN1C	ZINC000175415646	402804930	/nfs/dbraw/zinc/80/49/30/402804930.db2.gz	APRFKTKOJLHWPL-QWHCGFSZSA-N	0	3	319.405	2.404	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1cccc(NC(=O)C2CC2)c1	ZINC000263926769	402821659	/nfs/dbraw/zinc/82/16/59/402821659.db2.gz	SBNBWZGJOOMNPL-INIZCTEOSA-N	0	3	315.417	2.201	10	0		DEAEHN
CNC(=O)[C@@H](NCc1ccc(C(=O)OC(C)C)cc1)C(C)C	ZINC000183675078	402787550	/nfs/dbraw/zinc/78/75/50/402787550.db2.gz	CSKRBBRDAVFDQE-HNNXBMFYSA-N	0	3	306.406	2.112	10	0		DEAEHN
CNC(=O)[C@@H](NCc1ccc2oc(C(=O)OC)cc2c1)C(C)C	ZINC000183671620	402787568	/nfs/dbraw/zinc/78/75/68/402787568.db2.gz	VOIQRKBKBDWAIJ-HNNXBMFYSA-N	0	3	318.373	2.080	10	0		DEAEHN
CC(C)(CCS(C)(=O)=O)NCc1c[nH]c(-c2ccccc2)n1	ZINC000176000515	402847092	/nfs/dbraw/zinc/84/70/92/402847092.db2.gz	GCQISCUCFAOEFF-UHFFFAOYSA-N	0	3	321.446	2.380	10	0		DEAEHN
CC(C)(CCS(C)(=O)=O)NCc1cnc(-c2ccccc2)[nH]1	ZINC000176000515	402847094	/nfs/dbraw/zinc/84/70/94/402847094.db2.gz	GCQISCUCFAOEFF-UHFFFAOYSA-N	0	3	321.446	2.380	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000176004932	402847223	/nfs/dbraw/zinc/84/72/23/402847223.db2.gz	AKLMZVIBFXVDAK-ZIAGYGMSSA-N	0	3	305.422	2.424	10	0		DEAEHN
O=C(CN1CCC(c2ccn[nH]2)CC1)N1CCc2ccccc21	ZINC000195506876	402847967	/nfs/dbraw/zinc/84/79/67/402847967.db2.gz	OOQOPEZICDBHOX-UHFFFAOYSA-N	0	3	310.401	2.178	10	0		DEAEHN
CC/C=C/CCN1CCN(C[C@@H]2CN(C(C)C)CCO2)CC1	ZINC000184520923	402848680	/nfs/dbraw/zinc/84/86/80/402848680.db2.gz	DKKXSNZCFMFZBB-DUMMIQTOSA-N	0	3	309.498	2.070	10	0		DEAEHN
CCn1cc(C2CCN(C[C@H](O)COC(C)(C)C)CC2)cn1	ZINC000195513143	402848860	/nfs/dbraw/zinc/84/88/60/402848860.db2.gz	BIQGPXQUMQGZDB-INIZCTEOSA-N	0	3	309.454	2.258	10	0		DEAEHN
O=C(CN1CCC[C@@H]1[C@H]1CCCC[C@@H]1O)NCc1ccccc1	ZINC000281310464	403063353	/nfs/dbraw/zinc/06/33/53/403063353.db2.gz	HZQSIGBWJQPRFL-KURKYZTESA-N	0	3	316.445	2.318	10	0		DEAEHN
Brc1cccc2c1OCC[C@H]2NCCn1cncn1	ZINC000268795983	403114447	/nfs/dbraw/zinc/11/44/47/403114447.db2.gz	DPGXPHMQZYQPSC-GFCCVEGCSA-N	0	3	323.194	2.154	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@@H]1NCc1sccc1Br	ZINC000282216291	403133398	/nfs/dbraw/zinc/13/33/98/403133398.db2.gz	DRRVARWJVQKOHF-APPZFPTMSA-N	0	3	303.225	2.267	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)C(=O)Nc1cscc1C	ZINC000276093123	403145502	/nfs/dbraw/zinc/14/55/02/403145502.db2.gz	FJTVQRADAKPABD-CHWSQXEVSA-N	0	3	321.446	2.080	10	0		DEAEHN
O=C(c1cscc1Br)N1CCN2CCC[C@@H]2C1	ZINC000285288321	403280276	/nfs/dbraw/zinc/28/02/76/403280276.db2.gz	GDWKYUNVCOQMDN-SECBINFHSA-N	0	3	315.236	2.431	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CCO1	ZINC000271266507	403283857	/nfs/dbraw/zinc/28/38/57/403283857.db2.gz	NMMIMCIDCPRUIW-DZUCGIPZSA-N	0	3	317.433	2.299	10	0		DEAEHN
c1c(CNCCc2nc3c(s2)CCCC3)nc2ncccn12	ZINC000298447884	403384631	/nfs/dbraw/zinc/38/46/31/403384631.db2.gz	NUMHCICJMKXDED-UHFFFAOYSA-N	0	3	313.430	2.397	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N2CC[C@@H](N(C)C)C2)C12CCCC2	ZINC000245498681	286353390	/nfs/dbraw/zinc/35/33/90/286353390.db2.gz	WRDLWWKWPIGEDS-QLFBSQMISA-N	0	3	309.454	2.070	10	0		DEAEHN
Cc1nn(C)c2sc([C@@H](C)N[C@@H]3CCC(=O)N(C)C3)cc12	ZINC000287876350	403684038	/nfs/dbraw/zinc/68/40/38/403684038.db2.gz	YENXQPBUMPRYDX-GHMZBOCLSA-N	0	3	306.435	2.215	10	0		DEAEHN
C[C@H](N[C@H]1CCc2nnnn2CC1)c1nc2c(s1)CCCC2	ZINC000333681690	403813492	/nfs/dbraw/zinc/81/34/92/403813492.db2.gz	FGNZGXYUKUVHEV-QWRGUYRKSA-N	0	3	318.450	2.064	10	0		DEAEHN
c1ccc([C@@H]2N(C[C@@H]3COCCO3)CC23CCOCC3)cc1	ZINC000412014885	404058120	/nfs/dbraw/zinc/05/81/20/404058120.db2.gz	RLAWGKNMSZOYTK-SJORKVTESA-N	0	3	303.402	2.256	10	0		DEAEHN
C[C@H](N[C@H]1CCC(=O)N[C@@H]1C1CC1)C(=O)N1C[C@H](C)C[C@H](C)C1	ZINC000328861361	404163998	/nfs/dbraw/zinc/16/39/98/404163998.db2.gz	ARWLBJJDZYVCNF-VBWUIIQKSA-N	0	3	321.465	2.367	10	0		DEAEHN
CC1(C)CN(Cc2ccc(CO)cc2)C[C@]2(CCCOC2)O1	ZINC000370041268	404314421	/nfs/dbraw/zinc/31/44/21/404314421.db2.gz	PNSVVRHNVWKSIR-SFHVURJKSA-N	0	3	305.418	2.339	10	0		DEAEHN
c1cc(CN[C@H]2CCO[C@]3(CCOC3)C2)c2c(c1)OCCCO2	ZINC000356293991	404429847	/nfs/dbraw/zinc/42/98/47/404429847.db2.gz	XZXZNKNXAMCRER-MAUKXSAKSA-N	0	3	319.401	2.276	10	0		DEAEHN
CCn1nccc1CCN1C[C@H](O)C[C@H]1c1ccc(F)cc1	ZINC000338569245	404408805	/nfs/dbraw/zinc/40/88/05/404408805.db2.gz	HSXMQAAJBKFNPH-SJORKVTESA-N	0	3	303.381	2.393	10	0		DEAEHN
C[C@@H]1OCCN(c2nnc(C3CCC3)n2C[C@@H]2CCOC2)[C@H]1C	ZINC000329744443	404439069	/nfs/dbraw/zinc/43/90/69/404439069.db2.gz	QSENXYDBHDTLQP-IHRRRGAJSA-N	0	3	320.437	2.196	10	0		DEAEHN
COc1cccc2c1CCN(C(=O)[C@@H](C(C)C)N(C)C)CC2	ZINC000364810764	404536086	/nfs/dbraw/zinc/53/60/86/404536086.db2.gz	MGXHSUJKCAJICT-QGZVFWFLSA-N	0	3	304.434	2.209	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@@H]1CCC[C@@H]2OCC[C@H]21	ZINC000291895438	404570139	/nfs/dbraw/zinc/57/01/39/404570139.db2.gz	IKQIDISSUOPOGG-KSZLIROESA-N	0	3	312.417	2.374	10	0		DEAEHN
C[C@@H]1OCC[C@@]1(O)CNCc1ccsc1Br	ZINC000388965552	405036844	/nfs/dbraw/zinc/03/68/44/405036844.db2.gz	HMPTUXSSCSHHNH-GZMMTYOYSA-N	0	3	306.225	2.140	10	0		DEAEHN
CN(C)C1(CNC(=O)N2CCC23CCC3)Cc2ccccc2C1	ZINC000435570273	404990106	/nfs/dbraw/zinc/99/01/06/404990106.db2.gz	VYNGXFSVOPPAGL-UHFFFAOYSA-N	0	3	313.445	2.424	10	0		DEAEHN
O[C@H](CC1CCCC1)CN1CCOC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000408041272	405097039	/nfs/dbraw/zinc/09/70/39/405097039.db2.gz	BXNLTTVMFJIDFF-TVFCKZIOSA-N	0	3	311.466	2.180	10	0		DEAEHN
C[C@@H](C(=O)NCCNc1ccncc1)c1cn(C)c2ccccc12	ZINC000361363403	405040337	/nfs/dbraw/zinc/04/03/37/405040337.db2.gz	YNTJQORCXQWZGP-CQSZACIVSA-N	0	3	322.412	2.327	10	0		DEAEHN
COc1ccc(CNCC[C@H]2COc3ccccc3O2)cn1	ZINC000436304010	405068383	/nfs/dbraw/zinc/06/83/83/405068383.db2.gz	DNHBPFNJJUCVES-AWEZNQCLSA-N	0	3	300.358	2.410	10	0		DEAEHN
C[C@H]1[C@H](C)N(C(=O)c2[nH]nc3ccc(Cl)cc32)CCN1C	ZINC000408022916	405091828	/nfs/dbraw/zinc/09/18/28/405091828.db2.gz	OYMSZKZIRJLNCZ-UWVGGRQHSA-N	0	3	306.797	2.381	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cc3nc[nH]c3cc2F)CCN1C	ZINC000408464601	405212731	/nfs/dbraw/zinc/21/27/31/405212731.db2.gz	FJVKRGHOFAJHNA-QWRGUYRKSA-N	0	3	304.369	2.257	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cc3nc[nH]c3cc2F)CCN1C	ZINC000408464603	405212990	/nfs/dbraw/zinc/21/29/90/405212990.db2.gz	FJVKRGHOFAJHNA-WDEREUQCSA-N	0	3	304.369	2.257	10	0		DEAEHN
COc1ccc(OC)c(CN[C@H](C)C2(OC)CCOCC2)c1	ZINC000453072046	405281799	/nfs/dbraw/zinc/28/17/99/405281799.db2.gz	NBKFXUIQOHLPKT-CYBMUJFWSA-N	0	3	309.406	2.378	10	0		DEAEHN
COC1([C@@H](C)NCc2cn3ccc(C)cc3n2)CCOCC1	ZINC000453104733	405284240	/nfs/dbraw/zinc/28/42/40/405284240.db2.gz	GFQARIOGBLADTO-CQSZACIVSA-N	0	3	303.406	2.316	10	0		DEAEHN
Cn1cc(CCC(=O)NCCNc2ccncc2)c2ccccc21	ZINC000446736228	405391755	/nfs/dbraw/zinc/39/17/55/405391755.db2.gz	OCLLUHFDJXUNPT-UHFFFAOYSA-N	0	3	322.412	2.156	10	0		DEAEHN
Cc1c(CN2CC[C@](O)(Cc3ccc(F)cc3)C2)cnn1C	ZINC000420983684	405420497	/nfs/dbraw/zinc/42/04/97/405420497.db2.gz	RFGQCEUHBWQDPX-KRWDZBQOSA-N	0	3	303.381	2.047	10	0		DEAEHN
c1cnc(-c2ccnc(NC[C@@H]3CCN3C3CCCC3)n2)cn1	ZINC000528210534	405530529	/nfs/dbraw/zinc/53/05/29/405530529.db2.gz	LYZRIIXJZHSLAU-AWEZNQCLSA-N	0	3	310.405	2.362	10	0		DEAEHN
Cn1cncc1CN[C@H]1CCO[C@@H]1c1ccnn1-c1ccccc1	ZINC000583616638	405773732	/nfs/dbraw/zinc/77/37/32/405773732.db2.gz	VQTWSGMUNOWYBH-WMZOPIPTSA-N	0	3	323.400	2.226	10	0		DEAEHN
O[C@@]1(c2cn[nH]n2)CCN(Cc2ccc(-c3ccccc3)o2)C1	ZINC000583617302	405775133	/nfs/dbraw/zinc/77/51/33/405775133.db2.gz	DKBQYIXTUDVDML-KRWDZBQOSA-N	0	3	310.357	2.158	10	0		DEAEHN
c1cc2c(cc1C1(NC[C@@H]3COCCO3)CCCC1)OCCO2	ZINC000450522733	405941061	/nfs/dbraw/zinc/94/10/61/405941061.db2.gz	ZQWDAHQLNYNEHL-OAHLLOKOSA-N	0	3	319.401	2.232	10	0		DEAEHN
Cc1c2ccccc2oc1CNC(=O)NCCOCCN(C)C	ZINC000471634162	406102883	/nfs/dbraw/zinc/10/28/83/406102883.db2.gz	FAYMKTQWCMKYRX-UHFFFAOYSA-N	0	3	319.405	2.119	10	0		DEAEHN
C[C@H]1CCN(C(=O)NCCOCCN(C)C)[C@H](c2ccco2)C1	ZINC000471631992	406103061	/nfs/dbraw/zinc/10/30/61/406103061.db2.gz	ADLRLUDOFCQAEJ-GJZGRUSLSA-N	0	3	323.437	2.340	10	0		DEAEHN
C[C@@H]1CCN(C(=O)NCCOCCN(C)C)[C@@H](c2ccco2)C1	ZINC000471631993	406103211	/nfs/dbraw/zinc/10/32/11/406103211.db2.gz	ADLRLUDOFCQAEJ-HUUCEWRRSA-N	0	3	323.437	2.340	10	0		DEAEHN
c1nc(CN[C@@H](C2CCC2)[C@@H]2CCCO2)cc2c1OCCO2	ZINC000639388787	406076373	/nfs/dbraw/zinc/07/63/73/406076373.db2.gz	BGYUWWYWKXNUPE-YOEHRIQHSA-N	0	3	304.390	2.290	10	0		DEAEHN
CCN(CCNC(=O)N1CC[C@H](C(F)(F)F)[C@H]1C)C1CC1	ZINC000471816324	406121617	/nfs/dbraw/zinc/12/16/17/406121617.db2.gz	NCQUKIXGMWDAPL-PWSUYJOCSA-N	0	3	307.360	2.453	10	0		DEAEHN
CO[C@@H]1CC[C@H](NC(=O)Nc2ccccc2CCN(C)C)C1	ZINC000471964794	406133194	/nfs/dbraw/zinc/13/31/94/406133194.db2.gz	JXTRQNNCWLSGSS-LSDHHAIUSA-N	0	3	305.422	2.480	10	0		DEAEHN
CO[C@H]1CC[C@@H](NC(=O)Nc2ccccc2CCN(C)C)C1	ZINC000471964791	406133689	/nfs/dbraw/zinc/13/36/89/406133689.db2.gz	JXTRQNNCWLSGSS-CABCVRRESA-N	0	3	305.422	2.480	10	0		DEAEHN
COC[C@H](O)CN1CCC[C@H](c2nc3ccccc3s2)C1	ZINC000534339108	406185330	/nfs/dbraw/zinc/18/53/30/406185330.db2.gz	FSLUXLNCMRMBHK-QWHCGFSZSA-N	0	3	306.431	2.483	10	0		DEAEHN
c1nc2c(ncnc2N2C[C@H]3CCC[C@@H](C2)N3)n1-c1ccccc1	ZINC000634807253	406293922	/nfs/dbraw/zinc/29/39/22/406293922.db2.gz	DHWYWGVMVYWFKX-OKILXGFUSA-N	0	3	320.400	2.146	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637874244	406456959	/nfs/dbraw/zinc/45/69/59/406456959.db2.gz	GFALMFXGXDBFEH-HYVNUMGLSA-N	0	3	303.450	2.141	10	0		DEAEHN
CN1CCCC(C)(C)[C@H]1CNC(=O)c1cccc2nccnc21	ZINC000548394506	406510138	/nfs/dbraw/zinc/51/01/38/406510138.db2.gz	DWYHPGDXVGLEHG-OAHLLOKOSA-N	0	3	312.417	2.480	10	0		DEAEHN
CN(Cc1ccc(Cl)cc1Cl)C(=O)[C@@H]1CNCCOC1	ZINC000643618093	407018411	/nfs/dbraw/zinc/01/84/11/407018411.db2.gz	CAXHMLFIDDCROM-LLVKDONJSA-N	0	3	317.216	2.188	10	0		DEAEHN
C[C@H]1CC[C@@H](C(=O)NCC2(N3CCSCC3)CCCC2)O1	ZINC000130943481	196125538	/nfs/dbraw/zinc/12/55/38/196125538.db2.gz	URGQCBHRLCDEAF-KBPBESRZSA-N	0	3	312.479	2.032	10	0		DEAEHN
O=C(Nc1cnc(Br)cn1)c1ccc2c(c1)CNC2	ZINC000131185171	196147229	/nfs/dbraw/zinc/14/72/29/196147229.db2.gz	AOLOCGUMTQFDDN-UHFFFAOYSA-N	0	3	319.162	2.095	10	0		DEAEHN
CC1COC(CN)(c2cc(Br)ccc2F)OC1	ZINC000131398545	196165365	/nfs/dbraw/zinc/16/53/65/196165365.db2.gz	QPTQWHKDSNIFPN-UHFFFAOYSA-N	0	3	304.159	2.383	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1sc2cccnc2c1N	ZINC000132261454	196239674	/nfs/dbraw/zinc/23/96/74/196239674.db2.gz	IMIVMOKPVOEPHS-SNVBAGLBSA-N	0	3	304.419	2.045	10	0		DEAEHN
CNC1(c2nc(C(C)C)cs2)CCN(C(=O)N(C)C)CC1	ZINC000132903034	196294156	/nfs/dbraw/zinc/29/41/56/196294156.db2.gz	UGUVFICRHFJGJJ-UHFFFAOYSA-N	0	3	310.467	2.459	10	0		DEAEHN
CC[C@@H](CSC)[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000134258252	196374511	/nfs/dbraw/zinc/37/45/11/196374511.db2.gz	VJZXMEAADPFYAW-NSHDSACASA-N	0	3	320.480	2.198	10	0		DEAEHN
CC[C@@H](CSC)NS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000134258252	196374513	/nfs/dbraw/zinc/37/45/13/196374513.db2.gz	VJZXMEAADPFYAW-NSHDSACASA-N	0	3	320.480	2.198	10	0		DEAEHN
COc1ccc(C[C@]2(O)CCCN(C)C2)cc1Br	ZINC000134345782	196380720	/nfs/dbraw/zinc/38/07/20/196380720.db2.gz	SFBFPZFVXLSCED-CQSZACIVSA-N	0	3	314.223	2.457	10	0		DEAEHN
Cc1nc(C)n(C[C@@H]2CCCN(CCOCC(F)(F)F)C2)n1	ZINC000105885475	424849639	/nfs/dbraw/zinc/84/96/39/424849639.db2.gz	SQIZCODGWCEPBN-CYBMUJFWSA-N	0	3	320.359	2.186	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)Nc2ccc(C)c(C)c2)c1	ZINC000105881603	424849680	/nfs/dbraw/zinc/84/96/80/424849680.db2.gz	FEPIKBRKWVDICC-OAHLLOKOSA-N	0	3	300.406	2.425	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cccnc2N2CCCC2)C1	ZINC000194341499	424875157	/nfs/dbraw/zinc/87/51/57/424875157.db2.gz	DEAYOBUMOUHLPM-CQSZACIVSA-N	0	3	317.437	2.288	10	0		DEAEHN
CCOc1ccc2cc(C(=O)NC[C@@H]3CCCN3C)[nH]c2c1	ZINC000194693165	424877377	/nfs/dbraw/zinc/87/73/77/424877377.db2.gz	YWEUTNBWGMJWMZ-ZDUSSCGKSA-N	0	3	301.390	2.391	10	0		DEAEHN
CN(Cc1ccc(Br)cc1F)C[C@H]1CNCCO1	ZINC000125518166	424856015	/nfs/dbraw/zinc/85/60/15/424856015.db2.gz	CJQNNUVMQOFRSU-GFCCVEGCSA-N	0	3	317.202	2.008	10	0		DEAEHN
CC(C)n1ncnc1CN[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000389839276	424915251	/nfs/dbraw/zinc/91/52/51/424915251.db2.gz	MMHDDRCEOKFLAR-RDJZCZTQSA-N	0	3	313.449	2.469	10	0		DEAEHN
[NH3+]CC1(CC[N-]S(=O)(=O)c2cc(Cl)cc(Cl)c2)CC1	ZINC000404635874	424928449	/nfs/dbraw/zinc/92/84/49/424928449.db2.gz	JAKNIHMLDRECOL-UHFFFAOYSA-N	0	3	323.245	2.401	10	0		DEAEHN
C(CNc1nnc(C2CCOCC2)s1)CN1CCCCC1	ZINC000338642650	424938144	/nfs/dbraw/zinc/93/81/44/424938144.db2.gz	SERLIOHUZUOINX-UHFFFAOYSA-N	0	3	310.467	2.720	10	0		DEAEHN
c1nnc2ccc(NC[C@H]3CCCCN3Cc3ccccc3)nn12	ZINC000560193624	424888318	/nfs/dbraw/zinc/88/83/18/424888318.db2.gz	XQWRSNGFHTUAML-MRXNPFEDSA-N	0	3	322.416	2.591	10	0		DEAEHN
CN(C)c1nccc(NC[C@H]2CCCN2Cc2ccccc2)n1	ZINC000354341513	425062722	/nfs/dbraw/zinc/06/27/22/425062722.db2.gz	VXHASVRIEXNYSD-MRXNPFEDSA-N	0	3	311.433	2.619	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc(NC(=O)OC)cc1	ZINC000176965076	267549022	/nfs/dbraw/zinc/54/90/22/267549022.db2.gz	BYKGBVYXFFAPJW-HNNXBMFYSA-N	0	3	319.405	2.421	10	0		DEAEHN
CN(C(=O)c1ccc2ncsc2c1)[C@@H](CN)C(F)(F)F	ZINC000662980979	425771784	/nfs/dbraw/zinc/77/17/84/425771784.db2.gz	LIGCQJGITKPEQN-JTQLQIEISA-N	0	3	303.309	2.258	10	0		DEAEHN
CCN1CC[C@H](NC(=O)N[C@H]2CCO[C@@H](c3cccs3)C2)C1	ZINC000334128272	269023123	/nfs/dbraw/zinc/02/31/23/269023123.db2.gz	REJMFKVSSQEWPI-MELADBBJSA-N	0	3	323.462	2.362	10	0		DEAEHN
C[C@@H]1CN(C)CCN1C[C@H](O)Cc1ccccc1C(F)(F)F	ZINC000443411975	269137472	/nfs/dbraw/zinc/13/74/72/269137472.db2.gz	HLFIVJDXOJNCCF-TZMCWYRMSA-N	0	3	316.367	2.245	10	0		DEAEHN
Cc1c2c(nn1-c1ccc(C)cc1)c(N1CCNCC1)nnc2C	ZINC000049454554	274666783	/nfs/dbraw/zinc/66/67/83/274666783.db2.gz	ZVLFTXCVOVZCLU-UHFFFAOYSA-N	0	3	322.416	2.150	10	0		DEAEHN
O[C@H](CN1CCC[C@H](n2cncn2)C1)c1ccc(Cl)cc1	ZINC000171618740	275057052	/nfs/dbraw/zinc/05/70/52/275057052.db2.gz	DIUJGIYUAMKCIT-LSDHHAIUSA-N	0	3	306.797	2.302	10	0		DEAEHN
CC(C)c1nnc2n1C[C@@H](N[C@@H]1CCCc3c1cnn3C)CC2	ZINC000180506879	275776728	/nfs/dbraw/zinc/77/67/28/275776728.db2.gz	NNFUEIRAUQAEDG-GXTWGEPZSA-N	0	3	314.437	2.117	10	0		DEAEHN
CC(C)n1nc(I)c2c1ccnc2N	ZINC000089220063	275791808	/nfs/dbraw/zinc/79/18/08/275791808.db2.gz	BCKDNSCCRGSIGN-UHFFFAOYSA-N	0	3	302.119	2.199	10	0		DEAEHN
CCC[C@@H](C(=O)NC1CCN(c2ccc(C)cn2)CC1)N(C)C	ZINC000164039536	276020964	/nfs/dbraw/zinc/02/09/64/276020964.db2.gz	QOWRXNULIBGUMB-INIZCTEOSA-N	0	3	318.465	2.205	10	0		DEAEHN
CCc1nc2c(s1)[C@@H](N[C@@H]1CCc3ncnn3C1)CCC2	ZINC000180608066	276691646	/nfs/dbraw/zinc/69/16/46/276691646.db2.gz	MLNNSEOPBJTGBV-MNOVXSKESA-N	0	3	303.435	2.279	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)CCc2ccc(Cl)s2)CCO1	ZINC000116797346	276804286	/nfs/dbraw/zinc/80/42/86/276804286.db2.gz	HVZWIHDVDIBXFO-NSHDSACASA-N	0	3	316.854	2.123	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)N[C@H]1CCOc2ccc(F)cc21	ZINC000245813110	277080787	/nfs/dbraw/zinc/08/07/87/277080787.db2.gz	QGJROKRHGXYITQ-JSGCOSHPSA-N	0	3	307.369	2.043	10	0		DEAEHN
CN1CCO[C@H](CN[C@@H]2CCCOc3cc4c(cc32)CCC4)C1	ZINC000180501479	277127996	/nfs/dbraw/zinc/12/79/96/277127996.db2.gz	VBIXOPLPPBTYAT-SJLPKXTDSA-N	0	3	316.445	2.309	10	0		DEAEHN
CN1CC[C@@H](NC(=O)N2CCOC(C)(C)C2)[C@H]1c1ccccc1	ZINC000179276399	277136324	/nfs/dbraw/zinc/13/63/24/277136324.db2.gz	SJPDDIOABZMFNI-HZPDHXFCSA-N	0	3	317.433	2.252	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)N[C@@H]2COc3ccccc32)C1	ZINC000245995325	277155446	/nfs/dbraw/zinc/15/54/46/277155446.db2.gz	RFUIITOZQHAUMI-NUEKZKHPSA-N	0	3	315.417	2.246	10	0		DEAEHN
CN1CC[C@H](NC(=O)N2CCSCC2)[C@@H]1c1ccccc1	ZINC000179270526	277166092	/nfs/dbraw/zinc/16/60/92/277166092.db2.gz	YCRWGTUXMVEPFI-GJZGRUSLSA-N	0	3	305.447	2.190	10	0		DEAEHN
COCC[C@@H](Cc1cccc(F)c1)N[C@H]1CCCn2ncnc21	ZINC000164663527	277546129	/nfs/dbraw/zinc/54/61/29/277546129.db2.gz	JBATXHUNBWUTST-HOTGVXAUSA-N	0	3	318.396	2.490	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@H]2CC(=O)Nc3ccccc32)CCN1C	ZINC000247463467	278014357	/nfs/dbraw/zinc/01/43/57/278014357.db2.gz	RFLMJBWLBXUGKN-NFAWXSAZSA-N	0	3	315.417	2.054	10	0		DEAEHN
CS[C@H](C)CNC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000122972860	278159060	/nfs/dbraw/zinc/15/90/60/278159060.db2.gz	WKTNGXCPWNJRTG-HIFRSBDPSA-N	0	3	309.479	2.210	10	0		DEAEHN
CCC[C@H](C(=O)N(C)Cc1ncc(C)c(OC)c1C)N(C)C	ZINC000179719293	278917912	/nfs/dbraw/zinc/91/79/12/278917912.db2.gz	ABQGAVPALMKGQC-OAHLLOKOSA-N	0	3	307.438	2.396	10	0		DEAEHN
CCC[C@H](C(=O)NCC1CCN(CC(F)(F)F)CC1)N(C)C	ZINC000186990939	278920981	/nfs/dbraw/zinc/92/09/81/278920981.db2.gz	DRIDPBDYGPUWRM-CYBMUJFWSA-N	0	3	323.403	2.107	10	0		DEAEHN
C[C@H](NC1CCN(c2ncccn2)CC1)c1cncc(F)c1	ZINC000155923732	279457448	/nfs/dbraw/zinc/45/74/48/279457448.db2.gz	FLALPVZGJXCITL-LBPRGKRZSA-N	0	3	301.369	2.330	10	0		DEAEHN
Cc1cc(C)c(N2CC[C@H](N[C@@H]3CCO[C@@H]3C)C2=O)c(C)c1	ZINC000189456289	280388286	/nfs/dbraw/zinc/38/82/86/280388286.db2.gz	QJBMTILOHKMQSC-OAGGEKHMSA-N	0	3	302.418	2.484	10	0		DEAEHN
Cc1cnc(CN(C)C2CCN(CCn3cccn3)CC2)s1	ZINC000180478112	281586290	/nfs/dbraw/zinc/58/62/90/281586290.db2.gz	IPLGSORGQYRXAZ-UHFFFAOYSA-N	0	3	319.478	2.244	10	0		DEAEHN
CCCn1nc(C)c(C(=O)N(C)C[C@H]2CCCN2CC)c1C	ZINC000133505259	282017836	/nfs/dbraw/zinc/01/78/36/282017836.db2.gz	GVBBKOHZSBIMMP-OAHLLOKOSA-N	0	3	306.454	2.466	10	0		DEAEHN
Cc1nc2ccccc2cc1-c1nc([C@H]2CNCCN2C)no1	ZINC000263226072	282075281	/nfs/dbraw/zinc/07/52/81/282075281.db2.gz	MSYWNKQZSDGBBN-OAHLLOKOSA-N	0	3	309.373	2.169	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@H]1C(=O)N1CCCC[C@@H]1CN(C)C	ZINC000117788816	289086372	/nfs/dbraw/zinc/08/63/72/289086372.db2.gz	GRTSPARGCTUILT-CKEIUWERSA-N	0	3	302.418	2.494	10	0		DEAEHN
CN(C)C[C@@H]1COCCN1C(=O)c1ccc(C(F)(F)F)cc1	ZINC000085469911	289203220	/nfs/dbraw/zinc/20/32/20/289203220.db2.gz	GJEXDIINBQYGSN-CYBMUJFWSA-N	0	3	316.323	2.108	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@@H](C2CCCC2)C(F)(F)F)C1	ZINC000127207402	289312373	/nfs/dbraw/zinc/31/23/73/289312373.db2.gz	ZJPKASHOLUVOPG-NEPJUHHUSA-N	0	3	307.360	2.453	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@@H]2CCCOc3cc(F)ccc32)C1	ZINC000180595517	289312548	/nfs/dbraw/zinc/31/25/48/289312548.db2.gz	RIFMXUQFWBROQZ-UKRRQHHQSA-N	0	3	321.396	2.385	10	0		DEAEHN
CN1CCC(NC(=O)N2CCCC[C@@H]2c2nccs2)CC1	ZINC000176146711	289884761	/nfs/dbraw/zinc/88/47/61/289884761.db2.gz	SLVYGCRSMBRSRA-CYBMUJFWSA-N	0	3	308.451	2.474	10	0		DEAEHN
CN(C)Cc1ccc(CNC(=O)NCCOCC2CCC2)cc1	ZINC000584027536	331586555	/nfs/dbraw/zinc/58/65/55/331586555.db2.gz	ZTRDYPTWIGVIDW-UHFFFAOYSA-N	0	3	319.449	2.364	10	0		DEAEHN
COC[C@H](C)CN1CCN(Cc2ccc(OC)c(F)c2)CC1	ZINC000189576932	333142445	/nfs/dbraw/zinc/14/24/45/333142445.db2.gz	UGYLIWBHYDQXMZ-CQSZACIVSA-N	0	3	310.413	2.234	10	0		DEAEHN
COc1ccc([C@@H](O)CN(C)Cc2ccccc2)cc1CCO	ZINC000584595065	337373985	/nfs/dbraw/zinc/37/39/85/337373985.db2.gz	OBRPIAXYMNPXOW-SFHVURJKSA-N	0	3	315.413	2.395	10	0		DEAEHN
CC(C)CCc1nc(CN2CCO[C@H](CN(C)C)C2)cs1	ZINC000105923944	519697993	/nfs/dbraw/zinc/69/79/93/519697993.db2.gz	VBCZTYHXDHQQBB-OAHLLOKOSA-N	0	3	311.495	2.494	10	0		DEAEHN
CCC[C@H](C(=O)N1CCN([C@H](C)c2cccnc2)CC1)N(C)C	ZINC000162156796	520974406	/nfs/dbraw/zinc/97/44/06/520974406.db2.gz	UCITVWDUHGQWDL-NVXWUHKLSA-N	0	3	318.465	2.017	10	0		DEAEHN
CCN(CCNC(=O)N(C)CCc1ccccc1OC)C1CC1	ZINC000104801410	521053260	/nfs/dbraw/zinc/05/32/60/521053260.db2.gz	SHRAKZKTYCWVCG-UHFFFAOYSA-N	0	3	319.449	2.363	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@H]1CC(=O)Nc2ccccc21	ZINC000245423581	521652059	/nfs/dbraw/zinc/65/20/59/521652059.db2.gz	BNCKJMCNLNUZSI-ZFWWWQNUSA-N	0	3	315.417	2.055	10	0		DEAEHN
CCN1CC[C@H]2OCCN(Cc3ncc(Cl)s3)[C@@H]2C1	ZINC000339391768	521723369	/nfs/dbraw/zinc/72/33/69/521723369.db2.gz	IHHNZGXTTMKYOS-GHMZBOCLSA-N	0	3	301.843	2.092	10	0		DEAEHN
COCCN1CCC[C@H]1CN[C@H](C)c1cc(OC)ccc1OC	ZINC000163285543	523833647	/nfs/dbraw/zinc/83/36/47/523833647.db2.gz	ASLBYFRMGWWBBW-CABCVRRESA-N	0	3	322.449	2.465	10	0		DEAEHN
C[C@H](CO)[C@H](C)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000247010457	524573010	/nfs/dbraw/zinc/57/30/10/524573010.db2.gz	ZDDPIYUCBBNAKK-YCPHGPKFSA-N	0	3	322.424	2.171	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)CSCc2ccccn2)CCN1C	ZINC000124343597	524785368	/nfs/dbraw/zinc/78/53/68/524785368.db2.gz	BREVCELNMNTIMK-ZFWWWQNUSA-N	0	3	307.463	2.256	10	0		DEAEHN
C[C@H]1C[C@H]1NC(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000111599435	524957628	/nfs/dbraw/zinc/95/76/28/524957628.db2.gz	OSMNNRZUMINHGL-DOTOQJQBSA-N	0	3	301.434	2.113	10	0		DEAEHN
C=Cc1ccc(CCNC(=O)N[C@@H]2CNCCC2(F)F)cc1	ZINC000418195576	526271326	/nfs/dbraw/zinc/27/13/26/526271326.db2.gz	BYAATNPBHGAJSB-CQSZACIVSA-N	0	3	309.360	2.169	10	0		DEAEHN
C/C=C\C[C@H](NC(=O)[C@H](C)N1[C@H](C)CC[C@@H]1C)C(=O)OCC	ZINC000444309632	526332976	/nfs/dbraw/zinc/33/29/76/526332976.db2.gz	AQZXKOYQBULULT-JTNKCWDGSA-N	0	3	310.438	2.262	10	0		DEAEHN
c1ccc(OCCCCCN2CCN3CCOC[C@@H]3C2)cc1	ZINC000364838551	526485352	/nfs/dbraw/zinc/48/53/52/526485352.db2.gz	KMIGHPOWTROLQU-KRWDZBQOSA-N	0	3	304.434	2.252	10	0		DEAEHN
CN1CC[C@@H](NC(=O)CC2CCOCC2)[C@H]1c1ccccc1	ZINC000248048984	536453771	/nfs/dbraw/zinc/45/37/71/536453771.db2.gz	NKLXNNOBJQXNHL-SJLPKXTDSA-N	0	3	302.418	2.365	10	0		DEAEHN
CC(C)(CC(N)=O)NCc1ccc(Br)c(F)c1	ZINC000186251440	526981939	/nfs/dbraw/zinc/98/19/39/526981939.db2.gz	UGNPYFZDIHZMOM-UHFFFAOYSA-N	0	3	303.175	2.332	10	0		DEAEHN
CC(C)C[C@@H](C)[NH2+]CC[N-]S(=O)(=O)c1ccc(F)cc1F	ZINC000441346083	528267349	/nfs/dbraw/zinc/26/73/49/528267349.db2.gz	ITHFHZXNAKDDAI-LLVKDONJSA-N	0	3	320.405	2.267	10	0		DEAEHN
CC(C)C[C@H](C)[NH2+]CC[N-]S(=O)(=O)c1ccc(F)cc1F	ZINC000441346084	528474300	/nfs/dbraw/zinc/47/43/00/528474300.db2.gz	ITHFHZXNAKDDAI-NSHDSACASA-N	0	3	320.405	2.267	10	0		DEAEHN
CC(C)Cn1ccnc(NCC2(CN(C)C)CCCC2)c1=O	ZINC000302181461	528726679	/nfs/dbraw/zinc/72/66/79/528726679.db2.gz	ZSZYNLUWUBQFGS-UHFFFAOYSA-N	0	3	306.454	2.433	10	0		DEAEHN
CCOC(=O)[C@@]1(C(C)C)CCN(C[C@@H](O)CC(F)(F)F)C1	ZINC000373914246	535594766	/nfs/dbraw/zinc/59/47/66/535594766.db2.gz	XZNAUWDBBRKMLC-AAEUAGOBSA-N	0	3	311.344	2.211	10	0		DEAEHN
CN(C[C@H]1CCCN(C)C1)C(=O)N[C@H]1COc2ccccc21	ZINC000247056063	536445413	/nfs/dbraw/zinc/44/54/13/536445413.db2.gz	BFDYWODVYOLMRM-ZFWWWQNUSA-N	0	3	303.406	2.103	10	0		DEAEHN
COc1ccc(S[C@H](C)C(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000249839014	536881132	/nfs/dbraw/zinc/88/11/32/536881132.db2.gz	UXBFYWDTHXEREU-KGLIPLIRSA-N	0	3	320.458	2.482	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000192577983	625578240	/nfs/dbraw/zinc/57/82/40/625578240.db2.gz	BUYJAORCVWUDOS-DJIMGWMZSA-N	0	3	303.402	2.477	10	0		DEAEHN
CN1CCC(NC(=O)c2cc(-c3ccc(F)c(F)c3)on2)CC1	ZINC000222708150	636373118	/nfs/dbraw/zinc/37/31/18/636373118.db2.gz	ZAXVUYLNMSRMNJ-UHFFFAOYSA-N	0	3	321.327	2.444	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@H]1CCCN(C/C=C(\C)C(=O)OC)C1	ZINC000746501442	638350567	/nfs/dbraw/zinc/35/05/67/638350567.db2.gz	LSHALLSWSXDMHK-FQSSWDBKSA-N	0	3	310.438	2.123	10	0		DEAEHN
CC[C@@H]1CCCCCN1CC(=O)Nc1ccccc1C(N)=O	ZINC000150739270	646084834	/nfs/dbraw/zinc/08/48/34/646084834.db2.gz	FAZBNOUCDIOYKG-CYBMUJFWSA-N	0	3	303.406	2.379	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@@H]1N(C)S(=O)(=O)/C=C/c1ccccc1	ZINC000173246913	646763674	/nfs/dbraw/zinc/76/36/74/646763674.db2.gz	OPCZEWDUSTZLTC-SPBMYTGYSA-N	0	3	308.447	2.259	10	0		DEAEHN
CCCN(C)CC(=O)N[C@@H](C)c1ccc(N2CCCC2=O)cc1	ZINC000730281245	646888415	/nfs/dbraw/zinc/88/84/15/646888415.db2.gz	RRUNSFDHZBVBBK-AWEZNQCLSA-N	0	3	317.433	2.332	10	0		DEAEHN
COc1cc(Cl)cc(C[N@@H+]2C[C@H](C(N)=O)CC[C@H]2C)c1[O-]	ZINC000184680386	649344767	/nfs/dbraw/zinc/34/47/67/649344767.db2.gz	QLPIIUXKAMHEER-NXEZZACHSA-N	0	3	312.797	2.140	10	0		DEAEHN
COc1cc(Cl)cc(C[N@H+]2C[C@H](C(N)=O)CC[C@H]2C)c1[O-]	ZINC000184680386	649344772	/nfs/dbraw/zinc/34/47/72/649344772.db2.gz	QLPIIUXKAMHEER-NXEZZACHSA-N	0	3	312.797	2.140	10	0		DEAEHN
O=C([N-]CCC[N@H+](C[C@H]1CCCO1)C1CCCC1)C(F)(F)F	ZINC000091582632	684037403	/nfs/dbraw/zinc/03/74/03/684037403.db2.gz	XOAWIYDBNSSMDC-CYBMUJFWSA-N	0	3	322.371	2.479	10	0		DEAEHN
O=C([N-]CCC[N@@H+](C[C@H]1CCCO1)C1CCCC1)C(F)(F)F	ZINC000091582632	684037404	/nfs/dbraw/zinc/03/74/04/684037404.db2.gz	XOAWIYDBNSSMDC-CYBMUJFWSA-N	0	3	322.371	2.479	10	0		DEAEHN
Cn1cc([C@H]2CCN(C[C@H](O)c3ccc(F)c(F)c3)C2)cn1	ZINC000116322905	684065122	/nfs/dbraw/zinc/06/51/22/684065122.db2.gz	XRUGIPKYSCIPFQ-LRDDRELGSA-N	0	3	307.344	2.221	10	0		DEAEHN
Cn1c(=O)sc2cc(CNC[C@H](O)c3ccsc3)ccc21	ZINC000192586787	684452762	/nfs/dbraw/zinc/45/27/62/684452762.db2.gz	CDXYVAVHEHZXNX-ZDUSSCGKSA-N	0	3	320.439	2.485	10	0		DEAEHN
CN(C[C@H]1CCCCO1)C[C@@](C)(O)C(F)(F)C(F)(F)F	ZINC000724112552	777243631	/nfs/dbraw/zinc/24/36/31/777243631.db2.gz	ULOOJYSYNBCYPK-NXEZZACHSA-N	0	3	305.287	2.436	10	0		DEAEHN
C[C@@H](N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C)c1ccnn1C	ZINC000721869175	780450052	/nfs/dbraw/zinc/45/00/52/780450052.db2.gz	WUDMDWOXNGXKFG-JHJVBQTASA-N	0	3	308.426	2.326	10	0		DEAEHN
CO[C@]1(CN[C@@H](C)c2ccc(Cl)cc2)CCS(=O)(=O)C1	ZINC000721258569	781017850	/nfs/dbraw/zinc/01/78/50/781017850.db2.gz	IDZPMQYSCJXICF-FZMZJTMJSA-N	0	3	317.838	2.194	10	0		DEAEHN
C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CNCc1ccn(C)n1	ZINC000723819095	787345474	/nfs/dbraw/zinc/34/54/74/787345474.db2.gz	DVAHDWZSTJMJDD-CHWSQXEVSA-N	0	3	308.426	2.013	10	0		DEAEHN
C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CNCc1nccn1C	ZINC000723823734	787345628	/nfs/dbraw/zinc/34/56/28/787345628.db2.gz	MPVHDLJQMPZEJG-CHWSQXEVSA-N	0	3	308.426	2.013	10	0		DEAEHN
C[C@@H]1C[C@H](NCc2cn(C)nc2Br)C[C@H](C)O1	ZINC000724300039	787350992	/nfs/dbraw/zinc/35/09/92/787350992.db2.gz	RSVSATJRBHESPT-JZYVYDRUSA-N	0	3	302.216	2.228	10	0		DEAEHN
CS(=O)(=O)[C@H]1C[C@H](NCc2cccc(Br)c2)C1	ZINC000714249719	792306638	/nfs/dbraw/zinc/30/66/38/792306638.db2.gz	ZQJGUPDAMUMFJT-HAQNSBGRSA-N	0	3	318.236	2.114	10	0		DEAEHN
Cc1nc(C)c([C@@H](C)NCC[C@@H]2CCCS2(=O)=O)s1	ZINC000714335098	792309478	/nfs/dbraw/zinc/30/94/78/792309478.db2.gz	OXMXQZYXOQFAMD-SKDRFNHKSA-N	0	3	302.465	2.378	10	0		DEAEHN
Cc1cc(CN[C@@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)[nH]n1	ZINC000716447397	792959514	/nfs/dbraw/zinc/95/95/14/792959514.db2.gz	PFARSKMRETYQCC-SMDDNHRTSA-N	0	3	308.426	2.453	10	0		DEAEHN
C/C=C\C(=O)N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC000404242472	802012820	/nfs/dbraw/zinc/01/28/20/802012820.db2.gz	XZYSINQTXSNGRG-QBABJXPOSA-N	0	3	300.402	2.064	10	0		DEAEHN
CN1CCC[C@@H]2[C@H]1CCN2C(=O)c1cccnc1Br	ZINC000720829361	1086184706	/nfs/dbraw/zinc/18/47/06/1086184706.db2.gz	MBWJUDTWGVJCSL-VXGBXAGGSA-N	0	3	324.222	2.153	10	0		DEAEHN
COc1cncc(CN[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)c1	ZINC000700056110	1086308325	/nfs/dbraw/zinc/30/83/25/1086308325.db2.gz	JQDOCQPVCRRZHB-NEPJUHHUSA-N	0	3	309.410	2.482	10	0		DEAEHN
C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1NCCS(=O)(=O)C1CCCCC1	ZINC000701028030	1086347811	/nfs/dbraw/zinc/34/78/11/1086347811.db2.gz	VWIRHCTXLJWJFB-QVHKTLOISA-N	0	3	303.468	2.135	10	0		DEAEHN
Ic1cccc(CN[C@]23C[C@H]2COC3)c1	ZINC000718039872	1087739639	/nfs/dbraw/zinc/73/96/39/1087739639.db2.gz	AJUSLCGFLVIYJC-JQWIXIFHSA-N	0	3	315.154	2.170	10	0		DEAEHN
C[C@H](NC1CC(CC(N)=O)C1)c1ccc(Br)cn1	ZINC000718397928	1088505118	/nfs/dbraw/zinc/50/51/18/1088505118.db2.gz	LGVBXJSJVGQTJR-SILCLGDVSA-N	0	3	312.211	2.149	10	0		DEAEHN
CN(C)CCN(Cc1ccco1)C(=O)[C@H]1CCCc2n[nH]cc21	ZINC000134497290	282097193	/nfs/dbraw/zinc/09/71/93/282097193.db2.gz	JWDKGDJLBYCBLN-AWEZNQCLSA-N	0	3	316.405	2.013	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCCCOCCc1ccccc1	ZINC000139766039	282102157	/nfs/dbraw/zinc/10/21/57/282102157.db2.gz	ORIIZTPIUHCPMP-KRWDZBQOSA-N	0	3	319.449	2.029	10	0		DEAEHN
CCOC(=O)CSC[C@@H](NC)c1cc(OC)ccc1OC	ZINC000081795635	192324220	/nfs/dbraw/zinc/32/42/20/192324220.db2.gz	AOQCCSFAHXLAFG-CYBMUJFWSA-N	0	3	313.419	2.261	10	0		DEAEHN
COCCCN(CCOC)[C@H](CN)c1ccc(F)c(Cl)c1	ZINC000163818446	197650680	/nfs/dbraw/zinc/65/06/80/197650680.db2.gz	DBGVBCIOKGKLFP-OAHLLOKOSA-N	0	3	318.820	2.464	10	0		DEAEHN
CC[C@@H](N)[C@H](C)S(=O)(=O)c1ccc(Br)cc1	ZINC000081933363	192341702	/nfs/dbraw/zinc/34/17/02/192341702.db2.gz	MOVUGOIGTAQIDA-GZMMTYOYSA-N	0	3	306.225	2.349	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)N[C@H]2CCCc3sccc32)CCO1	ZINC000136621958	282137615	/nfs/dbraw/zinc/13/76/15/282137615.db2.gz	HBUFQKFJUOQOCD-JSGCOSHPSA-N	0	3	323.462	2.098	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2ccc(OC(C)(C)C)cc2)CCO1	ZINC000176059604	282139581	/nfs/dbraw/zinc/13/95/81/282139581.db2.gz	KGZKKQNJHZFOFG-INIZCTEOSA-N	0	3	320.433	2.267	10	0		DEAEHN
CCCN[C@H](CS(=O)(=O)CCOC)c1cc(C)ccc1C	ZINC000081943237	192344393	/nfs/dbraw/zinc/34/43/93/192344393.db2.gz	HHHZUAVIUPVKNG-MRXNPFEDSA-N	0	3	313.463	2.405	10	0		DEAEHN
CN(CCC(N)=S)C(=O)CN1CCC[C@H](C(C)(C)C)CC1	ZINC000079342518	185165820	/nfs/dbraw/zinc/16/58/20/185165820.db2.gz	NOJPUQWUAMCLNG-ZDUSSCGKSA-N	0	3	313.511	2.269	10	0		DEAEHN
CC(C)COC1CCN(C[C@@H](O)COCc2ccco2)CC1	ZINC000079391448	185168040	/nfs/dbraw/zinc/16/80/40/185168040.db2.gz	NFNKTXHZLSCOAO-OAHLLOKOSA-N	0	3	311.422	2.294	10	0		DEAEHN
CC[C@H](NC(=O)N1CC[C@H](N(C)C)C1)c1ccc(OC)cc1	ZINC000170826276	282180482	/nfs/dbraw/zinc/18/04/82/282180482.db2.gz	HKHMJPCZIRWQJJ-HOCLYGCPSA-N	0	3	305.422	2.492	10	0		DEAEHN
C[C@@H]1CN(c2ccc(I)cc2)CCN1	ZINC000083061258	185212454	/nfs/dbraw/zinc/21/24/54/185212454.db2.gz	HYFIOWHWRGWPRV-SECBINFHSA-N	0	3	302.159	2.089	10	0		DEAEHN
COc1ccc(Br)c(Cn2c(C)ncc2CN)c1	ZINC000087799529	185232350	/nfs/dbraw/zinc/23/23/50/185232350.db2.gz	DNXPFGDLBMVQHG-UHFFFAOYSA-N	0	3	310.195	2.470	10	0		DEAEHN
NC1(C(=O)Nc2cccc(NC(=O)c3cccs3)c2)CC1	ZINC000088130838	185240273	/nfs/dbraw/zinc/24/02/73/185240273.db2.gz	NGJODTBBWARWGC-UHFFFAOYSA-N	0	3	301.371	2.430	10	0		DEAEHN
NC1(C(=O)N(Cc2ccccc2Br)C2CC2)CC1	ZINC000088130457	185240437	/nfs/dbraw/zinc/24/04/37/185240437.db2.gz	WQXXUFHZRRTPHV-UHFFFAOYSA-N	0	3	309.207	2.431	10	0		DEAEHN
CC[NH2+][C@@](C)(CCCN1CCC[C@H](C(F)(F)F)C1)C(=O)[O-]	ZINC000088435282	185250530	/nfs/dbraw/zinc/25/05/30/185250530.db2.gz	WIGKFVYBLSYTQA-AAEUAGOBSA-N	0	3	310.360	2.494	10	0		DEAEHN
CC[C@@H](C)C[C@H](C)NCc1ccc(S(=O)(=O)N(C)C)o1	ZINC000088541003	185255647	/nfs/dbraw/zinc/25/56/47/185255647.db2.gz	KQHJLMZWLLCKLE-NEPJUHHUSA-N	0	3	302.440	2.444	10	0		DEAEHN
C[N-]S(=O)(=O)c1ccc(C[NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)o1	ZINC000088540915	185255831	/nfs/dbraw/zinc/25/58/31/185255831.db2.gz	WKOBFRNXWVLSIQ-GRYCIOLGSA-N	0	3	300.424	2.102	10	0		DEAEHN
CC[C@H](C)[C@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000088542943	185256457	/nfs/dbraw/zinc/25/64/57/185256457.db2.gz	AJTHHDFXRQWKJC-RYUDHWBXSA-N	0	3	302.440	2.491	10	0		DEAEHN
CC[C@H](C)[C@H](C)NS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000088542943	185256458	/nfs/dbraw/zinc/25/64/58/185256458.db2.gz	AJTHHDFXRQWKJC-RYUDHWBXSA-N	0	3	302.440	2.491	10	0		DEAEHN
CCC[C@@H](N)CS(=O)(=O)c1cccc(Br)c1	ZINC000081982567	192348744	/nfs/dbraw/zinc/34/87/44/192348744.db2.gz	DLJFDWCWKHSAQF-SNVBAGLBSA-N	0	3	306.225	2.350	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N(S(=O)(=O)c2ccc(F)c(CN)c2)C1	ZINC000088704765	185262746	/nfs/dbraw/zinc/26/27/46/185262746.db2.gz	NVFOBKMUDIOJJC-GHMZBOCLSA-N	0	3	300.399	2.094	10	0		DEAEHN
CC(C)CCCNS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000088550712	185257550	/nfs/dbraw/zinc/25/75/50/185257550.db2.gz	BHBPGQIYJDAWLM-UHFFFAOYSA-N	0	3	302.440	2.492	10	0		DEAEHN
CC(C)CCC[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000088550712	185257551	/nfs/dbraw/zinc/25/75/51/185257551.db2.gz	BHBPGQIYJDAWLM-UHFFFAOYSA-N	0	3	302.440	2.492	10	0		DEAEHN
CN1CC[C@H](CNC(=O)c2sc3ccc(F)cc3c2N)C1	ZINC000088640956	185260849	/nfs/dbraw/zinc/26/08/49/185260849.db2.gz	XLTHIKGPTFUSJZ-SECBINFHSA-N	0	3	307.394	2.304	10	0		DEAEHN
Nc1c2cc(F)ccc2sc1C(=O)NCCN1CCCC1	ZINC000088643150	185261181	/nfs/dbraw/zinc/26/11/81/185261181.db2.gz	AANACIUDSXTVHX-UHFFFAOYSA-N	0	3	307.394	2.448	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@@H]1S(=O)(=O)Cc1cccc(C)c1	ZINC000081984204	192349872	/nfs/dbraw/zinc/34/98/72/192349872.db2.gz	KQIAAIGUNMCLRT-CVEARBPZSA-N	0	3	311.447	2.067	10	0		DEAEHN
c1cnn(C[C@H](NCCOC2CCOCC2)c2ccccc2)c1	ZINC000625254099	365698603	/nfs/dbraw/zinc/69/86/03/365698603.db2.gz	HYTKHJOWOUTKNQ-SFHVURJKSA-N	0	3	315.417	2.410	10	0		DEAEHN
CN[C@H](c1ccc(C)cc1)[C@@H](C)S(=O)(=O)C1CCOCC1	ZINC000081990336	192350879	/nfs/dbraw/zinc/35/08/79/192350879.db2.gz	TUIIUCCPSKZASV-CJNGLKHVSA-N	0	3	311.447	2.238	10	0		DEAEHN
CN[C@@H](C[S@](=O)c1ccccc1)c1ccc2c(c1)OCO2	ZINC000082000992	192352900	/nfs/dbraw/zinc/35/29/00/192352900.db2.gz	UDXAHIFXYZRDNW-LHSJRXKWSA-N	0	3	303.383	2.484	10	0		DEAEHN
C[C@@H]1[C@H](C)OCCN1C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179259965	282221592	/nfs/dbraw/zinc/22/15/92/282221592.db2.gz	WDBPVGRITHZDFY-YALNPMBYSA-N	0	3	317.433	2.251	10	0		DEAEHN
CN(Cc1cccc(Br)c1)[C@H](CN)c1cncn1C	ZINC000090167503	185284481	/nfs/dbraw/zinc/28/44/81/185284481.db2.gz	CXOVHQFLZUCRKG-CYBMUJFWSA-N	0	3	323.238	2.314	10	0		DEAEHN
N[C@@H]1COC[C@H]1C(=O)Nc1ccccc1SC(F)(F)F	ZINC000090379822	185293416	/nfs/dbraw/zinc/29/34/16/185293416.db2.gz	UGHDQSIRUPYDLE-HTQZYQBOSA-N	0	3	306.309	2.211	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1ccc(SC(F)F)cc1	ZINC000090432829	185296442	/nfs/dbraw/zinc/29/64/42/185296442.db2.gz	BSUFMSHNAATDRM-MNOVXSKESA-N	0	3	302.346	2.174	10	0		DEAEHN
CCN(Cc1ccc(Cl)s1)C(=O)[C@@]1(C)COC[C@H]1N	ZINC000090590625	185305529	/nfs/dbraw/zinc/30/55/29/185305529.db2.gz	KLXXUPLFZAKYQO-MFKMUULPSA-N	0	3	302.827	2.114	10	0		DEAEHN
C[C@@]1(c2nc(CSc3ccc(F)cc3)no2)COC[C@@H]1N	ZINC000090574267	185304377	/nfs/dbraw/zinc/30/43/77/185304377.db2.gz	UGUUTVYVGAYYDM-SMDDNHRTSA-N	0	3	309.366	2.116	10	0		DEAEHN
C[C@@]1(C(=O)Nc2nc3ccc(Cl)cc3s2)COC[C@H]1N	ZINC000090580321	185304763	/nfs/dbraw/zinc/30/47/63/185304763.db2.gz	LFBCPXSGCSWRBI-ZWNOBZJWSA-N	0	3	311.794	2.252	10	0		DEAEHN
Cc1noc(C)c1C(=O)N1CCCSC[C@@H]1CN1CCCC1	ZINC000090700908	185310485	/nfs/dbraw/zinc/31/04/85/185310485.db2.gz	RHRQERZSHCTBBO-AWEZNQCLSA-N	0	3	323.462	2.335	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)Cc1c(Br)c(C)nn1CC	ZINC000167241581	197705079	/nfs/dbraw/zinc/70/50/79/197705079.db2.gz	IVJSQIJJVOTIIP-AMIZOPFISA-N	0	3	316.243	2.459	10	0		DEAEHN
CN[C@H]1c2cc(OC)ccc2CC[C@@H]1Sc1nncn1C	ZINC000092389748	185315621	/nfs/dbraw/zinc/31/56/21/185315621.db2.gz	ODKFEHRHCSHKLK-KBPBESRZSA-N	0	3	304.419	2.191	10	0		DEAEHN
CCOCCN1CCN(Cc2cnc(-c3ccccc3)[nH]2)CC1	ZINC000179969612	282235363	/nfs/dbraw/zinc/23/53/63/282235363.db2.gz	WSDDIPJNTCJRJN-UHFFFAOYSA-N	0	3	314.433	2.231	10	0		DEAEHN
Nc1nc2cc(Br)cnc2n1[C@H]1CN2CCC1CC2	ZINC000092575097	185326894	/nfs/dbraw/zinc/32/68/94/185326894.db2.gz	UOFXLGHDDNVCEM-NSHDSACASA-N	0	3	322.210	2.043	10	0		DEAEHN
COCOc1ccc(OC)cc1CN1CCN2CCCC[C@@H]2C1	ZINC000092616182	185329197	/nfs/dbraw/zinc/32/91/97/185329197.db2.gz	SLXQDFIOCGMRHU-MRXNPFEDSA-N	0	3	320.433	2.348	10	0		DEAEHN
CNCc1sccc1S(=O)(=O)NCC1C(C)(C)C1(C)C	ZINC000092833119	185344916	/nfs/dbraw/zinc/34/49/16/185344916.db2.gz	ZEVLLGYJUPOIEG-UHFFFAOYSA-N	0	3	316.492	2.428	10	0		DEAEHN
C[C@@H]1OCC[C@@H]1N[C@@H](CO)c1cccc(Br)c1	ZINC000181399772	199290731	/nfs/dbraw/zinc/29/07/31/199290731.db2.gz	YGIZUKBSADCLEB-XDTLVQLUSA-N	0	3	300.196	2.250	10	0		DEAEHN
COC1(CNC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CCC1	ZINC000181494996	199306153	/nfs/dbraw/zinc/30/61/53/199306153.db2.gz	UILKUJBDLKPGMQ-HOTGVXAUSA-N	0	3	317.433	2.300	10	0		DEAEHN
C[C@@H](N[C@@H](C)c1ccncc1)c1ccc(S(N)(=O)=O)cc1	ZINC000036954909	539334907	/nfs/dbraw/zinc/33/49/07/539334907.db2.gz	DYKRVXSUSZVVNO-NEPJUHHUSA-N	0	3	305.403	2.141	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCS[C@@H](C)CC1	ZINC000192257555	282340316	/nfs/dbraw/zinc/34/03/16/282340316.db2.gz	FRVILQAKINOQKE-KBPBESRZSA-N	0	3	301.500	2.500	10	0		DEAEHN
CN1CCC(NC(=O)N[C@H]2CCCc3c(O)cccc32)CC1	ZINC000190445996	530050330	/nfs/dbraw/zinc/05/03/30/530050330.db2.gz	UUKUKKINZPGGQQ-HNNXBMFYSA-N	0	3	303.406	2.163	10	0		DEAEHN
CC(C)OC[C@@H](O)CNCc1sccc1Br	ZINC000087575536	539407950	/nfs/dbraw/zinc/40/79/50/539407950.db2.gz	WGARKGOPKSRUPA-VIFPVBQESA-N	0	3	308.241	2.386	10	0		DEAEHN
C[C@H](CCc1ccc(O)cc1)NC(=O)NC[C@@H]1CCCN1C	ZINC000195124554	282368954	/nfs/dbraw/zinc/36/89/54/282368954.db2.gz	LXGIIBZLDANGQE-HIFRSBDPSA-N	0	3	305.422	2.107	10	0		DEAEHN
Cc1cc(C)n(CCCNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)n1	ZINC000245586995	282398756	/nfs/dbraw/zinc/39/87/56/282398756.db2.gz	AMOPTIJKJPFUCE-GOEBONIOSA-N	0	3	321.469	2.014	10	0		DEAEHN
CN(Cc1ccccc1OC(F)(F)F)C[C@@H]1CNCCO1	ZINC000125419216	539473036	/nfs/dbraw/zinc/47/30/36/539473036.db2.gz	QVDKHGRKJFHOQY-LBPRGKRZSA-N	0	3	304.312	2.005	10	0		DEAEHN
C[C@H](NC(=O)NCCN(C)C)c1cccc(Br)c1	ZINC000133414723	539507218	/nfs/dbraw/zinc/50/72/18/539507218.db2.gz	XBEUGAWZLMSSBE-JTQLQIEISA-N	0	3	314.227	2.371	10	0		DEAEHN
CCCCNC(=O)C(C)S(=O)(=O)Cc1ccccc1F	ZINC000069806112	190820185	/nfs/dbraw/zinc/82/01/85/190820185.db2.gz	BIOHLCBNDDILMS-NSHDSACASA-N	0	3	301.383	2.045	10	0		DEAEHN
Cc1ccc(OC[C@H](O)CN[C@@H](CO)c2ccccc2)cc1	ZINC000170846878	539615374	/nfs/dbraw/zinc/61/53/74/539615374.db2.gz	FVTQKPPOCMRLLC-AEFFLSMTSA-N	0	3	301.386	2.058	10	0		DEAEHN
COc1ccc([C@@H](C)NC[C@H](C)CS(C)(=O)=O)cc1OC	ZINC000180881718	539647560	/nfs/dbraw/zinc/64/75/60/539647560.db2.gz	MSBAIZXMCKCYNW-NWDGAFQWSA-N	0	3	315.435	2.035	10	0		DEAEHN
Cc1ccc([C@H](C)NCCN2C(=O)NC(C)(C)C2=O)cc1F	ZINC000181342199	539650853	/nfs/dbraw/zinc/65/08/53/539650853.db2.gz	TZJNDUUKBRNDCX-NSHDSACASA-N	0	3	307.369	2.115	10	0		DEAEHN
CC(C)c1ncc(Cl)c(C(=O)N(C)C[C@H]2CCN(C)C2)n1	ZINC000071189342	190940098	/nfs/dbraw/zinc/94/00/98/190940098.db2.gz	CZOHWABHEGQMBX-NSHDSACASA-N	0	3	310.829	2.277	10	0		DEAEHN
Brc1ccc2c(c1)[C@H](NCCc1nnc[nH]1)CCO2	ZINC000080573688	192169091	/nfs/dbraw/zinc/16/90/91/192169091.db2.gz	LGXCBYZIYVSSHD-LLVKDONJSA-N	0	3	323.194	2.223	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccc(N3CCCC3=O)cc2)C1	ZINC000194623995	539719037	/nfs/dbraw/zinc/71/90/37/539719037.db2.gz	AOUCLKNLOSOYGO-OAHLLOKOSA-N	0	3	315.417	2.028	10	0		DEAEHN
N[C@@H](C[S@@](=O)Cc1ccccc1)c1ccc2c(c1)OCO2	ZINC000084004306	192395102	/nfs/dbraw/zinc/39/51/02/192395102.db2.gz	TYEOPWRJOFTCEF-LHSJRXKWSA-N	0	3	303.383	2.364	10	0		DEAEHN
NCc1ccccc1C(=O)NC[C@H](O)c1ccc(Cl)cc1	ZINC000071699876	191009466	/nfs/dbraw/zinc/00/94/66/191009466.db2.gz	OHFDGVNRWGRBSZ-HNNXBMFYSA-N	0	3	304.777	2.262	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)Nc2cnc(C3CC3)nc2)C1	ZINC000246569603	539765188	/nfs/dbraw/zinc/76/51/88/539765188.db2.gz	XJBXRMBMWQGPCQ-BXUZGUMPSA-N	0	3	303.410	2.204	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N(C)C2CCCC2)c1	ZINC000138445748	186016857	/nfs/dbraw/zinc/01/68/57/186016857.db2.gz	ZGLXSKKEHHCACS-UHFFFAOYSA-N	0	3	318.389	2.247	10	0		DEAEHN
C[C@@H]1CC[C@H](C)CN1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000139159049	186020425	/nfs/dbraw/zinc/02/04/25/186020425.db2.gz	KFYMFLWHLAJQDP-VHSXEESVSA-N	0	3	318.389	2.233	10	0		DEAEHN
CN(C)CCn1ncc(Cl)c1[C@H](O)CCc1ccncc1	ZINC000140142187	186025063	/nfs/dbraw/zinc/02/50/63/186025063.db2.gz	YVJBKCLOJXZDOK-CQSZACIVSA-N	0	3	308.813	2.159	10	0		DEAEHN
CCCN(CCC)[C@@]1(CN)CCS(=O)(=O)c2ccccc21	ZINC000147636165	186041023	/nfs/dbraw/zinc/04/10/23/186041023.db2.gz	GKEVCLXRXDRDKA-MRXNPFEDSA-N	0	3	310.463	2.140	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1ccc(SC)cc1	ZINC000145545518	186037375	/nfs/dbraw/zinc/03/73/75/186037375.db2.gz	KXMUHTQYUDGMDQ-LBPRGKRZSA-N	0	3	316.492	2.417	10	0		DEAEHN
CN(Cc1ccsc1)C(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C	ZINC000253269637	539784893	/nfs/dbraw/zinc/78/48/93/539784893.db2.gz	ZSIHJDINZZTBLY-WOSRLPQWSA-N	0	3	308.447	2.239	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc1	ZINC000150797628	186066448	/nfs/dbraw/zinc/06/64/48/186066448.db2.gz	GHTNVNBTGWJNEE-BBRMVZONSA-N	0	3	317.433	2.032	10	0		DEAEHN
CCS(=O)(=O)C[C@@H](C)N[C@H](C)Cc1c(F)cccc1F	ZINC000164006375	186145444	/nfs/dbraw/zinc/14/54/44/186145444.db2.gz	NIPMQKFKPVZVHW-GHMZBOCLSA-N	0	3	305.390	2.309	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@](C)(O)c1ccccc1Cl)N(C)C	ZINC000155866128	186118837	/nfs/dbraw/zinc/11/88/37/186118837.db2.gz	TVTDMZZPRSZTSC-GDBMZVCRSA-N	0	3	312.841	2.394	10	0		DEAEHN
CCn1ncc(Br)c1C(=O)CNC1CCCC1	ZINC000164154222	186150806	/nfs/dbraw/zinc/15/08/06/186150806.db2.gz	GMTGAPYEHKCCTM-UHFFFAOYSA-N	0	3	300.200	2.380	10	0		DEAEHN
CC(C)NC(=O)CCN[C@@H](C)c1cccc(N2CCCC2=O)c1	ZINC000177867164	186196016	/nfs/dbraw/zinc/19/60/16/186196016.db2.gz	PNDRJKIOIMFKCM-AWEZNQCLSA-N	0	3	317.433	2.379	10	0		DEAEHN
CC(C)OC(=O)CCN[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000181903404	186217551	/nfs/dbraw/zinc/21/75/51/186217551.db2.gz	IPLQJDHAQVLMCX-CYBMUJFWSA-N	0	3	302.378	2.260	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)Nc1nc2c(s1)COCC2	ZINC000172256801	198066534	/nfs/dbraw/zinc/06/65/34/198066534.db2.gz	KEMPLTWLNSDARS-NSHDSACASA-N	0	3	324.450	2.212	10	0		DEAEHN
COc1cc(CCNC(=O)N2CCN3CCC[C@@H]3C2)ccc1C	ZINC000172661206	198133794	/nfs/dbraw/zinc/13/37/94/198133794.db2.gz	UFARNFSNJPQGIU-MRXNPFEDSA-N	0	3	317.433	2.036	10	0		DEAEHN
Cc1c(F)cccc1NC(=O)C(=O)NCCN1CCCC[C@H]1C	ZINC000072610377	191201881	/nfs/dbraw/zinc/20/18/81/191201881.db2.gz	UWBTXBBUXZHGPQ-GFCCVEGCSA-N	0	3	321.396	2.063	10	0		DEAEHN
Cc1cc(F)ccc1-n1ccc(C(=O)N2CC[C@@H](N(C)C)C2)n1	ZINC000182056092	199379939	/nfs/dbraw/zinc/37/99/39/199379939.db2.gz	KIUYKVOYVFCDBR-CQSZACIVSA-N	0	3	316.380	2.096	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCN2CCC[C@@H]2C1)Oc1ccccc1F	ZINC000173511021	198222482	/nfs/dbraw/zinc/22/24/82/198222482.db2.gz	RMMJKWWWSLUMEF-UONOGXRCSA-N	0	3	321.396	2.083	10	0		DEAEHN
Cc1ccc(O[C@H](C)CNC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000173917090	198268755	/nfs/dbraw/zinc/26/87/55/198268755.db2.gz	IDYSKSZHDOOMSN-HUUCEWRRSA-N	0	3	305.422	2.108	10	0		DEAEHN
C[C@H](COCc1ccccc1)NC(=O)NCCN1CCCCC1	ZINC000173983714	198276069	/nfs/dbraw/zinc/27/60/69/198276069.db2.gz	HBQDXZNQZYUHLO-MRXNPFEDSA-N	0	3	319.449	2.377	10	0		DEAEHN
Cc1nc(-c2cccc(NC(=O)C3CCN(C)CC3)c2)no1	ZINC000174289331	198315590	/nfs/dbraw/zinc/31/55/90/198315590.db2.gz	DWQXARFYMTUZQT-UHFFFAOYSA-N	0	3	300.362	2.325	10	0		DEAEHN
C=C/C(C)=C\CC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000617703862	363228614	/nfs/dbraw/zinc/22/86/14/363228614.db2.gz	QEIXTKWTQGMQLL-BXENKHIRSA-N	0	3	314.429	2.392	10	0		DEAEHN
Cc1ccn2c(CN[C@H]3CCCN(c4ccnn4C)C3)cnc2c1	ZINC000333515065	282936047	/nfs/dbraw/zinc/93/60/47/282936047.db2.gz	FWQGKEFGCGNJFZ-HNNXBMFYSA-N	0	3	324.432	2.135	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)CSC[C@@H]2CCCCO2)C1	ZINC000247342197	535256576	/nfs/dbraw/zinc/25/65/76/535256576.db2.gz	NPOYFLMVGMHTNO-QLFBSQMISA-N	0	3	314.495	2.134	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)C(=O)Nc2cccc(Cl)c2)C1	ZINC000246529259	535257565	/nfs/dbraw/zinc/25/75/65/535257565.db2.gz	UTBTXCRQQJFTHA-BXUZGUMPSA-N	0	3	323.824	2.123	10	0		DEAEHN
Cc1cccc(C)c1OCCN1CCC(C(=O)N(C)C)CC1	ZINC000061761339	354630648	/nfs/dbraw/zinc/63/06/48/354630648.db2.gz	AQRXUWHIOZTPPC-UHFFFAOYSA-N	0	3	304.434	2.482	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)c1ccc2cc(OC)ccc2n1	ZINC000073698955	191343715	/nfs/dbraw/zinc/34/37/15/191343715.db2.gz	ZVKQRSLLQUHMML-CQSZACIVSA-N	0	3	313.401	2.458	10	0		DEAEHN
Cc1nc2cc(CC(=O)NCCN(C)C)ccc2n1C(C)C	ZINC000074975178	191399924	/nfs/dbraw/zinc/39/99/24/191399924.db2.gz	NKOWLLYYXJQQSK-UHFFFAOYSA-N	0	3	302.422	2.146	10	0		DEAEHN
CN[C@H](C)C(=O)N1C[C@H](C)N(Cc2ccccc2)[C@@H](C)[C@@H]1C	ZINC000404312535	540145048	/nfs/dbraw/zinc/14/50/48/540145048.db2.gz	MCWKTBQRNVSWPL-FZKCQIBNSA-N	0	3	303.450	2.104	10	0		DEAEHN
O=C(Nc1nccs1)[C@@H]1CCCN1CCN1CCCCC1	ZINC000077313001	191690621	/nfs/dbraw/zinc/69/06/21/191690621.db2.gz	RDHVMKMSTHPHIY-ZDUSSCGKSA-N	0	3	308.451	2.032	10	0		DEAEHN
CC(C)CCN1CC[C@H](N2CCN(CCC(C)C)CC2)C1=O	ZINC000169793236	355984959	/nfs/dbraw/zinc/98/49/59/355984959.db2.gz	MAPDUFSQCAECNA-KRWDZBQOSA-N	0	3	309.498	2.297	10	0		DEAEHN
CC[C@](C)(CO)NCC(=O)Nc1ccc(Br)cc1	ZINC000080108412	192002014	/nfs/dbraw/zinc/00/20/14/192002014.db2.gz	KQWQXRGWFDPJIC-CYBMUJFWSA-N	0	3	315.211	2.138	10	0		DEAEHN
C[C@H]1CCC[C@](N)(C(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1	ZINC000080915114	192200574	/nfs/dbraw/zinc/20/05/74/192200574.db2.gz	CBSNSEAGIMGTKE-BJOHPYRUSA-N	0	3	309.797	2.285	10	0		DEAEHN
Ic1cnc([C@@H]2NC[C@H]2C2CC2)s1	ZINC000306898455	356405870	/nfs/dbraw/zinc/40/58/70/356405870.db2.gz	XHFWMAOOCMLTFN-POYBYMJQSA-N	0	3	306.172	2.418	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000236895089	202057687	/nfs/dbraw/zinc/05/76/87/202057687.db2.gz	PJDJAGBYMJQAFX-NJZAAPMLSA-N	0	3	309.841	2.408	10	0		DEAEHN
CN[C@@H](c1ccc(OC)cc1Cl)[C@H]1CCS(=O)(=O)C1	ZINC000086021890	192543768	/nfs/dbraw/zinc/54/37/68/192543768.db2.gz	CSGYETRRSXQFMI-TVQRCGJNSA-N	0	3	303.811	2.044	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000237039542	202132329	/nfs/dbraw/zinc/13/23/29/202132329.db2.gz	QEZNCKQEDGKFAH-CKLFPEKLSA-N	0	3	302.777	2.002	10	0		DEAEHN
Brc1ccc(CN2CC[C@@H]3OCCN[C@H]3C2)cc1	ZINC000404064898	356731793	/nfs/dbraw/zinc/73/17/93/356731793.db2.gz	JKBOJESEVASRLX-KBPBESRZSA-N	0	3	311.223	2.012	10	0		DEAEHN
C[C@@H]1CNCCN1c1ccc(F)cc1I	ZINC000086765468	192597631	/nfs/dbraw/zinc/59/76/31/192597631.db2.gz	GGJWRBWKEXISPW-MRVPVSSYSA-N	0	3	320.149	2.228	10	0		DEAEHN
CC(=O)N1C[C@@H]2CCC[C@H](N[C@@H](C)c3nccnc3C)[C@H]2C1	ZINC000579400823	356968534	/nfs/dbraw/zinc/96/85/34/356968534.db2.gz	ALDFCKCIURPGDH-TUUVXOQKSA-N	0	3	302.422	2.083	10	0		DEAEHN
CCCn1cc(S(=O)(=O)N2CCCC[C@@H]2CC)cc1CN	ZINC000088943240	192662664	/nfs/dbraw/zinc/66/26/64/192662664.db2.gz	PQODFQNIXMXYPM-ZDUSSCGKSA-N	0	3	313.467	2.310	10	0		DEAEHN
CCCNCc1ccc(S(=O)(=O)N(C)[C@H](C)CCC)nc1	ZINC000088964652	192673433	/nfs/dbraw/zinc/67/34/33/192673433.db2.gz	UHOMYSHBZVXHTP-CYBMUJFWSA-N	0	3	313.467	2.390	10	0		DEAEHN
CCCCC[C@H](C)NS(=O)(=O)c1cc(CNCC)n(C)c1	ZINC000088997960	192689169	/nfs/dbraw/zinc/68/91/69/192689169.db2.gz	LQQCCLIXXSTUMI-ZDUSSCGKSA-N	0	3	315.483	2.382	10	0		DEAEHN
CN(C)CCn1cc(NC(=O)c2csc(C(C)(C)C)n2)cn1	ZINC000588216516	357401919	/nfs/dbraw/zinc/40/19/19/357401919.db2.gz	NZHAXRJAWYXEML-UHFFFAOYSA-N	0	3	321.450	2.451	10	0		DEAEHN
Cc1ccccc1CCC(=O)Nc1cnn(CCN(C)C)c1	ZINC000590889592	357636102	/nfs/dbraw/zinc/63/61/02/357636102.db2.gz	NPKMPUXNKKIXGN-UHFFFAOYSA-N	0	3	300.406	2.324	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCc2ccncc2)[C@@H]1c1ccccc1	ZINC000179276715	199008932	/nfs/dbraw/zinc/00/89/32/199008932.db2.gz	HOWOPGGBRJKFEN-SJORKVTESA-N	0	3	310.401	2.326	10	0		DEAEHN
CN1CC[C@@H](NC(=O)Cc2cccc(O)c2)[C@@H]1c1ccccc1	ZINC000179222877	199001729	/nfs/dbraw/zinc/00/17/29/199001729.db2.gz	RXOWNMHDBKNGEV-MJGOQNOKSA-N	0	3	310.397	2.496	10	0		DEAEHN
CC[C@H](CSC)NC(=O)c1ccccc1OCCN(C)C	ZINC000180555630	199175102	/nfs/dbraw/zinc/17/51/02/199175102.db2.gz	XXQNVHQKRFWUBO-CYBMUJFWSA-N	0	3	310.463	2.498	10	0		DEAEHN
c1nc2n(n1)C[C@@H](N[C@@H]1CSCCc3ccccc31)CC2	ZINC000180604565	199183350	/nfs/dbraw/zinc/18/33/50/199183350.db2.gz	FFODRLSVRDRCNM-DZGCQCFKSA-N	0	3	300.431	2.213	10	0		DEAEHN
CC(=O)Nc1ccc(C)c(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000186966059	200039407	/nfs/dbraw/zinc/03/94/07/200039407.db2.gz	PASXRODKFRKWRZ-XJKSGUPXSA-N	0	3	315.417	2.262	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NCc2cccc(CN(C)C)c2)CC[C@@H]1C	ZINC000187325367	200095738	/nfs/dbraw/zinc/09/57/38/200095738.db2.gz	LBIWLTLMERWLGD-WMLDXEAASA-N	0	3	319.449	2.315	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NCCN(C)Cc2ccccc2)CC[C@@H]1C	ZINC000187424600	200111350	/nfs/dbraw/zinc/11/13/50/200111350.db2.gz	KATFFGUGYLNGBI-DOTOQJQBSA-N	0	3	319.449	2.185	10	0		DEAEHN
Cc1nccnc1[C@H](C)NC1CCN(Cc2ccccn2)CC1	ZINC000187788037	200157035	/nfs/dbraw/zinc/15/70/35/200157035.db2.gz	HOYUWQOKNWMJDQ-HNNXBMFYSA-N	0	3	311.433	2.495	10	0		DEAEHN
Cc1ccc(CNC(=O)CN(C)[C@]2(CO)CC[C@H](C)C2)cc1	ZINC000187915766	200175834	/nfs/dbraw/zinc/17/58/34/200175834.db2.gz	GETFXUVBAZIEMU-MAUKXSAKSA-N	0	3	304.434	2.094	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)Cc2ccc(OC)c(O)c2)C1	ZINC000194169302	201189337	/nfs/dbraw/zinc/18/93/37/201189337.db2.gz	IUIKPXRGGPGTMO-AWEZNQCLSA-N	0	3	321.421	2.027	10	0		DEAEHN
CCOC(=O)CCN[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000611406209	361593547	/nfs/dbraw/zinc/59/35/47/361593547.db2.gz	VXJHHFZDLRUALF-OAHLLOKOSA-N	0	3	307.390	2.470	10	0		DEAEHN
CCCOC(=O)[C@@H](C)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000195284160	201372834	/nfs/dbraw/zinc/37/28/34/201372834.db2.gz	FGHLUQYCDRPARC-NVXWUHKLSA-N	0	3	319.449	2.177	10	0		DEAEHN
CCCCOC[C@@H](O)CN(CCO)[C@@H]1CCc2ccccc21	ZINC000195181463	201355707	/nfs/dbraw/zinc/35/57/07/201355707.db2.gz	ZYESPLNCWRWDIQ-FUHWJXTLSA-N	0	3	307.434	2.146	10	0		DEAEHN
Cc1cnc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)o1	ZINC000195292724	201374864	/nfs/dbraw/zinc/37/48/64/201374864.db2.gz	BSONVYDYCLPMHP-INIZCTEOSA-N	0	3	300.406	2.332	10	0		DEAEHN
COc1ccc(-n2cc(CN3CC[C@@H](CO)[C@H]3C)cn2)cc1	ZINC000449290821	240316809	/nfs/dbraw/zinc/31/68/09/240316809.db2.gz	YYGOMCILQWNXEO-HIFRSBDPSA-N	0	3	301.390	2.084	10	0		DEAEHN
c1ccc2c(c1)CO[C@H](CNCc1cnc(N3CCCC3)nc1)C2	ZINC000623601908	365097169	/nfs/dbraw/zinc/09/71/69/365097169.db2.gz	VHKKUZDPEMIEFO-SFHVURJKSA-N	0	3	324.428	2.308	10	0		DEAEHN
CN1CCOC[C@@H]1CNCc1cc(F)cc(Br)c1	ZINC000623712741	365142168	/nfs/dbraw/zinc/14/21/68/365142168.db2.gz	KGUVLUQTOAQJLW-ZDUSSCGKSA-N	0	3	317.202	2.008	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)C[C@@H](O)c1cccc(F)c1	ZINC000091229928	193024726	/nfs/dbraw/zinc/02/47/26/193024726.db2.gz	PIGGSQJIIUJAQZ-HZPDHXFCSA-N	0	3	310.413	2.342	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000091480035	193061934	/nfs/dbraw/zinc/06/19/34/193061934.db2.gz	JBXZCGVLMJQBPQ-PWSUYJOCSA-N	0	3	302.296	2.187	10	0		DEAEHN
CC[C@H](C)[C@H](C)NC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000091847964	193117020	/nfs/dbraw/zinc/11/70/20/193117020.db2.gz	IEROIGMXAGYVKG-ULQDDVLXSA-N	0	3	324.513	2.233	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@H]2CC[C@@H](C)[NH2+]C2)sc1Cl	ZINC000624405064	365411679	/nfs/dbraw/zinc/41/16/79/365411679.db2.gz	BEPQPXDKEFLUEA-BDAKNGLRSA-N	0	3	308.856	2.129	10	0		DEAEHN
CC(=O)[C@](C)(O)CN[C@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000450661158	242077788	/nfs/dbraw/zinc/07/77/88/242077788.db2.gz	DEXSLPOAAOAXPV-PIGZYNQJSA-N	0	3	304.390	2.026	10	0		DEAEHN
Cc1nn(C)cc1CC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000450701075	242116736	/nfs/dbraw/zinc/11/67/36/242116736.db2.gz	VMHMITPLNZAFMF-RDTXWAMCSA-N	0	3	314.433	2.079	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccccc1C(N)=S)N1C[C@H](C)[C@H](C)C1	ZINC000092085499	193154558	/nfs/dbraw/zinc/15/45/58/193154558.db2.gz	HSKHOTXOTCLOSB-TUAOUCFPSA-N	0	3	305.447	2.236	10	0		DEAEHN
CC(C)NCc1ccccc1S(=O)(=O)N1C[C@@H](C)[C@H](C)C1	ZINC000092113965	193161260	/nfs/dbraw/zinc/16/12/60/193161260.db2.gz	XSURBBPRMILURB-ZIAGYGMSSA-N	0	3	310.463	2.461	10	0		DEAEHN
CCNCc1cccc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)c1C	ZINC000092113415	193161918	/nfs/dbraw/zinc/16/19/18/193161918.db2.gz	GGBLQNTWWYXRAL-BETUJISGSA-N	0	3	310.463	2.381	10	0		DEAEHN
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115595	193163527	/nfs/dbraw/zinc/16/35/27/193163527.db2.gz	HBEHSOBMYIWIRC-ZDUSSCGKSA-N	0	3	314.426	2.498	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N(CC(C)C)C2CC2)c(F)c1	ZINC000092115958	193164152	/nfs/dbraw/zinc/16/41/52/193164152.db2.gz	JFQBBBLQYAARBP-UHFFFAOYSA-N	0	3	314.426	2.354	10	0		DEAEHN
CCC1CCN(S(=O)(=O)c2ccc(CN)cc2F)CC1	ZINC000092115874	193164363	/nfs/dbraw/zinc/16/43/63/193164363.db2.gz	CKRJZGUNZXPNCM-UHFFFAOYSA-N	0	3	300.399	2.095	10	0		DEAEHN
c1cncc(-c2nc3c(c(N4CC(N5CCCC5)C4)n2)CCC3)c1	ZINC000631354182	368170509	/nfs/dbraw/zinc/17/05/09/368170509.db2.gz	YNYNGRAZTOOYEH-UHFFFAOYSA-N	0	3	321.428	2.312	10	0		DEAEHN
CCC[C@H](C(=O)NCCOCc1ccc(OC)cc1)N(C)C	ZINC000093003336	193192228	/nfs/dbraw/zinc/19/22/28/193192228.db2.gz	UIDZCUFUVIVUBV-MRXNPFEDSA-N	0	3	308.422	2.058	10	0		DEAEHN
COCCCN(CCOC)c1nc(C(C)C)c(CN)s1	ZINC000093000002	193192309	/nfs/dbraw/zinc/19/23/09/193192309.db2.gz	HNXJAXAEBBEYSL-UHFFFAOYSA-N	0	3	301.456	2.215	10	0		DEAEHN
C[C@H](N)C(=O)N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1	ZINC000262511019	203314917	/nfs/dbraw/zinc/31/49/17/203314917.db2.gz	BIQIBELNHRLDNI-NHYWBVRUSA-N	0	3	303.793	2.482	10	0		DEAEHN
Cc1c(CSC(C)C)cccc1NC(=O)[C@@H]1C[C@H](O)CN1	ZINC000262489056	203306357	/nfs/dbraw/zinc/30/63/57/203306357.db2.gz	ZBYSCLDQSSZKFP-ZFWWWQNUSA-N	0	3	308.447	2.298	10	0		DEAEHN
CN1CCC2(CC1)CC(=O)NC(=O)[C@H]2c1ccccc1Cl	ZINC000093183612	193212643	/nfs/dbraw/zinc/21/26/43/193212643.db2.gz	RREGWNBIBWLFHS-CQSZACIVSA-N	0	3	306.793	2.182	10	0		DEAEHN
CCC[C@](C)(N)C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO	ZINC000262587929	203340969	/nfs/dbraw/zinc/34/09/69/203340969.db2.gz	TXMBZXDZMRFVQL-YJBOKZPZSA-N	0	3	306.450	2.422	10	0		DEAEHN
CN[C@@H](Cc1cc(OC)ccc1Br)C(OC)OC	ZINC000093304915	193227365	/nfs/dbraw/zinc/22/73/65/193227365.db2.gz	LPSREHPFAUKKII-LBPRGKRZSA-N	0	3	318.211	2.207	10	0		DEAEHN
CS(=O)(=O)N1CCC[C@H](CNCc2ccccc2Cl)C1	ZINC000093696105	193291802	/nfs/dbraw/zinc/29/18/02/193291802.db2.gz	MZVWKWPCMXIKLW-GFCCVEGCSA-N	0	3	316.854	2.101	10	0		DEAEHN
Cc1nn([C@@H]2CCC[C@](NC3CC3)(C(N)=O)C2)c(C)c1Cl	ZINC000093759582	193300962	/nfs/dbraw/zinc/30/09/62/193300962.db2.gz	BLUVUUNMEDRXIG-IUODEOHRSA-N	0	3	310.829	2.245	10	0		DEAEHN
CCN[C@]1(C(N)=O)CC[C@@H](Sc2nc3ccccc3o2)C1	ZINC000093850871	193318857	/nfs/dbraw/zinc/31/88/57/193318857.db2.gz	ARWSKPXZFKUNCV-MEBBXXQBSA-N	0	3	305.403	2.306	10	0		DEAEHN
NC(=O)[C@@]1(N)CC[C@@H](Sc2cccc(Br)c2)C1	ZINC000093852769	193319112	/nfs/dbraw/zinc/31/91/12/193319112.db2.gz	KAHMPLRQHCQHFP-ZYHUDNBSSA-N	0	3	315.236	2.277	10	0		DEAEHN
COc1ccc(Cl)cc1C[C@@H](N)[C@@H]1CN(C(C)C)CCO1	ZINC000093925746	193328613	/nfs/dbraw/zinc/32/86/13/193328613.db2.gz	SUKROIKBYYFKFX-ZBFHGGJFSA-N	0	3	312.841	2.328	10	0		DEAEHN
CCN1CCO[C@H]([C@@H](Cc2nc(C(C)(C)C)cs2)NC)C1	ZINC000094257040	193355694	/nfs/dbraw/zinc/35/56/94/193355694.db2.gz	XEABZMDLNDCGJT-OLZOCXBDSA-N	0	3	311.495	2.292	10	0		DEAEHN
Cc1nn(C)c(C[C@@H](N)c2ccc(F)cn2)c1Br	ZINC000094046537	193341401	/nfs/dbraw/zinc/34/14/01/193341401.db2.gz	CYRPDNBTORJPMW-SECBINFHSA-N	0	3	313.174	2.268	10	0		DEAEHN
Cc1nn(C)c(C[C@H](N)c2ccc(F)cn2)c1Br	ZINC000094046536	193342009	/nfs/dbraw/zinc/34/20/09/193342009.db2.gz	CYRPDNBTORJPMW-VIFPVBQESA-N	0	3	313.174	2.268	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@@H](Oc2c(F)cc(CN)cc2F)C1	ZINC000094634588	193386012	/nfs/dbraw/zinc/38/60/12/193386012.db2.gz	DKCOEOZJIRZVCR-GHMZBOCLSA-N	0	3	319.373	2.158	10	0		DEAEHN
CCCN[C@H](c1ccncn1)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094642340	193389032	/nfs/dbraw/zinc/38/90/32/193389032.db2.gz	QGCHQQVUPQHGNB-IPYPFGDCSA-N	0	3	311.451	2.121	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)ccc2N)C1	ZINC000094596190	193382657	/nfs/dbraw/zinc/38/26/57/193382657.db2.gz	NJSLWFYVSDBLEF-SNVBAGLBSA-N	0	3	301.312	2.064	10	0		DEAEHN
Cc1c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)[nH]c2c1C(=O)CCC2	ZINC000265023399	204350510	/nfs/dbraw/zinc/35/05/10/204350510.db2.gz	YPSHLOVXMAENAE-AAEUAGOBSA-N	0	3	315.417	2.151	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)Nc2ccc(N(C)C)nc2)CCN1C	ZINC000266361450	205293409	/nfs/dbraw/zinc/29/34/09/205293409.db2.gz	JGLWMKHUFHBHGT-JSGCOSHPSA-N	0	3	305.426	2.094	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H](C)c1ccc(NC(N)=O)cc1)N(C)C	ZINC000161578695	197505324	/nfs/dbraw/zinc/50/53/24/197505324.db2.gz	QXSYAXXEMZWLBK-BXUZGUMPSA-N	0	3	306.410	2.085	10	0		DEAEHN
COC(C)(C)CNCC(=O)Nc1ccccc1Br	ZINC000160234838	197394779	/nfs/dbraw/zinc/39/47/79/197394779.db2.gz	AQCIYHUCPBCLDR-UHFFFAOYSA-N	0	3	315.211	2.402	10	0		DEAEHN
O=C1C[C@H](NC2Cc3ccccc3C2)C(=O)N1c1cccc(F)c1	ZINC000021344546	182272629	/nfs/dbraw/zinc/27/26/29/182272629.db2.gz	RZVVATUEACZJMI-KRWDZBQOSA-N	0	3	324.355	2.215	10	0		DEAEHN
CCOC(=O)CCN(C)C[C@H](C(=O)OCC)c1ccccc1	ZINC000039286583	183016383	/nfs/dbraw/zinc/01/63/83/183016383.db2.gz	ZWQJIPBVYNPNIG-HNNXBMFYSA-N	0	3	307.390	2.218	10	0		DEAEHN
CCC[C@H](N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2	ZINC000040856028	183142788	/nfs/dbraw/zinc/14/27/88/183142788.db2.gz	RLWZLJQAHBYMIR-JTQLQIEISA-N	0	3	310.419	2.479	10	0		DEAEHN
CCCNC(=O)COc1c(Br)cccc1CNC	ZINC000042411561	183265368	/nfs/dbraw/zinc/26/53/68/183265368.db2.gz	KQQBBBKLYTXOEQ-UHFFFAOYSA-N	0	3	315.211	2.074	10	0		DEAEHN
C[C@@H](N)c1cccc(S(=O)(=O)N(CC(F)(F)F)C2CC2)c1	ZINC000042782206	183308600	/nfs/dbraw/zinc/30/86/00/183308600.db2.gz	JMDFKGVUFGCXKZ-SECBINFHSA-N	0	3	322.352	2.422	10	0		DEAEHN
CN[C@H](c1ccc(Br)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000043300260	183352624	/nfs/dbraw/zinc/35/26/24/183352624.db2.gz	VQZGDMUGKLTQRL-CMPLNLGQSA-N	0	3	318.236	2.144	10	0		DEAEHN
NC(=S)c1cc2c(nc1NCCN1CCCCC1)CCC2	ZINC000043408921	183360237	/nfs/dbraw/zinc/36/02/37/183360237.db2.gz	ZTXFFONUFGPQPF-UHFFFAOYSA-N	0	3	304.463	2.102	10	0		DEAEHN
CNCc1c(N2CCO[C@H]3CCCC[C@@H]32)nc2sccn12	ZINC000043426696	183361939	/nfs/dbraw/zinc/36/19/39/183361939.db2.gz	FHFRXNBQJFJITL-AAEUAGOBSA-N	0	3	306.435	2.263	10	0		DEAEHN
Cc1ccc(N2CCCN(CCOc3ccccc3)CC2)nn1	ZINC000105800710	194132556	/nfs/dbraw/zinc/13/25/56/194132556.db2.gz	TUYSZMACBIZEPW-UHFFFAOYSA-N	0	3	312.417	2.376	10	0		DEAEHN
CN(c1cccnn1)C1CCN(CCC(=O)OC(C)(C)C)CC1	ZINC000105910252	194167031	/nfs/dbraw/zinc/16/70/31/194167031.db2.gz	OKEDRFHITZDHGF-UHFFFAOYSA-N	0	3	320.437	2.109	10	0		DEAEHN
Cc1oc(-c2cccs2)nc1CN1CCO[C@@H](CN(C)C)C1	ZINC000105925639	194170322	/nfs/dbraw/zinc/17/03/22/194170322.db2.gz	XOASGHWQRCCIFK-ZDUSSCGKSA-N	0	3	321.446	2.474	10	0		DEAEHN
CC1CCC2(CSC(NC3CCS(=O)(=O)CC3)=N2)CC1	ZINC000053100111	183886998	/nfs/dbraw/zinc/88/69/98/183886998.db2.gz	NAIIUBNWAAZDDE-UHFFFAOYSA-N	0	3	316.492	2.205	10	0		DEAEHN
Cc1ccc(C(N)=S)c(N2CC[C@H](N3CCCCC3)C2)n1	ZINC000110278656	194319113	/nfs/dbraw/zinc/31/91/13/194319113.db2.gz	GMLJXFSYJJVTBC-ZDUSSCGKSA-N	0	3	304.463	2.089	10	0		DEAEHN
Cc1ccsc1[C@@H]1C[C@H]1C(=O)NCCNc1ccncc1	ZINC000534530111	284848905	/nfs/dbraw/zinc/84/89/05/284848905.db2.gz	MQBOXZYXJPUMBL-ZIAGYGMSSA-N	0	3	301.415	2.205	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccccc1Cl)N1CCNC(=O)[C@@H]1CC	ZINC000110677645	194349047	/nfs/dbraw/zinc/34/90/47/194349047.db2.gz	HFTMJNBZIUYJDO-ILXRZTDVSA-N	0	3	309.841	2.329	10	0		DEAEHN
CN([C@H]1CCCNC1)S(=O)(=O)c1ccc(C(F)(F)F)cc1	ZINC000110928290	194370660	/nfs/dbraw/zinc/37/06/60/194370660.db2.gz	CQYLBLMHSGUUCD-NSHDSACASA-N	0	3	322.352	2.078	10	0		DEAEHN
CCCN[C@](C)(CCN(CC)CCOCC)C(=O)OCC	ZINC000111121701	194391877	/nfs/dbraw/zinc/39/18/77/194391877.db2.gz	ZSJHMDVWDLQXGI-MRXNPFEDSA-N	0	3	302.459	2.056	10	0		DEAEHN
O=S(=O)(CCC1CC[NH2+]CC1)[N-]c1cc(F)c(F)c(F)c1	ZINC000061120358	184162453	/nfs/dbraw/zinc/16/24/53/184162453.db2.gz	QQBHUQTUVNNDQQ-UHFFFAOYSA-N	0	3	322.352	2.235	10	0		DEAEHN
CC[C@H](Oc1ccc(Br)cc1[C@@H](C)N)C(N)=O	ZINC000061676068	184181958	/nfs/dbraw/zinc/18/19/58/184181958.db2.gz	QQELFQFMCWRCSC-XCBNKYQSSA-N	0	3	301.184	2.112	10	0		DEAEHN
COc1cc(Cl)c([C@H](N)C[C@H](C)CC(N)=O)cc1OC	ZINC000061830333	184188717	/nfs/dbraw/zinc/18/87/17/184188717.db2.gz	JHZKEFQVHJHABF-GZMMTYOYSA-N	0	3	300.786	2.259	10	0		DEAEHN
CN[C@H](C)c1cccc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)c1	ZINC000158211576	197253316	/nfs/dbraw/zinc/25/33/16/197253316.db2.gz	YVJPRQBKMJJHQF-BPLDGKMQSA-N	0	3	308.447	2.388	10	0		DEAEHN
C[C@@H](c1ccccc1Cl)N(C)CC(=O)N1CCCNCC1	ZINC000062014437	184200891	/nfs/dbraw/zinc/20/08/91/184200891.db2.gz	SVHQTFQOQUEXDE-ZDUSSCGKSA-N	0	3	309.841	2.155	10	0		DEAEHN
C[C@@H](C(=O)N(C)[C@@H](C)c1ccc(Cl)cc1)N1CCNCC1	ZINC000062010858	184201157	/nfs/dbraw/zinc/20/11/57/184201157.db2.gz	GIIVCESMCULOGZ-STQMWFEESA-N	0	3	309.841	2.153	10	0		DEAEHN
NC[C@@H](c1ccc(Br)cc1)N1CCn2ccnc2C1	ZINC000062246186	184225269	/nfs/dbraw/zinc/22/52/69/184225269.db2.gz	SSRVZYUCKXUIMC-ZDUSSCGKSA-N	0	3	321.222	2.161	10	0		DEAEHN
CCN[C@@H](c1cc(F)c(F)c(F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000062706583	184248659	/nfs/dbraw/zinc/24/86/59/184248659.db2.gz	JKSPIBOJCFZYAP-AMIZOPFISA-N	0	3	307.337	2.189	10	0		DEAEHN
COCCNCc1cc(Cl)ccc1O[C@H](C)C(=O)OC	ZINC000062731113	184251094	/nfs/dbraw/zinc/25/10/94/184251094.db2.gz	JOANPGITRPWTHX-SNVBAGLBSA-N	0	3	301.770	2.016	10	0		DEAEHN
N[C@H](CNC(=O)c1ccc(Br)cn1)c1ccccc1	ZINC000062837664	184255621	/nfs/dbraw/zinc/25/56/21/184255621.db2.gz	XMKDGVXSMFBKLB-GFCCVEGCSA-N	0	3	320.190	2.274	10	0		DEAEHN
Clc1nc(Cl)nc(N2CC[C@H](N3CCCCC3)C2)n1	ZINC000062983402	184264441	/nfs/dbraw/zinc/26/44/41/184264441.db2.gz	MZEFYMUIZMNHID-VIFPVBQESA-N	0	3	302.209	2.243	10	0		DEAEHN
CN[C@@H](C)c1cccc(S(=O)(=O)NCCC(F)(F)F)c1	ZINC000063101543	184270705	/nfs/dbraw/zinc/27/07/05/184270705.db2.gz	NXZGBNNHGOLDBG-VIFPVBQESA-N	0	3	310.341	2.198	10	0		DEAEHN
CNc1ccc(Cl)c(C(=O)N(C)CC2CCN(C)CC2)n1	ZINC000063125809	184271629	/nfs/dbraw/zinc/27/16/29/184271629.db2.gz	MMGKIAGKXVGYGU-UHFFFAOYSA-N	0	3	310.829	2.191	10	0		DEAEHN
CN1CCC(C(=O)NC2(c3noc(C4CC4)n3)CCCC2)CC1	ZINC000175704921	207362836	/nfs/dbraw/zinc/36/28/36/207362836.db2.gz	ZKFUFTCEIRSEOD-UHFFFAOYSA-N	0	3	318.421	2.174	10	0		DEAEHN
CN(C)CCCN(C)C(=O)CSCC(=O)c1ccccc1	ZINC000538314913	285031476	/nfs/dbraw/zinc/03/14/76/285031476.db2.gz	ADTJZAAZCBUYIZ-UHFFFAOYSA-N	0	3	308.447	2.013	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)CCCc1nc(C2CC2)no1	ZINC000119827639	195044144	/nfs/dbraw/zinc/04/41/44/195044144.db2.gz	PQVULHNKQQRERT-AWEZNQCLSA-N	0	3	322.453	2.362	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1cc(OC)c(Cl)cc1OC	ZINC000159095478	197326293	/nfs/dbraw/zinc/32/62/93/197326293.db2.gz	JOZCBSAHIBBLNE-SNVBAGLBSA-N	0	3	316.785	2.050	10	0		DEAEHN
CN(c1ccccc1)C1CCN([C@H]2CCCCNC2=O)CC1	ZINC000120255942	195129248	/nfs/dbraw/zinc/12/92/48/195129248.db2.gz	RNDWHXNJQPBDQJ-KRWDZBQOSA-N	0	3	301.434	2.256	10	0		DEAEHN
CC(C)(C)[C@@H](N)C(=O)N[C@@H]1CCC[C@H](OCC(F)(F)F)C1	ZINC000158237835	197256194	/nfs/dbraw/zinc/25/61/94/197256194.db2.gz	XGBRDLBRKKFTNB-VWYCJHECSA-N	0	3	310.360	2.366	10	0		DEAEHN
CN(C)C(=O)c1ccc(Cl)cc1NC(=O)[C@H](N)C(C)(C)C	ZINC000158236071	197255587	/nfs/dbraw/zinc/25/55/87/197255587.db2.gz	DZXPCMLSTGZUQA-LBPRGKRZSA-N	0	3	311.813	2.354	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC[C@@H](CCC(=O)OCC)C1)N(C)C	ZINC000120304887	195138451	/nfs/dbraw/zinc/13/84/51/195138451.db2.gz	OCVBSJPWQUKXHL-GJZGRUSLSA-N	0	3	312.454	2.299	10	0		DEAEHN
C[C@](F)(Cc1ccc(Br)cn1)C[C@@H]1COCCN1	ZINC000157601679	197200782	/nfs/dbraw/zinc/20/07/82/197200782.db2.gz	JNTLVLWCHUDFRX-OLZOCXBDSA-N	0	3	317.202	2.493	10	0		DEAEHN
CCOCCN(C)[C@@H](CN)c1cc(Cl)c2c(c1)OCCO2	ZINC000157118119	197162734	/nfs/dbraw/zinc/16/27/34/197162734.db2.gz	STQRKULFCOEKGP-ZDUSSCGKSA-N	0	3	314.813	2.079	10	0		DEAEHN
CCOCCN(C)[C@H](CN)c1cc(Cl)c2c(c1)OCCO2	ZINC000157118280	197162838	/nfs/dbraw/zinc/16/28/38/197162838.db2.gz	STQRKULFCOEKGP-CYBMUJFWSA-N	0	3	314.813	2.079	10	0		DEAEHN
Cc1ccc2ncc(CN[C@@H]3CCCN(c4cccnn4)C3)n2c1	ZINC000156583431	197125771	/nfs/dbraw/zinc/12/57/71/197125771.db2.gz	SVSPIVSWDYJWDY-OAHLLOKOSA-N	0	3	322.416	2.191	10	0		DEAEHN
O=C1C[C@@H](NC[C@@H]2CCCCS2)C(=O)N1C1CCCCC1	ZINC000156411930	197110784	/nfs/dbraw/zinc/11/07/84/197110784.db2.gz	QYGHIWDWUMLNBT-UONOGXRCSA-N	0	3	310.463	2.322	10	0		DEAEHN
Cc1cccc([S@@](=O)CC(=O)Nc2ccccc2CN)c1	ZINC000156022579	197080588	/nfs/dbraw/zinc/08/05/88/197080588.db2.gz	GQTHPEMBNDXYSM-OAQYLSRUSA-N	0	3	302.399	2.200	10	0		DEAEHN
CC1(C)CNCCN1C(=O)c1cccc(F)c1Br	ZINC000156001658	197078959	/nfs/dbraw/zinc/07/89/59/197078959.db2.gz	SHFYRGOGHQMGGZ-UHFFFAOYSA-N	0	3	315.186	2.412	10	0		DEAEHN
CC(C)[C@H](O)CNCc1cc(Br)cc2c1OCC2	ZINC000155950315	197076396	/nfs/dbraw/zinc/07/63/96/197076396.db2.gz	GIAWTFZNJCNMII-CYBMUJFWSA-N	0	3	314.223	2.491	10	0		DEAEHN
COc1cc(C)c(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1OC	ZINC000155630028	197073320	/nfs/dbraw/zinc/07/33/20/197073320.db2.gz	VGYGNBJJQPAJKG-DZGCQCFKSA-N	0	3	320.433	2.471	10	0		DEAEHN
O=c1cc(N2CC[C@@H]3[C@H](CCCN3C3CC3)C2)nc2ccccn12	ZINC000161935244	285219339	/nfs/dbraw/zinc/21/93/39/285219339.db2.gz	VANDJNBHSXHEMF-GDBMZVCRSA-N	0	3	324.428	2.148	10	0		DEAEHN
COc1cc(OC)cc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000155411875	197052485	/nfs/dbraw/zinc/05/24/85/197052485.db2.gz	IUQKDVDEGPODLR-LRDDRELGSA-N	0	3	306.406	2.162	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)N([C@H](C)C1CC1)C1CC1	ZINC000245475093	285239053	/nfs/dbraw/zinc/23/90/53/285239053.db2.gz	ROODHZIUXKTSGE-RHSMWYFYSA-N	0	3	307.482	2.192	10	0		DEAEHN
Cc1nccc([C@@H]2C[C@@H]3CN(C4CCOCC4)CC[C@H]3O2)n1	ZINC000247972567	257112617	/nfs/dbraw/zinc/11/26/17/257112617.db2.gz	TWSSLUHKZCPTOO-XYPHTWIQSA-N	0	3	303.406	2.116	10	0		DEAEHN
Cc1cccc(CN2C[C@@H]3CCN(c4cnccn4)C[C@@H]3C2)n1	ZINC000247868596	257116098	/nfs/dbraw/zinc/11/60/98/257116098.db2.gz	JVDSWLVXZCEQAM-HOTGVXAUSA-N	0	3	309.417	2.138	10	0		DEAEHN
C1CC1c1nnc([C@H]2C[C@H]3CCN(C4CCOCC4)C[C@@H]3O2)o1	ZINC000253596495	257105004	/nfs/dbraw/zinc/10/50/04/257105004.db2.gz	RWURHEYDIIMMSX-YUELXQCFSA-N	0	3	319.405	2.278	10	0		DEAEHN
Cc1ccnc(OC[C@]23CCO[C@H]2CCN(C2CCC2)C3)n1	ZINC000253476729	257105491	/nfs/dbraw/zinc/10/54/91/257105491.db2.gz	BCFXBKUBUSDVGG-DOTOQJQBSA-N	0	3	303.406	2.197	10	0		DEAEHN
CN(Cc1ccccc1)CC(C)(C)NC[C@H](O)C(F)(F)F	ZINC000121814804	195353367	/nfs/dbraw/zinc/35/33/67/195353367.db2.gz	FFTUXMNUICFVKD-ZDUSSCGKSA-N	0	3	304.356	2.410	10	0		DEAEHN
FC(F)(F)CN1CC[C@H](NCc2ccc(-c3cc[nH]n3)o2)C1	ZINC000562416276	291983384	/nfs/dbraw/zinc/98/33/84/291983384.db2.gz	DIMVDLFEBKGAPI-JTQLQIEISA-N	0	3	314.311	2.396	10	0		DEAEHN
CCN(C(C)=O)c1nc(CN[C@@H]2CCCN(CC)C2)cs1	ZINC000040502728	132478592	/nfs/dbraw/zinc/47/85/92/132478592.db2.gz	RNMTTXXWHSHEMV-CYBMUJFWSA-N	0	3	310.467	2.090	10	0		DEAEHN
CC[C@@]1(C2CN(C(=O)OC(C)(C)C)C2)NCCc2ncn(C)c21	ZINC000725242595	542769920	/nfs/dbraw/zinc/76/99/20/542769920.db2.gz	JXHIJKXYFLRJGF-KRWDZBQOSA-N	0	3	320.437	2.038	10	0		DEAEHN
C[C@H]1CCOCCN1C[C@H](O)COCc1ccccc1Cl	ZINC000362232003	133218339	/nfs/dbraw/zinc/21/83/39/133218339.db2.gz	ANUOXYPMOYFCGU-ZFWWWQNUSA-N	0	3	313.825	2.328	10	0		DEAEHN
CC(C)C[C@@H](NC(=O)CC1CCN(C)CC1)C(=O)OC(C)C	ZINC000362852984	133255429	/nfs/dbraw/zinc/25/54/29/133255429.db2.gz	RPNJMKILWTXJDF-OAHLLOKOSA-N	0	3	312.454	2.201	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)C2(C)COC2)[C@@H]1c1cccs1	ZINC000372932052	133370809	/nfs/dbraw/zinc/37/08/09/133370809.db2.gz	VVFQZPZGTMWRFL-GXTWGEPZSA-N	0	3	308.447	2.284	10	0		DEAEHN
COC[C@](C)(O)CN[C@@H]1CCCc2ncc(C(F)(F)F)cc21	ZINC000547659429	285614975	/nfs/dbraw/zinc/61/49/75/285614975.db2.gz	HQRYSWIIWMXCQY-ZIAGYGMSSA-N	0	3	318.339	2.465	10	0		DEAEHN
Cc1cc(N2CCN3CCOC[C@@H]3C2)c2cc(F)ccc2n1	ZINC000371800851	404474013	/nfs/dbraw/zinc/47/40/13/404474013.db2.gz	DAOHJZZTINZDQY-AWEZNQCLSA-N	0	3	301.365	2.203	10	0		DEAEHN
COC(=O)CN1CCC(N[C@@H]2CCOc3c(C)cccc32)CC1	ZINC000188010723	145005863	/nfs/dbraw/zinc/00/58/63/145005863.db2.gz	OHBPTNDAMWRPGA-MRXNPFEDSA-N	0	3	318.417	2.046	10	0		DEAEHN
CC(C)C[C@@H](CO)N(C)C(=O)NC[C@@H](C)N1CCC(C)CC1	ZINC000188534921	145013331	/nfs/dbraw/zinc/01/33/31/145013331.db2.gz	GUBXVEZLMHASEW-CVEARBPZSA-N	0	3	313.486	2.155	10	0		DEAEHN
O=C(Cc1cc(F)ccc1F)NCc1ccc2c(c1)CNC2	ZINC000188700551	145016203	/nfs/dbraw/zinc/01/62/03/145016203.db2.gz	ZTJISSGXQGIBNI-UHFFFAOYSA-N	0	3	302.324	2.427	10	0		DEAEHN
Cc1noc2ncc(C(=O)NCc3ccc4c(c3)CNC4)cc12	ZINC000188717533	145016381	/nfs/dbraw/zinc/01/63/81/145016381.db2.gz	VQGDFTAFOZYFLL-UHFFFAOYSA-N	0	3	308.341	2.064	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1CCCN1C[C@H](O)CC(F)(F)F	ZINC000189215944	145023723	/nfs/dbraw/zinc/02/37/23/145023723.db2.gz	PYQVMNQZIJGJNQ-VXGBXAGGSA-N	0	3	305.344	2.487	10	0		DEAEHN
Cc1nn(C)cc1NC(=O)N1CCCN(C2CCCC2)CC1	ZINC000189639959	145031494	/nfs/dbraw/zinc/03/14/94/145031494.db2.gz	XTYZRTXOCVQHLF-UHFFFAOYSA-N	0	3	305.426	2.211	10	0		DEAEHN
COC[C@H](C)n1ccc(NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)n1	ZINC000189901867	145035936	/nfs/dbraw/zinc/03/59/36/145035936.db2.gz	IFEAAPPEOSTRRG-IHRRRGAJSA-N	0	3	323.441	2.037	10	0		DEAEHN
CCOC1CC(CCNC(=O)NCCN2CCCC[C@H]2C)C1	ZINC000190047018	145037355	/nfs/dbraw/zinc/03/73/55/145037355.db2.gz	FZMUHCIHOYAVRJ-QQFBHYJXSA-N	0	3	311.470	2.365	10	0		DEAEHN
C[C@@H]1CN(CCN2CCC(Oc3ccc(F)cc3)CC2)CCO1	ZINC000191496571	145059591	/nfs/dbraw/zinc/05/95/91/145059591.db2.gz	IBUACMZEOVIPOL-OAHLLOKOSA-N	0	3	322.424	2.390	10	0		DEAEHN
Cc1nc(C[C@H]2CCCN(C[C@@H]3CC4(CCC4)C(=O)O3)C2)no1	ZINC000191991442	145069007	/nfs/dbraw/zinc/06/90/07/145069007.db2.gz	ZNZSCOQCMJXUDK-KGLIPLIRSA-N	0	3	319.405	2.118	10	0		DEAEHN
O=C1O[C@H](CN2CCCN(c3ccccn3)CC2)CC12CCC2	ZINC000192187842	145071405	/nfs/dbraw/zinc/07/14/05/145071405.db2.gz	LWPWJXVNBPGDFU-HNNXBMFYSA-N	0	3	315.417	2.080	10	0		DEAEHN
CCc1nc2n(n1)C[C@H](NCc1cccc(OC)c1F)CC2	ZINC000192680747	145077286	/nfs/dbraw/zinc/07/72/86/145077286.db2.gz	HZUXLHZUUPUPOZ-GFCCVEGCSA-N	0	3	304.369	2.093	10	0		DEAEHN
CCN(C(=O)[C@@H](C)N1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000246304999	145097960	/nfs/dbraw/zinc/09/79/60/145097960.db2.gz	JJSPPBIOLGVUSG-WBVHZDCISA-N	0	3	301.434	2.208	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1Cc1nc(-c2cccs2)no1	ZINC000246817904	145115516	/nfs/dbraw/zinc/11/55/16/145115516.db2.gz	CIJAMAFPAMEPRC-RYUDHWBXSA-N	0	3	304.419	2.467	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cnn(C(C)(C)C)c1	ZINC000246846781	145116459	/nfs/dbraw/zinc/11/64/59/145116459.db2.gz	CASOFIADTFVKAN-CABCVRRESA-N	0	3	304.438	2.337	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@H](C)C(=O)N1CCCCCC1	ZINC000246848297	145116596	/nfs/dbraw/zinc/11/65/96/145116596.db2.gz	CAPPZVAAAJRPTF-WBVHZDCISA-N	0	3	318.465	2.447	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)NC[C@@](C)(O)CCC(C)C	ZINC000246926189	145119700	/nfs/dbraw/zinc/11/97/00/145119700.db2.gz	DMZPSZGQIMHLKT-WBVHZDCISA-N	0	3	313.486	2.347	10	0		DEAEHN
CC(C)N(C(=O)[C@H](C)N1CCC[C@@H](Cn2cncn2)C1)C(C)C	ZINC000247091010	145126477	/nfs/dbraw/zinc/12/64/77/145126477.db2.gz	HOYLVLUKJFJZBJ-JKSUJKDBSA-N	0	3	321.469	2.024	10	0		DEAEHN
CCCCNC(=O)[C@@H](C)N1CCC[C@@H](n2ccnc2CC)C1	ZINC000247141900	145127834	/nfs/dbraw/zinc/12/78/34/145127834.db2.gz	LCJLKVIEKQWQAT-HUUCEWRRSA-N	0	3	306.454	2.387	10	0		DEAEHN
Cc1nn(C)c2sc(C(=O)N(C)[C@H]3CCN(C)[C@@H](C)C3)cc12	ZINC000247259624	145130778	/nfs/dbraw/zinc/13/07/78/145130778.db2.gz	DYIRFKMRBLOPJQ-JQWIXIFHSA-N	0	3	320.462	2.498	10	0		DEAEHN
CCOCCN1CCN(C[C@@H](O)Cc2ccccc2)C[C@@H]1CC	ZINC000247251253	145130960	/nfs/dbraw/zinc/13/09/60/145130960.db2.gz	UABCTPMNXYBCIV-OALUTQOASA-N	0	3	320.477	2.023	10	0		DEAEHN
CCc1noc2ncc(C(=O)N3C[C@@H]4CCCN4C[C@H]3C)cc12	ZINC000247253207	145130986	/nfs/dbraw/zinc/13/09/86/145130986.db2.gz	NQUWQBCEFONPHT-YPMHNXCESA-N	0	3	314.389	2.094	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000247471582	145138505	/nfs/dbraw/zinc/13/85/05/145138505.db2.gz	VHNGWBXSNPEKPH-KBAYOESNSA-N	0	3	317.477	2.004	10	0		DEAEHN
Cc1ccc(C)c(OCC(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000247508138	145139952	/nfs/dbraw/zinc/13/99/52/145139952.db2.gz	VOLPSUIDEIXMCM-CVEARBPZSA-N	0	3	302.418	2.377	10	0		DEAEHN
CC[C@H]1CN(CCCOCc2ccccc2)CCN1C[C@H](C)O	ZINC000248603965	145161176	/nfs/dbraw/zinc/16/11/76/145161176.db2.gz	VUZVYSALAWFXKY-HKUYNNGSSA-N	0	3	320.477	2.370	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@@H](CC)c2nccn2C)C12CCOCC2	ZINC000248644361	145162797	/nfs/dbraw/zinc/16/27/97/145162797.db2.gz	PTQSWXLIUHLESN-SOUVJXGZSA-N	0	3	307.438	2.435	10	0		DEAEHN
C[C@H](CS(=O)(=O)c1ccccc1)N[C@@H]1CCO[C@@H](C2CC2)C1	ZINC000248878320	145171552	/nfs/dbraw/zinc/17/15/52/145171552.db2.gz	RJEJXBARFFIVNA-FRFSOERESA-N	0	3	323.458	2.396	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCO[C@@H](c3ccccc3)C2)C1	ZINC000249772037	145189941	/nfs/dbraw/zinc/18/99/41/145189941.db2.gz	SXDRHRNSAINFNJ-DLBZAZTESA-N	0	3	317.433	2.254	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC[C@H]2c2cccn2C)C1	ZINC000249772095	145190099	/nfs/dbraw/zinc/19/00/99/145190099.db2.gz	SYXDYXDBBBWGAP-HOCLYGCPSA-N	0	3	304.438	2.356	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CC[C@@]3(O)CCCC[C@H]3C2)C1	ZINC000252696016	145199622	/nfs/dbraw/zinc/19/96/22/145199622.db2.gz	LQQFMKYKLGLPNK-CVYDXHPNSA-N	0	3	323.481	2.052	10	0		DEAEHN
C[C@H](NC(=O)[C@H]1NCCCC1(C)C)c1ccc2c(c1)OCCO2	ZINC000261626225	145211544	/nfs/dbraw/zinc/21/15/44/145211544.db2.gz	CQRWYPVFYXIYFV-BLLLJJGKSA-N	0	3	318.417	2.413	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)N1CCc2ccccc2C1	ZINC000261649079	145213873	/nfs/dbraw/zinc/21/38/73/145213873.db2.gz	FOKYJRXTZMWYGT-MDZRGWNJSA-N	0	3	314.429	2.104	10	0		DEAEHN
N[C@@H](C(=O)N1CC[C@H](c2ccc(Cl)cc2)C1)C1CCOCC1	ZINC000261794975	145227598	/nfs/dbraw/zinc/22/75/98/145227598.db2.gz	NUFVTUVMGZLURI-GOEBONIOSA-N	0	3	322.836	2.410	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)NCCc1cccc(F)c1	ZINC000261876655	145237122	/nfs/dbraw/zinc/23/71/22/145237122.db2.gz	LYFSNGYGWRJNLR-RKVPGOIHSA-N	0	3	320.408	2.017	10	0		DEAEHN
CCc1ccc(NC(=O)CN2CCNC[C@H]2c2cccnc2)cc1	ZINC000261890634	145237720	/nfs/dbraw/zinc/23/77/20/145237720.db2.gz	ZPFSOUXQRXIXGM-SFHVURJKSA-N	0	3	324.428	2.229	10	0		DEAEHN
Cc1ccccc1C1CCN(C(=O)[C@@H](N)C2CCOCC2)CC1	ZINC000261903172	145239162	/nfs/dbraw/zinc/23/91/62/145239162.db2.gz	WUAWVGAQGKDSQV-SFHVURJKSA-N	0	3	316.445	2.455	10	0		DEAEHN
N[C@H](C(=O)Nc1cc(C2CCCCC2)[nH]n1)C1CCOCC1	ZINC000261916760	145241468	/nfs/dbraw/zinc/24/14/68/145241468.db2.gz	YEBHJEDUOPRFBH-HNNXBMFYSA-N	0	3	306.410	2.150	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)NCc1ccc(F)cc1F	ZINC000261976927	145248977	/nfs/dbraw/zinc/24/89/77/145248977.db2.gz	ZSPXYLMLVOILGJ-MRRJBJDNSA-N	0	3	324.371	2.114	10	0		DEAEHN
CN(CCc1cccs1)C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000262575844	145294334	/nfs/dbraw/zinc/29/43/34/145294334.db2.gz	YDDCRIQRWJSAOU-JKIFEVAISA-N	0	3	322.474	2.282	10	0		DEAEHN
CCOCCOCC(=O)Nc1cc(CN)cc(C(F)(F)F)c1	ZINC000262926639	145311873	/nfs/dbraw/zinc/31/18/73/145311873.db2.gz	FRFUGRMPWMYCPP-UHFFFAOYSA-N	0	3	320.311	2.156	10	0		DEAEHN
CC[C@@H](C)Oc1ccc(-c2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263185048	145333589	/nfs/dbraw/zinc/33/35/89/145333589.db2.gz	HGDQXUBQUOYBPJ-IUODEOHRSA-N	0	3	316.405	2.490	10	0		DEAEHN
Cc1nc(C(C)(C)C)sc1-c1nc([C@@H]2CNCCN2C)no1	ZINC000263204750	145336103	/nfs/dbraw/zinc/33/61/03/145336103.db2.gz	JOHBSEFPSLPNJA-JTQLQIEISA-N	0	3	321.450	2.375	10	0		DEAEHN
C[C@H](C(=O)NC1CCC(C)CC1)N1CCC[C@@H](c2nc[nH]n2)C1	ZINC000332962603	145393089	/nfs/dbraw/zinc/39/30/89/145393089.db2.gz	ICPVGODTCRQYIM-PIOWNMBXSA-N	0	3	319.453	2.068	10	0		DEAEHN
C[C@H](NCCC1(F)CCC1)c1cccc(S(N)(=O)=O)c1	ZINC000348407917	146267270	/nfs/dbraw/zinc/26/72/70/146267270.db2.gz	NLBUZWMXBFGUHO-NSHDSACASA-N	0	3	300.399	2.267	10	0		DEAEHN
C[C@H](CN(C)C)NC(=O)N1C[C@@H](C)O[C@H](c2ccccc2)C1	ZINC000358509025	147147848	/nfs/dbraw/zinc/14/78/48/147147848.db2.gz	VTIMQGNROVCPKK-FMKPAKJESA-N	0	3	305.422	2.108	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N(C)Cc1nc2ccccc2n1C	ZINC000358709501	147187037	/nfs/dbraw/zinc/18/70/37/147187037.db2.gz	AEAJZOOQNFFBQA-INIZCTEOSA-N	0	3	314.433	2.406	10	0		DEAEHN
C[C@H](C(=O)NCc1ccc2cc[nH]c2n1)N1[C@H](C)CC[C@@H]1C	ZINC000359422351	147325189	/nfs/dbraw/zinc/32/51/89/147325189.db2.gz	MRKLHTLHBXQNHT-FRRDWIJNSA-N	0	3	300.406	2.440	10	0		DEAEHN
CC(C)(C)c1n[nH]cc1CNC[C@@H]1CCC2(CCOCC2)[C@@H]1O	ZINC000374707778	148280685	/nfs/dbraw/zinc/28/06/85/148280685.db2.gz	RHPWQBGQGIVZTD-XJKSGUPXSA-N	0	3	321.465	2.365	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCCC(C)(C)CC1	ZINC000074167420	401731585	/nfs/dbraw/zinc/73/15/85/401731585.db2.gz	NINDQUFTYKWRKA-OAHLLOKOSA-N	0	3	311.470	2.319	10	0		DEAEHN
C[C@@H]1C[C@H]1NC(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000112217104	401733557	/nfs/dbraw/zinc/73/35/57/401733557.db2.gz	CCZGEOXNFGLLIF-ZIAGYGMSSA-N	0	3	311.495	2.446	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)[C@@H]1CCCN1c1nccs1	ZINC000110628053	401692613	/nfs/dbraw/zinc/69/26/13/401692613.db2.gz	MNVCSJNRHRHMOA-KBPBESRZSA-N	0	3	322.478	2.103	10	0		DEAEHN
COCCN1CCC[C@H]1CN[C@H](c1ncc[nH]1)c1ccccc1	ZINC000126673504	401704088	/nfs/dbraw/zinc/70/40/88/401704088.db2.gz	JBROTAPHLLFFGL-IRXDYDNUSA-N	0	3	314.433	2.200	10	0		DEAEHN
c1cc(CN2CCCC[C@H]2CN2CCOCC2)cc2c1OCC2	ZINC000111301810	401710237	/nfs/dbraw/zinc/71/02/37/401710237.db2.gz	CXDCMPBQWZFHJB-SFHVURJKSA-N	0	3	316.445	2.308	10	0		DEAEHN
CN(C(=O)CN[C@@H]1CCCC[C@H]1n1cccn1)c1nccs1	ZINC000127963741	401757633	/nfs/dbraw/zinc/75/76/33/401757633.db2.gz	SHINZWWXXKGVLU-CHWSQXEVSA-N	0	3	319.434	2.076	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1coc(Br)c1	ZINC000113226181	401770870	/nfs/dbraw/zinc/77/08/70/401770870.db2.gz	MTVMKWNLLXGJLW-GXSJLCMTSA-N	0	3	313.195	2.351	10	0		DEAEHN
CC(C)N(CC(=O)N1CCc2ccccc21)C1CCOCC1	ZINC000077322879	401810230	/nfs/dbraw/zinc/81/02/30/401810230.db2.gz	MPDIOVYMRXGLLO-UHFFFAOYSA-N	0	3	302.418	2.465	10	0		DEAEHN
C[C@@H]1C[C@@H]1NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000075977732	401775179	/nfs/dbraw/zinc/77/51/79/401775179.db2.gz	JCZGTTGCONOIKO-PBHICJAKSA-N	0	3	301.434	2.401	10	0		DEAEHN
CC(C)OC(=O)CCN1CCC[C@H]1CNC(=O)OC(C)(C)C	ZINC000076007441	401777154	/nfs/dbraw/zinc/77/71/54/401777154.db2.gz	WPHZOWGXGCWWSE-ZDUSSCGKSA-N	0	3	314.426	2.317	10	0		DEAEHN
COc1cccc(CN2CC[C@H](c3cnn(C)c3)C2)c1OC	ZINC000128459859	401777759	/nfs/dbraw/zinc/77/77/59/401777759.db2.gz	GYJVRYFUXQVFHS-ZDUSSCGKSA-N	0	3	301.390	2.427	10	0		DEAEHN
Cn1cc([C@H]2CCN(Cc3cn(C)nc3-c3ccncc3)C2)cn1	ZINC000128521897	401780805	/nfs/dbraw/zinc/78/08/05/401780805.db2.gz	RREVWFPRSUTWRY-HNNXBMFYSA-N	0	3	322.416	2.205	10	0		DEAEHN
CC(=O)Nc1ccc(CN2CCC[C@H](Cn3cncn3)C2)cc1	ZINC000128522199	401780817	/nfs/dbraw/zinc/78/08/17/401780817.db2.gz	HIGWOBONMBZPGE-INIZCTEOSA-N	0	3	313.405	2.149	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H]1CCO[C@H](C2CC2)C1	ZINC000129917100	401811964	/nfs/dbraw/zinc/81/19/64/401811964.db2.gz	ZAZVWRUZQGSRGM-OAGGEKHMSA-N	0	3	309.454	2.070	10	0		DEAEHN
CC(C)C[C@@H](N)C(=O)N1CCN(c2ccccc2Cl)CC1	ZINC000020425753	401823724	/nfs/dbraw/zinc/82/37/24/401823724.db2.gz	SSQVUSIBZNPNFL-CQSZACIVSA-N	0	3	309.841	2.362	10	0		DEAEHN
Cc1ccc(CN(C[C@@H](O)CN2CCCC2=O)C2CC2)cc1C	ZINC000077657325	401824148	/nfs/dbraw/zinc/82/41/48/401824148.db2.gz	ZVCRSOGSMOVENH-SFHVURJKSA-N	0	3	316.445	2.251	10	0		DEAEHN
CCN(C)C(=O)CCN1CCC[C@H]1c1ccc2c(c1)OCO2	ZINC000130323153	401827140	/nfs/dbraw/zinc/82/71/40/401827140.db2.gz	XPTQBWUKHJKSMW-AWEZNQCLSA-N	0	3	304.390	2.421	10	0		DEAEHN
C[C@H](NC(=O)NCc1cccc(CN(C)C)c1)[C@@H]1CCCO1	ZINC000077839666	401834986	/nfs/dbraw/zinc/83/49/86/401834986.db2.gz	MQBKEYKDIBUSNP-BBRMVZONSA-N	0	3	305.422	2.115	10	0		DEAEHN
COCCCN(C)CCNc1cc(C)nc(-c2ccncc2)n1	ZINC000078372876	401848667	/nfs/dbraw/zinc/84/86/67/401848667.db2.gz	IVMCLUULVZKPJV-UHFFFAOYSA-N	0	3	315.421	2.227	10	0		DEAEHN
Cc1cc(C)n2c(CN[C@H](CO)Cc3ccccc3)cnc2n1	ZINC000131496333	401851615	/nfs/dbraw/zinc/85/16/15/401851615.db2.gz	QMECRICEFMZXGM-INIZCTEOSA-N	0	3	310.401	2.039	10	0		DEAEHN
C[C@H](CC(=O)N1CCO[C@H](CN(C)C)C1)c1ccccc1F	ZINC000116787500	401858987	/nfs/dbraw/zinc/85/89/87/401858987.db2.gz	FIVDOWPCXMHNQD-ZIAGYGMSSA-N	0	3	308.397	2.108	10	0		DEAEHN
C[C@@H](SCc1ccccc1)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000116793518	401859150	/nfs/dbraw/zinc/85/91/50/401859150.db2.gz	OCWMVFVJVPQTNG-ZBFHGGJFSA-N	0	3	322.474	2.097	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)C2(c3cccc(Cl)c3)CC2)CCO1	ZINC000116791670	401859469	/nfs/dbraw/zinc/85/94/69/401859469.db2.gz	JTKGZYYYLFOQBH-OAHLLOKOSA-N	0	3	322.836	2.161	10	0		DEAEHN
C/C(=C/C(=O)N1CCO[C@@H](CN(C)C)C1)c1cccc(F)c1	ZINC000116797070	401859989	/nfs/dbraw/zinc/85/99/89/401859989.db2.gz	CUEYGTAANHYLHC-OVHOFWQVSA-N	0	3	306.381	2.018	10	0		DEAEHN
Cc1ccc(CC(=O)N[C@H](Cc2ccccc2)CN(C)C)cn1	ZINC000132244577	401864518	/nfs/dbraw/zinc/86/45/18/401864518.db2.gz	JVODIUNHMJKODF-GOSISDBHSA-N	0	3	311.429	2.222	10	0		DEAEHN
C[C@H]1CC[C@H](C(=O)NCCCN2CCc3ccccc3C2)O1	ZINC000129961059	401813113	/nfs/dbraw/zinc/81/31/13/401813113.db2.gz	UKAYDBXVLHJPDW-WMLDXEAASA-N	0	3	302.418	2.119	10	0		DEAEHN
COC(=O)c1ccc(N2CCN[C@H](Cc3ccccc3)C2)cc1	ZINC000039952502	401924626	/nfs/dbraw/zinc/92/46/26/401924626.db2.gz	JWZSREPHUVKGND-QGZVFWFLSA-N	0	3	310.397	2.494	10	0		DEAEHN
CC(C)OC(=O)c1ccc(CN2C[C@H](C(N)=O)CC[C@H]2C)cc1	ZINC000135041002	401925122	/nfs/dbraw/zinc/92/51/22/401925122.db2.gz	QAVLMHYCGDEWTL-CZUORRHYSA-N	0	3	318.417	2.338	10	0		DEAEHN
CCc1ccc(CNC[C@H]2CCCN2c2cc(NC)ncn2)o1	ZINC000133038472	401878307	/nfs/dbraw/zinc/87/83/07/401878307.db2.gz	JKQBDXUWSTVBQY-CYBMUJFWSA-N	0	3	315.421	2.432	10	0		DEAEHN
C[C@H]1CCC[C@H](CN2CCN(c3ccc4nncn4n3)CC2)C1	ZINC000133384199	401884515	/nfs/dbraw/zinc/88/45/15/401884515.db2.gz	FKCYVEBJYXLNHB-GJZGRUSLSA-N	0	3	314.437	2.073	10	0		DEAEHN
Cc1cnn(CCNC(=O)c2cccc(CN3CCCC3)c2)c1	ZINC000117808666	401885527	/nfs/dbraw/zinc/88/55/27/401885527.db2.gz	TXIXVCAYBYQZET-UHFFFAOYSA-N	0	3	312.417	2.217	10	0		DEAEHN
CNCC(=O)Nc1cc(Br)ccc1Br	ZINC000037047074	401910152	/nfs/dbraw/zinc/91/01/52/401910152.db2.gz	VRJSBZYRTGSMBR-UHFFFAOYSA-N	0	3	322.000	2.370	10	0		DEAEHN
CN(C)c1nc(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)ns1	ZINC000134895573	401918706	/nfs/dbraw/zinc/91/87/06/401918706.db2.gz	MJZPZFFDZCIDJJ-OCCSQVGLSA-N	0	3	321.494	2.053	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc2oc(C(=O)OC)cc2c1	ZINC000085902938	401919883	/nfs/dbraw/zinc/91/98/83/401919883.db2.gz	PZIDMAFZHGCQHM-KRWDZBQOSA-N	0	3	321.373	2.097	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)Nc1ccc(F)nc1	ZINC000135020676	401924298	/nfs/dbraw/zinc/92/42/98/401924298.db2.gz	MWBQCVORKRRPEP-UHFFFAOYSA-N	0	3	303.337	2.413	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1c(OC)cc(OC)cc1OC)N(C)C	ZINC000136686671	401971886	/nfs/dbraw/zinc/97/18/86/401971886.db2.gz	AMYVTIXXZGURTC-AWEZNQCLSA-N	0	3	324.421	2.059	10	0		DEAEHN
COc1ccc([C@H](C)NC(=O)NC2CCN(C)CC2)cc1F	ZINC000047885612	401990427	/nfs/dbraw/zinc/99/04/27/401990427.db2.gz	CHHCIYLANZKZKK-NSHDSACASA-N	0	3	309.385	2.289	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000150776099	401995159	/nfs/dbraw/zinc/99/51/59/401995159.db2.gz	ZJZSSEQDAHHQPL-GJZGRUSLSA-N	0	3	317.433	2.087	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H](C)N1CCc2sccc2C1)N(C)C	ZINC000135635585	401949044	/nfs/dbraw/zinc/94/90/44/401949044.db2.gz	RQFIIIDGELAAAR-HIFRSBDPSA-N	0	3	323.506	2.341	10	0		DEAEHN
CC[C@H](CO)N1CCN(Cc2cccn2CCC(C)C)CC1	ZINC000093740492	402019096	/nfs/dbraw/zinc/01/90/96/402019096.db2.gz	JJDGLERURPWGEK-QGZVFWFLSA-N	0	3	307.482	2.423	10	0		DEAEHN
Cc1ccn(-c2ccccc2CNC(=O)C2CCN(C)CC2)n1	ZINC000121374989	402032344	/nfs/dbraw/zinc/03/23/44/402032344.db2.gz	OZOQWXGNBZOKIQ-UHFFFAOYSA-N	0	3	312.417	2.139	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2ccccc2OC)C1	ZINC000052500235	402043050	/nfs/dbraw/zinc/04/30/50/402043050.db2.gz	DJPIXLSDNGNJHR-HNNXBMFYSA-N	0	3	305.422	2.021	10	0		DEAEHN
CC(C)c1cc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc(=O)[nH]1	ZINC000121548259	402043115	/nfs/dbraw/zinc/04/31/15/402043115.db2.gz	KAOVIWPIRUHZKA-OCCSQVGLSA-N	0	3	305.422	2.465	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H](C)Oc1ccc(OC)cc1)N(C)C	ZINC000121667154	402048450	/nfs/dbraw/zinc/04/84/50/402048450.db2.gz	KYRYSWCOWFSUGR-XJKSGUPXSA-N	0	3	308.422	2.309	10	0		DEAEHN
CCCn1cc(CN2CCCN(Cc3cccn3C)CC2)cn1	ZINC000121685338	402048961	/nfs/dbraw/zinc/04/89/61/402048961.db2.gz	VWRNIICYEIUSEC-UHFFFAOYSA-N	0	3	315.465	2.340	10	0		DEAEHN
COC(=O)[C@H](C)CN(C)C[C@H](O)COc1ccccc1C(C)C	ZINC000120749863	402000908	/nfs/dbraw/zinc/00/09/08/402000908.db2.gz	DWKFBRUARHGLHU-CABCVRRESA-N	0	3	323.433	2.291	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc(OC)cc2OC)CCN1CCOC	ZINC000120908194	402006449	/nfs/dbraw/zinc/00/64/49/402006449.db2.gz	DDXGMWGFBNCNLR-MRXNPFEDSA-N	0	3	322.449	2.246	10	0		DEAEHN
C[C@H](C(=O)NCCN(C)Cc1ccccc1)C1CCOCC1	ZINC000122267439	402069541	/nfs/dbraw/zinc/06/95/41/402069541.db2.gz	HGPPKOCCYZJLSG-HNNXBMFYSA-N	0	3	304.434	2.297	10	0		DEAEHN
CN(C)CCN(C)C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000122577096	402084940	/nfs/dbraw/zinc/08/49/40/402084940.db2.gz	YBCLEXQQEQUFME-CYBMUJFWSA-N	0	3	317.355	2.363	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cccc3c2OCCO3)CCN1C	ZINC000122732228	402091962	/nfs/dbraw/zinc/09/19/62/402091962.db2.gz	YPQWGYQVBPWVND-QWHCGFSZSA-N	0	3	304.390	2.013	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H](C)N(C)c2ccccc2)C1	ZINC000057821716	402096863	/nfs/dbraw/zinc/09/68/63/402096863.db2.gz	IDERMVVXMQGHCL-CVEARBPZSA-N	0	3	318.465	2.295	10	0		DEAEHN
O[C@H](COCc1ccccc1)CN1CCC(c2cc[nH]n2)CC1	ZINC000058246126	402099344	/nfs/dbraw/zinc/09/93/44/402099344.db2.gz	ALUXVTALQABCFR-KRWDZBQOSA-N	0	3	315.417	2.167	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cccnc2N2CCCC2)CCN1C	ZINC000123025474	402106612	/nfs/dbraw/zinc/10/66/12/402106612.db2.gz	GLQZYJWXLHHSDR-GJZGRUSLSA-N	0	3	316.449	2.237	10	0		DEAEHN
C[C@@H](CN[C@@H]1CCCOc2ccc(F)cc21)N1CCOCC1	ZINC000123286110	402119511	/nfs/dbraw/zinc/11/95/11/402119511.db2.gz	AGQHKVOQGLPAHM-XJKSGUPXSA-N	0	3	308.397	2.350	10	0		DEAEHN
CCC[C@H](C(=O)N1CCN(c2nc(C)c(C)s2)CC1)N(C)C	ZINC000122122666	402062339	/nfs/dbraw/zinc/06/23/39/402062339.db2.gz	WDLYGLGFENSCCE-CQSZACIVSA-N	0	3	324.494	2.139	10	0		DEAEHN
CC(=O)c1cc(C(=O)NCCN(C)C2CCCCC2)n(C)c1	ZINC000122136105	402063091	/nfs/dbraw/zinc/06/30/91/402063091.db2.gz	UGNICCDSVHASNW-UHFFFAOYSA-N	0	3	305.422	2.222	10	0		DEAEHN
COC(=O)c1ccccc1NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000153406051	402143487	/nfs/dbraw/zinc/14/34/87/402143487.db2.gz	XFAWPCIPQBIJHW-OLZOCXBDSA-N	0	3	319.405	2.420	10	0		DEAEHN
Cc1cncc(CNC(=O)c2ccccc2OCCN(C)C)c1	ZINC000123784657	402145414	/nfs/dbraw/zinc/14/54/14/402145414.db2.gz	UKOYTBMJXROWEL-UHFFFAOYSA-N	0	3	313.401	2.260	10	0		DEAEHN
CC(=O)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000103467096	402189977	/nfs/dbraw/zinc/18/99/77/402189977.db2.gz	PIUWYOMWCLMZSW-UHFFFAOYSA-N	0	3	307.369	2.391	10	0		DEAEHN
CCn1cc(C2CCN(C(=O)[C@@H]3CCCCN3CC)CC2)cn1	ZINC000124044942	402161079	/nfs/dbraw/zinc/16/10/79/402161079.db2.gz	BCMYZXOAFJUKDJ-KRWDZBQOSA-N	0	3	318.465	2.483	10	0		DEAEHN
CCOC(CN1CCC[C@H](c2nncn2C2CC2)C1)OCC	ZINC000125118338	402213738	/nfs/dbraw/zinc/21/37/38/402213738.db2.gz	AVVNBANIQTZOGE-ZDUSSCGKSA-N	0	3	308.426	2.192	10	0		DEAEHN
CC[C@H](C(=O)N[C@H](C)c1cccc(-n2ccnc2)c1)N(C)C	ZINC000125367097	402227976	/nfs/dbraw/zinc/22/79/76/402227976.db2.gz	VOQDMVIAMOGQHU-CZUORRHYSA-N	0	3	300.406	2.390	10	0		DEAEHN
CCN1CCN([C@@H]2CCN(CCOc3ccccc3C)C2)CC1	ZINC000107370750	402231880	/nfs/dbraw/zinc/23/18/80/402231880.db2.gz	DOQFXLVGIYDVHM-GOSISDBHSA-N	0	3	317.477	2.086	10	0		DEAEHN
CC(=O)Nc1cccc([C@H](C)NC[C@@]2(CCO)CCOC2)c1	ZINC000125436319	402232451	/nfs/dbraw/zinc/23/24/51/402232451.db2.gz	NIBLYOZBSHBBOK-SUMWQHHRSA-N	0	3	306.406	2.085	10	0		DEAEHN
CC(C)N(C)CC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000154833335	402234921	/nfs/dbraw/zinc/23/49/21/402234921.db2.gz	KZJPVVITJJUPFA-LJQANCHMSA-N	0	3	317.477	2.498	10	0		DEAEHN
CN(C)C[C@@H]1CN(CCOc2cccc3ccccc32)CCO1	ZINC000155268848	402250836	/nfs/dbraw/zinc/25/08/36/402250836.db2.gz	CVICZFBGBDLKIY-QGZVFWFLSA-N	0	3	314.429	2.481	10	0		DEAEHN
CCOc1ccc(CNC(=O)NC[C@@H]2CCCN(C)C2)cc1F	ZINC000108575835	402257992	/nfs/dbraw/zinc/25/79/92/402257992.db2.gz	YVPWKACQVPRWCJ-AWEZNQCLSA-N	0	3	323.412	2.365	10	0		DEAEHN
Cc1ccc(OCCN(C)C(=O)NC[C@H]2CCCN(C)C2)cc1	ZINC000108588198	402258156	/nfs/dbraw/zinc/25/81/56/402258156.db2.gz	MQWJWXCFDVUPJR-MRXNPFEDSA-N	0	3	319.449	2.357	10	0		DEAEHN
CCN1CC[C@@H](N(C)C(=O)[C@H]2C[C@@H](C(C)=O)C2(C)C)[C@H](C)C1	ZINC000154335780	402206565	/nfs/dbraw/zinc/20/65/65/402206565.db2.gz	RWLQURBLOQPZOE-SLBVQIDZSA-N	0	3	308.466	2.426	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(Br)cc2F)C1	ZINC000071139973	402270397	/nfs/dbraw/zinc/27/03/97/402270397.db2.gz	ANOKMQKHGSDIFL-SNVBAGLBSA-N	0	3	315.186	2.364	10	0		DEAEHN
Fc1cccc(OCCN2CCCC[C@@H]2CN2CCOCC2)c1	ZINC000109821745	402276700	/nfs/dbraw/zinc/27/67/00/402276700.db2.gz	AUIGVGXZGBPZDM-QGZVFWFLSA-N	0	3	322.424	2.391	10	0		DEAEHN
COC[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000176104848	402279034	/nfs/dbraw/zinc/27/90/34/402279034.db2.gz	APTHQVOFGMOXPT-ZOBUZTSGSA-N	0	3	304.434	2.438	10	0		DEAEHN
CCc1cc(C(=O)NC[C@H](C)N2CCN(CC)CC2)oc1CC	ZINC000158118186	402301947	/nfs/dbraw/zinc/30/19/47/402301947.db2.gz	DJEBMNPSNYVRTN-AWEZNQCLSA-N	0	3	321.465	2.160	10	0		DEAEHN
CCC[NH+]1CCC(CNC(=O)NCc2ccc([O-])c(F)c2)CC1	ZINC000158295310	402303707	/nfs/dbraw/zinc/30/37/07/402303707.db2.gz	YCTIGZVKFWQPJA-UHFFFAOYSA-N	0	3	323.412	2.453	10	0		DEAEHN
CN(Cc1ccccc1)CC(C)(C)NCc1nc(N(C)C)no1	ZINC000185278112	402340190	/nfs/dbraw/zinc/34/01/90/402340190.db2.gz	JYUBYPHQDXMQOL-UHFFFAOYSA-N	0	3	317.437	2.136	10	0		DEAEHN
CCc1cccc(NC(=O)C(=O)N(C)C[C@@H]2CCCN2CC)c1	ZINC000176898174	402347483	/nfs/dbraw/zinc/34/74/83/402347483.db2.gz	WTKCWGACFKJGKN-INIZCTEOSA-N	0	3	317.433	2.130	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1cc(C)cc(C)c1	ZINC000176900676	402348287	/nfs/dbraw/zinc/34/82/87/402348287.db2.gz	ILPHAHKBIYNNPK-MRXNPFEDSA-N	0	3	317.433	2.185	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1ccc(C)cc1F	ZINC000176903396	402348790	/nfs/dbraw/zinc/34/87/90/402348790.db2.gz	DQCBXQOAMAXEHR-ZDUSSCGKSA-N	0	3	321.396	2.015	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)c1ccc(Cl)cc1	ZINC000176992524	402357723	/nfs/dbraw/zinc/35/77/23/402357723.db2.gz	CVEMSSSLQCJHLS-AWEZNQCLSA-N	0	3	308.809	2.465	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc(OC)c(OC)c1	ZINC000177005323	402358818	/nfs/dbraw/zinc/35/88/18/402358818.db2.gz	RPJFNNJFYGICAJ-AWEZNQCLSA-N	0	3	306.406	2.260	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cnc(C)nc1C(C)C	ZINC000177014773	402359416	/nfs/dbraw/zinc/35/94/16/402359416.db2.gz	LBILGXSXYDXUEI-AWEZNQCLSA-N	0	3	304.438	2.465	10	0		DEAEHN
OC[C@H]1C[C@@H](O)CN1CCCOc1ccc2ccccc2c1	ZINC000185153204	402328778	/nfs/dbraw/zinc/32/87/78/402328778.db2.gz	YJASQHUZIQYRKI-IAGOWNOFSA-N	0	3	301.386	2.036	10	0		DEAEHN
CC(C)O[C@@H]1C[C@@H](NCc2cccnc2-n2cncn2)C1(C)C	ZINC000185198593	402333347	/nfs/dbraw/zinc/33/33/47/402333347.db2.gz	CKMWMUDBVBYYHM-HUUCEWRRSA-N	0	3	315.421	2.344	10	0		DEAEHN
CCC[C@H](C(=O)NCc1nc2cc(C)ccc2n1C)N(C)C	ZINC000186159685	402406428	/nfs/dbraw/zinc/40/64/28/402406428.db2.gz	WPVVULWNLJNVNC-OAHLLOKOSA-N	0	3	302.422	2.228	10	0		DEAEHN
C[C@@H]1CN(C2CCN(Cc3cc(O)cc(F)c3)CC2)CCO1	ZINC000186191948	402409108	/nfs/dbraw/zinc/40/91/08/402409108.db2.gz	DLBMVYTUMREQTF-CYBMUJFWSA-N	0	3	308.397	2.216	10	0		DEAEHN
C[C@H](NC(=O)[C@H](CN)c1ccccc1)c1ccc2c(c1)OCO2	ZINC000237500522	402410108	/nfs/dbraw/zinc/41/01/08/402410108.db2.gz	AZWYPFBWMQNGAP-SWLSCSKDSA-N	0	3	312.369	2.335	10	0		DEAEHN
C[C@@H]1CN(C(=O)C2(N)CCCC2)C[C@H](c2ccc(F)cc2)O1	ZINC000237552631	402412725	/nfs/dbraw/zinc/41/27/25/402412725.db2.gz	LMZPAWHWNQNEIL-IUODEOHRSA-N	0	3	306.381	2.386	10	0		DEAEHN
COCCOc1cccc(CN2CCC(C(=O)N(C)C)CC2)c1	ZINC000162588776	402425565	/nfs/dbraw/zinc/42/55/65/402425565.db2.gz	ZSMKNSIXDZOKDL-UHFFFAOYSA-N	0	3	320.433	2.012	10	0		DEAEHN
CC[C@H](NC(=O)N1CC[C@@H](N2CCCC2)C1)c1nccs1	ZINC000162645569	402427234	/nfs/dbraw/zinc/42/72/34/402427234.db2.gz	HAUIKQZQJRHSJO-OLZOCXBDSA-N	0	3	308.451	2.474	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)NCc1sccc1C	ZINC000177697621	402427710	/nfs/dbraw/zinc/42/77/10/402427710.db2.gz	WPAZVENXRNAUDH-AWEZNQCLSA-N	0	3	309.479	2.089	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)Nc1ccccc1C(C)=O	ZINC000177709654	402429135	/nfs/dbraw/zinc/42/91/35/402429135.db2.gz	OXARKRQFNGAALE-OAHLLOKOSA-N	0	3	317.433	2.244	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N2CCC[C@@H]2Cn2ccnc2)cc1	ZINC000177750190	402432355	/nfs/dbraw/zinc/43/23/55/402432355.db2.gz	BOOZFIGZQADASR-QGZVFWFLSA-N	0	3	312.417	2.250	10	0		DEAEHN
O=C(CCN1CCN2CCCC[C@@H]2C1)NCC1CCCCC1	ZINC000177769382	402434483	/nfs/dbraw/zinc/43/44/83/402434483.db2.gz	KCFFMCIFRMKEPJ-QGZVFWFLSA-N	0	3	307.482	2.243	10	0		DEAEHN
C[C@H](OCc1ccccc1)C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000185949378	402391916	/nfs/dbraw/zinc/39/19/16/402391916.db2.gz	XRMVYFMNERKIHI-HLLBOEOZSA-N	0	3	302.418	2.287	10	0		DEAEHN
CCNCc1ccccc1NC(=O)CS(=O)(=O)C1CCCC1	ZINC000237050332	402392765	/nfs/dbraw/zinc/39/27/65/402392765.db2.gz	QYVYNHIRSIGCAJ-UHFFFAOYSA-N	0	3	324.446	2.092	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@H](O)c1ccccc1Cl	ZINC000161636878	402394083	/nfs/dbraw/zinc/39/40/83/402394083.db2.gz	AEUBZVWRCLFRQG-IUODEOHRSA-N	0	3	312.841	2.466	10	0		DEAEHN
COC[C@H](NCc1cnn(-c2ccccc2)c1)C1CCOCC1	ZINC000187740017	402510265	/nfs/dbraw/zinc/51/02/65/402510265.db2.gz	SWMYKCBKGDNLRZ-SFHVURJKSA-N	0	3	315.417	2.404	10	0		DEAEHN
Cc1c(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cnn1CC(C)C	ZINC000163528679	402452483	/nfs/dbraw/zinc/45/24/83/402452483.db2.gz	CTQGWRYOOPHXTI-UKRRQHHQSA-N	0	3	306.454	2.402	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)NCc1ccc(C)cc1	ZINC000245460233	402462481	/nfs/dbraw/zinc/46/24/81/402462481.db2.gz	FCGXWJSAYHAJIS-SJLPKXTDSA-N	0	3	317.477	2.416	10	0		DEAEHN
COC(=O)c1nc(N2CC[C@@H]3[C@H](CCCN3C)C2)sc1C	ZINC000164694437	402467866	/nfs/dbraw/zinc/46/78/66/402467866.db2.gz	IXCKRQZORVIEHW-VXGBXAGGSA-N	0	3	309.435	2.159	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)NO[C@@H]1CCCCO1	ZINC000165008738	402471867	/nfs/dbraw/zinc/47/18/67/402471867.db2.gz	ZVTVORXMOIQJOI-GOEBONIOSA-N	0	3	321.421	2.264	10	0		DEAEHN
COc1ccccc1/C=C/CN1CCN(C[C@H](C)O)[C@H](C)C1	ZINC000245726421	402483365	/nfs/dbraw/zinc/48/33/65/402483365.db2.gz	IWKYTLZZFQYVAE-DODUIYEKSA-N	0	3	304.434	2.095	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@@H](C)C(=O)N1CCCCCC1	ZINC000178315072	402483839	/nfs/dbraw/zinc/48/38/39/402483839.db2.gz	CAPPZVAAAJRPTF-RDJZCZTQSA-N	0	3	318.465	2.447	10	0		DEAEHN
CCCOc1cccc(CC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000178314525	402484056	/nfs/dbraw/zinc/48/40/56/402484056.db2.gz	BGRRSRVINWYJBH-INIZCTEOSA-N	0	3	302.418	2.325	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CC(=O)N1[C@H](C)CCC[C@@H]1C	ZINC000178326948	402485176	/nfs/dbraw/zinc/48/51/76/402485176.db2.gz	DPLLVNGNUNEISV-HLLBOEOZSA-N	0	3	318.465	2.445	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)CN1CCC[C@@H]1Cn1ccnc1C	ZINC000178333089	402485771	/nfs/dbraw/zinc/48/57/71/402485771.db2.gz	LBAKERFAEJAZOF-IAGOWNOFSA-N	0	3	318.465	2.447	10	0		DEAEHN
C[C@@H](N[C@H]1CCCN(c2cnn(C)c2)C1)c1cncc(F)c1	ZINC000166603765	402485847	/nfs/dbraw/zinc/48/58/47/402485847.db2.gz	AWDGWYHIDIYZFH-DOMZBBRYSA-N	0	3	303.385	2.274	10	0		DEAEHN
Cc1n[nH]c(C)c1[C@H](C)CC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000245764812	402486627	/nfs/dbraw/zinc/48/66/27/402486627.db2.gz	JDSGQZQWFSPEFM-XUJVJEKNSA-N	0	3	306.454	2.461	10	0		DEAEHN
COc1cccc(COC[C@H](O)CN2CCS[C@@H](C)C2)c1	ZINC000245837180	402490862	/nfs/dbraw/zinc/49/08/62/402490862.db2.gz	WOBOKYQPNFVHDU-DZGCQCFKSA-N	0	3	311.447	2.010	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCCCc2ccccn2)CCN1C	ZINC000178417617	402496613	/nfs/dbraw/zinc/49/66/13/402496613.db2.gz	VGIBJRXYOPJDQU-GDBMZVCRSA-N	0	3	304.438	2.138	10	0		DEAEHN
COc1ccc(C(F)(F)C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1	ZINC000245930439	402498550	/nfs/dbraw/zinc/49/85/50/402498550.db2.gz	QKJMRCPBVZVWIB-OCCSQVGLSA-N	0	3	324.371	2.482	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N1CC[C@H](N2CCCC2)C1	ZINC000187476356	402502266	/nfs/dbraw/zinc/50/22/66/402502266.db2.gz	CCKVIUMLLUCFPN-KBPBESRZSA-N	0	3	318.421	2.031	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)NCCOc2ccccc2)C1	ZINC000246063086	402506821	/nfs/dbraw/zinc/50/68/21/402506821.db2.gz	ZGSTZRZCRUQIEN-RDJZCZTQSA-N	0	3	317.433	2.191	10	0		DEAEHN
Cc1ccccc1CS(=O)(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000246079190	402507616	/nfs/dbraw/zinc/50/76/16/402507616.db2.gz	FSTRGRURAJIGMD-HOCLYGCPSA-N	0	3	310.463	2.239	10	0		DEAEHN
Cc1cc(C)cc(OCCCN2CCN(CCO)[C@H](C)C2)c1	ZINC000187709086	402509489	/nfs/dbraw/zinc/50/94/89/402509489.db2.gz	UTBWTPQFEXRLSV-QGZVFWFLSA-N	0	3	306.450	2.071	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)N(C)CCN(C)C3CC3)cc2c1	ZINC000189664066	402551106	/nfs/dbraw/zinc/55/11/06/402551106.db2.gz	NEUOHIFVPXDAOA-UHFFFAOYSA-N	0	3	301.390	2.343	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000247197591	402560007	/nfs/dbraw/zinc/56/00/07/402560007.db2.gz	LNWJQFNZJUEBIU-AAEUAGOBSA-N	0	3	314.838	2.197	10	0		DEAEHN
COc1c(CNCC[C@](C)(O)c2ccccc2)c(C)nn1C	ZINC000189834776	402561558	/nfs/dbraw/zinc/56/15/58/402561558.db2.gz	NPWHMLWXVHRMJJ-KRWDZBQOSA-N	0	3	303.406	2.125	10	0		DEAEHN
O=C(NCCN1CCCCC1)Nc1ccc(-c2ncon2)cc1	ZINC000171182802	402564681	/nfs/dbraw/zinc/56/46/81/402564681.db2.gz	LPBYVVPOPRSOLZ-UHFFFAOYSA-N	0	3	315.377	2.344	10	0		DEAEHN
Cc1cc(C)cc(OCCNC(=O)NC[C@@H]2CCCN2C)c1	ZINC000171192617	402565102	/nfs/dbraw/zinc/56/51/02/402565102.db2.gz	LWWVNXMSUWJPAL-HNNXBMFYSA-N	0	3	305.422	2.076	10	0		DEAEHN
COCCN(C)CCNC(=O)N[C@@H](C)c1cccc(Cl)c1	ZINC000171190783	402565307	/nfs/dbraw/zinc/56/53/07/402565307.db2.gz	FMILXWHQFJZILL-LBPRGKRZSA-N	0	3	313.829	2.278	10	0		DEAEHN
CN1CCC[C@@H]1CNC(=O)NCCCCOCc1ccccc1	ZINC000171190393	402565455	/nfs/dbraw/zinc/56/54/55/402565455.db2.gz	WIGVJHVPSIORSH-QGZVFWFLSA-N	0	3	319.449	2.377	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)C2C[C@H]3CCC[C@@H](C2)C3=O)C1	ZINC000247442916	402567229	/nfs/dbraw/zinc/56/72/29/402567229.db2.gz	SDGAVEPLJIQAMU-SRXPKIRMSA-N	0	3	306.450	2.227	10	0		DEAEHN
COc1cc(C)cc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1O	ZINC000247503507	402569486	/nfs/dbraw/zinc/56/94/86/402569486.db2.gz	VGHOAKQKZHPINU-OLZOCXBDSA-N	0	3	304.390	2.018	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccn(-c2ccccc2)n1	ZINC000247516047	402570879	/nfs/dbraw/zinc/57/08/79/402570879.db2.gz	WGTOFCVPUZOBEK-HOCLYGCPSA-N	0	3	310.401	2.181	10	0		DEAEHN
Cc1ccc(C)c(OC[C@H](O)CN(C)CC2(CO)CC2)c1C	ZINC000190026307	402571417	/nfs/dbraw/zinc/57/14/17/402571417.db2.gz	WSFRCQCFQZLQIK-MRXNPFEDSA-N	0	3	307.434	2.056	10	0		DEAEHN
O=C(c1cn2ccnc2s1)N1CCC[C@@H]1CN1CCCC1	ZINC000188448036	402520021	/nfs/dbraw/zinc/52/00/21/402520021.db2.gz	SCWRGCXNWKOBAJ-GFCCVEGCSA-N	0	3	304.419	2.096	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)C1CCN(C[C@@H](O)CC(F)(F)F)CC1	ZINC000188964240	402529261	/nfs/dbraw/zinc/52/92/61/402529261.db2.gz	FVLBGTDRBHWQJR-YPMHNXCESA-N	0	3	324.387	2.172	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCS[C@H](C)[C@H]1C	ZINC000246448349	402531531	/nfs/dbraw/zinc/53/15/31/402531531.db2.gz	VFZVPXQOTQNPGA-MGPQQGTHSA-N	0	3	301.500	2.498	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)N(C)[C@H]3CCCN(C)C3)cc2c1	ZINC000189325795	402533851	/nfs/dbraw/zinc/53/38/51/402533851.db2.gz	IQXADASUJSNMAK-ZDUSSCGKSA-N	0	3	301.390	2.343	10	0		DEAEHN
COc1ccc(S[C@H](C)C(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170865039	402535165	/nfs/dbraw/zinc/53/51/65/402535165.db2.gz	AVSHZTLZAIYBOT-CHWSQXEVSA-N	0	3	308.447	2.338	10	0		DEAEHN
CN(C)C[C@H](NC(=O)N[C@@H]1CCC[C@@H]1CCO)c1ccccc1	ZINC000190071727	402574321	/nfs/dbraw/zinc/57/43/21/402574321.db2.gz	AMLOAFZLZYTBKI-ZACQAIPSSA-N	0	3	319.449	2.140	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCc1cc(-c2ccccc2)on1	ZINC000171335414	402578813	/nfs/dbraw/zinc/57/88/13/402578813.db2.gz	FKDKHHQMTGPRLN-HNNXBMFYSA-N	0	3	314.389	2.235	10	0		DEAEHN
CC[C@H](C)[C@H](O)CNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248136240	402583781	/nfs/dbraw/zinc/58/37/81/402583781.db2.gz	XNLRIEVQHRGXRI-SVGFKBNWSA-N	0	3	319.449	2.138	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)CSC[C@H]1CCCCO1	ZINC000171396916	402584384	/nfs/dbraw/zinc/58/43/84/402584384.db2.gz	FQFYRJUKYKIXLW-HUUCEWRRSA-N	0	3	316.511	2.381	10	0		DEAEHN
C[C@H]1CN(C(=O)NC[C@H](c2ccccc2)N(C)C)CCS1	ZINC000171412211	402585500	/nfs/dbraw/zinc/58/55/00/402585500.db2.gz	BJDMGORQBPAKJY-DZGCQCFKSA-N	0	3	307.463	2.436	10	0		DEAEHN
CCOc1cccnc1C(=O)N[C@@H](C)CN1CCC[C@@H](C)C1	ZINC000248370098	402588010	/nfs/dbraw/zinc/58/80/10/402588010.db2.gz	XBAYJTXAWQXISI-KGLIPLIRSA-N	0	3	305.422	2.331	10	0		DEAEHN
CCN1CCC[C@H](N[C@H](C)c2ccccc2OCC(=O)OC)C1	ZINC000248510406	402593658	/nfs/dbraw/zinc/59/36/58/402593658.db2.gz	ZTWPGGCGSOVHDF-CABCVRRESA-N	0	3	320.433	2.373	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)C2(c3ccccc3)CCOCC2)C1	ZINC000171554042	402594161	/nfs/dbraw/zinc/59/41/61/402594161.db2.gz	UMWMAEOELGZHDI-QGZVFWFLSA-N	0	3	316.445	2.335	10	0		DEAEHN
CN(C)[C@H]1CCCN(C(=O)N[C@@H]2CCOc3ccccc32)C1	ZINC000171582812	402597332	/nfs/dbraw/zinc/59/73/32/402597332.db2.gz	GKXPWZUXYFRYJX-DZGCQCFKSA-N	0	3	303.406	2.246	10	0		DEAEHN
C[C@H](NC(=O)N1CCN2CCC[C@@H]2C1)[C@H]1COc2ccccc21	ZINC000179663528	402597754	/nfs/dbraw/zinc/59/77/54/402597754.db2.gz	FKXDQOUAINWTTM-SQWLQELKSA-N	0	3	315.417	2.041	10	0		DEAEHN
COc1cc(CN2CCCN(C3CC3)CC2)cc2c1OCCO2	ZINC000179729466	402598980	/nfs/dbraw/zinc/59/89/80/402598980.db2.gz	HOWHHMUKZLQQFY-UHFFFAOYSA-N	0	3	318.417	2.137	10	0		DEAEHN
C[C@H](Nc1ccc(OC2CCN(C)CC2)nc1)c1cnn(C)c1	ZINC000179744361	402599657	/nfs/dbraw/zinc/59/96/57/402599657.db2.gz	QUTIVCIMXXJAMH-ZDUSSCGKSA-N	0	3	315.421	2.461	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(C[C@H](O)COCC(C)C)C1	ZINC000171625440	402602637	/nfs/dbraw/zinc/60/26/37/402602637.db2.gz	SMZJJSCAKJAMIB-CVEARBPZSA-N	0	3	309.454	2.116	10	0		DEAEHN
C[C@H]1CN([C@@H](CNCc2cncn2C)c2cccs2)CCO1	ZINC000171627222	402603143	/nfs/dbraw/zinc/60/31/43/402603143.db2.gz	NCNBYLRPKSEKDC-ZFWWWQNUSA-N	0	3	320.462	2.033	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(Cc2nccn2C)C1	ZINC000190470090	402603335	/nfs/dbraw/zinc/60/33/35/402603335.db2.gz	ZXZGGRFGPPQNAU-AWEZNQCLSA-N	0	3	319.478	2.139	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCCc1ccccc1O	ZINC000171633504	402603796	/nfs/dbraw/zinc/60/37/96/402603796.db2.gz	DETXDYVVKGDENB-OAHLLOKOSA-N	0	3	307.438	2.210	10	0		DEAEHN
CCn1cc(CN2CC[C@@H](CN(C)Cc3cccnc3)C2)cn1	ZINC000190476014	402604126	/nfs/dbraw/zinc/60/41/26/402604126.db2.gz	MPCSRLRWPFFCKJ-KRWDZBQOSA-N	0	3	313.449	2.252	10	0		DEAEHN
C[C@H]1OCCC[C@H]1C(=O)N(CCN(C)C)Cc1ccccc1	ZINC000190475197	402604240	/nfs/dbraw/zinc/60/42/40/402604240.db2.gz	CJUHDITZZRNCIM-NVXWUHKLSA-N	0	3	304.434	2.392	10	0		DEAEHN
C[C@@H](O)CN(Cc1ccc(Br)c(F)c1)[C@H](C)CO	ZINC000248915876	402614457	/nfs/dbraw/zinc/61/44/57/402614457.db2.gz	JWFAHGHUKVHWBO-NXEZZACHSA-N	0	3	320.202	2.152	10	0		DEAEHN
COCCOc1ccc(C(=O)N[C@H](CC(C)C)CN(C)C)cc1	ZINC000171765734	402620108	/nfs/dbraw/zinc/62/01/08/402620108.db2.gz	AYPQKWHNOTXAOB-MRXNPFEDSA-N	0	3	322.449	2.418	10	0		DEAEHN
COc1ccc(O)cc1C(=O)NC[C@@H](C)N1CCC[C@H](C)C1	ZINC000249114899	402621305	/nfs/dbraw/zinc/62/13/05/402621305.db2.gz	NQPAATHCTHFZPQ-QWHCGFSZSA-N	0	3	306.406	2.251	10	0		DEAEHN
COCc1cc([C@@H](C)N[C@H]2CCc3ncnn3C2)ccc1OC	ZINC000180599893	402621426	/nfs/dbraw/zinc/62/14/26/402621426.db2.gz	FBAIULXCXUBTDO-DOMZBBRYSA-N	0	3	316.405	2.099	10	0		DEAEHN
CCc1cc(NC(=O)C(=O)NC[C@@H](C)N(C)C2CC2)ccc1C	ZINC000180598999	402621544	/nfs/dbraw/zinc/62/15/44/402621544.db2.gz	PTDHEPWHNGJRDG-CYBMUJFWSA-N	0	3	317.433	2.095	10	0		DEAEHN
CCCNC(=O)[C@H](C)N[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000180660333	402622431	/nfs/dbraw/zinc/62/24/31/402622431.db2.gz	UEGUCJOCKAJBNI-KBPBESRZSA-N	0	3	300.406	2.438	10	0		DEAEHN
Cc1ccccc1C1CCN(C[C@@H](O)CN2CCCC2=O)CC1	ZINC000171884176	402631772	/nfs/dbraw/zinc/63/17/72/402631772.db2.gz	LUHFXTBTYVZEDT-QGZVFWFLSA-N	0	3	316.445	2.158	10	0		DEAEHN
Cc1ccccc1C1CCN(C[C@H](O)CN2CCCC2=O)CC1	ZINC000171884175	402631938	/nfs/dbraw/zinc/63/19/38/402631938.db2.gz	LUHFXTBTYVZEDT-KRWDZBQOSA-N	0	3	316.445	2.158	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@H](C)c1cccs1	ZINC000171898135	402632532	/nfs/dbraw/zinc/63/25/32/402632532.db2.gz	KSLZLSGVLSSPQS-CHWSQXEVSA-N	0	3	311.451	2.219	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000249635460	402637566	/nfs/dbraw/zinc/63/75/66/402637566.db2.gz	RXKPUXGJDSXTSA-HJWJTTGWSA-N	0	3	302.418	2.363	10	0		DEAEHN
COc1cccc(CNCC[C@@H](C)NC(=O)OC(C)(C)C)n1	ZINC000190962506	402633443	/nfs/dbraw/zinc/63/34/43/402633443.db2.gz	WQKWZVOVKKIGNB-GFCCVEGCSA-N	0	3	309.410	2.483	10	0		DEAEHN
COc1cccc2[nH]cc(CC(=O)N3CCN4CCC[C@H]4C3)c21	ZINC000181215107	402638153	/nfs/dbraw/zinc/63/81/53/402638153.db2.gz	HLBCFKDEHMMEQP-AWEZNQCLSA-N	0	3	313.401	2.026	10	0		DEAEHN
CCC(=O)OC[C@@H]1CN(Cc2ccccc2)C[C@H]1OC(=O)CC	ZINC000249688193	402638383	/nfs/dbraw/zinc/63/83/83/402638383.db2.gz	IAILZLXBCDRKGE-JKSUJKDBSA-N	0	3	319.401	2.393	10	0		DEAEHN
CCc1ccc(NC(=O)N2CCO[C@@H](CN(C)C)C2)cc1F	ZINC000181281732	402639794	/nfs/dbraw/zinc/63/97/94/402639794.db2.gz	HLSSERUMLWSKGT-AWEZNQCLSA-N	0	3	309.385	2.182	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@H](C)Oc2cccc(C(C)=O)c2)C1	ZINC000249843803	402642391	/nfs/dbraw/zinc/64/23/91/402642391.db2.gz	ZJLVVOPPFXCEHV-HOCLYGCPSA-N	0	3	318.417	2.257	10	0		DEAEHN
C[C@@H]1OCCC[C@H]1C(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000191139601	402644768	/nfs/dbraw/zinc/64/47/68/402644768.db2.gz	CPUVRFPMZRENCQ-WMLDXEAASA-N	0	3	320.433	2.058	10	0		DEAEHN
Cc1ccc(OC2CCN(CC[C@@H]3CCOC3=O)CC2)nc1	ZINC000181553445	402649906	/nfs/dbraw/zinc/64/99/06/402649906.db2.gz	UHUSWAXTFUVRCC-CQSZACIVSA-N	0	3	304.390	2.186	10	0		DEAEHN
C[C@@H](C(=O)Nc1cccnc1Cl)N1CCCN(C2CC2)CC1	ZINC000172347236	402651376	/nfs/dbraw/zinc/65/13/76/402651376.db2.gz	BQGMRIRICQTZGQ-LBPRGKRZSA-N	0	3	322.840	2.232	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)[C@@H](C)N1CCCN(C2CC2)CC1	ZINC000172347888	402651680	/nfs/dbraw/zinc/65/16/80/402651680.db2.gz	ZBQDDMMCSBMMRK-HZPDHXFCSA-N	0	3	307.482	2.336	10	0		DEAEHN
O=C1[C@H](N2CCCN(C3CC3)CC2)CCN1c1ccccc1F	ZINC000172347593	402651797	/nfs/dbraw/zinc/65/17/97/402651797.db2.gz	UEAZFCNQOKAGMZ-QGZVFWFLSA-N	0	3	317.408	2.101	10	0		DEAEHN
CCOC(=O)CCN[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1	ZINC000192151528	402714462	/nfs/dbraw/zinc/71/44/62/402714462.db2.gz	CUTGXFFVUSLXQT-CZUORRHYSA-N	0	3	324.808	2.155	10	0		DEAEHN
O=C(Nc1ccc2c(c1F)CCNC2)[C@H]1CSCCS1	ZINC000261707512	402716060	/nfs/dbraw/zinc/71/60/60/402716060.db2.gz	KELNLVGCTYFQBI-GFCCVEGCSA-N	0	3	312.435	2.259	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c(C)c1	ZINC000173885538	402717145	/nfs/dbraw/zinc/71/71/45/402717145.db2.gz	USOJKSONJWFZFQ-LSDHHAIUSA-N	0	3	310.463	2.310	10	0		DEAEHN
Cc1[nH]ncc1CCCNC(=O)NCc1nccn1CC(C)C	ZINC000173901163	402718299	/nfs/dbraw/zinc/71/82/99/402718299.db2.gz	LPPOOUBKYXDXQI-UHFFFAOYSA-N	0	3	318.425	2.003	10	0		DEAEHN
Cc1ccsc1CNC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C	ZINC000253226886	402661958	/nfs/dbraw/zinc/66/19/58/402661958.db2.gz	JOFYEUQCIAGWQD-AXAPSJFSSA-N	0	3	308.447	2.205	10	0		DEAEHN
Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)C2(N)CCOCC2)C1	ZINC000261868180	402718917	/nfs/dbraw/zinc/71/89/17/402718917.db2.gz	NWWKGXSABSCRSC-CABCVRRESA-N	0	3	302.418	2.207	10	0		DEAEHN
Cn1ccnc1C[C@H]1CCCN(Cc2cc(C(N)=O)cs2)C1	ZINC000182090865	402666952	/nfs/dbraw/zinc/66/69/52/402666952.db2.gz	QIGLGKBVLAYLKJ-GFCCVEGCSA-N	0	3	318.446	2.035	10	0		DEAEHN
C[C@H](NC(=O)N1CCC[C@H]2CN(C)CC[C@@H]21)c1ccncc1	ZINC000182206850	402672060	/nfs/dbraw/zinc/67/20/60/402672060.db2.gz	OSAIGCCNNHFGTQ-BPUTZDHNSA-N	0	3	302.422	2.268	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cnc(OCC2CC2)c(Cl)c1	ZINC000182393887	402686195	/nfs/dbraw/zinc/68/61/95/402686195.db2.gz	BUZRJTKMOONMSH-ZDUSSCGKSA-N	0	3	323.824	2.348	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)S(=O)(=O)Cc2cccc(F)c2)CCN1C	ZINC000173268113	402690018	/nfs/dbraw/zinc/69/00/18/402690018.db2.gz	MPYVYUDEBYZEBN-WFASDCNBSA-N	0	3	314.426	2.070	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cccc(OCCCOC)c2)C1	ZINC000173562464	402703026	/nfs/dbraw/zinc/70/30/26/402703026.db2.gz	GGOFFYUWCMRKCD-MRXNPFEDSA-N	0	3	320.433	2.316	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@@H](C)Oc2ccc(F)cc2)C1	ZINC000174233905	402732938	/nfs/dbraw/zinc/73/29/38/402732938.db2.gz	NMXBPVRJAKDTCG-UKRRQHHQSA-N	0	3	323.412	2.377	10	0		DEAEHN
CC(C)NC(=O)CCN[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000183599834	402780542	/nfs/dbraw/zinc/78/05/42/402780542.db2.gz	ZHSQSURQUPKSKH-AWEZNQCLSA-N	0	3	300.406	2.438	10	0		DEAEHN
Cn1c2ccc(CNC[C@H](O)CC(C)(C)C)cc2sc1=O	ZINC000192578284	402738164	/nfs/dbraw/zinc/73/81/64/402738164.db2.gz	LJCPEKNOJQBLHQ-GFCCVEGCSA-N	0	3	308.447	2.487	10	0		DEAEHN
CCc1nc(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cs1	ZINC000174796414	402757957	/nfs/dbraw/zinc/75/79/57/402757957.db2.gz	IHKDLHQGEZWOKY-DGCLKSJQSA-N	0	3	310.467	2.330	10	0		DEAEHN
CCN(CC)[C@H](C)CNC(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000194247967	402788876	/nfs/dbraw/zinc/78/88/76/402788876.db2.gz	FYLUZRKPNFMIIS-CYBMUJFWSA-N	0	3	302.418	2.205	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000184404895	402841919	/nfs/dbraw/zinc/84/19/19/402841919.db2.gz	WWHVDVBGQGHYQR-SWLSCSKDSA-N	0	3	306.454	2.405	10	0		DEAEHN
COc1cccc([C@H](C)C(=O)N2CCCN(C3CC3)CC2)c1	ZINC000195410336	402844591	/nfs/dbraw/zinc/84/45/91/402844591.db2.gz	SKBSUPLVAARDQH-AWEZNQCLSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc(OC)cc2OC)C1	ZINC000194318647	402792066	/nfs/dbraw/zinc/79/20/66/402792066.db2.gz	FDEMHCQPOCVVSF-LBPRGKRZSA-N	0	3	307.394	2.310	10	0		DEAEHN
C[C@H](CC(=O)OC(C)(C)C)NCCNC(=O)c1ccccc1	ZINC000183740473	402793227	/nfs/dbraw/zinc/79/32/27/402793227.db2.gz	SBFFTIZLQMYLPO-CYBMUJFWSA-N	0	3	306.406	2.126	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)NCc1ccccc1C	ZINC000175345336	402798892	/nfs/dbraw/zinc/79/88/92/402798892.db2.gz	OYAVIAFDWIFKDF-KRWDZBQOSA-N	0	3	303.450	2.027	10	0		DEAEHN
C[C@H](NC(=O)NC[C@@H](O)CN1CCCCC1)C1CCCCC1	ZINC000175414656	402804738	/nfs/dbraw/zinc/80/47/38/402804738.db2.gz	IDPXQAJHNVOGSO-GOEBONIOSA-N	0	3	311.470	2.101	10	0		DEAEHN
C[C@H](NC[C@H](O)COC(C)(C)C)c1ccc(-n2cncn2)cc1	ZINC000194894721	402821519	/nfs/dbraw/zinc/82/15/19/402821519.db2.gz	AVYYHTPMMGXLLG-BBRMVZONSA-N	0	3	318.421	2.094	10	0		DEAEHN
COc1cc(CN2CCC[C@H](c3nc(C)no3)C2)ccc1O	ZINC000194973462	402825007	/nfs/dbraw/zinc/82/50/07/402825007.db2.gz	ZMUGHDCNFVEIQA-ZDUSSCGKSA-N	0	3	303.362	2.472	10	0		DEAEHN
Cn1c2ccc(CN3C[C@H]4CCC[C@@H](C3)C4O)cc2sc1=O	ZINC000195024865	402827507	/nfs/dbraw/zinc/82/75/07/402827507.db2.gz	MHLYVJFLUVFZIS-OCZCAGDBSA-N	0	3	318.442	2.193	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)N2CCN3CCCC[C@@H]3C2)c1	ZINC000195222445	402837700	/nfs/dbraw/zinc/83/77/00/402837700.db2.gz	BVQGOTBTTWJRLD-QGZVFWFLSA-N	0	3	316.449	2.450	10	0		DEAEHN
CC(C)[C@H](CNC(=O)N1CCN2CCC[C@@H]2C1)c1cccnc1	ZINC000175903721	402841372	/nfs/dbraw/zinc/84/13/72/402841372.db2.gz	QJGSFDIHYBPFGV-SJORKVTESA-N	0	3	316.449	2.311	10	0		DEAEHN
COC(=O)COc1ccccc1[C@H](C)NC[C@@H]1CCCC[C@@H]1O	ZINC000183637450	402784233	/nfs/dbraw/zinc/78/42/33/402784233.db2.gz	OEOIGGVMDQNUFD-DZKIICNBSA-N	0	3	321.417	2.440	10	0		DEAEHN
Cc1nccn1-c1ccc([C@@H](C)NCC(=O)N2CCCC2)cc1	ZINC000183681210	402788205	/nfs/dbraw/zinc/78/82/05/402788205.db2.gz	RIMUHKNDPZMWFF-CQSZACIVSA-N	0	3	312.417	2.454	10	0		DEAEHN
CCCCNC(=O)[C@H](C)N1CC[C@H](CNc2ccccn2)C1	ZINC000195515884	402848684	/nfs/dbraw/zinc/84/86/84/402848684.db2.gz	FCUKZMQSGUBTEO-LSDHHAIUSA-N	0	3	304.438	2.120	10	0		DEAEHN
CC/C=C/CCN1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000184528674	402849162	/nfs/dbraw/zinc/84/91/62/402849162.db2.gz	INJBLHGWOKPQOF-WHLIDYPQSA-N	0	3	318.461	2.400	10	0		DEAEHN
CCCNC(=O)[C@H](C)N1CC[C@H](CNc2cccc(C)n2)C1	ZINC000195516200	402849649	/nfs/dbraw/zinc/84/96/49/402849649.db2.gz	OTRKVVRORDNKHV-LSDHHAIUSA-N	0	3	304.438	2.039	10	0		DEAEHN
Cn1ccnc1[C@H]1OCCC[C@@H]1NCc1cccc2c1OCO2	ZINC000275553114	403105257	/nfs/dbraw/zinc/10/52/57/403105257.db2.gz	NMYASMYNBPTJBD-BBRMVZONSA-N	0	3	315.373	2.159	10	0		DEAEHN
CCOCCC(=O)N1CCC[C@H](N(C)Cc2ccccn2)CC1	ZINC000275918492	403132782	/nfs/dbraw/zinc/13/27/82/403132782.db2.gz	JTKJGQDREQAOFV-KRWDZBQOSA-N	0	3	319.449	2.321	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@H]1NCc1cc(Br)cs1	ZINC000282361476	403146480	/nfs/dbraw/zinc/14/64/80/403146480.db2.gz	NHVRDBYZWMLTTP-OIBJUYFYSA-N	0	3	303.225	2.267	10	0		DEAEHN
COCCN1CC[C@H](CNc2ccc(C(F)(F)F)cn2)C1	ZINC000301125287	403592510	/nfs/dbraw/zinc/59/25/10/403592510.db2.gz	XYYHIOCEMIWQFM-LLVKDONJSA-N	0	3	303.328	2.481	10	0		DEAEHN
Cc1cc(Cl)cnc1NC(=O)NC[C@H]1NC(C)(C)O[C@@H]1C	ZINC000333280136	403715045	/nfs/dbraw/zinc/71/50/45/403715045.db2.gz	HMCCRXWVIDVTES-MWLCHTKSSA-N	0	3	312.801	2.278	10	0		DEAEHN
c1ccc(COc2ccnc(N3CCN4CCC3CC4)n2)cc1	ZINC000302757271	403721989	/nfs/dbraw/zinc/72/19/89/403721989.db2.gz	IYVLZBHMPZZRQH-UHFFFAOYSA-N	0	3	310.401	2.340	10	0		DEAEHN
COc1cccc([C@@H]2[C@@H](N[C@@H]3CCNC3=O)CCN2C2CC2)c1	ZINC000328721877	404138347	/nfs/dbraw/zinc/13/83/47/404138347.db2.gz	XDQZAHKDOYQLOG-GVDBMIGSSA-N	0	3	315.417	2.291	10	0		DEAEHN
CN(C(=O)c1cc2ccccc2[nH]c1=O)[C@@H]1CN2CCC1CC2	ZINC000329442966	404339333	/nfs/dbraw/zinc/33/93/33/404339333.db2.gz	KMYVYXAKENRXPU-MRXNPFEDSA-N	0	3	311.385	2.107	10	0		DEAEHN
Cn1cc(C[C@H]2CCN(Cc3ccc4c(c3)OCCO4)C2)cn1	ZINC000370013041	404304931	/nfs/dbraw/zinc/30/49/31/404304931.db2.gz	VPHMIQXCVSHTMV-OAHLLOKOSA-N	0	3	313.401	2.256	10	0		DEAEHN
C[C@@H]1CCN(c2cncc3nncn32)CCN1Cc1ccccc1	ZINC000364683584	404499001	/nfs/dbraw/zinc/49/90/01/404499001.db2.gz	SWKFSRVAVGKXGW-OAHLLOKOSA-N	0	3	322.416	2.225	10	0		DEAEHN
C[C@@H]1OCCN(c2nnc(C3CCC3)n2C[C@H]2CCOC2)[C@H]1C	ZINC000329744445	404439109	/nfs/dbraw/zinc/43/91/09/404439109.db2.gz	QSENXYDBHDTLQP-MELADBBJSA-N	0	3	320.437	2.196	10	0		DEAEHN
COc1cccc2c1CCN(C[C@H](O)CC(F)(F)F)CC2	ZINC000365357772	404631878	/nfs/dbraw/zinc/63/18/78/404631878.db2.gz	MSTVQUBAYMDAQB-GFCCVEGCSA-N	0	3	303.324	2.409	10	0		DEAEHN
CCN(CCNC(=O)N1CCCC[C@@H]1c1ccnn1C)C1CC1	ZINC000376129696	404806486	/nfs/dbraw/zinc/80/64/86/404806486.db2.gz	HZBGCIPXOKPEJQ-MRXNPFEDSA-N	0	3	319.453	2.141	10	0		DEAEHN
COC(=O)c1cncc(NC[C@@H](C)N(C)Cc2ccccc2)n1	ZINC000360119492	404818989	/nfs/dbraw/zinc/81/89/89/404818989.db2.gz	VNKLBCGXVYRAIP-CYBMUJFWSA-N	0	3	314.389	2.196	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCCc1nc2cc(F)ccc2[nH]1	ZINC000361130139	404935088	/nfs/dbraw/zinc/93/50/88/404935088.db2.gz	SHRABKUCFYPBJJ-OAHLLOKOSA-N	0	3	318.396	2.235	10	0		DEAEHN
COC(=O)[C@H](C)CN(Cc1ccc(-c2cc[nH]n2)o1)C1CC1	ZINC000434980948	404947611	/nfs/dbraw/zinc/94/76/11/404947611.db2.gz	BZQMRTHXGYTUKQ-LLVKDONJSA-N	0	3	303.362	2.443	10	0		DEAEHN
OCCN1CCC[C@H](NCc2ccsc2Br)C1	ZINC000388981929	405036721	/nfs/dbraw/zinc/03/67/21/405036721.db2.gz	PMYKQBDMSQRSLL-NSHDSACASA-N	0	3	319.268	2.057	10	0		DEAEHN
CCN1C[C@@H](C)N(Cc2nc3oc(C)c(C)c3c(N)n2)C[C@@H]1C	ZINC000408048649	405099077	/nfs/dbraw/zinc/09/90/77/405099077.db2.gz	ZABMLCLISHIGME-WDEREUQCSA-N	0	3	317.437	2.336	10	0		DEAEHN
Cc1cc(=O)[nH]c(C(=O)N2CCC[C@@H]2CN2CCCCC2)c1	ZINC000408006285	405088145	/nfs/dbraw/zinc/08/81/45/405088145.db2.gz	XIUFCBHXQCKBGT-CQSZACIVSA-N	0	3	303.406	2.186	10	0		DEAEHN
CC(C)OCCOC1CCN(C[C@H](O)CC(F)(F)F)CC1	ZINC000451952265	405106817	/nfs/dbraw/zinc/10/68/17/405106817.db2.gz	OOWQRKXPRVRNNB-GFCCVEGCSA-N	0	3	313.360	2.206	10	0		DEAEHN
C[C@@H]1CCOCCN1CCC(=O)NCc1ccccc1Cl	ZINC000367663007	405117472	/nfs/dbraw/zinc/11/74/72/405117472.db2.gz	PARGLBIYGAPSPO-CYBMUJFWSA-N	0	3	310.825	2.457	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N[C@H](CC)COCC(F)(F)F	ZINC000452745959	405237200	/nfs/dbraw/zinc/23/72/00/405237200.db2.gz	ONWHFAUWROCZHQ-NEPJUHHUSA-N	0	3	310.360	2.335	10	0		DEAEHN
Cc1ccc(F)c(NC(=O)N[C@H](CO)CN2CCCCC2)c1	ZINC000454304161	405324902	/nfs/dbraw/zinc/32/49/02/405324902.db2.gz	QXPFOMVIKZSTDA-ZDUSSCGKSA-N	0	3	309.385	2.102	10	0		DEAEHN
Cc1csc2nc(CNC3(CCO)CCCCC3)cc(=O)n12	ZINC000440909814	405330988	/nfs/dbraw/zinc/33/09/88/405330988.db2.gz	OURIHMZAMMHKHT-UHFFFAOYSA-N	0	3	321.446	2.239	10	0		DEAEHN
COC[C@@H](NC1CCN(c2cnccn2)CC1)c1ccccc1	ZINC000557274534	405590509	/nfs/dbraw/zinc/59/05/09/405590509.db2.gz	ONIQVJUEOAQOBL-QGZVFWFLSA-N	0	3	312.417	2.423	10	0		DEAEHN
Cc1ccc(C[C@H](CO)NC(=O)CC2CCN(C)CC2)cc1C	ZINC000457241884	405764872	/nfs/dbraw/zinc/76/48/72/405764872.db2.gz	FEIHKNWVJLLOIK-GOSISDBHSA-N	0	3	318.461	2.055	10	0		DEAEHN
c1ccc(N2CC[C@@H](CN3CCO[C@]4(CCOC4)C3)C2)cc1	ZINC000639052052	405846876	/nfs/dbraw/zinc/84/68/76/405846876.db2.gz	HTWMELBXTQPPOY-FUHWJXTLSA-N	0	3	302.418	2.004	10	0		DEAEHN
C(CN1CCCC[C@H]1CN1CCOCC1)OCC1CCCC1	ZINC000459338876	405860980	/nfs/dbraw/zinc/86/09/80/405860980.db2.gz	BEBOLIFGODJWHD-SFHVURJKSA-N	0	3	310.482	2.380	10	0		DEAEHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1cncn1C	ZINC000298593935	292370736	/nfs/dbraw/zinc/37/07/36/292370736.db2.gz	JADCFXHTVNNQHM-GDBMZVCRSA-N	0	3	310.401	2.177	10	0		DEAEHN
c1nc(CN[C@H](C2CC2)[C@@H]2CCCCO2)cc2c1OCCO2	ZINC000639297284	406028620	/nfs/dbraw/zinc/02/86/20/406028620.db2.gz	RHMYQBJMDLVJLR-WMLDXEAASA-N	0	3	304.390	2.290	10	0		DEAEHN
COc1cc(CN[C@H]2CN(Cc3ccccc3)C[C@H]2C)on1	ZINC000639325381	406045921	/nfs/dbraw/zinc/04/59/21/406045921.db2.gz	WVEVVQGJWQIBBG-CJNGLKHVSA-N	0	3	301.390	2.293	10	0		DEAEHN
c1ccc(N2CCN(CCCN3C[C@@H]4C[C@H]3CS4)CC2)cc1	ZINC000459790771	406047718	/nfs/dbraw/zinc/04/77/18/406047718.db2.gz	GXBRXXGDRFJSNZ-ROUUACIJSA-N	0	3	317.502	2.388	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@@H]1CC[C@H]2CCC[C@@H]2C1	ZINC000533816331	406163431	/nfs/dbraw/zinc/16/34/31/406163431.db2.gz	SHBBHUYRWBLJMR-IIAWOOMASA-N	0	3	302.422	2.183	10	0		DEAEHN
CC(C)C[C@H](CCO)CNCc1c(Br)cnn1C	ZINC000487312189	406223752	/nfs/dbraw/zinc/22/37/52/406223752.db2.gz	RKMSVQOPCWBQKE-NSHDSACASA-N	0	3	318.259	2.317	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@@H]1CCC[C@@H]2OCC[C@H]21	ZINC000487322188	406224018	/nfs/dbraw/zinc/22/40/18/406224018.db2.gz	PWVCPHWMUZFHCY-NDMJEZRESA-N	0	3	314.227	2.230	10	0		DEAEHN
COc1ccccc1[C@]1(C)C[C@H]1NC(=O)NC[C@@H]1CCCN1C	ZINC000524781815	406460377	/nfs/dbraw/zinc/46/03/77/406460377.db2.gz	CAGLKJFFLBLTQU-XCRHUMRWSA-N	0	3	317.433	2.119	10	0		DEAEHN
CCN1CCCN(C(=O)[C@@H]2CCc3nc(C(C)C)[nH]c3C2)CC1	ZINC000526003740	406531745	/nfs/dbraw/zinc/53/17/45/406531745.db2.gz	ZXYJCPBGPHECGO-CQSZACIVSA-N	0	3	318.465	2.192	10	0		DEAEHN
CCN1CCCN(C(=O)[C@@H]2CCc3[nH]c(C(C)C)nc3C2)CC1	ZINC000526003740	406531750	/nfs/dbraw/zinc/53/17/50/406531750.db2.gz	ZXYJCPBGPHECGO-CQSZACIVSA-N	0	3	318.465	2.192	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N(C(=O)[C@H](N)CN(C)Cc2ccccc2)C1	ZINC000638007409	406520837	/nfs/dbraw/zinc/52/08/37/406520837.db2.gz	NJMNNTFUYLHKSB-HLLBOEOZSA-N	0	3	303.450	2.093	10	0		DEAEHN
C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)NC[C@@H]1CCCN(C)C1	ZINC000527224761	406600018	/nfs/dbraw/zinc/60/00/18/406600018.db2.gz	AEJTVZNBCPVPBC-WOPDTQHZSA-N	0	3	307.360	2.311	10	0		DEAEHN
CCN1CCN(C(=O)[C@H]2CCc3nc(C(C)C)[nH]c3C2)[C@@H](C)C1	ZINC000553329396	406750039	/nfs/dbraw/zinc/75/00/39/406750039.db2.gz	HERAPKWRKANTGY-KBPBESRZSA-N	0	3	318.465	2.191	10	0		DEAEHN
CCN1CCN(C(=O)[C@H]2CCc3[nH]c(C(C)C)nc3C2)[C@@H](C)C1	ZINC000553329396	406750044	/nfs/dbraw/zinc/75/00/44/406750044.db2.gz	HERAPKWRKANTGY-KBPBESRZSA-N	0	3	318.465	2.191	10	0		DEAEHN
CC1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638429982	406768693	/nfs/dbraw/zinc/76/86/93/406768693.db2.gz	LAMOYWOMXRXRGC-ONQFOCNCSA-N	0	3	315.461	2.235	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCc1nccn1-c1ccccc1	ZINC000555104786	406833776	/nfs/dbraw/zinc/83/37/76/406833776.db2.gz	DHEGOTIDNLTZEI-MRXNPFEDSA-N	0	3	312.417	2.363	10	0		DEAEHN
C[C@@H](NCc1cc(Br)cc2c1OCC2)[C@H](C)O	ZINC000129175508	196026051	/nfs/dbraw/zinc/02/60/51/196026051.db2.gz	BPFQFZKUZBTRSW-BDAKNGLRSA-N	0	3	300.196	2.243	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NC1CCN(c2ccccn2)CC1	ZINC000129260053	196034322	/nfs/dbraw/zinc/03/43/22/196034322.db2.gz	DDRHQRZANXYTNJ-MRXNPFEDSA-N	0	3	316.449	2.041	10	0		DEAEHN
CC(C)[C@@H]1CN2CCCC[C@@H]2CN1[C@@H](C)CC[S@](C)=O	ZINC000129833560	196078923	/nfs/dbraw/zinc/07/89/23/196078923.db2.gz	NLGQTCZAUQWTSX-KSVNGYGVSA-N	0	3	300.512	2.338	10	0		DEAEHN
CCN[C@H](Cc1cnn(C)c1)c1ccc(Br)cn1	ZINC000130864583	196117905	/nfs/dbraw/zinc/11/79/05/196117905.db2.gz	CJGFKDRHMIKYTD-CYBMUJFWSA-N	0	3	309.211	2.471	10	0		DEAEHN
CS[C@@H](C)CCNS(=O)(=O)c1cccc([C@H](C)N)c1	ZINC000130935513	196123563	/nfs/dbraw/zinc/12/35/63/196123563.db2.gz	OPQUMDDVVXFXDQ-QWRGUYRKSA-N	0	3	302.465	2.126	10	0		DEAEHN
CCOC(=O)CCCNCc1cccc(Br)n1	ZINC000131144334	196143596	/nfs/dbraw/zinc/14/35/96/196143596.db2.gz	UHPZVNHKXCWBBH-UHFFFAOYSA-N	0	3	301.184	2.277	10	0		DEAEHN
CN[C@H](C)c1cccc(S(=O)(=O)N[C@@H](C)CCSC)c1	ZINC000131238107	196151994	/nfs/dbraw/zinc/15/19/94/196151994.db2.gz	VLUHEMLVCHHFLY-NWDGAFQWSA-N	0	3	316.492	2.387	10	0		DEAEHN
CNC(=O)NC(=O)[C@@H](C)N[C@H](C)c1ccc(OCC(C)C)cc1	ZINC000131392160	196164125	/nfs/dbraw/zinc/16/41/25/196164125.db2.gz	WNEOMPVQZGRQNB-CHWSQXEVSA-N	0	3	321.421	2.216	10	0		DEAEHN
C[C@@H]1C[C@@H](N2C(=O)C3(CC3)N[C@H]2c2ccsc2)CCN1C	ZINC000131446613	196169738	/nfs/dbraw/zinc/16/97/38/196169738.db2.gz	GHTIFZXLGNBJJL-KWCYVHTRSA-N	0	3	305.447	2.194	10	0		DEAEHN
C[C@@H]1C[C@H](N2C(=O)C3(CC3)N[C@H]2c2ccsc2)CCN1C	ZINC000131446229	196170075	/nfs/dbraw/zinc/17/00/75/196170075.db2.gz	GHTIFZXLGNBJJL-MRVWCRGKSA-N	0	3	305.447	2.194	10	0		DEAEHN
N[C@H]1COC[C@H]1C(=O)Nc1cc(Cl)ccc1Br	ZINC000131636693	196185818	/nfs/dbraw/zinc/18/58/18/196185818.db2.gz	JFQBHFBYNGAKCF-APPZFPTMSA-N	0	3	319.586	2.015	10	0		DEAEHN
C[C@H](CN(C)C)N1C(=O)C2(CCCC2)N[C@H]1c1cccs1	ZINC000131649070	196187367	/nfs/dbraw/zinc/18/73/67/196187367.db2.gz	YPBRUAAYBFEXKP-TZMCWYRMSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCNc1nc(NCC[C@H](C)SC)nc(N2CCCC2)n1	ZINC000131671941	196190102	/nfs/dbraw/zinc/19/01/02/196190102.db2.gz	HCNBIXWSDJCEFT-NSHDSACASA-N	0	3	310.471	2.457	10	0		DEAEHN
Cc1cc(Br)c(N2CC[C@H](N)C2=O)cc1Cl	ZINC000131883233	196207165	/nfs/dbraw/zinc/20/71/65/196207165.db2.gz	LBECRPVAFKQMEN-VIFPVBQESA-N	0	3	303.587	2.475	10	0		DEAEHN
CCNCc1c(N(C)[C@@H]2CCCC[C@@H]2O)nc2sccn12	ZINC000132034311	196220226	/nfs/dbraw/zinc/22/02/26/196220226.db2.gz	JDUOGFOIAGEHSU-YPMHNXCESA-N	0	3	308.451	2.245	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1[C@@H](O)C(C)(C)C	ZINC000132222951	196237286	/nfs/dbraw/zinc/23/72/86/196237286.db2.gz	XLCQAAADASZYLZ-LLVKDONJSA-N	0	3	304.232	2.287	10	0		DEAEHN
C[C@@H]1CNC[C@H](COCc2ccccc2Br)O1	ZINC000132651766	196273460	/nfs/dbraw/zinc/27/34/60/196273460.db2.gz	ONRYMLJRROIMAD-ZYHUDNBSSA-N	0	3	300.196	2.343	10	0		DEAEHN
C[C@@H]1CNC[C@H](COCc2cccc(Br)c2)O1	ZINC000132728591	196279054	/nfs/dbraw/zinc/27/90/54/196279054.db2.gz	IWOXMRKXQNWLGK-ZWNOBZJWSA-N	0	3	300.196	2.343	10	0		DEAEHN
COCc1nc(NN)cc(Nc2ccccc2Br)n1	ZINC000133081891	196310304	/nfs/dbraw/zinc/31/03/04/196310304.db2.gz	JNPLWSZPOJZCCE-UHFFFAOYSA-N	0	3	324.182	2.415	10	0		DEAEHN
CCN[C@H](c1c(Cl)cnn1CCOC)[C@H]1CO[C@@H](C)C1	ZINC000134095311	196361259	/nfs/dbraw/zinc/36/12/59/196361259.db2.gz	MHJHLLMXAADIFD-LOWVWBTDSA-N	0	3	301.818	2.259	10	0		DEAEHN
CN(C)Cc1c2ccccc2oc1C(=O)NCC1(CCO)CC1	ZINC000188035515	225008471	/nfs/dbraw/zinc/00/84/71/225008471.db2.gz	JGTYUWQTLOMAKQ-UHFFFAOYSA-N	0	3	316.401	2.387	10	0		DEAEHN
C[C@@H](c1cnccn1)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000195269492	225200113	/nfs/dbraw/zinc/20/01/13/225200113.db2.gz	YHIWDYRYLWGDOZ-DOTOQJQBSA-N	0	3	311.433	2.387	10	0		DEAEHN
C[C@H](c1cnccn1)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000195269506	225200920	/nfs/dbraw/zinc/20/09/20/225200920.db2.gz	YHIWDYRYLWGDOZ-NVXWUHKLSA-N	0	3	311.433	2.387	10	0		DEAEHN
COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)NC[C@@H]2CCCN2C)c1	ZINC000248948873	225241203	/nfs/dbraw/zinc/24/12/03/225241203.db2.gz	CUGCKDAOHSXBAI-NOLJZWGESA-N	0	3	318.417	2.018	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@@H]1[C@H]2CCO[C@H]2C12CCC2	ZINC000291663591	222540544	/nfs/dbraw/zinc/54/05/44/222540544.db2.gz	FKSLWNBMVIKCFF-KZNAEPCWSA-N	0	3	324.428	2.374	10	0		DEAEHN
CN(C)CCOc1cccc(CNC(=O)Cc2ccccc2)c1	ZINC000193757324	424870925	/nfs/dbraw/zinc/87/09/25/424870925.db2.gz	VWZMNFGZPFVWEF-UHFFFAOYSA-N	0	3	312.413	2.486	10	0		DEAEHN
COc1ccc(SCC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000195318456	424882949	/nfs/dbraw/zinc/88/29/49/424882949.db2.gz	FJXXRVNGEDVPOW-ZDUSSCGKSA-N	0	3	306.431	2.094	10	0		DEAEHN
CC(C)n1ncnc1CN[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000389839278	424915511	/nfs/dbraw/zinc/91/55/11/424915511.db2.gz	MMHDDRCEOKFLAR-WBVHZDCISA-N	0	3	313.449	2.469	10	0		DEAEHN
C[C@H]1C[C@@H](c2nc(-c3cnc(C4CC4)nc3N)no2)CCN1C	ZINC000333764125	424923693	/nfs/dbraw/zinc/92/36/93/424923693.db2.gz	DBZAZUKDOXKQLH-ONGXEEELSA-N	0	3	314.393	2.184	10	0		DEAEHN
CC(C)(O)CCN1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC000404214980	424925884	/nfs/dbraw/zinc/92/58/84/424925884.db2.gz	SRQFPUVPQLIDGJ-QZTJIDSGSA-N	0	3	318.461	2.123	10	0		DEAEHN
COCc1ccc(C(=O)N(CCN(C)C)Cc2ccco2)o1	ZINC000088229678	267398631	/nfs/dbraw/zinc/39/86/31/267398631.db2.gz	AFHUTSQRGUOEBT-UHFFFAOYSA-N	0	3	306.362	2.223	10	0		DEAEHN
CN1C[C@@H](CNCc2cccc(F)c2Br)CC1=O	ZINC000657695223	425386977	/nfs/dbraw/zinc/38/69/77/425386977.db2.gz	JRTKVUHCVTXAEG-SECBINFHSA-N	0	3	315.186	2.156	10	0		DEAEHN
Cc1ccc(CNC[C@@H]2CC(=O)N(C)C2)c(Br)c1	ZINC000657694262	425387397	/nfs/dbraw/zinc/38/73/97/425387397.db2.gz	BLQNFWWZDGEQQE-NSHDSACASA-N	0	3	311.223	2.325	10	0		DEAEHN
COc1ccc([C@H](C)NC[C@@]2(CCO)CCOC2)c(OC)c1	ZINC000125744616	267429099	/nfs/dbraw/zinc/42/90/99/267429099.db2.gz	QZWWYKYEMFTUQK-SUMWQHHRSA-N	0	3	309.406	2.144	10	0		DEAEHN
CCn1ccnc1[C@@H]1OCC[C@H]1C[NH2+]Cc1nc(C)ccc1[O-]	ZINC000657650651	425382549	/nfs/dbraw/zinc/38/25/49/425382549.db2.gz	GNEQQSOLGXGYBQ-XJKSGUPXSA-N	0	3	316.405	2.179	10	0		DEAEHN
CN(C(=O)[C@H]1Cc2ccccc2S1)[C@@H](CN)C(F)(F)F	ZINC000662979240	425769960	/nfs/dbraw/zinc/76/99/60/425769960.db2.gz	UUBXHFWZWKBDED-MNOVXSKESA-N	0	3	304.337	2.051	10	0		DEAEHN
CCCCn1cc(CNC(=O)CC2CCN(C)CC2)c(C)n1	ZINC000362979691	269050858	/nfs/dbraw/zinc/05/08/58/269050858.db2.gz	KKESNLGCGBRDRN-UHFFFAOYSA-N	0	3	306.454	2.340	10	0		DEAEHN
Cc1noc(CN2CCN(C[C@H]3C(C)=CCC[C@@H]3C)CC2)n1	ZINC000443404524	269137116	/nfs/dbraw/zinc/13/71/16/269137116.db2.gz	GHBGWMOTDOPZDY-HOCLYGCPSA-N	0	3	304.438	2.488	10	0		DEAEHN
CN1CCCN(C[C@H](O)Cc2ccccc2C(F)(F)F)CC1	ZINC000443474391	269138597	/nfs/dbraw/zinc/13/85/97/269138597.db2.gz	HYHHWHYHWBYWEK-CQSZACIVSA-N	0	3	316.367	2.246	10	0		DEAEHN
COC[C@H](CN[C@H](C)c1ccc(Br)cn1)OC	ZINC000516829974	269369788	/nfs/dbraw/zinc/36/97/88/269369788.db2.gz	JVNQPJDSDMAUAB-KOLCDFICSA-N	0	3	303.200	2.156	10	0		DEAEHN
C[C@H](CNC(=O)c1ncsc1Br)N(C)C1CC1	ZINC000516803612	269369959	/nfs/dbraw/zinc/36/99/59/269369959.db2.gz	HQKODYRJBUEGAU-SSDOTTSWSA-N	0	3	318.240	2.118	10	0		DEAEHN
CCNC(=O)CN1CCCCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000246182496	276257436	/nfs/dbraw/zinc/25/74/36/276257436.db2.gz	HBWJMLDJCJGSGP-IAGOWNOFSA-N	0	3	304.434	2.491	10	0		DEAEHN
CCOC(=O)[C@@H]1CN([C@H]2CCc3ccc(F)cc32)CC12COC2	ZINC000451137799	276289159	/nfs/dbraw/zinc/28/91/59/276289159.db2.gz	PNVCFBRZUUPKMW-HOTGVXAUSA-N	0	3	319.376	2.325	10	0		DEAEHN
CC[C@](C)(O)CN[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1	ZINC000192159697	276650165	/nfs/dbraw/zinc/65/01/65/276650165.db2.gz	RCCGEVROHORUDB-IMJJTQAJSA-N	0	3	310.825	2.362	10	0		DEAEHN
CN1CCO[C@H](CN[C@H]2CC3(CCC3)Oc3ccccc32)C1	ZINC000246395520	276940265	/nfs/dbraw/zinc/94/02/65/276940265.db2.gz	LGKLUTUVDXKYLE-ZBFHGGJFSA-N	0	3	302.418	2.353	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)[C@H]1COc2ccc(Cl)cc2C1	ZINC000194721760	277081204	/nfs/dbraw/zinc/08/12/04/277081204.db2.gz	MOAHSRRXMFAHTE-OCCSQVGLSA-N	0	3	308.809	2.102	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NC2Cc3ccccc3C2)C1	ZINC000248394744	277155082	/nfs/dbraw/zinc/15/50/82/277155082.db2.gz	IHTJAMMBNTZFEI-FUHWJXTLSA-N	0	3	313.445	2.280	10	0		DEAEHN
CN1CC[C@H](NC(=O)NC2(CO)CCCC2)[C@@H]1c1ccccc1	ZINC000179482580	277166332	/nfs/dbraw/zinc/16/63/32/277166332.db2.gz	ONQFJPXQUSTUTO-HOTGVXAUSA-N	0	3	317.433	2.036	10	0		DEAEHN
COC[C@@H](Cc1ccccc1)N(C)C[C@H](O)COC(C)(C)C	ZINC000249149509	277246445	/nfs/dbraw/zinc/24/64/45/277246445.db2.gz	XKQKXPROJPTSAY-SJORKVTESA-N	0	3	309.450	2.352	10	0		DEAEHN
CS[C@@H](C)CNC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000122973060	278141532	/nfs/dbraw/zinc/14/15/32/278141532.db2.gz	WKTNGXCPWNJRTG-DZGCQCFKSA-N	0	3	309.479	2.210	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1CCOC[C@@H]1C	ZINC000248881446	279283198	/nfs/dbraw/zinc/28/31/98/279283198.db2.gz	SKNYXJURVQGUAV-ZMSDIMECSA-N	0	3	304.434	2.296	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCCC[C@H]2c2ncc[nH]2)C1	ZINC000247608149	279318679	/nfs/dbraw/zinc/31/86/79/279318679.db2.gz	LYZGZCZJTQQDPV-KBPBESRZSA-N	0	3	305.426	2.131	10	0		DEAEHN
C[C@](C[NH3+])([N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1)C1CC1	ZINC000130360924	280140109	/nfs/dbraw/zinc/14/01/09/280140109.db2.gz	OABBUYQZOCKDJL-GFCCVEGCSA-N	0	3	323.245	2.399	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)CCC(C)(C)C	ZINC000246272128	288317930	/nfs/dbraw/zinc/31/79/30/288317930.db2.gz	VAJVETNWLZYNIX-KBPBESRZSA-N	0	3	302.484	2.311	10	0		DEAEHN
C[C@H](C(=O)N1CCCc2ccccc21)N1CCN2CCC[C@H]2C1	ZINC000246239195	289281848	/nfs/dbraw/zinc/28/18/48/289281848.db2.gz	DCQCTJWPGQFQDX-WBVHZDCISA-N	0	3	313.445	2.134	10	0		DEAEHN
COC[C@H](Cc1ccccc1)N[C@H]1CCO[C@@H]1c1ccnn1C	ZINC000284647851	293115855	/nfs/dbraw/zinc/11/58/55/293115855.db2.gz	OODJDGTXTBBICR-BQFCYCMXSA-N	0	3	315.417	2.097	10	0		DEAEHN
COc1ccc(CC(=O)NCCN2CCCC[C@H]2C)cc1F	ZINC000046858116	295116094	/nfs/dbraw/zinc/11/60/94/295116094.db2.gz	ANKSGYJXYWEYKO-CYBMUJFWSA-N	0	3	308.397	2.367	10	0		DEAEHN
C[C@H]1CC[C@@H](C(=O)N(Cc2ccco2)C2CCN(C)CC2)O1	ZINC000154622337	300029603	/nfs/dbraw/zinc/02/96/03/300029603.db2.gz	LPNGGWKXPUUQEC-BBRMVZONSA-N	0	3	306.406	2.270	10	0		DEAEHN
COc1ccc([C@@H](NC[C@H](C)CS(C)(=O)=O)C2CC2)cc1	ZINC000176956398	325751157	/nfs/dbraw/zinc/75/11/57/325751157.db2.gz	HJCWROMCBMPLMX-LRDDRELGSA-N	0	3	311.447	2.417	10	0		DEAEHN
COC[C@H](C)CN[C@H](CCSC)c1nnc2ccccn21	ZINC000187629209	332979541	/nfs/dbraw/zinc/97/95/41/332979541.db2.gz	JPKCBJMXZWJZRZ-CHWSQXEVSA-N	0	3	308.451	2.396	10	0		DEAEHN
CN1C[C@@H](O)C[C@H](C(O)(c2cccs2)c2cccs2)C1	ZINC000584631763	337376999	/nfs/dbraw/zinc/37/69/99/337376999.db2.gz	UAQNWQBJYFDZLR-RYUDHWBXSA-N	0	3	309.456	2.358	10	0		DEAEHN
CC(C)(C)CCCCNC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000105253500	518642218	/nfs/dbraw/zinc/64/22/18/518642218.db2.gz	VAZRLVMMMKPYOQ-OAHLLOKOSA-N	0	3	313.486	2.349	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1C	ZINC000248901388	519737927	/nfs/dbraw/zinc/73/79/27/519737927.db2.gz	HICAZQLXUUOISK-PXAZEXFGSA-N	0	3	317.433	2.412	10	0		DEAEHN
CCC[C@H](C(=O)N1CCN([C@@H](C)c2cccnc2)CC1)N(C)C	ZINC000162156543	520975562	/nfs/dbraw/zinc/97/55/62/520975562.db2.gz	UCITVWDUHGQWDL-DOTOQJQBSA-N	0	3	318.465	2.017	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)CCc2ccccc2OC)C1	ZINC000105174160	521645165	/nfs/dbraw/zinc/64/51/65/521645165.db2.gz	NKCJGSOGPMWINJ-INIZCTEOSA-N	0	3	319.449	2.363	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCCOc2cccc(Cl)c2)C1	ZINC000170831509	522102843	/nfs/dbraw/zinc/10/28/43/522102843.db2.gz	YJHAPVFWFAGDBZ-ZDUSSCGKSA-N	0	3	311.813	2.064	10	0		DEAEHN
CCc1nc(CNC(=O)N(CCN(C)C)CC(C)C)cs1	ZINC000107854563	522330193	/nfs/dbraw/zinc/33/01/93/522330193.db2.gz	XRABNBAPJDUHBE-UHFFFAOYSA-N	0	3	312.483	2.435	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(CC(=O)N2CCCC[C@@H]2C)C1	ZINC000105922558	522600874	/nfs/dbraw/zinc/60/08/74/522600874.db2.gz	LXZJKEWXTPJHAU-HOTGVXAUSA-N	0	3	318.465	2.483	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(C)Cc1ccccc1F	ZINC000111864459	523831806	/nfs/dbraw/zinc/83/18/06/523831806.db2.gz	CODFRMUZIITNLL-HNNXBMFYSA-N	0	3	323.412	2.078	10	0		DEAEHN
Cc1cc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)n(C)n1	ZINC000245624380	525197558	/nfs/dbraw/zinc/19/75/58/525197558.db2.gz	GBCLOIWTHJKUTN-ZBFHGGJFSA-N	0	3	313.405	2.295	10	0		DEAEHN
Cc1ccc([C@H](C)CNC(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000162209170	525878631	/nfs/dbraw/zinc/87/86/31/525878631.db2.gz	PUEFPJCYNURSSO-WBVHZDCISA-N	0	3	319.449	2.071	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCCCNC1=O	ZINC000328874852	527893654	/nfs/dbraw/zinc/89/36/54/527893654.db2.gz	RVBQOZFLXPKEKK-KFWWJZLASA-N	0	3	307.438	2.218	10	0		DEAEHN
CCC1(CC)CN(CCCN2CCCCC2)CC[S@@]1=O	ZINC000189221296	529080798	/nfs/dbraw/zinc/08/07/98/529080798.db2.gz	GDPBEVHJUJTCBY-HXUWFJFHSA-N	0	3	300.512	2.486	10	0		DEAEHN
CC(C)(C)c1nnc(CN[C@@H]2CCC[C@@H]2[C@@H]2COCCN2)s1	ZINC000261978219	534926665	/nfs/dbraw/zinc/92/66/65/534926665.db2.gz	RIXIQTGFXKHCCW-XQQFMLRXSA-N	0	3	324.494	2.082	10	0		DEAEHN
CC(C)N1CCC[C@H](N2C[C@@H](CO)[C@@H](c3ccsc3)C2)C1=O	ZINC000249551257	535178718	/nfs/dbraw/zinc/17/87/18/535178718.db2.gz	HZRVZDXQGQIIRA-XHSDSOJGSA-N	0	3	322.474	2.155	10	0		DEAEHN
CC(F)(F)c1ccc(C(=O)NCCNc2ccncc2)cc1	ZINC000449812053	535211916	/nfs/dbraw/zinc/21/19/16/535211916.db2.gz	BIUNXDFYQGKOLH-UHFFFAOYSA-N	0	3	305.328	2.457	10	0		DEAEHN
CCCN(CCN1CCCC1)C(=O)NCCc1cc(C)no1	ZINC000358025465	535332246	/nfs/dbraw/zinc/33/22/46/535332246.db2.gz	AJFRFOPMBIJAEO-UHFFFAOYSA-N	0	3	308.426	2.043	10	0		DEAEHN
CCOC(=O)[C@@H](C)[C@H](C)NCc1ccc2c(c1)sc(=O)n2C	ZINC000192720552	535440367	/nfs/dbraw/zinc/44/03/67/535440367.db2.gz	AMKFGMAYSHIAAF-QWRGUYRKSA-N	0	3	322.430	2.277	10	0		DEAEHN
COCCOc1ccc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1	ZINC000247470039	536609395	/nfs/dbraw/zinc/60/93/95/536609395.db2.gz	RPKSANWGWUISAN-ZBFHGGJFSA-N	0	3	318.417	2.021	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COCc2ccccc2F)CC[C@@H]1C	ZINC000251602777	536730548	/nfs/dbraw/zinc/73/05/48/536730548.db2.gz	FVWAKVPPKJNRKK-JLJPHGGASA-N	0	3	311.397	2.060	10	0		DEAEHN
COc1ccc2c(c1NC(=O)N1CCN3CCC[C@H]3C1)CCC2	ZINC000191333185	537022919	/nfs/dbraw/zinc/02/29/19/537022919.db2.gz	FBTDHFXQRLFXAT-AWEZNQCLSA-N	0	3	315.417	2.496	10	0		DEAEHN
COCC[C@H](N)C(=O)N[C@@H]1CCSc2ccc(Cl)cc21	ZINC000052792481	625105050	/nfs/dbraw/zinc/10/50/50/625105050.db2.gz	YXFTWQSVQAUVPM-NWDGAFQWSA-N	0	3	314.838	2.357	10	0		DEAEHN
CCC[N@H+](CCC[N-]C(=O)C(F)(F)F)C[C@@H]1CCCCO1	ZINC000091619088	635144582	/nfs/dbraw/zinc/14/45/82/635144582.db2.gz	ADGKNHIXCSMBHB-LBPRGKRZSA-N	0	3	310.360	2.336	10	0		DEAEHN
CCC[N@@H+](CCC[N-]C(=O)C(F)(F)F)C[C@@H]1CCCCO1	ZINC000091619088	635144584	/nfs/dbraw/zinc/14/45/84/635144584.db2.gz	ADGKNHIXCSMBHB-LBPRGKRZSA-N	0	3	310.360	2.336	10	0		DEAEHN
Cc1ccc2c(c1)CC[C@@H]2N[C@H]1CCN(C2CCOCC2)C1=O	ZINC000747816182	638480675	/nfs/dbraw/zinc/48/06/75/638480675.db2.gz	UUUPRFDYBYHUNF-ROUUACIJSA-N	0	3	314.429	2.352	10	0		DEAEHN
COC(=O)/C(C)=C\CN(CCO)[C@H]1CCCc2ccccc21	ZINC000748815600	638595188	/nfs/dbraw/zinc/59/51/88/638595188.db2.gz	CBHRQVOVPIZUPP-QXSWTLKVSA-N	0	3	303.402	2.478	10	0		DEAEHN
O=C(CN1C[C@H]2CCCC[C@@H]2C1)Nc1ccc2[nH]c(=O)[nH]c2c1	ZINC000750062900	638707750	/nfs/dbraw/zinc/70/77/50/638707750.db2.gz	SQJKGBSXBSKTTC-VXGBXAGGSA-N	0	3	314.389	2.329	10	0		DEAEHN
Cn1ccnc1[C@]([O-])(C[NH2+][C@H]1CC[C@@H]1C1CCC1)C(F)(F)F	ZINC000800979593	645326256	/nfs/dbraw/zinc/32/62/56/645326256.db2.gz	SQGDDYJHEFMTLB-MBNYWOFBSA-N	0	3	317.355	2.338	10	0		DEAEHN
CCNS(=O)(=O)CCNCc1ccc(C(C)(C)C)s1	ZINC000226454069	646573850	/nfs/dbraw/zinc/57/38/50/646573850.db2.gz	GPXSYVWYPPPZLL-UHFFFAOYSA-N	0	3	304.481	2.075	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)Nc1ccc(Cl)nc1	ZINC000228934323	647407132	/nfs/dbraw/zinc/40/71/32/647407132.db2.gz	WZLJMKQYGROZGR-IXPVHAAZSA-N	0	3	309.797	2.206	10	0		DEAEHN
Cc1cc(=O)[n-]c(-c2ccc(NC(=O)CCCCC[NH3+])cc2)n1	ZINC000154747013	648084579	/nfs/dbraw/zinc/08/45/79/648084579.db2.gz	DBYOILIAQZTJRW-UHFFFAOYSA-N	0	3	314.389	2.203	10	0		DEAEHN
C[C@@H]([NH2+]CCCOC(=O)N=C(N)[O-])C12CC3CC(CC(C3)C1)C2	ZINC000183642217	649126355	/nfs/dbraw/zinc/12/63/55/649126355.db2.gz	XPHFROVYNRSZRU-SFCYXTAJSA-N	0	3	323.437	2.376	10	0		DEAEHN
Cn1nccc1CCC(=O)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000125621976	684147199	/nfs/dbraw/zinc/14/71/99/684147199.db2.gz	VLHWVWSTPLNNGU-QGZVFWFLSA-N	0	3	313.401	2.170	10	0		DEAEHN
Cc1cc(C)c(N2CC[C@@H](N[C@@H]3CCCOC3)C2=O)c(C)c1	ZINC000189457648	684380744	/nfs/dbraw/zinc/38/07/44/684380744.db2.gz	UCWNUXRAFUMXTG-HZPDHXFCSA-N	0	3	302.418	2.486	10	0		DEAEHN
CC(C)(C)OC(=O)[C@@H]1CCN(C[C@@H]2CC3(CCC3)C(=O)O2)C1	ZINC000192059998	684441265	/nfs/dbraw/zinc/44/12/65/684441265.db2.gz	ILAXHIZZXSOEIN-OLZOCXBDSA-N	0	3	309.406	2.136	10	0		DEAEHN
CC(C)Nc1ncnc2c1ncn2CN1CCSC[C@@H](C)C1	ZINC000192180159	684443504	/nfs/dbraw/zinc/44/35/04/684443504.db2.gz	RSCWYZBLBAOFSC-LBPRGKRZSA-N	0	3	320.466	2.289	10	0		DEAEHN
O=C(CCc1ccncn1)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000192432304	684449595	/nfs/dbraw/zinc/44/95/95/684449595.db2.gz	GJUIUPCNSQHJMQ-QGZVFWFLSA-N	0	3	311.385	2.227	10	0		DEAEHN
Cc1cc(C)n(CCN2CCC[C@H](c3nnc(C)o3)[C@@H]2C)n1	ZINC000886077625	691998621	/nfs/dbraw/zinc/99/86/21/691998621.db2.gz	AOMOKSLYZAQOGB-ZFWWWQNUSA-N	0	3	303.410	2.459	10	0		DEAEHN
CC[C@H](NCc1c(Br)cnn1C)[C@H]1CCCOC1	ZINC000724007670	777219571	/nfs/dbraw/zinc/21/95/71/777219571.db2.gz	KAMASRYQHHXXRP-JQWIXIFHSA-N	0	3	316.243	2.477	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@@H](CCO)C1CCCC1	ZINC000725106778	777586066	/nfs/dbraw/zinc/58/60/66/777586066.db2.gz	ZNPWPLLVDKBTKB-LBPRGKRZSA-N	0	3	316.243	2.213	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCn2c(C(C)C)nnc2[C@@H]1C	ZINC000439781423	781809026	/nfs/dbraw/zinc/80/90/26/781809026.db2.gz	MEWPNUKONKBJAR-KBPBESRZSA-N	0	3	319.453	2.179	10	0		DEAEHN
COC[C@@]1(C)CCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724074658	787348590	/nfs/dbraw/zinc/34/85/90/787348590.db2.gz	QJRBRTNELZIKFT-VHSXEESVSA-N	0	3	305.287	2.293	10	0		DEAEHN
Cc1ncsc1CCNCc1cn(C)nc1Br	ZINC000712490590	792190107	/nfs/dbraw/zinc/19/01/07/792190107.db2.gz	HUYMYXYQEXMNQY-UHFFFAOYSA-N	0	3	315.240	2.280	10	0		DEAEHN
Cc1c(Cl)cccc1S(=O)(=O)N1CCNCCC1(C)C	ZINC000712516531	792191835	/nfs/dbraw/zinc/19/18/35/792191835.db2.gz	ZYJXNGFZRYZRTQ-UHFFFAOYSA-N	0	3	316.854	2.411	10	0		DEAEHN
COc1cc(CNCC[C@@H]2CCCS2(=O)=O)ccc1Cl	ZINC000714350150	792310383	/nfs/dbraw/zinc/31/03/83/792310383.db2.gz	CCYHNUUTQZJOBU-LBPRGKRZSA-N	0	3	317.838	2.406	10	0		DEAEHN
CCCn1cc([C@@H](C)NCCN(C)Cc2ccccc2)nn1	ZINC000715881230	792530644	/nfs/dbraw/zinc/53/06/44/792530644.db2.gz	IVRBIJGUUACPGF-OAHLLOKOSA-N	0	3	301.438	2.471	10	0		DEAEHN
CCCN(CCN[C@H]1CCC1(OC)OC)C(=O)OC(C)(C)C	ZINC000710946359	1081177755	/nfs/dbraw/zinc/17/77/55/1081177755.db2.gz	JGICLJAWSHSHPB-ZDUSSCGKSA-N	0	3	316.442	2.375	10	0		DEAEHN
CN1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cccc(Br)n1	ZINC000720829369	1086186134	/nfs/dbraw/zinc/18/61/34/1086186134.db2.gz	MBYXZIBDHZXNEQ-NWDGAFQWSA-N	0	3	324.222	2.153	10	0		DEAEHN
O=S1(=O)CCC(NCc2csc(C(F)(F)F)c2)CC1	ZINC000703289470	1086492815	/nfs/dbraw/zinc/49/28/15/1086492815.db2.gz	BQAXTHLCZZHZQE-UHFFFAOYSA-N	0	3	313.366	2.434	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1nccnc1Cl	ZINC000703358571	1086493867	/nfs/dbraw/zinc/49/38/67/1086493867.db2.gz	QGBBHROPTRRNJU-LBPRGKRZSA-N	0	3	318.808	2.380	10	0		DEAEHN
COc1ncccc1CNC[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000711426592	1087101143	/nfs/dbraw/zinc/10/11/43/1087101143.db2.gz	UFUGVODJOAQYEX-XBXGTLAGSA-N	0	3	321.421	2.483	10	0		DEAEHN
O[C@@H]1CCCC[C@@H]1N1CCN(c2nc3ccccc3o2)CC1	ZINC000179286533	1090496304	/nfs/dbraw/zinc/49/63/04/1090496304.db2.gz	RPTONQJAMOOVIQ-LSDHHAIUSA-N	0	3	301.390	2.253	10	0		DEAEHN
Cc1nc2ccccc2nc1NC[C@@H](O)CN1CCCCC1	ZINC000174684945	282089151	/nfs/dbraw/zinc/08/91/51/282089151.db2.gz	DMMJVEMJVXBSQL-CQSZACIVSA-N	0	3	300.406	2.197	10	0		DEAEHN
CCN[C@H](c1ccc(OC)cc1)[C@H](C)Sc1nnnn1C	ZINC000081843738	192330103	/nfs/dbraw/zinc/33/01/03/192330103.db2.gz	NSSTYHNPVLNVFN-GWCFXTLKSA-N	0	3	307.423	2.050	10	0		DEAEHN
CCN[C@@H]1c2ccccc2OC[C@H]1Sc1nnc(C)n1C	ZINC000081886244	192334285	/nfs/dbraw/zinc/33/42/85/192334285.db2.gz	KQLGVTNEXYQEQY-ZIAGYGMSSA-N	0	3	304.419	2.327	10	0		DEAEHN
O=C1CCCC1S(=O)(=O)c1ccccc1Br	ZINC000081907569	192338073	/nfs/dbraw/zinc/33/80/73/192338073.db2.gz	NZOMYKZZAHAZDF-NSHDSACASA-N	0	3	303.177	2.344	10	0		DEAEHN
CC[C@H](CS(=O)(=O)c1ccc(Br)cc1)NC	ZINC000081933847	192340594	/nfs/dbraw/zinc/34/05/94/192340594.db2.gz	LWLUIHJBRCSLMB-SNVBAGLBSA-N	0	3	306.225	2.221	10	0		DEAEHN
CCC[C@@H](N)CS(=O)(=O)c1ccc(Br)cc1	ZINC000081933210	192341611	/nfs/dbraw/zinc/34/16/11/192341611.db2.gz	IXIALAKJZMWCQA-SNVBAGLBSA-N	0	3	306.225	2.350	10	0		DEAEHN
CCN[C@@H](CC)[C@H](C)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000081935452	192342291	/nfs/dbraw/zinc/34/22/91/192342291.db2.gz	JXJKRZJZAPGQPN-AAEUAGOBSA-N	0	3	313.419	2.008	10	0		DEAEHN
Cc1nn(C)c(Sc2ncccc2Br)c1CN	ZINC000079445532	185172047	/nfs/dbraw/zinc/17/20/47/185172047.db2.gz	ORMDPYCGMPLGTA-UHFFFAOYSA-N	0	3	313.224	2.496	10	0		DEAEHN
CC(C)(C)c1nc(CS(C)(=O)=O)sc1CNC1CC1	ZINC000082439819	185182897	/nfs/dbraw/zinc/18/28/97/185182897.db2.gz	HTGSCSYCLCOBQW-UHFFFAOYSA-N	0	3	302.465	2.237	10	0		DEAEHN
Cn1cc([C@H](CN)Oc2ccc(Br)c(F)c2)cn1	ZINC000087430492	185224596	/nfs/dbraw/zinc/22/45/96/185224596.db2.gz	CTVATAIWIHWOKD-LBPRGKRZSA-N	0	3	314.158	2.401	10	0		DEAEHN
CC(C)(C)c1nnsc1C(=O)NC[C@@H](N)c1ccccc1	ZINC000087455614	185225589	/nfs/dbraw/zinc/22/55/89/185225589.db2.gz	GSRVJVRKNGGXCU-LLVKDONJSA-N	0	3	304.419	2.265	10	0		DEAEHN
NC1CN(CC(=O)Nc2cc(Cl)c(Cl)cc2Cl)C1	ZINC000087590194	185229020	/nfs/dbraw/zinc/22/90/20/185229020.db2.gz	OUEVLGHZMAUFMM-UHFFFAOYSA-N	0	3	308.596	2.228	10	0		DEAEHN
NC1(C(=O)Nc2ccccc2I)CCC1	ZINC000088050200	185238027	/nfs/dbraw/zinc/23/80/27/185238027.db2.gz	QXALLZJLPUYSQQ-UHFFFAOYSA-N	0	3	316.142	2.111	10	0		DEAEHN
CC[C@H](N)CS(=O)(=O)Cc1ccc(Br)cc1	ZINC000088074791	185238930	/nfs/dbraw/zinc/23/89/30/185238930.db2.gz	ZMKHRUIOSOXAEW-NSHDSACASA-N	0	3	306.225	2.101	10	0		DEAEHN
COc1ccc(CSc2nnc3ccccn32)cc1CN	ZINC000087827729	185232506	/nfs/dbraw/zinc/23/25/06/185232506.db2.gz	QECFRMHLPNDQEW-UHFFFAOYSA-N	0	3	300.387	2.489	10	0		DEAEHN
Nc1nc2ccc(CN3CCN(CC4CC4)CC3)cc2s1	ZINC000087848059	185233485	/nfs/dbraw/zinc/23/34/85/185233485.db2.gz	KBNJFGXCYOJWJY-UHFFFAOYSA-N	0	3	302.447	2.406	10	0		DEAEHN
CN1CCCC[C@H]1CNC(=O)c1ccc2nc(N)sc2c1	ZINC000087847540	185233496	/nfs/dbraw/zinc/23/34/96/185233496.db2.gz	UNJRIGRTWZSXSN-NSHDSACASA-N	0	3	304.419	2.093	10	0		DEAEHN
CCc1cnc(CCNC(=O)NC[C@H]2CCCN2CC)s1	ZINC000175365209	282194871	/nfs/dbraw/zinc/19/48/71/282194871.db2.gz	NDPOWNFBYJAGDX-GFCCVEGCSA-N	0	3	310.467	2.032	10	0		DEAEHN
CCCCN(C)S(=O)(=O)c1ccc(CNCC(C)C)o1	ZINC000088543552	185256764	/nfs/dbraw/zinc/25/67/64/185256764.db2.gz	LFCJOTTWNCXJFN-UHFFFAOYSA-N	0	3	302.440	2.446	10	0		DEAEHN
C[C@@H]1CC[C@@H](NCc2ccc(S(=O)(=O)N(C)C)o2)C[C@@H]1C	ZINC000088540919	185255621	/nfs/dbraw/zinc/25/56/21/185255621.db2.gz	ZKTRANAJFMYRFJ-FRRDWIJNSA-N	0	3	314.451	2.444	10	0		DEAEHN
CC[C@@H](C)C[C@@H](C)NCc1ccc(S(=O)(=O)N(C)C)o1	ZINC000088541001	185255901	/nfs/dbraw/zinc/25/59/01/185255901.db2.gz	KQHJLMZWLLCKLE-VXGBXAGGSA-N	0	3	302.440	2.444	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1ccc(Cl)nc1	ZINC000177378409	282206041	/nfs/dbraw/zinc/20/60/41/282206041.db2.gz	YHIGDBPNFMKSRN-ZDUSSCGKSA-N	0	3	310.829	2.361	10	0		DEAEHN
CCCN[C@H](c1ccc(COC)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000088567527	185258185	/nfs/dbraw/zinc/25/81/85/185258185.db2.gz	RGSYOTKTDPYZEN-JKSUJKDBSA-N	0	3	311.447	2.308	10	0		DEAEHN
O=C(NC[C@H]1CCCCN1Cc1ccccc1)N[C@@H]1CCOC1	ZINC000179147606	282215448	/nfs/dbraw/zinc/21/54/48/282215448.db2.gz	XSBQIWFSQRIXKK-IAGOWNOFSA-N	0	3	317.433	2.129	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)NCCCc1ccccn1	ZINC000179221307	282218933	/nfs/dbraw/zinc/21/89/33/282218933.db2.gz	ZWENDHLRSXWDRK-MRXNPFEDSA-N	0	3	304.438	2.188	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000090293221	185289890	/nfs/dbraw/zinc/28/98/90/185289890.db2.gz	UECIBYZCZMGQPC-UHFFFAOYSA-N	0	3	323.245	2.366	10	0		DEAEHN
Cc1cc(Cl)c(NC(=O)[C@H]2COC[C@@H]2N)c2cccnc12	ZINC000090379769	185293694	/nfs/dbraw/zinc/29/36/94/185293694.db2.gz	MMTFFXUEVJXRQZ-JQWIXIFHSA-N	0	3	305.765	2.109	10	0		DEAEHN
CN[C@H]1COC[C@H]1c1nc(-c2ccccc2Br)no1	ZINC000090423588	185295297	/nfs/dbraw/zinc/29/52/97/185295297.db2.gz	YPNHTPBCOZIYFH-KOLCDFICSA-N	0	3	324.178	2.201	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1ccc(OC(F)F)c(Cl)c1	ZINC000090436571	185296280	/nfs/dbraw/zinc/29/62/80/185296280.db2.gz	SPRCFJLCMGKOEU-WCBMZHEXSA-N	0	3	320.723	2.114	10	0		DEAEHN
C[C@]1(C(=O)N(Cc2ccc(Cl)cc2)C2CC2)COC[C@H]1N	ZINC000090592015	185305959	/nfs/dbraw/zinc/30/59/59/185305959.db2.gz	KFPPDRUYVLNKPB-ZBFHGGJFSA-N	0	3	308.809	2.195	10	0		DEAEHN
COc1cccc(CC(=O)N2CCCSC[C@H]2CN(C)C)c1	ZINC000090700116	185310471	/nfs/dbraw/zinc/31/04/71/185310471.db2.gz	NTUWWGOJLCUAFI-OAHLLOKOSA-N	0	3	322.474	2.133	10	0		DEAEHN
CN(C)C[C@H]1CSCCCN1C(=O)NCCc1ccccc1	ZINC000090700229	185310561	/nfs/dbraw/zinc/31/05/61/185310561.db2.gz	TXUIZKIGDKYKLW-INIZCTEOSA-N	0	3	321.490	2.308	10	0		DEAEHN
Cc1cc(CN[C@@]2(C)CCS(=O)(=O)C2)c2ccccc2n1	ZINC000092345560	185313506	/nfs/dbraw/zinc/31/35/06/185313506.db2.gz	WDDDCIIFNCXYEM-INIZCTEOSA-N	0	3	304.415	2.210	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N)[C@H](Sc1nnc(C)n1C)CC2	ZINC000092389957	185315658	/nfs/dbraw/zinc/31/56/58/185315658.db2.gz	MNMVNYMVEUWXGV-KGLIPLIRSA-N	0	3	304.419	2.239	10	0		DEAEHN
CN(C)[C@H](Cc1ccccc1)C(=O)NCCN1CCCCCC1	ZINC000106457456	282251072	/nfs/dbraw/zinc/25/10/72/282251072.db2.gz	ABTFARALYHYFGW-GOSISDBHSA-N	0	3	317.477	2.152	10	0		DEAEHN
N[C@@H]1C(=O)Nc2cc(OCCN3CCCCC3)c(Cl)cc21	ZINC000092770051	185339550	/nfs/dbraw/zinc/33/95/50/185339550.db2.gz	SOGZRLDNDBGBQV-AWEZNQCLSA-N	0	3	309.797	2.157	10	0		DEAEHN
CNCc1csc(S(=O)(=O)NC2C(C)(C)C2(C)C)c1	ZINC000092833282	185344920	/nfs/dbraw/zinc/34/49/20/185344920.db2.gz	SQMIGNPBEVGWCA-UHFFFAOYSA-N	0	3	302.465	2.180	10	0		DEAEHN
CN[C@H]1c2cc(OC)ccc2C[C@H]1Sc1nnc(C)n1C	ZINC000092911768	185348552	/nfs/dbraw/zinc/34/85/52/185348552.db2.gz	UKEUKTBTKMRZCD-KGLIPLIRSA-N	0	3	304.419	2.110	10	0		DEAEHN
COC1(CNC(=O)N[C@H](CN(C)C)c2ccccc2)CCC1	ZINC000181414563	199293856	/nfs/dbraw/zinc/29/38/56/199293856.db2.gz	XMXJOUQKUFBIDM-OAHLLOKOSA-N	0	3	305.422	2.158	10	0		DEAEHN
C/C=C/c1ccc(OCC(=O)NCCN2CCCC2)c(OC)c1	ZINC000052851609	539339930	/nfs/dbraw/zinc/33/99/30/539339930.db2.gz	LMQBRGSXHGSERP-ZZXKWVIFSA-N	0	3	318.417	2.319	10	0		DEAEHN
CN(Cc1ccc(CO)o1)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000328630314	529984403	/nfs/dbraw/zinc/98/44/03/529984403.db2.gz	JFLKDCSFAANCPZ-YJBOKZPZSA-N	0	3	315.417	2.292	10	0		DEAEHN
Cc1nc(CN2CCC(CNCc3cocn3)CC2)oc1C	ZINC000192311972	282341677	/nfs/dbraw/zinc/34/16/77/282341677.db2.gz	RRNFLDLRLFJWFW-UHFFFAOYSA-N	0	3	304.394	2.281	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccc(F)cc1Br	ZINC000194725690	530063743	/nfs/dbraw/zinc/06/37/43/530063743.db2.gz	QBANYBWYSMYYPB-JTQLQIEISA-N	0	3	315.186	2.412	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000193800746	282357731	/nfs/dbraw/zinc/35/77/31/282357731.db2.gz	CDGOWDLYYCIRRF-HNNXBMFYSA-N	0	3	319.449	2.334	10	0		DEAEHN
CCNC(=O)CCN1CC[C@H](c2cc(OC)cc(OC)c2)C1	ZINC000083249873	192369160	/nfs/dbraw/zinc/36/91/60/192369160.db2.gz	WIPQVWKQLCJKFO-ZDUSSCGKSA-N	0	3	306.406	2.019	10	0		DEAEHN
CN(Cc1cccc(Cl)c1Cl)C(=O)COC1(C)CNC1	ZINC000098060411	539435871	/nfs/dbraw/zinc/43/58/71/539435871.db2.gz	WTKSXLSPWRRCNF-UHFFFAOYSA-N	0	3	317.216	2.330	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H](COC)c2ccccc2)C1	ZINC000245392619	282384619	/nfs/dbraw/zinc/38/46/19/282384619.db2.gz	BDUUTUNCBCUDDM-HZPDHXFCSA-N	0	3	305.422	2.158	10	0		DEAEHN
COc1ncc(C)cc1NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000245433594	282387640	/nfs/dbraw/zinc/38/76/40/282387640.db2.gz	QFBILLIQMZHTAG-QWHCGFSZSA-N	0	3	306.410	2.345	10	0		DEAEHN
Cc1nc(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)sc1C	ZINC000245484641	282391193	/nfs/dbraw/zinc/39/11/93/282391193.db2.gz	HURMKTKXPORPNL-GXFFZTMASA-N	0	3	310.467	2.384	10	0		DEAEHN
CCNCc1cc(Cl)cc(Cl)c1OC[C@@H](O)COC	ZINC000069053655	190794684	/nfs/dbraw/zinc/79/46/84/190794684.db2.gz	DDPCEETUJPJCST-NSHDSACASA-N	0	3	308.205	2.489	10	0		DEAEHN
N[C@@H]1CC(=O)N(C2CC2)[C@H]1c1cc(Br)cs1	ZINC000069798378	190818750	/nfs/dbraw/zinc/81/87/50/190818750.db2.gz	JAHLHJZJNRRVGS-LDYMZIIASA-N	0	3	301.209	2.274	10	0		DEAEHN
CCCCCNC(=O)[C@H](C)N1CCC[C@H]1Cn1ccnc1C	ZINC000247074681	535067646	/nfs/dbraw/zinc/06/76/46/535067646.db2.gz	OUMOOTPGTFSMHG-HOCLYGCPSA-N	0	3	306.454	2.351	10	0		DEAEHN
COC(=O)c1cnc(-c2ccc(F)cc2)nc1[C@H]1CCCN1	ZINC000616579912	362893977	/nfs/dbraw/zinc/89/39/77/362893977.db2.gz	SJEQBIGYUPWCGJ-CYBMUJFWSA-N	0	3	301.321	2.494	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCN[C@@H](c2cccc(F)c2)C1	ZINC000616656883	362904771	/nfs/dbraw/zinc/90/47/71/362904771.db2.gz	UTUJGMGQEVKHGX-OAHLLOKOSA-N	0	3	323.412	2.297	10	0		DEAEHN
NC[C@@H]1CCc2ccccc2N1S(=O)(=O)c1ccccc1	ZINC000616670555	362907271	/nfs/dbraw/zinc/90/72/71/362907271.db2.gz	VNBNPPDSIPIWEY-AWEZNQCLSA-N	0	3	302.399	2.155	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC[C@@H](C)CS(C)(=O)=O)c1	ZINC000176954650	539628663	/nfs/dbraw/zinc/62/86/63/539628663.db2.gz	JOXUSZXQEKICCJ-NEPJUHHUSA-N	0	3	315.435	2.035	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)[C@H](C)N[C@@H](C)[C@@H]1CCCO1	ZINC000183226014	539660018	/nfs/dbraw/zinc/66/00/18/539660018.db2.gz	SPIBJLYAJNUMLC-MKBNYLNASA-N	0	3	304.390	2.373	10	0		DEAEHN
C[C@H](NCC(=O)Nc1ccc(OC(F)F)cc1)[C@H]1CCCO1	ZINC000183179770	539660530	/nfs/dbraw/zinc/66/05/30/539660530.db2.gz	MEFJBAURILISTG-GXFFZTMASA-N	0	3	314.332	2.384	10	0		DEAEHN
CN[C@H](c1cccc2c1OC(C)(C)C2)[C@@H]1CCS(=O)(=O)C1	ZINC000080507484	192164243	/nfs/dbraw/zinc/16/42/43/192164243.db2.gz	YZLNFPCBGVIACZ-OCCSQVGLSA-N	0	3	309.431	2.095	10	0		DEAEHN
CN1C(=O)CC[C@@H](N)[C@H]1c1ccc(Br)cc1F	ZINC000070985037	190928899	/nfs/dbraw/zinc/92/88/99/190928899.db2.gz	LWVDSYRBEYYEFV-ZYHUDNBSSA-N	0	3	301.159	2.209	10	0		DEAEHN
CN[C@@H](C)c1cc(Br)ccc1SC[C@@H](O)CO	ZINC000130150778	185941438	/nfs/dbraw/zinc/94/14/38/185941438.db2.gz	MTSLZULYEVFGPY-WPRPVWTQSA-N	0	3	320.252	2.175	10	0		DEAEHN
CN[C@@H](c1sc(C)cc1Br)[C@@H]1COCCO1	ZINC000083678374	192378457	/nfs/dbraw/zinc/37/84/57/192378457.db2.gz	ZRCSAXKMQLGOEB-VHSXEESVSA-N	0	3	306.225	2.495	10	0		DEAEHN
COC(=O)COC[C@@H](N)c1cc(Br)sc1C	ZINC000084007043	192395480	/nfs/dbraw/zinc/39/54/80/192395480.db2.gz	OHSVCFAADIPVIM-MRVPVSSYSA-N	0	3	308.197	2.008	10	0		DEAEHN
CCN[C@H](C[S@@](=O)C1CCOCC1)c1ccc(OC)cc1	ZINC000084055311	192397384	/nfs/dbraw/zinc/39/73/84/192397384.db2.gz	BOJBRCCLLLIWDR-IERDGZPVSA-N	0	3	311.447	2.274	10	0		DEAEHN
CCN(CC)S(=O)(=O)c1cc(CNC(C)C)cc(F)c1F	ZINC000138252744	186015721	/nfs/dbraw/zinc/01/57/21/186015721.db2.gz	OJCGPENTGOUKLV-UHFFFAOYSA-N	0	3	320.405	2.493	10	0		DEAEHN
C[C@H]1CCC[C@H](C)N1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138363300	186016495	/nfs/dbraw/zinc/01/64/95/186016495.db2.gz	BIYHFQPEQKKNTL-UWVGGRQHSA-N	0	3	318.389	2.375	10	0		DEAEHN
CC(C)CCN(C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138707101	186018245	/nfs/dbraw/zinc/01/82/45/186018245.db2.gz	NRBQZWRVYDHVDX-UHFFFAOYSA-N	0	3	306.378	2.090	10	0		DEAEHN
CN[C@H](Cc1cc(OC)ncn1)c1ccc(Br)o1	ZINC000138719149	186018556	/nfs/dbraw/zinc/01/85/56/186018556.db2.gz	OZIALQVYQJBSOM-SECBINFHSA-N	0	3	312.167	2.344	10	0		DEAEHN
CCC1(CC)[C@H](OC)C[C@H]1N(C)C[C@@H](C)CS(C)(=O)=O	ZINC000140711901	186028404	/nfs/dbraw/zinc/02/84/04/186028404.db2.gz	NXFWVGJQCPDSRN-MGPQQGTHSA-N	0	3	305.484	2.193	10	0		DEAEHN
CN[C@@H](C)c1ccc(N2CCN(c3nccs3)CC2)cn1	ZINC000148141469	186042899	/nfs/dbraw/zinc/04/28/99/186042899.db2.gz	KXRVVTSAPBSHQS-LBPRGKRZSA-N	0	3	303.435	2.145	10	0		DEAEHN
CCN[C@@H](C)c1cccc(S(=O)(=O)NN2CCCCC2)c1	ZINC000148538834	186045168	/nfs/dbraw/zinc/04/51/68/186045168.db2.gz	VEZBLDTWKQKFHA-ZDUSSCGKSA-N	0	3	311.451	2.036	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)[C@H]2C[C@H]2C)C1	ZINC000252031930	539784106	/nfs/dbraw/zinc/78/41/06/539784106.db2.gz	ZNTCTQDHOOVABG-XBFCOCLRSA-N	0	3	307.463	2.388	10	0		DEAEHN
CCCN[C@H]1CCCc2sc([C@@H]3CCS(=O)(=O)C3)nc21	ZINC000150265471	186056229	/nfs/dbraw/zinc/05/62/29/186056229.db2.gz	XHTCTECJDOLXBK-MNOVXSKESA-N	0	3	314.476	2.422	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2cc(C)ccc2Br)C1	ZINC000163970468	186143887	/nfs/dbraw/zinc/14/38/87/186143887.db2.gz	KRJXDMHAABPPSA-JOYOIKCWSA-N	0	3	313.195	2.073	10	0		DEAEHN
CCS(=O)(=O)C[C@H](C)N[C@H](C)Cc1c(F)cccc1F	ZINC000164006500	186146072	/nfs/dbraw/zinc/14/60/72/186146072.db2.gz	NIPMQKFKPVZVHW-MNOVXSKESA-N	0	3	305.390	2.309	10	0		DEAEHN
C[C@H](C(=O)Nc1cccc(CN)c1)[S@@](=O)c1ccccc1	ZINC000155907248	186122148	/nfs/dbraw/zinc/12/21/48/186122148.db2.gz	OXCHWMGOONADTG-GTJPDFRWSA-N	0	3	302.399	2.280	10	0		DEAEHN
Cc1ccc([S@@](=O)CC(=O)Nc2cccc(CN)c2)cc1	ZINC000155915971	186122885	/nfs/dbraw/zinc/12/28/85/186122885.db2.gz	KLSQQBWQOAIBKX-OAQYLSRUSA-N	0	3	302.399	2.200	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1ccc(Br)cc1C	ZINC000159552623	186126972	/nfs/dbraw/zinc/12/69/72/186126972.db2.gz	QHPYZCSFWIXLKR-NSHDSACASA-N	0	3	315.211	2.450	10	0		DEAEHN
C[C@@H](NCCn1ccnn1)c1ccc(Br)s1	ZINC000159673302	186134686	/nfs/dbraw/zinc/13/46/86/186134686.db2.gz	QMLWRWNAMKXVRX-MRVPVSSYSA-N	0	3	301.213	2.453	10	0		DEAEHN
CCOc1cc2c(cc1CNC[C@H](C)[S@](C)=O)O[C@H](C)C2	ZINC000159672065	186134782	/nfs/dbraw/zinc/13/47/82/186134782.db2.gz	MYZWBCSIUXDVET-SMDDFHAHSA-N	0	3	311.447	2.265	10	0		DEAEHN
O=C(Cc1ccccc1Br)N1CCN2CCC[C@@H]2C1	ZINC000171471149	186165190	/nfs/dbraw/zinc/16/51/90/186165190.db2.gz	VWCMQUNCHPTCIU-CYBMUJFWSA-N	0	3	323.234	2.298	10	0		DEAEHN
CC(C)N(C)C(=O)[C@H](C)N[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000181911135	186217936	/nfs/dbraw/zinc/21/79/36/186217936.db2.gz	GZKNJHSIDXSXMV-KGLIPLIRSA-N	0	3	315.421	2.173	10	0		DEAEHN
CC(=O)Nc1cc(NC(=O)N2CCN3CCC[C@H]3C2)ccc1C	ZINC000171889939	198001852	/nfs/dbraw/zinc/00/18/52/198001852.db2.gz	WKKKVHOKLJMIKB-HNNXBMFYSA-N	0	3	316.405	2.265	10	0		DEAEHN
O=C(NCCc1ccc(Cl)cc1)N1CCN2CCC[C@@H]2C1	ZINC000171897368	198004387	/nfs/dbraw/zinc/00/43/87/198004387.db2.gz	ZBGRZLJPBWGMEI-OAHLLOKOSA-N	0	3	307.825	2.372	10	0		DEAEHN
COc1ccc(Cl)cc1CNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171902549	198005297	/nfs/dbraw/zinc/00/52/97/198005297.db2.gz	SEPMOXBGJKMOAA-CQSZACIVSA-N	0	3	323.824	2.338	10	0		DEAEHN
CC[C@H](Cc1ccccc1)NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171906968	198006301	/nfs/dbraw/zinc/00/63/01/198006301.db2.gz	YJMXPTGXHSBZGK-IAGOWNOFSA-N	0	3	301.434	2.497	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1cc(F)ccc1F	ZINC000171908411	198006342	/nfs/dbraw/zinc/00/63/42/198006342.db2.gz	SREGDUIGBZVEDH-LBPRGKRZSA-N	0	3	313.348	2.197	10	0		DEAEHN
CN1CC[C@H](N[C@@H]2CCc3c2cccc3Br)C1=O	ZINC000172087568	198037954	/nfs/dbraw/zinc/03/79/54/198037954.db2.gz	BJJPUHXRDYITGS-OLZOCXBDSA-N	0	3	309.207	2.257	10	0		DEAEHN
CN(C[C@H]1CCCN(C)C1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000172124994	198042742	/nfs/dbraw/zinc/04/27/42/198042742.db2.gz	CBJCUPALWWXZRL-GOEBONIOSA-N	0	3	317.433	2.493	10	0		DEAEHN
COCCCN(C)CCNc1cc(C)nc(-c2cccnc2)n1	ZINC000172771562	198147771	/nfs/dbraw/zinc/14/77/71/198147771.db2.gz	ACUKVQNSIWDZJO-UHFFFAOYSA-N	0	3	315.421	2.227	10	0		DEAEHN
C[C@@H](O)C1CCN(C[C@@H]2CN(c3ccccc3)C(=O)O2)CC1	ZINC000172801871	198150545	/nfs/dbraw/zinc/15/05/45/198150545.db2.gz	ANXRNLOPMTWBSW-CZUORRHYSA-N	0	3	304.390	2.105	10	0		DEAEHN
CC(C)Nc1ncccc1C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000173180419	198193127	/nfs/dbraw/zinc/19/31/27/198193127.db2.gz	OHZZJEYZEXWZDT-KGLIPLIRSA-N	0	3	304.438	2.457	10	0		DEAEHN
COC[C@@H](C)C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000173706778	198243070	/nfs/dbraw/zinc/24/30/70/198243070.db2.gz	KLZRBAPXVUGWEI-NVXWUHKLSA-N	0	3	304.434	2.392	10	0		DEAEHN
Cn1cc(CN[C@H]2CCc3cc(Br)ccc3C2)nn1	ZINC000389830296	540132486	/nfs/dbraw/zinc/13/24/86/540132486.db2.gz	YCSCPQKLRPMYKH-ZDUSSCGKSA-N	0	3	321.222	2.225	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1ccc2c(c1)CCC2	ZINC000110086385	355740850	/nfs/dbraw/zinc/74/08/50/355740850.db2.gz	BSVUXLKAVBGTLY-QGZVFWFLSA-N	0	3	317.433	2.408	10	0		DEAEHN
CCOCc1ccc(CNC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170829429	355994648	/nfs/dbraw/zinc/99/46/48/355994648.db2.gz	PFNSEBKFDJRRAW-MRXNPFEDSA-N	0	3	305.422	2.069	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cccc3c2OCCO3)C1	ZINC000194354156	356238432	/nfs/dbraw/zinc/23/84/32/356238432.db2.gz	CUHHJFJGVGCHRF-GFCCVEGCSA-N	0	3	305.378	2.064	10	0		DEAEHN
CCC[C@H](C)CN(C)CC(=O)N1CCC[C@@H](C(=O)OCC)C1	ZINC000245948478	356311008	/nfs/dbraw/zinc/31/10/08/356311008.db2.gz	WGGSMOYHWMFYIM-LSDHHAIUSA-N	0	3	312.454	2.156	10	0		DEAEHN
CN(CCNC1CN(C(=O)OC(C)(C)C)C1)Cc1ccccc1	ZINC000306883787	356405987	/nfs/dbraw/zinc/40/59/87/356405987.db2.gz	PEPIQVAWIBGYJR-UHFFFAOYSA-N	0	3	319.449	2.327	10	0		DEAEHN
O[C@H](CN1CCOC[C@@H]1[C@H]1CCCC[C@@H]1O)C1CCCCC1	ZINC000408043322	283165760	/nfs/dbraw/zinc/16/57/60/283165760.db2.gz	JVZNYNCJXJECAX-ZJPYXAASSA-N	0	3	311.466	2.180	10	0		DEAEHN
Brc1ccccc1CN1CC[C@@H]2OCCN[C@H]2C1	ZINC000404054527	283164458	/nfs/dbraw/zinc/16/44/58/283164458.db2.gz	GHFBQEFQYVBBSP-KBPBESRZSA-N	0	3	311.223	2.012	10	0		DEAEHN
N=C(N)c1cccc(Sc2nnc(C3CC3)n2C2CC2)n1	ZINC000081622543	192304006	/nfs/dbraw/zinc/30/40/06/192304006.db2.gz	LOKRADSOLBFAGL-UHFFFAOYSA-N	0	3	300.391	2.321	10	0		DEAEHN
Brc1nnc(N[C@H]2CCN3CCCC[C@@H]23)s1	ZINC000081664126	192307712	/nfs/dbraw/zinc/30/77/12/192307712.db2.gz	AYHLBZUWJYDJPG-YUMQZZPRSA-N	0	3	303.229	2.339	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)NCCOc1ncc(Cl)cc1Cl	ZINC000236972862	202103473	/nfs/dbraw/zinc/10/34/73/202103473.db2.gz	ZDLBMJIQJSDKSP-LDYMZIIASA-N	0	3	320.220	2.257	10	0		DEAEHN
CCc1cnc(CCNC(=O)C[C@H](N)c2ccccc2)s1	ZINC000237008848	202120515	/nfs/dbraw/zinc/12/05/15/202120515.db2.gz	NVINMVAESAXJOU-AWEZNQCLSA-N	0	3	303.431	2.454	10	0		DEAEHN
CN(C)CCOCCNCc1ccsc1Br	ZINC000388755608	356706375	/nfs/dbraw/zinc/70/63/75/356706375.db2.gz	RIBMFYNLQFWQBX-UHFFFAOYSA-N	0	3	307.257	2.178	10	0		DEAEHN
C[C@]1(CNc2ncncc2C#N)CCCN1Cc1ccccc1	ZINC000397915435	356719241	/nfs/dbraw/zinc/71/92/41/356719241.db2.gz	JZEOWSUYKVFLBG-GOSISDBHSA-N	0	3	307.401	2.237	10	0		DEAEHN
O=C(NCCOCC1CCC1)N1CCC[C@H]1CN1CCCCC1	ZINC000584694358	357291256	/nfs/dbraw/zinc/29/12/56/357291256.db2.gz	UEJXFPNQQZGKMU-KRWDZBQOSA-N	0	3	323.481	2.463	10	0		DEAEHN
Cc1c(CNC2CC2)cccc1S(=O)(=O)N1CC[C@@H](C)C1	ZINC000088986268	192682858	/nfs/dbraw/zinc/68/28/58/192682858.db2.gz	UXKXXCZBUMWPKL-GFCCVEGCSA-N	0	3	308.447	2.278	10	0		DEAEHN
Cc1ccc2oc(C(=O)Nc3cnn(CCN(C)C)c3)cc2n1	ZINC000591016191	357660709	/nfs/dbraw/zinc/66/07/09/357660709.db2.gz	QKBXHXYLTQUGCX-UHFFFAOYSA-N	0	3	313.361	2.147	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H](C)c1ccc(-n2cncn2)cc1)N(C)C	ZINC000179334215	199017691	/nfs/dbraw/zinc/01/76/91/199017691.db2.gz	DSWZTXKXPVMMSM-CJNGLKHVSA-N	0	3	315.421	2.175	10	0		DEAEHN
CC[C@H](CCO)CNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179487848	199044321	/nfs/dbraw/zinc/04/43/21/199044321.db2.gz	UBJHDMRLAXOOBL-DJIMGWMZSA-N	0	3	319.449	2.140	10	0		DEAEHN
CCCCN([C@H](C)CC)S(=O)(=O)c1n[nH]c(C)c1CNC	ZINC000089006037	192693029	/nfs/dbraw/zinc/69/30/29/192693029.db2.gz	ZNAAZDVZABDOTQ-LLVKDONJSA-N	0	3	316.471	2.027	10	0		DEAEHN
COc1cc(C)c([C@@H](C)N[C@H]2CCc3ncnn3C2)cc1OC	ZINC000180606195	199182853	/nfs/dbraw/zinc/18/28/53/199182853.db2.gz	RKHBFTAURRYPED-OLZOCXBDSA-N	0	3	316.405	2.269	10	0		DEAEHN
Cc1cc(Cl)c(C(=O)N2CCO[C@H](CN(C)C)C2)cc1C	ZINC000180804386	199211664	/nfs/dbraw/zinc/21/16/64/199211664.db2.gz	UFRFVHZSSFUTIN-CYBMUJFWSA-N	0	3	310.825	2.359	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)NCc2ccc(Cl)cn2)CN1C1CC1	ZINC000180916976	199227657	/nfs/dbraw/zinc/22/76/57/199227657.db2.gz	JYWJESMDMSIBLQ-ZWNOBZJWSA-N	0	3	308.813	2.159	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCCCCCCO)[C@@H]1c1ccccc1	ZINC000180997031	199238478	/nfs/dbraw/zinc/23/84/78/199238478.db2.gz	DCQSMHCGTTXXJV-IRXDYDNUSA-N	0	3	319.449	2.284	10	0		DEAEHN
CNCc1csc(S(=O)(=O)N2CCC[C@H](C)CC2)c1	ZINC000089036645	192712017	/nfs/dbraw/zinc/71/20/17/192712017.db2.gz	USWHDLBAUOXGLE-NSHDSACASA-N	0	3	302.465	2.278	10	0		DEAEHN
CN(C[C@H](O)c1ccccc1Br)CC1(CO)CC1	ZINC000186772674	200008206	/nfs/dbraw/zinc/00/82/06/200008206.db2.gz	SLDAFLSDTUAGKJ-ZDUSSCGKSA-N	0	3	314.223	2.187	10	0		DEAEHN
Cc1cnc([C@H](C)CNC(=O)N2CCN3CCC[C@@H]3C2)s1	ZINC000187088507	200058974	/nfs/dbraw/zinc/05/89/74/200058974.db2.gz	LXIIKBQPCLPYKU-DGCLKSJQSA-N	0	3	308.451	2.045	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1ccnc(F)c1F)c1ccccc1	ZINC000187658845	200141027	/nfs/dbraw/zinc/14/10/27/200141027.db2.gz	HYWLDTQIMICMED-CYBMUJFWSA-N	0	3	305.328	2.393	10	0		DEAEHN
COCCO[C@H]1CCN(Cc2cnc(-c3ccccc3)[nH]2)C1	ZINC000188828866	200309180	/nfs/dbraw/zinc/30/91/80/200309180.db2.gz	AAOHPNKHXVTFHU-INIZCTEOSA-N	0	3	301.390	2.314	10	0		DEAEHN
Cc1cnccc1CNC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000190071988	200482885	/nfs/dbraw/zinc/48/28/85/200482885.db2.gz	SCEIYSCLAZIHKI-KRWDZBQOSA-N	0	3	312.417	2.492	10	0		DEAEHN
C[C@H](NC(=O)N[C@H]1CCN(C2CC2)C1)c1ccc2c(c1)OCO2	ZINC000604165057	360887519	/nfs/dbraw/zinc/88/75/19/360887519.db2.gz	YPKJDZTTZDNROZ-AAEUAGOBSA-N	0	3	317.389	2.012	10	0		DEAEHN
Cc1cc(N(C)C[C@@H]2CCS(=O)(=O)C2)c2ccccc2n1	ZINC000607148458	361072072	/nfs/dbraw/zinc/07/20/72/361072072.db2.gz	SMIJUFNUVWFQLQ-ZDUSSCGKSA-N	0	3	304.415	2.414	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@@H]2C[C@H](O)C23CCC3)c2ccccc21	ZINC000621764256	364539028	/nfs/dbraw/zinc/53/90/28/364539028.db2.gz	BWYZLMOSMUGUPW-UAGQMJEPSA-N	0	3	300.402	2.377	10	0		DEAEHN
O=C(C[C@H]1CNCCO1)Nc1c2ncsc2ccc1Cl	ZINC000091299739	193034808	/nfs/dbraw/zinc/03/48/08/193034808.db2.gz	VAAZUWIITZSDPH-QMMMGPOBSA-N	0	3	311.794	2.267	10	0		DEAEHN
COCCNCc1cnn(-c2ccncc2)c1C(F)(F)F	ZINC000091337094	193043578	/nfs/dbraw/zinc/04/35/78/193043578.db2.gz	JMLTVIWJUIXXEJ-UHFFFAOYSA-N	0	3	300.284	2.022	10	0		DEAEHN
C[C@H](NC[C@@H]1CSCCS1)c1ccc2[nH]c(=O)[nH]c2c1	ZINC000091368921	193047096	/nfs/dbraw/zinc/04/70/96/193047096.db2.gz	GTLHJSBPSZVHNC-GXSJLCMTSA-N	0	3	309.460	2.355	10	0		DEAEHN
OC1CC(CNCc2cc3c(cc2Br)OCO3)C1	ZINC000091415652	193053114	/nfs/dbraw/zinc/05/31/14/193053114.db2.gz	FBLXZGLBGYIFNW-UHFFFAOYSA-N	0	3	314.179	2.038	10	0		DEAEHN
COc1cc(C[NH2+]CC2CC(O)C2)cc(Br)c1[O-]	ZINC000091524500	193068971	/nfs/dbraw/zinc/06/89/71/193068971.db2.gz	LNWKRSDXYILHMI-UHFFFAOYSA-N	0	3	316.195	2.024	10	0		DEAEHN
Cc1cc([C@@H](N)[C@H]2CCS(=O)(=O)C2)ccc1Br	ZINC000091474292	193061454	/nfs/dbraw/zinc/06/14/54/193061454.db2.gz	GHIDKBRZSYKJKC-CMPLNLGQSA-N	0	3	318.236	2.192	10	0		DEAEHN
C[C@H](NC[C@@H]1COCCN1C)c1cc(Br)cs1	ZINC000624176887	365320575	/nfs/dbraw/zinc/32/05/75/365320575.db2.gz	UQPKPXMFEVIANR-GXSJLCMTSA-N	0	3	319.268	2.492	10	0		DEAEHN
C[C@H](NC[C@H]1COCCN1C)c1cc(Br)cs1	ZINC000624176893	365321044	/nfs/dbraw/zinc/32/10/44/365321044.db2.gz	UQPKPXMFEVIANR-ONGXEEELSA-N	0	3	319.268	2.492	10	0		DEAEHN
CCCc1c(Cl)ncnc1NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000091677235	193088734	/nfs/dbraw/zinc/08/87/34/193088734.db2.gz	PQEIFQVIYZGXGP-VXGBXAGGSA-N	0	3	310.829	2.358	10	0		DEAEHN
C=COCCCNCc1cnc2cnc(Br)cn12	ZINC000092049141	193148385	/nfs/dbraw/zinc/14/83/85/193148385.db2.gz	BGBXDLBDUKBXLR-UHFFFAOYSA-N	0	3	311.183	2.132	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)c2cccc(C(F)(F)F)n2)CCN1C	ZINC000449941307	241271828	/nfs/dbraw/zinc/27/18/28/241271828.db2.gz	PICFJDCYEDNAQF-NXEZZACHSA-N	0	3	301.312	2.313	10	0		DEAEHN
COC[C@@H](N)Cc1cn(Cc2ccc(Cl)c(Cl)c2)nn1	ZINC000630587043	367741531	/nfs/dbraw/zinc/74/15/31/367741531.db2.gz	VXLJVMDPVXAEQQ-JTQLQIEISA-N	0	3	315.204	2.149	10	0		DEAEHN
COc1ccc(CN2CCC(N3CCO[C@H](C)C3)CC2)cc1O	ZINC000092079288	193155483	/nfs/dbraw/zinc/15/54/83/193155483.db2.gz	KZFDSYLXGNWLLG-CQSZACIVSA-N	0	3	320.433	2.086	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)c(C)s1	ZINC000092113861	193161466	/nfs/dbraw/zinc/16/14/66/193161466.db2.gz	VPBZPRKJHFPIKJ-UWVGGRQHSA-N	0	3	302.465	2.052	10	0		DEAEHN
CNCc1cc(C)c(C)c(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)c1	ZINC000092113951	193161551	/nfs/dbraw/zinc/16/15/51/193161551.db2.gz	ZYUVRHXWWLUXOS-STQMWFEESA-N	0	3	310.463	2.299	10	0		DEAEHN
C[NH2+]Cc1ccc(S(=O)(=O)[N-]Cc2cccs2)c(F)c1	ZINC000092115759	193163154	/nfs/dbraw/zinc/16/31/54/193163154.db2.gz	LIPVRFZUVZAYLN-UHFFFAOYSA-N	0	3	314.407	2.085	10	0		DEAEHN
CCC(CC)N(C)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115702	193163369	/nfs/dbraw/zinc/16/33/69/193163369.db2.gz	GPMWVLQQYOEBFA-UHFFFAOYSA-N	0	3	302.415	2.354	10	0		DEAEHN
CCCN(C)S(=O)(=O)c1ccc(CNC(C)C)cc1F	ZINC000092115613	193163378	/nfs/dbraw/zinc/16/33/78/193163378.db2.gz	HZHAXMXAZFXSNH-UHFFFAOYSA-N	0	3	302.415	2.354	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1N(C)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115974	193164254	/nfs/dbraw/zinc/16/42/54/193164254.db2.gz	VRVBLUKWXVQWNH-BXUZGUMPSA-N	0	3	314.426	2.484	10	0		DEAEHN
Cc1ccc(N(C)S(=O)(=O)c2ccc(CN)cc2F)cc1	ZINC000092116036	193164449	/nfs/dbraw/zinc/16/44/49/193164449.db2.gz	YOOTVPTVKWQRMF-UHFFFAOYSA-N	0	3	308.378	2.418	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)CN[C@H]2[C@@H](C)[C@H](C)O[C@H]2C)cc1	ZINC000528760183	284002887	/nfs/dbraw/zinc/00/28/87/284002887.db2.gz	WODNKDHWNTWBQD-PYERRIOISA-N	0	3	304.390	2.229	10	0		DEAEHN
COCCN([C@@H](C)COC)[C@@H](CN)c1cc(Cl)cs1	ZINC000093095611	193203539	/nfs/dbraw/zinc/20/35/39/193203539.db2.gz	DJCZVQFSAZLMTC-JQWIXIFHSA-N	0	3	306.859	2.385	10	0		DEAEHN
CCN(CC)CCN1C(=[NH2+])NC[C@H]1c1ccc([O-])c(Cl)c1	ZINC000093382287	193240715	/nfs/dbraw/zinc/24/07/15/193240715.db2.gz	OKCRJGBTVZGROO-ZDUSSCGKSA-N	0	3	310.829	2.059	10	0		DEAEHN
CCNC(=O)c1ccc(Cl)cc1NC(=O)CNCC1CC1	ZINC000262610956	203350256	/nfs/dbraw/zinc/35/02/56/203350256.db2.gz	IZSNEFOELUNRDR-UHFFFAOYSA-N	0	3	309.797	2.028	10	0		DEAEHN
COc1ccc2c(c1)CCC[C@H]2NCC(C)(C)S(C)(=O)=O	ZINC000093520711	193262650	/nfs/dbraw/zinc/26/26/50/193262650.db2.gz	AZFKDCLDOAXXHZ-OAHLLOKOSA-N	0	3	311.447	2.485	10	0		DEAEHN
CC(C)(CNC[C@@H]1Cc2cc(Cl)ccc2O1)S(C)(=O)=O	ZINC000093519897	193262687	/nfs/dbraw/zinc/26/26/87/193262687.db2.gz	ICAZRESFSXMGOI-LBPRGKRZSA-N	0	3	317.838	2.056	10	0		DEAEHN
CC(C)CO[C@@H]1C[C@@H](NCC(C)(C)S(C)(=O)=O)C1(C)C	ZINC000093523114	193263193	/nfs/dbraw/zinc/26/31/93/193263193.db2.gz	YBFZRASWHNNPRH-CHWSQXEVSA-N	0	3	305.484	2.239	10	0		DEAEHN
CC[C@@H](CO)N1CCN(Cc2cc(C)c(OC)c(C)c2)CC1	ZINC000093739937	193298210	/nfs/dbraw/zinc/29/82/10/193298210.db2.gz	LYYNFDLKBGUDHC-KRWDZBQOSA-N	0	3	306.450	2.201	10	0		DEAEHN
CC[C@H](CO)N1CCN(C/C=C/c2ccccc2OC)CC1	ZINC000093740096	193298750	/nfs/dbraw/zinc/29/87/50/193298750.db2.gz	CFLXQNUAEGALFY-DBWMJRBXSA-N	0	3	304.434	2.097	10	0		DEAEHN
CCC[NH2+][C@]1(C(=O)[O-])CCC[C@H](N(CC)[C@@H](C)COC)C1	ZINC000093751441	193299193	/nfs/dbraw/zinc/29/91/93/193299193.db2.gz	YYMWCFACUIZHEF-OFQRWUPVSA-N	0	3	300.443	2.109	10	0		DEAEHN
CCN[C@H](c1ccc(Cl)c(OC)c1)[C@H]1CN(C)CCN1C	ZINC000094009140	193338271	/nfs/dbraw/zinc/33/82/71/193338271.db2.gz	MYTSIOIJHPGMTE-GDBMZVCRSA-N	0	3	311.857	2.245	10	0		DEAEHN
CCC(C)(C)NC(=O)[C@@H](C)Oc1c(F)cc(CN)cc1F	ZINC000094346267	193363148	/nfs/dbraw/zinc/36/31/48/193363148.db2.gz	XIMKMOZREDASHD-SECBINFHSA-N	0	3	300.349	2.496	10	0		DEAEHN
CNC(=O)CCCOc1c(F)cc(CNC(C)C)cc1F	ZINC000094347364	193363254	/nfs/dbraw/zinc/36/32/54/193363254.db2.gz	HFXLQDYCJCZULQ-UHFFFAOYSA-N	0	3	300.349	2.368	10	0		DEAEHN
CC[C@](C)(N)C(=O)NCc1ccc(OCC(F)(F)F)cc1	ZINC000094237051	193353802	/nfs/dbraw/zinc/35/38/02/193353802.db2.gz	WNNVLTZXJNEYFW-ZDUSSCGKSA-N	0	3	304.312	2.371	10	0		DEAEHN
CC[C@H](N)c1c(C)nn([C@@H]2CCC[C@H](S(C)(=O)=O)C2)c1C	ZINC000094643961	193389474	/nfs/dbraw/zinc/38/94/74/193389474.db2.gz	NDEDJLQQHHSTJY-RDBSUJKOSA-N	0	3	313.467	2.438	10	0		DEAEHN
[NH3+]C1(c2ncc(-c3nc(CCC(F)(F)F)no3)[n-]2)CCC1	ZINC000094492265	193373319	/nfs/dbraw/zinc/37/33/19/193373319.db2.gz	QKPNVSFWGZUTLC-UHFFFAOYSA-N	0	3	301.272	2.293	10	0		DEAEHN
NC1(c2nc(-c3nc(CCC(F)(F)F)no3)c[nH]2)CCC1	ZINC000094492265	193373321	/nfs/dbraw/zinc/37/33/21/193373321.db2.gz	QKPNVSFWGZUTLC-UHFFFAOYSA-N	0	3	301.272	2.293	10	0		DEAEHN
c1ccc2c(c1)CNC[C@H]2c1nc([C@H]2CSCCO2)no1	ZINC000094501789	193374331	/nfs/dbraw/zinc/37/43/31/193374331.db2.gz	WKQHFVXXMOCLCI-CHWSQXEVSA-N	0	3	303.387	2.109	10	0		DEAEHN
CCCN[C@H](C)c1cc(F)ccc1O[C@@H]1CCS(=O)(=O)C1	ZINC000094620464	193385076	/nfs/dbraw/zinc/38/50/76/193385076.db2.gz	MTPOFSXQGAWRTM-DGCLKSJQSA-N	0	3	315.410	2.452	10	0		DEAEHN
Cc1cc(F)c([C@@H](C)NC[C@@H]2CCS(=O)(=O)C2)cc1F	ZINC000094736789	193394121	/nfs/dbraw/zinc/39/41/21/193394121.db2.gz	CQNMVLLQCXLLND-MNOVXSKESA-N	0	3	303.374	2.359	10	0		DEAEHN
CCN1C[C@H](N[C@H](C[C@@H]2CCOC2)c2ccccc2)CC1=O	ZINC000453356508	245092539	/nfs/dbraw/zinc/09/25/39/245092539.db2.gz	LSKHBCLLHNYORB-USXIJHARSA-N	0	3	302.418	2.365	10	0		DEAEHN
CC[C@H](C)NCc1cc(Br)ccc1OCC(N)=O	ZINC000020873076	182250847	/nfs/dbraw/zinc/25/08/47/182250847.db2.gz	XDXHBRBHFYDTBU-VIFPVBQESA-N	0	3	315.211	2.201	10	0		DEAEHN
C[C@H]1CN([C@@H](CN)c2cc(Br)ccc2F)CCO1	ZINC000022218051	182313803	/nfs/dbraw/zinc/31/38/03/182313803.db2.gz	RVBNBQPMPDEYGR-ZANVPECISA-N	0	3	317.202	2.309	10	0		DEAEHN
CC(=O)c1cccc(O[C@H](C)C(=O)N2CCC[C@@H]2CN(C)C)c1	ZINC000267504766	206111687	/nfs/dbraw/zinc/11/16/87/206111687.db2.gz	HCJCQKBRHCQDTJ-GDBMZVCRSA-N	0	3	318.417	2.209	10	0		DEAEHN
C[C@@H]1CN(C(=O)c2ccc(Cl)cc2)C[C@@H](C)N1CCN(C)C	ZINC000036126281	182805180	/nfs/dbraw/zinc/80/51/80/182805180.db2.gz	YNDXUKNDNDEKHH-ZIAGYGMSSA-N	0	3	323.868	2.436	10	0		DEAEHN
Cc1ccc([C@H](C)CNC(=O)N2C[C@@H]3CCN(C)[C@@H]3C2)cc1	ZINC000458432855	248307395	/nfs/dbraw/zinc/30/73/95/248307395.db2.gz	XCYJPLROXDKOBZ-HYVNUMGLSA-N	0	3	301.434	2.444	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2ccc(Br)cc2C)C1	ZINC000040629974	183111114	/nfs/dbraw/zinc/11/11/14/183111114.db2.gz	PRMDUFBJMLSABK-PWSUYJOCSA-N	0	3	313.195	2.073	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2ccc(OC(F)F)c(Cl)c2)C1	ZINC000040850851	183142220	/nfs/dbraw/zinc/14/22/20/183142220.db2.gz	HYNYFFDVJNESSD-WPRPVWTQSA-N	0	3	320.723	2.257	10	0		DEAEHN
O=S(=O)([N-]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(Cl)cc1F	ZINC000040746359	183128969	/nfs/dbraw/zinc/12/89/69/183128969.db2.gz	APBBSOWOHALRSS-ZACCUICWSA-N	0	3	318.801	2.040	10	0		DEAEHN
COCc1c(Br)cccc1NC(=O)C(C)(C)N	ZINC000040924861	183149265	/nfs/dbraw/zinc/14/92/65/183149265.db2.gz	ASDJWWMIRZEVPB-UHFFFAOYSA-N	0	3	301.184	2.271	10	0		DEAEHN
COc1cc(CN2CCC[C@@H]([NH3+])C2)cc(Br)c1[O-]	ZINC000041027549	183157763	/nfs/dbraw/zinc/15/77/63/183157763.db2.gz	JEJAUZSISJQWEZ-SNVBAGLBSA-N	0	3	315.211	2.086	10	0		DEAEHN
O=S1(=O)CC[C@@H](Nc2c3c(nc4ccccc42)CCC3)C1	ZINC000041473009	183193461	/nfs/dbraw/zinc/19/34/61/183193461.db2.gz	AMAIFCSVKHHGRZ-LLVKDONJSA-N	0	3	302.399	2.323	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)C(=O)NCCN1CCCC[C@H]1C	ZINC000041664551	183213821	/nfs/dbraw/zinc/21/38/21/183213821.db2.gz	DQCVTIXVRFQLML-OAHLLOKOSA-N	0	3	317.433	2.233	10	0		DEAEHN
CCNC(=O)[C@@H](C)Oc1c(Br)cccc1CNC	ZINC000042411505	183265226	/nfs/dbraw/zinc/26/52/26/183265226.db2.gz	NWGLQBKWBWFQNT-SECBINFHSA-N	0	3	315.211	2.072	10	0		DEAEHN
CCCN(CC(F)(F)F)S(=O)(=O)c1ccccc1CN	ZINC000042768575	183306638	/nfs/dbraw/zinc/30/66/38/183306638.db2.gz	WBSNYVRCMWNXFS-UHFFFAOYSA-N	0	3	310.341	2.108	10	0		DEAEHN
CC(C)N(CC(=O)Nc1cccc(CN)c1)CC(F)(F)F	ZINC000042741188	183303534	/nfs/dbraw/zinc/30/35/34/183303534.db2.gz	YGMZWHKHTJZPCM-UHFFFAOYSA-N	0	3	303.328	2.357	10	0		DEAEHN
NCc1cccc(NC(=O)CN(CC(F)(F)F)C2CC2)c1	ZINC000042740752	183303891	/nfs/dbraw/zinc/30/38/91/183303891.db2.gz	SILVJPCFWNSVDM-UHFFFAOYSA-N	0	3	301.312	2.111	10	0		DEAEHN
COc1cccc([C@@H](CN)N(C)Cc2cscn2)c1OC	ZINC000042863799	183315331	/nfs/dbraw/zinc/31/53/31/183315331.db2.gz	RFTHMLMSJIDHJC-CYBMUJFWSA-N	0	3	307.419	2.292	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccccc1Cl)N1CCCC[C@@H]1C(N)=O	ZINC000043052365	183332793	/nfs/dbraw/zinc/33/27/93/183332793.db2.gz	ZCALABZPAGXTBD-KFWWJZLASA-N	0	3	309.841	2.458	10	0		DEAEHN
CN(CCCNC(=O)Nc1nncs1)Cc1ccccc1	ZINC000043130089	183339670	/nfs/dbraw/zinc/33/96/70/183339670.db2.gz	ZQYRIGMENATPMF-UHFFFAOYSA-N	0	3	305.407	2.182	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1sccc1C)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043248009	183347376	/nfs/dbraw/zinc/34/73/76/183347376.db2.gz	CKTDYXVTKLAENH-MCIONIFRSA-N	0	3	309.479	2.388	10	0		DEAEHN
CCN(CC(=O)N(C)C)[C@@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043252921	183347638	/nfs/dbraw/zinc/34/76/38/183347638.db2.gz	ZRKFJTOABHSWAO-NOZJJQNGSA-N	0	3	303.859	2.200	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccc(Br)s1)N1CCN(C)CC1	ZINC000043258584	183348059	/nfs/dbraw/zinc/34/80/59/183348059.db2.gz	BQAMDGSPYVZYIT-CABZTGNLSA-N	0	3	318.284	2.146	10	0		DEAEHN
NC[C@@H](Sc1nc[nH]n1)c1ccc(Br)s1	ZINC000043283323	183350903	/nfs/dbraw/zinc/35/09/03/183350903.db2.gz	DJQWVRVGBPZEEA-ZCFIWIBFSA-N	0	3	305.226	2.421	10	0		DEAEHN
CCCN[C@@H](c1ccc(F)cc1F)[C@H]1CCS(=O)(=O)C1	ZINC000043301239	183352734	/nfs/dbraw/zinc/35/27/34/183352734.db2.gz	MCAYHRALHRHKHE-IINYFYTJSA-N	0	3	303.374	2.440	10	0		DEAEHN
Cc1ccc([C@H]([C@H](C)N)N2CCN(c3nccs3)CC2)o1	ZINC000043363897	183357337	/nfs/dbraw/zinc/35/73/37/183357337.db2.gz	WKBGOXIUHLARHJ-JSGCOSHPSA-N	0	3	306.435	2.255	10	0		DEAEHN
CC(C)CN(CCC(N)=S)[C@@H](C)C(=O)NC1CCCCC1	ZINC000043418484	183361062	/nfs/dbraw/zinc/36/10/62/183361062.db2.gz	RJXKDZGOBDRSAC-ZDUSSCGKSA-N	0	3	313.511	2.458	10	0		DEAEHN
CN[C@H](CN(C)CC(F)(F)F)c1ccc2c(c1)OCCO2	ZINC000043900634	183388944	/nfs/dbraw/zinc/38/89/44/183388944.db2.gz	FZZWYIWURDMRHR-LLVKDONJSA-N	0	3	304.312	2.212	10	0		DEAEHN
COc1cc(CNCC2(O)CCCCC2)cc2c1OCCO2	ZINC000102426239	193887213	/nfs/dbraw/zinc/88/72/13/193887213.db2.gz	IGZNPWATUIBXTQ-UHFFFAOYSA-N	0	3	307.390	2.251	10	0		DEAEHN
COCCN(CCN(C)C)C(=O)N[C@@H](C)c1ccccc1C	ZINC000105067489	194069279	/nfs/dbraw/zinc/06/92/79/194069279.db2.gz	HEWLSMFZMRNMFZ-HNNXBMFYSA-N	0	3	307.438	2.276	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)c2ccccc2F)C[C@@H]1CC	ZINC000105838270	194144557	/nfs/dbraw/zinc/14/45/57/194144557.db2.gz	UWPRQXZOUGFKAF-YJBOKZPZSA-N	0	3	324.440	2.292	10	0		DEAEHN
O[C@H](COc1ccccc1)CN1CCC(Cn2cccn2)CC1	ZINC000105886739	194157679	/nfs/dbraw/zinc/15/76/79/194157679.db2.gz	UZHFVTYNUIWKKV-KRWDZBQOSA-N	0	3	315.417	2.035	10	0		DEAEHN
CC(C)(C(N)=S)N1CCN(c2nc3ccccc3s2)CC1	ZINC000109471777	194267531	/nfs/dbraw/zinc/26/75/31/194267531.db2.gz	UFAKDOTWUVOSOR-UHFFFAOYSA-N	0	3	320.487	2.483	10	0		DEAEHN
CCC(CC)(C(N)=S)C(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000110272741	194318645	/nfs/dbraw/zinc/31/86/45/194318645.db2.gz	LUOILTRNHPZNJB-ZDUSSCGKSA-N	0	3	311.495	2.166	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccccc1Cl)N1CCNC(=O)C1(C)C	ZINC000110653912	194346741	/nfs/dbraw/zinc/34/67/41/194346741.db2.gz	APOAYFQFOOCHMP-UONOGXRCSA-N	0	3	309.841	2.329	10	0		DEAEHN
CCN([C@H]1CCCNC1)S(=O)(=O)c1ccc(F)cc1Cl	ZINC000110941596	194372738	/nfs/dbraw/zinc/37/27/38/194372738.db2.gz	ZJAUIEFKINCNMT-NSHDSACASA-N	0	3	320.817	2.242	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)Nc1nccs1	ZINC000057205912	184029419	/nfs/dbraw/zinc/02/94/19/184029419.db2.gz	QZOJPZOOLOEARW-CYBMUJFWSA-N	0	3	304.419	2.438	10	0		DEAEHN
Cc1ccc2c(c1)CC[C@H]2NC(=O)NCCNc1ccncc1	ZINC000535260796	284888776	/nfs/dbraw/zinc/88/87/76/284888776.db2.gz	KERLFVZHNGPDFZ-QGZVFWFLSA-N	0	3	310.401	2.211	10	0		DEAEHN
CN1CCCC[C@@H]1CNC(=O)c1ccc(Br)cn1	ZINC000061874483	184191684	/nfs/dbraw/zinc/19/16/84/184191684.db2.gz	TWPOXQZPULIQNB-LLVKDONJSA-N	0	3	312.211	2.058	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(NC[C@H]2CCCN2CC)n1	ZINC000061536833	184172807	/nfs/dbraw/zinc/17/28/07/184172807.db2.gz	NWCMWJSFHQZKJK-LLVKDONJSA-N	0	3	312.849	2.267	10	0		DEAEHN
CCN1CCC[C@@H](Nc2nc(Cl)nc(N3CCCC3)n2)C1	ZINC000061539220	184172896	/nfs/dbraw/zinc/17/28/96/184172896.db2.gz	VERNCWOTALNWSA-LLVKDONJSA-N	0	3	310.833	2.021	10	0		DEAEHN
C[C@@H](CN1CCCC1)Nc1nc(Cl)nc(N2CCCC2)n1	ZINC000061539161	184173149	/nfs/dbraw/zinc/17/31/49/184173149.db2.gz	OFMIEEAPMUJLCD-NSHDSACASA-N	0	3	310.833	2.021	10	0		DEAEHN
CN1CCCC[C@H]1CNC(=O)c1ccc(Br)cn1	ZINC000061874484	184191352	/nfs/dbraw/zinc/19/13/52/184191352.db2.gz	TWPOXQZPULIQNB-NSHDSACASA-N	0	3	312.211	2.058	10	0		DEAEHN
C[C@@H](N)[C@H](c1cccs1)N1CCN(CC(F)(F)F)CC1	ZINC000061940832	184197387	/nfs/dbraw/zinc/19/73/87/184197387.db2.gz	PXQFQVPOAMDEKF-ZYHUDNBSSA-N	0	3	307.385	2.316	10	0		DEAEHN
COCCCN(C)[C@@H](CN)c1ccccc1Br	ZINC000062029317	184202171	/nfs/dbraw/zinc/20/21/71/184202171.db2.gz	DSKLTLJJQIQRPM-ZDUSSCGKSA-N	0	3	301.228	2.417	10	0		DEAEHN
CCN[C@@H](C)c1cccc(S(=O)(=O)N(C)CCCOC)c1	ZINC000062037792	184202702	/nfs/dbraw/zinc/20/27/02/184202702.db2.gz	XRRYCISDYIRWHC-ZDUSSCGKSA-N	0	3	314.451	2.014	10	0		DEAEHN
CNCc1cc(Br)cnc1N(C)CCCOC	ZINC000062035885	184202856	/nfs/dbraw/zinc/20/28/56/184202856.db2.gz	DMXMPJRZHGYOIL-UHFFFAOYSA-N	0	3	302.216	2.036	10	0		DEAEHN
CN(Cc1nccn1C)[C@@H](CN)c1ccccc1Br	ZINC000062247508	184225289	/nfs/dbraw/zinc/22/52/89/184225289.db2.gz	HFSNSTSLRPAFKH-ZDUSSCGKSA-N	0	3	323.238	2.314	10	0		DEAEHN
CS(=O)(=O)c1ccc([C@H](N)c2ccc3c(c2)COC3)cc1	ZINC000062332438	184231292	/nfs/dbraw/zinc/23/12/92/184231292.db2.gz	QCUUTPGUBOMAPJ-INIZCTEOSA-N	0	3	303.383	2.168	10	0		DEAEHN
NC[C@@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CCCCC1	ZINC000062706172	184248766	/nfs/dbraw/zinc/24/87/66/184248766.db2.gz	GMBQTWXZZJWJHX-LLVKDONJSA-N	0	3	300.324	2.234	10	0		DEAEHN
COCCNCc1ccc(OCCCC(=O)OC)c(Cl)c1	ZINC000062730548	184251480	/nfs/dbraw/zinc/25/14/80/184251480.db2.gz	DRFRBKZZFLZAJQ-UHFFFAOYSA-N	0	3	315.797	2.408	10	0		DEAEHN
CN[C@H](CCSc1ccc(Br)cc1)C(N)=O	ZINC000062596971	184245113	/nfs/dbraw/zinc/24/51/13/184245113.db2.gz	PSOLTTXMGGBCJT-SNVBAGLBSA-N	0	3	303.225	2.005	10	0		DEAEHN
[NH3+][C@H]1CCCCC[C@H]1[N-]S(=O)(=O)c1ccc(Cl)s1	ZINC000063213899	184278957	/nfs/dbraw/zinc/27/89/57/184278957.db2.gz	MPWRYTIUHHGSFF-DTWKUNHWSA-N	0	3	308.856	2.340	10	0		DEAEHN
Nc1ccc(Cl)c(C(=O)N2CC[C@@H](N3CCCCC3)C2)n1	ZINC000062984971	184264718	/nfs/dbraw/zinc/26/47/18/184264718.db2.gz	QONWCVYJYLRTML-LLVKDONJSA-N	0	3	308.813	2.018	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(N)c(C(F)(F)F)c2)C1	ZINC000062984674	184264799	/nfs/dbraw/zinc/26/47/99/184264799.db2.gz	ZTMNEBHAKAGJIX-SNVBAGLBSA-N	0	3	301.312	2.064	10	0		DEAEHN
COc1ccc(CNC(C)C)c(OCCCS(C)(=O)=O)c1	ZINC000063014423	184266684	/nfs/dbraw/zinc/26/66/84/184266684.db2.gz	RZZONXUGLLNUIF-UHFFFAOYSA-N	0	3	315.435	2.007	10	0		DEAEHN
[NH3+][C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000063175788	184276641	/nfs/dbraw/zinc/27/66/41/184276641.db2.gz	KRUMIAREPSYOSA-RKDXNWHRSA-N	0	3	309.218	2.152	10	0		DEAEHN
CN(CCNS(=O)(=O)c1ccc(F)cc1)C1CCCCC1	ZINC000065010478	184308665	/nfs/dbraw/zinc/30/86/65/184308665.db2.gz	FWVCCOMHLMJCAX-UHFFFAOYSA-N	0	3	314.426	2.369	10	0		DEAEHN
CC(C)NCC(=O)Nc1ccc(C(=O)N2CCCCC2)cc1	ZINC000066215591	184397268	/nfs/dbraw/zinc/39/72/68/184397268.db2.gz	IHUNZSAOWJFRMX-UHFFFAOYSA-N	0	3	303.406	2.249	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)c2sc3cccnc3c2N)CCN1C	ZINC000159160582	197331810	/nfs/dbraw/zinc/33/18/10/197331810.db2.gz	XYIHBEQQYLHICU-ZJUUUORDSA-N	0	3	304.419	2.091	10	0		DEAEHN
CS(=O)(=O)CCOc1c(Cl)cccc1CNC1CC1	ZINC000159226362	197338305	/nfs/dbraw/zinc/33/83/05/197338305.db2.gz	JWHPLNWGVXKJEA-UHFFFAOYSA-N	0	3	303.811	2.015	10	0		DEAEHN
CCCNC(=O)[C@@H](CN)Cc1cc(F)cc(C(F)(F)F)c1	ZINC000159198354	197335322	/nfs/dbraw/zinc/33/53/22/197335322.db2.gz	NORCGTNJACRHER-SNVBAGLBSA-N	0	3	306.303	2.488	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)c2ccccc2)cc(CN)c1F	ZINC000159051207	197322727	/nfs/dbraw/zinc/32/27/27/197322727.db2.gz	VWCYZHJDRFVGHN-UHFFFAOYSA-N	0	3	308.378	2.418	10	0		DEAEHN
COc1cc2c(cc1[C@H](CN)N1CCSCC1)O[C@H](C)C2	ZINC000159053945	197322418	/nfs/dbraw/zinc/32/24/18/197322418.db2.gz	ZNNPURILVWNACL-RISCZKNCSA-N	0	3	308.447	2.067	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1ccc2c(c1)CCC(=O)N2	ZINC000120218224	195121754	/nfs/dbraw/zinc/12/17/54/195121754.db2.gz	QKYDHPVQKYOKEH-OAHLLOKOSA-N	0	3	317.433	2.277	10	0		DEAEHN
COc1ccccc1C[C@@H](N)c1c(Br)cnn1C	ZINC000158864884	197307143	/nfs/dbraw/zinc/30/71/43/197307143.db2.gz	BCEHRDVAFIYISH-LLVKDONJSA-N	0	3	310.195	2.434	10	0		DEAEHN
CCN[C@@H](CS(=O)(=O)c1cccc(Cl)c1)[C@H]1CCOC1	ZINC000158837256	197305596	/nfs/dbraw/zinc/30/55/96/197305596.db2.gz	AMDSBSAHSVKGOZ-FZMZJTMJSA-N	0	3	317.838	2.128	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)s1	ZINC000158745111	197298092	/nfs/dbraw/zinc/29/80/92/197298092.db2.gz	QLJMWCIXFZOIIO-VXGBXAGGSA-N	0	3	314.476	2.278	10	0		DEAEHN
CN[C@@H](CS(=O)(=O)c1ccc(C(C)C)cc1)[C@@H]1CCOC1	ZINC000158713957	197296176	/nfs/dbraw/zinc/29/61/76/197296176.db2.gz	DZPAAJDTTDVNRZ-ZBFHGGJFSA-N	0	3	311.447	2.208	10	0		DEAEHN
CCn1ncc(Br)c1[C@@H](C[C@H]1CCCO1)NC	ZINC000158642631	197290332	/nfs/dbraw/zinc/29/03/32/197290332.db2.gz	CCLYVZPKIDGKAX-MWLCHTKSSA-N	0	3	302.216	2.495	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@@H](c2cccc(OC)c2)C1)N(C)C	ZINC000158071947	197240866	/nfs/dbraw/zinc/24/08/66/197240866.db2.gz	UPXIEPRTLRXMOS-DLBZAZTESA-N	0	3	320.433	2.325	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC[C@H](CCC(=O)OCC)C1)N(C)C	ZINC000120304598	195138946	/nfs/dbraw/zinc/13/89/46/195138946.db2.gz	OCVBSJPWQUKXHL-CABCVRRESA-N	0	3	312.454	2.299	10	0		DEAEHN
COc1ccc2[nH]c(=S)n(C[C@H]3CCN(C(C)C)C3)c2n1	ZINC000157044372	197158308	/nfs/dbraw/zinc/15/83/08/197158308.db2.gz	YFFUXCZIFHMAGF-NSHDSACASA-N	0	3	306.435	2.459	10	0		DEAEHN
C[C@](O)(Cc1cccc(C(F)(F)F)c1)C[C@H]1COCCN1	ZINC000156778260	197140523	/nfs/dbraw/zinc/14/05/23/197140523.db2.gz	XODUCFHAOXANQH-KBPBESRZSA-N	0	3	303.324	2.377	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)NCCN1CCC[C@@H](C)C1	ZINC000189706943	533144630	/nfs/dbraw/zinc/14/46/30/533144630.db2.gz	ZJQVJRITQTYVLF-KGLIPLIRSA-N	0	3	320.437	2.182	10	0		DEAEHN
NCc1ccccc1NC(=O)C[S@](=O)c1cccc(F)c1	ZINC000156083419	197085283	/nfs/dbraw/zinc/08/52/83/197085283.db2.gz	KKJZHRCFRMHRFY-OAQYLSRUSA-N	0	3	306.362	2.031	10	0		DEAEHN
Cc1ccccc1[S@@](=O)CC(=O)Nc1ccccc1CN	ZINC000156011696	197080039	/nfs/dbraw/zinc/08/00/39/197080039.db2.gz	RSCXWZNVYWWOEJ-OAQYLSRUSA-N	0	3	302.399	2.200	10	0		DEAEHN
C[C@@H]1CNC[C@H](C)N1C(=O)c1cccc(F)c1Br	ZINC000155994609	197079174	/nfs/dbraw/zinc/07/91/74/197079174.db2.gz	UCWTWZDYGUWZMX-DTORHVGOSA-N	0	3	315.186	2.411	10	0		DEAEHN
CCc1nn(C)c(Cl)c1C(=O)N(C)C[C@@H]1CCCN1CC	ZINC000154933660	197006650	/nfs/dbraw/zinc/00/66/50/197006650.db2.gz	NZSOQOQIXOKOCB-NSHDSACASA-N	0	3	312.845	2.192	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)NCc1ccccc1OCCN(C)C	ZINC000120417021	195162160	/nfs/dbraw/zinc/16/21/60/195162160.db2.gz	GNJUEYGFUOTCHN-CQSZACIVSA-N	0	3	307.438	2.471	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2cccnc2Br)C1	ZINC000120455966	195170457	/nfs/dbraw/zinc/17/04/57/195170457.db2.gz	VTHFMXSTHNNOJT-VIFPVBQESA-N	0	3	313.199	2.012	10	0		DEAEHN
Cc1ccc(CN[C@H]2CCC(=O)N(C)C2)cc1Br	ZINC000120838465	195248279	/nfs/dbraw/zinc/24/82/79/195248279.db2.gz	LXAFUZLSAIKFML-LBPRGKRZSA-N	0	3	311.223	2.468	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)Nc2cccc3c2OCCO3)[C@@H](C)C1	ZINC000120885083	195256815	/nfs/dbraw/zinc/25/68/15/195256815.db2.gz	UXCMMVGFCNPBHS-JSGCOSHPSA-N	0	3	319.405	2.308	10	0		DEAEHN
CCN1CCO[C@H]2CN(C(=O)CCc3ccccc3)CC[C@H]2C1	ZINC000249684207	257107367	/nfs/dbraw/zinc/10/73/67/257107367.db2.gz	DNDRRGOEUIVJOP-ROUUACIJSA-N	0	3	316.445	2.188	10	0		DEAEHN
COc1ccc(CN2CC[C@@H]3[C@@H]2CCN3c2ncccn2)cc1	ZINC000247906968	257114411	/nfs/dbraw/zinc/11/44/11/257114411.db2.gz	SNFRZFVRRSOOCB-DLBZAZTESA-N	0	3	310.401	2.338	10	0		DEAEHN
O=C([C@@H]1C[C@@H]2OCC[C@@H]2N(Cc2cccs2)C1)N1CCCC1	ZINC000247799675	257117302	/nfs/dbraw/zinc/11/73/02/257117302.db2.gz	UHEZCHUHJDYQPS-KBMXLJTQSA-N	0	3	320.458	2.350	10	0		DEAEHN
Nc1cc(Br)cc(C(=O)Cc2cnccc2N)c1	ZINC000122308992	195432541	/nfs/dbraw/zinc/43/25/41/195432541.db2.gz	IKRQOFDSYDSIPW-UHFFFAOYSA-N	0	3	306.163	2.434	10	0		DEAEHN
O=C(N[C@@H]1C[C@H]1c1ccc(F)cc1)N1CC[C@H](N2CC=CC2)C1	ZINC000195246094	132546047	/nfs/dbraw/zinc/54/60/47/132546047.db2.gz	CGAVVRHWQUYHSO-YESZJQIVSA-N	0	3	315.392	2.337	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NC[C@H](C)Oc1ccc(OC)cc1	ZINC000361937742	133200406	/nfs/dbraw/zinc/20/04/06/133200406.db2.gz	IVKRFMCUGHPQRP-YOEHRIQHSA-N	0	3	320.433	2.453	10	0		DEAEHN
CO[C@@H](CNC(=O)CC1CCN(C)CC1)c1ccc(F)cc1	ZINC000362868191	133256305	/nfs/dbraw/zinc/25/63/05/133256305.db2.gz	OBXZUFLWWGEHDA-INIZCTEOSA-N	0	3	308.397	2.361	10	0		DEAEHN
CO[C@@H]1CC[C@@H]2OCCN(C(=O)[C@@H](C)N3CCCCCC3)[C@H]2C1	ZINC000120112033	285732334	/nfs/dbraw/zinc/73/23/34/285732334.db2.gz	RKMIYUISLDAMGC-NCOADZHNSA-N	0	3	324.465	2.046	10	0		DEAEHN
Cc1ccc(C2(C(=O)N3CC[C@@H](N(C)C)C3)CCOCC2)cc1	ZINC000110702322	292089641	/nfs/dbraw/zinc/08/96/41/292089641.db2.gz	ZIRLYKUUQAQRSM-QGZVFWFLSA-N	0	3	316.445	2.206	10	0		DEAEHN
CCCCN(C)c1ccc(NC(=O)[C@H]2C[C@H](OC)CN2)cc1	ZINC000187952670	145005223	/nfs/dbraw/zinc/00/52/23/145005223.db2.gz	ZJPVWPMKFGMWIU-JKSUJKDBSA-N	0	3	305.422	2.238	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1cc(=O)[nH]c2ccccc21	ZINC000188679617	145015617	/nfs/dbraw/zinc/01/56/17/145015617.db2.gz	OUOZOTLCUYYTAW-UHFFFAOYSA-N	0	3	319.364	2.474	10	0		DEAEHN
CCOC1CC(CCNC(=O)N[C@@H](CC(C)C)CN(C)C)C1	ZINC000190125582	145038225	/nfs/dbraw/zinc/03/82/25/145038225.db2.gz	JNBUQPLDQNLNAS-PCKAHOCUSA-N	0	3	313.486	2.467	10	0		DEAEHN
CCC(C)(C)CNC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000190779708	145048381	/nfs/dbraw/zinc/04/83/81/145048381.db2.gz	WFDMBAYVPGSECM-INIZCTEOSA-N	0	3	324.513	2.234	10	0		DEAEHN
CCCOc1cc(OC)ccc1C(=O)N1CC[C@@H](N(C)C)C1	ZINC000191173426	145053867	/nfs/dbraw/zinc/05/38/67/145053867.db2.gz	NSLIMXNRGOSIMA-CYBMUJFWSA-N	0	3	306.406	2.260	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2n[nH]c3c2CCCCC3)CCN1C	ZINC000191856273	145066545	/nfs/dbraw/zinc/06/65/45/145066545.db2.gz	ZMXORJQSPBNZTG-QWHCGFSZSA-N	0	3	304.438	2.233	10	0		DEAEHN
Cn1ccnc1CC1CCN(C[C@H]2CC3(CCC3)C(=O)O2)CC1	ZINC000192007063	145068799	/nfs/dbraw/zinc/06/87/99/145068799.db2.gz	RBWNLLBXULWMRY-OAHLLOKOSA-N	0	3	317.433	2.160	10	0		DEAEHN
C[C@H](CNC(=O)c1cnn2c1CCCC2)N1CCC[C@H](C)C1	ZINC000246205805	145094787	/nfs/dbraw/zinc/09/47/87/145094787.db2.gz	BSPRMLFNLZEDRM-UONOGXRCSA-N	0	3	304.438	2.070	10	0		DEAEHN
CCOC[C@@H]1CCN([C@H]2CCN(c3ccc(C)cc3)C2=O)C1	ZINC000246283329	145097156	/nfs/dbraw/zinc/09/71/56/145097156.db2.gz	XCOJWCXQQHHVKI-WBVHZDCISA-N	0	3	302.418	2.459	10	0		DEAEHN
CCc1cc(N2CCC[C@@H](N[C@H](C)c3cnn(C)c3)C2)ncn1	ZINC000246284292	145097175	/nfs/dbraw/zinc/09/71/75/145097175.db2.gz	BUAUGGVFVNVEIJ-CZUORRHYSA-N	0	3	314.437	2.092	10	0		DEAEHN
CCc1cc(N2CCC[C@@H](N[C@H](C)c3cnccn3)C2)ncn1	ZINC000246364018	145100617	/nfs/dbraw/zinc/10/06/17/145100617.db2.gz	ITBVRKJEZOPMIQ-UKRRQHHQSA-N	0	3	312.421	2.149	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CCC[C@@H](c3cc[nH]n3)C2)C1	ZINC000246434773	145102667	/nfs/dbraw/zinc/10/26/67/145102667.db2.gz	NLYZWYQRIDYRPW-FMKPAKJESA-N	0	3	319.453	2.027	10	0		DEAEHN
C[C@H]1C[C@H]1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000246441189	145102917	/nfs/dbraw/zinc/10/29/17/145102917.db2.gz	UJXPYOHURFQYGG-KLZNWCGWSA-N	0	3	308.466	2.380	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c(C)c1	ZINC000246434407	145103084	/nfs/dbraw/zinc/10/30/84/145103084.db2.gz	NJWHEPIBONSMFY-GDBMZVCRSA-N	0	3	317.433	2.087	10	0		DEAEHN
Cc1ccc([C@@H](O)CN2CCC[C@@H](Cn3cncn3)C2)cc1	ZINC000246633836	145108505	/nfs/dbraw/zinc/10/85/05/145108505.db2.gz	BGRIBPCMCBHGDC-WBVHZDCISA-N	0	3	300.406	2.032	10	0		DEAEHN
C[C@H](C(=O)NC[C@@H](C)c1ccccc1)N1CCN2CCC[C@H]2C1	ZINC000246777151	145114014	/nfs/dbraw/zinc/11/40/14/145114014.db2.gz	ZBHRVIDQJHKONQ-NUJGCVRESA-N	0	3	315.461	2.075	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@@H]1CCCN1C[C@@H](O)COCC(C)C	ZINC000247218011	145129472	/nfs/dbraw/zinc/12/94/72/145129472.db2.gz	QHBSCIUALVPUOR-CVEARBPZSA-N	0	3	309.454	2.207	10	0		DEAEHN
C[C@H](C(=O)N1CCC(c2ccnn2C)CC1)N1[C@H](C)CC[C@@H]1C	ZINC000247366293	145134716	/nfs/dbraw/zinc/13/47/16/145134716.db2.gz	NANCEZGPUHNKRT-QLFBSQMISA-N	0	3	318.465	2.387	10	0		DEAEHN
COC(=O)Nc1cccc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000247406289	145135991	/nfs/dbraw/zinc/13/59/91/145135991.db2.gz	PTRFBGHOTHHAHQ-WFASDCNBSA-N	0	3	317.389	2.174	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2ccnn2C)[C@H]1Oc1ccccc1	ZINC000248540257	145158143	/nfs/dbraw/zinc/15/81/43/145158143.db2.gz	BEVCDXHFUSZMOP-GVDBMIGSSA-N	0	3	301.390	2.135	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN(C[C@@H](O)C(F)(F)F)C2)n1	ZINC000248554489	145158527	/nfs/dbraw/zinc/15/85/27/145158527.db2.gz	HTUYBEXSBLBPAT-VXGBXAGGSA-N	0	3	303.328	2.047	10	0		DEAEHN
CCSCc1cc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)no1	ZINC000248567754	145159177	/nfs/dbraw/zinc/15/91/77/145159177.db2.gz	JWNBECQEXRELDZ-VXGBXAGGSA-N	0	3	309.435	2.236	10	0		DEAEHN
O=S1(=O)CC[C@H](N[C@@H]2CCC[C@@H]3OCC[C@H]32)c2ccccc21	ZINC000248587166	145160390	/nfs/dbraw/zinc/16/03/90/145160390.db2.gz	YBTGMCUUEOMSST-UKMLZYKCSA-N	0	3	321.442	2.452	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)[C@H](C)N[C@@H](C)[C@H]1CCCO1	ZINC000248599343	145160651	/nfs/dbraw/zinc/16/06/51/145160651.db2.gz	NKBGSOIUYTWVAQ-YQQAZPJKSA-N	0	3	304.434	2.499	10	0		DEAEHN
Cn1c2ccc(CN3CCN4CCCC[C@H]4C3)cc2sc1=O	ZINC000248657173	145163321	/nfs/dbraw/zinc/16/33/21/145163321.db2.gz	SEGITAZJZBLRGX-AWEZNQCLSA-N	0	3	317.458	2.270	10	0		DEAEHN
CN(C)c1ccncc1C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000248759951	145166873	/nfs/dbraw/zinc/16/68/73/145166873.db2.gz	YAJXNHXTJXCUFB-SJLPKXTDSA-N	0	3	324.428	2.323	10	0		DEAEHN
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1C[C@@H](O)CCc1ccccc1	ZINC000248809609	145168767	/nfs/dbraw/zinc/16/87/67/145168767.db2.gz	HKZLVUAIWHVJBY-XDNAFOTISA-N	0	3	317.429	2.254	10	0		DEAEHN
O=C1C[C@@H](c2ccccc2)N(C[C@@H](O)CC2CCCC2)CCN1	ZINC000249108204	145178960	/nfs/dbraw/zinc/17/89/60/145178960.db2.gz	QTWDAIUGSMRRCN-ROUUACIJSA-N	0	3	316.445	2.491	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H]1CCCO[C@H]1C	ZINC000253353938	145202104	/nfs/dbraw/zinc/20/21/04/145202104.db2.gz	XGKXYEMRBBIDPN-VYDXJSESSA-N	0	3	304.434	2.438	10	0		DEAEHN
Cn1c(CCN2CCNC[C@@H]2c2cccnc2)nc2ccccc21	ZINC000261640683	145212831	/nfs/dbraw/zinc/21/28/31/145212831.db2.gz	FQQHNRKBRATSJD-GOSISDBHSA-N	0	3	321.428	2.157	10	0		DEAEHN
Nc1ncc(CN2CCC[C@@](CO)(c3ccccc3)C2)s1	ZINC000261682490	145216117	/nfs/dbraw/zinc/21/61/17/145216117.db2.gz	QSHHBKFYAYVNDQ-MRXNPFEDSA-N	0	3	303.431	2.251	10	0		DEAEHN
Cn1c(CN2CCNC[C@H]2c2cccnc2)nc2ccccc21	ZINC000261746014	145223013	/nfs/dbraw/zinc/22/30/13/145223013.db2.gz	NAPIJKGPAKBDRC-KRWDZBQOSA-N	0	3	307.401	2.115	10	0		DEAEHN
Cc1ccc(CSCCNC(=O)[C@H](N)C2CCOCC2)cc1	ZINC000261776130	145224715	/nfs/dbraw/zinc/22/47/15/145224715.db2.gz	MPVQPOCHGFBHMQ-MRXNPFEDSA-N	0	3	322.474	2.098	10	0		DEAEHN
CCCn1cc(CN2CCNC[C@H]2c2ccccc2OC)cn1	ZINC000261784120	145225939	/nfs/dbraw/zinc/22/59/39/145225939.db2.gz	KJWXGORHQKLLDC-KRWDZBQOSA-N	0	3	314.433	2.448	10	0		DEAEHN
NC1(C(=O)NCCc2csc3ccccc23)CCOCC1	ZINC000261840893	145232633	/nfs/dbraw/zinc/23/26/33/145232633.db2.gz	LRTSBTNSJFXWIG-UHFFFAOYSA-N	0	3	304.415	2.068	10	0		DEAEHN
C[C@H](CNC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C)c1ccccc1	ZINC000261946346	145245706	/nfs/dbraw/zinc/24/57/06/145245706.db2.gz	VRBRUMDLCUIXGC-NVQRDWNXSA-N	0	3	316.445	2.439	10	0		DEAEHN
CN(Cc1cnc(N)s1)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000262059191	145258573	/nfs/dbraw/zinc/25/85/73/145258573.db2.gz	QZIPRNVSRSZSRD-ZFWWWQNUSA-N	0	3	317.462	2.245	10	0		DEAEHN
COc1ccccc1OCCN1CCNC[C@@H]1c1cccnc1	ZINC000262151896	145266338	/nfs/dbraw/zinc/26/63/38/145266338.db2.gz	GBPQOMSFYBQGNA-MRXNPFEDSA-N	0	3	313.401	2.116	10	0		DEAEHN
CC(C)(C)NC(=O)CN1CCNC[C@@H]1c1ccccc1Cl	ZINC000262289949	145273433	/nfs/dbraw/zinc/27/34/33/145273433.db2.gz	VWYKBXNLLMWZSR-CQSZACIVSA-N	0	3	309.841	2.201	10	0		DEAEHN
C[C@@H](NC(=O)C1(N)CCOCC1)c1ccc(C(F)(F)F)cc1	ZINC000262290784	145273698	/nfs/dbraw/zinc/27/36/98/145273698.db2.gz	NENWVXPEZVORMD-SNVBAGLBSA-N	0	3	316.323	2.391	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)Nc1ccc(F)c(F)c1	ZINC000262402167	145281738	/nfs/dbraw/zinc/28/17/38/145281738.db2.gz	CKSCIXWNPRZYDK-ZXIHIIQKSA-N	0	3	310.344	2.436	10	0		DEAEHN
Cc1cccc(N(C)C(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000262412810	145282183	/nfs/dbraw/zinc/28/21/83/145282183.db2.gz	DHKLPTNHSQISPW-RVKKMQEKSA-N	0	3	302.418	2.490	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)Nc1cccc(-c2nnc(C)n2C)c1	ZINC000262509869	145289094	/nfs/dbraw/zinc/28/90/94/145289094.db2.gz	AYOQKCBTAKKJHP-QMTHXVAHSA-N	0	3	301.394	2.102	10	0		DEAEHN
Cc1ccccc1CNC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C	ZINC000262558322	145293094	/nfs/dbraw/zinc/29/30/94/145293094.db2.gz	USJKAXYOUUZJNS-HDMKZQKVSA-N	0	3	302.418	2.144	10	0		DEAEHN
CCc1nc(NC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)sc1C	ZINC000262575854	145294456	/nfs/dbraw/zinc/29/44/56/145294456.db2.gz	YDGADXMJSPVYBM-KANYHAFZSA-N	0	3	323.462	2.485	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H]2CC[NH2+]C[C@@H]2C)c(Cl)cc1F	ZINC000262787404	145304800	/nfs/dbraw/zinc/30/48/00/145304800.db2.gz	QRIYRDBKKLOHQM-JOYOIKCWSA-N	0	3	320.817	2.064	10	0		DEAEHN
C[C@@H](Cc1nc([C@H]2CNCCN2C)no1)c1ccc(F)cc1	ZINC000263222500	145337749	/nfs/dbraw/zinc/33/77/49/145337749.db2.gz	MCHSZQIDWKMCDH-SMDDNHRTSA-N	0	3	304.369	2.131	10	0		DEAEHN
C[C@H](N[C@@H]1CCO[C@H]1C1CC1)C(=O)N[C@@H](C)c1ccccc1	ZINC000332988721	145393184	/nfs/dbraw/zinc/39/31/84/145393184.db2.gz	HNYXNTJRQQAXIE-CLROSIBMSA-N	0	3	302.418	2.409	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCCOCc1ccc(OC)cc1	ZINC000357169974	147055470	/nfs/dbraw/zinc/05/54/70/147055470.db2.gz	CQFYZFMICQSYMB-QGZVFWFLSA-N	0	3	320.433	2.202	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@H](C)N2CCC[C@H](C)C2)C1	ZINC000358603417	147164355	/nfs/dbraw/zinc/16/43/55/147164355.db2.gz	KAHVULVVURLCFE-GJZGRUSLSA-N	0	3	311.470	2.175	10	0		DEAEHN
O=C(NCCNc1ccncc1)c1scnc1C1CCCC1	ZINC000565511017	292166465	/nfs/dbraw/zinc/16/64/65/292166465.db2.gz	LRUBGZSKJKECBF-UHFFFAOYSA-N	0	3	316.430	2.460	10	0		DEAEHN
COCCN(CCN(C)C)C(=O)Nc1cccc2c1OCCC2	ZINC000370539144	148028329	/nfs/dbraw/zinc/02/83/29/148028329.db2.gz	QLWBLYIXKTVCRM-UHFFFAOYSA-N	0	3	321.421	2.054	10	0		DEAEHN
CC(C)C(=O)N[C@@H]1CCCN(C(=O)[C@H](C)N2[C@@H](C)CC[C@@H]2C)C1	ZINC000407979001	148550793	/nfs/dbraw/zinc/55/07/93/148550793.db2.gz	MTDQUMQSFXNXNU-YHUYYLMFSA-N	0	3	323.481	2.011	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1C[C@@H](C)c2ccccc21	ZINC000111867871	401726245	/nfs/dbraw/zinc/72/62/45/401726245.db2.gz	NZKQDGRVKDLPAL-CABCVRRESA-N	0	3	317.433	2.431	10	0		DEAEHN
Cc1ccc(CN(C)CCC(=O)Nc2ccc(C(N)=O)cc2)o1	ZINC000074021221	401728153	/nfs/dbraw/zinc/72/81/53/401728153.db2.gz	HLOPSMNCACNPKW-UHFFFAOYSA-N	0	3	315.373	2.148	10	0		DEAEHN
CCc1cnc(CCNC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)s1	ZINC000074842247	401744977	/nfs/dbraw/zinc/74/49/77/401744977.db2.gz	OEMDQYYUWXDMGP-OLZOCXBDSA-N	0	3	322.478	2.126	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)NCCc2cc(F)ccc2F)CN1C1CC1	ZINC000126444634	401694604	/nfs/dbraw/zinc/69/46/04/401694604.db2.gz	LIXQQTXPICYXTH-FZMZJTMJSA-N	0	3	323.387	2.432	10	0		DEAEHN
COCc1nc(C)c(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)s1	ZINC000126469324	401695924	/nfs/dbraw/zinc/69/59/24/401695924.db2.gz	HQZGEOIFNYRZSP-CMPLNLGQSA-N	0	3	311.451	2.056	10	0		DEAEHN
COc1ccc(C)nc1NC(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000127067434	401718873	/nfs/dbraw/zinc/71/88/73/401718873.db2.gz	MUWJUESTESNEMO-STQMWFEESA-N	0	3	304.394	2.099	10	0		DEAEHN
C[C@@H](N[C@H]1CCC(=O)N(C)C1=O)c1cc2c(s1)CCCC2	ZINC000129521772	401805234	/nfs/dbraw/zinc/80/52/34/401805234.db2.gz	QQOLLIHLEPCOTJ-PWSUYJOCSA-N	0	3	306.431	2.425	10	0		DEAEHN
CCOc1ccccc1OCCN1C[C@H](C(N)=O)CC[C@@H]1C	ZINC000075714513	401766982	/nfs/dbraw/zinc/76/69/82/401766982.db2.gz	ZMQKLQVRFSNWED-UONOGXRCSA-N	0	3	306.406	2.050	10	0		DEAEHN
CCc1cnc(CCNC(=O)NC[C@@H]2CCCCN2CC)s1	ZINC000075811049	401769041	/nfs/dbraw/zinc/76/90/41/401769041.db2.gz	QVUNFHMGQXVNFO-ZDUSSCGKSA-N	0	3	324.494	2.422	10	0		DEAEHN
COCCOC[C@@H]1CCN(Cc2ncc(C)c(OC)c2C)C1	ZINC000075948914	401774485	/nfs/dbraw/zinc/77/44/85/401774485.db2.gz	LKLGQZJFAGCXHU-OAHLLOKOSA-N	0	3	308.422	2.192	10	0		DEAEHN
CCc1ccc([C@H]2CCCCN2C(=O)C(C)S(C)(=O)=O)o1	ZINC000128558025	401782529	/nfs/dbraw/zinc/78/25/29/401782529.db2.gz	ZOQPWSQMEAGBOM-DGCLKSJQSA-N	0	3	313.419	2.329	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)CSCc1cccnc1	ZINC000077730645	401827618	/nfs/dbraw/zinc/82/76/18/401827618.db2.gz	MDMBJAAIIHSTFQ-OAHLLOKOSA-N	0	3	309.479	2.407	10	0		DEAEHN
COc1c(C)cnc(CN2CC[C@@H](c3cnn(C)c3)C2)c1C	ZINC000116322880	401850191	/nfs/dbraw/zinc/85/01/91/401850191.db2.gz	PTTBLIMIEVBECZ-CQSZACIVSA-N	0	3	300.406	2.430	10	0		DEAEHN
C[C@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N1CC[C@H](c2cnn(C)c2)C1	ZINC000116408028	401851960	/nfs/dbraw/zinc/85/19/60/401851960.db2.gz	WSUAWUBTVJEETG-QXSJWSMHSA-N	0	3	318.465	2.387	10	0		DEAEHN
CC[C@@H](CC(=O)N1CCO[C@@H](CN(C)C)C1)c1ccccc1	ZINC000116787307	401859264	/nfs/dbraw/zinc/85/92/64/401859264.db2.gz	PBBVJUOSMPTUHR-RDJZCZTQSA-N	0	3	304.434	2.359	10	0		DEAEHN
Cc1c2cccc(C)c2oc1C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000116786914	401859426	/nfs/dbraw/zinc/85/94/26/401859426.db2.gz	XAPLASPUFZSOFK-CQSZACIVSA-N	0	3	316.401	2.452	10	0		DEAEHN
CCCC1CCC(NC(=O)N2CCO[C@@H](CN(C)C)C2)CC1	ZINC000117038508	401867668	/nfs/dbraw/zinc/86/76/68/401867668.db2.gz	OIWBDPOJJGCXRS-GPANFISMSA-N	0	3	311.470	2.317	10	0		DEAEHN
CCC[C@@H](C(=O)NCCCOc1ccc(OC)cc1)N(C)C	ZINC000119081729	401924567	/nfs/dbraw/zinc/92/45/67/401924567.db2.gz	UFPGRHYTEQYQEE-INIZCTEOSA-N	0	3	308.422	2.311	10	0		DEAEHN
COC(=O)CCCN1CCC(NC(=O)c2ccccc2C)CC1	ZINC000117335554	401874924	/nfs/dbraw/zinc/87/49/24/401874924.db2.gz	NNDDBPWLMZSPMW-UHFFFAOYSA-N	0	3	318.417	2.142	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)NCCN1CCC[C@H](C)C1	ZINC000079531344	401875134	/nfs/dbraw/zinc/87/51/34/401875134.db2.gz	XWCHQALZOBJEGV-AWEZNQCLSA-N	0	3	305.422	2.331	10	0		DEAEHN
CNc1cc(N2CCC[C@@H]2CNCc2nc(C)cs2)ncn1	ZINC000117385436	401875735	/nfs/dbraw/zinc/87/57/35/401875735.db2.gz	BAAPVCZTACJVKD-GFCCVEGCSA-N	0	3	318.450	2.042	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)NCCN1CCC[C@@H](C)C1	ZINC000117756506	401883350	/nfs/dbraw/zinc/88/33/50/401883350.db2.gz	DUFYJAJRKFEBMF-CPUCHLNUSA-N	0	3	302.418	2.399	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)c1ccc(F)nc1	ZINC000118777741	401907301	/nfs/dbraw/zinc/90/73/01/401907301.db2.gz	RBXITLPLMMBRFW-HNNXBMFYSA-N	0	3	301.365	2.123	10	0		DEAEHN
CCOc1ccc(NC(=O)N2CCO[C@H](CN(C)C)C2)c(C)c1	ZINC000118808872	401909050	/nfs/dbraw/zinc/90/90/50/401909050.db2.gz	JFXOLXLMLNKRCJ-OAHLLOKOSA-N	0	3	321.421	2.188	10	0		DEAEHN
CSCc1ccc(NC(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000118817281	401909355	/nfs/dbraw/zinc/90/93/55/401909355.db2.gz	OBJIKYGSKOIZIM-HNNXBMFYSA-N	0	3	323.462	2.344	10	0		DEAEHN
CCOC(=O)CC[C@H](C)NC(=O)c1ccc(CN(C)C)cc1	ZINC000089881116	401969746	/nfs/dbraw/zinc/96/97/46/401969746.db2.gz	BTIZDOSZKCBPRW-ZDUSSCGKSA-N	0	3	306.406	2.210	10	0		DEAEHN
CC(C)N(C(=O)CN1CCC(Cn2cccn2)CC1)C(C)C	ZINC000090473422	401983711	/nfs/dbraw/zinc/98/37/11/401983711.db2.gz	PTTQXLNNYJGHGQ-UHFFFAOYSA-N	0	3	306.454	2.241	10	0		DEAEHN
O=C1NCCCC[C@H]1N1CCC([C@@H](O)c2ccc(F)cc2)CC1	ZINC000120325633	401986742	/nfs/dbraw/zinc/98/67/42/401986742.db2.gz	RDUQQWPQFYOMSP-SJORKVTESA-N	0	3	320.408	2.240	10	0		DEAEHN
COc1ccc(CNC(=O)CN2CCC[C@H]2CSC)cc1	ZINC000135440542	401939302	/nfs/dbraw/zinc/93/93/02/401939302.db2.gz	LNXWDYLNENKUMA-AWEZNQCLSA-N	0	3	308.447	2.139	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cc(-c3ccc(F)cc3)on2)C1	ZINC000135463140	401940540	/nfs/dbraw/zinc/94/05/40/401940540.db2.gz	HBKYRGIFXNRIPQ-CYBMUJFWSA-N	0	3	303.337	2.257	10	0		DEAEHN
C[C@@H]1CC[C@H](C(=O)N(CCN(C)C)Cc2ccccc2F)O1	ZINC000150817413	401997128	/nfs/dbraw/zinc/99/71/28/401997128.db2.gz	NJVIZMPCTOAOSH-CZUORRHYSA-N	0	3	308.397	2.283	10	0		DEAEHN
COCc1nc(C)c(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)s1	ZINC000135657011	401950250	/nfs/dbraw/zinc/95/02/50/401950250.db2.gz	GJUCSFOJYRZXBX-PWSUYJOCSA-N	0	3	311.451	2.153	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCc2csc(-c3ccco3)n2)C1	ZINC000121451331	402036905	/nfs/dbraw/zinc/03/69/05/402036905.db2.gz	OGPADCSSBLXKAA-GFCCVEGCSA-N	0	3	320.418	2.249	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2c(F)cccc2F)C1	ZINC000052553039	402043880	/nfs/dbraw/zinc/04/38/80/402043880.db2.gz	GRAAYFVNIGBONR-LBPRGKRZSA-N	0	3	311.376	2.291	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cncc(OC(C)C)c1	ZINC000121762034	402051746	/nfs/dbraw/zinc/05/17/46/402051746.db2.gz	PRLUELGYSVZKBQ-HNNXBMFYSA-N	0	3	305.422	2.425	10	0		DEAEHN
CC(C)c1csc(CNC(=O)N2CC[C@@H](N3CC=CC3)C2)n1	ZINC000121909666	402055976	/nfs/dbraw/zinc/05/59/76/402055976.db2.gz	OOGYVDSYKZUETN-CYBMUJFWSA-N	0	3	320.462	2.422	10	0		DEAEHN
COCc1ccc(C(=O)NC[C@H](c2ccccc2)N(C)C)o1	ZINC000096990173	402100387	/nfs/dbraw/zinc/10/03/87/402100387.db2.gz	LECJINVWEUTVBP-OAHLLOKOSA-N	0	3	302.374	2.459	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)CCc2nc(C(C)(C)C)no2)CCN1C	ZINC000123055334	402108042	/nfs/dbraw/zinc/10/80/42/402108042.db2.gz	WZSUUUKQBFLWDD-QWHCGFSZSA-N	0	3	322.453	2.241	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)NCCN2CCCC[C@@H]2C)cc1	ZINC000062121900	402109639	/nfs/dbraw/zinc/10/96/39/402109639.db2.gz	GSQVXTSMWMZELI-AWEZNQCLSA-N	0	3	317.433	2.178	10	0		DEAEHN
COc1cc(C(=O)N[C@H](CC(C)C)C[NH+](C)C)cc(OC)c1[O-]	ZINC000152909317	402116518	/nfs/dbraw/zinc/11/65/18/402116518.db2.gz	HWZPTBIJLAWCNR-CYBMUJFWSA-N	0	3	324.421	2.116	10	0		DEAEHN
CC(=O)Nc1cccc([C@@H](C)NC[C@H](C)N2CCOCC2)c1	ZINC000123252205	402118012	/nfs/dbraw/zinc/11/80/12/402118012.db2.gz	YQPZYEUZNPMDMO-UONOGXRCSA-N	0	3	305.422	2.016	10	0		DEAEHN
C[C@@H](CN[C@H]1CCCOc2ccc(F)cc21)N1CCOCC1	ZINC000123286611	402119766	/nfs/dbraw/zinc/11/97/66/402119766.db2.gz	AGQHKVOQGLPAHM-BBRMVZONSA-N	0	3	308.397	2.350	10	0		DEAEHN
COc1ccc(O)c(C(=O)N[C@H](CN(C)C)c2ccccc2)c1	ZINC000123460682	402129467	/nfs/dbraw/zinc/12/94/67/402129467.db2.gz	MFGZPGSGSXOPIW-MRXNPFEDSA-N	0	3	314.385	2.434	10	0		DEAEHN
CCN1CCN(Cc2ccc(NC(=O)[C@H](C)COC)cc2)CC1	ZINC000103430402	402187445	/nfs/dbraw/zinc/18/74/45/402187445.db2.gz	PPKJDHUTJNSAPM-OAHLLOKOSA-N	0	3	319.449	2.045	10	0		DEAEHN
CCN(CCNC(=O)N[C@H](C)c1ccc2c(c1)OCO2)C1CC1	ZINC000101978156	402159678	/nfs/dbraw/zinc/15/96/78/402159678.db2.gz	JHRGDIHRLKRHCF-GFCCVEGCSA-N	0	3	319.405	2.260	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)ccc1F	ZINC000124072004	402162350	/nfs/dbraw/zinc/16/23/50/402162350.db2.gz	FQUZXSPGSPOQJD-RISCZKNCSA-N	0	3	321.396	2.339	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)N(C)CCC2CCOCC2)[C@@H](C)C1	ZINC000153838135	402173565	/nfs/dbraw/zinc/17/35/65/402173565.db2.gz	LWPTYRSUHDAUMH-HOCLYGCPSA-N	0	3	311.470	2.173	10	0		DEAEHN
CC1(c2ccccc2)CCN(C[C@@H](O)CN2CCCC2=O)CC1	ZINC000153872034	402176110	/nfs/dbraw/zinc/17/61/10/402176110.db2.gz	IHZGEVLFWNXMLB-QGZVFWFLSA-N	0	3	316.445	2.023	10	0		DEAEHN
CCN1CCN([C@H]2CCN(CCOc3ccccc3C)C2)CC1	ZINC000107370752	402231968	/nfs/dbraw/zinc/23/19/68/402231968.db2.gz	DOQFXLVGIYDVHM-SFHVURJKSA-N	0	3	317.477	2.086	10	0		DEAEHN
COc1cccc2c1CC[C@H]2NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000154794317	402232240	/nfs/dbraw/zinc/23/22/40/402232240.db2.gz	NRQRLUQWBOVESR-IUODEOHRSA-N	0	3	303.406	2.028	10	0		DEAEHN
CC(C)[C@H](O)CNC(=O)NCC(C)(C)N[C@@H](C)c1ccccc1	ZINC000155075361	402244492	/nfs/dbraw/zinc/24/44/92/402244492.db2.gz	XECOWYNVTJSOQY-GOEBONIOSA-N	0	3	321.465	2.432	10	0		DEAEHN
COc1ccc2nc(N3CCO[C@H](CN(C)C)C3)ccc2c1	ZINC000108951923	402265000	/nfs/dbraw/zinc/26/50/00/402265000.db2.gz	WYAMYKDXTUNKDA-OAHLLOKOSA-N	0	3	301.390	2.010	10	0		DEAEHN
CC(C)c1ccc(NC(=O)CN2CCO[C@H](CN(C)C)C2)cc1	ZINC000155323609	402252608	/nfs/dbraw/zinc/25/26/08/402252608.db2.gz	UFYSTZCYWFEVOL-QGZVFWFLSA-N	0	3	319.449	2.011	10	0		DEAEHN
CCCC[C@@H](C(=O)OC)N1CCC(Cc2nccn2C)CC1	ZINC000105918310	402211118	/nfs/dbraw/zinc/21/11/18/402211118.db2.gz	AQBZMNNTFFNHMQ-HNNXBMFYSA-N	0	3	307.438	2.406	10	0		DEAEHN
CN(CCCCCO)C[C@@H](c1cccs1)N1CCOCC1	ZINC000105918119	402211543	/nfs/dbraw/zinc/21/15/43/402211543.db2.gz	MRJGYDXCDRYPSV-HNNXBMFYSA-N	0	3	312.479	2.216	10	0		DEAEHN
CCN1CCN(CCNC(=O)c2c(C)oc3ccccc32)CC1	ZINC000185060507	402321351	/nfs/dbraw/zinc/32/13/51/402321351.db2.gz	OLQJZEJQAKWGSX-UHFFFAOYSA-N	0	3	315.417	2.109	10	0		DEAEHN
CCc1ccccc1OCC(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000155812497	402267724	/nfs/dbraw/zinc/26/77/24/402267724.db2.gz	JNIGVYVSAMWDNV-GOEBONIOSA-N	0	3	304.434	2.473	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)CSCc1cscn1	ZINC000126168314	402268110	/nfs/dbraw/zinc/26/81/10/402268110.db2.gz	WATASHKRNOQXLE-GFCCVEGCSA-N	0	3	315.508	2.469	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@H]1COc2ccccc2C1	ZINC000176236002	402293270	/nfs/dbraw/zinc/29/32/70/402293270.db2.gz	GDQPEALRQMFXAT-CVEARBPZSA-N	0	3	317.433	2.116	10	0		DEAEHN
COCCCOc1ccc(C(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000176282468	402296906	/nfs/dbraw/zinc/29/69/06/402296906.db2.gz	ICFPIMBDOMSIEP-INIZCTEOSA-N	0	3	318.417	2.022	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1cccc2c1OCCO2	ZINC000176315985	402298944	/nfs/dbraw/zinc/29/89/44/402298944.db2.gz	XCIKFOZZBQPSHG-CYBMUJFWSA-N	0	3	319.405	2.406	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cnc(C(F)(F)F)nc1	ZINC000157883883	402299312	/nfs/dbraw/zinc/29/93/12/402299312.db2.gz	BCGLXQVVJZNOBN-LLVKDONJSA-N	0	3	316.327	2.052	10	0		DEAEHN
CCOC(=O)c1csc(N2CC[C@H]3[C@@H](CCCN3C)C2)n1	ZINC000221026874	402302925	/nfs/dbraw/zinc/30/29/25/402302925.db2.gz	XCMXCMAOELQPQH-AAEUAGOBSA-N	0	3	309.435	2.240	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H](COC)c1ccc(C)o1	ZINC000176436720	402308980	/nfs/dbraw/zinc/30/89/80/402308980.db2.gz	WRDMLURIMFZYBV-CABCVRRESA-N	0	3	323.437	2.401	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCCOCc2ccccc2)CCN1C	ZINC000176443467	402310372	/nfs/dbraw/zinc/31/03/72/402310372.db2.gz	JLTOWBBTBVLBSZ-NVXWUHKLSA-N	0	3	319.449	2.327	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Cn1nc(C)c(Cl)c1C	ZINC000177041030	402362769	/nfs/dbraw/zinc/36/27/69/402362769.db2.gz	SGUWTNVFDBCJKB-CYBMUJFWSA-N	0	3	312.845	2.096	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(CCCNC(C)=O)C2)c1	ZINC000177409562	402399394	/nfs/dbraw/zinc/39/93/94/402399394.db2.gz	SRYYFSPEXITCQJ-CQSZACIVSA-N	0	3	306.406	2.019	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1c(OC)cccc1OC	ZINC000177424329	402400983	/nfs/dbraw/zinc/40/09/83/402400983.db2.gz	KFAVPLPRBSSOIW-CYBMUJFWSA-N	0	3	306.406	2.260	10	0		DEAEHN
Cc1nc(CN2CCCC[C@@H](N3CCN(C)CC3)C2)cs1	ZINC000162049227	402407664	/nfs/dbraw/zinc/40/76/64/402407664.db2.gz	OIXSYPDNVGIAJX-MRXNPFEDSA-N	0	3	308.495	2.053	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2cn3ccccc3n2)C12CCOCC2	ZINC000186211649	402410862	/nfs/dbraw/zinc/41/08/62/402410862.db2.gz	CISRECOJWMKYJY-HZPDHXFCSA-N	0	3	315.417	2.398	10	0		DEAEHN
CCSCc1cc(C(=O)N(C)C[C@H]2CCCN2CC)no1	ZINC000186220947	402411924	/nfs/dbraw/zinc/41/19/24/402411924.db2.gz	BZEMQAUZVXTIMJ-GFCCVEGCSA-N	0	3	311.451	2.484	10	0		DEAEHN
Cc1ccc(C[C@H](C)N(C)C(=O)C[C@H]2CSCCN2)cc1	ZINC000237542533	402412127	/nfs/dbraw/zinc/41/21/27/402412127.db2.gz	JUCOHSBKDAHICH-HOCLYGCPSA-N	0	3	306.475	2.480	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1cccc(NC(=O)N(C)C)c1)N(C)C	ZINC000162277849	402414968	/nfs/dbraw/zinc/41/49/68/402414968.db2.gz	QQQFPDUCRYXFJK-HNNXBMFYSA-N	0	3	320.437	2.127	10	0		DEAEHN
CC(C)c1ccccc1NC(=O)C(=O)N1CCN2CCC[C@H]2C1	ZINC000177683075	402426226	/nfs/dbraw/zinc/42/62/26/402426226.db2.gz	PDTAHUQIHFMQSU-AWEZNQCLSA-N	0	3	315.417	2.055	10	0		DEAEHN
CC(C)c1ccc(NC(=O)C(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000177698420	402427917	/nfs/dbraw/zinc/42/79/17/402427917.db2.gz	QKQXSIZZAUEASW-INIZCTEOSA-N	0	3	315.417	2.055	10	0		DEAEHN
CC(C)N1CCC[C@H](N2CC[C@H](CNc3ccccn3)C2)C1=O	ZINC000177698528	402428054	/nfs/dbraw/zinc/42/80/54/402428054.db2.gz	QYUYOEQUDYMLHW-CVEARBPZSA-N	0	3	316.449	2.215	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)NCc1ccccc1C	ZINC000177709050	402428741	/nfs/dbraw/zinc/42/87/41/402428741.db2.gz	HLTJSZOGULQDJK-WMZOPIPTSA-N	0	3	317.477	2.416	10	0		DEAEHN
Cc1cc(=O)[nH]cc1C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000186472832	402433834	/nfs/dbraw/zinc/43/38/34/402433834.db2.gz	PVWHDSWTTDSTEL-SUMWQHHRSA-N	0	3	313.401	2.105	10	0		DEAEHN
CC[C@H]1CN(c2ncnc3c(C)cccc32)CCN1CCOC	ZINC000177929767	402444935	/nfs/dbraw/zinc/44/49/35/402444935.db2.gz	YPRQHAJGTSTMRY-HNNXBMFYSA-N	0	3	314.433	2.485	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2CC(=O)Nc1cccc(C)c1	ZINC000177339332	402392520	/nfs/dbraw/zinc/39/25/20/402392520.db2.gz	CYCBTTCOQMEAGD-SJORKVTESA-N	0	3	301.434	2.492	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)[C@H]1CCCN1Cc1ccc(F)cc1	ZINC000245418475	402458651	/nfs/dbraw/zinc/45/86/51/402458651.db2.gz	KYGLEOQQXCDICV-DLBZAZTESA-N	0	3	319.424	2.001	10	0		DEAEHN
COc1cccc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1F	ZINC000245594519	402472854	/nfs/dbraw/zinc/47/28/54/402472854.db2.gz	RGQZKNZDMLUWGR-GXTWGEPZSA-N	0	3	306.381	2.391	10	0		DEAEHN
O=C(NCc1nc(C2CC2)cs1)N1CCN2CCC[C@H]2C1	ZINC000178228934	402474269	/nfs/dbraw/zinc/47/42/69/402474269.db2.gz	JJVUNQCMPSNFRX-LBPRGKRZSA-N	0	3	306.435	2.010	10	0		DEAEHN
Cc1ccc(CCNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cn1	ZINC000246135511	402512833	/nfs/dbraw/zinc/51/28/33/402512833.db2.gz	JDDIWWCUWYQTFC-HOCLYGCPSA-N	0	3	304.438	2.057	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CC(=O)Nc1cccc(F)c1	ZINC000178299453	402481627	/nfs/dbraw/zinc/48/16/27/402481627.db2.gz	XZFPYMGZVANODN-MRXNPFEDSA-N	0	3	316.380	2.434	10	0		DEAEHN
Cn1cc(CN2CC[C@H]3OCCC[C@H]3C2)c(-c2ccncc2)n1	ZINC000245736700	402483940	/nfs/dbraw/zinc/48/39/40/402483940.db2.gz	KYYAMFKBGXWXDA-DOTOQJQBSA-N	0	3	312.417	2.483	10	0		DEAEHN
CCc1nn(C)c(CC)c1CN1CCN(CCOC)[C@@H](CC)C1	ZINC000245784897	402487665	/nfs/dbraw/zinc/48/76/65/402487665.db2.gz	UZFIOTBRUQQBTP-HNNXBMFYSA-N	0	3	322.497	2.088	10	0		DEAEHN
COc1ccccc1[C@H](C)CC(=O)N1CCN2CCC[C@H]2C1	ZINC000245835392	402490899	/nfs/dbraw/zinc/49/08/99/402490899.db2.gz	CROQHNYSOOWRNH-CABCVRRESA-N	0	3	302.418	2.495	10	0		DEAEHN
CC[C@@H](C(=O)N1CCN2CCC[C@H]2C1)c1ccc(OC)cc1	ZINC000245866490	402492630	/nfs/dbraw/zinc/49/26/30/402492630.db2.gz	QHOZPBPYUZAWDZ-DOTOQJQBSA-N	0	3	302.418	2.495	10	0		DEAEHN
Cc1ccc(CN(C)CC(C)(C)CN2CCOCC2)c(C)n1	ZINC000187319945	402494021	/nfs/dbraw/zinc/49/40/21/402494021.db2.gz	DQKVAEJLSSHEHF-UHFFFAOYSA-N	0	3	305.466	2.489	10	0		DEAEHN
Cc1ccc(-c2cc(C(=O)N3CCCN(C)CC3)n[nH]2)c(C)c1	ZINC000187354205	402495740	/nfs/dbraw/zinc/49/57/40/402495740.db2.gz	FPACOPZDVDOWKS-UHFFFAOYSA-N	0	3	312.417	2.471	10	0		DEAEHN
CCCCCCNC(=O)[C@@H]1CCCN([C@H]2CCCCNC2=O)C1	ZINC000245907980	402496468	/nfs/dbraw/zinc/49/64/68/402496468.db2.gz	QYLOFGOBTIVPMU-CVEARBPZSA-N	0	3	323.481	2.064	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)[C@@H](O)C1CCCCC1	ZINC000187385300	402497446	/nfs/dbraw/zinc/49/74/46/402497446.db2.gz	IWAPLJOYNIGNDG-ROUUACIJSA-N	0	3	318.461	2.217	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C)cc2)[C@@H](C)C1	ZINC000246065460	402506615	/nfs/dbraw/zinc/50/66/15/402506615.db2.gz	DQWVQNYQERZOGV-GOEBONIOSA-N	0	3	310.463	2.346	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)NCCCc1ccccn1	ZINC000178808771	402542400	/nfs/dbraw/zinc/54/24/00/402542400.db2.gz	RGSBWJYRUCJCPI-HNNXBMFYSA-N	0	3	304.438	2.188	10	0		DEAEHN
Cc1ncc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c(C(C)C)n1	ZINC000246817028	402546218	/nfs/dbraw/zinc/54/62/18/402546218.db2.gz	VTLQVKDQNODLCM-TZMCWYRMSA-N	0	3	302.422	2.217	10	0		DEAEHN
CSCC[C@H](C)N(C)CC(=O)N1CCO[C@@H]2CCCC[C@@H]21	ZINC000247208137	402560215	/nfs/dbraw/zinc/56/02/15/402560215.db2.gz	VJNAMUKEIJLYDC-SOUVJXGZSA-N	0	3	314.495	2.230	10	0		DEAEHN
C[C@@H]1CN(C2CCN(Cc3ccnc(Cl)c3)CC2)CCO1	ZINC000171147089	402561650	/nfs/dbraw/zinc/56/16/50/402561650.db2.gz	ORKMQUFYDZQQGL-CYBMUJFWSA-N	0	3	309.841	2.420	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)N2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000247274489	402562056	/nfs/dbraw/zinc/56/20/56/402562056.db2.gz	YGZRXJIZWKTVKL-NWDGAFQWSA-N	0	3	307.360	2.312	10	0		DEAEHN
CC[C@H](C)NC(=O)CN[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000189893250	402564903	/nfs/dbraw/zinc/56/49/03/402564903.db2.gz	BYLQKASTBASOEK-KBPBESRZSA-N	0	3	300.406	2.438	10	0		DEAEHN
CN(CCCCNC(=O)NC[C@@H]1CCCN1C)c1ccccc1	ZINC000171192634	402565298	/nfs/dbraw/zinc/56/52/98/402565298.db2.gz	YRFIBVPGJJGSCU-KRWDZBQOSA-N	0	3	318.465	2.296	10	0		DEAEHN
COc1ccc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c(OC)c1	ZINC000247458664	402567728	/nfs/dbraw/zinc/56/77/28/402567728.db2.gz	QPWWEFGHPZOSPZ-STQMWFEESA-N	0	3	304.390	2.013	10	0		DEAEHN
COC(=O)c1ccc(CNC(=O)[C@H](C)N2[C@H](C)CC[C@@H]2C)cc1	ZINC000171235778	402569936	/nfs/dbraw/zinc/56/99/36/402569936.db2.gz	WKFIOSVJKAYODN-MJBXVCDLSA-N	0	3	318.417	2.351	10	0		DEAEHN
CCCn1c(C)cc(C(=O)CN2CCN3CCC[C@H]3C2)c1C	ZINC000246171602	402515037	/nfs/dbraw/zinc/51/50/37/402515037.db2.gz	GBHZRJXBKDFBOE-INIZCTEOSA-N	0	3	303.450	2.478	10	0		DEAEHN
CN(C)[C@H](CNC(=O)c1cn2ccnc2s1)c1ccccc1	ZINC000188143913	402516041	/nfs/dbraw/zinc/51/60/41/402516041.db2.gz	HIWRSOOMFGNIES-CYBMUJFWSA-N	0	3	314.414	2.429	10	0		DEAEHN
CCNC(=O)CN1CCCCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000246182491	402516382	/nfs/dbraw/zinc/51/63/82/402516382.db2.gz	HBWJMLDJCJGSGP-DLBZAZTESA-N	0	3	304.434	2.491	10	0		DEAEHN
CCC[C@@H](NC(=O)CN1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000178623112	402518293	/nfs/dbraw/zinc/51/82/93/402518293.db2.gz	GFMCAWFJUAVCPP-QZTJIDSGSA-N	0	3	315.461	2.424	10	0		DEAEHN
COc1ccc(NC(=O)CN2CCN3CCC[C@@H]3C2)cc1Cl	ZINC000178623753	402518460	/nfs/dbraw/zinc/51/84/60/402518460.db2.gz	WIDWYNCOAUYRIX-CYBMUJFWSA-N	0	3	323.824	2.067	10	0		DEAEHN
COC(=O)c1cccc(NC(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000246249215	402520156	/nfs/dbraw/zinc/52/01/56/402520156.db2.gz	PEHPKIVQSAXLIX-SWLSCSKDSA-N	0	3	319.405	2.323	10	0		DEAEHN
CCC[C@H](C(=O)NCCc1cc(OC)ccc1OC)N(C)C	ZINC000178652109	402521817	/nfs/dbraw/zinc/52/18/17/402521817.db2.gz	JINIZCKEYJMEAR-OAHLLOKOSA-N	0	3	308.422	2.093	10	0		DEAEHN
COC(=O)Cc1cccc(C(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000188619312	402521991	/nfs/dbraw/zinc/52/19/91/402521991.db2.gz	DDKYPSMDDGHZMD-INIZCTEOSA-N	0	3	320.433	2.108	10	0		DEAEHN
CCCOc1ccc(CNC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170828956	402530281	/nfs/dbraw/zinc/53/02/81/402530281.db2.gz	ZMNVRJQXSSAZIR-OAHLLOKOSA-N	0	3	305.422	2.321	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NC[C@@H]2CCCc3ccccc32)C1	ZINC000170830485	402530486	/nfs/dbraw/zinc/53/04/86/402530486.db2.gz	GXQYAYUWIMKBLG-HOTGVXAUSA-N	0	3	301.434	2.452	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)C1	ZINC000170836509	402531715	/nfs/dbraw/zinc/53/17/15/402531715.db2.gz	DNVDNHDWFPVRNK-IXDOHACOSA-N	0	3	317.433	2.252	10	0		DEAEHN
CCCN(CC)c1ccc(C(=O)N2CC[C@@H](N(C)C)C2)cn1	ZINC000170863787	402534184	/nfs/dbraw/zinc/53/41/84/402534184.db2.gz	IBROBLFHLVWXBY-OAHLLOKOSA-N	0	3	304.438	2.094	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(OC[C@H]3CCCO3)cc2)C1	ZINC000170861756	402534420	/nfs/dbraw/zinc/53/44/20/402534420.db2.gz	RYSOOCRJESVBPN-NVXWUHKLSA-N	0	3	318.417	2.021	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cnn(-c3ccc(Cl)cc3)c2)C1	ZINC000170865545	402534868	/nfs/dbraw/zinc/53/48/68/402534868.db2.gz	LFARJSKTVXVMIC-OAHLLOKOSA-N	0	3	318.808	2.302	10	0		DEAEHN
CCN(C)[C@@H](C(=O)N1CCN2CCCC[C@@H]2C1)c1ccccc1	ZINC000171477301	402588957	/nfs/dbraw/zinc/58/89/57/402588957.db2.gz	VQTAGBCKMBXNFC-QZTJIDSGSA-N	0	3	315.461	2.376	10	0		DEAEHN
CCN(CC)C(=O)[C@H]1CCCN1C[C@@H](O)CCc1ccccc1	ZINC000248569454	402596007	/nfs/dbraw/zinc/59/60/07/402596007.db2.gz	LREGEHHJKJZUGF-ZWKOTPCHSA-N	0	3	318.461	2.313	10	0		DEAEHN
CCSCc1cc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)no1	ZINC000248638232	402600404	/nfs/dbraw/zinc/60/04/04/402600404.db2.gz	MBADHQUAKGPNEK-NWDGAFQWSA-N	0	3	311.451	2.482	10	0		DEAEHN
C[C@@H](C(=O)Nc1c(F)cccc1F)N1CCN2CCC[C@@H]2C1	ZINC000171639043	402604672	/nfs/dbraw/zinc/60/46/72/402604672.db2.gz	CRDLERLYOSLBCJ-NWDGAFQWSA-N	0	3	309.360	2.072	10	0		DEAEHN
CCC[C@H](C)CN1CCN(C[C@@H]2CN(C(C)C)CCO2)CC1	ZINC000180089876	402607145	/nfs/dbraw/zinc/60/71/45/402607145.db2.gz	WQMJBMTYURUQPX-ZWKOTPCHSA-N	0	3	311.514	2.149	10	0		DEAEHN
O=C1Nc2ccccc2CC[C@@H]1N1CCC[C@@H](C2OCCO2)C1	ZINC000248803850	402608925	/nfs/dbraw/zinc/60/89/25/402608925.db2.gz	ATMKARQLSOHICJ-ZBFHGGJFSA-N	0	3	316.401	2.025	10	0		DEAEHN
CCc1nc(CNC(=O)N2CCCN(C3CC3)CC2)cs1	ZINC000171689831	402610131	/nfs/dbraw/zinc/61/01/31/402610131.db2.gz	BQBKSGYPQVDLNS-UHFFFAOYSA-N	0	3	308.451	2.085	10	0		DEAEHN
CN(C[C@@H]1CCCC[C@H]1O)[C@H]1CCc2ccccc2NC1=O	ZINC000248845985	402611186	/nfs/dbraw/zinc/61/11/86/402611186.db2.gz	NDVKGIGIBPTYCH-BHYGNILZSA-N	0	3	302.418	2.423	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cnn(C(C)C)c1C	ZINC000180333896	402613221	/nfs/dbraw/zinc/61/32/21/402613221.db2.gz	YJFPZJOXXUBTQD-HUUCEWRRSA-N	0	3	304.438	2.471	10	0		DEAEHN
CC(C)[C@@H](C)CNC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000180461542	402617312	/nfs/dbraw/zinc/61/73/12/402617312.db2.gz	VSMHVUJYNJZFGL-DLBZAZTESA-N	0	3	324.513	2.090	10	0		DEAEHN
CCC[C@H]1CN(Cc2cnn(CCC)c2)CCN1CCOC	ZINC000180465607	402617552	/nfs/dbraw/zinc/61/75/52/402617552.db2.gz	ZQXKESJIBMSKTP-KRWDZBQOSA-N	0	3	308.470	2.226	10	0		DEAEHN
Cc1cc2c(cc1C)[C@H](NC[C@@H]1CN(C)CCO1)CCCO2	ZINC000180490032	402618059	/nfs/dbraw/zinc/61/80/59/402618059.db2.gz	YJFPPYAMQNYUMF-NVXWUHKLSA-N	0	3	304.434	2.437	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)N[C@@H]2CCOc3ccccc32)C1	ZINC000171746450	402618088	/nfs/dbraw/zinc/61/80/88/402618088.db2.gz	IBZHAVNRLXILJU-UKRRQHHQSA-N	0	3	303.406	2.151	10	0		DEAEHN
COc1cccc(Cl)c1CNC(=O)N1CCN2CCC[C@H]2C1	ZINC000190766571	402621993	/nfs/dbraw/zinc/62/19/93/402621993.db2.gz	NPLGXTNDEALEOR-LBPRGKRZSA-N	0	3	323.824	2.338	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000249172949	402622298	/nfs/dbraw/zinc/62/22/98/402622298.db2.gz	LQBXBTSGKVXHRK-LSDHHAIUSA-N	0	3	317.433	2.183	10	0		DEAEHN
C[C@@H]1COCC[C@H]1N[C@H]1CCN(c2ccccc2Cl)C1=O	ZINC000249327558	402626116	/nfs/dbraw/zinc/62/61/16/402626116.db2.gz	SOSVFFGYJDBMPV-BNOWGMLFSA-N	0	3	308.809	2.460	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cnc(C(C)(C)C)nc2)C1	ZINC000171318456	402577535	/nfs/dbraw/zinc/57/75/35/402577535.db2.gz	OMNMBDSWOMQSBY-GFCCVEGCSA-N	0	3	305.426	2.380	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC/C=C/c1ccccc1	ZINC000171871072	402630323	/nfs/dbraw/zinc/63/03/23/402630323.db2.gz	MPFCCUWGXPHMAH-HFTQHKIXSA-N	0	3	317.433	2.110	10	0		DEAEHN
CN(C)C[C@H](NC(=O)N[C@H]1CCC[C@H]1CCO)c1ccccc1	ZINC000249478196	402630842	/nfs/dbraw/zinc/63/08/42/402630842.db2.gz	AMLOAFZLZYTBKI-ULQDDVLXSA-N	0	3	319.449	2.140	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CCCO[C@H]1C	ZINC000249432345	402629519	/nfs/dbraw/zinc/62/95/19/402629519.db2.gz	IUWWAFIGIPZNKV-FZCLSBEQSA-N	0	3	316.445	2.438	10	0		DEAEHN
Cc1ccccc1CNC(=O)CN(C)[C@@]1(CO)CC[C@@H](C)C1	ZINC000249534754	402633594	/nfs/dbraw/zinc/63/35/94/402633594.db2.gz	CCTGEXIOFKZYBH-KDOFPFPSSA-N	0	3	304.434	2.094	10	0		DEAEHN
Cc1ccc(CNC(=O)CN(C)[C@]2(CO)CC[C@@H](C)C2)cc1	ZINC000249545597	402634143	/nfs/dbraw/zinc/63/41/43/402634143.db2.gz	GETFXUVBAZIEMU-CRAIPNDOSA-N	0	3	304.434	2.094	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H]1CC(C)(C)OC1(C)C	ZINC000181873808	402659309	/nfs/dbraw/zinc/65/93/09/402659309.db2.gz	APAJOGMQEUQRFR-ZIAGYGMSSA-N	0	3	311.470	2.458	10	0		DEAEHN
COCCCN1CCC(NC(=O)N[C@H](C)C2CCCC2)CC1	ZINC000172226180	402646308	/nfs/dbraw/zinc/64/63/08/402646308.db2.gz	OYLCFKOBVRFDEH-CQSZACIVSA-N	0	3	311.470	2.365	10	0		DEAEHN
Cc1ccc(OC2CCN(C[C@@H](O)COC(C)(C)C)CC2)nc1	ZINC000181554491	402649732	/nfs/dbraw/zinc/64/97/32/402649732.db2.gz	LBURTFFXNFDRLF-OAHLLOKOSA-N	0	3	322.449	2.409	10	0		DEAEHN
CC[C@H]1CCCCN1C(=O)[C@@H](C)N1CCCN(C2CC2)CC1	ZINC000172347889	402651822	/nfs/dbraw/zinc/65/18/22/402651822.db2.gz	ZBQDDMMCSBMMRK-CVEARBPZSA-N	0	3	307.482	2.336	10	0		DEAEHN
C[C@H](C(=O)N1CCc2ccccc21)N1CCCN(C2CC2)CC1	ZINC000172346496	402651832	/nfs/dbraw/zinc/65/18/32/402651832.db2.gz	ZZTZZICEESEVSM-OAHLLOKOSA-N	0	3	313.445	2.134	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)N(C1CC1)C1CCCC1	ZINC000172345849	402651872	/nfs/dbraw/zinc/65/18/72/402651872.db2.gz	XRINPBYKQMOGQE-UHFFFAOYSA-N	0	3	305.466	2.090	10	0		DEAEHN
COCC(C)(C)NCC(=O)N1CCC[C@H]1c1ccc(OC)cc1	ZINC000173640075	402706333	/nfs/dbraw/zinc/70/63/33/402706333.db2.gz	QXJOLAOAXIVOOV-INIZCTEOSA-N	0	3	320.433	2.373	10	0		DEAEHN
CSc1ccc(OCCN2CC[C@H](N3CCOCC3)C2)cc1	ZINC000173947500	402721195	/nfs/dbraw/zinc/72/11/95/402721195.db2.gz	DLTFWBQPWNUUKP-HNNXBMFYSA-N	0	3	322.474	2.194	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1ncc(F)cc1F)c1ccccc1	ZINC000192094939	402710802	/nfs/dbraw/zinc/71/08/02/402710802.db2.gz	UQWSTLQZYGHVBY-CQSZACIVSA-N	0	3	305.328	2.393	10	0		DEAEHN
CCOC(=O)CCN[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1	ZINC000192151544	402714783	/nfs/dbraw/zinc/71/47/83/402714783.db2.gz	CUTGXFFVUSLXQT-BBRMVZONSA-N	0	3	324.808	2.155	10	0		DEAEHN
CCCOc1nc(C)ccc1C(=O)NC[C@H]1CCCN(C)C1	ZINC000191482692	402673136	/nfs/dbraw/zinc/67/31/36/402673136.db2.gz	TZKGBUMFHDKLAA-CQSZACIVSA-N	0	3	305.422	2.250	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1ccc2nnn(C)c2c1)c1ccccc1	ZINC000182372774	402684448	/nfs/dbraw/zinc/68/44/48/402684448.db2.gz	JJWCIGXFURDXTG-INIZCTEOSA-N	0	3	323.400	2.001	10	0		DEAEHN
Cc1cccc(C(=O)N2CCCC[C@@H](N3CCN(C)CC3)C2)c1	ZINC000173288879	402691301	/nfs/dbraw/zinc/69/13/01/402691301.db2.gz	HKWZQGTUXNXYAL-GOSISDBHSA-N	0	3	315.461	2.237	10	0		DEAEHN
COCCN1CCC(NC(=O)NC2CCC(C)(C)CC2)CC1	ZINC000173398928	402696201	/nfs/dbraw/zinc/69/62/01/402696201.db2.gz	JLNOPTCUPNRQOH-UHFFFAOYSA-N	0	3	311.470	2.365	10	0		DEAEHN
Cc1cc2c(cc1C)O[C@H](C(=O)N1C[C@H]3CCCN3C[C@@H]1C)C2	ZINC000173439261	402697266	/nfs/dbraw/zinc/69/72/66/402697266.db2.gz	KYTLEDRGIZDUEO-LESCRADOSA-N	0	3	314.429	2.302	10	0		DEAEHN
Cc1cccc2c1OCC[C@H]2NC(=O)N1CCN2CCC[C@H]2C1	ZINC000191908970	402698015	/nfs/dbraw/zinc/69/80/15/402698015.db2.gz	HPZFIZVTCWLAKE-GOEBONIOSA-N	0	3	315.417	2.308	10	0		DEAEHN
CN1CCN(CCCNCc2cocn2)[C@H](c2ccccc2)C1	ZINC000192284992	402720794	/nfs/dbraw/zinc/72/07/94/402720794.db2.gz	XWQLCKZFYOHMOG-SFHVURJKSA-N	0	3	314.433	2.143	10	0		DEAEHN
CNCC(=O)N[C@H](Cc1ccc(Cl)cc1)c1ccccn1	ZINC000262762190	402730446	/nfs/dbraw/zinc/73/04/46/402730446.db2.gz	JPMJOHRPPWUDTH-OAHLLOKOSA-N	0	3	303.793	2.354	10	0		DEAEHN
Cc1ccccc1CCNC(=O)[C@H](C)N[C@H](C)[C@@H]1CCCO1	ZINC000183121810	402740660	/nfs/dbraw/zinc/74/06/60/402740660.db2.gz	KCWCXBOYYVMXRZ-VYDXJSESSA-N	0	3	304.434	2.199	10	0		DEAEHN
C[C@H](NCC(=O)N(C)CCCOc1ccccc1)[C@@H]1CCCO1	ZINC000183124576	402741299	/nfs/dbraw/zinc/74/12/99/402741299.db2.gz	VCPRSCAAYOHKKK-RDJZCZTQSA-N	0	3	320.433	2.071	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000192646574	402742340	/nfs/dbraw/zinc/74/23/40/402742340.db2.gz	QNZNMKLTLBCBCR-XLNGHYISSA-N	0	3	302.418	2.221	10	0		DEAEHN
C[C@H](NCC(=O)Nc1nc(-c2ccco2)cs1)[C@H]1CCCO1	ZINC000183165955	402744441	/nfs/dbraw/zinc/74/44/41/402744441.db2.gz	YXKSQVGYCZCEGV-CMPLNLGQSA-N	0	3	321.402	2.499	10	0		DEAEHN
C[C@@H](NCC(=O)NCC1CCC1)c1ccccc1-n1cccn1	ZINC000183173734	402744488	/nfs/dbraw/zinc/74/44/88/402744488.db2.gz	LLTWHHAKNLZDMZ-CQSZACIVSA-N	0	3	312.417	2.439	10	0		DEAEHN
CC[C@@H](Oc1ccccc1F)c1nc([C@H]2CNCCN2C)no1	ZINC000263238959	402748957	/nfs/dbraw/zinc/74/89/57/402748957.db2.gz	OJQWUHFVGFPGBE-CHWSQXEVSA-N	0	3	320.368	2.315	10	0		DEAEHN
C[C@H](Oc1ccc(F)c(F)c1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263248456	402750209	/nfs/dbraw/zinc/75/02/09/402750209.db2.gz	PPDJYMVHHJOJOQ-ZANVPECISA-N	0	3	324.331	2.064	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2cc(F)cc3cccnc32)[C@@H](C)C1	ZINC000192815731	402751459	/nfs/dbraw/zinc/75/14/59/402751459.db2.gz	UKQCRGIQJBLAOG-UONOGXRCSA-N	0	3	317.408	2.261	10	0		DEAEHN
C[C@H](C(=O)N(CCN(C)C)Cc1ccccn1)c1cccnc1	ZINC000174687913	402752207	/nfs/dbraw/zinc/75/22/07/402752207.db2.gz	QWCOUIBBTQWITL-HNNXBMFYSA-N	0	3	312.417	2.171	10	0		DEAEHN
CSCc1cc(-c2nc([C@H]3CNCCN3C)no2)ccc1F	ZINC000263267174	402752382	/nfs/dbraw/zinc/75/23/82/402752382.db2.gz	RSHVGNUYVKXWHB-CYBMUJFWSA-N	0	3	322.409	2.315	10	0		DEAEHN
C[C@@H](O)CCN(C)C[C@H](O)COc1c(Cl)cccc1Cl	ZINC000174792979	402757856	/nfs/dbraw/zinc/75/78/56/402757856.db2.gz	MONFQVMHKPWQNC-MNOVXSKESA-N	0	3	322.232	2.436	10	0		DEAEHN
C[C@H](COCc1ccccc1)NC(=O)NC[C@@H]1CCCN(C)C1	ZINC000174805771	402757981	/nfs/dbraw/zinc/75/79/81/402757981.db2.gz	MRBNXBIBSLTMBW-WBVHZDCISA-N	0	3	319.449	2.233	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)N(Cc1ccco1)C1CCN(C)CC1	ZINC000193944603	402779867	/nfs/dbraw/zinc/77/98/67/402779867.db2.gz	JNTDMWIRXMTJOT-RHSMWYFYSA-N	0	3	320.433	2.375	10	0		DEAEHN
CC(C)N(C)C(=O)NCc1ccccc1CN1CCC[C@H]1CO	ZINC000182881274	402724001	/nfs/dbraw/zinc/72/40/01/402724001.db2.gz	RCDPHEYWMRHAGH-KRWDZBQOSA-N	0	3	319.449	2.193	10	0		DEAEHN
C[C@H](CC(=O)OC(C)(C)C)NCc1cccnc1-n1ccnc1	ZINC000183704354	402790695	/nfs/dbraw/zinc/79/06/95/402790695.db2.gz	YZIAUMLWYMTPLE-CYBMUJFWSA-N	0	3	316.405	2.477	10	0		DEAEHN
CCOC(=O)CNCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000194298316	402791023	/nfs/dbraw/zinc/79/10/23/402791023.db2.gz	GKNKANUTYAPLBD-UHFFFAOYSA-N	0	3	320.433	2.060	10	0		DEAEHN
C[C@H]1COCC[C@H]1C(=O)N(CCN(C)C)Cc1cccc(F)c1	ZINC000194354789	402793479	/nfs/dbraw/zinc/79/34/79/402793479.db2.gz	XRXYUFVWDDFEMB-WMLDXEAASA-N	0	3	322.424	2.389	10	0		DEAEHN
O=C(CCCc1nc2ccccc2[nH]1)N1CCN2CCC[C@@H]2C1	ZINC000195330807	402842254	/nfs/dbraw/zinc/84/22/54/402842254.db2.gz	WENITQWRAXJZLK-CQSZACIVSA-N	0	3	312.417	2.192	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)Nc1cc(C)ccc1OC	ZINC000175357750	402799605	/nfs/dbraw/zinc/79/96/05/402799605.db2.gz	DXKIJIXULZUQAH-OAHLLOKOSA-N	0	3	319.449	2.358	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N[C@@H](C)COCc1ccccc1	ZINC000175369516	402800701	/nfs/dbraw/zinc/80/07/01/402800701.db2.gz	BFQOVZAUBBNZEL-RDJZCZTQSA-N	0	3	319.449	2.375	10	0		DEAEHN
COc1ccccc1[C@H](O)CNC(=O)[C@H](C)N1CCCCCC1	ZINC000175375441	402801181	/nfs/dbraw/zinc/80/11/81/402801181.db2.gz	URSXZPMSRQJXNU-GOEBONIOSA-N	0	3	320.433	2.109	10	0		DEAEHN
C[C@]1(CNC(=O)NCCCCO)CCCN1Cc1ccccc1	ZINC000194574657	402803370	/nfs/dbraw/zinc/80/33/70/402803370.db2.gz	GLLIFRHXNCGEMJ-GOSISDBHSA-N	0	3	319.449	2.113	10	0		DEAEHN
Cc1cc(CCCC(=O)N2CCO[C@@H](CN(C)C)C2)c(C)s1	ZINC000175421340	402805511	/nfs/dbraw/zinc/80/55/11/402805511.db2.gz	DCIKNSGCNIZFNM-INIZCTEOSA-N	0	3	324.490	2.477	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Cc2ccc(-n3cccn3)cc2)C1	ZINC000194660601	402808523	/nfs/dbraw/zinc/80/85/23/402808523.db2.gz	CSDOGRUKLHZPPL-INIZCTEOSA-N	0	3	312.417	2.015	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@@H]2CCCc3cccnc32)C1	ZINC000194677475	402809825	/nfs/dbraw/zinc/80/98/25/402809825.db2.gz	CTSBRKDCRAUGBB-BMFZPTHFSA-N	0	3	301.434	2.346	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1C(=O)C1CCN(C2CC2)CC1	ZINC000194725999	402812914	/nfs/dbraw/zinc/81/29/14/402812914.db2.gz	UNWYNCZVGWNULU-KRWDZBQOSA-N	0	3	316.449	2.057	10	0		DEAEHN
COc1cc(CN[C@@H]2CC(=O)N(c3ccccc3)C2)ccc1O	ZINC000194977031	402825167	/nfs/dbraw/zinc/82/51/67/402825167.db2.gz	XSQBAVHEWBGLBP-CQSZACIVSA-N	0	3	312.369	2.296	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)N[C@H]1COc2ccccc21	ZINC000195197671	402836551	/nfs/dbraw/zinc/83/65/51/402836551.db2.gz	VTTKNWVBJXOQLR-ZFWWWQNUSA-N	0	3	303.406	2.294	10	0		DEAEHN
COC[C@](C)(CCO)NCc1cc(Cl)c(OC)c(OC)c1	ZINC000175855712	402838414	/nfs/dbraw/zinc/83/84/14/402838414.db2.gz	LLJHONYMZVYTNN-HNNXBMFYSA-N	0	3	317.813	2.234	10	0		DEAEHN
COc1ccc2c(CC(=O)N3CCN4CCC[C@H]4C3)coc2c1	ZINC000195310859	402841415	/nfs/dbraw/zinc/84/14/15/402841415.db2.gz	BVZYAAVYKDFYMH-AWEZNQCLSA-N	0	3	314.385	2.291	10	0		DEAEHN
CCOc1ccc(C(=O)N2CCN3CCC[C@H]3C2)cc1OC	ZINC000195311952	402841456	/nfs/dbraw/zinc/84/14/56/402841456.db2.gz	IFBGRPWJXGJMEL-AWEZNQCLSA-N	0	3	304.390	2.014	10	0		DEAEHN
C[C@H]1C[C@H](C)CN(C(=O)CN2CCC(c3ccn[nH]3)CC2)C1	ZINC000195506067	402848102	/nfs/dbraw/zinc/84/81/02/402848102.db2.gz	AHHGDIBOLJBYCP-KBPBESRZSA-N	0	3	304.438	2.094	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@@H]1NCc1ccc(Br)cc1F	ZINC000282262651	403137645	/nfs/dbraw/zinc/13/76/45/403137645.db2.gz	HCIXSCSNBCVYAX-UFBFGSQYSA-N	0	3	315.186	2.345	10	0		DEAEHN
Cn1nccc1[C@H]1[C@H](N[C@H]2C=CCCCCC2)CC(=O)N1C	ZINC000293710145	403543749	/nfs/dbraw/zinc/54/37/49/403543749.db2.gz	XSFAUZBZLLKUEX-JJRVBVJISA-N	0	3	302.422	2.170	10	0		DEAEHN
C(CN1CCCCC1)O[C@@H]1CCN(c2nc(C3CC3)ns2)C1	ZINC000301857939	403691558	/nfs/dbraw/zinc/69/15/58/403691558.db2.gz	SBMPSHMFOAAGCY-CQSZACIVSA-N	0	3	322.478	2.497	10	0		DEAEHN
Cc1cc(N2CCO[C@H](CO)C2)c2cc(OC(F)F)ccc2n1	ZINC000301564307	403648295	/nfs/dbraw/zinc/64/82/95/403648295.db2.gz	PONLMGDQKBNHTM-LBPRGKRZSA-N	0	3	324.327	2.342	10	0		DEAEHN
Cc1cccc2c1ncnc2N1CCN(CC(C)(C)O)C[C@H]1C	ZINC000302567348	403712069	/nfs/dbraw/zinc/71/20/69/403712069.db2.gz	XCTLPMIVPVKQNM-CQSZACIVSA-N	0	3	314.433	2.220	10	0		DEAEHN
CCOC(=O)COCCN1CCC(OCc2ccccc2)CC1	ZINC000347712721	403821152	/nfs/dbraw/zinc/82/11/52/403821152.db2.gz	BAFJNNAMZNXYEV-UHFFFAOYSA-N	0	3	321.417	2.247	10	0		DEAEHN
O[C@H](CCNCc1ccc(Br)o1)C(F)(F)F	ZINC000336669306	403911630	/nfs/dbraw/zinc/91/16/30/403911630.db2.gz	GXKWGIWKSBLYOX-SSDOTTSWSA-N	0	3	302.090	2.445	10	0		DEAEHN
Cc1c(C(=O)N[C@H]2CC[C@@H](N(C)C)C2)[nH]c2c1C(=O)CCC2	ZINC000337156995	403969435	/nfs/dbraw/zinc/96/94/35/403969435.db2.gz	PXYAKXSLBCMMEP-NWDGAFQWSA-N	0	3	303.406	2.055	10	0		DEAEHN
C[C@H]1CN(Cc2ncc(C3CC3)o2)CC[C@H]1N1CCN(C)CC1	ZINC000370149758	404349989	/nfs/dbraw/zinc/34/99/89/404349989.db2.gz	POUVJGJPQXWDOI-GOEBONIOSA-N	0	3	318.465	2.010	10	0		DEAEHN
CCOC(=O)[C@H]1CN(CCSc2ccccc2)CC12COC2	ZINC000451138211	404877349	/nfs/dbraw/zinc/87/73/49/404877349.db2.gz	QFEBVIZCOGZTGD-OAHLLOKOSA-N	0	3	321.442	2.290	10	0		DEAEHN
c1cc(-c2ccc(CN[C@H]3CCO[C@]4(CCOC4)C3)o2)n[nH]1	ZINC000366822977	404853292	/nfs/dbraw/zinc/85/32/92/404853292.db2.gz	HBSSDFSOSBMNRS-BLLLJJGKSA-N	0	3	303.362	2.097	10	0		DEAEHN
c1ncn(-c2ccc(CN3CC[C@@H](Oc4ccccn4)C3)cc2)n1	ZINC000378348575	404936102	/nfs/dbraw/zinc/93/61/02/404936102.db2.gz	YYQHSMICXGNTDA-QGZVFWFLSA-N	0	3	321.384	2.316	10	0		DEAEHN
Cc1nc([C@@H]2CCCN(Cc3ccc(-c4cc[nH]n4)o3)C2)n[nH]1	ZINC000434986633	404947840	/nfs/dbraw/zinc/94/78/40/404947840.db2.gz	IEYKCCKEBPJXFW-GFCCVEGCSA-N	0	3	312.377	2.476	10	0		DEAEHN
Cc1n[nH]c([C@@H]2CCCN(Cc3ccc(-c4cc[nH]n4)o3)C2)n1	ZINC000434986633	404947846	/nfs/dbraw/zinc/94/78/46/404947846.db2.gz	IEYKCCKEBPJXFW-GFCCVEGCSA-N	0	3	312.377	2.476	10	0		DEAEHN
CC(=O)N1CCC(Nc2cccc3c2OCC[C@@H]3N(C)C)CC1	ZINC000435025622	404951386	/nfs/dbraw/zinc/95/13/86/404951386.db2.gz	JGYQGMNZTLRWPX-KRWDZBQOSA-N	0	3	317.433	2.495	10	0		DEAEHN
c1cn(-c2ccccc2)nc1CN[C@@H]1CCO[C@]2(CCOC2)C1	ZINC000367365675	405026125	/nfs/dbraw/zinc/02/61/25/405026125.db2.gz	QOHHAWVUGWNDFX-CRAIPNDOSA-N	0	3	313.401	2.300	10	0		DEAEHN
C[C@@H]1CCOCCN1C[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000367460165	405056287	/nfs/dbraw/zinc/05/62/87/405056287.db2.gz	YYGYOZSLWUJJDX-MJGOQNOKSA-N	0	3	318.461	2.388	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ncccc1N	ZINC000398032047	405060509	/nfs/dbraw/zinc/06/05/09/405060509.db2.gz	GYWMUSRNFALGGQ-YOEHRIQHSA-N	0	3	324.428	2.304	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CCCC[C@H](N3CCCC3)C2)o1	ZINC000408096403	405111602	/nfs/dbraw/zinc/11/16/02/405111602.db2.gz	BCFRTACZSNBVJN-AWEZNQCLSA-N	0	3	312.435	2.227	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)NC[C@H](C)N1CCC[C@@H](C)C1	ZINC000454504158	405354765	/nfs/dbraw/zinc/35/47/65/405354765.db2.gz	JIBIYUPOHLFICL-OLZOCXBDSA-N	0	3	322.453	2.465	10	0		DEAEHN
c1ccc2c(c1)CCN2CC1CCN(C[C@H]2COCCO2)CC1	ZINC000431002534	405556891	/nfs/dbraw/zinc/55/68/91/405556891.db2.gz	CWMMPLSQWMZKNU-SFHVURJKSA-N	0	3	316.445	2.177	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NCC[C@@H]1CC=CCC1	ZINC000638597805	405564550	/nfs/dbraw/zinc/56/45/50/405564550.db2.gz	BEQWZQHHQQPHPL-AEFFLSMTSA-N	0	3	315.461	2.308	10	0		DEAEHN
CCC(C)(C)CCNC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638867011	405728486	/nfs/dbraw/zinc/72/84/86/405728486.db2.gz	WSEQLTQTEAWIQF-INIZCTEOSA-N	0	3	305.466	2.388	10	0		DEAEHN
CC(C)(C)N1CCCN(C(=O)NCCOCC2CCC2)CC1	ZINC000584087455	405820272	/nfs/dbraw/zinc/82/02/72/405820272.db2.gz	MRHRKYPYBSYEOD-UHFFFAOYSA-N	0	3	311.470	2.319	10	0		DEAEHN
CC(=O)[C@](C)(O)CN(C)CCCc1cc(-c2ccccc2)n[nH]1	ZINC000450328406	405837494	/nfs/dbraw/zinc/83/74/94/405837494.db2.gz	BTXJLKZFNQPGFM-GOSISDBHSA-N	0	3	315.417	2.281	10	0		DEAEHN
c1c2c(cc3c1OCCC[C@H]3NC[C@@H]1CNCCO1)CCCC2	ZINC000423531128	405845896	/nfs/dbraw/zinc/84/58/96/405845896.db2.gz	XOYDROQNQXJOHJ-FUHWJXTLSA-N	0	3	316.445	2.357	10	0		DEAEHN
CC(C)Oc1ccc2nccc(N(C)Cc3nnnn3C)c2c1	ZINC000450375503	405863736	/nfs/dbraw/zinc/86/37/36/405863736.db2.gz	FACHUTDIMHJYGG-UHFFFAOYSA-N	0	3	312.377	2.182	10	0		DEAEHN
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(-n2cccn2)c(F)c1	ZINC000451067817	406037296	/nfs/dbraw/zinc/03/72/96/406037296.db2.gz	AIZDFFOWGYVSHX-MEDUHNTESA-N	0	3	305.353	2.002	10	0		DEAEHN
COCCOCCN1CCC[C@H](CC(=O)OC(C)(C)C)C1	ZINC000531614805	405984664	/nfs/dbraw/zinc/98/46/64/405984664.db2.gz	FRYSZDFPMKSSHD-CQSZACIVSA-N	0	3	301.427	2.093	10	0		DEAEHN
C[C@H]1CCN(CCNC(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC000562402857	406003536	/nfs/dbraw/zinc/00/35/36/406003536.db2.gz	FZGXJBFQXPMEKW-LBPRGKRZSA-N	0	3	303.381	2.389	10	0		DEAEHN
c1nc2n(n1)[C@H](CN1CCC(OCc3ccccc3)CC1)CC2	ZINC000639432619	406085267	/nfs/dbraw/zinc/08/52/67/406085267.db2.gz	FSBJAKRYYOEQLX-INIZCTEOSA-N	0	3	312.417	2.447	10	0		DEAEHN
C(c1noc(CN2CCN(C3CCCCC3)CC2)n1)C1CC1	ZINC000639518449	406126498	/nfs/dbraw/zinc/12/64/98/406126498.db2.gz	HULVBKMPHWSCCJ-UHFFFAOYSA-N	0	3	304.438	2.472	10	0		DEAEHN
C(c1noc(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)n1)C1CC1	ZINC000639543743	406138999	/nfs/dbraw/zinc/13/89/99/406138999.db2.gz	OUOFUCJGWRDUKS-GDBMZVCRSA-N	0	3	316.449	2.471	10	0		DEAEHN
CC(C)[C@@H]1CCCN1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637920615	406478118	/nfs/dbraw/zinc/47/81/18/406478118.db2.gz	OGQWLDKVGBVGHR-SJORKVTESA-N	0	3	303.450	2.093	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)[C@H]1C	ZINC000637971504	406502591	/nfs/dbraw/zinc/50/25/91/406502591.db2.gz	WCKAOOCEEAUYQY-HLLBOEOZSA-N	0	3	303.450	2.093	10	0		DEAEHN
O[C@H](COC[C@@H]1CCCO1)CN1CC[C@H](c2cccc(F)c2)C1	ZINC000552254110	406700371	/nfs/dbraw/zinc/70/03/71/406700371.db2.gz	MHIKUCADSPTKAX-SZMVWBNQSA-N	0	3	323.408	2.172	10	0		DEAEHN
Brc1ccc(-c2noc([C@H]3CNCCOC3)n2)cc1	ZINC000644512881	407133106	/nfs/dbraw/zinc/13/31/06/407133106.db2.gz	HVCQQRYIQXJCJB-JTQLQIEISA-N	0	3	324.178	2.203	10	0		DEAEHN
C[C@H](N)[C@H](c1ccc(Cl)s1)N1CCC(OCCO)CC1	ZINC000128792591	195992227	/nfs/dbraw/zinc/99/22/27/195992227.db2.gz	HXMXCHPLDQAICT-IINYFYTJSA-N	0	3	318.870	2.263	10	0		DEAEHN
Cc1cc2c(=O)n(CCN[C@@H](C)c3cccs3)ccn2n1	ZINC000130743903	196106104	/nfs/dbraw/zinc/10/61/04/196106104.db2.gz	AAAROERXAMTNJS-LBPRGKRZSA-N	0	3	302.403	2.217	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@@H](C)C(=O)N2C[C@@H](C)N2CCCC2)s1	ZINC000130751777	196107616	/nfs/dbraw/zinc/10/76/16/196107616.db2.gz	XCKJOZOJPBMELF-OSAQELSMSA-N	0	3	307.463	2.360	10	0		DEAEHN
CCN[C@@H](C)c1c(CC)nn([C@@H]2CCS(=O)(=O)C2)c1CC	ZINC000131106319	196140767	/nfs/dbraw/zinc/14/07/67/196140767.db2.gz	SSFOZFNQEVSOCG-NWDGAFQWSA-N	0	3	313.467	2.038	10	0		DEAEHN
CS(=O)(=O)CCC[C@@H](N)c1cc2c(s1)CCSC2	ZINC000131151217	196144596	/nfs/dbraw/zinc/14/45/96/196144596.db2.gz	QSFQOSTUHOQDLJ-SNVBAGLBSA-N	0	3	305.490	2.362	10	0		DEAEHN
Cc1c(CN)cccc1S(=O)(=O)NCCCCC(F)(F)F	ZINC000131239378	196152475	/nfs/dbraw/zinc/15/24/75/196152475.db2.gz	NGRLMNMXCPJPBW-UHFFFAOYSA-N	0	3	324.368	2.465	10	0		DEAEHN
CNC(=O)NC(=O)[C@@H](C)N[C@@H](C)c1ccc(OCC(C)C)cc1	ZINC000131392385	196164534	/nfs/dbraw/zinc/16/45/34/196164534.db2.gz	WNEOMPVQZGRQNB-QWHCGFSZSA-N	0	3	321.421	2.216	10	0		DEAEHN
C[S@@](=O)CCCNCc1ccc(Br)c(F)c1	ZINC000131651812	196187715	/nfs/dbraw/zinc/18/77/15/196187715.db2.gz	QBNGZDYXCOIXAU-INIZCTEOSA-N	0	3	308.216	2.446	10	0		DEAEHN
CCCN[C@H](CCCS(=O)(=O)CC)c1ncccc1F	ZINC000131732934	196194505	/nfs/dbraw/zinc/19/45/05/196194505.db2.gz	BFTSPAILCUKDPD-CYBMUJFWSA-N	0	3	302.415	2.476	10	0		DEAEHN
O=C(N[C@@H]1CCC[C@@H](OCC(F)(F)F)C1)[C@@H]1CCCCN1	ZINC000132326852	196246445	/nfs/dbraw/zinc/24/64/45/196246445.db2.gz	CCWZKWOKQFNBOC-UTUOFQBUSA-N	0	3	308.344	2.135	10	0		DEAEHN
C[C@H]1CNC[C@@H](COCc2cccc(F)c2Br)O1	ZINC000132495840	196260681	/nfs/dbraw/zinc/26/06/81/196260681.db2.gz	OXTFFPOEXQSJRV-ONGXEEELSA-N	0	3	318.186	2.482	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)N[C@@H]1[C@H]2CCO[C@H]2C12CCC2	ZINC000245564224	287270259	/nfs/dbraw/zinc/27/02/59/287270259.db2.gz	WEGOXVASBRBSHQ-KLHDSHLOSA-N	0	3	321.465	2.118	10	0		DEAEHN
CCc1nc(C2(NC)CCN(C(=O)N(C)C)CC2)sc1C	ZINC000132902825	196294855	/nfs/dbraw/zinc/29/48/55/196294855.db2.gz	GXQFSJOHVYMPRH-UHFFFAOYSA-N	0	3	310.467	2.206	10	0		DEAEHN
CC[C@@H](CSC)NS(=O)(=O)c1cccc([C@@H](C)N)c1	ZINC000133233171	196323821	/nfs/dbraw/zinc/32/38/21/196323821.db2.gz	XDPPHTBLPOZZPH-PWSUYJOCSA-N	0	3	302.465	2.126	10	0		DEAEHN
CN(C)CCNC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000133899825	196344920	/nfs/dbraw/zinc/34/49/20/196344920.db2.gz	HHDBETOQCWVUBT-GFCCVEGCSA-N	0	3	303.328	2.021	10	0		DEAEHN
CC[S@@](=O)CCN1C[C@@H]2CCCN2C[C@@H]1c1ccccc1	ZINC000134235434	196372633	/nfs/dbraw/zinc/37/26/33/196372633.db2.gz	VJUQEIUXQIKNEU-FVJLSDCUSA-N	0	3	306.475	2.276	10	0		DEAEHN
CC(C)(N)c1cn(Cc2ccc(Br)cc2F)nn1	ZINC000070117848	424841719	/nfs/dbraw/zinc/84/17/19/424841719.db2.gz	FBYWBMHBUWMREN-UHFFFAOYSA-N	0	3	313.174	2.422	10	0		DEAEHN
CN(Cc1ccc(Cl)cc1)C[C@@H](O)COC[C@@H]1CCCO1	ZINC000068047632	424842151	/nfs/dbraw/zinc/84/21/51/424842151.db2.gz	OIEWNYYCCLVVEW-CVEARBPZSA-N	0	3	313.825	2.328	10	0		DEAEHN
CCn1ncnc1CNC[C@@H]1CCCCN1Cc1ccccc1	ZINC000379650348	424908189	/nfs/dbraw/zinc/90/81/89/424908189.db2.gz	RNBJHHNAETZXLL-KRWDZBQOSA-N	0	3	313.449	2.442	10	0		DEAEHN
CN(C(=O)c1ccc(CN)o1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000390783560	424917628	/nfs/dbraw/zinc/91/76/28/424917628.db2.gz	UOMDNTNHJXLLED-OAHLLOKOSA-N	0	3	313.401	2.085	10	0		DEAEHN
CC(C)O[C@H]1CCCN(C[C@@H](O)COCc2ccccc2)C1	ZINC000404487755	424927872	/nfs/dbraw/zinc/92/78/72/424927872.db2.gz	ODNDTBIJZYEMJO-MSOLQXFVSA-N	0	3	307.434	2.454	10	0		DEAEHN
Brc1cncnc1NCCc1ccc2cn[nH]c2c1	ZINC000343074908	424971688	/nfs/dbraw/zinc/97/16/88/424971688.db2.gz	GWIAWIUIAPHIOH-UHFFFAOYSA-N	0	3	318.178	2.770	10	0		DEAEHN
CCN1CC[C@H](N(C)CCS(=O)(=O)c2ccccc2)[C@H](C)C1	ZINC000081095291	267378005	/nfs/dbraw/zinc/37/80/05/267378005.db2.gz	DPZJVEGEGMAYNE-WBVHZDCISA-N	0	3	324.490	2.122	10	0		DEAEHN
CCc1noc(CC)c1CC(=O)N1CCCN(C2CC2)CC1	ZINC000087220513	267393540	/nfs/dbraw/zinc/39/35/40/267393540.db2.gz	YXNHXHBBTAXXFZ-UHFFFAOYSA-N	0	3	305.422	2.039	10	0		DEAEHN
OCC1CC(NCc2cc3c(c(Br)c2)OCO3)C1	ZINC000657808320	425405088	/nfs/dbraw/zinc/40/50/88/425405088.db2.gz	FECDBLXUSRVGJZ-UHFFFAOYSA-N	0	3	314.179	2.038	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)Cc1ccc(OC(F)(F)F)cc1	ZINC000194697671	268555902	/nfs/dbraw/zinc/55/59/02/268555902.db2.gz	KMIIDEKFLMZYCE-LBPRGKRZSA-N	0	3	316.323	2.338	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CC[C@H](Cc2ccncc2)C1	ZINC000363718807	269073546	/nfs/dbraw/zinc/07/35/46/269073546.db2.gz	NSOAAYXZBHRIRZ-SJORKVTESA-N	0	3	316.449	2.140	10	0		DEAEHN
C[C@H](COCc1ccccc1)NCc1cnc(N(C)C)n1C	ZINC000390527413	269097370	/nfs/dbraw/zinc/09/73/70/269097370.db2.gz	JWWKKUUQKYSXOY-CQSZACIVSA-N	0	3	302.422	2.181	10	0		DEAEHN
CCc1nc2n(n1)C[C@H](N[C@H]1CCc3ccc(OC)cc31)CC2	ZINC000180608611	273776052	/nfs/dbraw/zinc/77/60/52/273776052.db2.gz	RKWABSFRQIWGNJ-CJNGLKHVSA-N	0	3	312.417	2.441	10	0		DEAEHN
COc1ccc(-c2nc3c(c(N4CCNCC4)n2)CCC3)cc1	ZINC000057328767	274104304	/nfs/dbraw/zinc/10/43/04/274104304.db2.gz	KADDCEMEDSCMOL-UHFFFAOYSA-N	0	3	310.401	2.051	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1nc(-c2ccco2)cs1)[C@@H]1CCCO1	ZINC000183165939	274246066	/nfs/dbraw/zinc/24/60/66/274246066.db2.gz	YXKSQVGYCZCEGV-PWSUYJOCSA-N	0	3	321.402	2.499	10	0		DEAEHN
O=C([C@@H]1CCCc2c(O)cccc21)N1CCN2CCC[C@H]2C1	ZINC000248914464	275004915	/nfs/dbraw/zinc/00/49/15/275004915.db2.gz	SJKAXFHAMCVHLW-XJKSGUPXSA-N	0	3	300.402	2.119	10	0		DEAEHN
c1ccc2c(c1)CC[C@H](CN1CCN(c3cnccn3)CC1)C2	ZINC000359586948	275069882	/nfs/dbraw/zinc/06/98/82/275069882.db2.gz	DKYLYXUYENWTNO-INIZCTEOSA-N	0	3	308.429	2.404	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)NCc1ccc2cc[nH]c2n1	ZINC000357796917	276160533	/nfs/dbraw/zinc/16/05/33/276160533.db2.gz	IVRBQKRFCWAXDP-HNNXBMFYSA-N	0	3	315.421	2.237	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCCCNc2ccccn2)C1	ZINC000105174576	276166709	/nfs/dbraw/zinc/16/67/09/276166709.db2.gz	YLJFUQVOUXISRR-OAHLLOKOSA-N	0	3	319.453	2.057	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc(-n2ccnc2)cc1	ZINC000176995890	276181555	/nfs/dbraw/zinc/18/15/55/276181555.db2.gz	OIMSDDMJGABSMK-KRWDZBQOSA-N	0	3	312.417	2.429	10	0		DEAEHN
CCN1CC[C@@H]2OCCN(CCc3ccc(F)c(F)c3)[C@@H]2C1	ZINC000339385525	276220159	/nfs/dbraw/zinc/22/01/59/276220159.db2.gz	QLCLKJMTTJHKAC-SJORKVTESA-N	0	3	310.388	2.302	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@@H]2c3ccccc3C[C@@H]2O)C12CCOCC2	ZINC000186271245	276481608	/nfs/dbraw/zinc/48/16/08/276481608.db2.gz	WJOJPPJKOUTQRI-WNRNVDISSA-N	0	3	317.429	2.209	10	0		DEAEHN
CN(c1cccnn1)C1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000105806682	277003474	/nfs/dbraw/zinc/00/34/74/277003474.db2.gz	GCWKCYAULHMKBC-KRWDZBQOSA-N	0	3	312.417	2.111	10	0		DEAEHN
CC(=O)Nc1ccc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc1	ZINC000155531847	277070965	/nfs/dbraw/zinc/07/09/65/277070965.db2.gz	NLXKNRMSKDTVSK-LRDDRELGSA-N	0	3	303.406	2.104	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(C(=O)C3CCCCC3)C2)CC1	ZINC000173275980	277111449	/nfs/dbraw/zinc/11/14/49/277111449.db2.gz	WTZGPRAZLJYUBH-KRWDZBQOSA-N	0	3	307.482	2.195	10	0		DEAEHN
COc1ccccc1/C=C/CN1CCN(CC(C)(C)O)[C@H](C)C1	ZINC000188890344	278045651	/nfs/dbraw/zinc/04/56/51/278045651.db2.gz	OHKHDECTMDJAAP-MNDMWVCDSA-N	0	3	318.461	2.485	10	0		DEAEHN
C[C@H](C1CC1)N(C(=O)CN1CC[C@@]2(O)CCCC[C@H]2C1)C1CC1	ZINC000248202576	278160257	/nfs/dbraw/zinc/16/02/57/278160257.db2.gz	ZEYFPVKPJRHOQZ-ALKREAHSSA-N	0	3	320.477	2.403	10	0		DEAEHN
CC(C)(C)S(=O)(=O)CCN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2	ZINC000181955700	278479136	/nfs/dbraw/zinc/47/91/36/278479136.db2.gz	XRGQRXGACPELQJ-MCIONIFRSA-N	0	3	315.479	2.137	10	0		DEAEHN
C[C@@](C[NH3+])([N-]S(=O)(=O)c1c(Cl)cccc1Cl)C1CC1	ZINC000130369387	279148749	/nfs/dbraw/zinc/14/87/49/279148749.db2.gz	XMZLPQOTZUIDEY-LBPRGKRZSA-N	0	3	323.245	2.399	10	0		DEAEHN
CC(C)C[C@H](N)C(=O)N1CCC(C(=O)N2CCCCCC2)CC1	ZINC000150767337	279174871	/nfs/dbraw/zinc/17/48/71/279174871.db2.gz	GORPLZRMBCLQIC-INIZCTEOSA-N	0	3	323.481	2.001	10	0		DEAEHN
CC[C@H](O)CN1CCN(C/C=C\c2ccccc2OC)CC1	ZINC000255512987	288110548	/nfs/dbraw/zinc/11/05/48/288110548.db2.gz	FJOKTHNIZFOPJW-QLBOMPFWSA-N	0	3	304.434	2.097	10	0		DEAEHN
C[C@H](C(=O)N1[C@@H](C)CCC[C@@H]1C)N1CCCN(C2CC2)CC1	ZINC000178869393	279213037	/nfs/dbraw/zinc/21/30/37/279213037.db2.gz	LKFABFQJNBZNID-HRCADAONSA-N	0	3	307.482	2.335	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)N(C)[C@H](CO)CC(C)C	ZINC000185469231	281053585	/nfs/dbraw/zinc/05/35/85/281053585.db2.gz	UFUHOSMDJHJDAW-HOTGVXAUSA-N	0	3	313.486	2.299	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)CCc1ccccc1	ZINC000173828907	281194849	/nfs/dbraw/zinc/19/48/49/281194849.db2.gz	LZLYBIGJEWWLHH-DLBZAZTESA-N	0	3	322.474	2.118	10	0		DEAEHN
CC1(C)CN(CCCOCC(F)(F)F)C[C@@]2(CCOC2)O1	ZINC000373795786	281236232	/nfs/dbraw/zinc/23/62/32/281236232.db2.gz	GEBKKGKQRGJTNV-CYBMUJFWSA-N	0	3	311.344	2.225	10	0		DEAEHN
C[C@@H](NCCC(=O)N1CCOCC1)c1ccc(F)c(Cl)c1	ZINC000135134762	282062950	/nfs/dbraw/zinc/06/29/50/282062950.db2.gz	UUBPHMYTOGYALP-LLVKDONJSA-N	0	3	314.788	2.379	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000122668734	289081184	/nfs/dbraw/zinc/08/11/84/289081184.db2.gz	BOHJAVLQDGOKHA-WVZRYYJFSA-N	0	3	302.418	2.492	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)CCO1	ZINC000245944593	289200111	/nfs/dbraw/zinc/20/01/11/289200111.db2.gz	UKKVCIBZAPYFHI-MWDXBVQZSA-N	0	3	308.466	2.382	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(C(=O)C(C3CC3)C3CC3)C2)CC1	ZINC000157077891	290054496	/nfs/dbraw/zinc/05/44/96/290054496.db2.gz	IUXWQOFBOKIDRB-QGZVFWFLSA-N	0	3	319.493	2.051	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCC(C)(C)CCO)[C@H]1c1ccccc1	ZINC000179487199	290139579	/nfs/dbraw/zinc/13/95/79/290139579.db2.gz	GUDWFADEPIGBNV-HZPDHXFCSA-N	0	3	319.449	2.140	10	0		DEAEHN
C[C@@H]1CN(CCN2CCC[C@@H]2c2ccc3c(c2)OCO3)CCO1	ZINC000191477736	297002497	/nfs/dbraw/zinc/00/24/97/297002497.db2.gz	KAWCXMUBMRNNQT-GDBMZVCRSA-N	0	3	318.417	2.273	10	0		DEAEHN
COC[C@@H](C)CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	ZINC000188231750	333039593	/nfs/dbraw/zinc/03/95/93/333039593.db2.gz	XSLGRNHPQHHHGD-IINYFYTJSA-N	0	3	314.788	2.457	10	0		DEAEHN
Cc1cc(CCNC(=O)NC[C@@H]2CCCN(C)C2)cc(C)c1O	ZINC000189488803	333093762	/nfs/dbraw/zinc/09/37/62/333093762.db2.gz	MBOQTKRLKGTQEB-INIZCTEOSA-N	0	3	319.449	2.193	10	0		DEAEHN
CCOc1ccc(CN2CCN(C[C@H](C)COC)CC2)cc1	ZINC000189602160	333155207	/nfs/dbraw/zinc/15/52/07/333155207.db2.gz	LVHSRBYKWPYUJO-INIZCTEOSA-N	0	3	306.450	2.485	10	0		DEAEHN
O=C(Nc1ccc(Cl)nc1)c1ccc(OC2CNC2)cc1	ZINC000584592314	337373551	/nfs/dbraw/zinc/37/35/51/337373551.db2.gz	PQCMBYTWNZXLGC-UHFFFAOYSA-N	0	3	303.749	2.338	10	0		DEAEHN
Cc1ccc2c(CCNC(=O)CN(C)C(C)C)cn(C)c2c1	ZINC000188418658	534382948	/nfs/dbraw/zinc/38/29/48/534382948.db2.gz	VTKVUPCUQREJJZ-UHFFFAOYSA-N	0	3	301.434	2.486	10	0		DEAEHN
O[C@H](C[C@@H]1CCCN1C[C@@H](O)CC(F)(F)F)c1ccco1	ZINC000248934794	534432829	/nfs/dbraw/zinc/43/28/29/534432829.db2.gz	BTZSAGAUJGQRGL-SDDRHHMPSA-N	0	3	307.312	2.481	10	0		DEAEHN
CCN(C(=O)NC[C@H]1CCCN1CCOC)C1CCCCC1	ZINC000111867797	519967455	/nfs/dbraw/zinc/96/74/55/519967455.db2.gz	RAZLIMYSOFFUOD-MRXNPFEDSA-N	0	3	311.470	2.461	10	0		DEAEHN
CCOc1ccccc1OCC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000124247972	521557647	/nfs/dbraw/zinc/55/76/47/521557647.db2.gz	NJAMYNDNTHNMDQ-CABCVRRESA-N	0	3	320.433	2.405	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCCC[C@H]2c2cn[nH]c2)C1	ZINC000245971329	521644448	/nfs/dbraw/zinc/64/44/48/521644448.db2.gz	OCAOAXQXMCVXPW-GJZGRUSLSA-N	0	3	305.426	2.131	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000107851680	522101692	/nfs/dbraw/zinc/10/16/92/522101692.db2.gz	CWRASQFOFQUFON-HNNXBMFYSA-N	0	3	314.433	2.446	10	0		DEAEHN
O=C(Cc1cccc(C(F)F)c1)NCCNc1ccncc1	ZINC000448036233	534719722	/nfs/dbraw/zinc/71/97/22/534719722.db2.gz	WSGRGLZQQRGXQR-UHFFFAOYSA-N	0	3	305.328	2.212	10	0		DEAEHN
CC(=O)Nc1ccc(N[C@@H]2CCC[C@@H]2[C@@H]2COCCN2)cc1	ZINC000262031910	534746874	/nfs/dbraw/zinc/74/68/74/534746874.db2.gz	XQHOROMUEHSZAW-BBWFWOEESA-N	0	3	303.406	2.214	10	0		DEAEHN
Cc1ccc(C)c(OC[C@@H](O)CN2[C@H](C)C[C@@H](O)C[C@@H]2C)c1	ZINC000248841834	524179677	/nfs/dbraw/zinc/17/96/77/524179677.db2.gz	QBACXPRUQIYJII-YVSFHVDLSA-N	0	3	307.434	2.277	10	0		DEAEHN
C[C@H](CCn1cccn1)NCc1cn(C)nc1C(F)(F)F	ZINC000159135006	524268127	/nfs/dbraw/zinc/26/81/27/524268127.db2.gz	ZHPIMSHRPIXFMG-SNVBAGLBSA-N	0	3	301.316	2.204	10	0		DEAEHN
Cc1cc(NC(=O)CCN(C)CCc2ncc(C)s2)no1	ZINC000157571088	525125024	/nfs/dbraw/zinc/12/50/24/525125024.db2.gz	SRMMCPIRFAIOQG-UHFFFAOYSA-N	0	3	308.407	2.251	10	0		DEAEHN
O=C(N[C@H]1CCc2c[nH]nc2C1)c1cccc(CN2CCCC2)c1	ZINC000366038818	527069640	/nfs/dbraw/zinc/06/96/40/527069640.db2.gz	BUYAUQSVSZJRGC-KRWDZBQOSA-N	0	3	324.428	2.293	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCN(CCC(C)(C)C)CC1	ZINC000193373971	528623450	/nfs/dbraw/zinc/62/34/50/528623450.db2.gz	MSXIMHFBYISWLJ-MRXNPFEDSA-N	0	3	300.487	2.218	10	0		DEAEHN
CC(C)(CO)CCNC(=O)c1cccc(CN2CCCC2)c1	ZINC000452431904	535166122	/nfs/dbraw/zinc/16/61/22/535166122.db2.gz	CSEYGISQUAOVOE-UHFFFAOYSA-N	0	3	304.434	2.421	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccnn2[C@@H](C)C2CC2)C1	ZINC000187729315	535577965	/nfs/dbraw/zinc/57/79/65/535577965.db2.gz	RIASGNARPSUPNH-JSGCOSHPSA-N	0	3	305.426	2.460	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NC[C@H](C)c1nccs1	ZINC000248553732	535585784	/nfs/dbraw/zinc/58/57/84/535585784.db2.gz	HOMWXXRQEMWRFJ-STQMWFEESA-N	0	3	310.467	2.372	10	0		DEAEHN
CCN1CCN(C(=O)[C@H](C)N2CCC3(C2)CCCCC3)CC1	ZINC000357726685	535634717	/nfs/dbraw/zinc/63/47/17/535634717.db2.gz	HTDYVWJOSRXHTM-INIZCTEOSA-N	0	3	307.482	2.195	10	0		DEAEHN
CN(C)Cc1c2ccccc2oc1C(=O)NC[C@@H](CO)C1CC1	ZINC000359773759	535975447	/nfs/dbraw/zinc/97/54/47/535975447.db2.gz	KMKMTIPFIUDWQB-ZDUSSCGKSA-N	0	3	316.401	2.243	10	0		DEAEHN
COc1ccc(F)c(NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)c1	ZINC000261948276	536608549	/nfs/dbraw/zinc/60/85/49/536608549.db2.gz	VXHIYOGAIUSORR-JDSLSITLSA-N	0	3	322.380	2.305	10	0		DEAEHN
CC[C@@]1(C2CN(C(=O)OC(C)(C)C)C2)NCCc2nc[nH]c21	ZINC000716166131	563465797	/nfs/dbraw/zinc/46/57/97/563465797.db2.gz	YEQKXBZHEZOGRY-INIZCTEOSA-N	0	3	306.410	2.028	10	0		DEAEHN
COCC[C@H](N)C(=O)Nc1ccc(Br)c(C)c1	ZINC000052790826	625320047	/nfs/dbraw/zinc/32/00/47/625320047.db2.gz	MWMNWJPGNMDXGF-NSHDSACASA-N	0	3	301.184	2.060	10	0		DEAEHN
CCN(CC)C(=O)[C@H]1CCCN1C[C@H](C)CBr	ZINC000248736594	634454809	/nfs/dbraw/zinc/45/48/09/634454809.db2.gz	QXLYLCMWBFXSHA-VXGBXAGGSA-N	0	3	305.260	2.350	10	0		DEAEHN
c1cn(-c2cc(CNCc3n[nH]c4ccccc34)ccn2)cn1	ZINC000727467771	637953330	/nfs/dbraw/zinc/95/33/30/637953330.db2.gz	CYYDCIDFSUPSCS-UHFFFAOYSA-N	0	3	304.357	2.433	10	0		DEAEHN
c1cn(-c2cc(CNCc3[nH]nc4ccccc43)ccn2)cn1	ZINC000727467771	637953332	/nfs/dbraw/zinc/95/33/32/637953332.db2.gz	CYYDCIDFSUPSCS-UHFFFAOYSA-N	0	3	304.357	2.433	10	0		DEAEHN
C/C(=C/c1ccc(F)cc1)C(=O)NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000749362953	638638044	/nfs/dbraw/zinc/63/80/44/638638044.db2.gz	GEUSPMWENQKBSN-ZOHQOTHLSA-N	0	3	318.392	2.208	10	0		DEAEHN
C[C@H](CCCO)N(C(=O)OC(C)(C)C)c1ccc(CN)nc1	ZINC000757131852	645927849	/nfs/dbraw/zinc/92/78/49/645927849.db2.gz	ABTGHPWHHGUJDI-GFCCVEGCSA-N	0	3	309.410	2.443	10	0		DEAEHN
CCN1CCN(c2ccc(CNCc3ccc(C)o3)cn2)CC1	ZINC000061020249	646658572	/nfs/dbraw/zinc/65/85/72/646658572.db2.gz	PQMOMIJYPYGXNU-UHFFFAOYSA-N	0	3	314.433	2.415	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)S(=O)(=O)/C=C/c2ccccc2)CCN1C	ZINC000173277088	646764715	/nfs/dbraw/zinc/76/47/15/646764715.db2.gz	XJRFVWBOBRTAOG-RHRXWLLISA-N	0	3	308.447	2.402	10	0		DEAEHN
CCNC(=O)CCCC(=O)O[C@H]1CCN(Cc2ccccc2)C1	ZINC000174339783	646804356	/nfs/dbraw/zinc/80/43/56/646804356.db2.gz	GOUZHWDLMTXAJR-INIZCTEOSA-N	0	3	318.417	2.111	10	0		DEAEHN
CNC(=O)[C@@H](NCc1ccc(SC(=O)N(C)C)cc1)C(C)C	ZINC000183643257	649127103	/nfs/dbraw/zinc/12/71/03/649127103.db2.gz	OKJLHKFKCJZGPU-AWEZNQCLSA-N	0	3	323.462	2.321	10	0		DEAEHN
C/C=C(/C)C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000081757176	649414386	/nfs/dbraw/zinc/41/43/86/649414386.db2.gz	UHYPDPQRMOLMEU-BNNQUZSASA-N	0	3	315.417	2.417	10	0		DEAEHN
CCOC(CN[C@@H](C)c1ccc(-n2cncn2)cc1)OCC	ZINC000125356396	684145133	/nfs/dbraw/zinc/14/51/33/684145133.db2.gz	QEOFLYSYRIJZRA-ZDUSSCGKSA-N	0	3	304.394	2.317	10	0		DEAEHN
C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CN[C@@H]1CCn2ccnc21	ZINC000723819090	787345511	/nfs/dbraw/zinc/34/55/11/787345511.db2.gz	DSMPQLBSKOUGPI-MGPQQGTHSA-N	0	3	320.437	2.421	10	0		DEAEHN
COCC1(CNCc2cn(C)nc2Br)CCC1	ZINC000712484020	792190456	/nfs/dbraw/zinc/19/04/56/792190456.db2.gz	YPMQOAIQQXODMZ-UHFFFAOYSA-N	0	3	302.216	2.089	10	0		DEAEHN
CC(C)(C)c1ncc(CNCC[C@H]2CCCS2(=O)=O)s1	ZINC000714367895	792311736	/nfs/dbraw/zinc/31/17/36/792311736.db2.gz	WZFJRXRHWKKJDJ-GFCCVEGCSA-N	0	3	316.492	2.498	10	0		DEAEHN
C[C@@H]1C[NH2+]C[C@H]1CC[N-]S(=O)(=O)c1cccc(Cl)c1F	ZINC000721034948	1085599587	/nfs/dbraw/zinc/59/95/87/1085599587.db2.gz	AIZHJTGUJVGDSC-NXEZZACHSA-N	0	3	320.817	2.003	10	0		DEAEHN
CN1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc(Br)c[nH]1	ZINC000720816612	1086167999	/nfs/dbraw/zinc/16/79/99/1086167999.db2.gz	OPWKYQCOMZFUGS-NWDGAFQWSA-N	0	3	312.211	2.086	10	0		DEAEHN
C[C@H]1CCC[C@H](CNCCS(=O)(=O)C2CCCCC2)O1	ZINC000700003532	1086300738	/nfs/dbraw/zinc/30/07/38/1086300738.db2.gz	DAEPWWOVOVPISG-UONOGXRCSA-N	0	3	303.468	2.281	10	0		DEAEHN
CCCS(=O)(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@]2(C)C1	ZINC000702266557	1086420394	/nfs/dbraw/zinc/42/03/94/1086420394.db2.gz	IKWPKHGPRZWMPE-DLBZAZTESA-N	0	3	322.474	2.180	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CCCCCCC1	ZINC000702388791	1086425971	/nfs/dbraw/zinc/42/59/71/1086425971.db2.gz	BOLGGQFCHPIRGR-KRWDZBQOSA-N	0	3	303.450	2.238	10	0		DEAEHN
CO[C@](C)(CNc1cc(C)nc(N)n1)COCc1ccccc1	ZINC000702945263	1086473819	/nfs/dbraw/zinc/47/38/19/1086473819.db2.gz	FYVRJPACDQWEBR-QGZVFWFLSA-N	0	3	316.405	2.401	10	0		DEAEHN
Cc1cc(Cl)ccc1CNC(C)(C)CNS(C)(=O)=O	ZINC000708293493	1086678341	/nfs/dbraw/zinc/67/83/41/1086678341.db2.gz	ZNMLYZYCJBLOJA-UHFFFAOYSA-N	0	3	304.843	2.066	10	0		DEAEHN
COC1(OC)CC[C@@H]1N[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000710957192	1086691796	/nfs/dbraw/zinc/69/17/96/1086691796.db2.gz	CRMNFEOCFQDTLN-TUAOUCFPSA-N	0	3	302.415	2.029	10	0		DEAEHN
CCN(C(=O)OC(C)(C)C)[C@H](C)CN[C@H]1CCC1(OC)OC	ZINC000710998141	1086692415	/nfs/dbraw/zinc/69/24/15/1086692415.db2.gz	TZDMSDOVZKMYTD-OLZOCXBDSA-N	0	3	316.442	2.373	10	0		DEAEHN
Cn1cncc1CN[C@]12CCC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000711350435	1087072521	/nfs/dbraw/zinc/07/25/21/1087072521.db2.gz	SQSFKVMGCNXVCM-GUYCJALGSA-N	0	3	320.437	2.299	10	0		DEAEHN
C[C@H]1[C@H](NC(=O)c2cccc(Br)c2F)CCN1C	ZINC000719388416	1089071549	/nfs/dbraw/zinc/07/15/49/1089071549.db2.gz	PUNULPKRVUODET-GZMMTYOYSA-N	0	3	315.186	2.411	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NC[C@@H]1CCCc2ccccc21	ZINC000139617056	282101661	/nfs/dbraw/zinc/10/16/61/282101661.db2.gz	CQPYFRLFGAJWMS-HOTGVXAUSA-N	0	3	301.434	2.500	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCCc1ccc(Cl)s1	ZINC000139695077	282101757	/nfs/dbraw/zinc/10/17/57/282101757.db2.gz	PUNLWPOFHTVKMY-JTQLQIEISA-N	0	3	301.843	2.337	10	0		DEAEHN
Cn1cc(SC[C@@H](N)c2ccc3c(c2)OCCCO3)cn1	ZINC000081893136	192333914	/nfs/dbraw/zinc/33/39/14/192333914.db2.gz	IOBLUQAKZPTAIA-CYBMUJFWSA-N	0	3	305.403	2.374	10	0		DEAEHN
NCc1ccc(S(=O)(=O)CCSc2ccccn2)cc1	ZINC000163345168	197624965	/nfs/dbraw/zinc/62/49/65/197624965.db2.gz	AMPDLOOJACJMDF-UHFFFAOYSA-N	0	3	308.428	2.106	10	0		DEAEHN
CCCN[C@H](C)CS(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000081936237	192343031	/nfs/dbraw/zinc/34/30/31/192343031.db2.gz	XGMSVGDCKRXRHJ-GFCCVEGCSA-N	0	3	313.419	2.010	10	0		DEAEHN
CCN[C@H]1c2ccccc2CCC[C@H]1S(=O)(=O)CCOC	ZINC000081944019	192344568	/nfs/dbraw/zinc/34/45/68/192344568.db2.gz	FGZSHDCRALHLBK-CVEARBPZSA-N	0	3	311.447	2.103	10	0		DEAEHN
CN(C)Cc1csc(CN2CCC[C@]3(CN(C)C(=O)O3)C2)c1	ZINC000072432374	282151036	/nfs/dbraw/zinc/15/10/36/282151036.db2.gz	YOUFHOOFGHZSLZ-INIZCTEOSA-N	0	3	323.462	2.226	10	0		DEAEHN
CCn1cc([C@H]2OCCC[C@@H]2NCc2ccnn2CC)cn1	ZINC000328633525	231268918	/nfs/dbraw/zinc/26/89/18/231268918.db2.gz	MDBMAZLYSSMRAY-JKSUJKDBSA-N	0	3	303.410	2.129	10	0		DEAEHN
C[C@H]1CN(c2ccc(I)cc2)CCN1	ZINC000083061262	185212391	/nfs/dbraw/zinc/21/23/91/185212391.db2.gz	HYFIOWHWRGWPRV-VIFPVBQESA-N	0	3	302.159	2.089	10	0		DEAEHN
C[C@@H]1CN(c2ccccc2I)CCN1	ZINC000083061368	185212440	/nfs/dbraw/zinc/21/24/40/185212440.db2.gz	QSEZHZDIPUPSPM-SECBINFHSA-N	0	3	302.159	2.089	10	0		DEAEHN
COc1cc(C(=O)[C@H]2CCCN2)c(OC)cc1Br	ZINC000083255765	185221528	/nfs/dbraw/zinc/22/15/28/185221528.db2.gz	WFZRFCSIRNCCIG-SNVBAGLBSA-N	0	3	314.179	2.401	10	0		DEAEHN
COc1ccc(Br)cc1C[C@H](N)c1cnn(C)c1	ZINC000087422941	185224368	/nfs/dbraw/zinc/22/43/68/185224368.db2.gz	WDANUBQBJCZCGW-LBPRGKRZSA-N	0	3	310.195	2.434	10	0		DEAEHN
Brc1cc2c(cc1CNCCc1c[nH]cn1)OCO2	ZINC000087538145	185228003	/nfs/dbraw/zinc/22/80/03/185228003.db2.gz	JDBBPMYYNDBYOV-UHFFFAOYSA-N	0	3	324.178	2.233	10	0		DEAEHN
Cc1nc(CN(C)C(=O)[C@H]2CNCc3ccccc32)cs1	ZINC000087618905	185229166	/nfs/dbraw/zinc/22/91/66/185229166.db2.gz	IRSWRXKVHBTSNZ-HNNXBMFYSA-N	0	3	301.415	2.297	10	0		DEAEHN
COc1ccc([C@@H](CN)NCC(F)(F)F)cc1OC(F)F	ZINC000087929440	185237700	/nfs/dbraw/zinc/23/77/00/185237700.db2.gz	HKKQLYMOJCGUKZ-MRVPVSSYSA-N	0	3	314.254	2.448	10	0		DEAEHN
Cn1ccnc1CCn1c(N)nc2ccc(Br)cc21	ZINC000087837379	185233057	/nfs/dbraw/zinc/23/30/57/185233057.db2.gz	WXLCINUGWXCFEV-UHFFFAOYSA-N	0	3	320.194	2.357	10	0		DEAEHN
CN[C@H](Cc1cc(Br)ccc1OC)c1nc[nH]n1	ZINC000087879190	185234261	/nfs/dbraw/zinc/23/42/61/185234261.db2.gz	UMEGRHPSUIDUDT-SNVBAGLBSA-N	0	3	311.183	2.079	10	0		DEAEHN
C[NH2+][C@H](Cc1cc(Br)ccc1OC)c1nnc[n-]1	ZINC000087879190	185234262	/nfs/dbraw/zinc/23/42/62/185234262.db2.gz	UMEGRHPSUIDUDT-SNVBAGLBSA-N	0	3	311.183	2.079	10	0		DEAEHN
CN[C@H](Cc1cc(Br)ccc1OC)c1nnc[nH]1	ZINC000087879190	185234263	/nfs/dbraw/zinc/23/42/63/185234263.db2.gz	UMEGRHPSUIDUDT-SNVBAGLBSA-N	0	3	311.183	2.079	10	0		DEAEHN
CCOc1nc(Cl)nc(NC2C[C@H]3CCC[C@@H](C2)N3C)n1	ZINC000088165101	185240852	/nfs/dbraw/zinc/24/08/52/185240852.db2.gz	HCVNJZZOMFHHRQ-FGWVZKOKSA-N	0	3	311.817	2.351	10	0		DEAEHN
CC1(C)CNCCN1C(=O)c1c(F)c(F)c(F)c(F)c1F	ZINC000088138628	185240507	/nfs/dbraw/zinc/24/05/07/185240507.db2.gz	FSZUPURRHUTVON-UHFFFAOYSA-N	0	3	308.250	2.206	10	0		DEAEHN
CCN[C@@](C)(CCN1CCC(C(F)(F)F)CC1)C(=O)OC	ZINC000088435589	185250504	/nfs/dbraw/zinc/25/05/04/185250504.db2.gz	SQQBETFIJDVGJP-ZDUSSCGKSA-N	0	3	310.360	2.192	10	0		DEAEHN
CN[C@@H](C)[C@@H](C)S(=O)(=O)c1cccc(Br)c1	ZINC000081982667	192348849	/nfs/dbraw/zinc/34/88/49/192348849.db2.gz	DJCBZUIQSFGMRZ-DTWKUNHWSA-N	0	3	306.225	2.219	10	0		DEAEHN
Cc1ccccc1S(=O)(=O)[N-]c1cccc2c1CC[NH2+]C2	ZINC000088715626	185263070	/nfs/dbraw/zinc/26/30/70/185263070.db2.gz	XUMJNJKQIUKLDT-UHFFFAOYSA-N	0	3	302.399	2.442	10	0		DEAEHN
Cc1ccccc1S(=O)(=O)N1CCC[C@@H](N2CCCC2)C1	ZINC000088718434	185263081	/nfs/dbraw/zinc/26/30/81/185263081.db2.gz	ZPXGQCOVNFLANP-OAHLLOKOSA-N	0	3	308.447	2.244	10	0		DEAEHN
COCCC[S@](=O)C[C@H](N)c1cccc(C(F)(F)F)c1	ZINC000081999307	192352996	/nfs/dbraw/zinc/35/29/96/192352996.db2.gz	LJXJNCSWBQJGLT-FKIZINRSSA-N	0	3	309.353	2.490	10	0		DEAEHN
CN[C@@H](C[S@@](=O)c1ccccc1)c1ccc2c(c1)OCO2	ZINC000082000990	192353435	/nfs/dbraw/zinc/35/34/35/192353435.db2.gz	UDXAHIFXYZRDNW-QKKBWIMNSA-N	0	3	303.383	2.484	10	0		DEAEHN
CC[C@H](NC[C@@](C)(O)CO)c1cccc(Br)c1	ZINC000090284464	185289289	/nfs/dbraw/zinc/28/92/89/185289289.db2.gz	QONJQHUWRPGOTB-QWHCGFSZSA-N	0	3	302.212	2.233	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1ccc(Cl)cc1C	ZINC000090293210	185290062	/nfs/dbraw/zinc/29/00/62/185290062.db2.gz	NUBRHMAJUCUVHV-UHFFFAOYSA-N	0	3	302.827	2.021	10	0		DEAEHN
N[C@@H]1COC[C@H]1c1nc(Cc2ccc(Cl)cc2Cl)no1	ZINC000090364354	185292867	/nfs/dbraw/zinc/29/28/67/185292867.db2.gz	JGNJKGUCKPJVHU-MWLCHTKSSA-N	0	3	314.172	2.408	10	0		DEAEHN
CN(C[C@@H]1CCOC1)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000179260710	282221543	/nfs/dbraw/zinc/22/15/43/282221543.db2.gz	KTZFTRYBLORYOD-UAGQMJEPSA-N	0	3	317.433	2.110	10	0		DEAEHN
CCN[C@H](C[S@@](=O)CCCOC)c1cc(C)ccc1OC	ZINC000081998319	192352750	/nfs/dbraw/zinc/35/27/50/192352750.db2.gz	XVQWVPBZOYTMTL-QVKFZJNVSA-N	0	3	313.463	2.439	10	0		DEAEHN
N[C@H]1COC[C@@H]1C(=O)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000090378787	185293553	/nfs/dbraw/zinc/29/35/53/185293553.db2.gz	NWRLQVUZIALKKI-CBAPKCEASA-N	0	3	308.687	2.271	10	0		DEAEHN
CN[C@@H]1COC[C@H]1c1nc(-c2cccc(Br)c2)no1	ZINC000090423182	185295488	/nfs/dbraw/zinc/29/54/88/185295488.db2.gz	NWEXMCLCTRTLLO-GHMZBOCLSA-N	0	3	324.178	2.201	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)N1CCC[C@@H]1c1ccccc1Cl	ZINC000090435339	185296064	/nfs/dbraw/zinc/29/60/64/185296064.db2.gz	RULBMYYOUKSIIR-BPLDGKMQSA-N	0	3	308.809	2.238	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1ccc(SC(F)F)cc1	ZINC000090432828	185296336	/nfs/dbraw/zinc/29/63/36/185296336.db2.gz	BSUFMSHNAATDRM-GHMZBOCLSA-N	0	3	302.346	2.174	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1ccccc1SC(F)(F)F	ZINC000090432891	185296364	/nfs/dbraw/zinc/29/63/64/185296364.db2.gz	XOEDFDGKEVFALQ-WPRPVWTQSA-N	0	3	320.336	2.471	10	0		DEAEHN
CSc1nc2ccc(NC(=O)[C@@]3(C)COC[C@@H]3N)cc2s1	ZINC000090586063	185305240	/nfs/dbraw/zinc/30/52/40/185305240.db2.gz	ADNVPOAWGCJTJV-FZMZJTMJSA-N	0	3	323.443	2.321	10	0		DEAEHN
CCn1c2ccc(Br)cc2nc1[C@@]1(C)COC[C@H]1N	ZINC000090571763	185304423	/nfs/dbraw/zinc/30/44/23/185304423.db2.gz	SXEJPMZIKOSAKY-OCCSQVGLSA-N	0	3	324.222	2.434	10	0		DEAEHN
CCCn1cc(CN[C@@H]2C[C@H](OCC)C23CCOCC3)cn1	ZINC000185669198	282264318	/nfs/dbraw/zinc/26/43/18/282264318.db2.gz	NJMHMZRKDXSNEY-CVEARBPZSA-N	0	3	307.438	2.357	10	0		DEAEHN
Cc1nn(C)c2sc(C(=O)N3C[C@@H]4CCCN4C[C@H]3C)cc12	ZINC000247399197	282291571	/nfs/dbraw/zinc/29/15/71/282291571.db2.gz	PHNJGBGYHJETCL-PWSUYJOCSA-N	0	3	318.446	2.252	10	0		DEAEHN
CCN1CCN(Cc2ccccc2CNCc2cocn2)CC1	ZINC000192287450	282341144	/nfs/dbraw/zinc/34/11/44/282341144.db2.gz	HBXQDVKFRSLENU-UHFFFAOYSA-N	0	3	314.433	2.102	10	0		DEAEHN
Cc1cc(C)n([C@@H](C)C(=O)NC[C@H](C)N2CCC(C)CC2)n1	ZINC000195067441	282368035	/nfs/dbraw/zinc/36/80/35/282368035.db2.gz	GCJFJPZVFUQASY-HOTGVXAUSA-N	0	3	306.454	2.298	10	0		DEAEHN
COc1cc(C[NH2+][C@H]2CCOC2)cc(Br)c1[O-]	ZINC000095015631	539433594	/nfs/dbraw/zinc/43/35/94/539433594.db2.gz	BJOOMNHROVTKHS-VIFPVBQESA-N	0	3	302.168	2.042	10	0		DEAEHN
CCCOc1ccc(NC(=O)COC2(C)CNC2)cc1Cl	ZINC000098060844	539435896	/nfs/dbraw/zinc/43/58/96/539435896.db2.gz	BIVSNAFDBXPABI-UHFFFAOYSA-N	0	3	312.797	2.446	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)s1	ZINC000245418329	282386106	/nfs/dbraw/zinc/38/61/06/282386106.db2.gz	AGQBTZVDMPOESY-QWHCGFSZSA-N	0	3	324.494	2.372	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H]2CCO[C@H]2c2ccccc2)C1	ZINC000245477810	282391096	/nfs/dbraw/zinc/39/10/96/282391096.db2.gz	URPSINBXLBNYPQ-ULQDDVLXSA-N	0	3	317.433	2.300	10	0		DEAEHN
CCOc1ncccc1CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000245585401	282398708	/nfs/dbraw/zinc/39/87/08/282398708.db2.gz	AGNWKLBWFRILHJ-DZGCQCFKSA-N	0	3	320.437	2.104	10	0		DEAEHN
OCC[C@@]1(CN[C@H]2CCCOc3ccc(F)cc32)CCOC1	ZINC000125523877	539473865	/nfs/dbraw/zinc/47/38/65/539473865.db2.gz	TUJMKSAPJIGWNC-RDJZCZTQSA-N	0	3	309.381	2.418	10	0		DEAEHN
CN(Cc1ccc(OC(F)(F)F)cc1)C[C@H]1CNCCO1	ZINC000125492574	539472604	/nfs/dbraw/zinc/47/26/04/539472604.db2.gz	UCIAPVDKOUECEF-CYBMUJFWSA-N	0	3	304.312	2.005	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC[C@H](n2cccn2)CC1	ZINC000616630427	362900836	/nfs/dbraw/zinc/90/08/36/362900836.db2.gz	XPUWOZFHJNZQOY-AWEZNQCLSA-N	0	3	308.426	2.435	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)C1(O)CCCCC1	ZINC000179715639	539642305	/nfs/dbraw/zinc/64/23/05/539642305.db2.gz	ATMMZMOANQMUDG-HNNXBMFYSA-N	0	3	304.434	2.318	10	0		DEAEHN
Cc1cc(-n2cccn2)ccc1NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000190798007	539696854	/nfs/dbraw/zinc/69/68/54/539696854.db2.gz	BKIGYGRPQKODMO-OAHLLOKOSA-N	0	3	313.405	2.349	10	0		DEAEHN
Cc1sc(Br)cc1[C@H](N)[C@@H]1CCS(=O)(=O)C1	ZINC000084006092	192395098	/nfs/dbraw/zinc/39/50/98/192395098.db2.gz	UKWKGDRVTCVDFX-GMSGAONNSA-N	0	3	324.265	2.254	10	0		DEAEHN
CN[C@H](C[S@](=O)C1CCCC1)c1ccc2c(c1)OCCO2	ZINC000084052363	192397751	/nfs/dbraw/zinc/39/77/51/192397751.db2.gz	PBHXRHTVWKUVEY-SPLOXXLWSA-N	0	3	309.431	2.410	10	0		DEAEHN
CN1C[C@@H](NCc2cc(Br)ccc2F)CCC1=O	ZINC000084059748	192397932	/nfs/dbraw/zinc/39/79/32/192397932.db2.gz	FGHJKZBGCNTZNJ-NSHDSACASA-N	0	3	315.186	2.299	10	0		DEAEHN
Cn1cc(CN2Cc3ccc(C(F)(F)F)cc3[C@H]2CN)cn1	ZINC000071684071	191008226	/nfs/dbraw/zinc/00/82/26/191008226.db2.gz	IDXBWVPWEPCTGW-CQSZACIVSA-N	0	3	310.323	2.455	10	0		DEAEHN
CN1CCN(c2ccc(NC(=O)c3ccccc3CN)cc2)CC1	ZINC000071700453	191009542	/nfs/dbraw/zinc/00/95/42/191009542.db2.gz	OUFXSLGSMSCYCN-UHFFFAOYSA-N	0	3	324.428	2.149	10	0		DEAEHN
CCN[C@@H](C)c1ccc(OC)cc1OCCS(=O)(=O)CC	ZINC000138536224	186017724	/nfs/dbraw/zinc/01/77/24/186017724.db2.gz	QHHOUXKQFYYAFH-LBPRGKRZSA-N	0	3	315.435	2.179	10	0		DEAEHN
CC1(C)CCN(S(=O)(=O)c2cc(CN)cc(F)c2F)CC1	ZINC000138987718	186019745	/nfs/dbraw/zinc/01/97/45/186019745.db2.gz	MEKVTVKTTCYLLJ-UHFFFAOYSA-N	0	3	318.389	2.234	10	0		DEAEHN
CC[C@@]1(C)N[C@@H](c2cccs2)N(C2CCN(C)CC2)C1=O	ZINC000141203687	186029460	/nfs/dbraw/zinc/02/94/60/186029460.db2.gz	ZBZNGZCJFSFGRS-GDBMZVCRSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCN[C@H](c1cnc2ccccc2c1)[C@H]1CCS(=O)(=O)C1	ZINC000150100808	186055186	/nfs/dbraw/zinc/05/51/86/186055186.db2.gz	JNBCBNDLQRAHTI-BBRMVZONSA-N	0	3	304.415	2.320	10	0		DEAEHN
CN(Cc1ccc(Cl)cc1)C[C@H](O)COC[C@H]1CCCO1	ZINC000250235924	539782856	/nfs/dbraw/zinc/78/28/56/539782856.db2.gz	OIEWNYYCCLVVEW-JKSUJKDBSA-N	0	3	313.825	2.328	10	0		DEAEHN
CCOC(=O)C1CCN(C(=O)CN2CCCCC[C@@H]2CC)CC1	ZINC000150743828	186062659	/nfs/dbraw/zinc/06/26/59/186062659.db2.gz	DCCLPAMJWZDYAO-INIZCTEOSA-N	0	3	324.465	2.443	10	0		DEAEHN
Fc1ccc(COC[C@@H]2CNCCO2)cc1Br	ZINC000164011987	186145905	/nfs/dbraw/zinc/14/59/05/186145905.db2.gz	YLADHSHTTVLISA-JTQLQIEISA-N	0	3	304.159	2.093	10	0		DEAEHN
C[C@@H]1C[C@H](C)CN1S(=O)(=O)c1ccc(CN)c(Cl)c1	ZINC000164243768	186153168	/nfs/dbraw/zinc/15/31/68/186153168.db2.gz	LYHMFIUILXHAML-VHSXEESVSA-N	0	3	302.827	2.218	10	0		DEAEHN
CC(C(=O)N(C)Cc1csc(Br)c1)=C1CNC1	ZINC000164458330	186159343	/nfs/dbraw/zinc/15/93/43/186159343.db2.gz	LQWQHGVBSOUYAL-UHFFFAOYSA-N	0	3	315.236	2.389	10	0		DEAEHN
Cc1ccc(C(N)=O)cc1NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000175736937	186191378	/nfs/dbraw/zinc/19/13/78/186191378.db2.gz	MDXQTYYPBYRCCG-TZMCWYRMSA-N	0	3	318.421	2.040	10	0		DEAEHN
CN(Cc1ccc(F)c(Br)c1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000626037534	366017703	/nfs/dbraw/zinc/01/77/03/366017703.db2.gz	SWZQWCIQCAGJII-AOOOYVTPSA-N	0	3	315.186	2.284	10	0		DEAEHN
CC(C)Oc1ncccc1NC(=O)N1CCN2CCC[C@H]2C1	ZINC000171890229	198002499	/nfs/dbraw/zinc/00/24/99/198002499.db2.gz	BYCFHFWTTCPHIB-ZDUSSCGKSA-N	0	3	304.394	2.181	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(-n2ccnc2)cc1	ZINC000172054977	198031832	/nfs/dbraw/zinc/03/18/32/198031832.db2.gz	KVBYBKMAWIVXNS-WMLDXEAASA-N	0	3	310.401	2.181	10	0		DEAEHN
O=C(NCC1(c2cccc(F)c2)CC1)N1CCN2CCC[C@@H]2C1	ZINC000172498059	198106315	/nfs/dbraw/zinc/10/63/15/198106315.db2.gz	SQBARSCZNISBPH-MRXNPFEDSA-N	0	3	317.408	2.347	10	0		DEAEHN
CC(=O)c1ccc(OCCCC(=O)N[C@H]2CCCN(C)C2)cc1	ZINC000617414506	363125568	/nfs/dbraw/zinc/12/55/68/363125568.db2.gz	KHMVQUTZSKRQES-INIZCTEOSA-N	0	3	318.417	2.259	10	0		DEAEHN
C[C@@H](CCc1ccccc1F)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000173522559	198223947	/nfs/dbraw/zinc/22/39/47/198223947.db2.gz	LDTMNMKMXACDEL-GOEBONIOSA-N	0	3	322.424	2.183	10	0		DEAEHN
C[C@H](CCc1cccc(F)c1)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000173522669	198223962	/nfs/dbraw/zinc/22/39/62/198223962.db2.gz	WSGJWZNLOFVSJF-PBHICJAKSA-N	0	3	322.424	2.183	10	0		DEAEHN
CC(=O)CCN(C)C[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000173531300	198224360	/nfs/dbraw/zinc/22/43/60/198224360.db2.gz	UXGVSOWZGKTGEX-GFCCVEGCSA-N	0	3	319.323	2.356	10	0		DEAEHN
Cc1ccccc1OCCNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000174204774	198305717	/nfs/dbraw/zinc/30/57/17/198305717.db2.gz	MTNAXBYKSPAJII-CVEARBPZSA-N	0	3	319.449	2.498	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(N3CCCCC3)cc2)C1	ZINC000174182278	198302673	/nfs/dbraw/zinc/30/26/73/198302673.db2.gz	MCHVOJAVEQPPOU-KRWDZBQOSA-N	0	3	301.434	2.453	10	0		DEAEHN
COC[C@H](NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)c1ccccc1	ZINC000174628128	198361963	/nfs/dbraw/zinc/36/19/63/198361963.db2.gz	DIXIQVKSMDXJOT-PVAVHDDUSA-N	0	3	319.449	2.498	10	0		DEAEHN
C=C/C(C)=C/CC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000617703864	363227984	/nfs/dbraw/zinc/22/79/84/363227984.db2.gz	QEIXTKWTQGMQLL-FXZAEMTOSA-N	0	3	314.429	2.392	10	0		DEAEHN
Fc1cc2c(c(F)c1F)[C@@H](N[C@H]1CCc3nnnn3CC1)CC2	ZINC000333510897	282933987	/nfs/dbraw/zinc/93/39/87/282933987.db2.gz	JCRJMHDZJHNKOJ-ONGXEEELSA-N	0	3	323.322	2.072	10	0		DEAEHN
CCc1nc(-c2ccc(OC)cc2)nc(N2CCNCC2)c1C	ZINC000073662787	191338893	/nfs/dbraw/zinc/33/88/93/191338893.db2.gz	VTWPURAMCIPPPF-UHFFFAOYSA-N	0	3	312.417	2.433	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2coc(-c3cccs3)n2)CCO1	ZINC000075133142	191427691	/nfs/dbraw/zinc/42/76/91/191427691.db2.gz	ZNGVLPAJVWHTNR-ZDUSSCGKSA-N	0	3	307.419	2.166	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)C[C@@H]2CCOc3ccccc32)C1	ZINC000117796713	355778393	/nfs/dbraw/zinc/77/83/93/355778393.db2.gz	GLFUBRKGYUXASX-CABCVRRESA-N	0	3	302.418	2.401	10	0		DEAEHN
C[C@@H]1CN(c2ccc(CNCC3=CCCOC3)cn2)C[C@H](C)O1	ZINC000126503832	355817534	/nfs/dbraw/zinc/81/75/34/355817534.db2.gz	UZEYMDNXEDSIBF-GASCZTMLSA-N	0	3	317.433	2.132	10	0		DEAEHN
CNC(=O)N1Cc2ccccc2OC2(CCN(C(C)C)CC2)C1	ZINC000169774549	355981901	/nfs/dbraw/zinc/98/19/01/355981901.db2.gz	ATZLQHOFNFQWMP-UHFFFAOYSA-N	0	3	317.433	2.463	10	0		DEAEHN
CC[C@@H]1CN(Cc2cn(C)nc2C(C)(C)C)CCN1CCOC	ZINC000180087463	356042474	/nfs/dbraw/zinc/04/24/74/356042474.db2.gz	JACVPYKTNLJLIK-MRXNPFEDSA-N	0	3	322.497	2.260	10	0		DEAEHN
NC(=O)NC(=O)CN[C@@H](CCc1ccccc1)c1ccccc1	ZINC000180386883	356049505	/nfs/dbraw/zinc/04/95/05/356049505.db2.gz	KXLGGRSSBUEBCV-INIZCTEOSA-N	0	3	311.385	2.145	10	0		DEAEHN
COc1ccc([C@@H](C)NC[C@@H](C)CS(C)(=O)=O)cc1F	ZINC000182021154	356106255	/nfs/dbraw/zinc/10/62/55/356106255.db2.gz	NDUWKMRCGVBGIP-GHMZBOCLSA-N	0	3	303.399	2.166	10	0		DEAEHN
CC(C)S(=O)(=O)CCCN[C@@H](C)c1ccc2c(c1)OCO2	ZINC000182285260	356118833	/nfs/dbraw/zinc/11/88/33/356118833.db2.gz	RBBAIGISOHRLNP-LBPRGKRZSA-N	0	3	313.419	2.279	10	0		DEAEHN
CCS(=O)(=O)NCCCN1CC[C@H](c2cc(C)cc(C)c2)C1	ZINC000183484004	356173758	/nfs/dbraw/zinc/17/37/58/356173758.db2.gz	FCWJUTLTWAXZEQ-INIZCTEOSA-N	0	3	324.490	2.422	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)NC1CCSCC1	ZINC000195470542	356254577	/nfs/dbraw/zinc/25/45/77/356254577.db2.gz	XQVDQQBSMKWNBP-INIZCTEOSA-N	0	3	321.490	2.354	10	0		DEAEHN
CCO[C@@H](CCNC(=O)N1CCCN(C2CC2)CC1)C(C)C	ZINC000080726654	192185662	/nfs/dbraw/zinc/18/56/62/192185662.db2.gz	AAQQYUXPJJYNPS-INIZCTEOSA-N	0	3	311.470	2.317	10	0		DEAEHN
NC[C@H]1c2ccccc2CCN1C(=O)c1ccc(Cl)cn1	ZINC000227721241	356280204	/nfs/dbraw/zinc/28/02/04/356280204.db2.gz	YOTWINWLEJJGDF-HNNXBMFYSA-N	0	3	301.777	2.433	10	0		DEAEHN
COc1ccsc1C(=O)N1CCc2ccccc2[C@@H]1CN	ZINC000227721288	356280384	/nfs/dbraw/zinc/28/03/84/356280384.db2.gz	MFCQOYMCWXHNEQ-ZDUSSCGKSA-N	0	3	302.399	2.455	10	0		DEAEHN
CN(C[C@@H]1CCCN(C)C1)C(=O)c1coc(Br)c1	ZINC000265215885	356346638	/nfs/dbraw/zinc/34/66/38/356346638.db2.gz	CARYGALSOXTBAB-SNVBAGLBSA-N	0	3	315.211	2.456	10	0		DEAEHN
C[C@@H](N)C(=O)Nc1cc(I)ccc1Cl	ZINC000300987219	356391336	/nfs/dbraw/zinc/39/13/36/356391336.db2.gz	UBZGGUNBWWIOIZ-RXMQYKEDSA-N	0	3	324.549	2.230	10	0		DEAEHN
Cc1c([C@H]2OCC[C@@H]2NC[C@@H](O)c2ccccc2C)cnn1C	ZINC000328618758	356460545	/nfs/dbraw/zinc/46/05/45/356460545.db2.gz	FAWRPXQQGNLPJY-RCCFBDPRSA-N	0	3	315.417	2.190	10	0		DEAEHN
Brc1cc(CN2CC[C@H]3OCCN[C@H]3C2)cs1	ZINC000404261630	283164955	/nfs/dbraw/zinc/16/49/55/283164955.db2.gz	OLCPBIJSFNUCAK-WDEREUQCSA-N	0	3	317.252	2.073	10	0		DEAEHN
CC[C@@H](C)[C@H](N)C(=O)NCc1cccnc1OC1CCCC1	ZINC000236949944	202088443	/nfs/dbraw/zinc/08/84/43/202088443.db2.gz	MCPYSAUWZNZUIN-DOMZBBRYSA-N	0	3	305.422	2.393	10	0		DEAEHN
C[C@@H]1CN(C(=O)c2c(F)c(F)c(F)c(F)c2F)[C@@H](C)CN1	ZINC000086467355	192573916	/nfs/dbraw/zinc/57/39/16/192573916.db2.gz	FKLOJTPYQGMITJ-RITPCOANSA-N	0	3	308.250	2.205	10	0		DEAEHN
N#Cc1cncnc1NC[C@H]1CCCCN1Cc1ccccc1	ZINC000379665897	356668474	/nfs/dbraw/zinc/66/84/74/356668474.db2.gz	URIXRJIJAOEFTQ-QGZVFWFLSA-N	0	3	307.401	2.237	10	0		DEAEHN
CN(CCOCc1ccccc1)C(=O)[C@@H]1NCCCC1(C)C	ZINC000384077435	356682021	/nfs/dbraw/zinc/68/20/21/356682021.db2.gz	SZOWVHGYYAGHPD-INIZCTEOSA-N	0	3	304.434	2.440	10	0		DEAEHN
O[C@H](CNC[C@H]1CCCN1Cc1ccccc1)C(F)(F)F	ZINC000390698258	356709780	/nfs/dbraw/zinc/70/97/80/356709780.db2.gz	IPYVMSVJLYWEAK-ZIAGYGMSSA-N	0	3	302.340	2.164	10	0		DEAEHN
C/C=C\c1ccc(OCC(=O)N2CCN[C@H](C)[C@H]2C)c(OC)c1	ZINC000578870395	356885262	/nfs/dbraw/zinc/88/52/62/356885262.db2.gz	PEAOJHGQZOMTAZ-HLMASZERSA-N	0	3	318.417	2.316	10	0		DEAEHN
c1cnc(N2CCC[C@@H](NCc3ccc4c(n3)CCC4)C2)nc1	ZINC000578614757	356844416	/nfs/dbraw/zinc/84/44/16/356844416.db2.gz	HYJKCSKLAICUDC-MRXNPFEDSA-N	0	3	309.417	2.119	10	0		DEAEHN
c1cn(-c2csc(CN3CCC[C@H](n4ccnn4)C3)c2)cn1	ZINC000579829920	357038361	/nfs/dbraw/zinc/03/83/61/357038361.db2.gz	XXGMRRAATHZXMP-ZDUSSCGKSA-N	0	3	314.418	2.362	10	0		DEAEHN
CCCCN(C1CC1)S(=O)(=O)c1ccc(OC)c(CN)c1	ZINC000088995207	192686757	/nfs/dbraw/zinc/68/67/57/192686757.db2.gz	UYFMIOAYENVJQI-UHFFFAOYSA-N	0	3	312.435	2.107	10	0		DEAEHN
CCOc1ccc([C@H](C)NC[C@@H]2CN(C)CCO2)cc1OCC	ZINC000180493775	199166185	/nfs/dbraw/zinc/16/61/85/199166185.db2.gz	RIFUFQQIICTPPL-GOEBONIOSA-N	0	3	322.449	2.465	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)NCc1ccc(Cl)cn1	ZINC000180757826	199205663	/nfs/dbraw/zinc/20/56/63/199205663.db2.gz	HWBVWBYLSFBNDA-AWEZNQCLSA-N	0	3	310.829	2.409	10	0		DEAEHN
CC(=O)N1CC[C@@H](NCc2ccc(C(=O)OC(C)(C)C)s2)C1	ZINC000598985847	359375963	/nfs/dbraw/zinc/37/59/63/359375963.db2.gz	APVSWTFHODGPPT-GFCCVEGCSA-N	0	3	324.446	2.414	10	0		DEAEHN
CC(=O)Nc1ccc(C)c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000186966039	200040187	/nfs/dbraw/zinc/04/01/87/200040187.db2.gz	PASXRODKFRKWRZ-BBRMVZONSA-N	0	3	315.417	2.262	10	0		DEAEHN
CSCc1cccc(CNC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000187410752	200108902	/nfs/dbraw/zinc/10/89/02/200108902.db2.gz	QNQXODZNVDDGPS-HNNXBMFYSA-N	0	3	307.463	2.395	10	0		DEAEHN
C[C@H]1OCCC[C@H]1C(=O)NCCCN1CCc2ccccc2C1	ZINC000188403851	200240127	/nfs/dbraw/zinc/24/01/27/200240127.db2.gz	YAPHEQCVDAIMLK-CRAIPNDOSA-N	0	3	316.445	2.366	10	0		DEAEHN
Cn1cc(-c2cc(CN3CCC([C@H]4CCCO4)CC3)on2)cn1	ZINC000189217577	200365527	/nfs/dbraw/zinc/36/55/27/200365527.db2.gz	KOBWBWISXULGLO-QGZVFWFLSA-N	0	3	316.405	2.466	10	0		DEAEHN
OC[C@@H](NCCOCC(F)F)c1cccc(Br)c1	ZINC000189882181	200464983	/nfs/dbraw/zinc/46/49/83/200464983.db2.gz	UDONVBIDIVHYKK-LLVKDONJSA-N	0	3	324.165	2.354	10	0		DEAEHN
Cn1ccc(C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)n1	ZINC000607538320	361095236	/nfs/dbraw/zinc/09/52/36/361095236.db2.gz	PDJGMXTVTHPEHN-WFASDCNBSA-N	0	3	318.446	2.295	10	0		DEAEHN
CCCCOC[C@H](O)CN[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000193358411	201038074	/nfs/dbraw/zinc/03/80/74/201038074.db2.gz	DNMSSPMNJXRDKV-WMLDXEAASA-N	0	3	318.421	2.096	10	0		DEAEHN
CCO[C@@H](CNC(=O)N1CC[C@@H](N(C)C)C1)c1ccccc1	ZINC000195187159	201354491	/nfs/dbraw/zinc/35/44/91/201354491.db2.gz	TWEQDZHJHNMGBX-CVEARBPZSA-N	0	3	305.422	2.110	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC(c2c(F)cncc2F)=C[C@@H](N)C1	ZINC000675078732	541286582	/nfs/dbraw/zinc/28/65/82/541286582.db2.gz	RWOMLISNYFDZGE-SNVBAGLBSA-N	0	3	311.332	2.321	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2ccc(SC)cc2)CC12COC2	ZINC000449357579	240391031	/nfs/dbraw/zinc/39/10/31/240391031.db2.gz	DUWLVMUMXLPHEV-OAHLLOKOSA-N	0	3	321.442	2.420	10	0		DEAEHN
C[C@H](NC(=O)C[C@H]1CSCCN1)c1cc(F)ccc1F	ZINC000091134715	193000147	/nfs/dbraw/zinc/00/01/47/193000147.db2.gz	ULEOUNBQOVTTAC-ONGXEEELSA-N	0	3	300.374	2.237	10	0		DEAEHN
CC1(C)Oc2ccc(NC(=O)C[C@H]3CSCCN3)cc2O1	ZINC000091134736	193000297	/nfs/dbraw/zinc/00/02/97/193000297.db2.gz	CPPQIJSSBQEBLV-NSHDSACASA-N	0	3	308.403	2.228	10	0		DEAEHN
COc1ccccc1[C@H](C)N(C)C(=O)C[C@H]1CSCCN1	ZINC000091136085	193001924	/nfs/dbraw/zinc/00/19/24/193001924.db2.gz	WUCUPCYSYPIWGI-STQMWFEESA-N	0	3	308.447	2.310	10	0		DEAEHN
CCCNCc1cnn([C@]2(C)CCS(=O)(=O)C2)c1C(C)C	ZINC000091337286	193042981	/nfs/dbraw/zinc/04/29/81/193042981.db2.gz	ZPXAGJKAGFQESD-OAHLLOKOSA-N	0	3	313.467	2.040	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2cc(C(F)(F)F)ccc2C)C1	ZINC000091479776	193062182	/nfs/dbraw/zinc/06/21/82/193062182.db2.gz	FOSOSCSGSVSZGN-JQWIXIFHSA-N	0	3	302.296	2.329	10	0		DEAEHN
C[C@H](N[C@@H]1CCOC[C@@H]1O)c1ccc(Br)cc1	ZINC000624235886	365345616	/nfs/dbraw/zinc/34/56/16/365345616.db2.gz	RHTDAXGPOMKTJL-BIMULSAOSA-N	0	3	300.196	2.250	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@@H]1O)c1sccc1Br	ZINC000624237377	365345829	/nfs/dbraw/zinc/34/58/29/365345829.db2.gz	WCNNAHYCUQNTIC-HGNGGELXSA-N	0	3	306.225	2.311	10	0		DEAEHN
O[C@@H]1COCC[C@@H]1N[C@H]1CCc2c1cccc2Br	ZINC000624238731	365346767	/nfs/dbraw/zinc/34/67/67/365346767.db2.gz	XNSPORARCWPQDB-MELADBBJSA-N	0	3	312.207	2.176	10	0		DEAEHN
C[C@]1(C(N)=O)CCCCN1CCCOCCc1ccccc1	ZINC000185945756	291375360	/nfs/dbraw/zinc/37/53/60/291375360.db2.gz	LIRVBOPJOJAYJF-GOSISDBHSA-N	0	3	304.434	2.366	10	0		DEAEHN
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(-n2ccnc2C)cc1	ZINC000450677483	242089216	/nfs/dbraw/zinc/08/92/16/242089216.db2.gz	GNXKDXNTANDOHB-YVEFUNNKSA-N	0	3	301.390	2.171	10	0		DEAEHN
CNCc1ccc(Cl)c(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)c1	ZINC000092113521	193161273	/nfs/dbraw/zinc/16/12/73/193161273.db2.gz	XIRHDGPGQNHHOD-GHMZBOCLSA-N	0	3	316.854	2.336	10	0		DEAEHN
CC(C)NCc1cccc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)c1	ZINC000092113714	193161446	/nfs/dbraw/zinc/16/14/46/193161446.db2.gz	RGXUGPWQZWUELZ-ZIAGYGMSSA-N	0	3	310.463	2.461	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)cs1	ZINC000092113673	193161756	/nfs/dbraw/zinc/16/17/56/193161756.db2.gz	ZHXVBYNJIRCLOR-QWRGUYRKSA-N	0	3	302.465	2.134	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2[C@@H](C)CCC[C@@H]2C)c(F)c1	ZINC000092115548	193163025	/nfs/dbraw/zinc/16/30/25/193163025.db2.gz	PTMDCWRLURKHCX-RYUDHWBXSA-N	0	3	314.426	2.497	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCC(C)CC2)c(F)c1	ZINC000092115453	193163400	/nfs/dbraw/zinc/16/34/00/193163400.db2.gz	OFVAMUGUVSBKOV-UHFFFAOYSA-N	0	3	314.426	2.356	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2C[C@H](C)C[C@H](C)C2)c(F)c1	ZINC000092115531	193163697	/nfs/dbraw/zinc/16/36/97/193163697.db2.gz	ADPLLJOJXCHASU-TXEJJXNPSA-N	0	3	314.426	2.212	10	0		DEAEHN
CC(C)C[C@H](C)N(C)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115963	193163895	/nfs/dbraw/zinc/16/38/95/193163895.db2.gz	UXBZEULOQBOTKU-NSHDSACASA-N	0	3	302.415	2.340	10	0		DEAEHN
Cc1cncc(CCNCc2ccncc2Br)n1	ZINC000631176768	368062528	/nfs/dbraw/zinc/06/25/28/368062528.db2.gz	WTGOWZTXVAVPIT-UHFFFAOYSA-N	0	3	307.195	2.275	10	0		DEAEHN
c1cc(CN[C@@H]2CCO[C@]3(CCOC3)C2)n(CC2CCC2)n1	ZINC000631105918	368020003	/nfs/dbraw/zinc/02/00/03/368020003.db2.gz	PGKHQPXCMPWSSP-NVXWUHKLSA-N	0	3	305.422	2.111	10	0		DEAEHN
COCCNCc1sc(N(C)CCOC)nc1C(C)C	ZINC000093000124	193192538	/nfs/dbraw/zinc/19/25/38/193192538.db2.gz	IJSCYTGQLXOSTM-UHFFFAOYSA-N	0	3	301.456	2.085	10	0		DEAEHN
CCC[C@H](C(=O)NCC1CCN(c2ccncc2)CC1)N(C)C	ZINC000093065231	193199204	/nfs/dbraw/zinc/19/92/04/193199204.db2.gz	YLZKWRAGMOSENR-QGZVFWFLSA-N	0	3	318.465	2.145	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(Br)nc1	ZINC000093097521	193202834	/nfs/dbraw/zinc/20/28/34/193202834.db2.gz	CELSSEOHXBFGIR-ZYHUDNBSSA-N	0	3	324.222	2.153	10	0		DEAEHN
Cc1c(C[S@@](C)=O)cccc1NC(=O)C1(N)CCCCC1	ZINC000262491703	203308565	/nfs/dbraw/zinc/30/85/65/203308565.db2.gz	XKNYWPMFDXFEPW-OAQYLSRUSA-N	0	3	308.447	2.474	10	0		DEAEHN
C[C@H](N)C(=O)N[C@H](Cc1ccc(Cl)cc1)c1ccccn1	ZINC000262511020	203314688	/nfs/dbraw/zinc/31/46/88/203314688.db2.gz	BIQIBELNHRLDNI-XHDPSFHLSA-N	0	3	303.793	2.482	10	0		DEAEHN
CSCC[C@@H](N)C(=O)NCC1(Cc2ccc(F)cc2)CC1	ZINC000262592168	203342659	/nfs/dbraw/zinc/34/26/59/203342659.db2.gz	VDRIVGWLDFGEJA-CQSZACIVSA-N	0	3	310.438	2.345	10	0		DEAEHN
C[C@H](Cc1cccs1)N(C)S(=O)(=O)c1cccc(CN)c1	ZINC000093294587	193226824	/nfs/dbraw/zinc/22/68/24/193226824.db2.gz	AAUINYORFRVFBF-GFCCVEGCSA-N	0	3	324.471	2.459	10	0		DEAEHN
NC(=O)[C@@]1(N)CCC[C@@H]1CCSc1ccc(F)c(F)c1	ZINC000093627220	193276166	/nfs/dbraw/zinc/27/61/66/193276166.db2.gz	OSKMJLQLSFGUIP-YMTOWFKASA-N	0	3	300.374	2.430	10	0		DEAEHN
CN[C@]1(C(N)=O)CC[C@@H](Sc2nc3ccccc3s2)C1	ZINC000093849279	193317508	/nfs/dbraw/zinc/31/75/08/193317508.db2.gz	WYQPCHNPQQETFG-YMTOWFKASA-N	0	3	307.444	2.384	10	0		DEAEHN
CN1CCN(c2nc(C(F)(F)F)ccc2CN)CC1(C)C	ZINC000094334303	193360184	/nfs/dbraw/zinc/36/01/84/193360184.db2.gz	QGCUPHFGIBEPJV-UHFFFAOYSA-N	0	3	302.344	2.090	10	0		DEAEHN
CCC(N)(CC)C(=O)Nc1cccc(Cl)c1-n1cncn1	ZINC000094244156	193354375	/nfs/dbraw/zinc/35/43/75/193354375.db2.gz	CEINFFQVYXVLKT-UHFFFAOYSA-N	0	3	307.785	2.377	10	0		DEAEHN
COc1ccccc1[C@](C)(N)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094640189	193388912	/nfs/dbraw/zinc/38/89/12/193388912.db2.gz	OZZRGJUFWSHNFL-HEHGZKQESA-N	0	3	311.447	2.473	10	0		DEAEHN
CC(C)CNCc1ncnn1[C@H]1CCO[C@@]2(CCSC2)C1	ZINC000094412859	193369123	/nfs/dbraw/zinc/36/91/23/193369123.db2.gz	UKNGFLRGWCTHFT-ZFWWWQNUSA-N	0	3	310.467	2.251	10	0		DEAEHN
CCOC(=O)[C@]1(NCCN(CC)CC)CCCS[C@H]1C	ZINC000094479801	193372827	/nfs/dbraw/zinc/37/28/27/193372827.db2.gz	QPBOANDXGQXIIY-ZFWWWQNUSA-N	0	3	302.484	2.135	10	0		DEAEHN
CN1CCC(NC(=O)c2cc(C(F)(F)F)ccc2N)CC1	ZINC000094595615	193381838	/nfs/dbraw/zinc/38/18/38/193381838.db2.gz	NEROFZRQSSQASB-UHFFFAOYSA-N	0	3	301.312	2.112	10	0		DEAEHN
C[C@H](CN1CCCC1)Nc1nc2c(Br)cccn2n1	ZINC000094604224	193384223	/nfs/dbraw/zinc/38/42/23/193384223.db2.gz	JRWIIGOHJHRGOC-SNVBAGLBSA-N	0	3	324.226	2.388	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(C)s1)N1CCN(C)C(=O)C1(C)C	ZINC000094865695	193403032	/nfs/dbraw/zinc/40/30/32/193403032.db2.gz	VQEUBHCQXBCHLK-TZMCWYRMSA-N	0	3	309.479	2.388	10	0		DEAEHN
COCCNCc1c(N2CCC(C)(C)C2)nc2sccn12	ZINC000094806106	193399038	/nfs/dbraw/zinc/39/90/38/193399038.db2.gz	NUWKBTKLVOITMM-UHFFFAOYSA-N	0	3	308.451	2.368	10	0		DEAEHN
O=C(Nc1nnc(-c2ccco2)s1)N1CCN2CCC[C@@H]2C1	ZINC000264748546	204123879	/nfs/dbraw/zinc/12/38/79/204123879.db2.gz	RAVUMLANBGTNJR-SNVBAGLBSA-N	0	3	319.390	2.110	10	0		DEAEHN
C[C@@H](CNC(=O)NCc1ccccc1OC(F)(F)F)N(C)C	ZINC000454159590	245478047	/nfs/dbraw/zinc/47/80/47/245478047.db2.gz	JURCUQIKCNXQFY-JTQLQIEISA-N	0	3	319.327	2.335	10	0		DEAEHN
CCn1ncc(Br)c1[C@H](NC)C1CCOCC1	ZINC000160347259	197402401	/nfs/dbraw/zinc/40/24/01/197402401.db2.gz	NVVFKWMAROYNID-LLVKDONJSA-N	0	3	302.216	2.353	10	0		DEAEHN
NC[C@@H](c1ccccc1F)N1CCN(c2nccs2)CC1	ZINC000019990098	182174362	/nfs/dbraw/zinc/17/43/62/182174362.db2.gz	SMYQBGZLGWOAAV-AWEZNQCLSA-N	0	3	306.410	2.104	10	0		DEAEHN
COC(C)(C)CNCC(=O)Nc1cccc(Br)c1	ZINC000160253947	197395836	/nfs/dbraw/zinc/39/58/36/197395836.db2.gz	ROIVLVOUTYGVRG-UHFFFAOYSA-N	0	3	315.211	2.402	10	0		DEAEHN
Cc1ccc(CN)cc1S(=O)(=O)N1CCc2ccccc21	ZINC000020189506	182195511	/nfs/dbraw/zinc/19/55/11/182195511.db2.gz	LOBZSLBQMCELJE-UHFFFAOYSA-N	0	3	302.399	2.205	10	0		DEAEHN
[NH3+][C@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1cc(F)ccc1Cl	ZINC000097896630	193766134	/nfs/dbraw/zinc/76/61/34/193766134.db2.gz	HRHUSOXWEYQFBI-QWRGUYRKSA-N	0	3	306.790	2.027	10	0		DEAEHN
COc1cccc(CN[C@H]2CCCN(C)C2)c1OC(F)F	ZINC000040672773	183116002	/nfs/dbraw/zinc/11/60/02/183116002.db2.gz	BAJLYUNCFOVLRH-LBPRGKRZSA-N	0	3	300.349	2.480	10	0		DEAEHN
CC(C)C[C@H](CO)NCc1ccc(I)o1	ZINC000040775836	183132615	/nfs/dbraw/zinc/13/26/15/183132615.db2.gz	BWWJQTDMXCSDCO-SECBINFHSA-N	0	3	323.174	2.381	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)Nc1sc2c(c1C(=O)OC)CCC2	ZINC000040858924	183143108	/nfs/dbraw/zinc/14/31/08/183143108.db2.gz	FWNXOGIGSVIFIP-OAHLLOKOSA-N	0	3	310.419	2.479	10	0		DEAEHN
CC[C@@H](C)N(CCOC)S(=O)(=O)c1cccc([C@@H](C)N)c1	ZINC000042593847	183289405	/nfs/dbraw/zinc/28/94/05/183289405.db2.gz	WMQQVIKRVDJDTH-CHWSQXEVSA-N	0	3	314.451	2.142	10	0		DEAEHN
Cc1cccc([C@@H](CN)Oc2cccc(S(C)(=O)=O)c2)c1	ZINC000042969280	183324534	/nfs/dbraw/zinc/32/45/34/183324534.db2.gz	DDJIVHNBPBHCHJ-MRXNPFEDSA-N	0	3	305.399	2.477	10	0		DEAEHN
CS(=O)(=O)c1ccc(O[C@H](CN)c2cccc(F)c2)cc1	ZINC000042974198	183325374	/nfs/dbraw/zinc/32/53/74/183325374.db2.gz	BHLKFSFPVZLEAH-OAHLLOKOSA-N	0	3	309.362	2.308	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)s1)N1CCC[C@@H]1C(=O)NC	ZINC000043253672	183347706	/nfs/dbraw/zinc/34/77/06/183347706.db2.gz	UDTGBUHUTMPTKL-GIPNMCIBSA-N	0	3	315.870	2.390	10	0		DEAEHN
CC(C)CN(CC(N)=O)[C@@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043254172	183348409	/nfs/dbraw/zinc/34/84/09/183348409.db2.gz	WAGYRESECDJENC-NOZJJQNGSA-N	0	3	303.859	2.233	10	0		DEAEHN
COc1ccc2cc([C@@H](N)[C@@H]3CCS(=O)(=O)C3)ccc2c1	ZINC000043299894	183351548	/nfs/dbraw/zinc/35/15/48/183351548.db2.gz	RSBUXWTYMDOQNO-GDBMZVCRSA-N	0	3	305.399	2.283	10	0		DEAEHN
CCN[C@@H](c1ccccc1OC(F)F)[C@H]1CCS(=O)(=O)C1	ZINC000043300991	183352225	/nfs/dbraw/zinc/35/22/25/183352225.db2.gz	FXBAYXMNLLMVBH-GXFFZTMASA-N	0	3	319.373	2.373	10	0		DEAEHN
CN[C@@H](c1ccc(C(F)(F)F)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000043300514	183352627	/nfs/dbraw/zinc/35/26/27/183352627.db2.gz	UHZAGXBXDXEPGJ-JQWIXIFHSA-N	0	3	307.337	2.401	10	0		DEAEHN
CNCc1cc(Br)ccc1OCC(=O)OC(C)C	ZINC000043445954	183363974	/nfs/dbraw/zinc/36/39/74/183363974.db2.gz	PARDNZYAEFIBJX-UHFFFAOYSA-N	0	3	316.195	2.499	10	0		DEAEHN
CCOc1ccc(OC)cc1NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000105044232	194067005	/nfs/dbraw/zinc/06/70/05/194067005.db2.gz	REHFKKXJAVCGBL-GFCCVEGCSA-N	0	3	307.394	2.262	10	0		DEAEHN
CCOc1ccccc1NC(=O)[C@H](C)NCCn1cc(C)cn1	ZINC000105881482	194155740	/nfs/dbraw/zinc/15/57/40/194155740.db2.gz	REKOPGSQAVFOLY-AWEZNQCLSA-N	0	3	316.405	2.207	10	0		DEAEHN
COc1ccc(OCCN2CCC[C@H](n3cncn3)C2)cc1	ZINC000105898053	194163361	/nfs/dbraw/zinc/16/33/61/194163361.db2.gz	FJSDHCOBLKUDNU-AWEZNQCLSA-N	0	3	302.378	2.003	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc3c(c2)OCCO3)CCN1CCOC	ZINC000106113001	194188281	/nfs/dbraw/zinc/18/82/81/194188281.db2.gz	MJOUOGGHBSGQOG-INIZCTEOSA-N	0	3	320.433	2.000	10	0		DEAEHN
C[C@H](OC[C@@H]1CCCCO1)C(=O)N[C@@H]1CCN(C2CCCC2)C1	ZINC000106789571	194253147	/nfs/dbraw/zinc/25/31/47/194253147.db2.gz	NSGSWJGBSAZQCT-UXLLHSPISA-N	0	3	324.465	2.094	10	0		DEAEHN
COC(=O)CCN(C)CCOc1cccc(Br)c1	ZINC000050068121	183771337	/nfs/dbraw/zinc/77/13/37/183771337.db2.gz	SABMIWBCZYSXAH-UHFFFAOYSA-N	0	3	316.195	2.323	10	0		DEAEHN
CC[C@@H](C(N)=S)N1CCN(c2nc3ccccc3o2)CC1	ZINC000109471531	194266737	/nfs/dbraw/zinc/26/67/37/194266737.db2.gz	CFSYPGFKTFCWTO-LBPRGKRZSA-N	0	3	304.419	2.015	10	0		DEAEHN
COC[C@@H](C)N(C)[C@@H](CN)c1ccc(OC)c(OC)c1Cl	ZINC000110829196	194362018	/nfs/dbraw/zinc/36/20/18/194362018.db2.gz	KBGHBQZRKDTWIH-PWSUYJOCSA-N	0	3	316.829	2.324	10	0		DEAEHN
CCCN([C@H]1CCCNC1)S(=O)(=O)c1cc(C)cc(C)c1	ZINC000110942106	194371982	/nfs/dbraw/zinc/37/19/82/194371982.db2.gz	OOPQSHMEBXFFCO-HNNXBMFYSA-N	0	3	310.463	2.456	10	0		DEAEHN
CCCN([C@@H]1CCCNC1)S(=O)(=O)c1ccccc1Cl	ZINC000110942186	194372757	/nfs/dbraw/zinc/37/27/57/194372757.db2.gz	SQGVAJRMSFHUKO-GFCCVEGCSA-N	0	3	316.854	2.493	10	0		DEAEHN
CC(C)c1ccc([C@@H](C)NCC(=O)NC(=O)NC2CC2)cc1	ZINC000057880047	184060706	/nfs/dbraw/zinc/06/07/06/184060706.db2.gz	VMDLMTIATAPBAG-GFCCVEGCSA-N	0	3	303.406	2.449	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)Nc1cc(F)ccc1F	ZINC000061040956	184160325	/nfs/dbraw/zinc/16/03/25/184160325.db2.gz	HEXDSCBMUFWAHD-UHFFFAOYSA-N	0	3	309.360	2.073	10	0		DEAEHN
CNC(C)(C)C(=O)Nc1cc(Br)ccc1OC	ZINC000061318912	184168124	/nfs/dbraw/zinc/16/81/24/184168124.db2.gz	VEZUCEPGVRLMQC-UHFFFAOYSA-N	0	3	301.184	2.394	10	0		DEAEHN
CCN1CCC[C@@H]1CNc1nc(Cl)nc(N2CCCC2)n1	ZINC000061536830	184172943	/nfs/dbraw/zinc/17/29/43/184172943.db2.gz	TYELIWAISRTCQW-LLVKDONJSA-N	0	3	310.833	2.021	10	0		DEAEHN
C[C@@H](N)[C@@H](c1cccs1)N1CCN(CC(F)(F)F)CC1	ZINC000061940829	184197243	/nfs/dbraw/zinc/19/72/43/184197243.db2.gz	PXQFQVPOAMDEKF-PWSUYJOCSA-N	0	3	307.385	2.316	10	0		DEAEHN
Cc1ccc([C@H](N)CN2CCN(CC(F)(F)F)CC2)cc1	ZINC000061941116	184197416	/nfs/dbraw/zinc/19/74/16/184197416.db2.gz	FCSAHLKJVXHVQF-CQSZACIVSA-N	0	3	301.356	2.175	10	0		DEAEHN
C[C@](N)(CN1CCN(CC(F)(F)F)CC1)c1ccccc1	ZINC000061948064	184198011	/nfs/dbraw/zinc/19/80/11/184198011.db2.gz	XKIMTCGZGBHUKL-AWEZNQCLSA-N	0	3	301.356	2.040	10	0		DEAEHN
CN(CCNCc1ccc(I)o1)C1CC1	ZINC000061994416	184200741	/nfs/dbraw/zinc/20/07/41/184200741.db2.gz	NAGXMMXOHCKJOZ-UHFFFAOYSA-N	0	3	320.174	2.068	10	0		DEAEHN
Cc1cccc(CN2CCC[C@@H]2C(=O)N2CCOC[C@@H]2C)c1	ZINC000062509676	184240890	/nfs/dbraw/zinc/24/08/90/184240890.db2.gz	WPKZSTAJIYSJSQ-DOTOQJQBSA-N	0	3	302.418	2.207	10	0		DEAEHN
CC(C)N[C@@H](CCSc1ccc(C(F)(F)F)cn1)C(N)=O	ZINC000062599066	184244737	/nfs/dbraw/zinc/24/47/37/184244737.db2.gz	DORWLXDRGQRELP-JTQLQIEISA-N	0	3	321.368	2.435	10	0		DEAEHN
CCNC(=O)COc1ccc(OCCN2CCCCC2)cc1	ZINC000063457416	184282220	/nfs/dbraw/zinc/28/22/20/184282220.db2.gz	WSFPVGZYIQWZIM-UHFFFAOYSA-N	0	3	306.406	2.066	10	0		DEAEHN
COc1ccc(S(=O)(=O)[N-]c2cccc(C[NH3+])c2)cc1C	ZINC000063191076	184277052	/nfs/dbraw/zinc/27/70/52/184277052.db2.gz	AKSCOMNGGSXGPW-UHFFFAOYSA-N	0	3	306.387	2.263	10	0		DEAEHN
CC[C@H](C)NCC(=O)Nc1ccc(CCC(=O)N(C)C)cc1	ZINC000066068231	184386517	/nfs/dbraw/zinc/38/65/17/184386517.db2.gz	KHMKKCADZZUXQW-ZDUSSCGKSA-N	0	3	305.422	2.034	10	0		DEAEHN
CC(C)(C)NCC(=O)Nc1cccc(C(=O)N2CCCC2)c1	ZINC000066212424	184396977	/nfs/dbraw/zinc/39/69/77/184396977.db2.gz	MCGSYTPTMRIKJN-UHFFFAOYSA-N	0	3	303.406	2.249	10	0		DEAEHN
C[C@H](CCO)NC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000119161558	207356041	/nfs/dbraw/zinc/35/60/41/207356041.db2.gz	MEZQKHPSTXCROM-QAPCUYQASA-N	0	3	319.449	2.111	10	0		DEAEHN
CC[C@H]1CN(c2ccccc2)CCN1CCCN1CCOCC1	ZINC000184004477	207363771	/nfs/dbraw/zinc/36/37/71/207363771.db2.gz	YRAMPNCMCYFLMV-SFHVURJKSA-N	0	3	317.477	2.310	10	0		DEAEHN
CCOC[C@@H](O)COc1ccc(Br)cc1[C@@H](C)N	ZINC000069275858	184506411	/nfs/dbraw/zinc/50/64/11/184506411.db2.gz	RQRHSXVNLGIMFT-MWLCHTKSSA-N	0	3	318.211	2.245	10	0		DEAEHN
COCCN1CCCN(C[C@@H](C)Cc2ccccc2)CC1=O	ZINC000191698907	285017821	/nfs/dbraw/zinc/01/78/21/285017821.db2.gz	ARPDDVHDBCBVDU-INIZCTEOSA-N	0	3	304.434	2.046	10	0		DEAEHN
C[C@@H](NC[C@H](O)COC[C@H]1CCCO1)c1ccc(F)cc1F	ZINC000538187401	285027192	/nfs/dbraw/zinc/02/71/92/285027192.db2.gz	GEVBQHHQHHLHFH-KWCYVHTRSA-N	0	3	315.360	2.172	10	0		DEAEHN
c1cn(Cc2ccccc2)c(CN[C@@H]2CCc3c[nH]nc3C2)n1	ZINC000539516017	285079480	/nfs/dbraw/zinc/07/94/80/285079480.db2.gz	ZHNUOCUWWYEMBC-MRXNPFEDSA-N	0	3	307.401	2.302	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)Cc2ccoc2)cc(CN)c1F	ZINC000159094758	197326238	/nfs/dbraw/zinc/32/62/38/197326238.db2.gz	HBPZPDZJUBAJGP-UHFFFAOYSA-N	0	3	312.366	2.007	10	0		DEAEHN
COCCNCc1cnc(N2CCSC(C)(C)C2)c(C)c1	ZINC000158928413	197312433	/nfs/dbraw/zinc/31/24/33/197312433.db2.gz	MADVSAVODGTUSS-UHFFFAOYSA-N	0	3	309.479	2.458	10	0		DEAEHN
NCc1cc(C(F)(F)F)ccc1NC(=O)N[C@H]1CCOC1	ZINC000158349171	197264294	/nfs/dbraw/zinc/26/42/94/197264294.db2.gz	RMMBHFYXFWIGHX-JTQLQIEISA-N	0	3	303.284	2.075	10	0		DEAEHN
COc1ccc([C@H](C)NC[C@@]2(O)CCSC2)cc1NC(C)=O	ZINC000158247774	197257046	/nfs/dbraw/zinc/25/70/46/197257046.db2.gz	SBOOZNREZDOGCG-ZBEGNZNMSA-N	0	3	324.446	2.172	10	0		DEAEHN
CCCN[C@H](Cc1ccc(OC)c(F)c1)[C@H](C)S(C)(=O)=O	ZINC000157284157	197176785	/nfs/dbraw/zinc/17/67/85/197176785.db2.gz	GVYJRDSVVTZKHW-SMDDNHRTSA-N	0	3	317.426	2.178	10	0		DEAEHN
COC[C@@H](C)C(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1	ZINC000186054302	285199502	/nfs/dbraw/zinc/19/95/02/285199502.db2.gz	OWYZNLRTLHPSKR-RHSMWYFYSA-N	0	3	304.434	2.296	10	0		DEAEHN
Cc1ccccc1CN1CCC(NC(=O)C[C@H](O)C(C)C)CC1	ZINC000156359756	197107226	/nfs/dbraw/zinc/10/72/26/197107226.db2.gz	VBKSODLZXQBLLO-SFHVURJKSA-N	0	3	318.461	2.483	10	0		DEAEHN
CS(=O)(=O)c1ccc(F)c(N[C@H]2CCN3CCC[C@@H]3C2)c1	ZINC000155931586	197075746	/nfs/dbraw/zinc/07/57/46/197075746.db2.gz	MJEXWZJUCRRIAJ-NWDGAFQWSA-N	0	3	312.410	2.268	10	0		DEAEHN
CC(=O)Nc1ccc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1	ZINC000155531727	197064021	/nfs/dbraw/zinc/06/40/21/197064021.db2.gz	NLXKNRMSKDTVSK-WBMJQRKESA-N	0	3	303.406	2.104	10	0		DEAEHN
COc1cc(OC)cc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000155411762	197052083	/nfs/dbraw/zinc/05/20/83/197052083.db2.gz	IUQKDVDEGPODLR-WBMJQRKESA-N	0	3	306.406	2.162	10	0		DEAEHN
C[C@H](Cc1ccccc1Cl)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000155121566	197024466	/nfs/dbraw/zinc/02/44/66/197024466.db2.gz	RLAUWPMUZJQNTA-HIFRSBDPSA-N	0	3	324.852	2.308	10	0		DEAEHN
CC[C@H](C)OCC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000328619522	257264561	/nfs/dbraw/zinc/26/45/61/257264561.db2.gz	FZGZDQLSILZVDW-ZVZYQTTQSA-N	0	3	319.449	2.348	10	0		DEAEHN
CC[C@@H](C)CNS(=O)(=O)c1cc(F)c(Cl)c(CN)c1	ZINC000122183512	195414647	/nfs/dbraw/zinc/41/46/47/195414647.db2.gz	FCKASLXETWGALD-MRVPVSSYSA-N	0	3	308.806	2.262	10	0		DEAEHN
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(CN)c(Cl)c2)C1	ZINC000126139128	195813531	/nfs/dbraw/zinc/81/35/31/195813531.db2.gz	GSCMXBOYGHARDH-GHMZBOCLSA-N	0	3	316.854	2.465	10	0		DEAEHN
CN1CCO[C@H](CN)[C@@H]1c1ccc(Br)cc1Cl	ZINC000127367594	195871150	/nfs/dbraw/zinc/87/11/50/195871150.db2.gz	CYXMQDDACKEOHO-NEPJUHHUSA-N	0	3	319.630	2.433	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2cnc(-c3ccco3)s2)n1	ZINC000263248446	132579075	/nfs/dbraw/zinc/57/90/75/132579075.db2.gz	POTNMBQEZBEYMH-VIFPVBQESA-N	0	3	317.374	2.029	10	0		DEAEHN
COc1ccc([C@@H](C)Cc2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263295427	132580902	/nfs/dbraw/zinc/58/09/02/132580902.db2.gz	WEVIMTQTYOYURA-SWLSCSKDSA-N	0	3	316.405	2.001	10	0		DEAEHN
COCCCN1C[C@]2(C[C@H]2N)c2cc(Br)ccc21	ZINC000725247290	542769845	/nfs/dbraw/zinc/76/98/45/542769845.db2.gz	LUINRVMLHZSZST-ZIAGYGMSSA-N	0	3	311.223	2.274	10	0		DEAEHN
CC(C)c1ccc(/C=C/CC(=O)NC[C@]2(O)CCN(C)C2)cc1	ZINC000358068364	133118904	/nfs/dbraw/zinc/11/89/04/133118904.db2.gz	QZPPEVAKCRLTMK-VZSQWMKGSA-N	0	3	316.445	2.396	10	0		DEAEHN
O=C(c1ccnnc1)N(CCN1CCCCCC1)C1CCC1	ZINC000359822756	133147047	/nfs/dbraw/zinc/14/70/47/133147047.db2.gz	RCVQHAUUDMWXFI-UHFFFAOYSA-N	0	3	302.422	2.347	10	0		DEAEHN
COC1(CNC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CCC1	ZINC000248600267	292119385	/nfs/dbraw/zinc/11/93/85/292119385.db2.gz	UILKUJBDLKPGMQ-JKSUJKDBSA-N	0	3	317.433	2.300	10	0		DEAEHN
Fc1ccc(-c2noc(CCCNCc3cncnc3)n2)cc1	ZINC000184169459	144940323	/nfs/dbraw/zinc/94/03/23/144940323.db2.gz	WGSNDYHYAXMUJQ-UHFFFAOYSA-N	0	3	313.336	2.388	10	0		DEAEHN
Cn1cc(CCC(=O)N2CCN3CCC2CC3)c2ccccc21	ZINC000188658213	145015504	/nfs/dbraw/zinc/01/55/04/145015504.db2.gz	PSVWNCDSJNSJJM-UHFFFAOYSA-N	0	3	311.429	2.418	10	0		DEAEHN
CCc1nn(C)c(CC)c1CC(=O)N(C)C[C@H]1CCCN1CC	ZINC000188705313	145016153	/nfs/dbraw/zinc/01/61/53/145016153.db2.gz	QGRDBHPVEKUHPY-CQSZACIVSA-N	0	3	320.481	2.030	10	0		DEAEHN
COc1ccc2[nH]cc(CC(=O)N3CCN4CCC3CC4)c2c1	ZINC000188850997	145018314	/nfs/dbraw/zinc/01/83/14/145018314.db2.gz	NRSFWDLAVLEMFB-UHFFFAOYSA-N	0	3	313.401	2.026	10	0		DEAEHN
Cn1c2ccc(CNCCc3nccs3)cc2sc1=O	ZINC000192521988	145074555	/nfs/dbraw/zinc/07/45/55/145074555.db2.gz	BJGPCZFBKMYRQN-UHFFFAOYSA-N	0	3	305.428	2.389	10	0		DEAEHN
O=C(N[C@H]1CCCC[C@@H]1n1cccn1)C1CCN(C2CC2)CC1	ZINC000192670376	145077178	/nfs/dbraw/zinc/07/71/78/145077178.db2.gz	QILWRXGJPZGXQR-IRXDYDNUSA-N	0	3	316.449	2.357	10	0		DEAEHN
CCOc1ccc(NC(=O)N2CCN3CCC[C@@H]3C2)cc1OC	ZINC000193724707	145089767	/nfs/dbraw/zinc/08/97/67/145089767.db2.gz	RNKZIOOHHRMZHW-CQSZACIVSA-N	0	3	319.405	2.406	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)[C@H](C)N1CCN2CCC[C@H]2C1	ZINC000246410870	145102467	/nfs/dbraw/zinc/10/24/67/145102467.db2.gz	QSLRBYXBYYLVJM-WMZOPIPTSA-N	0	3	315.461	2.204	10	0		DEAEHN
CC(C)(C)OC[C@H](O)CN1CCC[C@H]1C[C@H](O)c1ccco1	ZINC000246432529	145103078	/nfs/dbraw/zinc/10/30/78/145103078.db2.gz	DGFAWDMQHLCCNJ-ZNMIVQPWSA-N	0	3	311.422	2.344	10	0		DEAEHN
COc1cccc(OCCN2CCS[C@H]3COCC[C@H]32)c1	ZINC000246502179	145104623	/nfs/dbraw/zinc/10/46/23/145104623.db2.gz	BEOQLKLNOQRKDQ-CVEARBPZSA-N	0	3	309.431	2.280	10	0		DEAEHN
COc1cccc(CCCN2CCN(C[C@H](C)O)[C@H](C)C2)c1	ZINC000246620768	145108821	/nfs/dbraw/zinc/10/88/21/145108821.db2.gz	HCWGASYMENBYFI-CVEARBPZSA-N	0	3	306.450	2.015	10	0		DEAEHN
C[C@H](C(=O)NC[C@H]1CCCO1)N1CCC[C@]2(CC=CCC2)C1	ZINC000246676046	145110084	/nfs/dbraw/zinc/11/00/84/145110084.db2.gz	GMZJRYXFCJZVBJ-JFIYKMOQSA-N	0	3	306.450	2.492	10	0		DEAEHN
COC[C@@H](C)C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000246865202	145116950	/nfs/dbraw/zinc/11/69/50/145116950.db2.gz	SZKPJXIMQXXGJR-HZPDHXFCSA-N	0	3	304.434	2.392	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)C(=O)Nc2ccc(Cl)cc2)C1	ZINC000246974260	145120880	/nfs/dbraw/zinc/12/08/80/145120880.db2.gz	GDUAUVJSTYDRGP-SMDDNHRTSA-N	0	3	323.824	2.123	10	0		DEAEHN
NC(=O)c1cccc(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)c1	ZINC000246976239	145121733	/nfs/dbraw/zinc/12/17/33/145121733.db2.gz	VRJASDJYINUBIQ-WMZOPIPTSA-N	0	3	313.445	2.234	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cnc(-c2ccccc2)nc1	ZINC000247020270	145123394	/nfs/dbraw/zinc/12/33/94/145123394.db2.gz	GBAOJSKYQZLVTB-PBHICJAKSA-N	0	3	322.412	2.452	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cccc2c1OCCO2	ZINC000247021125	145123753	/nfs/dbraw/zinc/12/37/53/145123753.db2.gz	SOXVLFSLXKHSQI-KGLIPLIRSA-N	0	3	316.401	2.157	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)CSCc1cccnc1	ZINC000247063007	145125349	/nfs/dbraw/zinc/12/53/49/145125349.db2.gz	HJIZBYVEFKWPQJ-HIFRSBDPSA-N	0	3	305.447	2.010	10	0		DEAEHN
C[C@H](C(=O)Nc1cc(F)ccc1F)N1CCN2CCC[C@H]2C1	ZINC000247098676	145126307	/nfs/dbraw/zinc/12/63/07/145126307.db2.gz	ICFUYSMVCGPDPR-YPMHNXCESA-N	0	3	309.360	2.072	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@H]1CCN(c2ccccc2)C1=O	ZINC000247133938	145126746	/nfs/dbraw/zinc/12/67/46/145126746.db2.gz	SMIFZRXUANJBPU-MSOLQXFVSA-N	0	3	324.428	2.461	10	0		DEAEHN
C[C@@H]1CN([C@H](CNCc2cncn2C)c2cccs2)CCO1	ZINC000247175120	145128095	/nfs/dbraw/zinc/12/80/95/145128095.db2.gz	NCNBYLRPKSEKDC-UKRRQHHQSA-N	0	3	320.462	2.033	10	0		DEAEHN
Cc1cnc([C@H](NC(=O)N2CCN3CCC[C@H]3C2)C2CC2)s1	ZINC000247183744	145128311	/nfs/dbraw/zinc/12/83/11/145128311.db2.gz	SHELAARZQHBWPD-UONOGXRCSA-N	0	3	320.462	2.392	10	0		DEAEHN
C[C@H]1CCCCN1C(=O)CN1CC[C@@H](CNc2ccccn2)C1	ZINC000247352151	145134609	/nfs/dbraw/zinc/13/46/09/145134609.db2.gz	LKGNTYSBQUBZKA-HOTGVXAUSA-N	0	3	316.449	2.216	10	0		DEAEHN
C[C@H](C(=O)N1CCC(c2cc[nH]n2)CC1)N1[C@H](C)CC[C@@H]1C	ZINC000247422631	145136825	/nfs/dbraw/zinc/13/68/25/145136825.db2.gz	VAAZYIQFQIVCCD-HZSPNIEDSA-N	0	3	304.438	2.377	10	0		DEAEHN
Cc1ncsc1CN(C)C(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000247462792	145137629	/nfs/dbraw/zinc/13/76/29/145137629.db2.gz	UNLJPTXCKDFUKE-DGCLKSJQSA-N	0	3	310.467	2.322	10	0		DEAEHN
C[C@@H](c1cn(-c2ccccc2)nn1)N1CCN2CCCC[C@H]2C1	ZINC000247455367	145137703	/nfs/dbraw/zinc/13/77/03/145137703.db2.gz	PFABSWDINZPMTR-RDJZCZTQSA-N	0	3	311.433	2.498	10	0		DEAEHN
CC[C@H]1CN(CCCCCn2cc(C)cn2)CCN1C[C@H](C)O	ZINC000247591381	145141957	/nfs/dbraw/zinc/14/19/57/145141957.db2.gz	NIMXNHQSLZNIIX-ROUUACIJSA-N	0	3	322.497	2.139	10	0		DEAEHN
O=C(CCN1CCN2CCCC[C@H]2C1)Nc1ccc(F)cc1	ZINC000248339954	145151478	/nfs/dbraw/zinc/15/14/78/145151478.db2.gz	IKJKMYICIRGXAA-INIZCTEOSA-N	0	3	305.397	2.324	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCc1cccnc1	ZINC000248389128	145152744	/nfs/dbraw/zinc/15/27/44/145152744.db2.gz	GEZQCFLHFARIPX-MAUKXSAKSA-N	0	3	324.428	2.401	10	0		DEAEHN
CCc1nsc(N2CCCN(C[C@@](C)(O)C(C)C)CC2)n1	ZINC000248426434	145154852	/nfs/dbraw/zinc/15/48/52/145154852.db2.gz	MXPBXYQZWLGZOL-OAHLLOKOSA-N	0	3	312.483	2.020	10	0		DEAEHN
Cc1cc(C)cc([C@@H]2CCN(C[C@@H](O)CN3CCCC3=O)C2)c1	ZINC000248464897	145156284	/nfs/dbraw/zinc/15/62/84/145156284.db2.gz	RHWNSCAWMYFDSF-SJLPKXTDSA-N	0	3	316.445	2.076	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC[C@@H]1C[C@@H](O)c1ccco1	ZINC000248659120	145163475	/nfs/dbraw/zinc/16/34/75/145163475.db2.gz	UZMAAVFXEXYUEM-BZUAXINKSA-N	0	3	311.422	2.345	10	0		DEAEHN
C/C=C/C[C@H](CO)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248743254	145166316	/nfs/dbraw/zinc/16/63/16/145166316.db2.gz	RUIZNSDYMRKRSX-JUAGGHJOSA-N	0	3	317.433	2.058	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1C[C@H]1CC2(CCC2)C(=O)O1	ZINC000248825657	145169371	/nfs/dbraw/zinc/16/93/71/145169371.db2.gz	GWTJAHIRULTFKD-LSDHHAIUSA-N	0	3	303.406	2.142	10	0		DEAEHN
COc1ccc(F)c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1OC	ZINC000248998128	145175097	/nfs/dbraw/zinc/17/50/97/145175097.db2.gz	GYSDIVRZPHAUIU-RYUDHWBXSA-N	0	3	322.380	2.152	10	0		DEAEHN
Cc1nn(C)cc1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000249030052	145176027	/nfs/dbraw/zinc/17/60/27/145176027.db2.gz	LNBFQVBMVOYFTL-ZBFHGGJFSA-N	0	3	313.405	2.295	10	0		DEAEHN
Cc1nn(C)c(C)c1CN1C[C@H](CO)[C@@H](c2ccsc2)C1	ZINC000249544624	145186508	/nfs/dbraw/zinc/18/65/08/145186508.db2.gz	FXDXKBKUPMDWRD-GDBMZVCRSA-N	0	3	305.447	2.306	10	0		DEAEHN
CCN(CC)C(=O)[C@H](C)N1C[C@H](CO)[C@@H](c2ccsc2)C1	ZINC000249581991	145187314	/nfs/dbraw/zinc/18/73/14/145187314.db2.gz	RLWONCAAJOFAEV-NWANDNLSSA-N	0	3	310.463	2.013	10	0		DEAEHN
CCCN(C)[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000249824203	145190984	/nfs/dbraw/zinc/19/09/84/145190984.db2.gz	IVNTTZAYVMZKIA-WBVHZDCISA-N	0	3	303.450	2.107	10	0		DEAEHN
C[C@@H]1CCC[C@@H](NC(=O)CN2CCCN(C3CC3)CC2)[C@H]1C	ZINC000250209818	145193134	/nfs/dbraw/zinc/19/31/34/145193134.db2.gz	MXGIERQLMWWQQY-HLLBOEOZSA-N	0	3	307.482	2.097	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@H](c2nccn2C)C2CC2)C12CCOCC2	ZINC000251676667	145195699	/nfs/dbraw/zinc/19/56/99/145195699.db2.gz	MRDSCJAETMMQSD-XHSDSOJGSA-N	0	3	319.449	2.435	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc32)CC[C@H]1C	ZINC000251704489	145196092	/nfs/dbraw/zinc/19/60/92/145196092.db2.gz	KDLWMIYWDJLIIU-HBUWYVDXSA-N	0	3	318.417	2.264	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN([C@H]2CCCN(C(C)C)C2=O)C1	ZINC000252648878	145199940	/nfs/dbraw/zinc/19/99/40/145199940.db2.gz	NLBMRGDFIXLMAD-HOTGVXAUSA-N	0	3	318.465	2.482	10	0		DEAEHN
CCC(C)(C)NC(=O)CN1CCNC[C@@H]1c1cccc(F)c1	ZINC000261601301	145209169	/nfs/dbraw/zinc/20/91/69/145209169.db2.gz	AGJPRYKNMCVPAK-OAHLLOKOSA-N	0	3	307.413	2.077	10	0		DEAEHN
C[C@H](NC(=O)C1(N)CCOCC1)c1c(F)cccc1Cl	ZINC000261750670	145222829	/nfs/dbraw/zinc/22/28/29/145222829.db2.gz	FCOFOSWETNZTLK-VIFPVBQESA-N	0	3	300.761	2.164	10	0		DEAEHN
CC(C)N(C)c1cccc(NC(=O)[C@@H](N)C2CCOCC2)c1	ZINC000261798848	145227245	/nfs/dbraw/zinc/22/72/45/145227245.db2.gz	OBDRSPNQRIRIMP-INIZCTEOSA-N	0	3	305.422	2.224	10	0		DEAEHN
COc1ccc(NC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)c(C)c1	ZINC000261937584	145244120	/nfs/dbraw/zinc/24/41/20/145244120.db2.gz	UGIYWJVFPSREHD-JCKWVBRZSA-N	0	3	318.417	2.475	10	0		DEAEHN
C[C@H](CNC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C)c1ccccc1	ZINC000261946345	145245772	/nfs/dbraw/zinc/24/57/72/145245772.db2.gz	VRBRUMDLCUIXGC-JNNRSPCRSA-N	0	3	316.445	2.439	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)Nc1ccc2n[nH]cc2c1	ZINC000261953548	145246138	/nfs/dbraw/zinc/24/61/38/145246138.db2.gz	WSOLYNDXLLKOIC-QEORTHHSSA-N	0	3	314.389	2.034	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)Nc1nc(C2CC2)cs1	ZINC000262530289	145290636	/nfs/dbraw/zinc/29/06/36/145290636.db2.gz	PLIFECKXOCSYGB-NSODJVPESA-N	0	3	321.446	2.492	10	0		DEAEHN
C[C@H]1C[NH2+]CC[C@H]1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000262769047	145304152	/nfs/dbraw/zinc/30/41/52/145304152.db2.gz	LREHCYXYCPHDIK-WCBMZHEXSA-N	0	3	323.245	2.270	10	0		DEAEHN
CC[C@@H](Oc1ccccc1C)c1nc([C@H]2CNCCN2C)no1	ZINC000263131023	145328014	/nfs/dbraw/zinc/32/80/14/145328014.db2.gz	BRHGCWRGEWLRQL-ZIAGYGMSSA-N	0	3	316.405	2.484	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(/C=C/c2cccc3cccnc23)n1	ZINC000263146627	145329647	/nfs/dbraw/zinc/32/96/47/145329647.db2.gz	CTPIWNOSUZDODJ-MVGZEHJDSA-N	0	3	321.384	2.364	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(C[C@@H]2CCCc3ccccc32)n1	ZINC000263153300	145330213	/nfs/dbraw/zinc/33/02/13/145330213.db2.gz	DFBAEUBROJLRPL-GOEBONIOSA-N	0	3	312.417	2.308	10	0		DEAEHN
Cc1cc(C)c(OCc2nc([C@@H]3CNCCN3C)no2)c(C)c1	ZINC000263176509	145332709	/nfs/dbraw/zinc/33/27/09/145332709.db2.gz	GGGBMSYKGHHAMN-AWEZNQCLSA-N	0	3	316.405	2.150	10	0		DEAEHN
CCc1ccc([C@@H](C)c2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263189008	145334155	/nfs/dbraw/zinc/33/41/55/145334155.db2.gz	HQSNJSDHMLHHNR-IUODEOHRSA-N	0	3	300.406	2.360	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(C2(c3ccc(Cl)cc3)CC2)n1	ZINC000263213561	145336444	/nfs/dbraw/zinc/33/64/44/145336444.db2.gz	KNICWJUERIQWMM-ZDUSSCGKSA-N	0	3	318.808	2.379	10	0		DEAEHN
CCOCc1nc([C@H](C)NC(=O)[C@H](C)N2[C@H](C)CC[C@H]2C)no1	ZINC000359506324	147339701	/nfs/dbraw/zinc/33/97/01/147339701.db2.gz	MBRNGKWKAQGLFL-NDBYEHHHSA-N	0	3	324.425	2.045	10	0		DEAEHN
CCOCc1nc([C@H](C)NC(=O)[C@@H](C)N2[C@H](C)CC[C@@H]2C)no1	ZINC000359506325	147339913	/nfs/dbraw/zinc/33/99/13/147339913.db2.gz	MBRNGKWKAQGLFL-QNWHQSFQSA-N	0	3	324.425	2.045	10	0		DEAEHN
c1cc(-c2ccc(CN[C@H]3CCN(c4ccccn4)C3)o2)n[nH]1	ZINC000370535840	148028574	/nfs/dbraw/zinc/02/85/74/148028574.db2.gz	MPSGDGXEWFKOEF-ZDUSSCGKSA-N	0	3	309.373	2.433	10	0		DEAEHN
CC(C)Cn1cc(CNC[C@@H]2CCC3(CCOCC3)[C@@H]2O)cn1	ZINC000374687615	148278661	/nfs/dbraw/zinc/27/86/61/148278661.db2.gz	OTTGQLHHFRQSMA-DLBZAZTESA-N	0	3	321.465	2.196	10	0		DEAEHN
COc1cccc(CNC[C@H]2CCC3(CCOCC3)[C@@H]2O)c1F	ZINC000374719585	148282364	/nfs/dbraw/zinc/28/23/64/148282364.db2.gz	VVTZXGZMVXYHOM-RHSMWYFYSA-N	0	3	323.408	2.492	10	0		DEAEHN
CC[C@@]1(C)CCCN(C(=O)NC[C@H]2CCCN2CCOC)C1	ZINC000074167183	401732011	/nfs/dbraw/zinc/73/20/11/401732011.db2.gz	OIHRCVJKQNCVHI-WBVHZDCISA-N	0	3	311.470	2.319	10	0		DEAEHN
COC(=O)[C@H](C)[C@@H](NC[C@H](O)COC(C)(C)C)c1ccccc1	ZINC000127379348	401732198	/nfs/dbraw/zinc/73/21/98/401732198.db2.gz	REIBRJGIBFJSBH-VNQPRFMTSA-N	0	3	323.433	2.302	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)C(=O)Nc2ccc(Cl)cc2)CCN1C	ZINC000127586221	401741168	/nfs/dbraw/zinc/74/11/68/401741168.db2.gz	WJMOLTKHDLYCAV-RISCZKNCSA-N	0	3	323.824	2.220	10	0		DEAEHN
Cc1cnn(CCN[C@H]2CCN(c3ccccc3Cl)C2=O)c1	ZINC000111229102	401701948	/nfs/dbraw/zinc/70/19/48/401701948.db2.gz	CBLFAXYQQBFHHC-AWEZNQCLSA-N	0	3	318.808	2.240	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N[C@@H](C)CN1CCCCC1	ZINC000073665443	401719976	/nfs/dbraw/zinc/71/99/76/401719976.db2.gz	GAXRFQSEPZZTQL-HNNXBMFYSA-N	0	3	321.469	2.213	10	0		DEAEHN
C[C@@H]1C[C@H](C)CN(C(=O)CN[C@@H]2CCCC[C@@H]2n2cccn2)C1	ZINC000127868533	401753356	/nfs/dbraw/zinc/75/33/56/401753356.db2.gz	ONIUKKUFJMMNJC-TWMKSMIVSA-N	0	3	318.465	2.461	10	0		DEAEHN
COCCOc1cccc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000113225535	401770337	/nfs/dbraw/zinc/77/03/37/401770337.db2.gz	JDQVFEJHTQDHJE-GDBMZVCRSA-N	0	3	318.417	2.021	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(F)cc2nc[nH]c21	ZINC000113232839	401771426	/nfs/dbraw/zinc/77/14/26/401771426.db2.gz	ZZXIXTYLCMASDW-ZYHUDNBSSA-N	0	3	302.353	2.011	10	0		DEAEHN
Cc1cc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)nn1C(C)(C)C	ZINC000113230131	401771994	/nfs/dbraw/zinc/77/19/94/401771994.db2.gz	ZSYONWJUBJOWPS-UONOGXRCSA-N	0	3	304.438	2.255	10	0		DEAEHN
CC(C)(C)NC(=O)CN1CC[C@@H](COCc2ccccc2)C1	ZINC000075866109	401772198	/nfs/dbraw/zinc/77/21/98/401772198.db2.gz	AMANBYDODNLHDN-MRXNPFEDSA-N	0	3	304.434	2.440	10	0		DEAEHN
Cc1cc(OC(F)F)c(C(=O)N2CC[C@@H](N(C)C)C2)s1	ZINC000114328134	401796571	/nfs/dbraw/zinc/79/65/71/401796571.db2.gz	YTLSWGGQFVKKTH-SECBINFHSA-N	0	3	304.362	2.434	10	0		DEAEHN
O=C(N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)N1CC[C@H](N2CC=CC2)C1	ZINC000130281985	401826021	/nfs/dbraw/zinc/82/60/21/401826021.db2.gz	KPSZDBNTWLLIFP-WZGPROSRSA-N	0	3	323.440	2.371	10	0		DEAEHN
CCOc1ncccc1CNC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000079196475	401871295	/nfs/dbraw/zinc/87/12/95/401871295.db2.gz	FWSKWHNECAUFIT-OAHLLOKOSA-N	0	3	322.453	2.256	10	0		DEAEHN
CC(=O)c1cccc(OCC(=O)NCCN2CCCC[C@H]2C)c1	ZINC000078337577	401847376	/nfs/dbraw/zinc/84/73/76/401847376.db2.gz	QMIKHXCNALEBID-CQSZACIVSA-N	0	3	318.417	2.259	10	0		DEAEHN
COC(=O)[C@@H](C)CN(CCn1ccnc1)Cc1ccccc1	ZINC000131417212	401849727	/nfs/dbraw/zinc/84/97/27/401849727.db2.gz	GZJDDALKRCRRGJ-HNNXBMFYSA-N	0	3	301.390	2.194	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2)CCO1	ZINC000116786209	401859012	/nfs/dbraw/zinc/85/90/12/401859012.db2.gz	ZVJQSGRPPXHTTH-ZDUSSCGKSA-N	0	3	316.323	2.108	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2ccc(Cl)c(Cl)c2)CCO1	ZINC000116796177	401859123	/nfs/dbraw/zinc/85/91/23/401859123.db2.gz	UJPNTPVVVNAHJQ-LLVKDONJSA-N	0	3	317.216	2.396	10	0		DEAEHN
Cc1ccc(CCCCC(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000116789314	401859459	/nfs/dbraw/zinc/85/94/59/401859459.db2.gz	JCKREYJNQMOPRG-SFHVURJKSA-N	0	3	318.461	2.497	10	0		DEAEHN
O=C(NC[C@H](O)CN1CCCCC1)Nc1cccc(Cl)c1	ZINC000043154929	401937462	/nfs/dbraw/zinc/93/74/62/401937462.db2.gz	KBLFUJYAGTZSGR-AWEZNQCLSA-N	0	3	311.813	2.308	10	0		DEAEHN
O=C(NCCCCNc1ccccn1)[C@@H]1CCCc2[nH]ncc21	ZINC000135372616	401937705	/nfs/dbraw/zinc/93/77/05/401937705.db2.gz	MZQJYPDBRYTCNR-CYBMUJFWSA-N	0	3	313.405	2.233	10	0		DEAEHN
CCN(CCNC(=O)N(C)CCc1ncc(C)s1)C1CC1	ZINC000119200562	401932335	/nfs/dbraw/zinc/93/23/35/401932335.db2.gz	QLAWTAUPCFYVPG-UHFFFAOYSA-N	0	3	310.467	2.120	10	0		DEAEHN
CCOC(=O)CCCCN(C)[C@@H]1CCN(c2ccccc2)C1=O	ZINC000133046164	401878067	/nfs/dbraw/zinc/87/80/67/401878067.db2.gz	LNUJAYURUXOEFN-MRXNPFEDSA-N	0	3	318.417	2.457	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1cc(=O)oc2c(C)c(C)ccc12	ZINC000079921409	401883717	/nfs/dbraw/zinc/88/37/17/401883717.db2.gz	BNEUHXWNYFHVHM-GOSISDBHSA-N	0	3	319.401	2.287	10	0		DEAEHN
Cn1nccc1CNC1(CNC(=O)OC(C)(C)C)CCCC1	ZINC000080201564	401888701	/nfs/dbraw/zinc/88/87/01/401888701.db2.gz	RRXBFSRHVZJYHZ-UHFFFAOYSA-N	0	3	308.426	2.347	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCC1(O)CCCCCC1	ZINC000118061669	401890360	/nfs/dbraw/zinc/89/03/60/401890360.db2.gz	LEGRSDCMVMCGEB-HNNXBMFYSA-N	0	3	313.486	2.347	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)Nc2ccc(Cl)c(F)c2)CCO1	ZINC000118805115	401908857	/nfs/dbraw/zinc/90/88/57/401908857.db2.gz	KEKWHDJIHSUPFN-LLVKDONJSA-N	0	3	315.776	2.273	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)[C@@H]1C[C@@H]1C1CCCCC1	ZINC000118976883	401916422	/nfs/dbraw/zinc/91/64/22/401916422.db2.gz	ONCUQGKHJPJGTA-BRWVUGGUSA-N	0	3	308.466	2.430	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](NCCc1nc(C)no1)CCCO2	ZINC000089518749	401950931	/nfs/dbraw/zinc/95/09/31/401950931.db2.gz	OSRPHNMLPNLICH-AWEZNQCLSA-N	0	3	303.362	2.433	10	0		DEAEHN
COC(=O)CC(C)(C)CC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000136662373	401971450	/nfs/dbraw/zinc/97/14/50/401971450.db2.gz	LUCWIAUJTXVKHB-ZDUSSCGKSA-N	0	3	300.443	2.058	10	0		DEAEHN
COc1cc(CN(C)C[C@H]2CCC[C@@H]2O)cc2c1OCCO2	ZINC000091899089	401998370	/nfs/dbraw/zinc/99/83/70/401998370.db2.gz	GLSJBZLVLXLMMI-KGLIPLIRSA-N	0	3	307.390	2.059	10	0		DEAEHN
COC(=O)CCN(Cc1cnc2nc(C)cc(C)n12)CC(C)C	ZINC000091922750	401999407	/nfs/dbraw/zinc/99/94/07/401999407.db2.gz	GKZNODDMGNHRAF-UHFFFAOYSA-N	0	3	318.421	2.367	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N(C)C[C@@H](C)CS(C)(=O)=O)C12CCCC2	ZINC000119367706	401945133	/nfs/dbraw/zinc/94/51/33/401945133.db2.gz	DNWJQMYWVAYJKQ-RBSFLKMASA-N	0	3	317.495	2.337	10	0		DEAEHN
CN(C)[C@@H](CN)c1cc(Br)c(Br)o1	ZINC000050361648	402027323	/nfs/dbraw/zinc/02/73/23/402027323.db2.gz	FUFDEKBTXKKTIN-LURJTMIESA-N	0	3	312.005	2.366	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCOc2ccccc2C)C1	ZINC000052561839	402044033	/nfs/dbraw/zinc/04/40/33/402044033.db2.gz	FZNVALUEBHREDR-OAHLLOKOSA-N	0	3	305.422	2.157	10	0		DEAEHN
CC(C)N(C)CC(=O)N1C[C@@H](C)O[C@H](c2ccc(F)cc2)C1	ZINC000152194467	402080945	/nfs/dbraw/zinc/08/09/45/402080945.db2.gz	KRGWTELGHNNQKH-CJNGLKHVSA-N	0	3	308.397	2.454	10	0		DEAEHN
Cc1c2cc(C)ccc2[nH]c1C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000152220482	402082659	/nfs/dbraw/zinc/08/26/59/402082659.db2.gz	NQZXGVHVLRYGAJ-AWEZNQCLSA-N	0	3	315.417	2.187	10	0		DEAEHN
COc1ccc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1OC	ZINC000122927780	402101752	/nfs/dbraw/zinc/10/17/52/402101752.db2.gz	AOVNYYSVDKUDQA-TZMCWYRMSA-N	0	3	306.406	2.259	10	0		DEAEHN
CC[C@](C)(O)CN1CCC(n2c3ccccc3[nH]c2=O)CC1	ZINC000123245049	402117490	/nfs/dbraw/zinc/11/74/90/402117490.db2.gz	SQNSDZWTIARCGB-KRWDZBQOSA-N	0	3	303.406	2.128	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)Nc2cccc(N(C)C)n2)CCN1C	ZINC000152961256	402119158	/nfs/dbraw/zinc/11/91/58/402119158.db2.gz	WXEWYOMYPVDOFZ-QWHCGFSZSA-N	0	3	305.426	2.094	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccccc2OCCOC)C1	ZINC000066338630	402131051	/nfs/dbraw/zinc/13/10/51/402131051.db2.gz	ASRALZKNTTXPRD-AWEZNQCLSA-N	0	3	321.421	2.318	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCc3ccc(OC)cc3C2)C1	ZINC000066338826	402131203	/nfs/dbraw/zinc/13/12/03/402131203.db2.gz	YUYNTVCBBDZGEJ-MRXNPFEDSA-N	0	3	317.433	2.247	10	0		DEAEHN
CCCC(=O)N1CCCC[C@@H]1C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000123521353	402132307	/nfs/dbraw/zinc/13/23/07/402132307.db2.gz	ZFGWZLRMVAEONE-OWCLPIDISA-N	0	3	323.481	2.109	10	0		DEAEHN
CC[C@@](C)(O)CN1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000123348445	402123383	/nfs/dbraw/zinc/12/33/83/402123383.db2.gz	ZKNJYKLLFQOERN-QGZVFWFLSA-N	0	3	308.397	2.135	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cc3c(s2)CCOC3)CCN1C	ZINC000123770942	402145043	/nfs/dbraw/zinc/14/50/43/402145043.db2.gz	YEULMPPJNDHROU-WCQYABFASA-N	0	3	308.447	2.376	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)c2ccc(N3CCOC3=O)cc2)c1	ZINC000123887670	402152363	/nfs/dbraw/zinc/15/23/63/402152363.db2.gz	SSQZAGRWJSVBCU-AWEZNQCLSA-N	0	3	314.389	2.499	10	0		DEAEHN
CC(C)[C@H](O)CNC(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000153510985	402150399	/nfs/dbraw/zinc/15/03/99/402150399.db2.gz	SZGHBQAVGMSZLF-DLBZAZTESA-N	0	3	319.449	2.140	10	0		DEAEHN
CC(C)[C@@H](C(=O)NCc1cccnc1N(C)C)N1CCCCC1	ZINC000067292465	402156298	/nfs/dbraw/zinc/15/62/98/402156298.db2.gz	CGJDCWVZLFRKIL-INIZCTEOSA-N	0	3	318.465	2.274	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H]1CCN(c2ccccc2OC)C1)N(C)C	ZINC000153932912	402181368	/nfs/dbraw/zinc/18/13/68/402181368.db2.gz	WQSGVBIAZSQMCV-GOEBONIOSA-N	0	3	319.449	2.120	10	0		DEAEHN
Cc1cc(NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C)ccc1F	ZINC000103323769	402185289	/nfs/dbraw/zinc/18/52/89/402185289.db2.gz	UBBAIMCXYWNQQV-AWEZNQCLSA-N	0	3	323.412	2.165	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-]C2(C[NH3+])CCCC2)c(Cl)cc1F	ZINC000124046105	402161250	/nfs/dbraw/zinc/16/12/50/402161250.db2.gz	LURLDMGASQLEJS-UHFFFAOYSA-N	0	3	320.817	2.337	10	0		DEAEHN
CC(C)c1noc(CCC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)n1	ZINC000124120649	402165163	/nfs/dbraw/zinc/16/51/63/402165163.db2.gz	PWAPHBOYEHDIJE-CHWSQXEVSA-N	0	3	308.426	2.067	10	0		DEAEHN
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)NCc1ccc([O-])c(F)c1	ZINC000124153664	402166178	/nfs/dbraw/zinc/16/61/78/402166178.db2.gz	GIWPCBNMCPUSFE-CQSZACIVSA-N	0	3	323.412	2.451	10	0		DEAEHN
CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)NCc1ccc([O-])c(F)c1	ZINC000124153664	402166180	/nfs/dbraw/zinc/16/61/80/402166180.db2.gz	GIWPCBNMCPUSFE-CQSZACIVSA-N	0	3	323.412	2.451	10	0		DEAEHN
COCCCCCNC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000125380223	402228563	/nfs/dbraw/zinc/22/85/63/402228563.db2.gz	AGUNEPMKWHRHSV-INIZCTEOSA-N	0	3	307.438	2.405	10	0		DEAEHN
CC(=O)c1c[nH]c(C(=O)N2CCCC[C@H](N3CCCC3)C2)c1	ZINC000107666493	402236842	/nfs/dbraw/zinc/23/68/42/402236842.db2.gz	TYXXKIDFSDJBDB-HNNXBMFYSA-N	0	3	303.406	2.308	10	0		DEAEHN
C[C@@H](NC[C@]1(CCO)CCOC1)c1ccc(F)cc1N(C)C	ZINC000125727598	402247561	/nfs/dbraw/zinc/24/75/61/402247561.db2.gz	UHFIPQMGNITJJX-DYVFJYSZSA-N	0	3	310.413	2.331	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)NCCCc2cccc(F)c2)C1	ZINC000109399725	402271723	/nfs/dbraw/zinc/27/17/23/402271723.db2.gz	GSJMUAMUQGXKBY-OAHLLOKOSA-N	0	3	307.413	2.399	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1cc(C)ccc1F	ZINC000110086060	402281473	/nfs/dbraw/zinc/28/14/73/402281473.db2.gz	CXTKTBXHAWHBFN-CYBMUJFWSA-N	0	3	309.385	2.366	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCN(C)c1ccccc1	ZINC000176180195	402287222	/nfs/dbraw/zinc/28/72/22/402287222.db2.gz	HSTPMUJFIXSPPB-QGZVFWFLSA-N	0	3	318.465	2.249	10	0		DEAEHN
CCC1(C(=O)N2CCCC[C@H](N3CCN(C)CC3)C2)CCC1	ZINC000176191287	402288882	/nfs/dbraw/zinc/28/88/82/402288882.db2.gz	WSBXSQGRXNJDJS-INIZCTEOSA-N	0	3	307.482	2.195	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c1	ZINC000157122659	402292213	/nfs/dbraw/zinc/29/22/13/402292213.db2.gz	GPWUXMORYVIOIU-WBVHZDCISA-N	0	3	315.417	2.201	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)CSCc2cccnc2)[C@@H](C)C1	ZINC000158816715	402312632	/nfs/dbraw/zinc/31/26/32/402312632.db2.gz	HFDMWZRCNBKVIN-ZFWWWQNUSA-N	0	3	307.463	2.160	10	0		DEAEHN
Brc1ccc(-c2nnc(CN[C@H]3CCOC3)[nH]2)cc1	ZINC000176502846	402315255	/nfs/dbraw/zinc/31/52/55/402315255.db2.gz	GTSOZLNLLKSJEU-NSHDSACASA-N	0	3	323.194	2.113	10	0		DEAEHN
CN(CCC1CCOCC1)Cc1cc(-c2cnn(C)c2)no1	ZINC000185022776	402317935	/nfs/dbraw/zinc/31/79/35/402317935.db2.gz	UKHWWSQSPGWBNH-UHFFFAOYSA-N	0	3	304.394	2.324	10	0		DEAEHN
CC(C)c1nnc(CCC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)o1	ZINC000176896314	402347687	/nfs/dbraw/zinc/34/76/87/402347687.db2.gz	BPMUZGRXCZJGEH-STQMWFEESA-N	0	3	308.426	2.067	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1ccc(C)c(C)c1	ZINC000176905194	402348623	/nfs/dbraw/zinc/34/86/23/402348623.db2.gz	OGJWSWKAEORJSG-MRXNPFEDSA-N	0	3	317.433	2.185	10	0		DEAEHN
O=C(NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccc2c(c1[O-])CCCC2	ZINC000185425269	402352128	/nfs/dbraw/zinc/35/21/28/402352128.db2.gz	MCHQKOLFIMWONF-CYBMUJFWSA-N	0	3	314.429	2.485	10	0		DEAEHN
O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc2c(c1[O-])CCCC2	ZINC000185425269	402352132	/nfs/dbraw/zinc/35/21/32/402352132.db2.gz	MCHQKOLFIMWONF-CYBMUJFWSA-N	0	3	314.429	2.485	10	0		DEAEHN
CCCc1noc(CCCC(=O)N(C)C[C@H]2CCCN2CC)n1	ZINC000176968906	402355236	/nfs/dbraw/zinc/35/52/36/402355236.db2.gz	ZKGXITIMGRHQTK-CQSZACIVSA-N	0	3	322.453	2.288	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cccc2c1OCCO2	ZINC000176988635	402357157	/nfs/dbraw/zinc/35/71/57/402357157.db2.gz	OINGDXFXEPECOO-CYBMUJFWSA-N	0	3	304.390	2.014	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CCOc1ccccc1OC	ZINC000177026236	402360672	/nfs/dbraw/zinc/36/06/72/402360672.db2.gz	OTWDSFLSIJTJLB-HNNXBMFYSA-N	0	3	320.433	2.407	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc(F)c(NC(C)=O)c1	ZINC000177041113	402362782	/nfs/dbraw/zinc/36/27/82/402362782.db2.gz	MEAUJTNPAPLJAQ-AWEZNQCLSA-N	0	3	321.396	2.340	10	0		DEAEHN
COCCC(C)(C)CNC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000185792793	402377443	/nfs/dbraw/zinc/37/74/43/402377443.db2.gz	UTFMWWNRIVEWRU-AWEZNQCLSA-N	0	3	301.475	2.325	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@@H](C)n2cnc3ccccc32)C1	ZINC000177200336	402380695	/nfs/dbraw/zinc/38/06/95/402380695.db2.gz	BVIGFALPPIBTKJ-FMKPAKJESA-N	0	3	314.433	2.442	10	0		DEAEHN
COc1cccc([C@H](C)N2C[C@@H](C)[C@@H](N3CCOCC3)C2)c1	ZINC000177214184	402382506	/nfs/dbraw/zinc/38/25/06/402382506.db2.gz	YDPHHQPQKJVMNE-VKJFTORMSA-N	0	3	304.434	2.409	10	0		DEAEHN
COc1cc(C)ccc1CNC(=O)N1CCCN(C2CC2)CC1	ZINC000176768822	402335654	/nfs/dbraw/zinc/33/56/54/402335654.db2.gz	MAAGLDKMXGGSNJ-UHFFFAOYSA-N	0	3	317.433	2.383	10	0		DEAEHN
COc1cc(Br)ccc1CN[C@H](C)CN(C)C	ZINC000228129575	402336188	/nfs/dbraw/zinc/33/61/88/402336188.db2.gz	PUFZSUMEXKJSGW-SNVBAGLBSA-N	0	3	301.228	2.497	10	0		DEAEHN
C[C@H]1CC[C@@H](C(N)=O)CN1Cc1ccc2c(c1)COC(C)(C)O2	ZINC000186625874	402449265	/nfs/dbraw/zinc/44/92/65/402449265.db2.gz	KWLRQSPOAYVIJY-GXTWGEPZSA-N	0	3	318.417	2.418	10	0		DEAEHN
COc1cccc(F)c1[C@H](C)NC(=O)C[C@H]1CSCCN1	ZINC000237288327	402402379	/nfs/dbraw/zinc/40/23/79/402402379.db2.gz	FWEMQZKWKBMAOT-QWRGUYRKSA-N	0	3	312.410	2.107	10	0		DEAEHN
CC(C)C[C@H]1OCCC[C@H]1NC(=O)N1CCCN(C2CC2)CC1	ZINC000186216212	402411519	/nfs/dbraw/zinc/41/15/19/402411519.db2.gz	YJSGTXLBTPDQAU-IAGOWNOFSA-N	0	3	323.481	2.460	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H](C)Oc1ccccc1OC)N(C)C	ZINC000162332704	402416479	/nfs/dbraw/zinc/41/64/79/402416479.db2.gz	KCLCTFDTRKUUKZ-ZIAGYGMSSA-N	0	3	308.422	2.309	10	0		DEAEHN
Cc1nc(-c2cccc(NC(=O)C[C@H]3CSCCN3)c2)no1	ZINC000237820430	402422103	/nfs/dbraw/zinc/42/21/03/402422103.db2.gz	KKFOPXYDSRCTRM-ZDUSSCGKSA-N	0	3	318.402	2.079	10	0		DEAEHN
N[C@@H](CC(=O)NC[C@@H]1COc2ccccc2O1)c1ccccc1	ZINC000237889434	402424521	/nfs/dbraw/zinc/42/45/21/402424521.db2.gz	MBEQPOALTHHUBO-CABCVRRESA-N	0	3	312.369	2.033	10	0		DEAEHN
N[C@@H](CC(=O)NC1CCN(c2ccccn2)CC1)c1ccccc1	ZINC000237881632	402424619	/nfs/dbraw/zinc/42/46/19/402424619.db2.gz	KKZYWVJSJVXAJE-KRWDZBQOSA-N	0	3	324.428	2.257	10	0		DEAEHN
CCCn1nc(C)c(CN2CCC(C(=O)N(C)C)CC2)c1C	ZINC000162583319	402425049	/nfs/dbraw/zinc/42/50/49/402425049.db2.gz	WFEIRWHBKSRPGA-UHFFFAOYSA-N	0	3	306.454	2.210	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)NCc1ccccc1	ZINC000177709771	402428904	/nfs/dbraw/zinc/42/89/04/402428904.db2.gz	BOAIQYAPXRYMEO-RDJZCZTQSA-N	0	3	303.450	2.107	10	0		DEAEHN
Cc1ccc(C)c(OC[C@@H](O)CN2CCN3CCCC[C@@H]3C2)c1	ZINC000177775744	402435227	/nfs/dbraw/zinc/43/52/27/402435227.db2.gz	KYNUXFBYWDGHBB-MSOLQXFVSA-N	0	3	318.461	2.213	10	0		DEAEHN
CC1(C)C[C@@H](NCc2cccnc2-n2cncn2)C(C)(C)O1	ZINC000178056578	402456194	/nfs/dbraw/zinc/45/61/94/402456194.db2.gz	AVFAWFVFZMCGTB-CYBMUJFWSA-N	0	3	301.394	2.098	10	0		DEAEHN
COC[C@H](NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1)c1ccc(C)o1	ZINC000245422677	402459098	/nfs/dbraw/zinc/45/90/98/402459098.db2.gz	ADNWDVYYPZBUKN-CFVMTHIKSA-N	0	3	323.437	2.400	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CSC[C@H]1CCCCO1	ZINC000245425058	402459110	/nfs/dbraw/zinc/45/91/10/402459110.db2.gz	DKPBRKHZHTXXSO-LSDHHAIUSA-N	0	3	314.495	2.231	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@H](C)CCc1cccn1C	ZINC000245430262	402459935	/nfs/dbraw/zinc/45/99/35/402459935.db2.gz	ZPNJXJWMGQMHFH-WBVHZDCISA-N	0	3	320.481	2.472	10	0		DEAEHN
Cc1csc([C@H](C)CNC(=O)N2CCCN(C3CC3)CC2)n1	ZINC000186798172	402464721	/nfs/dbraw/zinc/46/47/21/402464721.db2.gz	LETVCAXQSVGVFS-GFCCVEGCSA-N	0	3	322.478	2.435	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C(=O)N(C)C)c1ccccc1	ZINC000245479497	402464940	/nfs/dbraw/zinc/46/49/40/402464940.db2.gz	WMUZFIHZVCKYIX-DLBZAZTESA-N	0	3	303.450	2.232	10	0		DEAEHN
CC[C@H](CSC)N(C)CC(=O)N1CCO[C@H]2CCCC[C@H]21	ZINC000245601453	402473935	/nfs/dbraw/zinc/47/39/35/402473935.db2.gz	PEBZNTODGYMDRU-KFWWJZLASA-N	0	3	314.495	2.230	10	0		DEAEHN
CN(c1cccnn1)C1CCN(C[C@H]2CCC(C)(C)O2)CC1	ZINC000186964687	402474689	/nfs/dbraw/zinc/47/46/89/402474689.db2.gz	MCGFSGYZJBYMQZ-OAHLLOKOSA-N	0	3	304.438	2.335	10	0		DEAEHN
CC(C)N1CCCC[C@@H]1C(=O)N[C@H](C)c1nnc2n1CCCC2	ZINC000245673401	402478674	/nfs/dbraw/zinc/47/86/74/402478674.db2.gz	INRYOFNDTSRFAZ-ZIAGYGMSSA-N	0	3	319.453	2.055	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CC(=O)NC1CCC(C)CC1	ZINC000178286597	402480038	/nfs/dbraw/zinc/48/00/38/402480038.db2.gz	PDTLNCHHZVKCCE-BDVYOWHSSA-N	0	3	318.465	2.351	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000245746625	402484898	/nfs/dbraw/zinc/48/48/98/402484898.db2.gz	CSSDRXKNVHYXKH-ZIAGYGMSSA-N	0	3	324.494	2.446	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2cccc3c2OC(C)(C)C3)C[C@@H]1C	ZINC000245754972	402485539	/nfs/dbraw/zinc/48/55/39/402485539.db2.gz	OMNOOIAXVPTYOB-GJZGRUSLSA-N	0	3	318.461	2.287	10	0		DEAEHN
C[C@@H](N[C@@H]1CCCN(c2cnn(C)c2)C1)c1cncc(F)c1	ZINC000166603548	402485954	/nfs/dbraw/zinc/48/59/54/402485954.db2.gz	AWDGWYHIDIYZFH-IUODEOHRSA-N	0	3	303.385	2.274	10	0		DEAEHN
CCOc1ncccc1NC(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000246158613	402513530	/nfs/dbraw/zinc/51/35/30/402513530.db2.gz	CZVVZFMYPDXAKF-TZMCWYRMSA-N	0	3	306.410	2.331	10	0		DEAEHN
COC(=O)c1ccccc1CCN1CCN2CCCC[C@@H]2C1	ZINC000187264238	402490443	/nfs/dbraw/zinc/49/04/43/402490443.db2.gz	JZMZLPFSWNIKFB-MRXNPFEDSA-N	0	3	302.418	2.186	10	0		DEAEHN
CC1(C)OCc2cc(CN[C@H]3CCc4ncnn4C3)ccc2O1	ZINC000187295761	402492282	/nfs/dbraw/zinc/49/22/82/402492282.db2.gz	TYBPDYHFPOKDCI-AWEZNQCLSA-N	0	3	314.389	2.028	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)C[C@H]1CCCO1	ZINC000245864087	402492772	/nfs/dbraw/zinc/49/27/72/402492772.db2.gz	PQXRUPKQPZULHC-NVXWUHKLSA-N	0	3	319.449	2.327	10	0		DEAEHN
CCC[C@H]1CN(C[C@@](C)(O)c2ccccc2)CCN1CCOC	ZINC000245876995	402493368	/nfs/dbraw/zinc/49/33/68/402493368.db2.gz	HQVCQAOZQCBYTB-RBUKOAKNSA-N	0	3	320.477	2.327	10	0		DEAEHN
Cc1cc(-c2noc(CN3CCN4CCC[C@@H]4C3)n2)ccc1F	ZINC000178446626	402499889	/nfs/dbraw/zinc/49/98/89/402499889.db2.gz	FPJSIPPBFMTMQT-CQSZACIVSA-N	0	3	316.380	2.464	10	0		DEAEHN
CC(C)OC[C@@H](O)CN1CCC[C@H]1c1ccc2c(c1)OCO2	ZINC000245997075	402502521	/nfs/dbraw/zinc/50/25/21/402502521.db2.gz	CNXOUWBGIBHGJF-GJZGRUSLSA-N	0	3	307.390	2.338	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000246088173	402508439	/nfs/dbraw/zinc/50/84/39/402508439.db2.gz	GJXUXZICTHXNEU-WFASDCNBSA-N	0	3	314.426	2.177	10	0		DEAEHN
Cc1cc2ncn(C[C@@H](O)CN3CCS[C@@H](C)C3)c2cc1C	ZINC000246086351	402508806	/nfs/dbraw/zinc/50/88/06/402508806.db2.gz	FHLHDAMWQIXCJK-GJZGRUSLSA-N	0	3	319.474	2.451	10	0		DEAEHN
CCOC[C@@H](NC(=O)c1ccccc1OCCN(C)C)C(C)C	ZINC000189545790	402544210	/nfs/dbraw/zinc/54/42/10/402544210.db2.gz	UUQRVTXYGIVTRU-MRXNPFEDSA-N	0	3	322.449	2.418	10	0		DEAEHN
O=C(CN1CCC[C@@H]2CCC[C@@H]21)N1CCO[C@@H]2CCCC[C@H]21	ZINC000247700729	402574820	/nfs/dbraw/zinc/57/48/20/402574820.db2.gz	XUXCOLHXGUTGAN-MWDXBVQZSA-N	0	3	306.450	2.421	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2ccn(Cc3ccccc3)n2)C1	ZINC000171079415	402555295	/nfs/dbraw/zinc/55/52/95/402555295.db2.gz	YLTCBCSBXITHCM-HNNXBMFYSA-N	0	3	313.405	2.099	10	0		DEAEHN
CCN1CCN(CCC(=O)Nc2cccc([C@H](C)OC)c2)CC1	ZINC000171130337	402560411	/nfs/dbraw/zinc/56/04/11/402560411.db2.gz	XTPPZOUIPCUVHE-HNNXBMFYSA-N	0	3	319.449	2.360	10	0		DEAEHN
O[C@@]1(CNCc2ccc(-c3ccncc3)cc2F)CCOC1	ZINC000179019961	402565151	/nfs/dbraw/zinc/56/51/51/402565151.db2.gz	CSVRMVAFQHTRHQ-QGZVFWFLSA-N	0	3	302.349	2.129	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@@H]2Oc3ccccc3[C@@H]2C)C1	ZINC000247366506	402565285	/nfs/dbraw/zinc/56/52/85/402565285.db2.gz	OWIRHZDBLYOESL-RPCCPQHDSA-N	0	3	302.418	2.396	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)CSCc1ccncc1	ZINC000247466922	402568157	/nfs/dbraw/zinc/56/81/57/402568157.db2.gz	RHLYGUPPSKGZHG-HIFRSBDPSA-N	0	3	305.447	2.010	10	0		DEAEHN
COCCN(C)CCNC(=O)N(C)Cc1ccc(Cl)cc1	ZINC000171213743	402568255	/nfs/dbraw/zinc/56/82/55/402568255.db2.gz	VLMTWRUEDFEHNO-UHFFFAOYSA-N	0	3	313.829	2.060	10	0		DEAEHN
COc1cc(C)cc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1O	ZINC000247503497	402569725	/nfs/dbraw/zinc/56/97/25/402569725.db2.gz	VGHOAKQKZHPINU-CHWSQXEVSA-N	0	3	304.390	2.018	10	0		DEAEHN
Cc1cc(=O)oc2cc(OCCN(C)CC3(CO)CC3)ccc12	ZINC000190035187	402572106	/nfs/dbraw/zinc/57/21/06/402572106.db2.gz	IWOMZOAPDHGCAE-UHFFFAOYSA-N	0	3	317.385	2.185	10	0		DEAEHN
COCCCCNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000179108898	402573121	/nfs/dbraw/zinc/57/31/21/402573121.db2.gz	FBVNBHSJKFPKBW-HOTGVXAUSA-N	0	3	305.422	2.158	10	0		DEAEHN
O=C(CCN1CCN2CCCC[C@H]2C1)N1CCc2ccccc21	ZINC000246180347	402516426	/nfs/dbraw/zinc/51/64/26/402516426.db2.gz	KOIRPDBTHZWHDF-KRWDZBQOSA-N	0	3	313.445	2.136	10	0		DEAEHN
COC(=O)Cc1cccc(C(=O)NCCN2CCCC[C@@H]2C)c1	ZINC000188264062	402518300	/nfs/dbraw/zinc/51/83/00/402518300.db2.gz	YXVALMUZODQRBJ-AWEZNQCLSA-N	0	3	318.417	2.006	10	0		DEAEHN
CCN(C(=O)[C@H](C)N1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000178631400	402519684	/nfs/dbraw/zinc/51/96/84/402519684.db2.gz	JJSPPBIOLGVUSG-DOTOQJQBSA-N	0	3	301.434	2.208	10	0		DEAEHN
C[C@@H]1C[C@H]1NC(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	ZINC000170823114	402529895	/nfs/dbraw/zinc/52/98/95/402529895.db2.gz	XFANSWLDYDGKMG-CZUORRHYSA-N	0	3	315.417	2.136	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCS[C@H](C)[C@@H]1C	ZINC000246448312	402531202	/nfs/dbraw/zinc/53/12/02/402531202.db2.gz	VFZVPXQOTQNPGA-BFHYXJOUSA-N	0	3	301.500	2.498	10	0		DEAEHN
C[C@@H](O)C1CCN(CCOCC(F)(F)C(F)(F)F)CC1	ZINC000189265883	402533430	/nfs/dbraw/zinc/53/34/30/402533430.db2.gz	YIEWUBFTGAETHX-SECBINFHSA-N	0	3	305.287	2.293	10	0		DEAEHN
Cc1noc(C)c1[C@H](C)CNC(=O)N1CCCN(C2CC2)CC1	ZINC000179120334	402574067	/nfs/dbraw/zinc/57/40/67/402574067.db2.gz	JTPGJAOVNXZOBT-GFCCVEGCSA-N	0	3	320.437	2.275	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000170859449	402533602	/nfs/dbraw/zinc/53/36/02/402533602.db2.gz	SXLPRBPDWRPVPN-GOSISDBHSA-N	0	3	324.424	2.085	10	0		DEAEHN
Cc1nn(-c2ccccc2)c(C)c1C(=O)N1CC[C@@H](N(C)C)C1	ZINC000170859114	402533633	/nfs/dbraw/zinc/53/36/33/402533633.db2.gz	KAELMGYPICNWHQ-MRXNPFEDSA-N	0	3	312.417	2.265	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COc2ccc(C)cc2C)CC[C@@H]1C	ZINC000189323427	402534179	/nfs/dbraw/zinc/53/41/79/402534179.db2.gz	DVPLOTXCHIHEEF-QILLFSRXSA-N	0	3	307.434	2.400	10	0		DEAEHN
C/C=C/c1ccc(OCC(=O)N2CC[C@H](N(C)C)C2)c(OC)c1	ZINC000170861249	402534212	/nfs/dbraw/zinc/53/42/12/402534212.db2.gz	WPISYVFWEHUHFL-NFAHFFEMSA-N	0	3	318.417	2.270	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COc2cc(C)ccc2C)CC[C@@H]1C	ZINC000189368373	402535382	/nfs/dbraw/zinc/53/53/82/402535382.db2.gz	WSRRTAPQAGLSRK-XYJFISCASA-N	0	3	307.434	2.400	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)CCc2ccc(OC(F)F)cc2)C1	ZINC000170867657	402535792	/nfs/dbraw/zinc/53/57/92/402535792.db2.gz	ZFNWFCXMACMGSQ-ZDUSSCGKSA-N	0	3	312.360	2.383	10	0		DEAEHN
C[C@@H]1CN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CCCO1	ZINC000248127013	402583318	/nfs/dbraw/zinc/58/33/18/402583318.db2.gz	VREATRBVZSKXNX-PVAVHDDUSA-N	0	3	317.433	2.252	10	0		DEAEHN
CCCCN(CCO)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248146564	402583355	/nfs/dbraw/zinc/58/33/55/402583355.db2.gz	ZSMPEKLQGUKXPK-SJORKVTESA-N	0	3	319.449	2.236	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)CSC[C@H]1CCCCO1	ZINC000171396912	402584417	/nfs/dbraw/zinc/58/44/17/402584417.db2.gz	FQFYRJUKYKIXLW-LSDHHAIUSA-N	0	3	316.511	2.381	10	0		DEAEHN
CC[C@H](CCO)CNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179487869	402591990	/nfs/dbraw/zinc/59/19/90/402591990.db2.gz	UBJHDMRLAXOOBL-HYVNUMGLSA-N	0	3	319.449	2.140	10	0		DEAEHN
CCOCCN1CCN(C[C@@H](O)CCc2ccccc2)C[C@H]1C	ZINC000248564108	402596112	/nfs/dbraw/zinc/59/61/12/402596112.db2.gz	KFYKMZBYYAGOED-MJGOQNOKSA-N	0	3	320.477	2.023	10	0		DEAEHN
C[C@H](NC(=O)N1CCN2CCC[C@@H]2C1)[C@@H]1COc2ccccc21	ZINC000179663506	402597780	/nfs/dbraw/zinc/59/77/80/402597780.db2.gz	FKXDQOUAINWTTM-LZWOXQAQSA-N	0	3	315.417	2.041	10	0		DEAEHN
C[C@H](Nc1ccc(OC2CCN(C)CC2)nc1)[C@H]1CCOC1	ZINC000179743342	402599876	/nfs/dbraw/zinc/59/98/76/402599876.db2.gz	PMTGHRHQSFDFQN-KBPBESRZSA-N	0	3	305.422	2.392	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1CCCN1C[C@H](O)COCC(C)C	ZINC000171625363	402602624	/nfs/dbraw/zinc/60/26/24/402602624.db2.gz	QHBSCIUALVPUOR-JKSUJKDBSA-N	0	3	309.454	2.207	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccc(F)cc1F)N1CCN2CCC[C@@H]2C1	ZINC000171639015	402604681	/nfs/dbraw/zinc/60/46/81/402604681.db2.gz	QZVSKRYDEWEFGC-WCQYABFASA-N	0	3	309.360	2.072	10	0		DEAEHN
C[C@@H](c1ccc(F)cc1)N(C)C(=O)CN1CCN2CCC[C@@H]2C1	ZINC000171641219	402605279	/nfs/dbraw/zinc/60/52/79/402605279.db2.gz	IFBLTKNAWBICKX-WMLDXEAASA-N	0	3	319.424	2.125	10	0		DEAEHN
O=C(Cc1coc(-c2cccs2)n1)N1CCN2CCC[C@H]2C1	ZINC000171712653	402613150	/nfs/dbraw/zinc/61/31/50/402613150.db2.gz	JORXHMLJQQYACU-ZDUSSCGKSA-N	0	3	317.414	2.252	10	0		DEAEHN
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)COC(C)(C)C)C1	ZINC000190658495	402616568	/nfs/dbraw/zinc/61/65/68/402616568.db2.gz	REMBNTJDGOOAHM-MRXNPFEDSA-N	0	3	319.449	2.177	10	0		DEAEHN
CO[C@@H]1CC[C@H](NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000249028126	402618114	/nfs/dbraw/zinc/61/81/14/402618114.db2.gz	LGXHKOCNRJJQKB-YESZJQIVSA-N	0	3	319.449	2.026	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1C	ZINC000249112666	402620844	/nfs/dbraw/zinc/62/08/44/402620844.db2.gz	AVMKDGWCMDJIGB-HOCLYGCPSA-N	0	3	317.433	2.183	10	0		DEAEHN
COc1cccc(Cl)c1CNC(=O)N1CC[C@H](N(C)C)C1	ZINC000190746021	402621096	/nfs/dbraw/zinc/62/10/96/402621096.db2.gz	UITZQYYUELFQOK-NSHDSACASA-N	0	3	311.813	2.194	10	0		DEAEHN
COC(=O)[C@H]1C[C@H](c2ccccc2)CN(Cc2c[nH]nc2C)C1	ZINC000180721124	402624644	/nfs/dbraw/zinc/62/46/44/402624644.db2.gz	BHBNACHHOFJCDI-HOTGVXAUSA-N	0	3	313.401	2.497	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H](C)c1cccs1	ZINC000171898134	402632758	/nfs/dbraw/zinc/63/27/58/402632758.db2.gz	KSLZLSGVLSSPQS-QWHCGFSZSA-N	0	3	311.451	2.219	10	0		DEAEHN
O[C@H](COC[C@H]1CCCO1)CN1Cc2ccccc2C2(CC2)C1	ZINC000249429503	402629193	/nfs/dbraw/zinc/62/91/93/402629193.db2.gz	JNKSPNSIJUXNAE-DLBZAZTESA-N	0	3	317.429	2.090	10	0		DEAEHN
Cc1ccccc1CNC(=O)CN(C)[C@]1(CO)CC[C@@H](C)C1	ZINC000249534756	402633476	/nfs/dbraw/zinc/63/34/76/402633476.db2.gz	CCTGEXIOFKZYBH-RDTXWAMCSA-N	0	3	304.434	2.094	10	0		DEAEHN
C[C@@H](c1cccc(F)c1)N1CCC[C@@H](C(=O)N2CCOCC2)C1	ZINC000249684095	402638234	/nfs/dbraw/zinc/63/82/34/402638234.db2.gz	CTEFURTWYWHNGK-GOEBONIOSA-N	0	3	320.408	2.458	10	0		DEAEHN
CCCOc1ccc(NC(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000181289040	402639919	/nfs/dbraw/zinc/63/99/19/402639919.db2.gz	CUJLEXKJOZEOLP-INIZCTEOSA-N	0	3	321.421	2.270	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](CN(C)C)c2ccccc2)C1	ZINC000249774241	402641707	/nfs/dbraw/zinc/64/17/07/402641707.db2.gz	VOUBRMHTYLJLEH-DLBZAZTESA-N	0	3	318.465	2.073	10	0		DEAEHN
Cc1c([C@@H](C)NC[C@H](C)N2CCOCC2)cnn1C(C)(C)C	ZINC000191145255	402645425	/nfs/dbraw/zinc/64/54/25/402645425.db2.gz	XFTBMIROGLKBQX-UONOGXRCSA-N	0	3	308.470	2.318	10	0		DEAEHN
Cc1c([C@@H](C)NC[C@@H](C)N2CCOCC2)cnn1C(C)(C)C	ZINC000191145220	402645484	/nfs/dbraw/zinc/64/54/84/402645484.db2.gz	XFTBMIROGLKBQX-ZIAGYGMSSA-N	0	3	308.470	2.318	10	0		DEAEHN
O=C(CN1C[C@@H]2CCCC[C@@H]2C1)N1CCO[C@@H]2CCCC[C@H]21	ZINC000252643229	402659755	/nfs/dbraw/zinc/65/97/55/402659755.db2.gz	JNVRRYVTVVYKAP-YYIAUSFCSA-N	0	3	306.450	2.278	10	0		DEAEHN
COCc1csc(NC(=O)N(CCN(C)C)C(C)C)n1	ZINC000181892042	402659903	/nfs/dbraw/zinc/65/99/03/402659903.db2.gz	WIHMPZLHURTGTE-UHFFFAOYSA-N	0	3	300.428	2.093	10	0		DEAEHN
CC(C)(C)OC(=O)CCCN1CCC[C@H](Cn2cncn2)C1	ZINC000181885434	402660132	/nfs/dbraw/zinc/66/01/32/402660132.db2.gz	MMMUDSSQGUDMRV-AWEZNQCLSA-N	0	3	308.426	2.112	10	0		DEAEHN
O=C1O[C@H](CN2CC[C@H](CNc3ccccn3)C2)CC12CCC2	ZINC000192034369	402706926	/nfs/dbraw/zinc/70/69/26/402706926.db2.gz	XMHGRHPHDHQXIV-CABCVRRESA-N	0	3	315.417	2.301	10	0		DEAEHN
C[C@H]1CCCC[C@H]1N(C)C(=O)CN1CCCN(C2CC2)CC1	ZINC000172543408	402662227	/nfs/dbraw/zinc/66/22/27/402662227.db2.gz	UHRRTYZCCFNMHM-DOTOQJQBSA-N	0	3	307.482	2.194	10	0		DEAEHN
CC[C@H](NC(=O)Nc1ccn(CCN(C)C)n1)c1nccs1	ZINC000173922670	402719546	/nfs/dbraw/zinc/71/95/46/402719546.db2.gz	HGPMRHPDCPSTIS-NSHDSACASA-N	0	3	322.438	2.174	10	0		DEAEHN
C[C@H](CNC(=O)[C@H]1CCCO[C@H]1C)N(C)Cc1ccccc1	ZINC000191564718	402678728	/nfs/dbraw/zinc/67/87/28/402678728.db2.gz	YGRZZUYBNXEYAR-VYDXJSESSA-N	0	3	304.434	2.438	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H](C)CN(C)Cc1ccccc1)N(C)C	ZINC000182533642	402697738	/nfs/dbraw/zinc/69/77/38/402697738.db2.gz	STMGEKXDADZKKP-RDJZCZTQSA-N	0	3	305.466	2.353	10	0		DEAEHN
CC(C)[C@@H]1CN(C)CCN1Cc1ccc2c(c1)sc(=O)n2C	ZINC000192637736	402741779	/nfs/dbraw/zinc/74/17/79/402741779.db2.gz	GMRSJJCHHNUNQA-HNNXBMFYSA-N	0	3	319.474	2.372	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2C[C@@H]2c2cc(F)ccc2F)n1	ZINC000263276737	402753261	/nfs/dbraw/zinc/75/32/61/402753261.db2.gz	SWMUZWFIFOSBFZ-SCDSUCTJSA-N	0	3	320.343	2.195	10	0		DEAEHN
CC[C@@H](Oc1cccc(C)c1)c1nc([C@H]2CNCCN2C)no1	ZINC000263298571	402755847	/nfs/dbraw/zinc/75/58/47/402755847.db2.gz	WTWGZLQLDDGYDN-HUUCEWRRSA-N	0	3	316.405	2.484	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)CSCc1cccnc1	ZINC000174978199	402768519	/nfs/dbraw/zinc/76/85/19/402768519.db2.gz	KGTBFJVLBYUHRG-JKSUJKDBSA-N	0	3	319.474	2.400	10	0		DEAEHN
CC(C)N(C)C(=O)NCc1ccccc1CN1CCC[C@@H]1CO	ZINC000182881249	402724035	/nfs/dbraw/zinc/72/40/35/402724035.db2.gz	RCDPHEYWMRHAGH-QGZVFWFLSA-N	0	3	319.449	2.193	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2cccc3c2OCCO3)CCN1C	ZINC000175415666	402804615	/nfs/dbraw/zinc/80/46/15/402804615.db2.gz	APRFKTKOJLHWPL-OLZOCXBDSA-N	0	3	319.405	2.404	10	0		DEAEHN
CCN(CCO)CCNC(=O)[C@@H]1C[C@@H]1c1ccc(C(C)C)cc1	ZINC000183955770	402808215	/nfs/dbraw/zinc/80/82/15/402808215.db2.gz	QZFBBDPSFCLRLT-QZTJIDSGSA-N	0	3	318.461	2.344	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000175477775	402810306	/nfs/dbraw/zinc/81/03/06/402810306.db2.gz	KTJSRKMMRZWZNK-CABCVRRESA-N	0	3	321.469	2.163	10	0		DEAEHN
Cc1nn(-c2ccccc2)c(C)c1C(=O)NC[C@@H]1CCCN1C	ZINC000194744323	402814425	/nfs/dbraw/zinc/81/44/25/402814425.db2.gz	GZUPHTRRGYRDBJ-INIZCTEOSA-N	0	3	312.417	2.313	10	0		DEAEHN
C[C@H](N[C@H]1CCCN(c2cnn(C)c2)C1)c1cccc(O)c1	ZINC000194901103	402821703	/nfs/dbraw/zinc/82/17/03/402821703.db2.gz	OWFWVWTXUWZTAG-ZFWWWQNUSA-N	0	3	300.406	2.445	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc(Oc2cnccn2)cc1	ZINC000175848588	402837978	/nfs/dbraw/zinc/83/79/78/402837978.db2.gz	QCCHTWULMDGPOG-QGZVFWFLSA-N	0	3	317.389	2.146	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)c1cc(C(=O)OC)co1	ZINC000183642673	402784828	/nfs/dbraw/zinc/78/48/28/402784828.db2.gz	GZGSHEAKFVXALH-CYBMUJFWSA-N	0	3	308.378	2.061	10	0		DEAEHN
CN1CC[C@@H]2OCCN(c3ncnc4c5ccccc5oc43)[C@@H]2C1	ZINC000284426366	403267822	/nfs/dbraw/zinc/26/78/22/403267822.db2.gz	AEXRXYFGGRFKCH-HIFRSBDPSA-N	0	3	324.384	2.285	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CC[C@@]3(CCN(C)C3)C2)sc1C	ZINC000292135788	403302412	/nfs/dbraw/zinc/30/24/12/403302412.db2.gz	YGTPIUSLSTVCKF-CQSZACIVSA-N	0	3	314.476	2.081	10	0		DEAEHN
CC(=O)c1ccc(CC(=O)NCCN2CCCC[C@@H]2C)cc1	ZINC000298705157	403444056	/nfs/dbraw/zinc/44/40/56/403444056.db2.gz	CHDVERNXKNSJRH-AWEZNQCLSA-N	0	3	302.418	2.422	10	0		DEAEHN
COc1cc(CN2CC[C@@H](O)C23CCCC3)cc2c1OCCO2	ZINC000294063619	403637582	/nfs/dbraw/zinc/63/75/82/403637582.db2.gz	XZISAGBTFUUKMP-MRXNPFEDSA-N	0	3	319.401	2.346	10	0		DEAEHN
CC1CCN(C[C@H](O)CNc2c(F)c(F)nc(F)c2F)CC1	ZINC000301614120	403654753	/nfs/dbraw/zinc/65/47/53/403654753.db2.gz	UKHREJGMMNSDKS-SECBINFHSA-N	0	3	321.318	2.143	10	0		DEAEHN
Cc1nn(C)c2sc([C@@H](C)N[C@H]3CCC(=O)N(C)C3)cc12	ZINC000287876355	403684383	/nfs/dbraw/zinc/68/43/83/403684383.db2.gz	YENXQPBUMPRYDX-MNOVXSKESA-N	0	3	306.435	2.215	10	0		DEAEHN
Cc1cncc(-c2nc(CN3CCN4CCCC[C@H]4C3)no2)c1	ZINC000333635893	403799259	/nfs/dbraw/zinc/79/92/59/403799259.db2.gz	BCEUDWBCEJHPQK-HNNXBMFYSA-N	0	3	313.405	2.110	10	0		DEAEHN
NCc1nccc(C(F)(F)F)c1I	ZINC000307454065	403953846	/nfs/dbraw/zinc/95/38/46/403953846.db2.gz	VUARFNNXDUKMAZ-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
CO[C@@H]1COC[C@H]1n1cc(CN[C@H]2CCCC[C@H]2C(C)C)nn1	ZINC000329509973	404362038	/nfs/dbraw/zinc/36/20/38/404362038.db2.gz	JVJUSDKWYLQUSO-MWDXBVQZSA-N	0	3	322.453	2.169	10	0		DEAEHN
CC(C)(C)n1cnc(C(=O)N2CCCC[C@H](N3CCCC3)C2)n1	ZINC000329746277	404438956	/nfs/dbraw/zinc/43/89/56/404438956.db2.gz	RSKYRAPLSKAHLV-AWEZNQCLSA-N	0	3	319.453	2.124	10	0		DEAEHN
Cc1nccc(N2CCN(C[C@@H]3CCOc4ccccc43)CC2)n1	ZINC000373411509	404542071	/nfs/dbraw/zinc/54/20/71/404542071.db2.gz	FROOOXPVLLHWRF-INIZCTEOSA-N	0	3	324.428	2.473	10	0		DEAEHN
Brc1ccc(CN[C@H]2CCO[C@@]3(CCOC3)C2)o1	ZINC000365154431	404563925	/nfs/dbraw/zinc/56/39/25/404563925.db2.gz	GLXUEYHRFAYHPD-GWCFXTLKSA-N	0	3	316.195	2.470	10	0		DEAEHN
CC(=O)N1CC[C@H](NCC[C@H](C)[S@@](C)=O)c2ccccc2C1	ZINC000352847751	404661653	/nfs/dbraw/zinc/66/16/53/404661653.db2.gz	GGTUOBVTPBOJKF-YOKWENHESA-N	0	3	322.474	2.227	10	0		DEAEHN
CCc1noc([C@@]2(O)CCN(Cc3ccc4occc4c3)C2)n1	ZINC000377836098	404847317	/nfs/dbraw/zinc/84/73/17/404847317.db2.gz	YVOISFWCLDEXRY-QGZVFWFLSA-N	0	3	313.357	2.472	10	0		DEAEHN
CC(C)(O)C1CN(C[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000435901004	405024601	/nfs/dbraw/zinc/02/46/01/405024601.db2.gz	DYRWWZRBRYAJQL-CYBMUJFWSA-N	0	3	317.351	2.312	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)c2ccc(F)c(Br)c2)C1	ZINC000389952820	405043173	/nfs/dbraw/zinc/04/31/73/405043173.db2.gz	DRWFSLYGKMFLNM-SNVBAGLBSA-N	0	3	315.186	2.412	10	0		DEAEHN
Cc1cc(=O)[nH]c(C(=O)N2CCN(C3CCCCC3)CC2)c1	ZINC000408025119	405092399	/nfs/dbraw/zinc/09/23/99/405092399.db2.gz	OCWVHOXINIPCEX-UHFFFAOYSA-N	0	3	303.406	2.186	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(NC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000408135261	405120271	/nfs/dbraw/zinc/12/02/71/405120271.db2.gz	XCWZVDZMWURKFN-CYBMUJFWSA-N	0	3	320.368	2.096	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@H](C)NC1CCS(=O)(=O)CC1	ZINC000408241173	405149907	/nfs/dbraw/zinc/14/99/07/405149907.db2.gz	HZBGXWOVZSSKPF-NSHDSACASA-N	0	3	313.467	2.174	10	0		DEAEHN
CCOc1cccc(CN(CCO)C[C@@H](O)CC(F)(F)F)c1	ZINC000452050415	405142108	/nfs/dbraw/zinc/14/21/08/405142108.db2.gz	VFYLERUEMNITQX-ZDUSSCGKSA-N	0	3	321.339	2.193	10	0		DEAEHN
CN(C[C@H]1CCCN1C)C(=O)c1ccc2c(c1O)OC(C)(C)C2	ZINC000408470830	405214856	/nfs/dbraw/zinc/21/48/56/405214856.db2.gz	RFWUFJLTVVRTBH-CYBMUJFWSA-N	0	3	318.417	2.272	10	0		DEAEHN
CC(=O)CCc1ccc(OC[C@H](O)CN2CC[C@@H]2C2CC2)cc1	ZINC000453043662	405278829	/nfs/dbraw/zinc/27/88/29/405278829.db2.gz	UNFQCBPTZZMYDE-IEBWSBKVSA-N	0	3	317.429	2.432	10	0		DEAEHN
CC(C)CC1(C(=O)N2CCN(CCN(C)C)CC2)CCCC1	ZINC000445770259	405356706	/nfs/dbraw/zinc/35/67/06/405356706.db2.gz	WACMNQPGZSRXSH-UHFFFAOYSA-N	0	3	309.498	2.299	10	0		DEAEHN
Cc1csc([C@H](C)NC(=O)Nc2ccnn2CCN(C)C)n1	ZINC000455667820	405442564	/nfs/dbraw/zinc/44/25/64/405442564.db2.gz	KKOLMJFDWSVCFA-NSHDSACASA-N	0	3	322.438	2.092	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(C/C=C/c2ccc(F)cc2)CC12COC2	ZINC000449366714	405527389	/nfs/dbraw/zinc/52/73/89/405527389.db2.gz	SEEXJJZYJOKNCG-CWDCEQMOSA-N	0	3	319.376	2.350	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)N(C)[C@H](C)C1CCN(C)CC1	ZINC000458815343	405605091	/nfs/dbraw/zinc/60/50/91/405605091.db2.gz	HZTSISOONMAYFF-GFCCVEGCSA-N	0	3	322.453	2.417	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)NCCN1CCCC(C)(C)C1	ZINC000458813505	405605903	/nfs/dbraw/zinc/60/59/03/405605903.db2.gz	FNUVAYAAUFQWKI-UHFFFAOYSA-N	0	3	322.453	2.467	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)NC(C)(C)CN2CCCC2)cc1	ZINC000457053164	405672391	/nfs/dbraw/zinc/67/23/91/405672391.db2.gz	OTEDMXIVLQHCOW-UHFFFAOYSA-N	0	3	317.433	2.274	10	0		DEAEHN
c1ccc(OCCCCN2CCN(C[C@H]3CCOC3)CC2)cc1	ZINC000494690440	405748197	/nfs/dbraw/zinc/74/81/97/405748197.db2.gz	KVEQPTUEUWURSD-GOSISDBHSA-N	0	3	318.461	2.500	10	0		DEAEHN
CCOc1cc(CNC2(CO)Cc3ccccc3C2)ccc1O	ZINC000459405079	405890776	/nfs/dbraw/zinc/89/07/76/405890776.db2.gz	BAGHQDPNMKLXGG-UHFFFAOYSA-N	0	3	313.397	2.410	10	0		DEAEHN
c1c2c(cc3c1OCCC[C@@H]3NC[C@H]1CNCCO1)CCCC2	ZINC000423530894	405845434	/nfs/dbraw/zinc/84/54/34/405845434.db2.gz	XOYDROQNQXJOHJ-AEFFLSMTSA-N	0	3	316.445	2.357	10	0		DEAEHN
c1ccc(N2CC[C@H](CN3CCO[C@]4(CCCOC4)C3)C2)cc1	ZINC000639157391	405933135	/nfs/dbraw/zinc/93/31/35/405933135.db2.gz	NDTFHEPRWOPFQL-IEBWSBKVSA-N	0	3	316.445	2.394	10	0		DEAEHN
Cc1cc(NC(=O)NC[C@@H]2C[C@H]2C)n(C2CCN(C)CC2)n1	ZINC000531189475	405922479	/nfs/dbraw/zinc/92/24/79/405922479.db2.gz	BIJKJYCUYYOEDY-YPMHNXCESA-N	0	3	305.426	2.236	10	0		DEAEHN
c1nc(CNC[C@H]2CCN2C2CCCCC2)cc2c1OCCO2	ZINC000639344716	406057763	/nfs/dbraw/zinc/05/77/63/406057763.db2.gz	BFIVYJFUHXRXAD-MRXNPFEDSA-N	0	3	317.433	2.349	10	0		DEAEHN
c1ccc2c(c1)CC(C[NH2+]Cc1nnc(C3CCOCC3)[n-]1)C2	ZINC000639377292	406071960	/nfs/dbraw/zinc/07/19/60/406071960.db2.gz	LFPFUVYWDHTKGT-UHFFFAOYSA-N	0	3	312.417	2.203	10	0		DEAEHN
c1ccc2c(c1)CC(CNCc1nnc(C3CCOCC3)[nH]1)C2	ZINC000639377292	406071964	/nfs/dbraw/zinc/07/19/64/406071964.db2.gz	LFPFUVYWDHTKGT-UHFFFAOYSA-N	0	3	312.417	2.203	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@@H]1CCO[C@@H](C2CC2)C1	ZINC000487533374	406242454	/nfs/dbraw/zinc/24/24/54/406242454.db2.gz	DRCSWRCARUTESH-ZWNOBZJWSA-N	0	3	314.227	2.230	10	0		DEAEHN
CC(=O)CCc1ccc(OC[C@@H](O)CNCC(C)(C)F)cc1	ZINC000634723325	406247759	/nfs/dbraw/zinc/24/77/59/406247759.db2.gz	KNCFHWJLVHOWLX-HNNXBMFYSA-N	0	3	311.397	2.286	10	0		DEAEHN
COc1ccc(C[C@@H](C)NC[C@H]2CCCCS2(=O)=O)cc1	ZINC000545242412	406307120	/nfs/dbraw/zinc/30/71/20/406307120.db2.gz	JUIDDHJFOZQHAJ-CZUORRHYSA-N	0	3	311.447	2.183	10	0		DEAEHN
Cc1nc2ccccc2n1CCC(=O)NCCN1CC[C@H](C)C1	ZINC000548452626	406517443	/nfs/dbraw/zinc/51/74/43/406517443.db2.gz	RQNBWNPREYUFAS-AWEZNQCLSA-N	0	3	314.433	2.193	10	0		DEAEHN
c1ccc(N2CC[C@H](CN3CCO[C@H]([C@@H]4CCCO4)C3)C2)cc1	ZINC000638172368	406605017	/nfs/dbraw/zinc/60/50/17/406605017.db2.gz	ZWIFFFWYBWCQNY-NEWSRXKRSA-N	0	3	316.445	2.393	10	0		DEAEHN
c1ccc(N2CC[C@H](CN3CCO[C@@H]([C@@H]4CCCO4)C3)C2)cc1	ZINC000638172369	406605163	/nfs/dbraw/zinc/60/51/63/406605163.db2.gz	ZWIFFFWYBWCQNY-NZSAHSFTSA-N	0	3	316.445	2.393	10	0		DEAEHN
CCC(C)(C)[C@H](C)NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638408511	406754649	/nfs/dbraw/zinc/75/46/49/406754649.db2.gz	ZJSNRFFSIDMTOV-HOCLYGCPSA-N	0	3	305.466	2.387	10	0		DEAEHN
O=C([C@H]1CNCCOC1)N(Cc1ccccc1)Cc1ccccc1	ZINC000643614411	407016842	/nfs/dbraw/zinc/01/68/42/407016842.db2.gz	VQFDQTKCRANHPD-IBGZPJMESA-N	0	3	324.424	2.451	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NC1CCN(c2ccccn2)CC1	ZINC000129260262	196034006	/nfs/dbraw/zinc/03/40/06/196034006.db2.gz	DDRHQRZANXYTNJ-INIZCTEOSA-N	0	3	316.449	2.041	10	0		DEAEHN
Cc1ccc([C@H](C)N(C)C(=O)C(C)(C)N2CCNCC2)s1	ZINC000129663477	196066231	/nfs/dbraw/zinc/06/62/31/196066231.db2.gz	YOBIMVIEDVVJPH-ZDUSSCGKSA-N	0	3	309.479	2.260	10	0		DEAEHN
CCCN[C@H](C)c1c(OC)cccc1N1CCS(=O)CC1	ZINC000129715277	196070489	/nfs/dbraw/zinc/07/04/89/196070489.db2.gz	OHWHMNHVJYPCMD-CYBMUJFWSA-N	0	3	310.463	2.325	10	0		DEAEHN
CC(C)Cn1ncnc1C[C@H](N)c1ccc(Br)cn1	ZINC000130779516	196108960	/nfs/dbraw/zinc/10/89/60/196108960.db2.gz	ZUEDIKSIGBGLBG-NSHDSACASA-N	0	3	324.226	2.334	10	0		DEAEHN
CCc1nn(CCCS(C)(=O)=O)c(CC)c1[C@H](CC)NC	ZINC000131093953	196139881	/nfs/dbraw/zinc/13/98/81/196139881.db2.gz	KHKIDQZOQCGAKV-LBPRGKRZSA-N	0	3	315.483	2.113	10	0		DEAEHN
CCN[C@H](CC)c1c(CC)nn(CCS(C)(=O)=O)c1CC	ZINC000131144620	196143138	/nfs/dbraw/zinc/14/31/38/196143138.db2.gz	ZZRUIUXMLBHNCI-GFCCVEGCSA-N	0	3	315.483	2.113	10	0		DEAEHN
CNCc1cc(S(=O)(=O)NCCCC(F)(F)F)ccc1C	ZINC000131219845	196151056	/nfs/dbraw/zinc/15/10/56/196151056.db2.gz	IKIHWNSFQRJXIN-UHFFFAOYSA-N	0	3	324.368	2.335	10	0		DEAEHN
CCNCc1cccc(S(=O)(=O)NCCCC(F)(F)F)c1	ZINC000131229183	196152361	/nfs/dbraw/zinc/15/23/61/196152361.db2.gz	REGBOKIJDRGOEX-UHFFFAOYSA-N	0	3	324.368	2.417	10	0		DEAEHN
CC(C)Oc1nc(NCCCCC(F)(F)F)[nH]c(=NN)n1	ZINC000131283446	196157269	/nfs/dbraw/zinc/15/72/69/196157269.db2.gz	HDRRPWJKKHMAEU-UHFFFAOYSA-N	0	3	308.308	2.089	10	0		DEAEHN
CC1COC(CN)(c2ccc(Br)cc2F)OC1	ZINC000131398775	196165055	/nfs/dbraw/zinc/16/50/55/196165055.db2.gz	QFBIVKURTIBLSX-UHFFFAOYSA-N	0	3	304.159	2.383	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1[C@@H](O)C1CCCC1	ZINC000132131337	196228862	/nfs/dbraw/zinc/22/88/62/196228862.db2.gz	KZURTXYOZQOAQC-ZDUSSCGKSA-N	0	3	316.243	2.431	10	0		DEAEHN
CC[C@H](CSC)NS(=O)(=O)c1cccc([C@@H](C)NC)c1	ZINC000133237742	196323759	/nfs/dbraw/zinc/32/37/59/196323759.db2.gz	RPFJBBXTCRJYIU-DGCLKSJQSA-N	0	3	316.492	2.387	10	0		DEAEHN
COCCNCc1cnc(N2CCS[C@H](C)[C@@H]2C)c(C)c1	ZINC000133290672	196327855	/nfs/dbraw/zinc/32/78/55/196327855.db2.gz	VSWBRICODOOAGH-UONOGXRCSA-N	0	3	309.479	2.456	10	0		DEAEHN
C[C@H]1CNC[C@@H](COc2ncc(Cl)cc2Br)O1	ZINC000133853258	196340531	/nfs/dbraw/zinc/34/05/31/196340531.db2.gz	NZYKSGPZYXQVJF-CBAPKCEASA-N	0	3	321.602	2.253	10	0		DEAEHN
COc1cccc(C2CC(NC[C@H]3CCCS3(=O)=O)C2)c1	ZINC000133915266	196345326	/nfs/dbraw/zinc/34/53/26/196345326.db2.gz	RLWKBLPZTOQUPI-ZBCRRDGASA-N	0	3	309.431	2.108	10	0		DEAEHN
C1COC2(CCCN([C@@H]3CCOC4(CCSCC4)C3)C2)O1	ZINC000134026447	196355212	/nfs/dbraw/zinc/35/52/12/196355212.db2.gz	TWSDSMZMVFCTSH-CQSZACIVSA-N	0	3	313.463	2.270	10	0		DEAEHN
CCN[C@H](c1c(Cl)cnn1CCOC)[C@@H]1CCO[C@@H]1C	ZINC000134047751	196356987	/nfs/dbraw/zinc/35/69/87/196356987.db2.gz	NPAJHRDUXAIPFA-WZRBSPASSA-N	0	3	301.818	2.259	10	0		DEAEHN
NC[C@@H]1OCCN(C2CC2)[C@@H]1c1sccc1Br	ZINC000135540126	196485374	/nfs/dbraw/zinc/48/53/74/196485374.db2.gz	XZNNSAGYUPDKKF-QWRGUYRKSA-N	0	3	317.252	2.374	10	0		DEAEHN
C[C@@H](NC1CCS(=O)(=O)CC1)c1cccc(-n2ccnc2)c1	ZINC000291104667	222140495	/nfs/dbraw/zinc/14/04/95/222140495.db2.gz	JSKUWEMZIPPUAH-CYBMUJFWSA-N	0	3	319.430	2.100	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCCC[C@H](c2cc(N)n[nH]2)C1	ZINC000616630054	422516597	/nfs/dbraw/zinc/51/65/97/422516597.db2.gz	YEJZVTWFVLNTJD-LBPRGKRZSA-N	0	3	323.441	2.086	10	0		DEAEHN
CCCCCNC(=O)[C@@H](C)N1CCC(Cc2nccn2C)CC1	ZINC000105876239	424849437	/nfs/dbraw/zinc/84/94/37/424849437.db2.gz	SOCCHDTTWHZWFB-OAHLLOKOSA-N	0	3	320.481	2.370	10	0		DEAEHN
Cc1cc(NC(=O)CC2CCN(C)CC2)nn1-c1ccccc1	ZINC000362981432	424854237	/nfs/dbraw/zinc/85/42/37/424854237.db2.gz	WGCRYHIIHPACDM-UHFFFAOYSA-N	0	3	312.417	2.851	10	0		DEAEHN
C[C@@]1(CNC(=O)c2csnn2)CCCN1Cc1ccccc1	ZINC000153797735	424859860	/nfs/dbraw/zinc/85/98/60/424859860.db2.gz	UYMKSOKDUUWIGJ-INIZCTEOSA-N	0	3	316.430	2.323	10	0		DEAEHN
Cc1ccc(CNC2COCCOC2)cc1Br	ZINC000380053479	424907499	/nfs/dbraw/zinc/90/74/99/424907499.db2.gz	WBFLPALSDHGGIN-UHFFFAOYSA-N	0	3	300.196	2.263	10	0		DEAEHN
CN(C(=O)c1ncccc1N)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000388656888	424915055	/nfs/dbraw/zinc/91/50/55/424915055.db2.gz	SIZSBIPTKJQJBU-INIZCTEOSA-N	0	3	324.428	2.400	10	0		DEAEHN
C[C@H](O)CCCN1CCO[C@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC000404219065	424925844	/nfs/dbraw/zinc/92/58/44/424925844.db2.gz	WGUITJKECAIZRJ-UHOSZYNNSA-N	0	3	318.461	2.123	10	0		DEAEHN
CC(C)(O)CCN1CCO[C@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC000404214976	424926159	/nfs/dbraw/zinc/92/61/59/424926159.db2.gz	SRQFPUVPQLIDGJ-MSOLQXFVSA-N	0	3	318.461	2.123	10	0		DEAEHN
CN1CC[C@@H](CNc2ncc(Cl)cn2)[C@@H]1c1cccnc1	ZINC000328634853	424901537	/nfs/dbraw/zinc/90/15/37/424901537.db2.gz	UIJBBOHEKBDEBB-JSGCOSHPSA-N	0	3	303.797	2.630	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC[C@@H](c2ccnc(N)c2)C1	ZINC000616619817	425097867	/nfs/dbraw/zinc/09/78/67/425097867.db2.gz	KGPULXUDULEGHZ-CQSZACIVSA-N	0	3	320.437	2.368	10	0		DEAEHN
O=C(Nc1ccc2c(c1)CNC2)N1CC[C@]2(O)CCCC[C@H]2C1	ZINC000333099091	268885122	/nfs/dbraw/zinc/88/51/22/268885122.db2.gz	ANKQPHJAYXNYHK-MAUKXSAKSA-N	0	3	315.417	2.449	10	0		DEAEHN
CCN1CC[C@H](NC(=O)N2CCc3[nH]c4ccccc4c3C2)C1	ZINC000334121940	269021696	/nfs/dbraw/zinc/02/16/96/269021696.db2.gz	LZGMFKZKOIEVFS-ZDUSSCGKSA-N	0	3	312.417	2.330	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)c2ccc(Br)cc2F)C1	ZINC000390021465	269097121	/nfs/dbraw/zinc/09/71/21/269097121.db2.gz	WRHMZMATZAYXDH-SNVBAGLBSA-N	0	3	315.186	2.412	10	0		DEAEHN
Fc1c(Br)cccc1CNCCCn1ccnn1	ZINC000394913209	269101072	/nfs/dbraw/zinc/10/10/72/269101072.db2.gz	AZLKQGASQGDKTF-UHFFFAOYSA-N	0	3	313.174	2.360	10	0		DEAEHN
O=C(CC1CCC1)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000397616308	269106881	/nfs/dbraw/zinc/10/68/81/269106881.db2.gz	GZAOKXMNWXEVQG-UHFFFAOYSA-N	0	3	316.445	2.320	10	0		DEAEHN
c1cc(CNCCOC[C@@H]2CCCO2)n(-c2ccccc2)n1	ZINC000516390054	269362587	/nfs/dbraw/zinc/36/25/87/269362587.db2.gz	STVSHEUGWSDQHH-KRWDZBQOSA-N	0	3	301.390	2.158	10	0		DEAEHN
CC(=O)NCCCCCC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000052852884	273492374	/nfs/dbraw/zinc/49/23/74/273492374.db2.gz	GKCZYSLZOUDWHK-QGZVFWFLSA-N	0	3	319.449	2.102	10	0		DEAEHN
CC(C)c1ccc(NC(=O)CN[C@H]2CCCC[C@@H]2C(N)=O)cc1	ZINC000184810043	273563548	/nfs/dbraw/zinc/56/35/48/273563548.db2.gz	OJMRKVOYOTUNGR-HOTGVXAUSA-N	0	3	317.433	2.382	10	0		DEAEHN
C[C@@H]1COCC[C@H]1N[C@@H]1CCN(c2ccccc2Cl)C1=O	ZINC000191694057	274380092	/nfs/dbraw/zinc/38/00/92/274380092.db2.gz	SOSVFFGYJDBMPV-MRVWCRGKSA-N	0	3	308.809	2.460	10	0		DEAEHN
O=C(NCCN1CCCCCC1)[C@@H]1CCCN1c1nccs1	ZINC000192591609	274980895	/nfs/dbraw/zinc/98/08/95/274980895.db2.gz	XDHFBLSQGLGTMW-AWEZNQCLSA-N	0	3	322.478	2.104	10	0		DEAEHN
O[C@H](CN1CCC[C@H](Cn2cncn2)C1)c1ccccc1Cl	ZINC000105884119	275056990	/nfs/dbraw/zinc/05/69/90/275056990.db2.gz	JWCRISOCQRMDCM-XJKSGUPXSA-N	0	3	320.824	2.377	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@]1(O)CCC[C@H](C(F)(F)F)C1)N(C)C	ZINC000187680934	276038821	/nfs/dbraw/zinc/03/88/21/276038821.db2.gz	IXOMFWYCGWXBJE-SCRDCRAPSA-N	0	3	324.387	2.317	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)N1CCO[C@@H](c2ccccc2)C1	ZINC000262566851	276106168	/nfs/dbraw/zinc/10/61/68/276106168.db2.gz	WVPBLMNSMWUIEE-HZPDHXFCSA-N	0	3	302.418	2.365	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccc2c(c1)OCCCO2)N(C)C	ZINC000161976072	276282154	/nfs/dbraw/zinc/28/21/54/276282154.db2.gz	UXKYFEVVJGTYNH-CQSZACIVSA-N	0	3	306.406	2.194	10	0		DEAEHN
CCOc1cccc(CN2C[C@H](N3CCOCC3)[C@@H](C)C2)c1	ZINC000245729818	276380145	/nfs/dbraw/zinc/38/01/45/276380145.db2.gz	JNHMWCJMKMMUBZ-YJBOKZPZSA-N	0	3	304.434	2.238	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)NC1CCC(C)(C)CC1	ZINC000074167467	277222874	/nfs/dbraw/zinc/22/28/74/277222874.db2.gz	CGCXNDALLQNHHG-HNNXBMFYSA-N	0	3	311.470	2.365	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NC1Cc2ccccc2C1	ZINC000186607119	277478400	/nfs/dbraw/zinc/47/84/00/277478400.db2.gz	YGUJCKPIKRZBSZ-QGZVFWFLSA-N	0	3	303.450	2.429	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)NCc1ccc(Cl)cn1	ZINC000180892248	278252926	/nfs/dbraw/zinc/25/29/26/278252926.db2.gz	JEKUYCJTNMKSDX-LBPRGKRZSA-N	0	3	310.829	2.409	10	0		DEAEHN
C[C@H](O)CCCN[C@H](Cn1ccccc1=O)c1ccccc1	ZINC000450921697	278287031	/nfs/dbraw/zinc/28/70/31/278287031.db2.gz	JPIIWGXYMXPNGU-DOTOQJQBSA-N	0	3	300.402	2.340	10	0		DEAEHN
C[C@@H](N)C(=O)Nc1ccc2c(c1)oc(=O)cc2C(F)(F)F	ZINC000025666379	278304905	/nfs/dbraw/zinc/30/49/05/278304905.db2.gz	XOLSUKMEFPGXNO-ZCFIWIBFSA-N	0	3	300.236	2.098	10	0		DEAEHN
C[C@@H](NC[C@H](O)Cn1ccnn1)c1ccccc1C(F)(F)F	ZINC000459710803	278353717	/nfs/dbraw/zinc/35/37/17/278353717.db2.gz	ZPPRNYFULFFNFD-MNOVXSKESA-N	0	3	314.311	2.009	10	0		DEAEHN
C[C@H](C(=O)N1c2ccccc2C[C@@H]1C)N1CCN2CCC[C@@H]2C1	ZINC000178632002	279214607	/nfs/dbraw/zinc/21/46/07/279214607.db2.gz	SYNKJSKGNXGTAR-ZMSDIMECSA-N	0	3	313.445	2.133	10	0		DEAEHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)c1cn2ccnc2s1	ZINC000188361822	279309398	/nfs/dbraw/zinc/30/93/98/279309398.db2.gz	OAEDKGXEYGXAQJ-VXGBXAGGSA-N	0	3	306.435	2.246	10	0		DEAEHN
Cc1c2ccccc2oc(=O)c1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000177200505	280271394	/nfs/dbraw/zinc/27/13/94/280271394.db2.gz	BNFPQKUIOWYSDB-CYBMUJFWSA-N	0	3	312.369	2.022	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000173830568	288312320	/nfs/dbraw/zinc/31/23/20/288312320.db2.gz	CXOAJCRHIUUIBQ-UONOGXRCSA-N	0	3	312.410	2.073	10	0		DEAEHN
CC1(C)C[C@H](NCC(=O)N2CCO[C@H]3CCCC[C@H]32)C(C)(C)O1	ZINC000249483899	281356821	/nfs/dbraw/zinc/35/68/21/281356821.db2.gz	XOQBRHQNYWVGNF-ILXRZTDVSA-N	0	3	324.465	2.092	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)NC[C@]1(C)CCCO1	ZINC000119989219	281732673	/nfs/dbraw/zinc/73/26/73/281732673.db2.gz	MRQYVPKMWAIRHY-AEFFLSMTSA-N	0	3	319.449	2.028	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NCCc1cscn1)c1ccccc1	ZINC000131900564	281976239	/nfs/dbraw/zinc/97/62/39/281976239.db2.gz	ZJVVKXLITUNRHQ-HNNXBMFYSA-N	0	3	318.446	2.288	10	0		DEAEHN
COc1ccc(C(C)(C)C(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000178112902	295100312	/nfs/dbraw/zinc/10/03/12/295100312.db2.gz	LTFWFBUFSDJFJS-OAHLLOKOSA-N	0	3	302.418	2.279	10	0		DEAEHN
COc1ccc(CC(=O)NCCN2CCCC[C@@H]2C)cc1F	ZINC000046858117	295116232	/nfs/dbraw/zinc/11/62/32/295116232.db2.gz	ANKSGYJXYWEYKO-ZDUSSCGKSA-N	0	3	308.397	2.367	10	0		DEAEHN
C[C@@H]1C[NH2+]CC[C@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1Cl	ZINC000262763319	297109672	/nfs/dbraw/zinc/10/96/72/297109672.db2.gz	JZOPUZFAYOMDRZ-LDYMZIIASA-N	0	3	323.245	2.270	10	0		DEAEHN
C[C@@H]1OCC[C@@H]1N[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1	ZINC000245580964	297599799	/nfs/dbraw/zinc/59/97/99/297599799.db2.gz	HDHKMEPAJVGPNH-LOHUMSBYSA-N	0	3	308.809	2.379	10	0		DEAEHN
O=C(C1CC1)N1CCCCC[C@H]1C1CCN(CCCO)CC1	ZINC000369280951	303547963	/nfs/dbraw/zinc/54/79/63/303547963.db2.gz	USYVVRXHVQJRMY-KRWDZBQOSA-N	0	3	308.466	2.262	10	0		DEAEHN
COc1cccc(CNCC[C@@H]2COc3ccccc3O2)n1	ZINC000574892415	326197541	/nfs/dbraw/zinc/19/75/41/326197541.db2.gz	QHHCEKLPPUPAEH-CQSZACIVSA-N	0	3	300.358	2.410	10	0		DEAEHN
c1ccc(N2CCOCC2)c(CNCCOCC2CCC2)c1	ZINC000580267311	333045859	/nfs/dbraw/zinc/04/58/59/333045859.db2.gz	IKFBVTOCFGURBQ-UHFFFAOYSA-N	0	3	304.434	2.430	10	0		DEAEHN
CN(C)[C@H](CNC(=O)NCCOCC1CCC1)c1ccccc1	ZINC000583786586	337332875	/nfs/dbraw/zinc/33/28/75/337332875.db2.gz	RLSPGCWQECFLRH-QGZVFWFLSA-N	0	3	319.449	2.405	10	0		DEAEHN
O[C@H](CNC1(c2ccc(Cl)cc2)CCC1)CN1CCOCC1	ZINC000178839768	341967102	/nfs/dbraw/zinc/96/71/02/341967102.db2.gz	YMLHCVIZGHERRT-MRXNPFEDSA-N	0	3	324.852	2.002	10	0		DEAEHN
CC(C)CNC(=O)CN[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000180675803	519734965	/nfs/dbraw/zinc/73/49/65/519734965.db2.gz	KPFUBPWTHYRSGE-CQSZACIVSA-N	0	3	300.406	2.295	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H](C)c2c(C)noc2C)C1	ZINC000246922107	521645580	/nfs/dbraw/zinc/64/55/80/521645580.db2.gz	YLOJNTHEJZYRDS-FZMZJTMJSA-N	0	3	308.426	2.178	10	0		DEAEHN
CCc1noc(-c2ccc(CCNCc3cncnc3)cc2)n1	ZINC000105491416	522824744	/nfs/dbraw/zinc/82/47/44/522824744.db2.gz	OEAJFKUVOKBDCG-UHFFFAOYSA-N	0	3	309.373	2.421	10	0		DEAEHN
Cn1nccc1C(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000163422220	527593405	/nfs/dbraw/zinc/59/34/05/527593405.db2.gz	PVIQPWAGEUERJA-GOSISDBHSA-N	0	3	312.417	2.205	10	0		DEAEHN
CC(C)CCNC(=O)[C@H](C)N1CC[C@@H](CNc2ccccn2)C1	ZINC000249800604	535385421	/nfs/dbraw/zinc/38/54/21/535385421.db2.gz	AAUOTJHZEUEAMH-HOTGVXAUSA-N	0	3	318.465	2.366	10	0		DEAEHN
CC[C@@H](C)Oc1ccc(C(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000176608617	535623428	/nfs/dbraw/zinc/62/34/28/535623428.db2.gz	DCHKTQHQSKUVHE-PBHICJAKSA-N	0	3	320.433	2.267	10	0		DEAEHN
CC[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1cc(OC)ccc1[O-]	ZINC000246572937	536167970	/nfs/dbraw/zinc/16/79/70/536167970.db2.gz	NHXXVFHUINHQPS-STQMWFEESA-N	0	3	304.390	2.100	10	0		DEAEHN
CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc(OC)ccc1[O-]	ZINC000246572937	536167973	/nfs/dbraw/zinc/16/79/73/536167973.db2.gz	NHXXVFHUINHQPS-STQMWFEESA-N	0	3	304.390	2.100	10	0		DEAEHN
CN1CCC(CC(=O)N2CC[C@@H](Nc3ccccc3)C2)CC1	ZINC000376836884	536335226	/nfs/dbraw/zinc/33/52/26/536335226.db2.gz	OUTIMTOXTGPERC-QGZVFWFLSA-N	0	3	301.434	2.431	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3c(s2)CCOC3)C1	ZINC000246816704	536472178	/nfs/dbraw/zinc/47/21/78/536472178.db2.gz	SATPPMHYCRVQFV-GXTWGEPZSA-N	0	3	320.458	2.377	10	0		DEAEHN
COC(=O)c1cc(C(=O)Nc2ccc(CN(C)C)c(C)c2)c[nH]1	ZINC000458267704	536876705	/nfs/dbraw/zinc/87/67/05/536876705.db2.gz	QGQFCTIFYXCGOG-UHFFFAOYSA-N	0	3	315.373	2.424	10	0		DEAEHN
COCC[C@@H](N)C(=O)N(C)Cc1ccc(Cl)c(Cl)c1	ZINC000052808268	625105952	/nfs/dbraw/zinc/10/59/52/625105952.db2.gz	YUMJNRNIKOXSPR-GFCCVEGCSA-N	0	3	305.205	2.316	10	0		DEAEHN
CCOC[C@H]1CCN(Cn2ncc3cc(C(=O)OC)ccc32)C1	ZINC000748087762	638508571	/nfs/dbraw/zinc/50/85/71/638508571.db2.gz	BZDDCXSBTXMZJV-ZDUSSCGKSA-N	0	3	317.389	2.139	10	0		DEAEHN
CON(C)C(=O)CCN[C@H](C)c1ccccc1OC(F)F	ZINC000806625666	645855090	/nfs/dbraw/zinc/85/50/90/645855090.db2.gz	JIADNDRYCJFHAZ-SNVBAGLBSA-N	0	3	302.321	2.349	10	0		DEAEHN
Cc1[nH]c2ccc(F)cc2c1CC(=O)N[C@H]1CN2CCC1CC2	ZINC000222555605	646452276	/nfs/dbraw/zinc/45/22/76/646452276.db2.gz	OBVJILCZBUYYID-KRWDZBQOSA-N	0	3	315.392	2.368	10	0		DEAEHN
CC(C)[C@@H](C(=O)OCCN1CCSCC1)N1CCCCC1	ZINC000120495885	684096748	/nfs/dbraw/zinc/09/67/48/684096748.db2.gz	ICAVOEWPYJNTEF-HNNXBMFYSA-N	0	3	314.495	2.089	10	0		DEAEHN
C#CCN1CCC(C(=O)N[C@H](C)c2ccc3c(c2)CCO3)CC1	ZINC000143380708	684256572	/nfs/dbraw/zinc/25/65/72/684256572.db2.gz	FKZLKKQWBBTHHY-CQSZACIVSA-N	0	3	312.413	2.144	10	0		DEAEHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@@H]2CCOC[C@@H]2C)c1	ZINC000192509514	684451661	/nfs/dbraw/zinc/45/16/61/684451661.db2.gz	LFJSHDBHSPDWLD-NILFDRSVSA-N	0	3	316.357	2.015	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1ccc(COC)cc1	ZINC000192566491	684453268	/nfs/dbraw/zinc/45/32/68/684453268.db2.gz	JBDBHOHEGWYXGE-INIZCTEOSA-N	0	3	321.421	2.065	10	0		DEAEHN
CN1C[C@H](CCNCc2cscc2Br)CC1=O	ZINC000723551706	777121697	/nfs/dbraw/zinc/12/16/97/777121697.db2.gz	HWBZEPYMTRIXCQ-SECBINFHSA-N	0	3	317.252	2.469	10	0		DEAEHN
Brc1c[nH]c(CN[C@H](C2CC2)[C@@H]2CCCOC2)n1	ZINC000723979504	777213767	/nfs/dbraw/zinc/21/37/67/777213767.db2.gz	XWVQVRLIILSDTD-ZWNOBZJWSA-N	0	3	314.227	2.467	10	0		DEAEHN
C[C@H](O)[C@H]1CCCN(C[C@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724061013	777233851	/nfs/dbraw/zinc/23/38/51/777233851.db2.gz	ICVYFHYHDVAJOS-GUBZILKMSA-N	0	3	305.287	2.028	10	0		DEAEHN
CO[C@]1(C)CCCN(C[C@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724110699	777243101	/nfs/dbraw/zinc/24/31/01/777243101.db2.gz	ISVMYDBXWSGPSO-ZJUUUORDSA-N	0	3	305.287	2.436	10	0		DEAEHN
CS[C@H](CO)[C@@H](C)NCc1ccc(Br)nc1	ZINC000309928580	778287051	/nfs/dbraw/zinc/28/70/51/778287051.db2.gz	WSGBIVJUQPXPNM-PSASIEDQSA-N	0	3	305.241	2.046	10	0		DEAEHN
C[C@@H](c1ccc(Cl)cc1Cl)N(C)S(=O)(=O)C1CNC1	ZINC000722218274	778510912	/nfs/dbraw/zinc/51/09/12/778510912.db2.gz	GCUWORCYEKOVFB-QMMMGPOBSA-N	0	3	323.245	2.288	10	0		DEAEHN
COC[C@@H](CCO)NCc1ccc(Br)c(F)c1	ZINC000217852613	789333719	/nfs/dbraw/zinc/33/37/19/789333719.db2.gz	QVDVBSYGEIJDMJ-SNVBAGLBSA-N	0	3	306.175	2.075	10	0		DEAEHN
CC1(C)CCNCCN1S(=O)(=O)c1cc(F)ccc1Cl	ZINC000712516115	792192424	/nfs/dbraw/zinc/19/24/24/792192424.db2.gz	VVKBUAXGTVZDLV-UHFFFAOYSA-N	0	3	320.817	2.242	10	0		DEAEHN
CC(C)(C)OC(=O)NC1CC(CN[C@H]2CCn3ccnc32)C1	ZINC000715086479	792381554	/nfs/dbraw/zinc/38/15/54/792381554.db2.gz	VKKUFHXXLZDKPE-BPCQOVAHSA-N	0	3	306.410	2.221	10	0		DEAEHN
NC(=O)C1CC(NCc2ccc(Br)cc2Cl)C1	ZINC000716715666	793003235	/nfs/dbraw/zinc/00/32/35/793003235.db2.gz	JIWJHBALQJTCMV-UHFFFAOYSA-N	0	3	317.614	2.456	10	0		DEAEHN
CC(C)=CC(=O)N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21	ZINC000404199737	802007507	/nfs/dbraw/zinc/00/75/07/802007507.db2.gz	HQNAEJVZBCKBRF-ZWKOTPCHSA-N	0	3	314.429	2.455	10	0		DEAEHN
Cc1nn(C)c(Cl)c1CN[C@@H]1CCCN2CCSC[C@@H]12	ZINC000720509194	1085261961	/nfs/dbraw/zinc/26/19/61/1085261961.db2.gz	GXXKFWYDYQEMCG-OLZOCXBDSA-N	0	3	314.886	2.051	10	0		DEAEHN
COc1cncc(CN[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)c1	ZINC000700056112	1086308338	/nfs/dbraw/zinc/30/83/38/1086308338.db2.gz	JQDOCQPVCRRZHB-NWDGAFQWSA-N	0	3	309.410	2.482	10	0		DEAEHN
Cc1ncc(CNCC23CC(C2)CN3C(=O)OC(C)(C)C)n1C	ZINC000706483939	1086639709	/nfs/dbraw/zinc/63/97/09/1086639709.db2.gz	LTJDXKARSGXUMK-UHFFFAOYSA-N	0	3	320.437	2.218	10	0		DEAEHN
NC(=O)CC1CC(NCc2ccc(Br)cc2F)C1	ZINC000718557947	1088581934	/nfs/dbraw/zinc/58/19/34/1088581934.db2.gz	IZNIZJCTMWSSIY-UHFFFAOYSA-N	0	3	315.186	2.332	10	0		DEAEHN
Cc1nc(CNCCc2cncn2C)sc1Br	ZINC000719312230	1088933522	/nfs/dbraw/zinc/93/35/22/1088933522.db2.gz	YJQJOJCUENDJSJ-UHFFFAOYSA-N	0	3	315.240	2.280	10	0		DEAEHN
Cc1nc(CNC[C@H]2CC[C@@H](O)C2)sc1Br	ZINC000719303360	1088940873	/nfs/dbraw/zinc/94/08/73/1088940873.db2.gz	BFZHACQQJPVXNU-DTWKUNHWSA-N	0	3	305.241	2.465	10	0		DEAEHN
C[C@@H]1[C@H](NC(=O)c2csc(Br)c2)CCN1C	ZINC000719387045	1089056840	/nfs/dbraw/zinc/05/68/40/1089056840.db2.gz	WGPYBEXFNPIERV-VXNVDRBHSA-N	0	3	303.225	2.333	10	0		DEAEHN
CCn1cc(Br)cc1C(=O)N[C@@H]1CCN(C)[C@H]1C	ZINC000719383942	1089077674	/nfs/dbraw/zinc/07/76/74/1089077674.db2.gz	AMSBSUANHLGKIO-GXSJLCMTSA-N	0	3	314.227	2.093	10	0		DEAEHN
C[C@H]1[C@H](NC(=O)c2c(F)cccc2Br)CCN1C	ZINC000719388965	1089079908	/nfs/dbraw/zinc/07/99/08/1089079908.db2.gz	UBBKVVKOMFTONQ-GZMMTYOYSA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@H](NC[C@](C)(O)C(F)(F)C(F)(F)F)c1cnn(C)c1	ZINC000724024389	1143896419	/nfs/dbraw/zinc/89/64/19/1143896419.db2.gz	PYIHBYINKRSOMZ-CBAPKCEASA-N	0	3	301.259	2.019	10	0		DEAEHN
Cc1nccn1CCCN(C)Cc1nc(-c2ccoc2)no1	ZINC000136310874	282085605	/nfs/dbraw/zinc/08/56/05/282085605.db2.gz	JXNNXOGTESENHQ-UHFFFAOYSA-N	0	3	301.350	2.357	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1	ZINC000278296472	214073128	/nfs/dbraw/zinc/07/31/28/214073128.db2.gz	HOQNURYFBHTISP-CXAGYDPISA-N	0	3	317.433	2.224	10	0		DEAEHN
CN[C@H](CSCCS(C)(=O)=O)c1cc(C)ccc1OC	ZINC000081768991	192323333	/nfs/dbraw/zinc/32/33/33/192323333.db2.gz	GOOAWVTZWYPIDD-CYBMUJFWSA-N	0	3	317.476	2.042	10	0		DEAEHN
CN[C@@H](CSCCC(=O)OC)c1ccc(OC)c(OC)c1	ZINC000081789986	192324645	/nfs/dbraw/zinc/32/46/45/192324645.db2.gz	SPVBNWVRPOTIAB-LBPRGKRZSA-N	0	3	313.419	2.261	10	0		DEAEHN
CCN[C@H](CSCC(=O)OCC)c1ccc2c(c1)OCO2	ZINC000081795697	192324884	/nfs/dbraw/zinc/32/48/84/192324884.db2.gz	PSBGHJXDLNRFOL-GFCCVEGCSA-N	0	3	311.403	2.362	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@@H]1S(=O)(=O)c1cc(C)ccc1C	ZINC000081922256	192338393	/nfs/dbraw/zinc/33/83/93/192338393.db2.gz	RGSIAGDBFVJNAV-ZBFHGGJFSA-N	0	3	311.447	2.234	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(CCOC)Cc2ccc(C)o2)C1	ZINC000151451397	282117215	/nfs/dbraw/zinc/11/72/15/282117215.db2.gz	CFXGMUNWFRKRSD-HNNXBMFYSA-N	0	3	323.437	2.230	10	0		DEAEHN
CCCN[C@H]1CCOC[C@@H]1S(=O)(=O)c1ccc(C)c(C)c1	ZINC000081921888	192339027	/nfs/dbraw/zinc/33/90/27/192339027.db2.gz	YHSCOZLAEXEZIV-HOTGVXAUSA-N	0	3	311.447	2.234	10	0		DEAEHN
CCCN[C@H]1CCOC[C@H]1S(=O)(=O)c1ccc(C)cc1C	ZINC000081922489	192339336	/nfs/dbraw/zinc/33/93/36/192339336.db2.gz	PCHSXTHLQDRATE-GOEBONIOSA-N	0	3	311.447	2.234	10	0		DEAEHN
CN[C@H](CS(=O)(=O)c1ccccc1Br)C1CC1	ZINC000081931505	192341515	/nfs/dbraw/zinc/34/15/15/192341515.db2.gz	RKSMPNWKXPKXIW-LLVKDONJSA-N	0	3	318.236	2.221	10	0		DEAEHN
CCC[C@@H](CS(=O)(=O)c1ccc2c(c1)OCCCO2)NC	ZINC000081936280	192342922	/nfs/dbraw/zinc/34/29/22/192342922.db2.gz	LDVSYOIJHCIYBU-LBPRGKRZSA-N	0	3	313.419	2.010	10	0		DEAEHN
CCCN[C@@H]1c2ccccc2CC[C@@H]1S(=O)(=O)CCOC	ZINC000081944539	192345129	/nfs/dbraw/zinc/34/51/29/192345129.db2.gz	URKPGMHITAUUHX-JKSUJKDBSA-N	0	3	311.447	2.103	10	0		DEAEHN
CN1C[C@@H](NCc2ccc(Br)s2)CCC1=O	ZINC000082756507	185202314	/nfs/dbraw/zinc/20/23/14/185202314.db2.gz	MDLHQYNJGSLTDN-QMMMGPOBSA-N	0	3	303.225	2.221	10	0		DEAEHN
O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H]1CCCOC1	ZINC000171589940	295678231	/nfs/dbraw/zinc/67/82/31/295678231.db2.gz	AUORJIKNWPUDEC-DLBZAZTESA-N	0	3	317.433	2.302	10	0		DEAEHN
Cc1cc(C(=O)N2CC[C@@H](N(C)C)C2)c(C)n1-c1nccs1	ZINC000170867101	282180559	/nfs/dbraw/zinc/18/05/59/282180559.db2.gz	UIAUSTAXUPPHKR-CYBMUJFWSA-N	0	3	318.446	2.327	10	0		DEAEHN
CCCNCc1snnc1-c1ccc(S(C)(=O)=O)cc1	ZINC000087457451	185225817	/nfs/dbraw/zinc/22/58/17/185225817.db2.gz	PILMJBFMGDTUEI-UHFFFAOYSA-N	0	3	311.432	2.108	10	0		DEAEHN
CCOC(=O)COC[C@H](N)c1sccc1Br	ZINC000087630825	185229518	/nfs/dbraw/zinc/22/95/18/185229518.db2.gz	VFOJLZUMYHALFG-QMMMGPOBSA-N	0	3	308.197	2.090	10	0		DEAEHN
CCc1cc(N2CC[C@H](OCCN3CCCCC3)C2)nc(C)n1	ZINC000302069677	529536134	/nfs/dbraw/zinc/53/61/34/529536134.db2.gz	DUNQRRKNPWZICJ-KRWDZBQOSA-N	0	3	318.465	2.429	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCc1nccn1CC(C)C	ZINC000173999435	282192230	/nfs/dbraw/zinc/19/22/30/282192230.db2.gz	HBIDPLSRLISSGW-HNNXBMFYSA-N	0	3	323.485	2.315	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@]1(CN)Nc1ccc(Cl)cc1	ZINC000087914284	185237271	/nfs/dbraw/zinc/23/72/71/185237271.db2.gz	KSFCWLZBWULAKX-CHWSQXEVSA-N	0	3	302.827	2.047	10	0		DEAEHN
NC[C@@H](NC[C@@H]1CCCO1)c1ccc(Br)cc1F	ZINC000087928578	185237638	/nfs/dbraw/zinc/23/76/38/185237638.db2.gz	FCIKQTIYEWDMAR-GXFFZTMASA-N	0	3	317.202	2.357	10	0		DEAEHN
C[C@H](CNC(=O)NC[C@@H]1CCCN1C)c1ccc(F)cc1F	ZINC000174351469	282193591	/nfs/dbraw/zinc/19/35/91/282193591.db2.gz	ASBINLYGQMCIRW-YPMHNXCESA-N	0	3	311.376	2.462	10	0		DEAEHN
CC(C)(C)C[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)(C)C)o1	ZINC000088542820	185256486	/nfs/dbraw/zinc/25/64/86/185256486.db2.gz	AUHZSSOHYBDWPF-UHFFFAOYSA-N	0	3	302.440	2.492	10	0		DEAEHN
CCCN[C@H]1CCOC[C@H]1S(=O)(=O)c1cccc(Cl)c1	ZINC000081982189	192348718	/nfs/dbraw/zinc/34/87/18/192348718.db2.gz	XPTQWDBTHQVZHO-UONOGXRCSA-N	0	3	317.838	2.271	10	0		DEAEHN
CCN[C@@H](Cc1ncnn1C)c1ccccc1Br	ZINC000088581939	185258467	/nfs/dbraw/zinc/25/84/67/185258467.db2.gz	LWJWKWTURLNKTH-LBPRGKRZSA-N	0	3	309.211	2.471	10	0		DEAEHN
CN1CC[C@@H](CNC(=O)c2sc3ccc(F)cc3c2N)C1	ZINC000088640957	185260890	/nfs/dbraw/zinc/26/08/90/185260890.db2.gz	XLTHIKGPTFUSJZ-VIFPVBQESA-N	0	3	307.394	2.304	10	0		DEAEHN
CCCNCCS(=O)(=O)c1cccc(Br)c1	ZINC000082011444	192353172	/nfs/dbraw/zinc/35/31/72/192353172.db2.gz	AXCROSJEERQGIP-UHFFFAOYSA-N	0	3	306.225	2.222	10	0		DEAEHN
CC[C@H](NC[C@@](C)(O)CO)c1ccc(Br)cc1	ZINC000090284256	185289462	/nfs/dbraw/zinc/28/94/62/185289462.db2.gz	YARJWJNPZNEAKJ-QWHCGFSZSA-N	0	3	302.212	2.233	10	0		DEAEHN
N[C@H]1COC[C@@H]1c1nc(-c2ccc(Br)s2)no1	ZINC000090364812	185292782	/nfs/dbraw/zinc/29/27/82/185292782.db2.gz	GASXRQZMWHFCFF-WDSKDSINSA-N	0	3	316.180	2.002	10	0		DEAEHN
C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)[C@H]1COC[C@@H]1N	ZINC000090382177	185293756	/nfs/dbraw/zinc/29/37/56/185293756.db2.gz	HLROCZJSWHXLJB-WLTAIBSBSA-N	0	3	317.216	2.487	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)[C@]1(C)COC[C@H]1N	ZINC000090589949	185305423	/nfs/dbraw/zinc/30/54/23/185305423.db2.gz	DSARACRUQUVKLX-UKRRQHHQSA-N	0	3	312.797	2.431	10	0		DEAEHN
CN(Cc1ccc(Cl)cc1Cl)C(=O)[C@]1(C)COC[C@H]1N	ZINC000090591499	185305469	/nfs/dbraw/zinc/30/54/69/185305469.db2.gz	BYHSKWLZURGGFM-TZMCWYRMSA-N	0	3	317.216	2.316	10	0		DEAEHN
CC(C)N(Cc1cccc(Cl)c1)C(=O)[C@@]1(C)COC[C@@H]1N	ZINC000090592330	185305942	/nfs/dbraw/zinc/30/59/42/185305942.db2.gz	DOIFDGDWDUDZHP-HOCLYGCPSA-N	0	3	310.825	2.441	10	0		DEAEHN
C[C@@H](CS(C)(=O)=O)NCc1c[nH]c2cc(Cl)ccc12	ZINC000166642230	197695597	/nfs/dbraw/zinc/69/55/97/197695597.db2.gz	OFRIKZBDHGWKDO-VIFPVBQESA-N	0	3	300.811	2.344	10	0		DEAEHN
C[C@]1(c2nc(-c3ccccc3Br)no2)COC[C@@H]1N	ZINC000090573559	185304366	/nfs/dbraw/zinc/30/43/66/185304366.db2.gz	OJEOYUVIUKZKHG-GWCFXTLKSA-N	0	3	324.178	2.114	10	0		DEAEHN
CCn1c2ccc(Br)cc2nc1[C@]1(C)COC[C@H]1N	ZINC000090571762	185304408	/nfs/dbraw/zinc/30/44/08/185304408.db2.gz	SXEJPMZIKOSAKY-TZMCWYRMSA-N	0	3	324.222	2.434	10	0		DEAEHN
Cc1noc(C)c1[C@H](C)NC(=O)c1c[nH]c(=NN)c(Cl)c1	ZINC000092343045	185313169	/nfs/dbraw/zinc/31/31/69/185313169.db2.gz	VKNQKEKZXKEVFH-LURJTMIESA-N	0	3	309.757	2.116	10	0		DEAEHN
CNCc1ccccc1S(=O)(=O)NCC1C(C)(C)C1(C)C	ZINC000092833111	185344949	/nfs/dbraw/zinc/34/49/49/185344949.db2.gz	SVBMBQFOJODVHR-UHFFFAOYSA-N	0	3	310.463	2.367	10	0		DEAEHN
CCC[C@H](C(=O)N1CCN([C@H](C)c2nccs2)CC1)N(C)C	ZINC000185760662	282266450	/nfs/dbraw/zinc/26/64/50/282266450.db2.gz	MCQOUTDYFFJQAW-ZIAGYGMSSA-N	0	3	324.494	2.079	10	0		DEAEHN
CSC[C@@H](C)N(C)S(=O)(=O)c1cc(CN)ccc1Cl	ZINC000168565691	197725659	/nfs/dbraw/zinc/72/56/59/197725659.db2.gz	VAFSPHMGOQHUOB-SECBINFHSA-N	0	3	322.883	2.171	10	0		DEAEHN
CC1(C)CC[C@H](CNCc2cnc(N3CCOCC3)s2)O1	ZINC000189725320	282316784	/nfs/dbraw/zinc/31/67/84/282316784.db2.gz	OLPAIRAPEWTDHM-GFCCVEGCSA-N	0	3	311.451	2.027	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)COC1(C)CNC1	ZINC000098060976	539436004	/nfs/dbraw/zinc/43/60/04/539436004.db2.gz	PQTKWDIJDGNWHZ-UHFFFAOYSA-N	0	3	312.797	2.446	10	0		DEAEHN
C[C@H](NCc1nccn1C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000279659957	215040051	/nfs/dbraw/zinc/04/00/51/215040051.db2.gz	DBGYAVRWKHUZAG-QWHCGFSZSA-N	0	3	308.426	2.155	10	0		DEAEHN
CCOc1ccccc1[C@H](CC)NC[C@H](O)CN1CCCC1=O	ZINC000179741302	539642339	/nfs/dbraw/zinc/64/23/39/539642339.db2.gz	YFKFOTFXDULKJH-HOCLYGCPSA-N	0	3	320.433	2.109	10	0		DEAEHN
Cc1n[nH]cc1[C@@H](C)N[C@H](C)Cn1ncc2ccccc2c1=O	ZINC000181035362	539647871	/nfs/dbraw/zinc/64/78/71/539647871.db2.gz	RUJDYWBDYIHEDP-VXGBXAGGSA-N	0	3	311.389	2.167	10	0		DEAEHN
CNC(=O)[C@H](NCCC(=O)Nc1cccc(Cl)c1)C(C)C	ZINC000183679731	539664461	/nfs/dbraw/zinc/66/44/61/539664461.db2.gz	SCRAZBJVXFUSCE-CQSZACIVSA-N	0	3	311.813	2.029	10	0		DEAEHN
CCc1nn(C)cc1CN1C[C@@H](c2ccsc2)[C@H](CO)C1	ZINC000190295528	539694440	/nfs/dbraw/zinc/69/44/40/539694440.db2.gz	UDGMTBGKHZKHFM-GJZGRUSLSA-N	0	3	305.447	2.252	10	0		DEAEHN
Cc1cccc(N(C)S(=O)(=O)c2ccc(F)c(CN)c2)c1	ZINC000071244336	190948645	/nfs/dbraw/zinc/94/86/45/190948645.db2.gz	VLFWNURNETWEKM-UHFFFAOYSA-N	0	3	308.378	2.418	10	0		DEAEHN
Cn1ccnc1CN1Cc2c(cccc2C(F)(F)F)[C@@H]1CN	ZINC000071684181	191008799	/nfs/dbraw/zinc/00/87/99/191008799.db2.gz	WSLVQNMESSRFHG-ZDUSSCGKSA-N	0	3	310.323	2.455	10	0		DEAEHN
CC(=O)Nc1ccc(N[C@H](C)C[C@H]2COCCN2)cc1Cl	ZINC000133611483	185999998	/nfs/dbraw/zinc/99/99/98/185999998.db2.gz	RHCSJOXHFOQNKZ-MFKMUULPSA-N	0	3	311.813	2.477	10	0		DEAEHN
CCCCN(CC)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138323170	186015755	/nfs/dbraw/zinc/01/57/55/186015755.db2.gz	NWMCYXDPSRDWMS-UHFFFAOYSA-N	0	3	320.405	2.495	10	0		DEAEHN
CC[C@@H](C)N(CC)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138463873	186017020	/nfs/dbraw/zinc/01/70/20/186017020.db2.gz	PPBUCCGLKZVRTL-SECBINFHSA-N	0	3	306.378	2.233	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N(C)CC(C)(C)C)c1	ZINC000138873665	186019068	/nfs/dbraw/zinc/01/90/68/186019068.db2.gz	AVZHJCJWMIATIQ-UHFFFAOYSA-N	0	3	320.405	2.351	10	0		DEAEHN
CN(CC1CCCC1)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000139069973	186020467	/nfs/dbraw/zinc/02/04/67/186020467.db2.gz	DMOAYSIRVWEMLU-UHFFFAOYSA-N	0	3	318.389	2.234	10	0		DEAEHN
CCC(C)(C)N(C)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000139092948	186020538	/nfs/dbraw/zinc/02/05/38/186020538.db2.gz	YSHMCSADCAXOIE-UHFFFAOYSA-N	0	3	320.405	2.493	10	0		DEAEHN
CC(C)[C@@H]1N[C@H](c2cccs2)N(C[C@@H]2CCN(C)C2)C1=O	ZINC000142172699	186031680	/nfs/dbraw/zinc/03/16/80/186031680.db2.gz	SBEJSNHXTIWLKV-SNPRPXQTSA-N	0	3	307.463	2.155	10	0		DEAEHN
CC(C)[C@@H]1N[C@@H](c2ccsc2)N(C2CCN(C)CC2)C1=O	ZINC000141241486	186029364	/nfs/dbraw/zinc/02/93/64/186029364.db2.gz	JBSTYQJZXGEZHH-LSDHHAIUSA-N	0	3	307.463	2.297	10	0		DEAEHN
CC[C@@H](C(N)=S)N1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000147661221	186040909	/nfs/dbraw/zinc/04/09/09/186040909.db2.gz	RIJPUVPDLRNASS-AWEZNQCLSA-N	0	3	313.417	2.147	10	0		DEAEHN
CCCNc1ncc(Br)c(OCCN(C)C)n1	ZINC000147919733	186042485	/nfs/dbraw/zinc/04/24/85/186042485.db2.gz	FLETZYULVKNDHU-UHFFFAOYSA-N	0	3	303.204	2.001	10	0		DEAEHN
CCCNc1nc(NCC(F)F)nc(N2CCCCC2)n1	ZINC000148234066	186044110	/nfs/dbraw/zinc/04/41/10/186044110.db2.gz	YTORJMSLPWTDJT-UHFFFAOYSA-N	0	3	300.357	2.361	10	0		DEAEHN
CN1CCC[C@@H](CN2C(=O)C3(CC3)N[C@H]2c2ccsc2)C1	ZINC000144214067	186035188	/nfs/dbraw/zinc/03/51/88/186035188.db2.gz	KUFSYTNKQLNYQU-TZMCWYRMSA-N	0	3	305.447	2.053	10	0		DEAEHN
CC(C)NCc1sccc1S(=O)(=O)N(C)C1CCC1	ZINC000144666153	186035641	/nfs/dbraw/zinc/03/56/41/186035641.db2.gz	DJUJVQIZAHJTRS-UHFFFAOYSA-N	0	3	302.465	2.419	10	0		DEAEHN
Cc1cc(S(=O)(=O)NCCCC(F)(F)F)sc1CN	ZINC000149978070	186053760	/nfs/dbraw/zinc/05/37/60/186053760.db2.gz	QPHNOSYQZUQSGC-UHFFFAOYSA-N	0	3	316.370	2.136	10	0		DEAEHN
N[C@@H](Cc1nc(-c2ccccc2)cs1)[C@H]1CCS(=O)(=O)C1	ZINC000150001811	186054232	/nfs/dbraw/zinc/05/42/32/186054232.db2.gz	SSVZVNYXZSRYLS-STQMWFEESA-N	0	3	322.455	2.115	10	0		DEAEHN
CC[C@@H]1CN(c2ncnc3c(C)csc32)CCN1C[C@H](C)O	ZINC000248960510	539777522	/nfs/dbraw/zinc/77/75/22/539777522.db2.gz	MJMFWNKVHRGPKV-QWHCGFSZSA-N	0	3	320.462	2.281	10	0		DEAEHN
N[C@H](Cc1csc([C@H]2CCS(=O)(=O)C2)n1)c1ccccc1	ZINC000150260814	186056138	/nfs/dbraw/zinc/05/61/38/186056138.db2.gz	WPBIBYVLRYNNCF-GXTWGEPZSA-N	0	3	322.455	2.288	10	0		DEAEHN
COCC[C@H](N)C(=O)Nc1cc(C)ccc1Br	ZINC000163985785	186144811	/nfs/dbraw/zinc/14/48/11/186144811.db2.gz	QUPCCXAPNSOBNI-JTQLQIEISA-N	0	3	301.184	2.060	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)NCCN(C)[C@H](C)CC)cc1F	ZINC000164134240	186149802	/nfs/dbraw/zinc/14/98/02/186149802.db2.gz	AVOKDSIDYBAIPG-GFCCVEGCSA-N	0	3	323.412	2.173	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccccc1CN)[S@](=O)c1ccccc1	ZINC000155908079	186122415	/nfs/dbraw/zinc/12/24/15/186122415.db2.gz	QCAWBIDARBZNTF-LAJNKCICSA-N	0	3	302.399	2.280	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1cc(Br)ccc1F	ZINC000159616894	186130790	/nfs/dbraw/zinc/13/07/90/186130790.db2.gz	DVCYFWAQCRUWQT-JTQLQIEISA-N	0	3	319.174	2.281	10	0		DEAEHN
CCNc1cc(NCC(C)(C)S(C)(=O)=O)nc(C(C)C)n1	ZINC000163898633	186141762	/nfs/dbraw/zinc/14/17/62/186141762.db2.gz	QUCQPZUQKZQCIL-UHFFFAOYSA-N	0	3	314.455	2.267	10	0		DEAEHN
CCc1nnc(NC(=O)N2CCC[C@@H]2CN2CCCC2)s1	ZINC000171504114	186170091	/nfs/dbraw/zinc/17/00/91/186170091.db2.gz	RTRGCSKQFYZKJN-LLVKDONJSA-N	0	3	309.439	2.193	10	0		DEAEHN
C[C@@H]1CCC[C@@](N)(C(=O)c2c(Cl)cnn2CCN(C)C)C1	ZINC000164351532	186157050	/nfs/dbraw/zinc/15/70/50/186157050.db2.gz	YCPCJGDNVMJZCH-ABAIWWIYSA-N	0	3	312.845	2.188	10	0		DEAEHN
CCn1ncc(Br)c1C(=O)[C@@H]1CCCCCN1	ZINC000164396439	186158829	/nfs/dbraw/zinc/15/88/29/186158829.db2.gz	HFPOBXXZKQAHLG-JTQLQIEISA-N	0	3	300.200	2.380	10	0		DEAEHN
CNC(=O)[C@@H](C)CN(C)Cc1ccc(Br)c(F)c1	ZINC000177845378	186192210	/nfs/dbraw/zinc/19/22/10/186192210.db2.gz	HLIVTRUTFNTKHM-VIFPVBQESA-N	0	3	317.202	2.402	10	0		DEAEHN
CN(Cc1ccc(Br)s1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000626037572	366016869	/nfs/dbraw/zinc/01/68/69/366016869.db2.gz	VCKURCIYWOZTNL-OCAPTIKFSA-N	0	3	303.225	2.206	10	0		DEAEHN
COC(=O)CNC(=O)CCN[C@H](C)c1ccc(C(C)C)cc1	ZINC000171912669	198006787	/nfs/dbraw/zinc/00/67/87/198006787.db2.gz	JKEANIWHARZXCJ-CYBMUJFWSA-N	0	3	306.406	2.140	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2ccc(-n3ccnc3)cc2)CCN1C	ZINC000172620621	198126936	/nfs/dbraw/zinc/12/69/36/198126936.db2.gz	MJJDQNWHASYQOS-YOEHRIQHSA-N	0	3	312.417	2.427	10	0		DEAEHN
C[C@@H](O)C1CCN(C[C@H]2CN(c3ccccc3)C(=O)O2)CC1	ZINC000172801881	198151427	/nfs/dbraw/zinc/15/14/27/198151427.db2.gz	ANXRNLOPMTWBSW-CJNGLKHVSA-N	0	3	304.390	2.105	10	0		DEAEHN
C[C@H](NCC(=O)N[C@H]1CCCc2ccccc21)[C@@H]1CCCO1	ZINC000332907448	539943621	/nfs/dbraw/zinc/94/36/21/539943621.db2.gz	XNFWWWRUXRDCAJ-JQFCIGGWSA-N	0	3	302.418	2.337	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2nc3c(s2)COCC3)CCN1C	ZINC000173241772	198199321	/nfs/dbraw/zinc/19/93/21/198199321.db2.gz	AIFWJLKJJIQWKO-GHMZBOCLSA-N	0	3	324.450	2.162	10	0		DEAEHN
O=C(NCCCOc1ccccc1)N1CC[C@@H](N2CC=CC2)C1	ZINC000173570676	198228944	/nfs/dbraw/zinc/22/89/44/198228944.db2.gz	DCYABIYENGXLMS-MRXNPFEDSA-N	0	3	315.417	2.111	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2cnn(CC(F)F)c2)CCN1C	ZINC000174852968	198392929	/nfs/dbraw/zinc/39/29/29/198392929.db2.gz	PRPYEKHBUHNYQT-ZYHUDNBSSA-N	0	3	315.368	2.095	10	0		DEAEHN
CCCCNC(=O)C[C@@H]1NCCc2cc(OC)c(OC)cc21	ZINC000041536460	354175227	/nfs/dbraw/zinc/17/52/27/354175227.db2.gz	AWXYJLLVZZVKAK-AWEZNQCLSA-N	0	3	306.406	2.197	10	0		DEAEHN
COc1cccc(F)c1[C@@H](C)NC(=O)N[C@H]1CCN(C2CC2)C1	ZINC000074267404	355018809	/nfs/dbraw/zinc/01/88/09/355018809.db2.gz	SYNDMDMBEQEKMD-NEPJUHHUSA-N	0	3	321.396	2.431	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)NC[C@@H]2CCC(C)(C)O2)C1	ZINC000249391675	283095996	/nfs/dbraw/zinc/09/59/96/283095996.db2.gz	ADDSDCOKWQPHDD-QLFBSQMISA-N	0	3	309.454	2.070	10	0		DEAEHN
CN1CC[C@H](NC(=O)C[C@](C)(O)C2CC2)[C@H]1c1ccccc1	ZINC000270399065	283121447	/nfs/dbraw/zinc/12/14/47/283121447.db2.gz	CFFKAODSTQHPEO-JQHSSLGASA-N	0	3	302.418	2.099	10	0		DEAEHN
COCCCCN1CCN(Cc2cnn(C(C)(C)C)c2)CC1	ZINC000117880297	355779060	/nfs/dbraw/zinc/77/90/60/355779060.db2.gz	IFCRCYCYXSPQRI-UHFFFAOYSA-N	0	3	308.470	2.182	10	0		DEAEHN
COc1ccc([C@H](C)NC(=O)NC[C@H]2CCCN2C)cc1OC	ZINC000139681828	355878672	/nfs/dbraw/zinc/87/86/72/355878672.db2.gz	JIVQUUWISMBGOD-GXTWGEPZSA-N	0	3	321.421	2.158	10	0		DEAEHN
NC(=O)C[C@H](NCC(=O)Nc1ccccc1F)C1CCCCC1	ZINC000182016153	356105308	/nfs/dbraw/zinc/10/53/08/356105308.db2.gz	TWEOXFKRJUQYMW-HNNXBMFYSA-N	0	3	321.396	2.178	10	0		DEAEHN
CS(=O)(=O)[C@H]1CCCC[C@@H]1NCCc1cc(F)ccc1F	ZINC000183065654	356158969	/nfs/dbraw/zinc/15/89/69/356158969.db2.gz	SEVSHTATHKXHHV-GJZGRUSLSA-N	0	3	317.401	2.453	10	0		DEAEHN
COc1cc(C[NH2+][C@@H](C)[C@H](C)CO)cc(Br)c1[O-]	ZINC000080204307	192012319	/nfs/dbraw/zinc/01/23/19/192012319.db2.gz	MYNPJDWAZXTQGH-BDAKNGLRSA-N	0	3	318.211	2.270	10	0		DEAEHN
CCS(=O)(=O)NCCCN1CC[C@@H](c2cc(C)cc(C)c2)C1	ZINC000183484024	356174110	/nfs/dbraw/zinc/17/41/10/356174110.db2.gz	FCWJUTLTWAXZEQ-MRXNPFEDSA-N	0	3	324.490	2.422	10	0		DEAEHN
CCN(CC)C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000192937906	356221780	/nfs/dbraw/zinc/22/17/80/356221780.db2.gz	HMSOKGBQEOTEEU-MRXNPFEDSA-N	0	3	304.438	2.297	10	0		DEAEHN
C[C@H](N)c1csc(N2CCN(Cc3ccccc3)CC2)n1	ZINC000080807822	192192651	/nfs/dbraw/zinc/19/26/51/192192651.db2.gz	SNFFHNLWFSNUJJ-ZDUSSCGKSA-N	0	3	302.447	2.485	10	0		DEAEHN
NCc1cc(I)nc(OC(F)(F)F)c1	ZINC000238665884	356305152	/nfs/dbraw/zinc/30/51/52/356305152.db2.gz	MSSBIKQNBYAWJI-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
CNCc1cc(Br)cnc1N1CC[C@H](COC)C1	ZINC000081117386	192228901	/nfs/dbraw/zinc/22/89/01/192228901.db2.gz	WLLDXNNGPDFRAK-JTQLQIEISA-N	0	3	314.227	2.036	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)CCN(c2nc(N)ns2)C1	ZINC000306503906	356404062	/nfs/dbraw/zinc/40/40/62/356404062.db2.gz	XPWONGXFLSGNLY-GFCCVEGCSA-N	0	3	303.435	2.079	10	0		DEAEHN
C[C@@H](CCc1ccco1)N[C@H]1CCCN(c2ncc[nH]c2=O)C1	ZINC000328625896	356462546	/nfs/dbraw/zinc/46/25/46/356462546.db2.gz	DQVFYYHFVKEDNJ-KBPBESRZSA-N	0	3	316.405	2.355	10	0		DEAEHN
C[C@H](CCc1ccco1)N[C@@H]1CCCN(c2ncc[nH]c2=O)C1	ZINC000328625901	356462594	/nfs/dbraw/zinc/46/25/94/356462594.db2.gz	DQVFYYHFVKEDNJ-ZIAGYGMSSA-N	0	3	316.405	2.355	10	0		DEAEHN
CC(C)N1CC[C@H](CNc2nnc(Br)s2)C1	ZINC000081664502	192309449	/nfs/dbraw/zinc/30/94/49/192309449.db2.gz	GNZJOJOYZIVZRM-MRVPVSSYSA-N	0	3	305.245	2.443	10	0		DEAEHN
Brc1csc(CN2CC[C@@H]3OCCN[C@@H]3C2)c1	ZINC000404186536	356732639	/nfs/dbraw/zinc/73/26/39/356732639.db2.gz	FAMIMYLZSCWIFY-NEPJUHHUSA-N	0	3	317.252	2.073	10	0		DEAEHN
CC[NH2+]CCc1ccc(S(=O)(=O)[N-]CC(C)(C)C)s1	ZINC000088985363	192681305	/nfs/dbraw/zinc/68/13/05/192681305.db2.gz	PLTNMQZWRSWRMK-UHFFFAOYSA-N	0	3	304.481	2.225	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)C2C[C@H]3CCC[C@@H](C2)C3=O)CCN1C	ZINC000247159571	291125178	/nfs/dbraw/zinc/12/51/78/291125178.db2.gz	AJTHJEZXIQBCKZ-SRXPKIRMSA-N	0	3	306.450	2.323	10	0		DEAEHN
Cc1ccc(CC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cn1	ZINC000180163166	199125150	/nfs/dbraw/zinc/12/51/50/199125150.db2.gz	ZHKJDMDVVHJCCR-PKOBYXMFSA-N	0	3	309.413	2.494	10	0		DEAEHN
Cc1ccc(-c2noc(NC[C@@H](O)CN3CCCCC3)n2)cc1	ZINC000180224923	199133597	/nfs/dbraw/zinc/13/35/97/199133597.db2.gz	TZCRWNVOGVRHKR-OAHLLOKOSA-N	0	3	316.405	2.304	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N(CC(C)C)C(C)C)nc1	ZINC000089005323	192692700	/nfs/dbraw/zinc/69/27/00/192692700.db2.gz	LXTBJDPRXNOZRZ-UHFFFAOYSA-N	0	3	313.467	2.246	10	0		DEAEHN
Cc1nn(C)cc1[C@H](C)N[C@@H]1CCc2nnc(C(C)C)n2C1	ZINC000180501006	199168397	/nfs/dbraw/zinc/16/83/97/199168397.db2.gz	GUDSZHJXTBYUDY-WCQYABFASA-N	0	3	302.426	2.109	10	0		DEAEHN
COc1ccc(C[C@H](C)C(=O)N2CC[C@@H](N(C)C)C2)cc1OC	ZINC000180703748	199199227	/nfs/dbraw/zinc/19/92/27/199199227.db2.gz	JTTGQGZAPDCNMF-DZGCQCFKSA-N	0	3	320.433	2.045	10	0		DEAEHN
CCn1cc(S(=O)(=O)N2CC[C@H](C)C[C@@H]2C)cc1CNC	ZINC000089023170	192704045	/nfs/dbraw/zinc/70/40/45/192704045.db2.gz	RTARONXXBOHYGL-STQMWFEESA-N	0	3	313.467	2.037	10	0		DEAEHN
CN(C[C@@H](O)c1ccccc1Br)CC1(CO)CC1	ZINC000186772693	200008187	/nfs/dbraw/zinc/00/81/87/200008187.db2.gz	SLDAFLSDTUAGKJ-CYBMUJFWSA-N	0	3	314.223	2.187	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1c[nH]nc1C1CC1	ZINC000187307125	200091749	/nfs/dbraw/zinc/09/17/49/200091749.db2.gz	RFVYJMAPHLYWEE-OAHLLOKOSA-N	0	3	312.417	2.190	10	0		DEAEHN
CO[C@H]1CN(Cc2cn(C)nc2-c2ccncc2)CC[C@@H]1C	ZINC000188313516	200225778	/nfs/dbraw/zinc/22/57/78/200225778.db2.gz	JULMTBPRWBIKRV-BBRMVZONSA-N	0	3	300.406	2.339	10	0		DEAEHN
COC(=O)[C@H](C)Oc1ccc(CN2CC[C@H](C)[C@@H](OC)C2)cc1	ZINC000188332000	200229226	/nfs/dbraw/zinc/22/92/26/200229226.db2.gz	YWDCRUAWZDHZHQ-ZQIUZPCESA-N	0	3	321.417	2.484	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1C	ZINC000188495775	200256632	/nfs/dbraw/zinc/25/66/32/200256632.db2.gz	DODHYHKVUOBSCZ-SWLSCSKDSA-N	0	3	315.417	2.262	10	0		DEAEHN
CC(C)c1n[nH]cc1C(=O)NCCN(C)Cc1ccccc1	ZINC000189215873	200365714	/nfs/dbraw/zinc/36/57/14/200365714.db2.gz	FNEUZDWKLFDTPD-UHFFFAOYSA-N	0	3	300.406	2.395	10	0		DEAEHN
O=C(NCCNc1ccncc1)c1ncoc1-c1ccccc1	ZINC000601550962	360070051	/nfs/dbraw/zinc/07/00/51/360070051.db2.gz	CENRBQGUQQHBSW-UHFFFAOYSA-N	0	3	308.341	2.000	10	0		DEAEHN
C[C@@H](NC(=O)C(=O)c1ccc2c(c1)CCC2)C1CCN(C)CC1	ZINC000603333942	360795765	/nfs/dbraw/zinc/79/57/65/360795765.db2.gz	FDPJRUFQWQFBEG-CYBMUJFWSA-N	0	3	314.429	2.205	10	0		DEAEHN
COc1cccc(C[C@H](C)NC(=O)N[C@H]2CCN(C3CC3)C2)c1	ZINC000604199808	360890039	/nfs/dbraw/zinc/89/00/39/360890039.db2.gz	QFGJRHCBSYUFRA-ZFWWWQNUSA-N	0	3	317.433	2.162	10	0		DEAEHN
CC[C@H](CN1CCCC1)NC(=O)c1cc(-c2cccnc2)on1	ZINC000605372490	360963071	/nfs/dbraw/zinc/96/30/71/360963071.db2.gz	WUWPTMDJODLSNJ-CQSZACIVSA-N	0	3	314.389	2.341	10	0		DEAEHN
CC1CCN(CCNC(=O)Nc2ccc3nccn3c2)CC1	ZINC000606581277	361023358	/nfs/dbraw/zinc/02/33/58/361023358.db2.gz	XMETTYGZFPZNTO-UHFFFAOYSA-N	0	3	301.394	2.188	10	0		DEAEHN
Cc1ncc(CN(C)C[C@]2(O)CCN(Cc3ccccc3)C2)o1	ZINC000628242576	366781439	/nfs/dbraw/zinc/78/14/39/366781439.db2.gz	KKJWQOLYRHKJDH-GOSISDBHSA-N	0	3	315.417	2.052	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2nc3cccnc3s2)CCN1C	ZINC000193958842	201152391	/nfs/dbraw/zinc/15/23/91/201152391.db2.gz	WQSNDJRXJXVPHF-WDEREUQCSA-N	0	3	304.419	2.246	10	0		DEAEHN
COC[C@@H](NC1CCN(C(N)=O)CC1)c1ccc(Cl)cc1	ZINC000194040977	201168322	/nfs/dbraw/zinc/16/83/22/201168322.db2.gz	HYBYYOVPZFZAOA-CQSZACIVSA-N	0	3	311.813	2.160	10	0		DEAEHN
COC(=O)[C@H](C1CC1)N1CC[C@H](N(C)Cc2ccccc2)C1	ZINC000611668759	361654813	/nfs/dbraw/zinc/65/48/13/361654813.db2.gz	QQOQFPALOBGAGW-IRXDYDNUSA-N	0	3	302.418	2.144	10	0		DEAEHN
COC(=O)[C@@H](C1CC1)N1CC[C@@H](N(C)Cc2ccccc2)C1	ZINC000611668757	361654898	/nfs/dbraw/zinc/65/48/98/361654898.db2.gz	QQOQFPALOBGAGW-IAGOWNOFSA-N	0	3	302.418	2.144	10	0		DEAEHN
O=C1[C@@H](NC[C@@H]2CCC=CO2)CCN1Cc1ccc(F)cc1	ZINC000194885862	201305277	/nfs/dbraw/zinc/30/52/77/201305277.db2.gz	LYDMSNLWVFWHFY-HOTGVXAUSA-N	0	3	304.365	2.209	10	0		DEAEHN
CCO[C@H](CNC(=O)N1CC[C@H](N(C)C)C1)c1ccccc1	ZINC000195187151	201355360	/nfs/dbraw/zinc/35/53/60/201355360.db2.gz	TWEQDZHJHNMGBX-JKSUJKDBSA-N	0	3	305.422	2.110	10	0		DEAEHN
c1cc(CN[C@@H]2CCn3ccnc3C2)n(CCc2ccccc2)n1	ZINC000621345281	364361477	/nfs/dbraw/zinc/36/14/77/364361477.db2.gz	HWSNGPZLVCVVJI-QGZVFWFLSA-N	0	3	321.428	2.427	10	0		DEAEHN
c1c(CN2CCOCC3(CCOCC3)C2)oc2ncccc12	ZINC000449240473	240239749	/nfs/dbraw/zinc/23/97/49/240239749.db2.gz	NOONLOAHKWXWDT-UHFFFAOYSA-N	0	3	302.374	2.457	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1ccc(Br)nc1	ZINC000091448525	193057497	/nfs/dbraw/zinc/05/74/97/193057497.db2.gz	GWSUWMKCBTXXJD-LLVKDONJSA-N	0	3	312.211	2.010	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)C2(C(N)=S)CCCCCC2)C1	ZINC000091395329	193051203	/nfs/dbraw/zinc/05/12/03/193051203.db2.gz	FPMXCHFCMSORPN-CYBMUJFWSA-N	0	3	311.495	2.166	10	0		DEAEHN
Cc1n[nH]cc1CN1CCC[C@@H](C(=O)Nc2cccc(C)n2)C1	ZINC000091686729	193091361	/nfs/dbraw/zinc/09/13/61/193091361.db2.gz	RWRMPAJBKVIIDT-CQSZACIVSA-N	0	3	313.405	2.272	10	0		DEAEHN
CC[C@@H]1[NH2+]CC[C@H]1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000624392368	365407692	/nfs/dbraw/zinc/40/76/92/365407692.db2.gz	PRDFKFZJDDVHGT-VHSXEESVSA-N	0	3	323.245	2.412	10	0		DEAEHN
C[C@H]1CC[C@@H]([N-]S(=O)(=O)c2cc(Cl)cc(Cl)c2)C[NH2+]1	ZINC000624406896	365413221	/nfs/dbraw/zinc/41/32/21/365413221.db2.gz	OKDIPRYUFUMFBV-GZMMTYOYSA-N	0	3	323.245	2.412	10	0		DEAEHN
COc1cc(F)cc(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000091928391	193128300	/nfs/dbraw/zinc/12/83/00/193128300.db2.gz	FVKFDBPSLPHCHZ-DOMZBBRYSA-N	0	3	323.412	2.458	10	0		DEAEHN
CN1CCO[C@H](COc2c(Cl)cc(Cl)cc2CN)C1	ZINC000092054305	193149246	/nfs/dbraw/zinc/14/92/46/193149246.db2.gz	GYOCJCTZGRQMKR-NSHDSACASA-N	0	3	305.205	2.162	10	0		DEAEHN
C=C/C(C)=C\CC(=O)Nc1ccc(C(=O)NCCN(C)C)cc1	ZINC000628640563	366911582	/nfs/dbraw/zinc/91/15/82/366911582.db2.gz	GHJIXTGLPMRNAD-NSIKDUERSA-N	0	3	315.417	2.439	10	0		DEAEHN
CCC(=O)CCCN(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782960	242214366	/nfs/dbraw/zinc/21/43/66/242214366.db2.gz	ZTKXIMPQEMIIND-LJQANCHMSA-N	0	3	318.461	2.315	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)c(C)s1	ZINC000092113749	193161711	/nfs/dbraw/zinc/16/17/11/193161711.db2.gz	MHSTZVIYQVEZGK-PHIMTYICSA-N	0	3	316.492	2.443	10	0		DEAEHN
CCNCc1sccc1S(=O)(=O)N1C[C@@H](C)[C@H](C)C1	ZINC000092113803	193161899	/nfs/dbraw/zinc/16/18/99/193161899.db2.gz	IKQHRAUSIIHKPF-GHMZBOCLSA-N	0	3	302.465	2.134	10	0		DEAEHN
CCC[C@](C)(CO)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248067120	284002224	/nfs/dbraw/zinc/00/22/24/284002224.db2.gz	PWCVGEKHXHEHHK-SOLBZPMBSA-N	0	3	319.449	2.282	10	0		DEAEHN
CC(=O)N1CCC[C@H](CNCc2ccnn2CC2CCC2)C1	ZINC000631124847	368030804	/nfs/dbraw/zinc/03/08/04/368030804.db2.gz	SXYQPGAAIVGXOG-MRXNPFEDSA-N	0	3	304.438	2.031	10	0		DEAEHN
c1cc(N2CC(NCc3ccc(OCC4CC4)cc3)C2)ncn1	ZINC000631256270	368105759	/nfs/dbraw/zinc/10/57/59/368105759.db2.gz	DALNTGITSUKLKV-UHFFFAOYSA-N	0	3	310.401	2.244	10	0		DEAEHN
Cn1cc(CN[C@H]2CCCCCN(Cc3ccccc3)C2)nn1	ZINC000631205172	368077483	/nfs/dbraw/zinc/07/74/83/368077483.db2.gz	LCEBIELQSCHXTP-KRWDZBQOSA-N	0	3	313.449	2.350	10	0		DEAEHN
CCN(CCOC)c1nc(C(C)C)c(CNCCOC)s1	ZINC000093000027	193192097	/nfs/dbraw/zinc/19/20/97/193192097.db2.gz	WRBDZHLHRUTDER-UHFFFAOYSA-N	0	3	315.483	2.475	10	0		DEAEHN
Cc1cc2ncc([C@@H](C)NCCCN3CCCC3=O)c(C)n2n1	ZINC000093370053	193240077	/nfs/dbraw/zinc/24/00/77/193240077.db2.gz	ZQLWQCGKTLYQCQ-CYBMUJFWSA-N	0	3	315.421	2.009	10	0		DEAEHN
COc1c(CN2CCN(C3CCC(C)CC3)CC2)c(C)nn1C	ZINC000093386984	193242353	/nfs/dbraw/zinc/24/23/53/193242353.db2.gz	PORZLXSNXQTGAM-UHFFFAOYSA-N	0	3	320.481	2.433	10	0		DEAEHN
CC(C)CO[C@H]1C[C@H](NCC(C)(C)S(C)(=O)=O)C1(C)C	ZINC000093523113	193263240	/nfs/dbraw/zinc/26/32/40/193263240.db2.gz	YBFZRASWHNNPRH-STQMWFEESA-N	0	3	305.484	2.239	10	0		DEAEHN
[NH3+][C@]1(C(=O)[O-])CCC[C@@H]1CCN1CCC(C(F)(F)F)CC1	ZINC000093596151	193271027	/nfs/dbraw/zinc/27/10/27/193271027.db2.gz	SPRWFZKVWVBDTA-ZWNOBZJWSA-N	0	3	308.344	2.233	10	0		DEAEHN
NC(=O)[C@]1(N)CCC[C@@H]1CCSc1ccc(F)c(F)c1	ZINC000093627222	193276778	/nfs/dbraw/zinc/27/67/78/193276778.db2.gz	OSKMJLQLSFGUIP-OTYXRUKQSA-N	0	3	300.374	2.430	10	0		DEAEHN
COc1cc(CN(C)[C@@H](CO)C(C)(C)C)cc2c1OCCO2	ZINC000093821905	193313682	/nfs/dbraw/zinc/31/36/82/193313682.db2.gz	XZJVESCZIYBGJO-HNNXBMFYSA-N	0	3	309.406	2.305	10	0		DEAEHN
CC(C)N[C@@]1(C(N)=O)CC[C@H](N(CC(F)(F)F)C(C)C)C1	ZINC000093826239	193313868	/nfs/dbraw/zinc/31/38/68/193313868.db2.gz	RVVDAKLZZZFQGD-AAEUAGOBSA-N	0	3	309.376	2.034	10	0		DEAEHN
CN[C@@]1(C(N)=O)CC[C@H](Oc2ccccc2C(F)(F)F)C1	ZINC000093836632	193314840	/nfs/dbraw/zinc/31/48/40/193314840.db2.gz	ZRSPGFPJAXFYPG-ZANVPECISA-N	0	3	302.296	2.080	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccccc1Cl)N(C)CCS(C)(=O)=O	ZINC000094297394	193356626	/nfs/dbraw/zinc/35/66/26/193356626.db2.gz	VOILHYLVCXBHMJ-ZIAGYGMSSA-N	0	3	318.870	2.095	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)cc1)N(C)CCS(C)(=O)=O	ZINC000094297105	193357100	/nfs/dbraw/zinc/35/71/00/193357100.db2.gz	YHXCGAPWAQZICU-KGLIPLIRSA-N	0	3	318.870	2.095	10	0		DEAEHN
CCC(C)(C)NC(=O)COc1c(F)cc(CNC)cc1F	ZINC000094346521	193363339	/nfs/dbraw/zinc/36/33/39/193363339.db2.gz	NQYCADVBOQGSPV-UHFFFAOYSA-N	0	3	300.349	2.368	10	0		DEAEHN
CCCNC(=O)[C@@H](C)Oc1c(F)cc(CNCC)cc1F	ZINC000094346785	193363694	/nfs/dbraw/zinc/36/36/94/193363694.db2.gz	CCOMNAVSVWNZJQ-SNVBAGLBSA-N	0	3	300.349	2.368	10	0		DEAEHN
CCNCc1c(C)nn([C@H]2CCC[C@H](S(C)(=O)=O)C2)c1C	ZINC000094643982	193389640	/nfs/dbraw/zinc/38/96/40/193389640.db2.gz	BRGCSZQZOQXFBE-KBPBESRZSA-N	0	3	313.467	2.138	10	0		DEAEHN
COc1cc(Br)c(C(=O)[C@H]2CCCN2)c(OC)c1	ZINC000094649895	193390719	/nfs/dbraw/zinc/39/07/19/193390719.db2.gz	QGXANBSIHJWIHM-SNVBAGLBSA-N	0	3	314.179	2.401	10	0		DEAEHN
COc1cc(Br)c(C(=O)[C@@H]2CCCN2)c(OC)c1	ZINC000094649894	193391006	/nfs/dbraw/zinc/39/10/06/193391006.db2.gz	QGXANBSIHJWIHM-JTQLQIEISA-N	0	3	314.179	2.401	10	0		DEAEHN
C[C@@H](C1CC1)n1nccc1NC(=O)N1CCN2CCC[C@H]2C1	ZINC000274917110	212031718	/nfs/dbraw/zinc/03/17/18/212031718.db2.gz	LHRQFMKSYKEXPP-JSGCOSHPSA-N	0	3	303.410	2.166	10	0		DEAEHN
COc1ccc(Cl)cc1C[C@H](N)[C@@H]1CCCCS1(=O)=O	ZINC000161949865	197532197	/nfs/dbraw/zinc/53/21/97/197532197.db2.gz	KHWKWQKMIAZPPR-JSGCOSHPSA-N	0	3	317.838	2.186	10	0		DEAEHN
CCN1CCN([C@H](CN)c2ccccc2Br)CC1	ZINC000019439086	182122864	/nfs/dbraw/zinc/12/28/64/182122864.db2.gz	SSZRZESPXZXZSM-CQSZACIVSA-N	0	3	312.255	2.086	10	0		DEAEHN
O=S1(=O)C[C@H](NCc2ccccc2)[C@@H](c2ccccc2)C1	ZINC000019794338	182150132	/nfs/dbraw/zinc/15/01/32/182150132.db2.gz	VMIVEXMISUDXGH-SJORKVTESA-N	0	3	301.411	2.357	10	0		DEAEHN
NC[C@H](c1ccccc1F)N1CCN(c2nccs2)CC1	ZINC000019990095	182174378	/nfs/dbraw/zinc/17/43/78/182174378.db2.gz	SMYQBGZLGWOAAV-CQSZACIVSA-N	0	3	306.410	2.104	10	0		DEAEHN
Cc1ccc(CN)cc1S(=O)(=O)N(C)Cc1ccccc1	ZINC000020189410	182195282	/nfs/dbraw/zinc/19/52/82/182195282.db2.gz	XTKNXEYHVZGFDD-UHFFFAOYSA-N	0	3	304.415	2.274	10	0		DEAEHN
CC(=O)c1cccc(O[C@H](C)C(=O)N2CCC[C@H]2CN(C)C)c1	ZINC000267504777	206112632	/nfs/dbraw/zinc/11/26/32/206112632.db2.gz	HCJCQKBRHCQDTJ-ZBFHGGJFSA-N	0	3	318.417	2.209	10	0		DEAEHN
Cc1ccccc1CN[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000035230386	182763676	/nfs/dbraw/zinc/76/36/76/182763676.db2.gz	MRVYSPFMHDIQLK-ZDUSSCGKSA-N	0	3	304.415	2.493	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N(C)C[C@@H](C)C(=O)OC(C)(C)C	ZINC000458369639	248278755	/nfs/dbraw/zinc/27/87/55/248278755.db2.gz	WCYHREOBHFJHQF-KGLIPLIRSA-N	0	3	312.454	2.297	10	0		DEAEHN
O=C([C@H]1CCCN(Cc2ccccc2Cl)C1)N1CCOCC1	ZINC000038832725	183011559	/nfs/dbraw/zinc/01/15/59/183011559.db2.gz	PBIMCSUCZNLMJD-HNNXBMFYSA-N	0	3	322.836	2.411	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2ccc(C)cc2Br)C1	ZINC000040629750	183111147	/nfs/dbraw/zinc/11/11/47/183111147.db2.gz	KLWSIRSZASJVAD-BXKDBHETSA-N	0	3	313.195	2.073	10	0		DEAEHN
CN1CCC[C@H](Nc2c(C(N)=S)cnc3ccccc32)C1	ZINC000040716156	183123000	/nfs/dbraw/zinc/12/30/00/183123000.db2.gz	NLMMXGBOSUINNB-NSHDSACASA-N	0	3	300.431	2.375	10	0		DEAEHN
CCOc1cc(/C=C\C(=O)N[C@@H]2CCCN(CC)C2)ccc1O	ZINC000493445507	249296394	/nfs/dbraw/zinc/29/63/94/249296394.db2.gz	BFDOBEIPTUMTPA-WKTRQSJXSA-N	0	3	318.417	2.405	10	0		DEAEHN
COCCCN(CCOC)[C@@H](CN)c1ccccc1Cl	ZINC000042420996	183267931	/nfs/dbraw/zinc/26/79/31/183267931.db2.gz	LDIRDCRZGIOHFZ-HNNXBMFYSA-N	0	3	300.830	2.325	10	0		DEAEHN
CNCc1c(N(CCO)C2CCCCC2)nc2sccn12	ZINC000042512066	183278709	/nfs/dbraw/zinc/27/87/09/183278709.db2.gz	PQXKRBOOGBVLPB-UHFFFAOYSA-N	0	3	308.451	2.247	10	0		DEAEHN
CC[C@H](C)N(CCOC)S(=O)(=O)c1cccc([C@@H](C)N)c1	ZINC000042593849	183289493	/nfs/dbraw/zinc/28/94/93/183289493.db2.gz	WMQQVIKRVDJDTH-QWHCGFSZSA-N	0	3	314.451	2.142	10	0		DEAEHN
CCN(CC(F)(F)F)[C@H](C)C(=O)Nc1ccccc1CN	ZINC000042739561	183303927	/nfs/dbraw/zinc/30/39/27/183303927.db2.gz	GVCKYLMWCSFESA-SNVBAGLBSA-N	0	3	303.328	2.357	10	0		DEAEHN
C[C@H](N)[C@@H](c1cccc(Cl)c1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043014540	183327741	/nfs/dbraw/zinc/32/77/41/183327741.db2.gz	WCXGXLMDUHLYAQ-GLQYFDAESA-N	0	3	309.841	2.281	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccccc1Cl)N1CCC[C@@H]1C(=O)NC	ZINC000043052326	183332900	/nfs/dbraw/zinc/33/29/00/183332900.db2.gz	NJGGABSHIPYHST-KFWWJZLASA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccccc1Cl)N(C)CC(=O)NC1CC1	ZINC000043051478	183332944	/nfs/dbraw/zinc/33/29/44/183332944.db2.gz	JWHIXGHNOKABNN-HOCLYGCPSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)s1)N(CC(N)=O)C(C)C	ZINC000043253844	183347869	/nfs/dbraw/zinc/34/78/69/183347869.db2.gz	DCPYARSVOUEUML-ZANVPECISA-N	0	3	303.859	2.376	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccc(Br)s1)N1CCOCC1	ZINC000043258526	183348183	/nfs/dbraw/zinc/34/81/83/183348183.db2.gz	BJGPKJWDBUZDSZ-LDYMZIIASA-N	0	3	305.241	2.231	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccc(Br)s1)N1CCC[C@@H]1CO	ZINC000043261344	183349257	/nfs/dbraw/zinc/34/92/57/183349257.db2.gz	XNMCCSBEQTVXFP-SBMIAAHKSA-N	0	3	319.268	2.356	10	0		DEAEHN
COCCCN(CCOC)[C@@H](CN)c1ccc(Cl)c(F)c1	ZINC000043390593	183358039	/nfs/dbraw/zinc/35/80/39/183358039.db2.gz	XVIGTYQBZOIWNS-HNNXBMFYSA-N	0	3	318.820	2.464	10	0		DEAEHN
C[C@H](NC(=O)N1CCC[C@@H]1CN1CCCCC1)[C@@H]1CCCO1	ZINC000105146481	194078871	/nfs/dbraw/zinc/07/88/71/194078871.db2.gz	RUZJGLVQZKBYRY-XHSDSOJGSA-N	0	3	309.454	2.214	10	0		DEAEHN
C[C@@H](O)CN1CCN(CCOc2ccc(Cl)cc2)C[C@H]1C	ZINC000105821076	194135683	/nfs/dbraw/zinc/13/56/83/194135683.db2.gz	WSQMTBHAPRPDSU-ZIAGYGMSSA-N	0	3	312.841	2.106	10	0		DEAEHN
Cc1noc(C)c1CN(C)C1CCN(CCn2cccn2)CC1	ZINC000105863056	194150559	/nfs/dbraw/zinc/15/05/59/194150559.db2.gz	QNKAFDJBLNYTIW-UHFFFAOYSA-N	0	3	317.437	2.084	10	0		DEAEHN
CC[C@H]1CN(Cc2cc(OC)ccc2OC)CCN1CCOC	ZINC000106115330	194187414	/nfs/dbraw/zinc/18/74/14/194187414.db2.gz	KXCDAPHWRUMXGQ-INIZCTEOSA-N	0	3	322.449	2.246	10	0		DEAEHN
CC(C)(C)NC(=O)[C@@H](CN)Cc1ccccc1OC(F)F	ZINC000050304435	183781971	/nfs/dbraw/zinc/78/19/71/183781971.db2.gz	XHXXUAONUKNSEH-LLVKDONJSA-N	0	3	300.349	2.320	10	0		DEAEHN
CC[C@@H]1CN(Cc2ncc(C)c(OC)c2C)CCN1CCOC	ZINC000110031114	194304310	/nfs/dbraw/zinc/30/43/10/194304310.db2.gz	LXUPZUXUHJENRS-MRXNPFEDSA-N	0	3	321.465	2.250	10	0		DEAEHN
CC[C@@H](C(N)=S)N1CCN(CCCc2ccccc2)CC1	ZINC000110460809	194332265	/nfs/dbraw/zinc/33/22/65/194332265.db2.gz	CGSBCIYLKACXKB-INIZCTEOSA-N	0	3	305.491	2.302	10	0		DEAEHN
CCNCc1cc(Br)cnc1O[C@@H]1CCOC1	ZINC000110532503	194337016	/nfs/dbraw/zinc/33/70/16/194337016.db2.gz	JTQGVMWYJFPEHM-LLVKDONJSA-N	0	3	301.184	2.121	10	0		DEAEHN
CN(C[C@H]1CCCOC1)[C@@H](CN)c1ccc(Br)o1	ZINC000111157818	194396707	/nfs/dbraw/zinc/39/67/07/194396707.db2.gz	ISHFIAQHFMGXRJ-MNOVXSKESA-N	0	3	317.227	2.400	10	0		DEAEHN
CN(CC1CCOCC1)[C@H](CN)c1ccc(Br)o1	ZINC000111159507	194397168	/nfs/dbraw/zinc/39/71/68/194397168.db2.gz	CSORCRYAXLSHPF-LLVKDONJSA-N	0	3	317.227	2.400	10	0		DEAEHN
COC(=O)[C@H](NC1CCN([C@@H](C)c2ccncc2)CC1)C1CC1	ZINC000358844666	291765256	/nfs/dbraw/zinc/76/52/56/291765256.db2.gz	DTDUBDYHLNNVDS-SUMWQHHRSA-N	0	3	317.433	2.148	10	0		DEAEHN
CC(C)NCCS(=O)(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000061627357	184178998	/nfs/dbraw/zinc/17/89/98/184178998.db2.gz	HDAPTULMUVDEHB-UHFFFAOYSA-N	0	3	324.368	2.123	10	0		DEAEHN
C[C@H]1CN([C@@H](CN)c2cc3c(c(Cl)c2)OCO3)CCCO1	ZINC000061915084	184195189	/nfs/dbraw/zinc/19/51/89/184195189.db2.gz	DZKQQCDWSFPJDW-GWCFXTLKSA-N	0	3	312.797	2.179	10	0		DEAEHN
CCCN1C(=O)CC[C@H](N)[C@@H]1c1ccc(Br)o1	ZINC000062212213	184221750	/nfs/dbraw/zinc/22/17/50/184221750.db2.gz	KWBZKJRJHADFQA-QPUJVOFHSA-N	0	3	301.184	2.443	10	0		DEAEHN
NC[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CCCCC1	ZINC000062706170	184248742	/nfs/dbraw/zinc/24/87/42/184248742.db2.gz	GMBQTWXZZJWJHX-NSHDSACASA-N	0	3	300.324	2.234	10	0		DEAEHN
N[C@@H](CNC(=O)c1ccc(Br)cn1)c1ccccc1	ZINC000062837665	184255571	/nfs/dbraw/zinc/25/55/71/184255571.db2.gz	XMKDGVXSMFBKLB-LBPRGKRZSA-N	0	3	320.190	2.274	10	0		DEAEHN
O=S(=O)(C[C@H]1CCCCN1)N1CCC2(CCCC2)CC1	ZINC000062960094	184262567	/nfs/dbraw/zinc/26/25/67/184262567.db2.gz	GSHOUTOIKZVQFF-CQSZACIVSA-N	0	3	300.468	2.115	10	0		DEAEHN
[NH3+]CCCCS(=O)(=O)[N-]c1cc(C(F)(F)F)ccc1F	ZINC000062657349	184246644	/nfs/dbraw/zinc/24/66/44/184246644.db2.gz	URZUXWPOHBSXIE-UHFFFAOYSA-N	0	3	314.304	2.325	10	0		DEAEHN
Brc1ccc(-c2cc(N3CCNCC3)n[nH]2)s1	ZINC000062669992	184247360	/nfs/dbraw/zinc/24/73/60/184247360.db2.gz	LGIXEBIGDOJEFZ-UHFFFAOYSA-N	0	3	313.224	2.310	10	0		DEAEHN
COc1cc(CN(C)C[C@H]2CCCOC2)cc2c1OCCO2	ZINC000119738556	195028031	/nfs/dbraw/zinc/02/80/31/195028031.db2.gz	QNOWKRNFWCTYBV-CYBMUJFWSA-N	0	3	307.390	2.325	10	0		DEAEHN
CCC1(CNC(=O)NC[C@H](O)CN2CCCCC2)CCCC1	ZINC000119906134	195058846	/nfs/dbraw/zinc/05/88/46/195058846.db2.gz	HXLPVBHQKKPXCW-HNNXBMFYSA-N	0	3	311.470	2.103	10	0		DEAEHN
CC(C)[C@@H]1CN[C@@](C)(c2ccccc2)CN1CC[S@](C)=O	ZINC000159181816	197334048	/nfs/dbraw/zinc/33/40/48/197334048.db2.gz	HCVCOXZEQCMUAY-CSODHUTKSA-N	0	3	308.491	2.210	10	0		DEAEHN
COCCC[C@@H](N)C(=O)N[C@@H]1CCSc2ccc(F)cc21	ZINC000159172939	197333374	/nfs/dbraw/zinc/33/33/74/197333374.db2.gz	ZUEHSMOTPZJDLN-CHWSQXEVSA-N	0	3	312.410	2.233	10	0		DEAEHN
Cc1cc(S(=O)(=O)NCc2ccsc2)cc(CN)c1F	ZINC000159115824	197328596	/nfs/dbraw/zinc/32/85/96/197328596.db2.gz	ZIWVZZHTLJRHFB-UHFFFAOYSA-N	0	3	314.407	2.133	10	0		DEAEHN
Cc1cc(S(=O)(=O)N[C@@H]2C[C@@H]2C)cc(CNC(C)C)c1F	ZINC000159110078	197328217	/nfs/dbraw/zinc/32/82/17/197328217.db2.gz	SLRIBBTYAVBLIC-IINYFYTJSA-N	0	3	314.426	2.319	10	0		DEAEHN
CCCNCc1cc(S(=O)(=O)N(C)C2CC2)cc(C)c1F	ZINC000159061389	197323889	/nfs/dbraw/zinc/32/38/89/197323889.db2.gz	CQSWNIQHYBQOCS-UHFFFAOYSA-N	0	3	314.426	2.417	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)c1cccc(C)c1)[C@@H]1CCOC1	ZINC000158863780	197307598	/nfs/dbraw/zinc/30/75/98/197307598.db2.gz	FFGVFLJEMIZKFW-ZBFHGGJFSA-N	0	3	311.447	2.173	10	0		DEAEHN
O=C1NCCCC[C@H]1N1CCC(OCCc2ccccc2)CC1	ZINC000120227295	195123153	/nfs/dbraw/zinc/12/31/53/195123153.db2.gz	CTJADFWWYUAEPX-GOSISDBHSA-N	0	3	316.445	2.379	10	0		DEAEHN
NCc1cc(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)ccc1Cl	ZINC000158757931	197299266	/nfs/dbraw/zinc/29/92/66/197299266.db2.gz	XFCKWHDQTRNYHT-QWRGUYRKSA-N	0	3	314.838	2.219	10	0		DEAEHN
CC1(C)CNC[C@H](COc2nc(Br)cs2)O1	ZINC000158631192	197289635	/nfs/dbraw/zinc/28/96/35/197289635.db2.gz	VRDRZHWPMXZBDE-SSDOTTSWSA-N	0	3	307.213	2.051	10	0		DEAEHN
CNCc1cnc(Oc2cccc(S(C)(=O)=O)c2)c(C)c1	ZINC000158414022	197269990	/nfs/dbraw/zinc/26/99/90/197269990.db2.gz	KYMKCQRHONJCBK-UHFFFAOYSA-N	0	3	306.387	2.305	10	0		DEAEHN
C[C@H](CCO)NC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000157986506	197233191	/nfs/dbraw/zinc/23/31/91/197233191.db2.gz	UFSXISJHSOQMLR-NVXWUHKLSA-N	0	3	319.449	2.111	10	0		DEAEHN
CN(CCc1nccs1)C[C@H](O)COCc1ccccc1	ZINC000157708361	197209652	/nfs/dbraw/zinc/20/96/52/197209652.db2.gz	WCDGOGVNIUFOSO-HNNXBMFYSA-N	0	3	306.431	2.195	10	0		DEAEHN
CC(C)(C)[C@@H](N)C(=O)NCCc1ccc(OC(F)F)cc1	ZINC000157586258	197200183	/nfs/dbraw/zinc/20/01/83/197200183.db2.gz	APYDIGHSWOLOTH-LBPRGKRZSA-N	0	3	300.349	2.320	10	0		DEAEHN
CNc1nc(NCc2sccc2C)nc(N2CCCC2)n1	ZINC000157507742	197192402	/nfs/dbraw/zinc/19/24/02/197192402.db2.gz	AISRYCZMYKOVQE-UHFFFAOYSA-N	0	3	304.423	2.496	10	0		DEAEHN
Cc1cccc2nc(N)n(-c3ccc(S(C)(=O)=O)cc3)c21	ZINC000157307220	197178599	/nfs/dbraw/zinc/17/85/99/197178599.db2.gz	QUBHMWLSZKVFDO-UHFFFAOYSA-N	0	3	301.371	2.320	10	0		DEAEHN
CCOCCN(C)S(=O)(=O)c1cccc([C@@H](CC)NC)c1	ZINC000157292389	197177596	/nfs/dbraw/zinc/17/75/96/197177596.db2.gz	KXTDLVLCKDHENM-OAHLLOKOSA-N	0	3	314.451	2.014	10	0		DEAEHN
Cc1cc(N(C)CCc2ccccn2)c(C(N)=S)c(C)n1	ZINC000156621774	197128175	/nfs/dbraw/zinc/12/81/75/197128175.db2.gz	URFCTWGDCIMUQL-UHFFFAOYSA-N	0	3	300.431	2.407	10	0		DEAEHN
NCc1ccccc1NC(=O)CC[S@](=O)c1cccs1	ZINC000155970120	197077961	/nfs/dbraw/zinc/07/79/61/197077961.db2.gz	JCHQAWFETSDYLV-HXUWFJFHSA-N	0	3	308.428	2.343	10	0		DEAEHN
NCc1ccccc1NC(=O)C[S@@](=O)Cc1ccccc1	ZINC000155959195	197077693	/nfs/dbraw/zinc/07/76/93/197077693.db2.gz	PHCRRUOGFKZJNP-OAQYLSRUSA-N	0	3	302.399	2.033	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2ccc(N3CCCC3)nc2)C1	ZINC000155435441	197055189	/nfs/dbraw/zinc/05/51/89/197055189.db2.gz	XLQGQMGZQVFWCU-ZBFHGGJFSA-N	0	3	316.449	2.140	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)N1C[C@@H](C)C[C@H](C)C1	ZINC000245477354	285241691	/nfs/dbraw/zinc/24/16/91/285241691.db2.gz	UILNYGISCDVHAH-MWDXBVQZSA-N	0	3	309.498	2.296	10	0		DEAEHN
c1c(CNCCN2C[C@H]3CC[C@@H](C2)O3)[nH]nc1-c1ccccc1	ZINC000560278434	291926051	/nfs/dbraw/zinc/92/60/51/291926051.db2.gz	OBDNRNLPRKWMLT-CALCHBBNSA-N	0	3	312.417	2.030	10	0		DEAEHN
Cc1cc(C(=O)N2Cc3cncn3[C@H](CN(C)C)C2)sc1C	ZINC000248112291	257109404	/nfs/dbraw/zinc/10/94/04/257109404.db2.gz	KKSSBJALEVANHP-CQSZACIVSA-N	0	3	318.446	2.320	10	0		DEAEHN
CO[C@@H]1CCN(CC2CC2)[C@H]2CN(Cc3ccncc3)C[C@H]21	ZINC000247849536	257116071	/nfs/dbraw/zinc/11/60/71/257116071.db2.gz	QPRPFIMMKKWKRV-FGTMMUONSA-N	0	3	301.434	2.013	10	0		DEAEHN
O=C(NCC1CC1)[C@@H]1C[C@H]2CCN(Cc3ccccc3)C[C@@H]2O1	ZINC000247480404	257119286	/nfs/dbraw/zinc/11/92/86/257119286.db2.gz	IRTWMMXXPWDVEM-SQNIBIBYSA-N	0	3	314.429	2.192	10	0		DEAEHN
CCC[C@@H]1CN(C[C@](C)(O)c2ccccc2)CCN1CCOC	ZINC000121798145	195348911	/nfs/dbraw/zinc/34/89/11/195348911.db2.gz	HQVCQAOZQCBYTB-MOPGFXCFSA-N	0	3	320.477	2.327	10	0		DEAEHN
C[C@@H]1C[C@]2(CCN1C(=O)OC(C)(C)C)NCCc1ncn(C)c12	ZINC000725242528	542769765	/nfs/dbraw/zinc/76/97/65/542769765.db2.gz	CCOAJLOSKMXREB-PXAZEXFGSA-N	0	3	320.437	2.181	10	0		DEAEHN
COCCCN1C[C@]2(C[C@@H]2N)c2cc(Br)ccc21	ZINC000725247287	542770292	/nfs/dbraw/zinc/77/02/92/542770292.db2.gz	LUINRVMLHZSZST-UONOGXRCSA-N	0	3	311.223	2.274	10	0		DEAEHN
C[C@H]1CN(CC(=O)NCCc2cccc3cccnc32)C[C@H]1C	ZINC000362445933	133231123	/nfs/dbraw/zinc/23/11/23/133231123.db2.gz	FSSGOBUUICQZMZ-GASCZTMLSA-N	0	3	311.429	2.481	10	0		DEAEHN
O[C@H](COC1CCOCC1)CN1CCCC[C@@H]1c1ccco1	ZINC000368550405	133277782	/nfs/dbraw/zinc/27/77/82/133277782.db2.gz	ZKIQFSPLAXSXHV-GOEBONIOSA-N	0	3	309.406	2.363	10	0		DEAEHN
c1ccn2c(c1)nnc2C1CCN(CCOC2CCC2)CC1	ZINC000376503645	133297667	/nfs/dbraw/zinc/29/76/67/133297667.db2.gz	UJKHVESNUWEEHD-UHFFFAOYSA-N	0	3	300.406	2.478	10	0		DEAEHN
CCN1CCCN(C(=O)CC2(CC(=O)OC)CCCC2)CC1	ZINC000372738795	133364101	/nfs/dbraw/zinc/36/41/01/133364101.db2.gz	JUUYIPXWIDNHOY-UHFFFAOYSA-N	0	3	310.438	2.054	10	0		DEAEHN
CC[C@H](C)[C@@H](C)C(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000184061170	144938813	/nfs/dbraw/zinc/93/88/13/144938813.db2.gz	OXGIXCLCXXXGMG-BBWFWOEESA-N	0	3	309.498	2.297	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)Cc2ccc(-n3ccnc3)nc2)C1	ZINC000187908357	145004742	/nfs/dbraw/zinc/00/47/42/145004742.db2.gz	VSALUCWHQQWYTF-PBHICJAKSA-N	0	3	300.406	2.250	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N(C)[C@H](CO)CC(C)C	ZINC000188407270	145011507	/nfs/dbraw/zinc/01/15/07/145011507.db2.gz	MEEPDLZHKCQGPY-GJZGRUSLSA-N	0	3	301.475	2.011	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@@H]1CCCN1C[C@H](O)CC(F)(F)F	ZINC000189215925	145023824	/nfs/dbraw/zinc/02/38/24/145023824.db2.gz	PYQVMNQZIJGJNQ-NEPJUHHUSA-N	0	3	305.344	2.487	10	0		DEAEHN
CN(CC1CC(O)C1)[C@@H]1CCCN(c2cccc(F)c2)C1=O	ZINC000190153345	145038493	/nfs/dbraw/zinc/03/84/93/145038493.db2.gz	PTYIJHUAQQXQJI-VDSRIPIWSA-N	0	3	306.381	2.024	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@H](C)N1CCC(c2n[nH]c(CC)n2)CC1	ZINC000190662783	145045577	/nfs/dbraw/zinc/04/55/77/145045577.db2.gz	PFJJJIRFRJEPHF-STQMWFEESA-N	0	3	321.469	2.240	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@H](C)N1CCC(c2nc(CC)n[nH]2)CC1	ZINC000190662783	145045578	/nfs/dbraw/zinc/04/55/78/145045578.db2.gz	PFJJJIRFRJEPHF-STQMWFEESA-N	0	3	321.469	2.240	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@H](C)N1CCC(c2nnc(CC)[nH]2)CC1	ZINC000190662783	145045579	/nfs/dbraw/zinc/04/55/79/145045579.db2.gz	PFJJJIRFRJEPHF-STQMWFEESA-N	0	3	321.469	2.240	10	0		DEAEHN
CCC(C)(C)CNC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000190779722	145048089	/nfs/dbraw/zinc/04/80/89/145048089.db2.gz	WFDMBAYVPGSECM-MRXNPFEDSA-N	0	3	324.513	2.234	10	0		DEAEHN
COc1ccc(C(=O)N2CC[C@H](N(C)C)C2)c(OC(F)F)c1	ZINC000191173390	145054267	/nfs/dbraw/zinc/05/42/67/145054267.db2.gz	GZLZNDUNXJCFJQ-JTQLQIEISA-N	0	3	314.332	2.073	10	0		DEAEHN
c1cc(OCC2CC2)ccc1CN1CC[C@@H](N2CCOCC2)C1	ZINC000191255702	145054684	/nfs/dbraw/zinc/05/46/84/145054684.db2.gz	QGCHTTDKPUJEJF-GOSISDBHSA-N	0	3	316.445	2.382	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2cccc(SC(F)F)c2)C1	ZINC000191920373	145067534	/nfs/dbraw/zinc/06/75/34/145067534.db2.gz	ZVNJZAHRKIFBGB-GXSJLCMTSA-N	0	3	302.346	2.317	10	0		DEAEHN
Cc1csc([C@@H]2CCCN(CCN3CCO[C@H](C)C3)C2)n1	ZINC000192728943	145078044	/nfs/dbraw/zinc/07/80/44/145078044.db2.gz	IQZDQZVADNONPR-HUUCEWRRSA-N	0	3	309.479	2.352	10	0		DEAEHN
O=C(NC[C@@H]1CCN(C2CC2)C1)c1csc(C(F)(F)F)n1	ZINC000192823602	145079521	/nfs/dbraw/zinc/07/95/21/145079521.db2.gz	RFEQZFYNRFIWGW-QMMMGPOBSA-N	0	3	319.352	2.376	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC[C@@H]1c1c(C)nn(C)c1C	ZINC000193379734	145085897	/nfs/dbraw/zinc/08/58/97/145085897.db2.gz	CIXMKQYUSZUPNQ-HZPDHXFCSA-N	0	3	309.454	2.351	10	0		DEAEHN
COC(=O)[C@@H]1C[C@H](c2ccccc2)CN(C[C@H]2CCCO2)C1	ZINC000246347061	145099131	/nfs/dbraw/zinc/09/91/31/145099131.db2.gz	VNRCAVXMQWQXIN-GVDBMIGSSA-N	0	3	303.402	2.444	10	0		DEAEHN
CCc1cc(N2CCC[C@H](N[C@H](C)c3cnccn3)C2)ncn1	ZINC000246364008	145100265	/nfs/dbraw/zinc/10/02/65/145100265.db2.gz	ITBVRKJEZOPMIQ-HIFRSBDPSA-N	0	3	312.421	2.149	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)cc1C	ZINC000246409123	145101974	/nfs/dbraw/zinc/10/19/74/145101974.db2.gz	LVDNGDBLRHXQQI-GDBMZVCRSA-N	0	3	317.433	2.087	10	0		DEAEHN
Cc1ccc([C@H](C)NC(=O)CN2CCN3CCC[C@H]3C2)cc1C	ZINC000246573456	145107034	/nfs/dbraw/zinc/10/70/34/145107034.db2.gz	RQECHNGINRRBQG-WMZOPIPTSA-N	0	3	315.461	2.261	10	0		DEAEHN
COc1ccccc1NCC(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000246668202	145109808	/nfs/dbraw/zinc/10/98/08/145109808.db2.gz	FDZLCRFMPUTEDZ-HOCLYGCPSA-N	0	3	317.433	2.050	10	0		DEAEHN
CCC(C)(C)NC(=O)[C@H](C)N1CCC[C@H]1Cn1ccnc1C	ZINC000246915123	145119013	/nfs/dbraw/zinc/11/90/13/145119013.db2.gz	GFYKTKVHSZTWRA-ZFWWWQNUSA-N	0	3	306.454	2.349	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCO[C@@H](c2ccc(C)o2)C1	ZINC000246956130	145120248	/nfs/dbraw/zinc/12/02/48/145120248.db2.gz	SMSPYRLRDNPGNY-GDBMZVCRSA-N	0	3	321.421	2.155	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)C(=O)c1ccc(Cl)cc1	ZINC000247062886	145124862	/nfs/dbraw/zinc/12/48/62/145124862.db2.gz	HJHKSJOVUYHZJI-FZMZJTMJSA-N	0	3	306.793	2.218	10	0		DEAEHN
c1ccc(CCc2noc(CN3CCN4CCC[C@H]4C3)n2)cc1	ZINC000247190096	145129222	/nfs/dbraw/zinc/12/92/22/145129222.db2.gz	BQASOIKFJOLIGY-INIZCTEOSA-N	0	3	312.417	2.135	10	0		DEAEHN
Cc1ccc(C)c(OCCN2CCN(C[C@@H](C)O)[C@@H](C)C2)c1	ZINC000247400629	145136039	/nfs/dbraw/zinc/13/60/39/145136039.db2.gz	YJFGEKHPMFBFRK-DLBZAZTESA-N	0	3	306.450	2.069	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)[C@H](Cc2ccccc2)N(C)C)C1	ZINC000247471593	145138649	/nfs/dbraw/zinc/13/86/49/145138649.db2.gz	VHNGWBXSNPEKPH-NXHRZFHOSA-N	0	3	317.477	2.004	10	0		DEAEHN
CCc1ccc(S(=O)(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cc1	ZINC000247669766	145142970	/nfs/dbraw/zinc/14/29/70/145142970.db2.gz	ZFTFBMAOQBBKTK-DOTOQJQBSA-N	0	3	322.474	2.354	10	0		DEAEHN
COC(=O)c1ccccc1OCCN1CC[C@H]2OCCC[C@H]2C1	ZINC000248425173	145154182	/nfs/dbraw/zinc/15/41/82/145154182.db2.gz	NVNQOTGANHMPLU-GOEBONIOSA-N	0	3	319.401	2.353	10	0		DEAEHN
Cc1cccc(OCCNC(=O)[C@H](C)N[C@H](C)[C@H]2CCCO2)c1	ZINC000248584798	145159898	/nfs/dbraw/zinc/15/98/98/145159898.db2.gz	JJPOIBKEVTXLBW-HLLBOEOZSA-N	0	3	320.433	2.036	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccncc1	ZINC000248712649	145165059	/nfs/dbraw/zinc/16/50/59/145165059.db2.gz	BMKVAHZTCCUNLQ-CRAIPNDOSA-N	0	3	309.413	2.261	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccncn1	ZINC000248759197	145166734	/nfs/dbraw/zinc/16/67/34/145166734.db2.gz	JDPGMZCNXDANJA-DZGCQCFKSA-N	0	3	311.389	2.119	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccn(C)n1	ZINC000248816564	145168520	/nfs/dbraw/zinc/16/85/20/145168520.db2.gz	KZGARPMJNMYXNY-DZGCQCFKSA-N	0	3	313.405	2.062	10	0		DEAEHN
O=C1O[C@@H](CN2CC[C@@H](CNc3ccccn3)C2)CC12CCC2	ZINC000248908914	145173313	/nfs/dbraw/zinc/17/33/13/145173313.db2.gz	XMHGRHPHDHQXIV-LSDHHAIUSA-N	0	3	315.417	2.301	10	0		DEAEHN
O=C1O[C@@H](CN2CC[C@H](CNc3ccccn3)C2)CC12CCC2	ZINC000248908909	145173889	/nfs/dbraw/zinc/17/38/89/145173889.db2.gz	XMHGRHPHDHQXIV-HUUCEWRRSA-N	0	3	315.417	2.301	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cn2ccnc2s1	ZINC000248966086	145174425	/nfs/dbraw/zinc/17/44/25/145174425.db2.gz	RUVIWAGEEJMPAH-RYUDHWBXSA-N	0	3	304.419	2.095	10	0		DEAEHN
CC(=O)Nc1ccc(C)c(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000249078622	145177430	/nfs/dbraw/zinc/17/74/30/145177430.db2.gz	PASXRODKFRKWRZ-CZUORRHYSA-N	0	3	315.417	2.262	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NC(=O)CN(C)C(C)C)[C@H]1Oc1ccccc1	ZINC000251878381	145197032	/nfs/dbraw/zinc/19/70/32/145197032.db2.gz	ULIFRIKPXWEIBS-JFIYKMOQSA-N	0	3	320.433	2.068	10	0		DEAEHN
C[C@@H](CN1CCC[C@H](C)C1)n1c(=O)[nH]c2ccccc2c1=O	ZINC000253612859	145203337	/nfs/dbraw/zinc/20/33/37/145203337.db2.gz	WIGIVMVTLMVVKQ-STQMWFEESA-N	0	3	301.390	2.395	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)N1CCN(Cc2ccccc2)CC1	ZINC000261559407	145208074	/nfs/dbraw/zinc/20/80/74/145208074.db2.gz	ZBGNQKQQVVWUBU-KRWDZBQOSA-N	0	3	315.461	2.109	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H]1NCCCC1(C)C)c1ccc2c(c1)OCCO2	ZINC000261626228	145211670	/nfs/dbraw/zinc/21/16/70/145211670.db2.gz	CQRWYPVFYXIYFV-WBMJQRKESA-N	0	3	318.417	2.413	10	0		DEAEHN
Cc1ccc(CCC(=O)Nc2ccc(N3CCNCC3)cn2)cc1	ZINC000261642050	145212808	/nfs/dbraw/zinc/21/28/08/145212808.db2.gz	IMPYNTLVKZIHLW-UHFFFAOYSA-N	0	3	324.428	2.371	10	0		DEAEHN
CC(=O)Nc1ccc(CN2CCNC[C@H]2c2cccnc2)cc1	ZINC000261656249	145214308	/nfs/dbraw/zinc/21/43/08/145214308.db2.gz	HSPGYJBFRDKNQW-SFHVURJKSA-N	0	3	310.401	2.187	10	0		DEAEHN
C[C@H](c1ccc2ccccc2c1)N(C)CC(=O)N1CCNCC1	ZINC000261661173	145214416	/nfs/dbraw/zinc/21/44/16/145214416.db2.gz	GHUKOYQPZOIMIU-OAHLLOKOSA-N	0	3	311.429	2.264	10	0		DEAEHN
c1ccc(-c2nc(CN3CCNC[C@@H]3c3cccnc3)no2)cc1	ZINC000261713441	145219691	/nfs/dbraw/zinc/21/96/91/145219691.db2.gz	KNQBSUWOPCZMJC-MRXNPFEDSA-N	0	3	321.384	2.278	10	0		DEAEHN
COc1ccccc1[C@H]1C[NH2+]CCN1Cc1nc(C)ccc1[O-]	ZINC000261769445	145224446	/nfs/dbraw/zinc/22/44/46/145224446.db2.gz	RYWKGXMYWAWFBW-MRXNPFEDSA-N	0	3	313.401	2.251	10	0		DEAEHN
N[C@@H](C(=O)Nc1ccc2oc(C3CC3)nc2c1)C1CCOCC1	ZINC000261792959	145227182	/nfs/dbraw/zinc/22/71/82/145227182.db2.gz	NQUFEDJGDOUCAW-OAHLLOKOSA-N	0	3	315.373	2.398	10	0		DEAEHN
Cc1cccc(CCNC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000261839526	145232585	/nfs/dbraw/zinc/23/25/85/145232585.db2.gz	IQVPMAKNELEVIG-JTDSTZFVSA-N	0	3	316.445	2.186	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)NCc1ccc(F)c(F)c1	ZINC000261878060	145236650	/nfs/dbraw/zinc/23/66/50/145236650.db2.gz	MEAJIYSNQHUMPH-FABXCBLPSA-N	0	3	324.371	2.114	10	0		DEAEHN
NC1(C(=O)Nc2cccc(OCC(F)(F)F)c2)CCOCC1	ZINC000261936228	145244355	/nfs/dbraw/zinc/24/43/55/145244355.db2.gz	WUHQKMDLSKIJNH-UHFFFAOYSA-N	0	3	318.295	2.074	10	0		DEAEHN
O=C(CCN1CCCC[C@@H]1c1ccc(F)cc1)N1CCNCC1	ZINC000262118769	145263924	/nfs/dbraw/zinc/26/39/24/145263924.db2.gz	NCFMGDWLXKLELC-QGZVFWFLSA-N	0	3	319.424	2.175	10	0		DEAEHN
O=C(CCN1CCCC[C@H]1c1ccc(F)cc1)N1CCNCC1	ZINC000262118768	145264116	/nfs/dbraw/zinc/26/41/16/145264116.db2.gz	NCFMGDWLXKLELC-KRWDZBQOSA-N	0	3	319.424	2.175	10	0		DEAEHN
CC1CCC(CNC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)CC1	ZINC000262464639	145285654	/nfs/dbraw/zinc/28/56/54/145285654.db2.gz	IVTKFTLGZOMEPF-IVRBQTHCSA-N	0	3	308.466	2.461	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)Nc1cccc(F)c1F	ZINC000262505698	145288969	/nfs/dbraw/zinc/28/89/69/145288969.db2.gz	MKMUOXCVWOPJPC-HDIHMHJESA-N	0	3	310.344	2.436	10	0		DEAEHN
C[C@H](C(=O)NCc1cccnc1N(C)C)[C@H](N)c1ccccc1	ZINC000262661902	145298472	/nfs/dbraw/zinc/29/84/72/145298472.db2.gz	GLVZWNJSKLBFAM-BBRMVZONSA-N	0	3	312.417	2.100	10	0		DEAEHN
C[C@H]1C[NH2+]CC[C@@H]1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000262769049	145304341	/nfs/dbraw/zinc/30/43/41/145304341.db2.gz	LREHCYXYCPHDIK-WPRPVWTQSA-N	0	3	323.245	2.270	10	0		DEAEHN
CC(C)Oc1cccc(Cc2nc([C@@H]3CNCCN3C)no2)c1	ZINC000263137333	145329054	/nfs/dbraw/zinc/32/90/54/145329054.db2.gz	CCQFUBYFJOBQES-HNNXBMFYSA-N	0	3	316.405	2.024	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2cnc(C(C)(C)C)s2)n1	ZINC000263173528	145332215	/nfs/dbraw/zinc/33/22/15/145332215.db2.gz	GAJAVDFZJSOCCH-VIFPVBQESA-N	0	3	307.423	2.067	10	0		DEAEHN
C[C@@H](c1nc([C@@H]2CNCCN2C)no1)c1ccc(F)c(F)c1	ZINC000263175530	145332808	/nfs/dbraw/zinc/33/28/08/145332808.db2.gz	GEPCLHSQGWQSFD-RNCFNFMXSA-N	0	3	308.332	2.076	10	0		DEAEHN
C[C@H]1CCCC[C@H]1CCNC(=O)NCCNc1ccncc1	ZINC000358626529	147168346	/nfs/dbraw/zinc/16/83/46/147168346.db2.gz	IILGQIDEYYGOQA-GJZGRUSLSA-N	0	3	304.438	2.431	10	0		DEAEHN
CC[C@@H](CC1CCCC1)C(=O)N1CCN(CCN(C)C)CC1	ZINC000358802248	147208467	/nfs/dbraw/zinc/20/84/67/147208467.db2.gz	BVXSDCMNPCJAKZ-KRWDZBQOSA-N	0	3	309.498	2.299	10	0		DEAEHN
COCCOC[C@@H](C)NC(=O)c1cccc(CN2CCCC2)c1	ZINC000359341698	147310569	/nfs/dbraw/zinc/31/05/69/147310569.db2.gz	FBOWHAYRKDEUEP-OAHLLOKOSA-N	0	3	320.433	2.064	10	0		DEAEHN
CC(C)CC[C@H](NC(=O)NC[C@@](C)(O)CN(C)C)C(C)(C)C	ZINC000127132691	401721713	/nfs/dbraw/zinc/72/17/13/401721713.db2.gz	YZVYENJQUSOWRT-WMLDXEAASA-N	0	3	315.502	2.449	10	0		DEAEHN
C[C@H](C(=O)N(C)C)N1CCC(CN2CCc3ccccc32)CC1	ZINC000111696912	401721739	/nfs/dbraw/zinc/72/17/39/401721739.db2.gz	NXJALIXQXUBTES-OAHLLOKOSA-N	0	3	315.461	2.238	10	0		DEAEHN
CCN1CCC[C@H](Nc2cncc(-n3nc(C)cc3C)n2)C1	ZINC000112075873	401730280	/nfs/dbraw/zinc/73/02/80/401730280.db2.gz	TXNLJNZSAULFRB-AWEZNQCLSA-N	0	3	300.410	2.175	10	0		DEAEHN
CCOc1ccccc1C(F)(F)C(=O)N1CC[C@@H](N(C)C)C1	ZINC000127457965	401736015	/nfs/dbraw/zinc/73/60/15/401736015.db2.gz	GWANZTHBWALRMZ-GFCCVEGCSA-N	0	3	312.360	2.340	10	0		DEAEHN
CCN(C(=O)c1ccc(N2CCN(CC)CC2)cc1)C1CC1	ZINC000074349155	401736659	/nfs/dbraw/zinc/73/66/59/401736659.db2.gz	HKBMWHZEYDXMEK-UHFFFAOYSA-N	0	3	301.434	2.453	10	0		DEAEHN
CC1CCN(CC(=O)N[C@H](CN(C)C)c2ccccc2)CC1	ZINC000126749465	401706825	/nfs/dbraw/zinc/70/68/25/401706825.db2.gz	FOOOSEAKZIUWQQ-QGZVFWFLSA-N	0	3	303.450	2.137	10	0		DEAEHN
COC(=O)Nc1ccccc1C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000127815359	401751206	/nfs/dbraw/zinc/75/12/06/401751206.db2.gz	GSQRMDPLJHTKKF-STQMWFEESA-N	0	3	319.405	2.420	10	0		DEAEHN
O=C1CCCN1C[C@H](O)CN[C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000127987380	401757973	/nfs/dbraw/zinc/75/79/73/401757973.db2.gz	PMDHFXMTWKQMIT-NVXWUHKLSA-N	0	3	322.836	2.364	10	0		DEAEHN
C[C@@H](Oc1ccc(F)cc1Cl)C(=O)NC[C@@H]1CCCN1C	ZINC000112924358	401761764	/nfs/dbraw/zinc/76/17/64/401761764.db2.gz	GDFYSWWSVNXBES-PWSUYJOCSA-N	0	3	314.788	2.457	10	0		DEAEHN
CCc1noc2ncc(C(=O)N3C[C@@H]4CCCN4C[C@@H]3C)cc12	ZINC000113223916	401770760	/nfs/dbraw/zinc/77/07/60/401770760.db2.gz	NQUWQBCEFONPHT-AAEUAGOBSA-N	0	3	314.389	2.094	10	0		DEAEHN
C[C@H](C(=O)N1CCCCCC1)N1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000128420358	401775986	/nfs/dbraw/zinc/77/59/86/401775986.db2.gz	HWQSJOKEJUOZNK-JFIYKMOQSA-N	0	3	308.466	2.405	10	0		DEAEHN
COc1cc(CN2CC[C@H](c3cnn(C)c3)C2)cc(OC)c1	ZINC000128435832	401776421	/nfs/dbraw/zinc/77/64/21/401776421.db2.gz	PMFGUNYEGNBYHQ-AWEZNQCLSA-N	0	3	301.390	2.427	10	0		DEAEHN
COc1ccc2c(c1)CCN2C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1	ZINC000130312846	401826988	/nfs/dbraw/zinc/82/69/88/401826988.db2.gz	NKJXGOLFOZWSFF-JSGCOSHPSA-N	0	3	315.417	2.393	10	0		DEAEHN
CN(C)Cc1cccc(CNC(=O)NC[C@H]2CCCC[C@H]2O)c1	ZINC000077776223	401830961	/nfs/dbraw/zinc/83/09/61/401830961.db2.gz	HRGVZWUHIYLGMY-IAGOWNOFSA-N	0	3	319.449	2.099	10	0		DEAEHN
Cn1cc([C@H]2CCN(CCC(=O)Nc3ccccc3F)C2)cn1	ZINC000116314233	401849502	/nfs/dbraw/zinc/84/95/02/401849502.db2.gz	UNDNVEQCEBBDAQ-ZDUSSCGKSA-N	0	3	316.380	2.377	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)[C@]2(C)CCCc3ccccc32)CCO1	ZINC000116791029	401859177	/nfs/dbraw/zinc/85/91/77/401859177.db2.gz	OOHHVUSGVQLVSS-VQIMIIECSA-N	0	3	316.445	2.070	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2ccc(C(C)(C)C)cc2)CCO1	ZINC000116788424	401859248	/nfs/dbraw/zinc/85/92/48/401859248.db2.gz	SSLAINNTISKSGD-INIZCTEOSA-N	0	3	304.434	2.387	10	0		DEAEHN
CC[C@H](CC(=O)N1CCO[C@H](CN(C)C)C1)c1ccccc1	ZINC000116787305	401859379	/nfs/dbraw/zinc/85/93/79/401859379.db2.gz	PBBVJUOSMPTUHR-NVXWUHKLSA-N	0	3	304.434	2.359	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)CCc2ccc(Cl)s2)CCO1	ZINC000116797345	401859851	/nfs/dbraw/zinc/85/98/51/401859851.db2.gz	HVZWIHDVDIBXFO-LLVKDONJSA-N	0	3	316.854	2.123	10	0		DEAEHN
CC[C@H](NC(=O)c1ccccc1OCCN(C)C)[C@H]1CCCO1	ZINC000132342351	401865624	/nfs/dbraw/zinc/86/56/24/401865624.db2.gz	PSCXSALZZHKKQW-DOTOQJQBSA-N	0	3	320.433	2.314	10	0		DEAEHN
Cc1cccc([C@H](C)NC(=O)N2CCO[C@@H](CN(C)C)C2)c1C	ZINC000117052189	401867508	/nfs/dbraw/zinc/86/75/08/401867508.db2.gz	JUYQILAJYXFOEY-HOTGVXAUSA-N	0	3	319.449	2.336	10	0		DEAEHN
CC(C)OC(=O)c1ccc(CN2CCO[C@H](CN(C)C)C2)cc1	ZINC000135057183	401925617	/nfs/dbraw/zinc/92/56/17/401925617.db2.gz	JTOPYPOCFFLDKW-QGZVFWFLSA-N	0	3	320.433	2.014	10	0		DEAEHN
CCc1cnccc1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1	ZINC000119106411	401926117	/nfs/dbraw/zinc/92/61/17/401926117.db2.gz	ZDPLCJRLVJYKAC-GASCZTMLSA-N	0	3	319.449	2.263	10	0		DEAEHN
CCCNC(=O)c1cccc(C(=O)N[C@H]2CCCN(CC)C2)c1	ZINC000133018145	401878258	/nfs/dbraw/zinc/87/82/58/401878258.db2.gz	HKMSWWOMUSLOKJ-INIZCTEOSA-N	0	3	317.433	2.041	10	0		DEAEHN
CCC1CCC(NC(=O)NC2CCN(CCN(C)C)CC2)CC1	ZINC000079974425	401885216	/nfs/dbraw/zinc/88/52/16/401885216.db2.gz	KGETZJCFMPFFQS-UHFFFAOYSA-N	0	3	324.513	2.280	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1ccc(F)c(C)c1	ZINC000118020007	401888981	/nfs/dbraw/zinc/88/89/81/401888981.db2.gz	PUMUJISCLKZLPV-AWEZNQCLSA-N	0	3	309.385	2.366	10	0		DEAEHN
Cc1nccn1CCCCNC(=O)NCCN1CCCC[C@@H]1C	ZINC000080563986	401890053	/nfs/dbraw/zinc/89/00/53/401890053.db2.gz	QDYFAFVVWXSMSV-HNNXBMFYSA-N	0	3	321.469	2.145	10	0		DEAEHN
COc1cc(C[NH2+][C@H]2CCO[C@@H]2C)cc(Br)c1[O-]	ZINC000135312081	401935385	/nfs/dbraw/zinc/93/53/85/401935385.db2.gz	SIDMTCYVGRJIFF-KCJUWKMLSA-N	0	3	316.195	2.430	10	0		DEAEHN
C[C@@H](CNC(=O)[C@H]1CCCc2n[nH]cc21)N1CCC(C)CC1	ZINC000133736502	401894046	/nfs/dbraw/zinc/89/40/46/401894046.db2.gz	XMRZJSYSZMVKRB-KBPBESRZSA-N	0	3	304.438	2.066	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)[C@@H]1CSc2ccccc21	ZINC000118332602	401895846	/nfs/dbraw/zinc/89/58/46/401895846.db2.gz	JXHNVNBOTWQZEC-DZGCQCFKSA-N	0	3	320.458	2.103	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)[C@@H]1CCCc2n[nH]cc21	ZINC000134349209	401902240	/nfs/dbraw/zinc/90/22/40/401902240.db2.gz	LNVCQLVPEJREGI-ZIAGYGMSSA-N	0	3	304.438	2.210	10	0		DEAEHN
Cc1ccccc1SCC(=O)NCCCN1CCC(O)CC1	ZINC000118722690	401905341	/nfs/dbraw/zinc/90/53/41/401905341.db2.gz	WYBSLKXTNODFPM-UHFFFAOYSA-N	0	3	322.474	2.050	10	0		DEAEHN
C[C@H](N)C(=O)Nc1ccc(I)cc1Cl	ZINC000037045430	401910107	/nfs/dbraw/zinc/91/01/07/401910107.db2.gz	ZDZOLRKVIJBURE-YFKPBYRVSA-N	0	3	324.549	2.230	10	0		DEAEHN
O=C(c1ccccc1Br)N1CCN2CCC[C@H]2C1	ZINC000037845334	401917889	/nfs/dbraw/zinc/91/78/89/401917889.db2.gz	WGNZNXZIWLQGTB-NSHDSACASA-N	0	3	309.207	2.369	10	0		DEAEHN
OC[C@H](NC[C@H]1CCCO1)c1cccc(Br)c1	ZINC000038114866	401923015	/nfs/dbraw/zinc/92/30/15/401923015.db2.gz	TUZCNJSFTMDPRD-OLZOCXBDSA-N	0	3	300.196	2.251	10	0		DEAEHN
COc1c(C)cnc(CN2CCC[C@@H](Cn3ccnn3)C2)c1C	ZINC000119447444	401950640	/nfs/dbraw/zinc/95/06/40/401950640.db2.gz	KGRLOLHVFZPWAE-OAHLLOKOSA-N	0	3	315.421	2.211	10	0		DEAEHN
C[C@H](O)CCNC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000119626850	401962168	/nfs/dbraw/zinc/96/21/68/401962168.db2.gz	STHKCUBNMCDROV-MAUKXSAKSA-N	0	3	319.449	2.111	10	0		DEAEHN
C[C@@]1(CNC(=O)N2CCOCC2)CCCN1Cc1ccccc1	ZINC000119692450	401963583	/nfs/dbraw/zinc/96/35/83/401963583.db2.gz	DYJRTVRKQAEIJZ-SFHVURJKSA-N	0	3	317.433	2.083	10	0		DEAEHN
CC(C)NC(=O)CCN1CCC(C(=O)N2CCCCCC2)CC1	ZINC000046503474	401970764	/nfs/dbraw/zinc/97/07/64/401970764.db2.gz	ZXRDYLAPVFZEBH-UHFFFAOYSA-N	0	3	323.481	2.016	10	0		DEAEHN
CCn1c2ccccc2nc1[C@H](C)NC1CCN(C(N)=O)CC1	ZINC000090037045	401979248	/nfs/dbraw/zinc/97/92/48/401979248.db2.gz	VOLZZIYPYCRZEG-LBPRGKRZSA-N	0	3	315.421	2.250	10	0		DEAEHN
CC(C)OCCCNC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000047682454	401988011	/nfs/dbraw/zinc/98/80/11/401988011.db2.gz	VGERSASYEDULAJ-MRXNPFEDSA-N	0	3	307.438	2.404	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1C	ZINC000150775517	401994999	/nfs/dbraw/zinc/99/49/99/401994999.db2.gz	YWPFYJWYMDAAGJ-BBRMVZONSA-N	0	3	317.433	2.087	10	0		DEAEHN
CCc1ccccc1NC(=O)C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000150792047	401995963	/nfs/dbraw/zinc/99/59/63/401995963.db2.gz	HFZVNUPRDXTYTJ-BBRMVZONSA-N	0	3	317.433	2.032	10	0		DEAEHN
C[C@H](NC(=O)N[C@@H](CN(C)C)c1ccccc1)[C@@H]1CCCO1	ZINC000048216765	401996034	/nfs/dbraw/zinc/99/60/34/401996034.db2.gz	RULWYCXZOKAJQD-BPUTZDHNSA-N	0	3	305.422	2.156	10	0		DEAEHN
Cc1nc2ccccc2n1CC(=O)NCCN1CCCC[C@@H]1C	ZINC000044532990	401945048	/nfs/dbraw/zinc/94/50/48/401945048.db2.gz	HXHORVUIDNWTKT-AWEZNQCLSA-N	0	3	314.433	2.335	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NCC1(CC(C)C)CC1	ZINC000121186505	402019509	/nfs/dbraw/zinc/01/95/09/402019509.db2.gz	RWZCWWRMYNHBEP-OAHLLOKOSA-N	0	3	311.470	2.223	10	0		DEAEHN
CN(C)[C@H](CN)c1cc(Br)c(Br)o1	ZINC000050361651	402027402	/nfs/dbraw/zinc/02/74/02/402027402.db2.gz	FUFDEKBTXKKTIN-ZCFIWIBFSA-N	0	3	312.005	2.366	10	0		DEAEHN
C[C@@H](C(=O)N1CC[C@@H](Oc2cccnc2)C1)N1CCCCCC1	ZINC000151524609	402041344	/nfs/dbraw/zinc/04/13/44/402041344.db2.gz	WBFGLVOAWABVOM-DOTOQJQBSA-N	0	3	317.433	2.326	10	0		DEAEHN
CCn1cc(CN2CCCN(Cc3cccnc3C)CC2)cn1	ZINC000121646444	402047137	/nfs/dbraw/zinc/04/71/37/402047137.db2.gz	UBKRDBLDIIIZJX-UHFFFAOYSA-N	0	3	313.449	2.314	10	0		DEAEHN
COC(=O)[C@H](C)CN(C)C[C@@H](O)COc1ccccc1C(C)C	ZINC000120749702	402000988	/nfs/dbraw/zinc/00/09/88/402000988.db2.gz	DWKFBRUARHGLHU-HUUCEWRRSA-N	0	3	323.433	2.291	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cccc(-n3cccn3)c2)CCN1C	ZINC000122667358	402089416	/nfs/dbraw/zinc/08/94/16/402089416.db2.gz	YCTOUVNCCWFDIH-HOCLYGCPSA-N	0	3	312.417	2.427	10	0		DEAEHN
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCCN1CCCC[C@H]1C	ZINC000056770091	402090678	/nfs/dbraw/zinc/09/06/78/402090678.db2.gz	UCTZZJWVQTYUSB-LSDHHAIUSA-N	0	3	319.449	2.497	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(Cc2cc(C(N)=O)cs2)C1	ZINC000122944710	402102740	/nfs/dbraw/zinc/10/27/40/402102740.db2.gz	CZXAEIFPHNPUSO-ZDUSSCGKSA-N	0	3	318.446	2.443	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cc(-c3cccnc3)on2)CCN1C	ZINC000123026365	402106437	/nfs/dbraw/zinc/10/64/37/402106437.db2.gz	SNBAJNHDJOYMNL-JSGCOSHPSA-N	0	3	314.389	2.291	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)c1cnc(C(F)(F)F)nc1	ZINC000123022913	402106635	/nfs/dbraw/zinc/10/66/35/402106635.db2.gz	SOFOGCCSMMNDNG-JTQLQIEISA-N	0	3	316.327	2.100	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)c1cnc(C(F)(F)F)nc1	ZINC000123022663	402106811	/nfs/dbraw/zinc/10/68/11/402106811.db2.gz	SOFOGCCSMMNDNG-SNVBAGLBSA-N	0	3	316.327	2.100	10	0		DEAEHN
CC(C)[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000123041891	402107077	/nfs/dbraw/zinc/10/70/77/402107077.db2.gz	UTULDOPEFGURNY-ROUUACIJSA-N	0	3	318.461	2.290	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1nc(-c2cccs2)no1)N(C)C	ZINC000123327101	402122334	/nfs/dbraw/zinc/12/23/34/402122334.db2.gz	QLXJMSNSWAEHSX-JTQLQIEISA-N	0	3	308.407	2.145	10	0		DEAEHN
COc1cccc(OC)c1CC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000122214906	402067001	/nfs/dbraw/zinc/06/70/01/402067001.db2.gz	KHTUBJCAWHWWNJ-ZIAGYGMSSA-N	0	3	320.433	2.187	10	0		DEAEHN
COc1ccc([C@H](C)NC[C@H](C)N2CCOCC2)c(OC)c1	ZINC000123480914	402130260	/nfs/dbraw/zinc/13/02/60/402130260.db2.gz	ZRVQQGYFOBAULC-KBPBESRZSA-N	0	3	308.422	2.075	10	0		DEAEHN
CC[C@@](C)(O)CN1CCCN(C(=O)c2ccccc2F)CC1	ZINC000123349408	402123669	/nfs/dbraw/zinc/12/36/69/402123669.db2.gz	AQVSVVOXOZLHGK-QGZVFWFLSA-N	0	3	308.397	2.135	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2ccn(-c3ccccc3)n2)CCN1C	ZINC000123823468	402148577	/nfs/dbraw/zinc/14/85/77/402148577.db2.gz	MHXYBPNWQSMXGX-ZBFHGGJFSA-N	0	3	312.417	2.427	10	0		DEAEHN
CC[C@H](O)C[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000124542606	402185015	/nfs/dbraw/zinc/18/50/15/402185015.db2.gz	LJCCYTAGQJVPBI-VIFPVBQESA-N	0	3	304.184	2.024	10	0		DEAEHN
Cc1cc(N2CCO[C@H](CN(C)C)C2)c2cccc(F)c2n1	ZINC000124920331	402203617	/nfs/dbraw/zinc/20/36/17/402203617.db2.gz	BMNRPBQTGAFJQC-CYBMUJFWSA-N	0	3	303.381	2.449	10	0		DEAEHN
c1ccc(Cc2nc(CN3CC[C@H](N4CCCC4)C3)no2)cc1	ZINC000069222332	402216631	/nfs/dbraw/zinc/21/66/31/402216631.db2.gz	QYRSJPZIBDFMPR-INIZCTEOSA-N	0	3	312.417	2.331	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)[C@@H](Cc1ccccc1)N(C)C	ZINC000106905639	402221255	/nfs/dbraw/zinc/22/12/55/402221255.db2.gz	WIUKIYKPHOTIGD-FUHWJXTLSA-N	0	3	317.477	2.150	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)[C@@H]1CSC(=O)N1)c1ccccc1	ZINC000154798770	402232895	/nfs/dbraw/zinc/23/28/95/402232895.db2.gz	CDJZGUBSQZRGRT-UONOGXRCSA-N	0	3	321.446	2.011	10	0		DEAEHN
O=C(Nc1ccccc1)C(=O)N1CCCC[C@@H](N2CCCC2)C1	ZINC000107666963	402237184	/nfs/dbraw/zinc/23/71/84/402237184.db2.gz	JNWILFMAWLSWPD-MRXNPFEDSA-N	0	3	315.417	2.102	10	0		DEAEHN
CC(C)[C@@H](O)CNC(=O)NCC(C)(C)N[C@H](C)c1ccccc1	ZINC000155075689	402244582	/nfs/dbraw/zinc/24/45/82/402244582.db2.gz	XECOWYNVTJSOQY-ZBFHGGJFSA-N	0	3	321.465	2.432	10	0		DEAEHN
c1ccc(-c2cc(N3CCNCC3)nc(-c3ccncc3)n2)nc1	ZINC000070451639	402260404	/nfs/dbraw/zinc/26/04/04/402260404.db2.gz	LGHMDQWLXKEIHE-UHFFFAOYSA-N	0	3	318.384	2.010	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cc(Br)ccc2F)C1	ZINC000071139981	402270402	/nfs/dbraw/zinc/27/04/02/402270402.db2.gz	POLISWKHPVGUKY-SNVBAGLBSA-N	0	3	315.186	2.364	10	0		DEAEHN
CCOc1cc(CN(C)CC)ccc1O[C@@H](C)C(=O)N(C)C	ZINC000126266834	402272110	/nfs/dbraw/zinc/27/21/10/402272110.db2.gz	PUNLMWKMUGSJAA-ZDUSSCGKSA-N	0	3	308.422	2.393	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)CCn1cnc2ccccc21	ZINC000126284550	402273078	/nfs/dbraw/zinc/27/30/78/402273078.db2.gz	WFJYNORMKDRLSS-OAHLLOKOSA-N	0	3	314.433	2.417	10	0		DEAEHN
Cc1ccc(/C=C/CC(=O)NCCCN2CCN(C)CC2)cc1	ZINC000176510533	402316154	/nfs/dbraw/zinc/31/61/54/402316154.db2.gz	PTWLVWBRWIAORB-HWKANZROSA-N	0	3	315.461	2.152	10	0		DEAEHN
Cn1cc(-c2cc(CN3CC[C@@]4(O)CCCC[C@@H]4C3)on2)cn1	ZINC000185026924	402317965	/nfs/dbraw/zinc/31/79/65/402317965.db2.gz	DZQVKTUJGWNQMX-PBHICJAKSA-N	0	3	316.405	2.202	10	0		DEAEHN
CN(CCN1CCC[C@H](CCC(N)=O)C1)Cc1ccc(F)cc1	ZINC000159176502	402318494	/nfs/dbraw/zinc/31/84/94/402318494.db2.gz	CFBUQIWGQXBCFK-OAHLLOKOSA-N	0	3	321.440	2.235	10	0		DEAEHN
O=C(N[C@@H]1CCO[C@H]1c1ccccc1)N1CCN2CCC[C@@H]2C1	ZINC000176575386	402320745	/nfs/dbraw/zinc/32/07/45/402320745.db2.gz	OMFALWYKUBSDJX-ZACQAIPSSA-N	0	3	315.417	2.006	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)/C=C/c2ccc(OC)c(O)c2)C1	ZINC000185323714	402343325	/nfs/dbraw/zinc/34/33/25/402343325.db2.gz	KDVUHNRZYAESCR-RCQQVGEISA-N	0	3	304.390	2.015	10	0		DEAEHN
CC(C)c1nnc(CCC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)o1	ZINC000176896277	402347410	/nfs/dbraw/zinc/34/74/10/402347410.db2.gz	BPMUZGRXCZJGEH-CHWSQXEVSA-N	0	3	308.426	2.067	10	0		DEAEHN
CCCC(=O)N1CCCC[C@@H]1C(=O)N(C)C[C@H]1CCCN1CC	ZINC000176990267	402357548	/nfs/dbraw/zinc/35/75/48/402357548.db2.gz	CEIGFYXRECFQNG-HZPDHXFCSA-N	0	3	323.481	2.110	10	0		DEAEHN
COc1cccc(CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000234991310	402362272	/nfs/dbraw/zinc/36/22/72/402362272.db2.gz	KZRRRTVJTAFWMS-ZDUSSCGKSA-N	0	3	321.421	2.437	10	0		DEAEHN
CNc1cc(N2CCC[C@@H]2CN[C@H](C)c2ccccn2)ncn1	ZINC000177125827	402372243	/nfs/dbraw/zinc/37/22/43/402372243.db2.gz	ZFUIQSGNJRGQSW-ZIAGYGMSSA-N	0	3	312.421	2.233	10	0		DEAEHN
CCCNC(=O)[C@@H](C)N[C@@H](C)c1ccccc1-n1cccn1	ZINC000177185591	402379239	/nfs/dbraw/zinc/37/92/39/402379239.db2.gz	MVCZPPDYYAXJKZ-UONOGXRCSA-N	0	3	300.406	2.438	10	0		DEAEHN
COc1csc(C(=O)N2CCc3ccccc3[C@@H]2CN)c1	ZINC000227720174	402333993	/nfs/dbraw/zinc/33/39/93/402333993.db2.gz	PLBJLDXYKDIDQC-AWEZNQCLSA-N	0	3	302.399	2.455	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1Cc1ccc(-n2ccnc2)nc1	ZINC000177372572	402395698	/nfs/dbraw/zinc/39/56/98/402395698.db2.gz	UGWXWNKJFFMOOB-QGZVFWFLSA-N	0	3	322.416	2.437	10	0		DEAEHN
CCOc1ncccc1C(=O)N[C@H](C)CN1CCCCCC1	ZINC000186279795	402417301	/nfs/dbraw/zinc/41/73/01/402417301.db2.gz	IRBZCDYXNRIXCW-CQSZACIVSA-N	0	3	305.422	2.475	10	0		DEAEHN
N[C@H](CC(=O)NC1CCN(c2ccccn2)CC1)c1ccccc1	ZINC000237847522	402423510	/nfs/dbraw/zinc/42/35/10/402423510.db2.gz	KKZYWVJSJVXAJE-QGZVFWFLSA-N	0	3	324.428	2.257	10	0		DEAEHN
COC(=O)[C@@]1(C)CCCN1CC1CCN(C(=O)C(C)(C)C)CC1	ZINC000186389965	402427402	/nfs/dbraw/zinc/42/74/02/402427402.db2.gz	CBTDATSYGARZOX-GOSISDBHSA-N	0	3	324.465	2.299	10	0		DEAEHN
CCCN1CCC(CNS(=O)(=O)CC2CCCC2)CC1	ZINC000177747734	402432001	/nfs/dbraw/zinc/43/20/01/402432001.db2.gz	ORZYMCDEBJALQS-UHFFFAOYSA-N	0	3	302.484	2.218	10	0		DEAEHN
OCC[C@H](NC1CCN(Cc2cccnc2)CC1)c1ccco1	ZINC000186536562	402440431	/nfs/dbraw/zinc/44/04/31/402440431.db2.gz	BOBSFABHIZUEAF-KRWDZBQOSA-N	0	3	315.417	2.352	10	0		DEAEHN
CN(C)C(=O)[C@H](c1ccccc1)N1CC[C@H]2OCCC[C@@H]2C1	ZINC000177981066	402448899	/nfs/dbraw/zinc/44/88/99/402448899.db2.gz	PCAHDJYQDUUYBI-ZACQAIPSSA-N	0	3	302.418	2.317	10	0		DEAEHN
C[C@@H]1CC[C@H](C(N)=O)CN1Cc1ccc2c(c1)COC(C)(C)O2	ZINC000186625819	402448891	/nfs/dbraw/zinc/44/88/91/402448891.db2.gz	KWLRQSPOAYVIJY-OCCSQVGLSA-N	0	3	318.417	2.418	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)c2cccs2)[C@@H](C)C1	ZINC000246121980	402511631	/nfs/dbraw/zinc/51/16/31/402511631.db2.gz	JDDLEHWVQYDUIR-NWDGAFQWSA-N	0	3	302.465	2.099	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H]1COc2ccccc2C1	ZINC000245461981	402463127	/nfs/dbraw/zinc/46/31/27/402463127.db2.gz	GDQPEALRQMFXAT-JKSUJKDBSA-N	0	3	317.433	2.116	10	0		DEAEHN
CCc1cnc(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)s1	ZINC000245497033	402465919	/nfs/dbraw/zinc/46/59/19/402465919.db2.gz	SPWKBRVQBLVLBX-RYUDHWBXSA-N	0	3	310.467	2.330	10	0		DEAEHN
COc1ccc(CN2CCN(C[C@H](C)O)[C@@H](C)C2)cc1Cl	ZINC000245580817	402472365	/nfs/dbraw/zinc/47/23/65/402472365.db2.gz	CIGIRVVSYFZUOV-STQMWFEESA-N	0	3	312.841	2.236	10	0		DEAEHN
COC[C@](C)(CCO)NCc1cc(Br)cs1	ZINC000165448822	402476186	/nfs/dbraw/zinc/47/61/86/402476186.db2.gz	WVSSFWJEGFPWDS-NSHDSACASA-N	0	3	308.241	2.388	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCC[C@@H](C(F)(F)F)C1	ZINC000245651833	402476985	/nfs/dbraw/zinc/47/69/85/402476985.db2.gz	BZSNJWFGPVOXJU-NEPJUHHUSA-N	0	3	307.360	2.455	10	0		DEAEHN
Cn1cncc1CN[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000245655845	402477225	/nfs/dbraw/zinc/47/72/25/402477225.db2.gz	FYNNSICBOAAJEE-CVEARBPZSA-N	0	3	306.360	2.233	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCc2nccs2)[C@H]1c1ccccc1	ZINC000245678325	402478536	/nfs/dbraw/zinc/47/85/36/402478536.db2.gz	UQHKUCRQWVHTPA-DZGCQCFKSA-N	0	3	316.430	2.388	10	0		DEAEHN
COC(=O)c1coc(CN2CCC[C@H]2Cn2ccnc2C)c1	ZINC000178303759	402482765	/nfs/dbraw/zinc/48/27/65/402482765.db2.gz	HVXVWGFULDWXAU-AWEZNQCLSA-N	0	3	303.362	2.236	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N(C)C1CCCCC1	ZINC000178313143	402484295	/nfs/dbraw/zinc/48/42/95/402484295.db2.gz	UHAWTSXAGMHJCK-KRWDZBQOSA-N	0	3	318.465	2.447	10	0		DEAEHN
Cc1nnc(CN2CCN(C)CC23CCCCC3)n1C1CC1	ZINC000178403518	402494582	/nfs/dbraw/zinc/49/45/82/402494582.db2.gz	IVLLTQAMYYDBDZ-UHFFFAOYSA-N	0	3	303.454	2.372	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C[C@H](C)c1c(C)n[nH]c1C	ZINC000245926029	402498208	/nfs/dbraw/zinc/49/82/08/402498208.db2.gz	XNPYPCQIDWGMLU-WFASDCNBSA-N	0	3	306.454	2.463	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N(CCN(C)C)CC(C)C	ZINC000187496975	402502701	/nfs/dbraw/zinc/50/27/01/402502701.db2.gz	KIGADAVFRJYVBS-AWEZNQCLSA-N	0	3	322.453	2.380	10	0		DEAEHN
COc1cc(CN2CCN(C[C@H](C)O)[C@H](C)C2)ccc1SC	ZINC000246009214	402502990	/nfs/dbraw/zinc/50/29/90/402502990.db2.gz	HMFPXKGVXLWYNX-KGLIPLIRSA-N	0	3	324.490	2.304	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000187501477	402503370	/nfs/dbraw/zinc/50/33/70/402503370.db2.gz	FZHQXEPTKDSTFH-HZSPNIEDSA-N	0	3	320.437	2.275	10	0		DEAEHN
Cc1cc(CNC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)on1	ZINC000179143897	402576003	/nfs/dbraw/zinc/57/60/03/402576003.db2.gz	NPSLZBYYKYTGSV-HZPDHXFCSA-N	0	3	314.389	2.228	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1C[C@H](C)CCC[C@H]1C	ZINC000246922085	402549974	/nfs/dbraw/zinc/54/99/74/402549974.db2.gz	JEMACGWFAWGGII-BZUAXINKSA-N	0	3	311.470	2.317	10	0		DEAEHN
CC(C)(C)CCN1CCN(CC(=O)Nc2ccncc2)CC1	ZINC000171053986	402552704	/nfs/dbraw/zinc/55/27/04/402552704.db2.gz	WPFJKIYIEXZPIH-UHFFFAOYSA-N	0	3	304.438	2.074	10	0		DEAEHN
CC(=O)Nc1cc(NC(=O)N2CC[C@H](N(C)C)C2)ccc1C	ZINC000171077607	402555135	/nfs/dbraw/zinc/55/51/35/402555135.db2.gz	LOENAXMVJWCBCN-AWEZNQCLSA-N	0	3	304.394	2.121	10	0		DEAEHN
COc1ccc(C(=O)N2CCC(C[NH+]3CCCC3)CC2)c([O-])c1	ZINC000171138749	402560980	/nfs/dbraw/zinc/56/09/80/402560980.db2.gz	KEEJJPNUSWVPSG-UHFFFAOYSA-N	0	3	318.417	2.349	10	0		DEAEHN
C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1coc(Br)c1	ZINC000247270565	402562131	/nfs/dbraw/zinc/56/21/31/402562131.db2.gz	FMWKGZQKSLINES-GXSJLCMTSA-N	0	3	315.211	2.454	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@H]2CCOc3ccccc32)C1	ZINC000247341610	402564796	/nfs/dbraw/zinc/56/47/96/402564796.db2.gz	NNSAHQGLKYWCNH-KBMXLJTQSA-N	0	3	302.418	2.398	10	0		DEAEHN
CC(C)C[C@@H]1COCCN1C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000247367963	402564925	/nfs/dbraw/zinc/56/49/25/402564925.db2.gz	OYRBBKGFMXCLMH-OAGGEKHMSA-N	0	3	311.470	2.172	10	0		DEAEHN
COC(=O)Nc1cccc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000247511653	402570553	/nfs/dbraw/zinc/57/05/53/402570553.db2.gz	YKZBUHVVHQPNEV-SWLSCSKDSA-N	0	3	319.405	2.323	10	0		DEAEHN
C[C@H](COCc1ccccc1)NC(=O)C1(N)Cc2ccccc2C1	ZINC000178607657	402517203	/nfs/dbraw/zinc/51/72/03/402517203.db2.gz	SXDZVNUHASRODD-OAHLLOKOSA-N	0	3	324.424	2.204	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](C)CNc2ccccc2)C1	ZINC000246194548	402517578	/nfs/dbraw/zinc/51/75/78/402517578.db2.gz	BTPDRUJTDWGUIR-ZBFHGGJFSA-N	0	3	304.438	2.271	10	0		DEAEHN
CC(C)N(Cc1ccccc1)C(=O)CN1CCN2CCC[C@H]2C1	ZINC000246251878	402521009	/nfs/dbraw/zinc/52/10/09/402521009.db2.gz	FKQYKUITKZJKPE-SFHVURJKSA-N	0	3	315.461	2.204	10	0		DEAEHN
Cc1ccc(NC(=O)c2n[nH]c3c2CNCC3)c2cccnc12	ZINC000188709197	402524245	/nfs/dbraw/zinc/52/42/45/402524245.db2.gz	WPYOYIWPCUKRHO-UHFFFAOYSA-N	0	3	307.357	2.164	10	0		DEAEHN
O=C([C@H]1C[C@H](F)CN1)N1CCC[C@@H](c2nc3ccccc3o2)C1	ZINC000188710853	402524586	/nfs/dbraw/zinc/52/45/86/402524586.db2.gz	FIDLJNPOXYGLAU-MBNYWOFBSA-N	0	3	317.364	2.234	10	0		DEAEHN
CC[C@@H](C(=O)NC1CCN(c2ccccc2OC)CC1)N(C)C	ZINC000178710520	402529150	/nfs/dbraw/zinc/52/91/50/402529150.db2.gz	XAABQTQIEFBQGI-HNNXBMFYSA-N	0	3	319.449	2.120	10	0		DEAEHN
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170834795	402531095	/nfs/dbraw/zinc/53/10/95/402531095.db2.gz	FHCONRCONAHSDG-GDBMZVCRSA-N	0	3	319.449	2.362	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)C2(c3cccc(F)c3)CCOCC2)C1	ZINC000170855588	402532979	/nfs/dbraw/zinc/53/29/79/402532979.db2.gz	YKGFUHGZCMTBTG-MRXNPFEDSA-N	0	3	320.408	2.036	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cccnc2SC(F)F)C1	ZINC000170856451	402533009	/nfs/dbraw/zinc/53/30/09/402533009.db2.gz	DYPNAXRGVYCVFX-SECBINFHSA-N	0	3	301.362	2.172	10	0		DEAEHN
COc1ccc(OCCCC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170862359	402534424	/nfs/dbraw/zinc/53/44/24/402534424.db2.gz	MPQILUVQOXHLLL-AWEZNQCLSA-N	0	3	306.406	2.017	10	0		DEAEHN
CN(C)C[C@H](NC(=O)N[C@H]1CCC[C@@H]1CCO)c1ccccc1	ZINC000190071763	402574175	/nfs/dbraw/zinc/57/41/75/402574175.db2.gz	AMLOAFZLZYTBKI-IKGGRYGDSA-N	0	3	319.449	2.140	10	0		DEAEHN
C[C@H]1CN(C2CCN(Cc3cnn4ccccc34)CC2)CCO1	ZINC000179345983	402586361	/nfs/dbraw/zinc/58/63/61/402586361.db2.gz	GFHFSRZLLGVQIW-HNNXBMFYSA-N	0	3	314.433	2.019	10	0		DEAEHN
CCN1CCC[C@@H](N[C@H](C)c2ccccc2OCC(=O)OC)C1	ZINC000248510408	402593681	/nfs/dbraw/zinc/59/36/81/402593681.db2.gz	ZTWPGGCGSOVHDF-HUUCEWRRSA-N	0	3	320.433	2.373	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@H](C)c2ncc(C)s2)C1	ZINC000248543091	402595132	/nfs/dbraw/zinc/59/51/32/402595132.db2.gz	CHXBSWCAERPEIA-WCQYABFASA-N	0	3	310.467	2.339	10	0		DEAEHN
CCOc1ccc(OCCN2CCC[C@H](n3cncn3)C2)cc1	ZINC000171615622	402601986	/nfs/dbraw/zinc/60/19/86/402601986.db2.gz	UKOBFJBUMUSFLH-HNNXBMFYSA-N	0	3	316.405	2.393	10	0		DEAEHN
CC(C)n1cc(CN[C@@H]2CCCN(c3cccnn3)C2)cn1	ZINC000171841722	402627734	/nfs/dbraw/zinc/62/77/34/402627734.db2.gz	IVUSETKULXPOJC-OAHLLOKOSA-N	0	3	300.410	2.013	10	0		DEAEHN
CCc1cccc(C)c1NC(=O)CN1CCN2CCC[C@@H]2C1	ZINC000171639432	402604439	/nfs/dbraw/zinc/60/44/39/402604439.db2.gz	XIEBASVXRFKUJQ-MRXNPFEDSA-N	0	3	301.434	2.276	10	0		DEAEHN
Cc1nc(C)n(C[C@@H]2CCCN(Cc3cccc4nccn43)C2)n1	ZINC000180120562	402607784	/nfs/dbraw/zinc/60/77/84/402607784.db2.gz	ACSSTYYHFKEZJD-MRXNPFEDSA-N	0	3	324.432	2.455	10	0		DEAEHN
CN1CC[C@H](NC(=O)c2ccc(NC=O)cc2)[C@@H]1c1ccccc1	ZINC000180120547	402607799	/nfs/dbraw/zinc/60/77/99/402607799.db2.gz	JOTUAVSWHCGFET-ROUUACIJSA-N	0	3	323.396	2.430	10	0		DEAEHN
CSC[C@@H](C)C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190604572	402613060	/nfs/dbraw/zinc/61/30/60/402613060.db2.gz	XLOYVIYGNNMHQE-GDBMZVCRSA-N	0	3	321.490	2.361	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@H]2CCCc3c(O)cccc32)C1	ZINC000248920583	402614490	/nfs/dbraw/zinc/61/44/90/402614490.db2.gz	WDFJXZZMEPHUPL-BBRMVZONSA-N	0	3	302.418	2.413	10	0		DEAEHN
O=C(NCc1ccc(Cl)cn1)N1CC[C@@H](N2CCCC2)C1	ZINC000180853700	402628193	/nfs/dbraw/zinc/62/81/93/402628193.db2.gz	UJMQPHREENIIPO-CQSZACIVSA-N	0	3	308.813	2.115	10	0		DEAEHN
CCC(CC)NC(=O)N(C)C1CCN(CCn2cccn2)CC1	ZINC000171757254	402618990	/nfs/dbraw/zinc/61/89/90/402618990.db2.gz	MLAGUIGSTCABQE-UHFFFAOYSA-N	0	3	321.469	2.178	10	0		DEAEHN
COc1cccc(Cl)c1CNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000190766549	402622273	/nfs/dbraw/zinc/62/22/73/402622273.db2.gz	NPLGXTNDEALEOR-GFCCVEGCSA-N	0	3	323.824	2.338	10	0		DEAEHN
O=C1C[C@H](c2ccccc2)N(C[C@@H](O)C2CCCCC2)CCN1	ZINC000249152324	402622481	/nfs/dbraw/zinc/62/24/81/402622481.db2.gz	XYPNBXJHFGJJPW-QZTJIDSGSA-N	0	3	316.445	2.491	10	0		DEAEHN
C[C@H](CNC(=O)N1CCN2CCC[C@@H]2C1)N(C)c1ccccc1	ZINC000171900889	402632415	/nfs/dbraw/zinc/63/24/15/402632415.db2.gz	AJBZHONDXWZRAQ-NVXWUHKLSA-N	0	3	316.449	2.001	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cnn([C@H](C)C3CC3)c2)C1	ZINC000249522748	402632778	/nfs/dbraw/zinc/63/27/78/402632778.db2.gz	WJQMRUUFMVHCKI-OCCSQVGLSA-N	0	3	305.426	2.460	10	0		DEAEHN
Cn1c(CN2CCN(C3CCCC3)CC2)nnc1C1CCC1	ZINC000181088058	402634846	/nfs/dbraw/zinc/63/48/46/402634846.db2.gz	QKZDIGTXDJSPIF-UHFFFAOYSA-N	0	3	303.454	2.143	10	0		DEAEHN
CN(Cc1csc(Br)c1)C1(CO)CCOCC1	ZINC000191012803	402636529	/nfs/dbraw/zinc/63/65/29/402636529.db2.gz	WDPYXSGUEIIKAW-UHFFFAOYSA-N	0	3	320.252	2.484	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1C[C@@H](c2ccsc2)[C@H](CO)C1	ZINC000249527091	402633210	/nfs/dbraw/zinc/63/32/10/402633210.db2.gz	YUDZJEXFCDOMHA-HRCADAONSA-N	0	3	322.474	2.157	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@H](C)OC[C@H]1CCCCO1	ZINC000249809087	402642422	/nfs/dbraw/zinc/64/24/22/402642422.db2.gz	HFRLDXHXHXIIFG-ARFHVFGLSA-N	0	3	314.470	2.053	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000191139631	402644846	/nfs/dbraw/zinc/64/48/46/402644846.db2.gz	CPUVRFPMZRENCQ-YOEHRIQHSA-N	0	3	320.433	2.058	10	0		DEAEHN
C[C@@H]1C[C@H](C)CN(C(=O)CN[C@H]2CCCC[C@H]2n2cccn2)C1	ZINC000251687236	402648914	/nfs/dbraw/zinc/64/89/14/402648914.db2.gz	ONIUKKUFJMMNJC-VVLHAWIVSA-N	0	3	318.465	2.461	10	0		DEAEHN
Cc1ccccc1NC(=O)[C@H](C)N1CCCN(C2CC2)CC1	ZINC000172346774	402651488	/nfs/dbraw/zinc/65/14/88/402651488.db2.gz	JMEVPXKGWOMQHW-HNNXBMFYSA-N	0	3	301.434	2.492	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccc(F)cc1F)N1CCCN(C2CC2)CC1	ZINC000172345986	402651558	/nfs/dbraw/zinc/65/15/58/402651558.db2.gz	XACSCHBKUGQVOB-LBPRGKRZSA-N	0	3	323.387	2.462	10	0		DEAEHN
CCc1ccc(NC(=O)CN2CCCN(C3CC3)CC2)cc1	ZINC000172348143	402651766	/nfs/dbraw/zinc/65/17/66/402651766.db2.gz	ZYGBLUWBNXLLKF-UHFFFAOYSA-N	0	3	301.434	2.358	10	0		DEAEHN
COc1cccc(F)c1[C@H](C)NC(=O)N1CC[C@H](N(C)C)C1	ZINC000173915377	402718476	/nfs/dbraw/zinc/71/84/76/402718476.db2.gz	AFUHQCVHXBPHEJ-RYUDHWBXSA-N	0	3	309.385	2.241	10	0		DEAEHN
CCN1CCN(C[C@H](C)CNC(=O)NCCC2CCCC2)CC1	ZINC000173914929	402718952	/nfs/dbraw/zinc/71/89/52/402718952.db2.gz	YHNNIIMASXJXIV-MRXNPFEDSA-N	0	3	324.513	2.140	10	0		DEAEHN
C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)C1(N)CCOCC1	ZINC000261849491	402718953	/nfs/dbraw/zinc/71/89/53/402718953.db2.gz	MEYBBIOTEFMYAX-TZMCWYRMSA-N	0	3	306.381	2.038	10	0		DEAEHN
O=C(NC1CCN(C2CC2)CC1)N1CCCC[C@@H]1c1cn[nH]c1	ZINC000182274842	402678274	/nfs/dbraw/zinc/67/82/74/402678274.db2.gz	WEVTVQVNWZQAIJ-MRXNPFEDSA-N	0	3	317.437	2.273	10	0		DEAEHN
Cc1ccccc1C(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000173272543	402690109	/nfs/dbraw/zinc/69/01/09/402690109.db2.gz	DQXMXMQKGOSGRR-QGZVFWFLSA-N	0	3	315.461	2.237	10	0		DEAEHN
C[C@H]1C[C@H](N(C)S(=O)(=O)Cc2cccc(F)c2)CCN1C	ZINC000173268082	402690157	/nfs/dbraw/zinc/69/01/57/402690157.db2.gz	MPYVYUDEBYZEBN-SWLSCSKDSA-N	0	3	314.426	2.070	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)S(=O)(=O)Cc2cccc(F)c2)CCN1C	ZINC000173268100	402690242	/nfs/dbraw/zinc/69/02/42/402690242.db2.gz	MPYVYUDEBYZEBN-DOMZBBRYSA-N	0	3	314.426	2.070	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)S(=O)(=O)CC2CCCCC2)CCN1C	ZINC000173276814	402690661	/nfs/dbraw/zinc/69/06/61/402690661.db2.gz	KTICVGNZJXQAOL-HIFRSBDPSA-N	0	3	302.484	2.311	10	0		DEAEHN
Cc1cccc2c1OCC[C@H]2NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000191895765	402696803	/nfs/dbraw/zinc/69/68/03/402696803.db2.gz	LCXXZOFBUBGHNA-UKRRQHHQSA-N	0	3	303.406	2.164	10	0		DEAEHN
COC(=O)c1ccsc1N1CC[C@H](N[C@H](C)C(C)C)C1=O	ZINC000174054913	402725392	/nfs/dbraw/zinc/72/53/92/402725392.db2.gz	WOJDHWVMZFALAP-PWSUYJOCSA-N	0	3	310.419	2.274	10	0		DEAEHN
CCc1ccc([C@H](COC)NC(=O)N[C@@H]2CCCN(CC)C2)o1	ZINC000174236525	402733224	/nfs/dbraw/zinc/73/32/24/402733224.db2.gz	SPWVCAUDILRVDZ-HIFRSBDPSA-N	0	3	323.437	2.313	10	0		DEAEHN
C[C@H](NCC(=O)N[C@@H](c1ccccc1)C1CC1)[C@H]1CCCO1	ZINC000183114592	402740153	/nfs/dbraw/zinc/74/01/53/402740153.db2.gz	MTHKOMXLSMRGMF-XCRHUMRWSA-N	0	3	302.418	2.411	10	0		DEAEHN
COc1ccc(NC(=O)[C@H](C)N[C@@H](C)[C@H]2CCCO2)c(OC)c1	ZINC000183134339	402741519	/nfs/dbraw/zinc/74/15/19/402741519.db2.gz	LTOUPDPTJYLVFW-SLEUVZQESA-N	0	3	322.405	2.188	10	0		DEAEHN
CC(C)Cn1cc(CN2CCC(N3CCO[C@H](C)C3)CC2)cn1	ZINC000183133930	402741580	/nfs/dbraw/zinc/74/15/80/402741580.db2.gz	WBFVNOMKYBMYQP-MRXNPFEDSA-N	0	3	320.481	2.224	10	0		DEAEHN
C[C@H](N[C@@H](C)[C@H]1CCCO1)C(=O)NC(=O)Nc1ccccc1F	ZINC000183142820	402742824	/nfs/dbraw/zinc/74/28/24/402742824.db2.gz	RUIPODJCICPMRU-COPLHBTASA-N	0	3	323.368	2.019	10	0		DEAEHN
COc1ccccc1[C@H](C)NC(=O)CN[C@@H](C)[C@@H]1CCCO1	ZINC000183189593	402745418	/nfs/dbraw/zinc/74/54/18/402745418.db2.gz	XHSYFUJWTXUWHP-YDHLFZDLSA-N	0	3	306.406	2.030	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2CCCC[C@H]2C(F)(F)F)n1	ZINC000263274266	402753327	/nfs/dbraw/zinc/75/33/27/402753327.db2.gz	SQBHEBUKYLWXPI-GMTAPVOTSA-N	0	3	318.343	2.482	10	0		DEAEHN
Cc1ccc(CCNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cn1	ZINC000174843636	402759886	/nfs/dbraw/zinc/75/98/86/402759886.db2.gz	JDDIWWCUWYQTFC-ZBFHGGJFSA-N	0	3	304.438	2.057	10	0		DEAEHN
CCc1nc([C@H](C)NC(=O)N2CC[C@H](N3CC=CC3)C2)cs1	ZINC000174847749	402760113	/nfs/dbraw/zinc/76/01/13/402760113.db2.gz	QOCGHIOLTHHKMW-STQMWFEESA-N	0	3	320.462	2.422	10	0		DEAEHN
O=C(NCCOC1CCCCCC1)N1CC[C@@H](N2CC=CC2)C1	ZINC000175056828	402775220	/nfs/dbraw/zinc/77/52/20/402775220.db2.gz	KYAKFUHIEIYCKI-MRXNPFEDSA-N	0	3	321.465	2.382	10	0		DEAEHN
CCc1ccc(CCNC(=O)N2CC[C@@H](N3CC=CC3)C2)cc1	ZINC000175071034	402776456	/nfs/dbraw/zinc/77/64/56/402776456.db2.gz	YQXANLUZFOCTQJ-GOSISDBHSA-N	0	3	313.445	2.447	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)NCc2cccnc2N(C)C)c1	ZINC000193927937	402778844	/nfs/dbraw/zinc/77/88/44/402778844.db2.gz	DXTQJOHPQIXZAL-UHFFFAOYSA-N	0	3	312.417	2.139	10	0		DEAEHN
COC(=O)c1ccsc1N1CC[C@@H](N[C@H](C)C(C)C)C1=O	ZINC000174054890	402724846	/nfs/dbraw/zinc/72/48/46/402724846.db2.gz	WOJDHWVMZFALAP-ZYHUDNBSSA-N	0	3	310.419	2.274	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN([C@@H](C)C(=O)N(C)C(C)C)C2)n1	ZINC000175252805	402791584	/nfs/dbraw/zinc/79/15/84/402791584.db2.gz	PUXDFTZAGUYNFQ-HOTGVXAUSA-N	0	3	318.465	2.379	10	0		DEAEHN
CC(C)N(C)C(=O)[C@@H](C)N1CC[C@H](CNc2ccccn2)C1	ZINC000175252451	402791906	/nfs/dbraw/zinc/79/19/06/402791906.db2.gz	XLVVJOXSZNCLJO-HUUCEWRRSA-N	0	3	304.438	2.071	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccccc1F	ZINC000194353541	402793341	/nfs/dbraw/zinc/79/33/41/402793341.db2.gz	MWBKSMVEJMAIKJ-ZBFHGGJFSA-N	0	3	322.424	2.389	10	0		DEAEHN
CC[C@H]1CN(CCC(=O)NC(C)C)CCN1Cc1ccccc1	ZINC000183747994	402794366	/nfs/dbraw/zinc/79/43/66/402794366.db2.gz	MWZLLGKVSOJDIQ-SFHVURJKSA-N	0	3	317.477	2.498	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2nc(SC)n3ccccc23)C1	ZINC000194401150	402795767	/nfs/dbraw/zinc/79/57/67/402795767.db2.gz	UXMWZYHCMKKBKM-LBPRGKRZSA-N	0	3	318.446	2.270	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)N(C)Cc1cccs1	ZINC000175354177	402799498	/nfs/dbraw/zinc/79/94/98/402799498.db2.gz	PBAPHMGAMUTJNP-AWEZNQCLSA-N	0	3	309.479	2.123	10	0		DEAEHN
C[C@@H](NC[C@H](O)COC(C)(C)C)c1ccc(-n2cncn2)cc1	ZINC000194894734	402821441	/nfs/dbraw/zinc/82/14/41/402821441.db2.gz	AVYYHTPMMGXLLG-CJNGLKHVSA-N	0	3	318.421	2.094	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1ncccc1Br	ZINC000194902324	402821876	/nfs/dbraw/zinc/82/18/76/402821876.db2.gz	UVLPXNXZUVDRTA-GHMZBOCLSA-N	0	3	324.222	2.153	10	0		DEAEHN
CC[C@H](C(=O)Nc1ccc(OC)cc1)N1CCN2CCC[C@@H]2C1	ZINC000175205923	402788096	/nfs/dbraw/zinc/78/80/96/402788096.db2.gz	JREROTMUKGNMJC-NVXWUHKLSA-N	0	3	317.433	2.192	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(C(=O)C3C(C)(C)C3(C)C)C2)CC1	ZINC000176005505	402847196	/nfs/dbraw/zinc/84/71/96/402847196.db2.gz	TXIYZVDLQYDWTR-HNNXBMFYSA-N	0	3	321.509	2.297	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000176004982	402847389	/nfs/dbraw/zinc/84/73/89/402847389.db2.gz	AKLMZVIBFXVDAK-KBPBESRZSA-N	0	3	305.422	2.424	10	0		DEAEHN
CC(=O)N(C[C@H]1CCCN1C[C@@H](O)c1ccc(F)cc1)C1CC1	ZINC000276339549	403165549	/nfs/dbraw/zinc/16/55/49/403165549.db2.gz	HBVVFFODJDKDDQ-QZTJIDSGSA-N	0	3	320.408	2.334	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@@H]1NCc1cc(Br)cs1	ZINC000282361478	403146759	/nfs/dbraw/zinc/14/67/59/403146759.db2.gz	NHVRDBYZWMLTTP-XCBNKYQSSA-N	0	3	303.225	2.267	10	0		DEAEHN
C[C@H](C(=O)N(C)C1CCCCC1)N1CCC[C@@H](c2nc[nH]n2)C1	ZINC000333116549	403669088	/nfs/dbraw/zinc/66/90/88/403669088.db2.gz	YVKHXOOUHCCTNR-ZIAGYGMSSA-N	0	3	319.453	2.164	10	0		DEAEHN
CC1(C)Cc2ccc(C(=O)N[C@H]3CCN(C4CC4)C3)c(O)c2O1	ZINC000333116722	403669483	/nfs/dbraw/zinc/66/94/83/403669483.db2.gz	YXYILYAYWXUHSC-LBPRGKRZSA-N	0	3	316.401	2.072	10	0		DEAEHN
c1ccc(-c2nnc3ccc(N4CCN5CCC4CC5)nn32)cc1	ZINC000302764436	403723002	/nfs/dbraw/zinc/72/30/02/403723002.db2.gz	LBMGLFYQNPABDT-UHFFFAOYSA-N	0	3	320.400	2.076	10	0		DEAEHN
C[C@@H]1[C@H](N(C)CCO)CCN1c1nc(C2CCCC2)ns1	ZINC000333635464	403799273	/nfs/dbraw/zinc/79/92/73/403799273.db2.gz	BLOMCPFQPGSHGW-DGCLKSJQSA-N	0	3	310.467	2.087	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCC[C@@H]([C@H](C)O)C1	ZINC000305676076	403909756	/nfs/dbraw/zinc/90/97/56/403909756.db2.gz	ZYHGCCHTMRFKSZ-DOTOQJQBSA-N	0	3	304.434	2.128	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@H](C)c2cn(C)nc2C)C12CCOCC2	ZINC000249039262	286402550	/nfs/dbraw/zinc/40/25/50/286402550.db2.gz	UTLRUBNYHOLKCU-UHOFOFEASA-N	0	3	307.438	2.353	10	0		DEAEHN
c1cc(CN[C@@H]2CCO[C@]3(CCOC3)C2)c2c(c1)OCCCO2	ZINC000356293990	404429828	/nfs/dbraw/zinc/42/98/28/404429828.db2.gz	XZXZNKNXAMCRER-CRAIPNDOSA-N	0	3	319.401	2.276	10	0		DEAEHN
Brc1cnn(CCNCc2ccc3c[nH]nc3c2)c1	ZINC000353082458	404738788	/nfs/dbraw/zinc/73/87/88/404738788.db2.gz	DSAMTWBVTZYNKS-UHFFFAOYSA-N	0	3	320.194	2.312	10	0		DEAEHN
COC(=O)[C@@H](N[C@@H](CN1CCCC1)c1ccccc1)C1CC1	ZINC000358810521	404776719	/nfs/dbraw/zinc/77/67/19/404776719.db2.gz	FZVCWNRIDFRULD-IRXDYDNUSA-N	0	3	302.418	2.365	10	0		DEAEHN
CC[C@@H](NC1CCN(c2nnnn2C)CC1)c1ccccc1F	ZINC000376177786	404814404	/nfs/dbraw/zinc/81/44/04/404814404.db2.gz	KZXKDXIHQMBGRB-OAHLLOKOSA-N	0	3	318.400	2.059	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2ccccc2SC)CC12COC2	ZINC000451138180	404877507	/nfs/dbraw/zinc/87/75/07/404877507.db2.gz	QDRFTTZCIRFVIZ-AWEZNQCLSA-N	0	3	321.442	2.420	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCCN(C)Cc1ccc(F)cc1	ZINC000360894942	404847417	/nfs/dbraw/zinc/84/74/17/404847417.db2.gz	SMYZCRXBFLYKHZ-QGZVFWFLSA-N	0	3	321.440	2.248	10	0		DEAEHN
C[C@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@H]2CCN(C)C[C@H]21	ZINC000361124567	404932257	/nfs/dbraw/zinc/93/22/57/404932257.db2.gz	QFFNKMQPMXNTKR-FRFSOERESA-N	0	3	317.433	2.059	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)c2cccc(F)c2Br)C1	ZINC000389872985	405040795	/nfs/dbraw/zinc/04/07/95/405040795.db2.gz	AZEZETMCMMGMHC-SECBINFHSA-N	0	3	315.186	2.412	10	0		DEAEHN
Cn1c2ccc(CN3CC[C@H](C(C)(C)C)[C@H](O)C3)cc2oc1=O	ZINC000408012413	405088759	/nfs/dbraw/zinc/08/87/59/405088759.db2.gz	IPKINMQXXJSETI-DZGCQCFKSA-N	0	3	318.417	2.360	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CC[C@H]3[C@@H](CCCN3C3CC3)C2)o1	ZINC000408097823	405111205	/nfs/dbraw/zinc/11/12/05/405111205.db2.gz	NYOVWBJERWLAPF-ZFWWWQNUSA-N	0	3	324.446	2.225	10	0		DEAEHN
O=C(c1cccc(CN2CCCC2)c1)N1CC(OC(F)F)C1	ZINC000437611309	405210447	/nfs/dbraw/zinc/21/04/47/405210447.db2.gz	YHBMUVKXVGELKB-UHFFFAOYSA-N	0	3	310.344	2.346	10	0		DEAEHN
Cc1c(CN2CC[C@@](O)(Cc3ccc(F)cc3)C2)cnn1C	ZINC000420983686	405420825	/nfs/dbraw/zinc/42/08/25/405420825.db2.gz	RFGQCEUHBWQDPX-QGZVFWFLSA-N	0	3	303.381	2.047	10	0		DEAEHN
c1c2cccnc2oc1CN1CCC(CN2CCOCC2)CC1	ZINC000449008444	405495458	/nfs/dbraw/zinc/49/54/58/405495458.db2.gz	DLVCYONCFVGOET-UHFFFAOYSA-N	0	3	315.417	2.372	10	0		DEAEHN
O=C(c1nc2ccccc2nc1C1CC1)N1CCN2CCC[C@@H]2C1	ZINC000448924177	405464692	/nfs/dbraw/zinc/46/46/92/405464692.db2.gz	XQULKVPAMWHTLU-CQSZACIVSA-N	0	3	322.412	2.427	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2cc(C)ccc2C)CC12COC2	ZINC000449367542	405529687	/nfs/dbraw/zinc/52/96/87/405529687.db2.gz	WYHXMNAIOLGHLY-MRXNPFEDSA-N	0	3	303.402	2.315	10	0		DEAEHN
c1c(CNCC2(N3CCCC3)CCOCC2)onc1C1CC1	ZINC000638559165	405546984	/nfs/dbraw/zinc/54/69/84/405546984.db2.gz	SREUQAOTMXMOLV-UHFFFAOYSA-N	0	3	305.422	2.287	10	0		DEAEHN
O=C(COCc1ccccc1)Nc1ccc2c(c1)OCCNC2	ZINC000638665224	405603792	/nfs/dbraw/zinc/60/37/92/405603792.db2.gz	AMWRWLRWDFCLIX-UHFFFAOYSA-N	0	3	312.369	2.324	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)NC[C@@H](C)N1CCCC1)CC2	ZINC000530473587	405808868	/nfs/dbraw/zinc/80/88/68/405808868.db2.gz	AXBHURISBZQFAC-ZIAGYGMSSA-N	0	3	318.465	2.239	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NC[C@@H](C)N1CCCC1)C2	ZINC000530473587	405808876	/nfs/dbraw/zinc/80/88/76/405808876.db2.gz	AXBHURISBZQFAC-ZIAGYGMSSA-N	0	3	318.465	2.239	10	0		DEAEHN
COc1ccc(C(=O)C[C@H](C)C(=O)NC(C)(C)CN(C)C)cc1	ZINC000457257469	405769608	/nfs/dbraw/zinc/76/96/08/405769608.db2.gz	ZURHJCIUZMTANM-ZDUSSCGKSA-N	0	3	320.433	2.361	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)c1	ZINC000457639973	405930786	/nfs/dbraw/zinc/93/07/86/405930786.db2.gz	YXWZMOXIGSNNKF-WFASDCNBSA-N	0	3	316.401	2.137	10	0		DEAEHN
C[C@H](NC[C@H](O)Cn1ccnn1)c1ccccc1C(F)(F)F	ZINC000459710804	406014349	/nfs/dbraw/zinc/01/43/49/406014349.db2.gz	ZPPRNYFULFFNFD-QWRGUYRKSA-N	0	3	314.311	2.009	10	0		DEAEHN
Cc1cnc(CNCC2(O)CCN(Cc3ccccc3)CC2)o1	ZINC000639264452	406009644	/nfs/dbraw/zinc/00/96/44/406009644.db2.gz	DPGBHNBJUMCYOA-UHFFFAOYSA-N	0	3	315.417	2.100	10	0		DEAEHN
CN1CCN(Cc2ccccc2)[C@@H](CNCc2ccns2)C1	ZINC000639326080	406046569	/nfs/dbraw/zinc/04/65/69/406046569.db2.gz	DCEVZNQDNSEMHG-INIZCTEOSA-N	0	3	316.474	2.049	10	0		DEAEHN
CC(C)(C)OC(=O)C[C@@H]1CCCN(CCN2CCCC2=O)C1	ZINC000532125040	406048141	/nfs/dbraw/zinc/04/81/41/406048141.db2.gz	SSRXGWJMZHANGS-AWEZNQCLSA-N	0	3	310.438	2.053	10	0		DEAEHN
C[C@H](NC(=O)c1cccc2ncnn21)[C@@H](c1ccccc1)N(C)C	ZINC000545317735	406314094	/nfs/dbraw/zinc/31/40/94/406314094.db2.gz	UZZCRAATBLICTP-GUYCJALGSA-N	0	3	323.400	2.151	10	0		DEAEHN
C[C@H](N(C)C(=O)[C@H](N)CN(C)Cc1ccccc1)C(C)(C)C	ZINC000637930077	406482144	/nfs/dbraw/zinc/48/21/44/406482144.db2.gz	SMPKFAVUQMMTBJ-GOEBONIOSA-N	0	3	305.466	2.339	10	0		DEAEHN
COC(=O)[C@H](CC(C)C)NC(=O)CN1CCC2(C1)CCCCC2	ZINC000525635886	406492304	/nfs/dbraw/zinc/49/23/04/406492304.db2.gz	VTILYCRZLSSQQD-HNNXBMFYSA-N	0	3	324.465	2.347	10	0		DEAEHN
C[C@@H]1Cc2ccccc2N1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637868526	406454351	/nfs/dbraw/zinc/45/43/51/406454351.db2.gz	OMMGWNQODDUFKC-CRAIPNDOSA-N	0	3	323.440	2.424	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@H](N)CN(C)Cc2ccccc2)c(C)n1	ZINC000638072972	406555823	/nfs/dbraw/zinc/55/58/23/406555823.db2.gz	ASLXTLKEPTZHFZ-INIZCTEOSA-N	0	3	312.417	2.096	10	0		DEAEHN
Cc1ccc2[nH]c(CN[C@@H](C)C3CCS(=O)(=O)CC3)nc2c1	ZINC000526988913	406565488	/nfs/dbraw/zinc/56/54/88/406565488.db2.gz	WIDZOYAFRXHADV-LBPRGKRZSA-N	0	3	321.446	2.174	10	0		DEAEHN
Cc1ccc2nc(CN[C@@H](C)C3CCS(=O)(=O)CC3)[nH]c2c1	ZINC000526988913	406565492	/nfs/dbraw/zinc/56/54/92/406565492.db2.gz	WIDZOYAFRXHADV-LBPRGKRZSA-N	0	3	321.446	2.174	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)NCc1nc2cc(C)ccc2[nH]1	ZINC000525821259	406507085	/nfs/dbraw/zinc/50/70/85/406507085.db2.gz	XJKIFKZOCPTKTN-CYBMUJFWSA-N	0	3	315.421	2.155	10	0		DEAEHN
CC[C@H](C)C[C@H](C)NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638002299	406517546	/nfs/dbraw/zinc/51/75/46/406517546.db2.gz	CRTHHPYPZCKSHL-ZOBUZTSGSA-N	0	3	305.466	2.387	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N[C@@H]1CCCC1(C)C	ZINC000638004685	406519182	/nfs/dbraw/zinc/51/91/82/406519182.db2.gz	FBTJIQGOVODXMO-HZPDHXFCSA-N	0	3	303.450	2.141	10	0		DEAEHN
CC[C@H](NC[C@H]1CCC2(CCOCC2)[C@H]1O)c1ccn(C)n1	ZINC000549625110	406589223	/nfs/dbraw/zinc/58/92/23/406589223.db2.gz	HKEFNZFSDBIYIZ-YCPHGPKFSA-N	0	3	307.438	2.029	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)c2ncsc2Br)C1	ZINC000553096368	406735063	/nfs/dbraw/zinc/73/50/63/406735063.db2.gz	KYRLFQUJSFOWFR-MRVPVSSYSA-N	0	3	318.240	2.072	10	0		DEAEHN
Cc1cc(CCNC(=O)NCC(C)(C)N2CCCCC2)on1	ZINC000553702165	406771631	/nfs/dbraw/zinc/77/16/31/406771631.db2.gz	YMEJHMBVFMQXKP-UHFFFAOYSA-N	0	3	308.426	2.089	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N[C@@H]1CCc2ccccc21	ZINC000638416965	406760824	/nfs/dbraw/zinc/76/08/24/406760824.db2.gz	WANZJLRXNPNICM-RBUKOAKNSA-N	0	3	323.440	2.249	10	0		DEAEHN
C[C@@H]1C[C@H](c2cccnc2)N(C[C@@H](O)COC[C@@H]2CCCO2)C1	ZINC000554264186	406789923	/nfs/dbraw/zinc/78/99/23/406789923.db2.gz	NGNAAIGUDLZANV-NRSFXHEJSA-N	0	3	320.433	2.021	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)N2CCC(C3CCOCC3)CC2)CCN1C	ZINC000554587496	406814526	/nfs/dbraw/zinc/81/45/26/406814526.db2.gz	ARXMABWECISCFK-YOEHRIQHSA-N	0	3	323.481	2.317	10	0		DEAEHN
CC[C@@H](NC(=O)N1CCO[C@@H](CN(C)C)C1)c1ccc(C)cc1	ZINC000172115780	286875095	/nfs/dbraw/zinc/87/50/95/286875095.db2.gz	FWWBXHDPYHQMQB-DLBZAZTESA-N	0	3	319.449	2.418	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)N(C)[C@@H](CO)CC(C)C	ZINC000253191059	287008043	/nfs/dbraw/zinc/00/80/43/287008043.db2.gz	UFUHOSMDJHJDAW-HZPDHXFCSA-N	0	3	313.486	2.299	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)N(C)[C@H](CO)CC(C)C	ZINC000185469213	287008318	/nfs/dbraw/zinc/00/83/18/287008318.db2.gz	UFUHOSMDJHJDAW-CVEARBPZSA-N	0	3	313.486	2.299	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)N[C@H](CO)CC(C)(C)C	ZINC000128785555	195991114	/nfs/dbraw/zinc/99/11/14/195991114.db2.gz	FMRJCXGXQRVTDR-AWEZNQCLSA-N	0	3	322.449	2.154	10	0		DEAEHN
CCO[C@H](C)CNCc1cnc2cnc(Br)cn12	ZINC000129523877	196055605	/nfs/dbraw/zinc/05/56/05/196055605.db2.gz	DIWOVETVOATYLM-SECBINFHSA-N	0	3	313.199	2.006	10	0		DEAEHN
Cc1cc(Br)cnc1NC(=O)CNC(C)(C)C	ZINC000129606973	196061260	/nfs/dbraw/zinc/06/12/60/196061260.db2.gz	XZLWYHRUSLOKJP-UHFFFAOYSA-N	0	3	300.200	2.479	10	0		DEAEHN
C[C@H](CN1C(=O)C2(CC2)N[C@H]1c1ccsc1)N1CCCC1	ZINC000130755789	196107255	/nfs/dbraw/zinc/10/72/55/196107255.db2.gz	BDWBZDYJDFLQKI-TZMCWYRMSA-N	0	3	305.447	2.195	10	0		DEAEHN
CS[C@H](C)CCNS(=O)(=O)c1cccc([C@H](C)N)c1	ZINC000130935701	196123751	/nfs/dbraw/zinc/12/37/51/196123751.db2.gz	OPQUMDDVVXFXDQ-MNOVXSKESA-N	0	3	302.465	2.126	10	0		DEAEHN
COc1ccc([C@H](N)[C@@H]2CCC[C@H](S(C)(=O)=O)C2)c(F)c1	ZINC000130978173	196128473	/nfs/dbraw/zinc/12/84/73/196128473.db2.gz	VXPUPYDUDNXVBS-IFUGULHKSA-N	0	3	315.410	2.438	10	0		DEAEHN
CCc1nn(CCCS(=O)(=O)CC)c(CC)c1[C@@H](N)CC	ZINC000131003217	196130642	/nfs/dbraw/zinc/13/06/42/196130642.db2.gz	QINDRALAPMWWIA-LBPRGKRZSA-N	0	3	315.483	2.243	10	0		DEAEHN
CN[C@@H](C)c1cccc(S(=O)(=O)N[C@@H](C)CCSC)c1	ZINC000131238511	196151981	/nfs/dbraw/zinc/15/19/81/196151981.db2.gz	VLUHEMLVCHHFLY-RYUDHWBXSA-N	0	3	316.492	2.387	10	0		DEAEHN
C[C@H](CN(C)C)N1C(=O)C2(CCCC2)N[C@@H]1c1ccsc1	ZINC000131648650	196186744	/nfs/dbraw/zinc/18/67/44/196186744.db2.gz	PNPLKTGRLAMIMQ-OCCSQVGLSA-N	0	3	307.463	2.441	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@@H](C(C)C)C(=O)N2[C@@H](C)CN(C)C)s1	ZINC000131659527	196189430	/nfs/dbraw/zinc/18/94/30/196189430.db2.gz	MFQFAUYYGWJSEI-TUKIKUTGSA-N	0	3	309.479	2.462	10	0		DEAEHN
CNCc1sccc1S(=O)(=O)N1CC[C@H](C)[C@@H](C)C1	ZINC000131777455	196198322	/nfs/dbraw/zinc/19/83/22/196198322.db2.gz	FRJHOZFOHHWKON-QWRGUYRKSA-N	0	3	302.465	2.134	10	0		DEAEHN
CN(C)C[C@H](NC(=O)[C@@H]1CCCc2n[nH]cc21)c1ccccc1	ZINC000131937111	196211603	/nfs/dbraw/zinc/21/16/03/196211603.db2.gz	XAPYAXPQEQQBBH-PBHICJAKSA-N	0	3	312.417	2.249	10	0		DEAEHN
COC[C@H](C)C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000131970950	196215295	/nfs/dbraw/zinc/21/52/95/196215295.db2.gz	WOQPFLXNLAMQFV-JKSUJKDBSA-N	0	3	304.434	2.392	10	0		DEAEHN
C[C@@H]1CNC[C@H](COCc2cc(F)cc(Br)c2)O1	ZINC000132629425	196271746	/nfs/dbraw/zinc/27/17/46/196271746.db2.gz	VXSWGZZTVHCZNO-NOZJJQNGSA-N	0	3	318.186	2.482	10	0		DEAEHN
COCc1nc(NN)cc(Nc2cc(OC)ccc2Cl)n1	ZINC000132865317	196292029	/nfs/dbraw/zinc/29/20/29/196292029.db2.gz	XXSRUAKYGCMJHJ-UHFFFAOYSA-N	0	3	309.757	2.314	10	0		DEAEHN
CNC(=O)c1ccc(Cl)c(NC(=O)[C@@]2(C)CCCCN2)c1	ZINC000133165692	196317252	/nfs/dbraw/zinc/31/72/52/196317252.db2.gz	XBGCQUJRTHAOTH-OAHLLOKOSA-N	0	3	309.797	2.170	10	0		DEAEHN
CCN[C@H](C[C@@H]1CCCN(S(C)(=O)=O)C1)c1occc1C	ZINC000133190341	196319930	/nfs/dbraw/zinc/31/99/30/196319930.db2.gz	GANNZJBDVUVLLB-UONOGXRCSA-N	0	3	314.451	2.300	10	0		DEAEHN
CN(C)CCn1ncc(Cl)c1C(=O)C1(N(C)C)CCCC1	ZINC000134133112	196364519	/nfs/dbraw/zinc/36/45/19/196364519.db2.gz	MXAPIZCRHJHGNX-UHFFFAOYSA-N	0	3	312.845	2.155	10	0		DEAEHN
CC[C@H](CCO)NCC(=O)Nc1ccccc1Br	ZINC000134399536	196386076	/nfs/dbraw/zinc/38/60/76/196386076.db2.gz	ASPXMBMNWDZJHM-SNVBAGLBSA-N	0	3	315.211	2.138	10	0		DEAEHN
COCCNCc1cc(Br)cc(C)c1OCOC	ZINC000135863391	196505957	/nfs/dbraw/zinc/50/59/57/196505957.db2.gz	XYIHGOQKMNARIZ-UHFFFAOYSA-N	0	3	318.211	2.476	10	0		DEAEHN
COCCCN(C)CCNC(=O)Nc1ccc2cc[nH]c2c1	ZINC000194254612	225178821	/nfs/dbraw/zinc/17/88/21/225178821.db2.gz	JSNCUICGUOXLFG-UHFFFAOYSA-N	0	3	304.394	2.258	10	0		DEAEHN
Cc1cc(OCC(=O)N2CCN3CCC[C@H]3C2)ccc1Cl	ZINC000195315982	225201759	/nfs/dbraw/zinc/20/17/59/225201759.db2.gz	UMNMHTGFFQSHFR-ZDUSSCGKSA-N	0	3	308.809	2.334	10	0		DEAEHN
Cc1cc(Cl)c(C)c(S(=O)(=O)[N-]CCC[NH3+])c1Cl	ZINC000036297813	424807400	/nfs/dbraw/zinc/80/74/00/424807400.db2.gz	AYEXQQODJKJVQZ-UHFFFAOYSA-N	0	3	311.234	2.237	10	0		DEAEHN
COCCN(C)CCCNC(=O)NC[C@H]1C[C@@H]1c1ccccc1	ZINC000111826173	424851978	/nfs/dbraw/zinc/85/19/78/424851978.db2.gz	UYXJHPFJQMYTEW-IAGOWNOFSA-N	0	3	319.449	2.058	10	0		DEAEHN
COc1cccc(CNC(=O)Nc2cccc(CN(C)C)c2)n1	ZINC000194630404	424877634	/nfs/dbraw/zinc/87/76/34/424877634.db2.gz	ATLCVCVCIVTNKJ-UHFFFAOYSA-N	0	3	314.389	2.474	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)CCc2cc(OC)cc(OC)c2)C1	ZINC000194641288	424877726	/nfs/dbraw/zinc/87/77/26/424877726.db2.gz	ATLKUMUYEOAUJA-OAHLLOKOSA-N	0	3	320.433	2.237	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccc(N3CCC(C)=N3)cc2)C1	ZINC000194659417	424877734	/nfs/dbraw/zinc/87/77/34/424877734.db2.gz	VTDLPYNKAQMTFY-INIZCTEOSA-N	0	3	314.433	2.487	10	0		DEAEHN
O=C(COc1ccc(F)c(Cl)c1)N1CCN2CCC[C@@H]2C1	ZINC000195328486	424882121	/nfs/dbraw/zinc/88/21/21/424882121.db2.gz	VANWNKUXSJQLDP-LLVKDONJSA-N	0	3	312.772	2.165	10	0		DEAEHN
Cc1nn(CC(C)C)c(C)c1CC(=O)N(C)[C@@H]1CCCN(C)C1	ZINC000153799491	424860081	/nfs/dbraw/zinc/86/00/81/424860081.db2.gz	GFGIYTWJWIXMRO-MRXNPFEDSA-N	0	3	320.481	2.251	10	0		DEAEHN
O[C@]1(CCNCc2cc(Br)cs2)CCOC1	ZINC000404180540	424925525	/nfs/dbraw/zinc/92/55/25/424925525.db2.gz	BNRXLFNMWWHECY-LLVKDONJSA-N	0	3	306.225	2.142	10	0		DEAEHN
COc1ccc(CNC2CC(CO)C2)cc1Br	ZINC000657808590	425404085	/nfs/dbraw/zinc/40/40/85/425404085.db2.gz	MTKWLLPGMWQHON-UHFFFAOYSA-N	0	3	300.196	2.318	10	0		DEAEHN
Cc1nn(C)c2ncc(CN3CC[C@@H](O)CC34CCC4)cc12	ZINC000333892723	269001286	/nfs/dbraw/zinc/00/12/86/269001286.db2.gz	XNKGZOSCLYGRGI-CQSZACIVSA-N	0	3	300.406	2.156	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)c2cscc2Br)C1	ZINC000405031835	269112952	/nfs/dbraw/zinc/11/29/52/269112952.db2.gz	PHNYTSMEAVCHJG-MRVPVSSYSA-N	0	3	303.225	2.335	10	0		DEAEHN
COc1ccc2nc(C(=O)N3CCN4CCC[C@H]4C3)ccc2c1	ZINC000171585559	274141866	/nfs/dbraw/zinc/14/18/66/274141866.db2.gz	JKKJVWHJUGYNJD-AWEZNQCLSA-N	0	3	311.385	2.164	10	0		DEAEHN
C[C@@H](N)C(=O)Nc1ccc(I)cc1Cl	ZINC000037045431	274234577	/nfs/dbraw/zinc/23/45/77/274234577.db2.gz	ZDZOLRKVIJBURE-RXMQYKEDSA-N	0	3	324.549	2.230	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)Cc1c(F)cccc1F	ZINC000122791137	276118173	/nfs/dbraw/zinc/11/81/73/276118173.db2.gz	MYOCVHCSEKBTPI-LLVKDONJSA-N	0	3	320.405	2.115	10	0		DEAEHN
CC1CCN(CCNC(=O)N2CC[C@]3(O)CCCC[C@H]3C2)CC1	ZINC000162772288	276197722	/nfs/dbraw/zinc/19/77/22/276197722.db2.gz	IRFIMPJCMUSVIY-FUHWJXTLSA-N	0	3	323.481	2.055	10	0		DEAEHN
CCc1ccc(NC(=O)[C@H](C)NCCn2cc(C)cn2)cc1	ZINC000105881266	276689295	/nfs/dbraw/zinc/68/92/95/276689295.db2.gz	PJJRFXOZFRWZFT-AWEZNQCLSA-N	0	3	300.406	2.371	10	0		DEAEHN
CN1C(=O)C[C@H](N[C@@H]2CCCOC2)[C@@H]1c1ccc(Cl)cc1	ZINC000179587904	277015211	/nfs/dbraw/zinc/01/52/11/277015211.db2.gz	MPXIVSAOILZNAI-YCPHGPKFSA-N	0	3	308.809	2.380	10	0		DEAEHN
CN1CCC(CC(=O)N2CCOC[C@@H]2c2ccc(F)cc2)CC1	ZINC000456472397	277025713	/nfs/dbraw/zinc/02/57/13/277025713.db2.gz	IENCXAZXMOZTEH-QGZVFWFLSA-N	0	3	320.408	2.458	10	0		DEAEHN
CC(C)(C)OC(=O)[C@@]1(C)CCN(C[C@H](O)CC(F)(F)F)C1	ZINC000459565792	277207071	/nfs/dbraw/zinc/20/70/71/277207071.db2.gz	SJGWGFRKKWIRQW-MFKMUULPSA-N	0	3	311.344	2.353	10	0		DEAEHN
CC(=O)N1CC[C@H](NCC2(C)OCCCO2)c2ccccc2C1	ZINC000373805649	278055618	/nfs/dbraw/zinc/05/56/18/278055618.db2.gz	FTDCXYFPKMHUAG-KRWDZBQOSA-N	0	3	318.417	2.223	10	0		DEAEHN
C[C@H](CNC(=O)N1CCCC[C@H]1c1cn[nH]c1)N(C)C1CC1	ZINC000182701855	278199045	/nfs/dbraw/zinc/19/90/45/278199045.db2.gz	ZFHQGEMRDGXMDI-DOMZBBRYSA-N	0	3	305.426	2.129	10	0		DEAEHN
C[C@@H]1NC(=S)N(C[C@@H]2CCCN(C)[C@H]2c2cccs2)C1=O	ZINC000369676930	279029536	/nfs/dbraw/zinc/02/95/36/279029536.db2.gz	BMPJEGMOMIDKBQ-GMXVVIOVSA-N	0	3	323.487	2.236	10	0		DEAEHN
CC(C)C[C@H](CO)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248130094	279171250	/nfs/dbraw/zinc/17/12/50/279171250.db2.gz	WJNBCAVPDYVXES-IKGGRYGDSA-N	0	3	319.449	2.138	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCOC3(CCCCC3)C2)C1	ZINC000174237849	279293930	/nfs/dbraw/zinc/29/39/30/279293930.db2.gz	UNQIVZBYFAQOHW-OAHLLOKOSA-N	0	3	309.454	2.215	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CCCS(=O)(=O)c1ccccc1	ZINC000175329979	279301485	/nfs/dbraw/zinc/30/14/85/279301485.db2.gz	KDHWSHISCRGTPB-MRXNPFEDSA-N	0	3	324.490	2.267	10	0		DEAEHN
CC[C@@H](C(=O)NCC[C@@H]1COc2ccccc2O1)N(CC)CC	ZINC000361914977	280076759	/nfs/dbraw/zinc/07/67/59/280076759.db2.gz	GNDOUQPODHUWPS-CABCVRRESA-N	0	3	320.433	2.453	10	0		DEAEHN
CC1(C)CC[C@@H](NC(=O)C2(N)CCOCC2)c2ccccc21	ZINC000261829313	281108679	/nfs/dbraw/zinc/10/86/79/281108679.db2.gz	KSXUTAQYLGIOTK-OAHLLOKOSA-N	0	3	302.418	2.423	10	0		DEAEHN
CN(C)Cc1cccc(CNC(=O)NCc2cscn2)c1	ZINC000051750745	281471676	/nfs/dbraw/zinc/47/16/76/281471676.db2.gz	LXODRBREJYTLKI-UHFFFAOYSA-N	0	3	304.419	2.204	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)c2ccnc(OC3CCC3)c2)[C@@H](C)C1	ZINC000134480173	282043137	/nfs/dbraw/zinc/04/31/37/282043137.db2.gz	APCFYLQOAKXSDY-BBRMVZONSA-N	0	3	317.433	2.471	10	0		DEAEHN
C[C@H](O)C1CCN(Cc2ccccc2N2CCOCC2)CC1	ZINC000092970674	290068758	/nfs/dbraw/zinc/06/87/58/290068758.db2.gz	SOYJEMDOCAWWES-HNNXBMFYSA-N	0	3	304.434	2.116	10	0		DEAEHN
Cc1nc(C(F)(F)F)ccc1C(=O)N1CC[C@@H](N(C)C)C1	ZINC000168639662	293206874	/nfs/dbraw/zinc/20/68/74/293206874.db2.gz	KVKPOFZZBQGVJF-SNVBAGLBSA-N	0	3	301.312	2.185	10	0		DEAEHN
COc1c(C)cnc(CN2CCNC[C@@H]2c2cccnc2)c1C	ZINC000261877669	294899296	/nfs/dbraw/zinc/89/92/96/294899296.db2.gz	YCJHTTFUGZGHNB-QGZVFWFLSA-N	0	3	312.417	2.249	10	0		DEAEHN
Cc1cc(F)ccc1[C@H]1C(=O)NCCN1CCN1CCCCC1	ZINC000184745098	301324591	/nfs/dbraw/zinc/32/45/91/301324591.db2.gz	ZHJWIVZISVURHD-KRWDZBQOSA-N	0	3	319.424	2.093	10	0		DEAEHN
CC[C@H](N[C@H](C)C1CCS(=O)(=O)CC1)c1nccs1	ZINC000187228174	332963622	/nfs/dbraw/zinc/96/36/22/332963622.db2.gz	LJORHNJYCVMYRD-PWSUYJOCSA-N	0	3	302.465	2.397	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)N2CC3(CCCC3)OC(C)(C)C2)C1	ZINC000188184785	333038642	/nfs/dbraw/zinc/03/86/42/333038642.db2.gz	DCHPLLOIFQJTBO-OAHLLOKOSA-N	0	3	323.481	2.461	10	0		DEAEHN
COC[C@@H](C)CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	ZINC000188231796	333039804	/nfs/dbraw/zinc/03/98/04/333039804.db2.gz	XSLGRNHPQHHHGD-HZMBPMFUSA-N	0	3	314.788	2.457	10	0		DEAEHN
COC[C@@H](C)CN1CCN(c2ncnc3sc(C)cc32)CC1	ZINC000188757688	333054543	/nfs/dbraw/zinc/05/45/43/333054543.db2.gz	TZVYFJZNUMXDAQ-LBPRGKRZSA-N	0	3	320.462	2.404	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN1CCC(c2c[nH]c3ncccc23)CC1	ZINC000582587055	337110149	/nfs/dbraw/zinc/11/01/49/337110149.db2.gz	UPVCVXHKDJHFET-KRWDZBQOSA-N	0	3	301.390	2.082	10	0		DEAEHN
CC(C)[N@H+]1C[C@H](NC(=O)NCc2ccc([O-])c(F)c2)[C@@H](C)C1	ZINC000132582334	519697062	/nfs/dbraw/zinc/69/70/62/519697062.db2.gz	GTMIFVMGOFQKEA-FZMZJTMJSA-N	0	3	309.385	2.059	10	0		DEAEHN
CC(C)[N@@H+]1C[C@H](NC(=O)NCc2ccc([O-])c(F)c2)[C@@H](C)C1	ZINC000132582334	519697063	/nfs/dbraw/zinc/69/70/63/519697063.db2.gz	GTMIFVMGOFQKEA-FZMZJTMJSA-N	0	3	309.385	2.059	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)N[C@@H](C)c1ccc(N2CCCC2=O)cc1	ZINC000153643960	521832952	/nfs/dbraw/zinc/83/29/52/521832952.db2.gz	BZASJCRBEPWVIF-GDZNZVCISA-N	0	3	317.433	2.364	10	0		DEAEHN
COCc1ccc(CN2CCC[C@H](Cn3cncn3)C2)cc1	ZINC000128508932	522974095	/nfs/dbraw/zinc/97/40/95/522974095.db2.gz	BSTSCJJHMQVNBP-KRWDZBQOSA-N	0	3	300.406	2.337	10	0		DEAEHN
CO[C@@H]1CC[C@@H]2OCCN(CCCCCn3cccn3)[C@@H]2C1	ZINC000158447361	523707992	/nfs/dbraw/zinc/70/79/92/523707992.db2.gz	CPEKPVBJMRTZER-ZACQAIPSSA-N	0	3	307.438	2.322	10	0		DEAEHN
COCCN1CCC[C@@H]1CN[C@@H](C)c1cc(OC)ccc1OC	ZINC000163285667	523828749	/nfs/dbraw/zinc/82/87/49/523828749.db2.gz	ASLBYFRMGWWBBW-LSDHHAIUSA-N	0	3	322.449	2.465	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(C[C@@H](O)COCC(C)C)CC2	ZINC000374347434	534882713	/nfs/dbraw/zinc/88/27/13/534882713.db2.gz	CCOFFFHAIKVOHA-LJQANCHMSA-N	0	3	319.445	2.323	10	0		DEAEHN
C[C@@]1(CNC(=O)Cn2cccn2)CCCN1Cc1ccccc1	ZINC000163375152	525835186	/nfs/dbraw/zinc/83/51/86/525835186.db2.gz	ONQVJAUVKIKYPX-SFHVURJKSA-N	0	3	312.417	2.054	10	0		DEAEHN
Cc1cnc(CCN(C)C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)s1	ZINC000121352181	525991911	/nfs/dbraw/zinc/99/19/11/525991911.db2.gz	ZREJXTLYHFTKNG-WCQYABFASA-N	0	3	322.478	2.261	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)NC1CCN(C)CC1	ZINC000154344397	527581330	/nfs/dbraw/zinc/58/13/30/527581330.db2.gz	RCRAQXGJZOBCTR-GFCCVEGCSA-N	0	3	321.469	2.401	10	0		DEAEHN
CC(C)c1cccc(OCC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000195330915	528180646	/nfs/dbraw/zinc/18/06/46/528180646.db2.gz	CUBXXOGWQJNEQI-INIZCTEOSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCN1CCC[C@@H](CN(C)Cc2ccon2)[C@@H]1c1cnn(C)c1	ZINC000328626454	529045873	/nfs/dbraw/zinc/04/58/73/529045873.db2.gz	FCIKTWQHHLEJAP-WMLDXEAASA-N	0	3	317.437	2.313	10	0		DEAEHN
CC(C)(C)c1ccc(CCNC(=O)C2(N)CCOCC2)cc1	ZINC000261866391	535116249	/nfs/dbraw/zinc/11/62/49/535116249.db2.gz	NRVLNXBGAFLPBC-UHFFFAOYSA-N	0	3	304.434	2.151	10	0		DEAEHN
CCCN(C)CC(=O)N[C@@H](c1ccn(C)n1)c1ccc(F)cc1	ZINC000358904541	535252825	/nfs/dbraw/zinc/25/28/25/535252825.db2.gz	JOYAMYCUYCAMAM-QGZVFWFLSA-N	0	3	318.396	2.107	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)Nc1ccc(Cn2cncn2)cc1	ZINC000261949497	535298107	/nfs/dbraw/zinc/29/81/07/535298107.db2.gz	WDEJPDILWJKIJU-OAHLLOKOSA-N	0	3	313.405	2.043	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)N1CC[C@@]2(O)CCCC[C@@H]2C1	ZINC000247188157	535483967	/nfs/dbraw/zinc/48/39/67/535483967.db2.gz	ZQTNMAYOCBRKDM-NUJGCVRESA-N	0	3	323.481	2.197	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)[C@H](C)Oc1ccc(OC)cc1	ZINC000253383579	535564838	/nfs/dbraw/zinc/56/48/38/535564838.db2.gz	LYRHMVXCDUWQJF-UONOGXRCSA-N	0	3	306.406	2.063	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)[C@@H]1CCc2nc(C(C)C)[nH]c2C1	ZINC000372392136	535601570	/nfs/dbraw/zinc/60/15/70/535601570.db2.gz	ACEUEJVKIHUMDQ-KGLIPLIRSA-N	0	3	318.465	2.239	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)[C@@H]1CCc2[nH]c(C(C)C)nc2C1	ZINC000372392136	535601575	/nfs/dbraw/zinc/60/15/75/535601575.db2.gz	ACEUEJVKIHUMDQ-KGLIPLIRSA-N	0	3	318.465	2.239	10	0		DEAEHN
CCN(C)c1ccc(CNCc2ccc(-n3cncn3)cc2)cn1	ZINC000190953851	535764473	/nfs/dbraw/zinc/76/44/73/535764473.db2.gz	BBGYQPOUWPKHFX-UHFFFAOYSA-N	0	3	322.416	2.408	10	0		DEAEHN
CN(C)CCN(C)C(=O)c1cccc(OCc2cscn2)c1	ZINC000359597736	535849843	/nfs/dbraw/zinc/84/98/43/535849843.db2.gz	ZYAZFPVLPQOCRB-UHFFFAOYSA-N	0	3	319.430	2.356	10	0		DEAEHN
CN(C(=O)CN1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1)C1CC1	ZINC000246444141	535987789	/nfs/dbraw/zinc/98/77/89/535987789.db2.gz	DJOXVHTUCJPZKZ-IAGOWNOFSA-N	0	3	320.408	2.334	10	0		DEAEHN
COc1ccc(CN[C@H](C(N)=O)C(C)C)cc1Br	ZINC000107322925	563316399	/nfs/dbraw/zinc/31/63/99/563316399.db2.gz	XXILIUSAZLHSMR-LBPRGKRZSA-N	0	3	315.211	2.057	10	0		DEAEHN
Nc1nc(N[C@H]2CCN(Cc3ccccc3)C2)nc(C2CC2)n1	ZINC000309785003	625569968	/nfs/dbraw/zinc/56/99/68/625569968.db2.gz	GDXGTUQBVQYLED-AWEZNQCLSA-N	0	3	310.405	2.018	10	0		DEAEHN
Cc1c(CNCCN(C(=O)OC(C)(C)C)C2CC2)cnn1C	ZINC000161891068	625232964	/nfs/dbraw/zinc/23/29/64/625232964.db2.gz	TYBNURARYGFPCY-UHFFFAOYSA-N	0	3	308.426	2.218	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)CCN(c2ncc(C=O)cn2)C1	ZINC000323304776	641355218	/nfs/dbraw/zinc/35/52/18/641355218.db2.gz	CVCGERYNAVXXIY-OAHLLOKOSA-N	0	3	310.401	2.247	10	0		DEAEHN
CCN1CC[C@H](N[C@@H](C)c2ccc(N3CCCC3=O)cc2)C1=O	ZINC000802318006	645516595	/nfs/dbraw/zinc/51/65/95/645516595.db2.gz	LWVQFJGEFUSFQE-BBRMVZONSA-N	0	3	315.417	2.085	10	0		DEAEHN
C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NNc2ccncc2)c1	ZINC000180517503	648497035	/nfs/dbraw/zinc/49/70/35/648497035.db2.gz	XRXRHQCEMXPWIW-ABAIWWIYSA-N	0	3	310.357	2.433	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1cnc(Cl)c(C)c1	ZINC000117359795	684068955	/nfs/dbraw/zinc/06/89/55/684068955.db2.gz	BLSVALYIKPALPK-NSHDSACASA-N	0	3	319.858	2.052	10	0		DEAEHN
C[C@@H](NCC1(C)OCCCO1)c1ccc(N2CCOC2=O)cc1	ZINC000190663186	684411657	/nfs/dbraw/zinc/41/16/57/684411657.db2.gz	WFSUYPKCKITPIF-CYBMUJFWSA-N	0	3	320.389	2.447	10	0		DEAEHN
COCC[N@@H+]1CCN(Cc2c([O-])ccc(Cl)c2F)C[C@H]1C	ZINC000191336539	684426159	/nfs/dbraw/zinc/42/61/59/684426159.db2.gz	CFWGKUOXOSNPFW-LLVKDONJSA-N	0	3	316.804	2.337	10	0		DEAEHN
COCC[N@H+]1CCN(Cc2c([O-])ccc(Cl)c2F)C[C@H]1C	ZINC000191336539	684426161	/nfs/dbraw/zinc/42/61/61/684426161.db2.gz	CFWGKUOXOSNPFW-LLVKDONJSA-N	0	3	316.804	2.337	10	0		DEAEHN
CC(C)Nc1ncnc2c1ncn2CN1CCSC[C@H](C)C1	ZINC000192180152	684443462	/nfs/dbraw/zinc/44/34/62/684443462.db2.gz	RSCWYZBLBAOFSC-GFCCVEGCSA-N	0	3	320.466	2.289	10	0		DEAEHN
CC1(CNCc2ccc(OC[C@H]3CCCO3)cc2)OCCCO1	ZINC000192248489	684445523	/nfs/dbraw/zinc/44/55/23/684445523.db2.gz	UWSHRSQYOYXBKR-QGZVFWFLSA-N	0	3	321.417	2.487	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)[C@@H]1CSCCS1)c1ccccc1	ZINC000192933035	684460954	/nfs/dbraw/zinc/46/09/54/684460954.db2.gz	WTIKUIIEKXZBBP-KGLIPLIRSA-N	0	3	310.488	2.254	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)[C@H]1CC(c2ccccc2)=NO1	ZINC000249504291	685181310	/nfs/dbraw/zinc/18/13/10/685181310.db2.gz	FFTSBWJPDLNWMD-RHSMWYFYSA-N	0	3	315.417	2.170	10	0		DEAEHN
CN(C)[C@H]1Cc2ccccc2N(C(=O)/C=C\c2ccncn2)C1	ZINC000588438841	777195049	/nfs/dbraw/zinc/19/50/49/777195049.db2.gz	BEFPAPNJJMYZSP-PTZVLDCSSA-N	0	3	308.385	2.009	10	0		DEAEHN
C[C@](O)(CN1CC[C@@H]2OCC[C@@H]2C1)C(F)(F)C(F)(F)F	ZINC000724681612	777460360	/nfs/dbraw/zinc/46/03/60/777460360.db2.gz	CKFPIQBUGYHXEQ-UTLUCORTSA-N	0	3	303.271	2.046	10	0		DEAEHN
CC[C@@H](NCc1cn(C)nc1Br)[C@H]1CCCOC1	ZINC000723959418	787346178	/nfs/dbraw/zinc/34/61/78/787346178.db2.gz	QYGPCPUAVZCUSE-CMPLNLGQSA-N	0	3	316.243	2.477	10	0		DEAEHN
COC[C@@]1(C)CCN(C[C@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724074657	787348177	/nfs/dbraw/zinc/34/81/77/787348177.db2.gz	QJRBRTNELZIKFT-UWVGGRQHSA-N	0	3	305.287	2.293	10	0		DEAEHN
Cn1cc(CNC[C@]23CCC[C@H]2OCC3)c(Br)n1	ZINC000712497966	792191025	/nfs/dbraw/zinc/19/10/25/792191025.db2.gz	ILBRGRFUOXZKBR-DGCLKSJQSA-N	0	3	314.227	2.231	10	0		DEAEHN
COc1ccc([C@H](C)N[C@H]2C[C@H](S(C)(=O)=O)C2)cc1F	ZINC000714252246	792305506	/nfs/dbraw/zinc/30/55/06/792305506.db2.gz	ZPEMFJXONRROHV-DLOVCJGASA-N	0	3	301.383	2.061	10	0		DEAEHN
c1cn(-c2ccccc2)nc1CNCCCOC[C@H]1CCOC1	ZINC000091060973	801487071	/nfs/dbraw/zinc/48/70/71/801487071.db2.gz	FXBGWBRKXBEDOR-MRXNPFEDSA-N	0	3	315.417	2.405	10	0		DEAEHN
CCc1nc(CN[C@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)n[nH]1	ZINC000401796580	801852795	/nfs/dbraw/zinc/85/27/95/801852795.db2.gz	JVJYDGNNVVUKHK-NEPJUHHUSA-N	0	3	323.441	2.102	10	0		DEAEHN
CN1CCC[C@H]2[C@@H]1CCN2C(=O)c1ccoc1Br	ZINC000720817242	1086168210	/nfs/dbraw/zinc/16/82/10/1086168210.db2.gz	RHUJXQFVHPBNTK-QWRGUYRKSA-N	0	3	313.195	2.351	10	0		DEAEHN
C[C@H](N[C@H]1CON(C(=O)OC(C)(C)C)C1)[C@H]1CCCCO1	ZINC000703289523	1086492794	/nfs/dbraw/zinc/49/27/94/1086492794.db2.gz	IPFHIHQPNSICER-YNEHKIRRSA-N	0	3	300.399	2.085	10	0		DEAEHN
COC[C@H](C)OC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000704405063	1086579505	/nfs/dbraw/zinc/57/95/05/1086579505.db2.gz	OBPINPPBUCUPOZ-DZKIICNBSA-N	0	3	306.406	2.268	10	0		DEAEHN
COC[C@@H](C)OC(=O)N[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000704469441	1086580725	/nfs/dbraw/zinc/58/07/25/1086580725.db2.gz	AOYUBXKMOXISDQ-RHSMWYFYSA-N	0	3	306.406	2.412	10	0		DEAEHN
COC[C@H](C)OC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000704405066	1086580763	/nfs/dbraw/zinc/58/07/63/1086580763.db2.gz	OBPINPPBUCUPOZ-YCPHGPKFSA-N	0	3	306.406	2.268	10	0		DEAEHN
COC[C@H](C)OC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000704489278	1086583281	/nfs/dbraw/zinc/58/32/81/1086583281.db2.gz	NTTVFGMLKUSEAT-HOCLYGCPSA-N	0	3	306.406	2.364	10	0		DEAEHN
Cn1ncc(CN[C@H]2CCCCCN(Cc3ccccc3)C2)n1	ZINC000709621424	1086683533	/nfs/dbraw/zinc/68/35/33/1086683533.db2.gz	VETBTTCHGWCIOB-KRWDZBQOSA-N	0	3	313.449	2.350	10	0		DEAEHN
C[C@@H](NCc1cnc2n1CCC2)[C@H](C)NC(=O)OC(C)(C)C	ZINC000719117123	1088843510	/nfs/dbraw/zinc/84/35/10/1088843510.db2.gz	QKLAKAUMWAYCHG-NEPJUHHUSA-N	0	3	308.426	2.221	10	0		DEAEHN
C[C@@H]1[C@H](NC(=O)c2c(F)cccc2Br)CCN1C	ZINC000719388968	1089080401	/nfs/dbraw/zinc/08/04/01/1089080401.db2.gz	UBBKVVKOMFTONQ-LDYMZIIASA-N	0	3	315.186	2.411	10	0		DEAEHN
CCOc1ccc([C@H](CSCCS(C)(=O)=O)NC)cc1	ZINC000081768798	192323113	/nfs/dbraw/zinc/32/31/13/192323113.db2.gz	AINJDFWKNOYZGX-AWEZNQCLSA-N	0	3	317.476	2.124	10	0		DEAEHN
CCOC(=O)CSC[C@@H](NC)c1ccc(OC)c(OC)c1	ZINC000081795518	192324295	/nfs/dbraw/zinc/32/42/95/192324295.db2.gz	CHCSEGQHHYPAJA-GFCCVEGCSA-N	0	3	313.419	2.261	10	0		DEAEHN
C/C=C/CC[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)(C)C)o1	ZINC000162387280	197562931	/nfs/dbraw/zinc/56/29/31/197562931.db2.gz	DIMTZEHAJOQNOP-AATRIKPKSA-N	0	3	300.424	2.412	10	0		DEAEHN
Cc1cc(Br)cnc1OC[C@@H]1CNCC(C)(C)O1	ZINC000162800679	197592806	/nfs/dbraw/zinc/59/28/06/197592806.db2.gz	RAPBUOYDDLCGEU-NSHDSACASA-N	0	3	315.211	2.298	10	0		DEAEHN
COc1ccc(CN)cc1CS(=O)(=O)c1ccccc1F	ZINC000081922845	192339542	/nfs/dbraw/zinc/33/95/42/192339542.db2.gz	KDMYPIVAMSXGJI-UHFFFAOYSA-N	0	3	309.362	2.267	10	0		DEAEHN
Cc1nc2ccccn2c1CCC(=O)N(C)C1CCN(C)CC1	ZINC000096772824	185386948	/nfs/dbraw/zinc/38/69/48/185386948.db2.gz	KJQOPGJNCABCEG-UHFFFAOYSA-N	0	3	314.433	2.128	10	0		DEAEHN
CN1CCC(OCC(C)(C)N2C(=O)c3ccccc3C2=O)CC1	ZINC000096777630	185387195	/nfs/dbraw/zinc/38/71/95/185387195.db2.gz	SIMQCIDMGOQIRB-UHFFFAOYSA-N	0	3	316.401	2.172	10	0		DEAEHN
Cc1nccn1CCN1CCN(Cc2cc(F)ccc2F)CC1	ZINC000077121752	185110557	/nfs/dbraw/zinc/11/05/57/185110557.db2.gz	GESWIGSKSWBDNK-UHFFFAOYSA-N	0	3	320.387	2.288	10	0		DEAEHN
CC[C@@H](N)[C@H](C)S(=O)(=O)c1ccccc1Br	ZINC000081931522	192341528	/nfs/dbraw/zinc/34/15/28/192341528.db2.gz	HYTQGPJMFATWTD-WCBMZHEXSA-N	0	3	306.225	2.349	10	0		DEAEHN
CN[C@@H]1CCOC[C@@H]1S(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000081930537	192341794	/nfs/dbraw/zinc/34/17/94/192341794.db2.gz	NUHQKGZXGQECRY-CABCVRRESA-N	0	3	311.447	2.135	10	0		DEAEHN
CN[C@H]1CCC[C@H]1S(=O)(=O)c1ccccc1Br	ZINC000081931562	192341953	/nfs/dbraw/zinc/34/19/53/192341953.db2.gz	FDYRBQVYDURPOR-CMPLNLGQSA-N	0	3	318.236	2.363	10	0		DEAEHN
CC[C@@H](NC)[C@H](C)S(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000081936075	192342535	/nfs/dbraw/zinc/34/25/35/192342535.db2.gz	CTNATFLGWRTPKR-WCQYABFASA-N	0	3	313.419	2.008	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NC[C@@H](c1ccco1)N(C)C	ZINC000079192864	185161349	/nfs/dbraw/zinc/16/13/49/185161349.db2.gz	JDYJITTWPUNIRP-CABCVRRESA-N	0	3	324.469	2.158	10	0		DEAEHN
CC(C)[C@H]1CCCN(S(=O)(=O)C[C@@H]2CCCCN2)CC1	ZINC000079382414	185167818	/nfs/dbraw/zinc/16/78/18/185167818.db2.gz	XNLHFSFMYGAMDE-GJZGRUSLSA-N	0	3	302.484	2.216	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCC[C@H]2CCC[C@@H]21	ZINC000173175245	282188318	/nfs/dbraw/zinc/18/83/18/282188318.db2.gz	YFNOKXGOEWPRAH-OAGGEKHMSA-N	0	3	309.454	2.071	10	0		DEAEHN
COc1ccc(Br)cc1[C@H](N)CC(C)(C)C(N)=O	ZINC000087722132	185230958	/nfs/dbraw/zinc/23/09/58/185230958.db2.gz	PMPMQYKNRSOXLM-SNVBAGLBSA-N	0	3	315.211	2.359	10	0		DEAEHN
COCCN(C)CCNc1cc(Br)ccc1N	ZINC000087835594	185232966	/nfs/dbraw/zinc/23/29/66/185232966.db2.gz	RJGYGSYOQZCYGL-UHFFFAOYSA-N	0	3	302.216	2.021	10	0		DEAEHN
CCNc1ncc(Br)c(SCCN(C)C)n1	ZINC000087852351	185233633	/nfs/dbraw/zinc/23/36/33/185233633.db2.gz	HBPJYUXZMVKLEG-UHFFFAOYSA-N	0	3	305.245	2.325	10	0		DEAEHN
N[C@H]1CC(=O)N(c2c3nsnc3c(Cl)cc2Cl)C1	ZINC000088127205	185240254	/nfs/dbraw/zinc/24/02/54/185240254.db2.gz	XZZYPMGCZVJOQC-BYPYZUCNSA-N	0	3	303.174	2.062	10	0		DEAEHN
CC[C@@H](CN)S(=O)(=O)N1CCC(Cc2ccccc2)CC1	ZINC000088472435	185252277	/nfs/dbraw/zinc/25/22/77/185252277.db2.gz	RQAXDSIQPKCHHK-INIZCTEOSA-N	0	3	310.463	2.008	10	0		DEAEHN
Cc1cc(C)c2c(N)c(C(=O)NC[C@@H](C)N(C)C)sc2n1	ZINC000088642588	185261176	/nfs/dbraw/zinc/26/11/76/185261176.db2.gz	TUAHBYBTIPMRSQ-SNVBAGLBSA-N	0	3	306.435	2.175	10	0		DEAEHN
CCOc1ccccc1-c1nnc(CCNCCOC)s1	ZINC000088824229	185266617	/nfs/dbraw/zinc/26/66/17/185266617.db2.gz	ADTBTJYCBNFXPA-UHFFFAOYSA-N	0	3	307.419	2.382	10	0		DEAEHN
CCN[C@@H]1c2ccccc2CC[C@@H]1S(=O)(=O)CCCOC	ZINC000081986159	192349678	/nfs/dbraw/zinc/34/96/78/192349678.db2.gz	YRUUUTKNXHGDNM-JKSUJKDBSA-N	0	3	311.447	2.103	10	0		DEAEHN
CN[C@@H](c1ccc(C)cc1)[C@@H](C)S(=O)(=O)C1CCOCC1	ZINC000081990333	192350679	/nfs/dbraw/zinc/35/06/79/192350679.db2.gz	TUIIUCCPSKZASV-CZUORRHYSA-N	0	3	311.447	2.238	10	0		DEAEHN
CN[C@@H](c1ccc(C)cc1)[C@H](C)S(=O)(=O)C1CCOCC1	ZINC000081990338	192351100	/nfs/dbraw/zinc/35/11/00/192351100.db2.gz	TUIIUCCPSKZASV-XJKSGUPXSA-N	0	3	311.447	2.238	10	0		DEAEHN
N[C@@H]1COC[C@@H]1c1nc(Cc2c(Cl)cccc2Cl)no1	ZINC000090364596	185292829	/nfs/dbraw/zinc/29/28/29/185292829.db2.gz	QGDSQTQMWZTUSS-GZMMTYOYSA-N	0	3	314.172	2.408	10	0		DEAEHN
CCN[C@@H]1COC[C@@H]1c1nc(Cc2ccc(Cl)cc2)no1	ZINC000090473334	185298480	/nfs/dbraw/zinc/29/84/80/185298480.db2.gz	QTBBVIFIGOYBNC-QWHCGFSZSA-N	0	3	307.781	2.406	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)N(C)C[C@@H]1CCCO1	ZINC000181335861	199282296	/nfs/dbraw/zinc/28/22/96/199282296.db2.gz	PQXRUPKQPZULHC-RDJZCZTQSA-N	0	3	319.449	2.327	10	0		DEAEHN
C[C@]1(C(=O)N2CCC[C@@H]2c2ccccc2Cl)COC[C@@H]1N	ZINC000090593802	185305741	/nfs/dbraw/zinc/30/57/41/185305741.db2.gz	SLVCWBYRXSLDJQ-YCPHGPKFSA-N	0	3	308.809	2.367	10	0		DEAEHN
C[C@]1(c2nnc3c(Cl)cc(C(F)(F)F)cn32)COC[C@H]1N	ZINC000090573054	185304260	/nfs/dbraw/zinc/30/42/60/185304260.db2.gz	SXZCFRIPFSVOCX-KCJUWKMLSA-N	0	3	320.702	2.017	10	0		DEAEHN
Cc1cc(NC(=O)[C@@]2(C)COC[C@H]2N)ccc1Br	ZINC000090580527	185304843	/nfs/dbraw/zinc/30/48/43/185304843.db2.gz	BVDHVVBTSSHWMF-YPMHNXCESA-N	0	3	313.195	2.060	10	0		DEAEHN
Cc1cccc(OCC(=O)N2CCCSC[C@H]2CN(C)C)c1	ZINC000090699943	185310367	/nfs/dbraw/zinc/31/03/67/185310367.db2.gz	VHBYEISTWHZMTL-OAHLLOKOSA-N	0	3	322.474	2.270	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N)[C@H](Sc1nnc(C)n1C)CC2	ZINC000092389961	185315619	/nfs/dbraw/zinc/31/56/19/185315619.db2.gz	MNMVNYMVEUWXGV-ZIAGYGMSSA-N	0	3	304.419	2.239	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@H](O)c1ccccc1	ZINC000179716935	282232653	/nfs/dbraw/zinc/23/26/53/282232653.db2.gz	LHHAUIQUJOGUDD-MAUKXSAKSA-N	0	3	312.413	2.357	10	0		DEAEHN
CCCn1cc(CN[C@H]2C[C@@H](OCC)C23CCOCC3)cn1	ZINC000185669257	282264591	/nfs/dbraw/zinc/26/45/91/282264591.db2.gz	NJMHMZRKDXSNEY-JKSUJKDBSA-N	0	3	307.438	2.357	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2cn(C)nc2CC)C12CCOCC2	ZINC000186393247	282274308	/nfs/dbraw/zinc/27/43/08/282274308.db2.gz	CUWUZABGGAXQKK-JKSUJKDBSA-N	0	3	307.438	2.046	10	0		DEAEHN
CN1CCN(CCNC(=O)N[C@H]2CCC23CCCC3)CC1(C)C	ZINC000441038380	529771998	/nfs/dbraw/zinc/77/19/98/529771998.db2.gz	PWQBAYIDTMZWOZ-HNNXBMFYSA-N	0	3	322.497	2.034	10	0		DEAEHN
CN(C)c1ccc(NC(=O)NCCN2CCCC(C)(C)C2)cn1	ZINC000444855036	529784528	/nfs/dbraw/zinc/78/45/28/529784528.db2.gz	FYQIMACVKFLDPB-UHFFFAOYSA-N	0	3	319.453	2.391	10	0		DEAEHN
CN1CC[C@@H](CNC(=O)c2cc(Cl)c[nH]2)[C@@H]1c1cccnc1	ZINC000328622937	529793321	/nfs/dbraw/zinc/79/33/21/529793321.db2.gz	IUPDGJGBVRICLT-WFASDCNBSA-N	0	3	318.808	2.486	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)N(C)CCN2CCCCC2)c1	ZINC000074915223	539355945	/nfs/dbraw/zinc/35/59/45/539355945.db2.gz	JLGHUFRUVBUTEY-UHFFFAOYSA-N	0	3	303.406	2.203	10	0		DEAEHN
CCN(CC(=O)OC(C)(C)C)C1CCN([C@@H](C)COC)CC1	ZINC000190348938	282318534	/nfs/dbraw/zinc/31/85/34/282318534.db2.gz	GFJNXLXNHFBYAT-AWEZNQCLSA-N	0	3	314.470	2.149	10	0		DEAEHN
CN(Cc1ccncc1)C[C@@H]1CCCN(C)[C@H]1c1cnn(C)c1	ZINC000328624274	530011076	/nfs/dbraw/zinc/01/10/76/530011076.db2.gz	CJPBXVSDPUQSHW-FUHWJXTLSA-N	0	3	313.449	2.330	10	0		DEAEHN
CCOc1ccc([C@@H](C)NC(=O)C[C@H]2CSCCN2)cc1	ZINC000091135312	539418122	/nfs/dbraw/zinc/41/81/22/539418122.db2.gz	BMTXKTMHANMIGM-OCCSQVGLSA-N	0	3	308.447	2.358	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@H](C)Cc1c(C)noc1C	ZINC000245421899	282386416	/nfs/dbraw/zinc/38/64/16/282386416.db2.gz	OMUOEYJFHPFNOT-IUODEOHRSA-N	0	3	322.453	2.348	10	0		DEAEHN
CC(C)(C)OC(=O)CCCN1CCCN(c2cccnn2)CC1	ZINC000181798954	199353826	/nfs/dbraw/zinc/35/38/26/199353826.db2.gz	UMOIMOHEBSJSKV-UHFFFAOYSA-N	0	3	320.437	2.111	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)N1C[C@@H](N(C)C)Cc2ccccc21	ZINC000248879120	282535328	/nfs/dbraw/zinc/53/53/28/282535328.db2.gz	ROZFCUWSINBCMK-VNQPRFMTSA-N	0	3	302.418	2.179	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2CCCC[C@H]2C(F)(F)F)n1	ZINC000263274268	282974359	/nfs/dbraw/zinc/97/43/59/282974359.db2.gz	SQBHEBUKYLWXPI-HBNTYKKESA-N	0	3	318.343	2.482	10	0		DEAEHN
CC(C)(C)C(=O)N1CCC(c2nnc([C@@H]3CCCN3)o2)CC1	ZINC000616575012	362893042	/nfs/dbraw/zinc/89/30/42/362893042.db2.gz	COXKLIIVOAHYMC-LBPRGKRZSA-N	0	3	306.410	2.246	10	0		DEAEHN
N[C@H](c1cc(F)c(Br)cc1F)[C@H]1COCCO1	ZINC000070472667	190900716	/nfs/dbraw/zinc/90/07/16/190900716.db2.gz	BRLXTNUUFWEJAC-GHMZBOCLSA-N	0	3	308.122	2.143	10	0		DEAEHN
CCCOc1ccc(OCCN[C@@H](C(=O)NC)C(C)C)cc1	ZINC000183639353	539663576	/nfs/dbraw/zinc/66/35/76/539663576.db2.gz	VBHHDXVZUZMVFZ-MRXNPFEDSA-N	0	3	308.422	2.214	10	0		DEAEHN
CN1C(=O)C[C@H](N[C@@H]2CCCOC2)[C@H]1c1ccc(Cl)cc1	ZINC000179587892	282645541	/nfs/dbraw/zinc/64/55/41/282645541.db2.gz	MPXIVSAOILZNAI-IJEWVQPXSA-N	0	3	308.809	2.380	10	0		DEAEHN
CC(C)(C)c1ccc2c(c1)[C@@H](CN)N(CCN1CCOCC1)C2	ZINC000071683789	191007208	/nfs/dbraw/zinc/00/72/08/191007208.db2.gz	ZJQJASSLAOUWFV-GOSISDBHSA-N	0	3	317.477	2.132	10	0		DEAEHN
CC(C)[C@H](N)c1nc(CC(=O)Nc2ncccc2O)cs1	ZINC000071694404	191008380	/nfs/dbraw/zinc/00/83/80/191008380.db2.gz	ZXIJWJGRSLFPQT-LBPRGKRZSA-N	0	3	306.391	2.081	10	0		DEAEHN
COc1cc2c(c(OC)c1)[C@H](CN)N(Cc1nc(C)cs1)C2	ZINC000071683946	191008954	/nfs/dbraw/zinc/00/89/54/191008954.db2.gz	MNCBQDZCHDVZQM-ZDUSSCGKSA-N	0	3	319.430	2.484	10	0		DEAEHN
Nc1ncccc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000071700405	191009962	/nfs/dbraw/zinc/00/99/62/191009962.db2.gz	CTAMYFILQQMWLP-INIZCTEOSA-N	0	3	310.401	2.231	10	0		DEAEHN
Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NC[C@H](O)CN1CCCCC1	ZINC000133686044	186007213	/nfs/dbraw/zinc/00/72/13/186007213.db2.gz	ZQFPBVJXDUVZPT-ZNMIVQPWSA-N	0	3	322.474	2.123	10	0		DEAEHN
Cc1ccc([C@H]2N[C@@H](CC(C)C)C(=O)N2CCN(C)C)s1	ZINC000140033141	186025373	/nfs/dbraw/zinc/02/53/73/186025373.db2.gz	QOBTUIVOHDKCPI-ZFWWWQNUSA-N	0	3	309.479	2.463	10	0		DEAEHN
CC[C@H](C)[C@@H]1N[C@@H](c2ccc(C)s2)N(CCN(C)C)C1=O	ZINC000139969202	186025488	/nfs/dbraw/zinc/02/54/88/186025488.db2.gz	FVBSWQHTNBBBMB-TUKIKUTGSA-N	0	3	309.479	2.463	10	0		DEAEHN
CN(C)CCn1ncc(Cl)c1[C@@H](O)[C@]1(C)CCCS1	ZINC000140179026	186026421	/nfs/dbraw/zinc/02/64/21/186026421.db2.gz	AIYNQFQWSDKOCZ-OLZOCXBDSA-N	0	3	303.859	2.417	10	0		DEAEHN
CCOCCN1CCN(c2cc(CC)nc(C)n2)C[C@@H]1CC	ZINC000248438353	539773805	/nfs/dbraw/zinc/77/38/05/539773805.db2.gz	SXDZOGQOONLEJW-INIZCTEOSA-N	0	3	306.454	2.285	10	0		DEAEHN
CC(C)[C@@H]1N[C@@H](c2ccsc2)N([C@@H]2CCCN(C)C2)C1=O	ZINC000142875927	186032919	/nfs/dbraw/zinc/03/29/19/186032919.db2.gz	UXAJHZXFXXWHHN-QLFBSQMISA-N	0	3	307.463	2.297	10	0		DEAEHN
CC[C@H]1N[C@@H](c2ccsc2)N(CCN2CCCCC2)C1=O	ZINC000144076800	186034985	/nfs/dbraw/zinc/03/49/85/186034985.db2.gz	COSRYUYNSMLUNG-HUUCEWRRSA-N	0	3	307.463	2.443	10	0		DEAEHN
CN1CCCC[C@H]1CN1C(=O)C2(CC2)N[C@H]1c1cccs1	ZINC000144370260	186035287	/nfs/dbraw/zinc/03/52/87/186035287.db2.gz	VSJBHIXGRMIAGV-GXTWGEPZSA-N	0	3	305.447	2.195	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@@H](C(C)C)C(=O)N2C[C@@H](C)N(C)C)s1	ZINC000144952038	186036406	/nfs/dbraw/zinc/03/64/06/186036406.db2.gz	RBGCJPOENBOMOO-BYCMXARLSA-N	0	3	309.479	2.462	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1cccc(N(C)C)n1	ZINC000152669741	186095579	/nfs/dbraw/zinc/09/55/79/186095579.db2.gz	QQUKWUWBFRGLIZ-ZDUSSCGKSA-N	0	3	305.426	2.096	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1ccc(Br)cc1F	ZINC000159556069	186127160	/nfs/dbraw/zinc/12/71/60/186127160.db2.gz	FDDXRHOOPIQPDI-JTQLQIEISA-N	0	3	319.174	2.281	10	0		DEAEHN
NC1(C(=O)Nc2ccc(F)c(Br)c2)CCOCC1	ZINC000159570547	186127724	/nfs/dbraw/zinc/12/77/24/186127724.db2.gz	UVULCRHDAHJBPN-UHFFFAOYSA-N	0	3	317.158	2.035	10	0		DEAEHN
C[C@H](CNCc1cc(Cl)c2c(c1)OCCCO2)[S@](C)=O	ZINC000159684112	186135195	/nfs/dbraw/zinc/13/51/95/186135195.db2.gz	WYYNIYOEMFWOHT-CFMSYZGJSA-N	0	3	317.838	2.358	10	0		DEAEHN
C[C@@H](CNCc1cc(Cl)c2c(c1)OCCCO2)[S@@](C)=O	ZINC000159684275	186135407	/nfs/dbraw/zinc/13/54/07/186135407.db2.gz	WYYNIYOEMFWOHT-FVINQWEUSA-N	0	3	317.838	2.358	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1cc(Br)ccc1C	ZINC000159690850	186135677	/nfs/dbraw/zinc/13/56/77/186135677.db2.gz	FRNFFOAQUMTDEL-LLVKDONJSA-N	0	3	315.211	2.450	10	0		DEAEHN
C[C@H]1CCC[C@@](N)(C(=O)c2c(Cl)cnn2CCN(C)C)C1	ZINC000164351666	186156897	/nfs/dbraw/zinc/15/68/97/186156897.db2.gz	YCPCJGDNVMJZCH-NHYWBVRUSA-N	0	3	312.845	2.188	10	0		DEAEHN
Cc1ccc(OCCNC(=O)N2CC[C@H](N3CC=CC3)C2)cc1	ZINC000173334602	186177527	/nfs/dbraw/zinc/17/75/27/186177527.db2.gz	AUKKKODUAITKSI-INIZCTEOSA-N	0	3	315.417	2.030	10	0		DEAEHN
CC(C)NC(=O)CCN[C@@H](c1ccc2c(c1)OCCO2)C1CC1	ZINC000179733448	186211564	/nfs/dbraw/zinc/21/15/64/186211564.db2.gz	JENAEEVHAGJXNO-GOSISDBHSA-N	0	3	318.417	2.413	10	0		DEAEHN
C[C@H]1CC[C@](CO)(N(C)CC(=O)N(C)Cc2ccccc2)C1	ZINC000188004750	186242487	/nfs/dbraw/zinc/24/24/87/186242487.db2.gz	IAJFCDKJJJTVAJ-YJBOKZPZSA-N	0	3	304.434	2.128	10	0		DEAEHN
CC(C)[C@@H](NCC(=O)NC(N)=O)c1cccc(C(F)(F)F)c1	ZINC000181897109	186216201	/nfs/dbraw/zinc/21/62/01/186216201.db2.gz	MOQNDHJJZAXWGH-GFCCVEGCSA-N	0	3	317.311	2.187	10	0		DEAEHN
CC(C)Oc1ccccc1CNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171903650	198004683	/nfs/dbraw/zinc/00/46/83/198004683.db2.gz	KXANRJIMVVOFLU-MRXNPFEDSA-N	0	3	317.433	2.463	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCc2ccc(F)cc21	ZINC000171908470	198006403	/nfs/dbraw/zinc/00/64/03/198006403.db2.gz	BVEAILVXJRXDGB-OAHLLOKOSA-N	0	3	321.396	2.009	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)NCC3CCC3)cc2)CC1	ZINC000172052823	198031646	/nfs/dbraw/zinc/03/16/46/198031646.db2.gz	QKXHNSJCKZFHIT-UHFFFAOYSA-N	0	3	301.434	2.358	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2ccc3c(c2)OCCCO3)CCN1C	ZINC000172622001	198126455	/nfs/dbraw/zinc/12/64/55/198126455.db2.gz	OIQAAYGFKLSIMB-HIFRSBDPSA-N	0	3	318.417	2.403	10	0		DEAEHN
CN(C(=O)c1cnc(-c2ccncc2)s1)C1CCN(C)CC1	ZINC000172765139	198147117	/nfs/dbraw/zinc/14/71/17/198147117.db2.gz	RVPHRMQKMJJHKN-UHFFFAOYSA-N	0	3	316.430	2.371	10	0		DEAEHN
COCc1ccccc1CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000173812210	198256115	/nfs/dbraw/zinc/25/61/15/198256115.db2.gz	RNGZYMPZPYMXFC-WMLDXEAASA-N	0	3	319.449	2.457	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2COc3ccccc32)CCN1C	ZINC000174441294	198335985	/nfs/dbraw/zinc/33/59/85/198335985.db2.gz	MXIHQTMFAKKIKS-VNHYZAJKSA-N	0	3	303.406	2.244	10	0		DEAEHN
COC[C@H](NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)c1ccccc1	ZINC000174628105	198362035	/nfs/dbraw/zinc/36/20/35/198362035.db2.gz	DIXIQVKSMDXJOT-OIISXLGYSA-N	0	3	319.449	2.498	10	0		DEAEHN
COc1ccc([C@H](C)C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1	ZINC000174642581	198364142	/nfs/dbraw/zinc/36/41/42/198364142.db2.gz	BWVKKSCHDHVPOJ-IMJJTQAJSA-N	0	3	302.418	2.494	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)c2ccc(C)cc2)C[C@H]1CC	ZINC000174782739	198384977	/nfs/dbraw/zinc/38/49/77/198384977.db2.gz	DKOQXZQHVYEOIB-MOPGFXCFSA-N	0	3	320.477	2.461	10	0		DEAEHN
CN(C)C1(CNC(=O)c2coc(Br)c2)CCC1	ZINC000383356076	540124484	/nfs/dbraw/zinc/12/44/84/540124484.db2.gz	VLPSWLJZZMHDAW-UHFFFAOYSA-N	0	3	301.184	2.256	10	0		DEAEHN
CN(Cc1ccc(CO)cc1)C[C@@H]1CCCN1c1cccnn1	ZINC000364977360	283108154	/nfs/dbraw/zinc/10/81/54/283108154.db2.gz	GKWCDNAJNOTLDK-KRWDZBQOSA-N	0	3	312.417	2.070	10	0		DEAEHN
CC(C)[C@H](N)C(=O)N1CC[C@]2(CC[C@H](CBr)C2)C1	ZINC000095087991	355696177	/nfs/dbraw/zinc/69/61/77/355696177.db2.gz	TYDGVJSORRQXLJ-OBJOEFQTSA-N	0	3	317.271	2.383	10	0		DEAEHN
Cc1ccccc1C1(CNC(=O)NC[C@@H]2CCCN2C)CC1	ZINC000170687489	355992099	/nfs/dbraw/zinc/99/20/99/355992099.db2.gz	PGZDNIAJYKMWKI-HNNXBMFYSA-N	0	3	301.434	2.420	10	0		DEAEHN
Cc1cccc(CN(Cc2cccc(C)n2)C(=O)CNC2CC2)n1	ZINC000154682537	355944208	/nfs/dbraw/zinc/94/42/08/355944208.db2.gz	RFPPZYUNHVGPIZ-UHFFFAOYSA-N	0	3	324.428	2.374	10	0		DEAEHN
CNCc1ccn(CCOc2ccc(Br)cc2)n1	ZINC000080093885	192000994	/nfs/dbraw/zinc/00/09/94/192000994.db2.gz	RNZGEGUUHDVMAH-UHFFFAOYSA-N	0	3	310.195	2.444	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1n[nH]nc1-c1ccccc1	ZINC000194203613	356235342	/nfs/dbraw/zinc/23/53/42/356235342.db2.gz	CJODEMNZIMYIFG-AWEZNQCLSA-N	0	3	313.405	2.028	10	0		DEAEHN
C[C@@H](N[C@@H](C)c1nncn1C)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000400399498	283156510	/nfs/dbraw/zinc/15/65/10/283156510.db2.gz	KFICWALKDICHII-AGIUHOORSA-N	0	3	323.441	2.111	10	0		DEAEHN
NCc1cc(C(F)(F)F)c(I)cn1	ZINC000306913869	356406490	/nfs/dbraw/zinc/40/64/90/356406490.db2.gz	QAAJPAFVWXGOEA-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
C[C@@H]1CN[C@H](C(=O)N(Cc2ccccc2)Cc2ccccc2)CN1	ZINC000307733897	356409193	/nfs/dbraw/zinc/40/91/93/356409193.db2.gz	UCAGOTDVYANPQO-APWZRJJASA-N	0	3	323.440	2.165	10	0		DEAEHN
Brc1ccc(CN2CC[C@@H]3OCCN[C@H]3C2)s1	ZINC000404284207	283165108	/nfs/dbraw/zinc/16/51/08/283165108.db2.gz	WTHSUJONCCOBOP-QWRGUYRKSA-N	0	3	317.252	2.073	10	0		DEAEHN
Cc1c([C@H]2OCC[C@@H]2NC[C@@H](O)c2ccccc2F)cnn1C	ZINC000328642212	356466036	/nfs/dbraw/zinc/46/60/36/356466036.db2.gz	YGMRBPWJAQPBQE-GVDBMIGSSA-N	0	3	319.380	2.021	10	0		DEAEHN
CCN1CCC(N(C)c2nnc(Br)s2)CC1	ZINC000081664265	192307629	/nfs/dbraw/zinc/30/76/29/192307629.db2.gz	JLBRVZUOQKUAHX-UHFFFAOYSA-N	0	3	305.245	2.221	10	0		DEAEHN
COCC[C@@H](C)NCC(=O)Nc1ccccc1Br	ZINC000081713156	192316385	/nfs/dbraw/zinc/31/63/85/192316385.db2.gz	REXALIWLBCEBCN-SNVBAGLBSA-N	0	3	315.211	2.402	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)NCc1ccnc(OC2CCCC2)c1	ZINC000236895217	202058944	/nfs/dbraw/zinc/05/89/44/202058944.db2.gz	YMFVWEKZMGXZQR-LRDDRELGSA-N	0	3	305.422	2.393	10	0		DEAEHN
CC1CCN(S(=O)(=O)c2ccc(Cl)c(CN)c2)CC1	ZINC000088905096	192651549	/nfs/dbraw/zinc/65/15/49/192651549.db2.gz	IKVQRINQCNYGOH-UHFFFAOYSA-N	0	3	302.827	2.219	10	0		DEAEHN
CCNCc1ccc(F)c(S(=O)(=O)N(C)[C@H](C)CC)c1	ZINC000088949447	192666620	/nfs/dbraw/zinc/66/66/20/192666620.db2.gz	MSDIWBWHQFWEGN-LLVKDONJSA-N	0	3	302.415	2.354	10	0		DEAEHN
CCOc1ccc(S(=O)(=O)N(CC)C(C)C)cc1CNC	ZINC000088942079	192663294	/nfs/dbraw/zinc/66/32/94/192663294.db2.gz	OYJXLCWZOLLMRN-UHFFFAOYSA-N	0	3	314.451	2.224	10	0		DEAEHN
CC(C)(O)CN1CCN(c2ncnc3cc(Cl)ccc32)CC1	ZINC000588753497	357420862	/nfs/dbraw/zinc/42/08/62/357420862.db2.gz	JQGLLKNZCFYSDT-UHFFFAOYSA-N	0	3	320.824	2.176	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1c(C)nn(CC)c1C	ZINC000179548903	199053090	/nfs/dbraw/zinc/05/30/90/199053090.db2.gz	WGVRZSCCJQXSRU-CQSZACIVSA-N	0	3	307.442	2.468	10	0		DEAEHN
CN1CC[C@H](NC(=O)Cc2ccc(O)cc2)[C@@H]1c1ccccc1	ZINC000180129828	199121456	/nfs/dbraw/zinc/12/14/56/199121456.db2.gz	ITGDFWKFMWBRHZ-HKUYNNGSSA-N	0	3	310.397	2.496	10	0		DEAEHN
Cc1ccc(-c2noc(NC[C@H](O)CN3CCCCC3)n2)cc1	ZINC000180224911	199133479	/nfs/dbraw/zinc/13/34/79/199133479.db2.gz	TZCRWNVOGVRHKR-HNNXBMFYSA-N	0	3	316.405	2.304	10	0		DEAEHN
CCOc1ccc([C@@H](C)NC[C@H]2CN(C)CCO2)cc1OCC	ZINC000180493792	199166011	/nfs/dbraw/zinc/16/60/11/199166011.db2.gz	RIFUFQQIICTPPL-ZBFHGGJFSA-N	0	3	322.449	2.465	10	0		DEAEHN
COc1cc(C)c([C@H](C)N[C@H]2CCc3ncnn3C2)cc1OC	ZINC000180606212	199183082	/nfs/dbraw/zinc/18/30/82/199183082.db2.gz	RKHBFTAURRYPED-STQMWFEESA-N	0	3	316.405	2.269	10	0		DEAEHN
COc1ccc(C[C@@H](C)C(=O)NC[C@@H]2CCCN2C)cc1OC	ZINC000180613367	199185341	/nfs/dbraw/zinc/18/53/41/199185341.db2.gz	SHBUUSLSHZSPDH-HIFRSBDPSA-N	0	3	320.433	2.093	10	0		DEAEHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)N(C)[C@@H](C)c1cnn(C)c1	ZINC000180787990	199209512	/nfs/dbraw/zinc/20/95/12/199209512.db2.gz	SXXGBAFEYIACAK-KFWWJZLASA-N	0	3	321.469	2.243	10	0		DEAEHN
CCCn1cc(C(=O)N[C@H](Cc2ccccc2)CN(C)C)cn1	ZINC000180751341	199204010	/nfs/dbraw/zinc/20/40/10/199204010.db2.gz	UQEHSRSYIFWBNL-QGZVFWFLSA-N	0	3	314.433	2.196	10	0		DEAEHN
COc1ccc(C(=O)NCCNc2ccncc2)c(Cl)c1	ZINC000594848283	358347774	/nfs/dbraw/zinc/34/77/74/358347774.db2.gz	UFOTUMHQJCFXBF-UHFFFAOYSA-N	0	3	305.765	2.007	10	0		DEAEHN
COCCN(C)CCNC(=O)N[C@@H]1c2cc(C)ccc2C[C@H]1C	ZINC000181201201	199264980	/nfs/dbraw/zinc/26/49/80/199264980.db2.gz	IVNJDUSLNVCHKM-PBHICJAKSA-N	0	3	319.449	2.106	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCC(C)(C)CC2)s1	ZINC000089027102	192706298	/nfs/dbraw/zinc/70/62/98/192706298.db2.gz	AUNSADHODKQIQP-UHFFFAOYSA-N	0	3	302.465	2.278	10	0		DEAEHN
CN(C[C@@H](O)Cc1ccc(C(F)(F)F)cc1)CC1(CO)CC1	ZINC000186783849	200010730	/nfs/dbraw/zinc/01/07/30/200010730.db2.gz	LXVKUFOCZNRCJX-AWEZNQCLSA-N	0	3	317.351	2.313	10	0		DEAEHN
Cc1cnc([C@@H](C)CNC(=O)N2CCN3CCC[C@@H]3C2)s1	ZINC000187088488	200058964	/nfs/dbraw/zinc/05/89/64/200058964.db2.gz	LXIIKBQPCLPYKU-WCQYABFASA-N	0	3	308.451	2.045	10	0		DEAEHN
CC(C)Oc1ccc(F)cc1NC(=O)c1n[nH]c2c1CNCC2	ZINC000188510519	200258513	/nfs/dbraw/zinc/25/85/13/200258513.db2.gz	WIMYFLICBJJRPW-UHFFFAOYSA-N	0	3	318.352	2.234	10	0		DEAEHN
COc1cc(CN(C)CC2(CO)CC2)ccc1OC(=O)C1CC1	ZINC000188951480	200327312	/nfs/dbraw/zinc/32/73/12/200327312.db2.gz	VIEFFWMHUGZJBV-UHFFFAOYSA-N	0	3	319.401	2.215	10	0		DEAEHN
C[C@@H]1OCCC[C@H]1C(=O)N(CCN(C)C)Cc1cccs1	ZINC000189149855	200357139	/nfs/dbraw/zinc/35/71/39/200357139.db2.gz	MULQOPXUWLAKLP-DZGCQCFKSA-N	0	3	310.463	2.453	10	0		DEAEHN
OCCC1(NCc2nncn2-c2ccccc2)CCCCC1	ZINC000444670438	238236557	/nfs/dbraw/zinc/23/65/57/238236557.db2.gz	XUPBWXCGFICUKU-UHFFFAOYSA-N	0	3	300.406	2.442	10	0		DEAEHN
C[C@@H](CO)CN(C)CCOc1ccc(Br)cc1	ZINC000608498645	361227949	/nfs/dbraw/zinc/22/79/49/361227949.db2.gz	XIXNPBWEJJOTIB-LLVKDONJSA-N	0	3	302.212	2.388	10	0		DEAEHN
CC(C)Cc1ccc(S(=O)(=O)N[C@H]2CNCC[C@@H]2C)cc1	ZINC000193400661	201045687	/nfs/dbraw/zinc/04/56/87/201045687.db2.gz	AMIADQFTSHZNGA-BBRMVZONSA-N	0	3	310.463	2.161	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCC[C@@H](C(C)(C)C(=O)OC)C1	ZINC000611311384	361578067	/nfs/dbraw/zinc/57/80/67/361578067.db2.gz	MBYAKEMCVACQFM-HUUCEWRRSA-N	0	3	324.465	2.299	10	0		DEAEHN
CCOC(=O)c1cc(CNC[C@H](CO)c2ccccc2)[nH]c1C	ZINC000449176436	240153278	/nfs/dbraw/zinc/15/32/78/240153278.db2.gz	SUTGRXICECXOIO-OAHLLOKOSA-N	0	3	316.401	2.366	10	0		DEAEHN
CN1CCOC[C@@H]1CNCc1ccc(F)c(Br)c1	ZINC000623710756	365140249	/nfs/dbraw/zinc/14/02/49/365140249.db2.gz	MTMOCFBOQPQDRR-NSHDSACASA-N	0	3	317.202	2.008	10	0		DEAEHN
Cc1ccc(C(F)(F)F)cc1[N-]S(=O)(=O)[C@H]1CC[NH2+]C1	ZINC000091481321	193061953	/nfs/dbraw/zinc/06/19/53/193061953.db2.gz	ZGAIZAMZVSLVNQ-JTQLQIEISA-N	0	3	308.325	2.117	10	0		DEAEHN
COc1ccc(Cl)cc1C[C@H](O)[C@@H]1CN2CCC[C@@H]2CO1	ZINC000091715103	193097520	/nfs/dbraw/zinc/09/75/20/193097520.db2.gz	FFWIPJQZKBYDNG-YCPHGPKFSA-N	0	3	311.809	2.115	10	0		DEAEHN
O=C1[C@@H](NC2CC(OCc3ccccc3)C2)CCN1C1CCC1	ZINC000624344334	365387938	/nfs/dbraw/zinc/38/79/38/365387938.db2.gz	IZOAMYRRMMRIQR-VJFUWPCTSA-N	0	3	314.429	2.477	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccsc1Br	ZINC000449825023	241132277	/nfs/dbraw/zinc/13/22/77/241132277.db2.gz	OACHEMIYQURKBE-QMMMGPOBSA-N	0	3	303.225	2.335	10	0		DEAEHN
O=C(NC1CC(N2CCCCC2)C1)c1noc2c1CCCC2	ZINC000330101579	283917677	/nfs/dbraw/zinc/91/76/77/283917677.db2.gz	IDIJZOQGZUCKJI-UHFFFAOYSA-N	0	3	303.406	2.300	10	0		DEAEHN
CC[C@H]1CCCN(S(=O)(=O)c2ccc(CNC)cc2F)C1	ZINC000092115713	193162957	/nfs/dbraw/zinc/16/29/57/193162957.db2.gz	RAQQXALJPAWSNH-LBPRGKRZSA-N	0	3	314.426	2.356	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N(C)c2ccccc2)c(F)c1	ZINC000092115483	193163210	/nfs/dbraw/zinc/16/32/10/193163210.db2.gz	CPQXXNUUKQDLIV-UHFFFAOYSA-N	0	3	308.378	2.370	10	0		DEAEHN
CCCCN(C1CC1)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115910	193163796	/nfs/dbraw/zinc/16/37/96/193163796.db2.gz	WPHNJULFBIBSLP-UHFFFAOYSA-N	0	3	300.399	2.238	10	0		DEAEHN
c1c(C2CC2)nn2ccnc(N3CCN(c4ccncc4)CC3)c12	ZINC000631047986	367986721	/nfs/dbraw/zinc/98/67/21/367986721.db2.gz	RYAQANCCZCVYLB-UHFFFAOYSA-N	0	3	320.400	2.328	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	ZINC000262112102	203202742	/nfs/dbraw/zinc/20/27/42/203202742.db2.gz	HOVZJFRDJVKPTH-OAHLLOKOSA-N	0	3	321.812	2.436	10	0		DEAEHN
CCC[C@@](C)([NH3+])C(=O)NCc1ccc([O-])c(Br)c1	ZINC000262169241	203217860	/nfs/dbraw/zinc/21/78/60/203217860.db2.gz	WWWTYJOCENWOLZ-CYBMUJFWSA-N	0	3	315.211	2.288	10	0		DEAEHN
CN1CCC2(CC1)CC(=O)NC(=O)[C@H]2c1cccc(Cl)c1	ZINC000093170802	193210178	/nfs/dbraw/zinc/21/01/78/193210178.db2.gz	MEPZDEDNXAQTGB-CQSZACIVSA-N	0	3	306.793	2.182	10	0		DEAEHN
CC(C)(CNC1=NC[C@H](c2ccccc2)S1)S(C)(=O)=O	ZINC000093524730	193264405	/nfs/dbraw/zinc/26/44/05/193264405.db2.gz	GRQRDACWOONUHI-GFCCVEGCSA-N	0	3	312.460	2.243	10	0		DEAEHN
NC(=O)[C@@]1(N)CCC[C@H]1CCSc1cc(F)ccc1F	ZINC000093629592	193276217	/nfs/dbraw/zinc/27/62/17/193276217.db2.gz	CEOKZPRFLFASDL-LKFCYVNXSA-N	0	3	300.374	2.430	10	0		DEAEHN
CC[NH2+][C@]1(C(=O)[O-])CCC[C@@H](N(CCOC)[C@@H](C)CC)C1	ZINC000093752190	193299211	/nfs/dbraw/zinc/29/92/11/193299211.db2.gz	DLDJTQKGDFZUKH-SQWLQELKSA-N	0	3	300.443	2.109	10	0		DEAEHN
CCN[C@]1(C(=O)[O-])CCC[C@@H]([N@H+](CCOC)[C@@H](C)CC)C1	ZINC000093752190	193299212	/nfs/dbraw/zinc/29/92/12/193299212.db2.gz	DLDJTQKGDFZUKH-SQWLQELKSA-N	0	3	300.443	2.109	10	0		DEAEHN
CCN[C@]1(C(=O)[O-])CCC[C@@H]([N@@H+](CCOC)[C@@H](C)CC)C1	ZINC000093752190	193299213	/nfs/dbraw/zinc/29/92/13/193299213.db2.gz	DLDJTQKGDFZUKH-SQWLQELKSA-N	0	3	300.443	2.109	10	0		DEAEHN
COC(=O)[C@]1(N)CCC[C@@H](N2CCC(C(F)(F)F)CC2)C1	ZINC000093756680	193302235	/nfs/dbraw/zinc/30/22/35/193302235.db2.gz	IPISGOAFRIKOGT-YPMHNXCESA-N	0	3	308.344	2.074	10	0		DEAEHN
CCOC[C@@H]1CCN(Cc2cc(OC)c3c(c2)OCCO3)C1	ZINC000093838852	193315217	/nfs/dbraw/zinc/31/52/17/193315217.db2.gz	ARYAURAUOUNITE-CYBMUJFWSA-N	0	3	307.390	2.325	10	0		DEAEHN
NCc1ccc(C(F)(F)F)nc1N1CCC[C@H]1CCCO	ZINC000094334262	193360220	/nfs/dbraw/zinc/36/02/20/193360220.db2.gz	IRSWKKCXFJPPOI-NSHDSACASA-N	0	3	303.328	2.300	10	0		DEAEHN
CCNCc1cc(F)c(OC[C@H](O)COC(C)C)c(F)c1	ZINC000094346945	193363192	/nfs/dbraw/zinc/36/31/92/193363192.db2.gz	ZRGVDPKLVMCYRI-GFCCVEGCSA-N	0	3	303.349	2.239	10	0		DEAEHN
CC(C)NCc1cc(F)c(O[C@@H](C)C(=O)N(C)C)c(F)c1	ZINC000094347509	193363648	/nfs/dbraw/zinc/36/36/48/193363648.db2.gz	MSLIVEILFWQNAK-JTQLQIEISA-N	0	3	300.349	2.318	10	0		DEAEHN
CC(C)(C)NCc1cnn([C@H]2CCC[C@H](S(C)(=O)=O)C2)c1	ZINC000094644010	193389655	/nfs/dbraw/zinc/38/96/55/193389655.db2.gz	ILHXQKOQNVHOER-KBPBESRZSA-N	0	3	313.467	2.300	10	0		DEAEHN
CN[C@H](C)c1c(C)nn([C@H]2CCC[C@@H](S(C)(=O)=O)C2)c1C	ZINC000094643988	193389791	/nfs/dbraw/zinc/38/97/91/193389791.db2.gz	IMSHDHNJSMPGKM-DDTOSNHZSA-N	0	3	313.467	2.309	10	0		DEAEHN
Cc1cc(C(=O)NC[C@@H](C)N(C)C)sc1Br	ZINC000094494330	193374039	/nfs/dbraw/zinc/37/40/39/193374039.db2.gz	VXTNMSHGLVMGEU-MRVPVSSYSA-N	0	3	305.241	2.499	10	0		DEAEHN
CN[C@H](Cc1c(Cl)cccc1Cl)[C@@H]1CN2CCN1CC2	ZINC000094509038	193375602	/nfs/dbraw/zinc/37/56/02/193375602.db2.gz	XFTYKRDXUVTDOK-CABCVRRESA-N	0	3	314.260	2.124	10	0		DEAEHN
O=C(N[C@H]1CCOc2c(F)cccc21)N1CCN2CCC[C@H]2C1	ZINC000191021863	284212197	/nfs/dbraw/zinc/21/21/97/284212197.db2.gz	ZMQLDRVRXFBCRT-WFASDCNBSA-N	0	3	319.380	2.139	10	0		DEAEHN
O=S(=O)([N-]c1cccc(OC(F)(F)F)c1)[C@H]1CCC[NH2+]C1	ZINC000019995094	182175332	/nfs/dbraw/zinc/17/53/32/182175332.db2.gz	XGPWEFYLXJKVBV-NSHDSACASA-N	0	3	324.324	2.079	10	0		DEAEHN
O=S(=O)(Nc1cccc(OC(F)(F)F)c1)[C@H]1CCCNC1	ZINC000019995094	182175333	/nfs/dbraw/zinc/17/53/33/182175333.db2.gz	XGPWEFYLXJKVBV-NSHDSACASA-N	0	3	324.324	2.079	10	0		DEAEHN
NC[C@H](c1cccc(Br)c1)N1CCSCC1	ZINC000020257075	182199989	/nfs/dbraw/zinc/19/99/89/182199989.db2.gz	UFPDDMAOOUFVBJ-GFCCVEGCSA-N	0	3	301.253	2.498	10	0		DEAEHN
COCCn1ncc(Br)c1[C@@H](N)CSC(C)C	ZINC000160078351	197384812	/nfs/dbraw/zinc/38/48/12/197384812.db2.gz	LBEOCLKHWDGYPT-JTQLQIEISA-N	0	3	322.272	2.433	10	0		DEAEHN
CN1CCN(CCNC(=O)NCC2CCCCCC2)CC1(C)C	ZINC000454909430	246249372	/nfs/dbraw/zinc/24/93/72/246249372.db2.gz	KGBBQDCFLOQAIO-UHFFFAOYSA-N	0	3	324.513	2.282	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1ccc(F)cc1C	ZINC000032073043	182633457	/nfs/dbraw/zinc/63/34/57/182633457.db2.gz	QNJCMBOLEHPASS-LBPRGKRZSA-N	0	3	302.415	2.143	10	0		DEAEHN
CCCCNC(=O)C[C@@H](CC(=O)OC)NCc1ccccc1	ZINC000036462264	182825532	/nfs/dbraw/zinc/82/55/32/182825532.db2.gz	CQZYEMZOZNFFAK-HNNXBMFYSA-N	0	3	306.406	2.014	10	0		DEAEHN
C[C@H](CNCc1ccc(Br)cc1F)[S@](C)=O	ZINC000159808988	197366588	/nfs/dbraw/zinc/36/65/88/197366588.db2.gz	CJSAOKZXCOLHHC-VPTHRUTESA-N	0	3	308.216	2.445	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)[C@H]1C[C@H](OC)CN1	ZINC000040634270	183111521	/nfs/dbraw/zinc/11/15/21/183111521.db2.gz	SPAPNYLKJMOGKM-WCQYABFASA-N	0	3	312.797	2.444	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2ccc(Br)cc2C)C1	ZINC000040629968	183110918	/nfs/dbraw/zinc/11/09/18/183110918.db2.gz	PRMDUFBJMLSABK-JQWIXIFHSA-N	0	3	313.195	2.073	10	0		DEAEHN
CCN(CCO)c1c2ccccc2nc(C)c1CC(=O)OC	ZINC000041477978	183194031	/nfs/dbraw/zinc/19/40/31/183194031.db2.gz	SJXCANQQRFOZEQ-UHFFFAOYSA-N	0	3	302.374	2.077	10	0		DEAEHN
COC[C@H](C)NC(=O)CNCCc1ccc(Cl)cc1Cl	ZINC000042312291	183253523	/nfs/dbraw/zinc/25/35/23/183253523.db2.gz	CNEZCSXZONCBQY-JTQLQIEISA-N	0	3	319.232	2.277	10	0		DEAEHN
CCN(CCOC)[C@H](CN)c1cccc(Br)c1	ZINC000042492562	183276269	/nfs/dbraw/zinc/27/62/69/183276269.db2.gz	LIVMIDLAFGXJAI-CYBMUJFWSA-N	0	3	301.228	2.417	10	0		DEAEHN
COC[C@H](C)N(C)[C@@H](CN)c1ccccc1Br	ZINC000042517703	183279268	/nfs/dbraw/zinc/27/92/68/183279268.db2.gz	ZTHJWGFQOWEULB-GWCFXTLKSA-N	0	3	301.228	2.416	10	0		DEAEHN
C[C@H](CN1CCCC1)NC(=O)c1cc(Br)cn1C	ZINC000042371346	183260371	/nfs/dbraw/zinc/26/03/71/183260371.db2.gz	GOAIUJWGOJDJPK-SNVBAGLBSA-N	0	3	314.227	2.002	10	0		DEAEHN
N[C@@H](CN(CC(F)(F)F)C1CC1)c1ccc2c(c1)OCO2	ZINC000042748916	183304659	/nfs/dbraw/zinc/30/46/59/183304659.db2.gz	YKXLZANZZJTEGW-NSHDSACASA-N	0	3	302.296	2.442	10	0		DEAEHN
CS(=O)(=O)c1ccc(O[C@@H](CN)c2cccc(F)c2)cc1	ZINC000042974197	183324916	/nfs/dbraw/zinc/32/49/16/183324916.db2.gz	BHLKFSFPVZLEAH-HNNXBMFYSA-N	0	3	309.362	2.308	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)s1)N(C)CC(=O)N(C)C	ZINC000043252475	183347242	/nfs/dbraw/zinc/34/72/42/183347242.db2.gz	PPLMIWKALMMJBZ-TVQRCGJNSA-N	0	3	303.859	2.200	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccc(Cl)s1)N1CCCC[C@@H]1C(N)=O	ZINC000043253716	183347974	/nfs/dbraw/zinc/34/79/74/183347974.db2.gz	GPXUJZPRSXTTAS-KBVBSXBZSA-N	0	3	301.843	2.130	10	0		DEAEHN
COCCN(CCOC)[C@@H](c1ccc(Cl)s1)[C@H](C)N	ZINC000043252905	183348223	/nfs/dbraw/zinc/34/82/23/183348223.db2.gz	ZMBAHFNRUOKGAO-GXFFZTMASA-N	0	3	306.859	2.385	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)s1)N(CC(N)=O)C(C)C	ZINC000043253849	183348391	/nfs/dbraw/zinc/34/83/91/183348391.db2.gz	DCPYARSVOUEUML-NOZJJQNGSA-N	0	3	303.859	2.376	10	0		DEAEHN
COCCN(C)[C@@H](c1ccc(Br)s1)[C@@H](C)N	ZINC000043261647	183349199	/nfs/dbraw/zinc/34/91/99/183349199.db2.gz	VIYYLUQYOMEKNS-LDYMZIIASA-N	0	3	307.257	2.477	10	0		DEAEHN
CN[C@H](CN1CCN(C)CC1)c1cccc(C(F)(F)F)c1	ZINC000043810457	183386337	/nfs/dbraw/zinc/38/63/37/183386337.db2.gz	WGOHEXQGBYEUBH-CQSZACIVSA-N	0	3	301.356	2.213	10	0		DEAEHN
CCN(CC)[C@@H](C(=O)N1CC[C@H](N(C)C)C1)c1ccccc1	ZINC000104898372	194051221	/nfs/dbraw/zinc/05/12/21/194051221.db2.gz	XZHYGNHESSDRKV-DLBZAZTESA-N	0	3	303.450	2.232	10	0		DEAEHN
CCCCCNC(=O)[C@H](C)N[C@@H]1CCc2nc(C(C)C)nn2C1	ZINC000105874074	194153872	/nfs/dbraw/zinc/15/38/72/194153872.db2.gz	HSMDZXWWQVRMAQ-UONOGXRCSA-N	0	3	321.469	2.001	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Cc2coc(-c3cccs3)n2)C1	ZINC000106023718	194180239	/nfs/dbraw/zinc/18/02/39/194180239.db2.gz	AZURSUAYGDSLQI-LBPRGKRZSA-N	0	3	305.403	2.108	10	0		DEAEHN
CC(C)c1cccc(NC(=O)CN2CCO[C@@H](CN(C)C)C2)c1	ZINC000105927492	194173162	/nfs/dbraw/zinc/17/31/62/194173162.db2.gz	HJIGVWUVCZSMIA-KRWDZBQOSA-N	0	3	319.449	2.011	10	0		DEAEHN
CCOCCN1CCN(Cc2cn3ccccc3n2)C[C@H]1CC	ZINC000106117144	194188136	/nfs/dbraw/zinc/18/81/36/194188136.db2.gz	NVHMPOKSIUJLMS-QGZVFWFLSA-N	0	3	316.449	2.267	10	0		DEAEHN
Cc1ccc([C@H](C)NS(=O)(=O)C[C@H]2CCCCN2)s1	ZINC000049631431	183749468	/nfs/dbraw/zinc/74/94/68/183749468.db2.gz	LZKJCPDCMRKGEV-NWDGAFQWSA-N	0	3	302.465	2.179	10	0		DEAEHN
CC(C)c1ncc(Cl)c(C(=O)N[C@H](C)CN2CCCC2)n1	ZINC000050367102	183783326	/nfs/dbraw/zinc/78/33/26/183783326.db2.gz	YOZFKFXLUJMHFC-LLVKDONJSA-N	0	3	310.829	2.468	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)cc1)N1CCNC(=O)C1(C)C	ZINC000110653200	194346666	/nfs/dbraw/zinc/34/66/66/194346666.db2.gz	UYJGPXDCKQIJAF-KGLIPLIRSA-N	0	3	309.841	2.329	10	0		DEAEHN
CS(=O)(=O)CCSc1ccc(C(F)(F)F)cc1CN	ZINC000111005446	194380742	/nfs/dbraw/zinc/38/07/42/194380742.db2.gz	AZHNSFWHYRNIFU-UHFFFAOYSA-N	0	3	313.366	2.301	10	0		DEAEHN
CCN[C@@](C)(C[C@@H](C)N(C)CCOC(C)C)C(=O)OCC	ZINC000157527489	197194029	/nfs/dbraw/zinc/19/40/29/197194029.db2.gz	JSCLCPAMERVPPO-ZBFHGGJFSA-N	0	3	302.459	2.053	10	0		DEAEHN
Clc1nc(NCCN2CCCCC2)nc(N2CCCC2)n1	ZINC000061539596	184173796	/nfs/dbraw/zinc/17/37/96/184173796.db2.gz	GYBMYBYJVMWLEC-UHFFFAOYSA-N	0	3	310.833	2.023	10	0		DEAEHN
NNc1ccc(Cl)c(Cn2ccc(=O)c3ccccc32)n1	ZINC000061639204	184179906	/nfs/dbraw/zinc/17/99/06/184179906.db2.gz	FIKFECZGCXPCNY-UHFFFAOYSA-N	0	3	300.749	2.384	10	0		DEAEHN
NNc1ccc(Cl)c(Cn2cc(Br)cn2)n1	ZINC000061639375	184180576	/nfs/dbraw/zinc/18/05/76/184180576.db2.gz	SIXOVJCVZPVGNO-UHFFFAOYSA-N	0	3	302.563	2.028	10	0		DEAEHN
CC[C@@H](Oc1ccc(Br)cc1[C@@H](C)NC)C(N)=O	ZINC000061676073	184181965	/nfs/dbraw/zinc/18/19/65/184181965.db2.gz	BJXHBNBKGDMTNX-LDYMZIIASA-N	0	3	315.211	2.372	10	0		DEAEHN
C[C@@H](CN1CCCC1)NC(=O)c1ccc(Br)cn1	ZINC000061874424	184191737	/nfs/dbraw/zinc/19/17/37/184191737.db2.gz	QNHVMBANYFHRFI-JTQLQIEISA-N	0	3	312.211	2.058	10	0		DEAEHN
NCc1ccccc1CNS(=O)(=O)c1ccc(Cl)cc1	ZINC000061841308	184189142	/nfs/dbraw/zinc/18/91/42/184189142.db2.gz	WILBUUWMUALMHA-UHFFFAOYSA-N	0	3	310.806	2.277	10	0		DEAEHN
C[C@@H]1CN(c2nc3sccn3c2CNC2CC2)CCCO1	ZINC000061920139	184195936	/nfs/dbraw/zinc/19/59/36/184195936.db2.gz	KPUGZUDTGCUCHX-LLVKDONJSA-N	0	3	306.435	2.263	10	0		DEAEHN
C[C@H](c1ccc(Cl)cc1)N(C)S(=O)(=O)[C@@H]1CCCNC1	ZINC000062010838	184201141	/nfs/dbraw/zinc/20/11/41/184201141.db2.gz	OKPXWWACXRMZGD-BXUZGUMPSA-N	0	3	316.854	2.415	10	0		DEAEHN
C[C@H](C(=O)N(C)[C@@H](C)c1cccc(Cl)c1)N1CCNCC1	ZINC000062028185	184202390	/nfs/dbraw/zinc/20/23/90/184202390.db2.gz	KTIPMSKIGSSRFJ-QWHCGFSZSA-N	0	3	309.841	2.153	10	0		DEAEHN
CCOC(=O)[C@@H](C)Oc1ccc(CNCCOC)cc1Cl	ZINC000062730588	184251071	/nfs/dbraw/zinc/25/10/71/184251071.db2.gz	RRJKDFHPFCMMMN-LLVKDONJSA-N	0	3	315.797	2.406	10	0		DEAEHN
CC[NH2+]CCS(=O)(=O)[N-]c1cc(C(F)(F)F)ccc1F	ZINC000062666479	184247127	/nfs/dbraw/zinc/24/71/27/184247127.db2.gz	ZQDCKUQXLBJDNL-UHFFFAOYSA-N	0	3	314.304	2.196	10	0		DEAEHN
[NH3+][C@H]1CCCCC[C@@H]1[N-]S(=O)(=O)c1cccc(Cl)c1F	ZINC000063213656	184279014	/nfs/dbraw/zinc/27/90/14/184279014.db2.gz	ABXIMJXUVKVXSM-QWRGUYRKSA-N	0	3	320.817	2.417	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(N)c(C(F)(F)F)c2)C1	ZINC000062984675	184264705	/nfs/dbraw/zinc/26/47/05/184264705.db2.gz	ZTMNEBHAKAGJIX-JTQLQIEISA-N	0	3	301.312	2.064	10	0		DEAEHN
O=c1cc2c(nn1Cc1c(Cl)cccc1Cl)CCNC2	ZINC000063169757	184275852	/nfs/dbraw/zinc/27/58/52/184275852.db2.gz	QZZSGEFTRBHJPA-UHFFFAOYSA-N	0	3	310.184	2.244	10	0		DEAEHN
CCc1ncc(CNC[C@H]2CCC3(CCOCC3)[C@@H]2O)s1	ZINC000554936448	291784061	/nfs/dbraw/zinc/78/40/61/291784061.db2.gz	QRODCIMKHDZVMR-IUODEOHRSA-N	0	3	310.463	2.363	10	0		DEAEHN
CC1CCC(N2CCN(Cc3nsc(N(C)C)n3)CC2)CC1	ZINC000119735549	195028634	/nfs/dbraw/zinc/02/86/34/195028634.db2.gz	DKXBGFAIVIAFMI-UHFFFAOYSA-N	0	3	323.510	2.300	10	0		DEAEHN
COCCC[C@@H](N)C(=O)N[C@H]1CCSc2ccc(F)cc21	ZINC000159173235	197332726	/nfs/dbraw/zinc/33/27/26/197332726.db2.gz	ZUEHSMOTPZJDLN-OLZOCXBDSA-N	0	3	312.410	2.233	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1ccccc1OC(F)(F)F	ZINC000159103117	197327552	/nfs/dbraw/zinc/32/75/52/197327552.db2.gz	RKHJMSSCIKMQCF-VIFPVBQESA-N	0	3	306.284	2.278	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000158838553	197305835	/nfs/dbraw/zinc/30/58/35/197305835.db2.gz	JYSYQGFIXGHARH-KBPBESRZSA-N	0	3	305.422	2.327	10	0		DEAEHN
CC(C)(C)c1ccc(S(=O)(=O)C[C@@H](N)[C@H]2CCOC2)cc1	ZINC000158771545	197300389	/nfs/dbraw/zinc/30/03/89/197300389.db2.gz	MCNIHVAMZNZRCR-SWLSCSKDSA-N	0	3	311.447	2.122	10	0		DEAEHN
CCc1ccc(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)cc1CN	ZINC000158757043	197299161	/nfs/dbraw/zinc/29/91/61/197299161.db2.gz	CJYZZWULWDMROO-KBPBESRZSA-N	0	3	308.447	2.128	10	0		DEAEHN
N[C@H](CS(=O)(=O)c1cc(Cl)ccc1Cl)[C@H]1CCOC1	ZINC000158741175	197298108	/nfs/dbraw/zinc/29/81/08/197298108.db2.gz	UWWHAPMHUOJHQG-GZMMTYOYSA-N	0	3	324.229	2.131	10	0		DEAEHN
CCN[C@H](CS(=O)(=O)c1ccc(C)c(C)c1)[C@H]1CCOC1	ZINC000158731559	197297320	/nfs/dbraw/zinc/29/73/20/197297320.db2.gz	OJNUVCHBUKRZMB-GOEBONIOSA-N	0	3	311.447	2.092	10	0		DEAEHN
CCN[C@H](CS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CCOC1	ZINC000158714930	197296381	/nfs/dbraw/zinc/29/63/81/197296381.db2.gz	JXRAFVZOCSBSEL-SMDDNHRTSA-N	0	3	317.838	2.128	10	0		DEAEHN
O=S1CCC(NC2=N[C@H](Cc3ccccc3)CS2)CC1	ZINC000158576420	197284408	/nfs/dbraw/zinc/28/44/08/197284408.db2.gz	SMTJFWSTQDTTII-LQZXRHCMSA-N	0	3	308.472	2.201	10	0		DEAEHN
CN(Cc1cscn1)[C@H](CN)c1cn(C)nc1C(C)(C)C	ZINC000158393736	197268384	/nfs/dbraw/zinc/26/83/84/197268384.db2.gz	DYSVWKJKAPWBEX-CYBMUJFWSA-N	0	3	307.467	2.306	10	0		DEAEHN
C[C@H](NC1CCS(=O)CC1)c1ccc2c(c1)OCCCO2	ZINC000158011139	197234685	/nfs/dbraw/zinc/23/46/85/197234685.db2.gz	PRXYCAIESYDBOM-LTKVMPMFSA-N	0	3	309.431	2.410	10	0		DEAEHN
CC[C@H]1CN(S(=O)(=O)c2cccc([C@@H](C)N)c2)CCS1	ZINC000157702129	197209172	/nfs/dbraw/zinc/20/91/72/197209172.db2.gz	ORWMROGNQKCIPH-YPMHNXCESA-N	0	3	314.476	2.222	10	0		DEAEHN
C[C@](F)(Cc1cncc(Br)c1)C[C@H]1COCCN1	ZINC000157668993	197207186	/nfs/dbraw/zinc/20/71/86/197207186.db2.gz	BCKRHLCLXSHDOM-STQMWFEESA-N	0	3	317.202	2.493	10	0		DEAEHN
CCn1ncc(Br)c1[C@H](O)[C@](C)(CC)N(C)C	ZINC000157612018	197201366	/nfs/dbraw/zinc/20/13/66/197201366.db2.gz	UAYRGPLNNQTYCB-RYUDHWBXSA-N	0	3	304.232	2.429	10	0		DEAEHN
C[C@](F)(C[C@H]1COCCN1)[C@@H]1CCOC2(CCOCC2)C1	ZINC000157634360	197203655	/nfs/dbraw/zinc/20/36/55/197203655.db2.gz	AKGPDBADWKYGJU-ILXRZTDVSA-N	0	3	301.402	2.069	10	0		DEAEHN
CS(=O)(=O)c1ccc(N[C@H]2C[C@@H](N)c3ccccc32)cn1	ZINC000157305570	197178596	/nfs/dbraw/zinc/17/85/96/197178596.db2.gz	MMLBPOQZNMNTJK-KGLIPLIRSA-N	0	3	303.387	2.042	10	0		DEAEHN
COc1cc(CN(C)CC2(O)CCOCC2)ccc1SC	ZINC000157161051	197166713	/nfs/dbraw/zinc/16/67/13/197166713.db2.gz	JNYLQYGVWCIYAA-UHFFFAOYSA-N	0	3	311.447	2.390	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccc(OCCOC)cc1)N(C)C	ZINC000156891443	197148302	/nfs/dbraw/zinc/14/83/02/197148302.db2.gz	VFMWIAMCYKBOQB-INIZCTEOSA-N	0	3	308.422	2.058	10	0		DEAEHN
CN[C@@H](Cc1cccc(F)c1Br)C(OC)OC	ZINC000157453592	197188155	/nfs/dbraw/zinc/18/81/55/197188155.db2.gz	OSEYKPIEMHFJCT-JTQLQIEISA-N	0	3	306.175	2.338	10	0		DEAEHN
O=C1C[C@H](NC[C@@H]2CCCCS2)C(=O)N1C1CCCCC1	ZINC000156411815	197110796	/nfs/dbraw/zinc/11/07/96/197110796.db2.gz	QYGHIWDWUMLNBT-KBPBESRZSA-N	0	3	310.463	2.322	10	0		DEAEHN
Cc1noc(CCCN2CCC[C@@H](c3nncn3C3CC3)C2)n1	ZINC000271601778	209049324	/nfs/dbraw/zinc/04/93/24/209049324.db2.gz	AWLNJJBSWNUYNH-CYBMUJFWSA-N	0	3	316.409	2.117	10	0		DEAEHN
CC(=O)N1CCO[C@@H]2CCN(Cc3ccc(C)c(C)c3)C[C@H]21	ZINC000248070384	257108912	/nfs/dbraw/zinc/10/89/12/257108912.db2.gz	GALYKZVUCVQQJF-QZTJIDSGSA-N	0	3	302.418	2.125	10	0		DEAEHN
Cc1ccc(CN2C[C@H]3COC[C@@]3(c3nc(C)no3)C2)s1	ZINC000248023121	257110780	/nfs/dbraw/zinc/11/07/80/257110780.db2.gz	MRONUOSAEJINIJ-WFASDCNBSA-N	0	3	305.403	2.148	10	0		DEAEHN
Cc1ccc(N2CC[C@H]3CN(Cc4cccc(C)n4)C[C@H]3C2)nn1	ZINC000247906135	257114591	/nfs/dbraw/zinc/11/45/91/257114591.db2.gz	JWBUEHYRODADCS-IRXDYDNUSA-N	0	3	323.444	2.447	10	0		DEAEHN
COC[C@@H]1CNC(=O)[C@H]2CCN(Cc3cc(C)c(C)o3)CC[C@@H]12	ZINC000247827377	257116795	/nfs/dbraw/zinc/11/67/95/257116795.db2.gz	GJDALHHXHDYWKY-XIRDDKMYSA-N	0	3	320.433	2.117	10	0		DEAEHN
O=C(NCC1CC1)[C@]12CCO[C@H]1CCN(Cc1ccsc1)C2	ZINC000247465763	257119825	/nfs/dbraw/zinc/11/98/25/257119825.db2.gz	COPQEDPEPKHFKB-RDJZCZTQSA-N	0	3	320.458	2.255	10	0		DEAEHN
O=S(=O)(c1ccc(F)cc1)N1CC[C@@H]2[C@@H]1CCN2CC1CC1	ZINC000247331853	257119912	/nfs/dbraw/zinc/11/99/12/257119912.db2.gz	PCVDGQOKJGECGE-CVEARBPZSA-N	0	3	324.421	2.073	10	0		DEAEHN
CN1CCC(CN2C(=O)C3(CC3)N[C@H]2c2cccs2)CC1	ZINC000122019351	195390522	/nfs/dbraw/zinc/39/05/22/195390522.db2.gz	KVNVGCMSQKKOIH-CQSZACIVSA-N	0	3	305.447	2.053	10	0		DEAEHN
CCNCc1sccc1S(=O)(=O)NC[C@@H](C)C1CC1	ZINC000128233617	195947571	/nfs/dbraw/zinc/94/75/71/195947571.db2.gz	LNWCVFQZMAIKCA-SNVBAGLBSA-N	0	3	302.465	2.182	10	0		DEAEHN
COc1ccc2cc(CN3CCN(CCO)[C@H](C)C3)ccc2c1	ZINC000190252063	533327136	/nfs/dbraw/zinc/32/71/36/533327136.db2.gz	CMQAOFBWYQFPCI-OAHLLOKOSA-N	0	3	314.429	2.347	10	0		DEAEHN
Fc1ccccc1NC1CCN(CCCN2CCOCC2)CC1	ZINC000072688296	132501877	/nfs/dbraw/zinc/50/18/77/132501877.db2.gz	ZJONLAHIABBXPA-UHFFFAOYSA-N	0	3	321.440	2.424	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(CC(C)(C)c2ccccc2)n1	ZINC000263260515	132579883	/nfs/dbraw/zinc/57/98/83/132579883.db2.gz	QVIAMERENTUFFJ-CQSZACIVSA-N	0	3	300.406	2.166	10	0		DEAEHN
CCCN(CCN1CCCCCC1)C(=O)NCCc1cn[nH]c1	ZINC000360297448	133174196	/nfs/dbraw/zinc/17/41/96/133174196.db2.gz	XNXXNOOZKOSVLC-UHFFFAOYSA-N	0	3	321.469	2.250	10	0		DEAEHN
c1nn2ccccc2c1CN1CCC(c2nnc3n2CCC3)CC1	ZINC000362353634	133225807	/nfs/dbraw/zinc/22/58/07/133225807.db2.gz	QQYNXOYTGJWRIX-UHFFFAOYSA-N	0	3	322.416	2.252	10	0		DEAEHN
Cc1n[nH]cc1CN1CCC[C@@H](Cc2nnc3ccccn32)C1	ZINC000368656524	133282738	/nfs/dbraw/zinc/28/27/38/133282738.db2.gz	YDQQIQTYKWGJBU-AWEZNQCLSA-N	0	3	310.405	2.216	10	0		DEAEHN
CC(C)[C@@]1(CO)CCN(Cc2cccc(C(=O)N(C)C)c2)C1	ZINC000377657200	133339494	/nfs/dbraw/zinc/33/94/94/133339494.db2.gz	UFSYZAACVIFNJG-SFHVURJKSA-N	0	3	304.434	2.229	10	0		DEAEHN
CC[C@@H]1CO[C@@H](C)CN1c1ncc(Br)cc1CN	ZINC000051397986	134762808	/nfs/dbraw/zinc/76/28/08/134762808.db2.gz	CPZUQEWZOFKXCW-JOYOIKCWSA-N	0	3	314.227	2.307	10	0		DEAEHN
Cc1cc(CCN[C@H](C)CC(=O)NCCc2ccccc2)on1	ZINC000563331468	292046642	/nfs/dbraw/zinc/04/66/42/292046642.db2.gz	ANOLBVVGRKZFRB-CQSZACIVSA-N	0	3	315.417	2.253	10	0		DEAEHN
CO[C@H](C)CN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000182286308	144915793	/nfs/dbraw/zinc/91/57/93/144915793.db2.gz	HCIFSSVLGPAIHD-CQSZACIVSA-N	0	3	302.418	2.323	10	0		DEAEHN
O=C(C[C@@H]1CCOc2ccccc21)N1CCN2CCC1CC2	ZINC000188617450	145014561	/nfs/dbraw/zinc/01/45/61/145014561.db2.gz	UJKPPYIEEJDCSD-AWEZNQCLSA-N	0	3	300.402	2.249	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1cc2ccccc2c(=O)[nH]1	ZINC000188733259	145016797	/nfs/dbraw/zinc/01/67/97/145016797.db2.gz	AZGLHYFMOOJZAE-UHFFFAOYSA-N	0	3	319.364	2.061	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1cn(C(C)(C)C)nn1)c1ccccc1	ZINC000191366639	145057387	/nfs/dbraw/zinc/05/73/87/145057387.db2.gz	BMGYMIPTNZBPJN-CQSZACIVSA-N	0	3	315.421	2.066	10	0		DEAEHN
Nc1cc(CN2CCC(C(=O)NCc3ccccc3)CC2)ccn1	ZINC000193298112	145084282	/nfs/dbraw/zinc/08/42/82/145084282.db2.gz	MIWLYGNZXZTTTI-UHFFFAOYSA-N	0	3	324.428	2.192	10	0		DEAEHN
O[C@@H](CN1CCC[C@@H](Cn2cncn2)C1)c1ccc(Cl)cc1	ZINC000246307531	145097736	/nfs/dbraw/zinc/09/77/36/145097736.db2.gz	AFNDGCGAWAQBAO-CJNGLKHVSA-N	0	3	320.824	2.377	10	0		DEAEHN
Cc1csc(=O)n1CCN1CCC[C@@H]1C[C@@H](O)c1ccco1	ZINC000246488790	145104046	/nfs/dbraw/zinc/10/40/46/145104046.db2.gz	HAAOSWFDKFLUMG-ZIAGYGMSSA-N	0	3	322.430	2.399	10	0		DEAEHN
CCOc1ncccc1C(=O)N1C[C@@H]2CCCN2C[C@H]1CC	ZINC000246668182	145109990	/nfs/dbraw/zinc/10/99/90/145109990.db2.gz	YENMVDIZYWOTIC-KGLIPLIRSA-N	0	3	303.406	2.179	10	0		DEAEHN
Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)C(C)S(C)(=O)=O)o1	ZINC000246791184	145114785	/nfs/dbraw/zinc/11/47/85/145114785.db2.gz	JAORZPGFVRGSLD-DRZSPHRISA-N	0	3	313.419	2.321	10	0		DEAEHN
C[C@H](NC(=O)N1CCC[C@@H](N(C)C)C1)[C@H]1COc2ccccc21	ZINC000247083893	145126147	/nfs/dbraw/zinc/12/61/47/145126147.db2.gz	VZOHDIOPKZXRMI-SQWLQELKSA-N	0	3	317.433	2.287	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)COc1ccc(Cl)cc1	ZINC000247311633	145132674	/nfs/dbraw/zinc/13/26/74/145132674.db2.gz	OCFZSKLGRPSHEB-OCCSQVGLSA-N	0	3	308.809	2.414	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCC[C@H]1C1CCCC1	ZINC000247499886	145138984	/nfs/dbraw/zinc/13/89/84/145138984.db2.gz	NJAPXTPMBOMDEM-SJORKVTESA-N	0	3	323.481	2.461	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccccc2N(C)C)CCN1C[C@H](C)O	ZINC000247495940	145139044	/nfs/dbraw/zinc/13/90/44/145139044.db2.gz	LHGNNMACVCARJM-DOTOQJQBSA-N	0	3	305.466	2.030	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2cccc(-n3cccn3)c2)C1	ZINC000247527053	145140082	/nfs/dbraw/zinc/14/00/82/145140082.db2.gz	ZMWRGCTVBQWAMJ-WMLDXEAASA-N	0	3	312.417	2.331	10	0		DEAEHN
Cc1ccc(CC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cn1	ZINC000248144866	145149144	/nfs/dbraw/zinc/14/91/44/145149144.db2.gz	ZHKJDMDVVHJCCR-HKUYNNGSSA-N	0	3	309.413	2.494	10	0		DEAEHN
COC(=O)COc1ccccc1[C@H](C)N[C@@H](C)[C@H]1CCCO1	ZINC000248488225	145156901	/nfs/dbraw/zinc/15/69/01/145156901.db2.gz	MIOUSEQAXQBDJC-KCQAQPDRSA-N	0	3	307.390	2.457	10	0		DEAEHN
COC(=O)c1ccccc1CCN1CCN2CCCC[C@H]2C1	ZINC000248554294	145158929	/nfs/dbraw/zinc/15/89/29/145158929.db2.gz	JZMZLPFSWNIKFB-INIZCTEOSA-N	0	3	302.418	2.186	10	0		DEAEHN
Cc1cnc([C@H](C)CNC(=O)N2CCN3CCC[C@H]3C2)s1	ZINC000248615974	145161532	/nfs/dbraw/zinc/16/15/32/145161532.db2.gz	LXIIKBQPCLPYKU-YPMHNXCESA-N	0	3	308.451	2.045	10	0		DEAEHN
CCN(CCO)CCNC(=O)[C@H]1C[C@H]1c1ccc(C(C)C)cc1	ZINC000248645331	145162900	/nfs/dbraw/zinc/16/29/00/145162900.db2.gz	QZFBBDPSFCLRLT-ROUUACIJSA-N	0	3	318.461	2.344	10	0		DEAEHN
CC(C)[C@@H]1C[C@@H]1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000249270263	145181748	/nfs/dbraw/zinc/18/17/48/145181748.db2.gz	AUZNZNMXBAOCLN-SQNIBIBYSA-N	0	3	316.445	2.162	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)NCc1cc(F)ccc1F	ZINC000261649241	145213532	/nfs/dbraw/zinc/21/35/32/145213532.db2.gz	FPZRADJOHIRLQE-QEORTHHSSA-N	0	3	324.371	2.114	10	0		DEAEHN
N[C@H](C(=O)Nc1cccc(-c2cnco2)c1)C1CCOCC1	ZINC000261705266	145218256	/nfs/dbraw/zinc/21/82/56/145218256.db2.gz	IJRWDOXWQHYEEX-HNNXBMFYSA-N	0	3	301.346	2.034	10	0		DEAEHN
N[C@H](C(=O)NCC1CCC(C(F)(F)F)CC1)C1CCOCC1	ZINC000261716628	145219970	/nfs/dbraw/zinc/21/99/70/145219970.db2.gz	CDJVERYIHXCUBV-GDKBPFBDSA-N	0	3	322.371	2.225	10	0		DEAEHN
Fc1cccc(OCCN2CCNC[C@H]2c2cccnc2)c1	ZINC000261764199	145224432	/nfs/dbraw/zinc/22/44/32/145224432.db2.gz	OEPNATNIVNUUDW-KRWDZBQOSA-N	0	3	301.365	2.246	10	0		DEAEHN
CO[C@@H](C)c1nc(CN2CCNC[C@H]2c2cccnc2)cs1	ZINC000261868315	145235239	/nfs/dbraw/zinc/23/52/39/145235239.db2.gz	XBDLHQMQAKXSRD-WFASDCNBSA-N	0	3	318.446	2.392	10	0		DEAEHN
COc1ccc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)c(C)c1	ZINC000261937582	145243993	/nfs/dbraw/zinc/24/39/93/145243993.db2.gz	UGIYWJVFPSREHD-DDUZABMNSA-N	0	3	318.417	2.475	10	0		DEAEHN
N[C@H](C(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1)C1CCOCC1	ZINC000261996133	145251400	/nfs/dbraw/zinc/25/14/00/145251400.db2.gz	NCMBBVHKNJLLOF-RTXFEEFZSA-N	0	3	322.371	2.225	10	0		DEAEHN
N[C@H](C(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1)C1CCOCC1	ZINC000261996135	145251462	/nfs/dbraw/zinc/25/14/62/145251462.db2.gz	NCMBBVHKNJLLOF-WXHSDQCUSA-N	0	3	322.371	2.225	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)NCc1ccc(Cl)cc1	ZINC000262498013	145288377	/nfs/dbraw/zinc/28/83/77/145288377.db2.gz	LRASTTIFBPIFRY-CKEIUWERSA-N	0	3	322.836	2.489	10	0		DEAEHN
C[C@H](NC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C)c1ccccc1	ZINC000262587096	145295614	/nfs/dbraw/zinc/29/56/14/145295614.db2.gz	ZWJPMQRMFMRBNS-KDQZPGIASA-N	0	3	302.418	2.396	10	0		DEAEHN
C[C@H](C(=O)NCc1cccnc1N(C)C)[C@@H](N)c1ccccc1	ZINC000262661905	145298512	/nfs/dbraw/zinc/29/85/12/145298512.db2.gz	GLVZWNJSKLBFAM-XJKSGUPXSA-N	0	3	312.417	2.100	10	0		DEAEHN
C[C@H]1NCCN(C(=O)c2cnn(-c3cccc(Cl)c3)c2)[C@H]1C	ZINC000262787964	145305233	/nfs/dbraw/zinc/30/52/33/145305233.db2.gz	MSVSBQCRAOEAIW-NEPJUHHUSA-N	0	3	318.808	2.348	10	0		DEAEHN
CCCOc1cccc(-c2nc([C@@H]3CNCCN3C)no2)c1	ZINC000263206527	145335972	/nfs/dbraw/zinc/33/59/72/145335972.db2.gz	JTTARTYPBBXIEZ-AWEZNQCLSA-N	0	3	302.378	2.102	10	0		DEAEHN
Brc1cnc(CN[C@@H]2CCc3nc[nH]c3C2)s1	ZINC000565333703	292154941	/nfs/dbraw/zinc/15/49/41/292154941.db2.gz	ZRPORNLWCZYBMK-SSDOTTSWSA-N	0	3	313.224	2.276	10	0		DEAEHN
Brc1cnc(CN[C@@H]2CCc3[nH]cnc3C2)s1	ZINC000565333703	292154942	/nfs/dbraw/zinc/15/49/42/292154942.db2.gz	ZRPORNLWCZYBMK-SSDOTTSWSA-N	0	3	313.224	2.276	10	0		DEAEHN
CC1=CCN(CCN[C@H](C)CS(=O)(=O)c2ccccc2)CC1	ZINC000358253350	147101699	/nfs/dbraw/zinc/10/16/99/147101699.db2.gz	OMXJNDVMRVFQAR-MRXNPFEDSA-N	0	3	322.474	2.090	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCCc1ccc2c(c1)CCO2	ZINC000358268849	147102515	/nfs/dbraw/zinc/10/25/15/147102515.db2.gz	YSCDSBSLQZEXPR-INIZCTEOSA-N	0	3	302.418	2.155	10	0		DEAEHN
CC(C)[C@@H]1C[C@H](NCc2cccc(N3CCOCC3)n2)CCO1	ZINC000359101410	147261845	/nfs/dbraw/zinc/26/18/45/147261845.db2.gz	IDNGALDXFPBPNC-WBVHZDCISA-N	0	3	319.449	2.211	10	0		DEAEHN
C[C@@H](C(=O)NCc1ccc2cc[nH]c2n1)N1CCCCCC1	ZINC000359407029	147322291	/nfs/dbraw/zinc/32/22/91/147322291.db2.gz	BNVNPTNGXQVMOU-ZDUSSCGKSA-N	0	3	300.406	2.444	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@@H](C)c1ccccc1	ZINC000111790447	401723874	/nfs/dbraw/zinc/72/38/74/401723874.db2.gz	DPPUEZBSODKENM-HOCLYGCPSA-N	0	3	305.422	2.158	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(CC(C)C)CC(C)C	ZINC000111867151	401726330	/nfs/dbraw/zinc/72/63/30/401726330.db2.gz	UJICDOJKCGJQND-INIZCTEOSA-N	0	3	313.486	2.421	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N([C@H](C)C1CC1)C1CC1	ZINC000074167324	401731999	/nfs/dbraw/zinc/73/19/99/401731999.db2.gz	MGKIAVDARJONTE-CZUORRHYSA-N	0	3	309.454	2.070	10	0		DEAEHN
CCOC(=O)CCCNC(=O)CN1CCC[C@@]2(CC=CCC2)C1	ZINC000114495672	401802407	/nfs/dbraw/zinc/80/24/07/401802407.db2.gz	SERIUQXOYBURFZ-SFHVURJKSA-N	0	3	322.449	2.268	10	0		DEAEHN
CN1CCC(NC(=O)Cc2ccc(Br)s2)CC1	ZINC000114558898	401803578	/nfs/dbraw/zinc/80/35/78/401803578.db2.gz	KXVQPFXIGNRVMW-UHFFFAOYSA-N	0	3	317.252	2.264	10	0		DEAEHN
C[C@H](CCNCc1cnn(Cc2ccccc2)c1)[S@@](C)=O	ZINC000129507464	401805356	/nfs/dbraw/zinc/80/53/56/401805356.db2.gz	OMGVFGFCDDHBRV-SZNDQCEHSA-N	0	3	305.447	2.178	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@H]3C2)cc1	ZINC000128295723	401770418	/nfs/dbraw/zinc/77/04/18/401770418.db2.gz	SNGGHXFCWVONKM-IAGOWNOFSA-N	0	3	302.418	2.389	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cnc(-c2ccccc2)nc1	ZINC000113226951	401770894	/nfs/dbraw/zinc/77/08/94/401770894.db2.gz	GBAOJSKYQZLVTB-WMLDXEAASA-N	0	3	322.412	2.452	10	0		DEAEHN
COCCOC[C@H]1CCN(Cc2ncc(C)c(OC)c2C)C1	ZINC000075948909	401774572	/nfs/dbraw/zinc/77/45/72/401774572.db2.gz	LKLGQZJFAGCXHU-HNNXBMFYSA-N	0	3	308.422	2.192	10	0		DEAEHN
CCc1ccc([C@@H]2CCCCN2C(=O)C(C)S(C)(=O)=O)o1	ZINC000128558254	401782776	/nfs/dbraw/zinc/78/27/76/401782776.db2.gz	ZOQPWSQMEAGBOM-AAEUAGOBSA-N	0	3	313.419	2.329	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)C[C@H]2CCCN(C)C2)c(C)s1	ZINC000115585407	401832383	/nfs/dbraw/zinc/83/23/83/401832383.db2.gz	RWROHVIWLRGYPJ-ZDUSSCGKSA-N	0	3	316.492	2.327	10	0		DEAEHN
CN(C)[C@H](CNC(=O)[C@H]1CCCc2n[nH]cc21)c1ccccc1	ZINC000131691308	401854995	/nfs/dbraw/zinc/85/49/95/401854995.db2.gz	BDJRRHLVIHWFHK-WMLDXEAASA-N	0	3	312.417	2.249	10	0		DEAEHN
Cc1ccccc1[C@@H](C)CC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000116785130	401858704	/nfs/dbraw/zinc/85/87/04/401858704.db2.gz	KTKCLUZYBVIHNY-HOTGVXAUSA-N	0	3	304.434	2.278	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)CCc2ccc(Cl)cc2)CCO1	ZINC000116793854	401859479	/nfs/dbraw/zinc/85/94/79/401859479.db2.gz	YTGAXJQGKNWVCN-OAHLLOKOSA-N	0	3	310.825	2.062	10	0		DEAEHN
Cc1cc(C)c(CNC(=O)N2CCO[C@@H](CN(C)C)C2)c(C)c1	ZINC000117040565	401867788	/nfs/dbraw/zinc/86/77/88/401867788.db2.gz	PHDFKRQGJGAXNW-INIZCTEOSA-N	0	3	319.449	2.084	10	0		DEAEHN
COCCC1(CNC(=O)N2CC[C@H](N3CC=CC3)C2)CCCC1	ZINC000119077302	401924420	/nfs/dbraw/zinc/92/44/20/401924420.db2.gz	GCFKZDTUNKNDMX-INIZCTEOSA-N	0	3	321.465	2.239	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1c[nH]nc1-c1c(F)cccc1F	ZINC000135250187	401931876	/nfs/dbraw/zinc/93/18/76/401931876.db2.gz	GIKHYLDFJWSWEU-JTQLQIEISA-N	0	3	320.343	2.179	10	0		DEAEHN
C[C@H](Oc1cccnc1)C(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000117746968	401882816	/nfs/dbraw/zinc/88/28/16/401882816.db2.gz	PCTBBNHFUMNBLV-WMLDXEAASA-N	0	3	313.401	2.268	10	0		DEAEHN
COc1ccc(C(C)(C)C(=O)NC[C@@H]2CCCN2C)cc1OC	ZINC000133582397	401891245	/nfs/dbraw/zinc/89/12/45/401891245.db2.gz	COSCBTNURIIETQ-AWEZNQCLSA-N	0	3	320.433	2.192	10	0		DEAEHN
COc1ccc([C@H](C)N[C@@H]2C=C[C@H](CO)C2)cc1NC(C)=O	ZINC000134634462	401909785	/nfs/dbraw/zinc/90/97/85/401909785.db2.gz	HUFXRQPHSIHNBP-CORIIIEPSA-N	0	3	304.390	2.241	10	0		DEAEHN
CC(C)[C@H](N)C(=O)N1CCN(Cc2ccc(Cl)s2)CC1	ZINC000037799888	401917709	/nfs/dbraw/zinc/91/77/09/401917709.db2.gz	GRMAYEIUYLTIQC-ZDUSSCGKSA-N	0	3	315.870	2.029	10	0		DEAEHN
CCN(CC)C(=O)[C@H](C)N[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000119492348	401954333	/nfs/dbraw/zinc/95/43/33/401954333.db2.gz	HBJMQIVMOPMCBA-KGLIPLIRSA-N	0	3	315.421	2.175	10	0		DEAEHN
CCCS(=O)(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000119689795	401963359	/nfs/dbraw/zinc/96/33/59/401963359.db2.gz	SOUATCTVNHWWDU-MRXNPFEDSA-N	0	3	310.463	2.371	10	0		DEAEHN
CCOc1ccccc1OCC(=O)NCCN1CCCC[C@@H]1C	ZINC000046859335	401974494	/nfs/dbraw/zinc/97/44/94/401974494.db2.gz	JSDGBGMABOMQHG-HNNXBMFYSA-N	0	3	320.433	2.455	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)N1CCC[C@@H]2CCCC[C@@H]21	ZINC000145767758	401991749	/nfs/dbraw/zinc/99/17/49/401991749.db2.gz	BWFHYGSOBUCUDR-WMZOPIPTSA-N	0	3	319.493	2.338	10	0		DEAEHN
C[C@H](NC[C@@H](O)Cn1cccn1)c1ccccc1Br	ZINC000149004428	401992829	/nfs/dbraw/zinc/99/28/29/401992829.db2.gz	BKZQFFJRISULIJ-NWDGAFQWSA-N	0	3	324.222	2.357	10	0		DEAEHN
CCOc1cccc(NC(=O)NC[C@@H](O)CN2CCCCC2)c1	ZINC000048119775	401994300	/nfs/dbraw/zinc/99/43/00/401994300.db2.gz	BYJZBWANMXTVBD-OAHLLOKOSA-N	0	3	321.421	2.054	10	0		DEAEHN
Cc1ccc(F)cc1NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000043276417	401937815	/nfs/dbraw/zinc/93/78/15/401937815.db2.gz	LOAJFOOBVNUSIQ-AWEZNQCLSA-N	0	3	309.385	2.102	10	0		DEAEHN
CCCn1nccc1NC(=O)N1CCN(C2CCCC2)CC1	ZINC000043720987	401939279	/nfs/dbraw/zinc/93/92/79/401939279.db2.gz	COMQLKDGJDMIQJ-UHFFFAOYSA-N	0	3	305.426	2.385	10	0		DEAEHN
C[C@H]1CC[C@H](C(=O)N(CCN(C)C)Cc2ccc(F)cc2)O1	ZINC000151040283	402012530	/nfs/dbraw/zinc/01/25/30/402012530.db2.gz	RSQAIOMPUQTQJP-XJKSGUPXSA-N	0	3	308.397	2.283	10	0		DEAEHN
COCCCNC(=O)CN1C[C@H](c2ccc(OC)cc2)C[C@@H]1C	ZINC000151046819	402012858	/nfs/dbraw/zinc/01/28/58/402012858.db2.gz	VFHAGDNUCTUJFZ-GOEBONIOSA-N	0	3	320.433	2.026	10	0		DEAEHN
COCCOc1cccc(CN2C[C@H]3CCC[C@@H](C2)C3O)c1	ZINC000093479675	402015859	/nfs/dbraw/zinc/01/58/59/402015859.db2.gz	SDEIPAOKGKUXIX-BYICEURKSA-N	0	3	305.418	2.305	10	0		DEAEHN
COCCCN1CCC(NC(=O)NCCC2=CCCC2)CC1	ZINC000121134163	402016843	/nfs/dbraw/zinc/01/68/43/402016843.db2.gz	VDEDMWLECKJRIN-UHFFFAOYSA-N	0	3	309.454	2.287	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1ccc(C(N)=S)cc1	ZINC000049560027	402019357	/nfs/dbraw/zinc/01/93/57/402019357.db2.gz	GCNMCHMWBXNJFK-CQSZACIVSA-N	0	3	307.463	2.027	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCC(CNCC(=O)c2ccc[nH]2)CC1	ZINC000095083945	402024828	/nfs/dbraw/zinc/02/48/28/402024828.db2.gz	ITARKYRKSYBLOH-UHFFFAOYSA-N	0	3	321.421	2.434	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCC[C@H]3OCC[C@@H]32)CCN1C	ZINC000122295947	402071108	/nfs/dbraw/zinc/07/11/08/402071108.db2.gz	LLUOPPMHDVXFGV-OXGONZEZSA-N	0	3	309.454	2.068	10	0		DEAEHN
C[C@H](C1CC1)N(C(=O)CN1CC[C@H]2OCCC[C@@H]2C1)C1CC1	ZINC000152807031	402109679	/nfs/dbraw/zinc/10/96/79/402109679.db2.gz	HKHJPBFVELLBBH-FRFSOERESA-N	0	3	306.450	2.277	10	0		DEAEHN
CC(=O)Oc1ccc(CN2CCC[C@@H](Cn3cncn3)C2)cc1	ZINC000123130031	402112129	/nfs/dbraw/zinc/11/21/29/402112129.db2.gz	LPIOIMMAXWKUGQ-MRXNPFEDSA-N	0	3	314.389	2.116	10	0		DEAEHN
COC(=O)c1cccc(OCCN2CC[C@H]3OCCC[C@@H]3C2)c1	ZINC000153062787	402124735	/nfs/dbraw/zinc/12/47/35/402124735.db2.gz	WJIOOXPBMBJDBE-NVXWUHKLSA-N	0	3	319.401	2.353	10	0		DEAEHN
COc1cc(OC)cc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000123425301	402127231	/nfs/dbraw/zinc/12/72/31/402127231.db2.gz	PFKJMXKAKWBZHF-TZMCWYRMSA-N	0	3	306.406	2.259	10	0		DEAEHN
Cc1ccccc1CCNC(=O)CN1CC[C@H]2OCCC[C@@H]2C1	ZINC000153152980	402130181	/nfs/dbraw/zinc/13/01/81/402130181.db2.gz	FPINEMFUQFCQGT-QZTJIDSGSA-N	0	3	316.445	2.155	10	0		DEAEHN
CC[C@H](O)CN1CCN(Cc2ccc3c(c2)CC(C)(C)O3)CC1	ZINC000123524471	402132173	/nfs/dbraw/zinc/13/21/73/402132173.db2.gz	MSIMMJBESJRAIN-KRWDZBQOSA-N	0	3	318.461	2.289	10	0		DEAEHN
COCCOc1cccc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000123776268	402145549	/nfs/dbraw/zinc/14/55/49/402145549.db2.gz	DMLKIAKZCFRMKA-GOEBONIOSA-N	0	3	320.433	2.267	10	0		DEAEHN
COCCOc1cccc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000123776476	402145809	/nfs/dbraw/zinc/14/58/09/402145809.db2.gz	DMLKIAKZCFRMKA-ZBFHGGJFSA-N	0	3	320.433	2.267	10	0		DEAEHN
COCCCNC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000067005046	402149986	/nfs/dbraw/zinc/14/99/86/402149986.db2.gz	HUZQZLHAYQDWKT-KRWDZBQOSA-N	0	3	319.449	2.377	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)Cc2noc3ccccc32)CCN1C	ZINC000124466045	402181083	/nfs/dbraw/zinc/18/10/83/402181083.db2.gz	NILYDXHGEHLFCA-QWHCGFSZSA-N	0	3	301.390	2.311	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)Cc2noc3ccccc32)CCN1C	ZINC000124466465	402181182	/nfs/dbraw/zinc/18/11/82/402181182.db2.gz	NILYDXHGEHLFCA-STQMWFEESA-N	0	3	301.390	2.311	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2ccc3c(c2)OCCO3)CCN1C	ZINC000124826257	402199245	/nfs/dbraw/zinc/19/92/45/402199245.db2.gz	KDBFSSYKXQFSKA-GXTWGEPZSA-N	0	3	304.390	2.013	10	0		DEAEHN
O=C(CN1CCC[C@@H]1C1CCC1)N1CCO[C@@H]2CCCC[C@@H]21	ZINC000102927454	402174823	/nfs/dbraw/zinc/17/48/23/402174823.db2.gz	WHZIJCHFYCOVSB-IXDOHACOSA-N	0	3	306.450	2.421	10	0		DEAEHN
COc1ccc2oc(CNC[C@H]3CN(C4CC4)CCO3)cc2c1	ZINC000125173958	402217385	/nfs/dbraw/zinc/21/73/85/402217385.db2.gz	LSPPVYHRJSIRRT-KRWDZBQOSA-N	0	3	316.401	2.394	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@](C)(O)c2ccccc2)C1	ZINC000106868052	402219523	/nfs/dbraw/zinc/21/95/23/402219523.db2.gz	MSYZMPWDSWGCBB-QAPCUYQASA-N	0	3	320.433	2.493	10	0		DEAEHN
CC(C)Oc1cncc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000154652946	402224178	/nfs/dbraw/zinc/22/41/78/402224178.db2.gz	UWTNUNSTZNETPL-CJNGLKHVSA-N	0	3	305.422	2.327	10	0		DEAEHN
COc1ccccc1C[C@H](C)CC(=O)N1CC[C@H](N(C)C)C1	ZINC000107246895	402228737	/nfs/dbraw/zinc/22/87/37/402228737.db2.gz	MOESILUBBVKFAJ-HOCLYGCPSA-N	0	3	304.434	2.426	10	0		DEAEHN
CC(C)[C@@H](O)CC(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000155400330	402255980	/nfs/dbraw/zinc/25/59/80/402255980.db2.gz	TXPURNLBYRCFSY-SJORKVTESA-N	0	3	304.434	2.347	10	0		DEAEHN
COc1ccc(C(=O)NCC[N@H+](C)C2CCCCC2)c([O-])c1	ZINC000070828065	402265354	/nfs/dbraw/zinc/26/53/54/402265354.db2.gz	QYOCOPAPCQPCSX-UHFFFAOYSA-N	0	3	306.406	2.395	10	0		DEAEHN
COc1ccc(C(=O)NCC[N@@H+](C)C2CCCCC2)c([O-])c1	ZINC000070828065	402265355	/nfs/dbraw/zinc/26/53/55/402265355.db2.gz	QYOCOPAPCQPCSX-UHFFFAOYSA-N	0	3	306.406	2.395	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)N[C@@H]1CCOC(C)(C)C1	ZINC000155563345	402260780	/nfs/dbraw/zinc/26/07/80/402260780.db2.gz	GJXMUNRITAKIKM-CQSZACIVSA-N	0	3	320.433	2.314	10	0		DEAEHN
CC(C)c1ccccc1NC(=O)CN1CCO[C@@H](CN(C)C)C1	ZINC000105927259	402211707	/nfs/dbraw/zinc/21/17/07/402211707.db2.gz	FKZCFNVTQMFUGJ-HNNXBMFYSA-N	0	3	319.449	2.011	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)CSCc1cscn1	ZINC000126168113	402267977	/nfs/dbraw/zinc/26/79/77/402267977.db2.gz	WATASHKRNOQXLE-LBPRGKRZSA-N	0	3	315.508	2.469	10	0		DEAEHN
CCOc1cc(CN(C)CC)ccc1O[C@H](C)C(=O)N(C)C	ZINC000126267044	402272366	/nfs/dbraw/zinc/27/23/66/402272366.db2.gz	PUNLMWKMUGSJAA-CYBMUJFWSA-N	0	3	308.422	2.393	10	0		DEAEHN
O=C(NCc1ccc(C[NH+]2CCCC2)cc1)c1cncc([O-])c1	ZINC000109934653	402279500	/nfs/dbraw/zinc/27/95/00/402279500.db2.gz	PHWFVGRHTZXBIK-UHFFFAOYSA-N	0	3	311.385	2.313	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1ccc(F)cc1C	ZINC000110086661	402281146	/nfs/dbraw/zinc/28/11/46/402281146.db2.gz	QBYJNCBNZGYRQC-AWEZNQCLSA-N	0	3	309.385	2.366	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@H](CC(C)C)N2CCCCC2=O)C1	ZINC000176292118	402297453	/nfs/dbraw/zinc/29/74/53/402297453.db2.gz	VAXPXIFJQOAYQK-JKSUJKDBSA-N	0	3	323.481	2.014	10	0		DEAEHN
CC[N@@H+]1CCC[C@H]1CN(C)C(=O)NCc1ccc([O-])c(F)c1	ZINC000176390015	402305502	/nfs/dbraw/zinc/30/55/02/402305502.db2.gz	FKDPXTQRJAQMFQ-ZDUSSCGKSA-N	0	3	309.385	2.157	10	0		DEAEHN
CC[N@H+]1CCC[C@H]1CN(C)C(=O)NCc1ccc([O-])c(F)c1	ZINC000176390015	402305505	/nfs/dbraw/zinc/30/55/05/402305505.db2.gz	FKDPXTQRJAQMFQ-ZDUSSCGKSA-N	0	3	309.385	2.157	10	0		DEAEHN
CO[C@@H](C)c1nc(C)c(C(=O)N2CCC[C@@H](N(C)C)C2)s1	ZINC000176407916	402306973	/nfs/dbraw/zinc/30/69/73/402306973.db2.gz	JLPUZLGRFWISBE-NWDGAFQWSA-N	0	3	311.451	2.325	10	0		DEAEHN
CC(C)N(C)CC(=O)N1CCCC[C@H]1c1nnc2n1CCCC2	ZINC000176419459	402307702	/nfs/dbraw/zinc/30/77/02/402307702.db2.gz	YLCOXEDZLRUSDD-AWEZNQCLSA-N	0	3	319.453	2.008	10	0		DEAEHN
CC(C)[C@@](C)(O)C[NH+]1CCC(C(=O)Nc2ccccc2[O-])CC1	ZINC000184937112	402310534	/nfs/dbraw/zinc/31/05/34/402310534.db2.gz	GNZJNFNWMWVIOG-SFHVURJKSA-N	0	3	320.433	2.450	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)COc1ccc(F)cc1F	ZINC000176987791	402357091	/nfs/dbraw/zinc/35/70/91/402357091.db2.gz	JYSDUBLVWBMYHO-ZDUSSCGKSA-N	0	3	312.360	2.286	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CSCc1ccccn1	ZINC000176990148	402357377	/nfs/dbraw/zinc/35/73/77/402357377.db2.gz	ITEASEQWUKFSBA-OAHLLOKOSA-N	0	3	307.463	2.258	10	0		DEAEHN
CCCC(=O)N1CCCC[C@@H]1C(=O)N(C)C[C@@H]1CCCN1CC	ZINC000176990241	402357518	/nfs/dbraw/zinc/35/75/18/402357518.db2.gz	CEIGFYXRECFQNG-JKSUJKDBSA-N	0	3	323.481	2.110	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(C)nc2onc(C)c21	ZINC000177025541	402360851	/nfs/dbraw/zinc/36/08/51/402360851.db2.gz	GVRYHOSMBYHQFR-CYBMUJFWSA-N	0	3	316.405	2.396	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CCc1nc(C(C)(C)C)no1	ZINC000177031442	402361322	/nfs/dbraw/zinc/36/13/22/402361322.db2.gz	QDRGVKFRHRMDSZ-ZDUSSCGKSA-N	0	3	322.453	2.242	10	0		DEAEHN
COc1cccc(CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000234992837	402362279	/nfs/dbraw/zinc/36/22/79/402362279.db2.gz	KZRRRTVJTAFWMS-CYBMUJFWSA-N	0	3	321.421	2.437	10	0		DEAEHN
CCc1oc(C(=O)OC)cc1CN1CCN2CCCC[C@@H]2C1	ZINC000177255059	402385890	/nfs/dbraw/zinc/38/58/90/402385890.db2.gz	KDECRZKTBOGNCR-CQSZACIVSA-N	0	3	306.406	2.299	10	0		DEAEHN
COC(=O)[C@@](C)(O)CN[C@H](C)c1cccc(Br)c1	ZINC000228639303	402339003	/nfs/dbraw/zinc/33/90/03/402339003.db2.gz	DWUVXAKCJLTNJU-RNCFNFMXSA-N	0	3	316.195	2.024	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1cccc2c1OCO2	ZINC000177384247	402396877	/nfs/dbraw/zinc/39/68/77/402396877.db2.gz	CRXTVFHNXZFSLW-CQSZACIVSA-N	0	3	319.405	2.041	10	0		DEAEHN
CCC[C@H](C(=O)NCCc1nc2ccc(F)cc2n1C)N(C)C	ZINC000162075328	402408514	/nfs/dbraw/zinc/40/85/14/402408514.db2.gz	PWBWVUQVPIWDCN-CQSZACIVSA-N	0	3	320.412	2.101	10	0		DEAEHN
CCC[C@H](C(=O)N(C)Cc1nc2ccccc2n1C)N(C)C	ZINC000162099419	402409569	/nfs/dbraw/zinc/40/95/69/402409569.db2.gz	ZBLKXOOVKAVILB-OAHLLOKOSA-N	0	3	302.422	2.262	10	0		DEAEHN
CCc1nc(CNC(=O)N(C)C[C@H]2CCCN2CC)cs1	ZINC000177497524	402409535	/nfs/dbraw/zinc/40/95/35/402409535.db2.gz	WTDTVIQCXLPJAQ-CYBMUJFWSA-N	0	3	310.467	2.331	10	0		DEAEHN
CCC[C@@H](C(=O)N(C)Cc1nc2ccccc2n1C)N(C)C	ZINC000162099315	402409825	/nfs/dbraw/zinc/40/98/25/402409825.db2.gz	ZBLKXOOVKAVILB-HNNXBMFYSA-N	0	3	302.422	2.262	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CCNC(=O)OC(C)(C)C	ZINC000177517236	402411708	/nfs/dbraw/zinc/41/17/08/402411708.db2.gz	ZPXSRTNEYLPTLC-AWEZNQCLSA-N	0	3	308.426	2.181	10	0		DEAEHN
CCOC(=O)c1nn(C)cc1CNC[C@@H]1C[C@H]1c1ccccc1	ZINC000186349154	402423674	/nfs/dbraw/zinc/42/36/74/402423674.db2.gz	BQSWDSNCSYKYCW-HOCLYGCPSA-N	0	3	313.401	2.490	10	0		DEAEHN
CC(C)Cc1ncc(CNC[C@@H]2CN(C3CC3)CCO2)s1	ZINC000162552673	402424095	/nfs/dbraw/zinc/42/40/95/402424095.db2.gz	RPMBZNQDIFHGNV-CQSZACIVSA-N	0	3	309.479	2.294	10	0		DEAEHN
CN1CCO[C@@H](CNCc2ccc(F)c(C(F)(F)F)c2)C1	ZINC000162603033	402426219	/nfs/dbraw/zinc/42/62/19/402426219.db2.gz	GDYICZSEXNODBE-NSHDSACASA-N	0	3	306.303	2.265	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc2c(c1)COC(C)(C)O2	ZINC000186394798	402428143	/nfs/dbraw/zinc/42/81/43/402428143.db2.gz	OJWVBZINBUZIFJ-QGZVFWFLSA-N	0	3	309.406	2.209	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)CN[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000163077873	402440712	/nfs/dbraw/zinc/44/07/12/402440712.db2.gz	ZRQQVLOYMKNNNE-KGLIPLIRSA-N	0	3	315.421	2.079	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)[C@H](O)c2cc(Cl)cc(Cl)c2)C1	ZINC000163126836	402442113	/nfs/dbraw/zinc/44/21/13/402442113.db2.gz	BOYVIRLOTCBGOW-CHWSQXEVSA-N	0	3	317.216	2.189	10	0		DEAEHN
CCOC[C@H](C)NCc1ccc(Cn2ccccc2=O)cc1	ZINC000177931621	402445065	/nfs/dbraw/zinc/44/50/65/402445065.db2.gz	VVVZHBNHEQZEPR-HNNXBMFYSA-N	0	3	300.402	2.411	10	0		DEAEHN
C[C@@H](NC(=O)CCc1ccnn1C)[C@@H](c1ccccc1)N(C)C	ZINC000185949675	402391875	/nfs/dbraw/zinc/39/18/75/402391875.db2.gz	YSIIYOAPCOWODX-KDOFPFPSSA-N	0	3	314.433	2.160	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)CCc1ccccc1	ZINC000246162905	402514512	/nfs/dbraw/zinc/51/45/12/402514512.db2.gz	LZLYBIGJEWWLHH-SJORKVTESA-N	0	3	322.474	2.118	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cccc(C[S@@](C)=O)c1	ZINC000245426273	402459037	/nfs/dbraw/zinc/45/90/37/402459037.db2.gz	FVQAANUDBFQCQY-OPAMFIHVSA-N	0	3	322.474	2.121	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)Nc1ccnn1C(C)C	ZINC000245470047	402463929	/nfs/dbraw/zinc/46/39/29/402463929.db2.gz	MLFVPGKLZLREHC-HUUCEWRRSA-N	0	3	321.469	2.207	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)CSCC(F)(F)F	ZINC000245603877	402473583	/nfs/dbraw/zinc/47/35/83/402473583.db2.gz	XHLXYIOBSJRJQP-MNOVXSKESA-N	0	3	310.385	2.367	10	0		DEAEHN
C[C@H]1C[C@H]1C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1	ZINC000178260874	402476925	/nfs/dbraw/zinc/47/69/25/402476925.db2.gz	UJXPYOHURFQYGG-LJIGWXMPSA-N	0	3	308.466	2.380	10	0		DEAEHN
CCOCCCNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245691354	402479997	/nfs/dbraw/zinc/47/99/97/402479997.db2.gz	XDJXBUYQBCMENI-CVEARBPZSA-N	0	3	305.422	2.158	10	0		DEAEHN
COCC[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245695419	402480045	/nfs/dbraw/zinc/48/00/45/402480045.db2.gz	XZDPQHLIPFIURC-IMJJTQAJSA-N	0	3	305.422	2.156	10	0		DEAEHN
CN1CC[C@H](NC(=O)N2CCSCC2)[C@H]1c1ccccc1	ZINC000245695610	402480075	/nfs/dbraw/zinc/48/00/75/402480075.db2.gz	YCRWGTUXMVEPFI-LSDHHAIUSA-N	0	3	305.447	2.190	10	0		DEAEHN
CSCCCNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000245700906	402480488	/nfs/dbraw/zinc/48/04/88/402480488.db2.gz	ZGELMEPQRZBYCJ-HUUCEWRRSA-N	0	3	307.463	2.484	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@@H](C)C(=O)N1CCCCC1	ZINC000178320698	402484577	/nfs/dbraw/zinc/48/45/77/402484577.db2.gz	JZPPVHBJRQMEBI-GOEBONIOSA-N	0	3	304.438	2.057	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)NCC1CCCCC1	ZINC000178320113	402484720	/nfs/dbraw/zinc/48/47/20/402484720.db2.gz	LNBGACUDIAYJIT-KRWDZBQOSA-N	0	3	318.465	2.352	10	0		DEAEHN
COC[C@H](C)n1ccc(NC(=O)NCCN2CCCC[C@@H]2C)n1	ZINC000187176641	402486507	/nfs/dbraw/zinc/48/65/07/402486507.db2.gz	POWMZZGQLCBKTH-KBPBESRZSA-N	0	3	323.441	2.086	10	0		DEAEHN
O=C([C@@H]1C[C@@H]1c1cccc(Br)c1)N1CCCNCC1	ZINC000178362799	402489906	/nfs/dbraw/zinc/48/99/06/402489906.db2.gz	JOYZGSPRQKUPCW-ZIAGYGMSSA-N	0	3	323.234	2.375	10	0		DEAEHN
COC[C@H](C)CN(CCO)Cc1cnn(Cc2ccccc2)c1	ZINC000187273847	402490973	/nfs/dbraw/zinc/49/09/73/402490973.db2.gz	FNZGBWZKQWHJLZ-MRXNPFEDSA-N	0	3	317.433	2.008	10	0		DEAEHN
COCC[C@@](C)(O)CNCc1ccc(Br)c(F)c1	ZINC000178386255	402492379	/nfs/dbraw/zinc/49/23/79/402492379.db2.gz	QHZKKVHNGFNBSC-CYBMUJFWSA-N	0	3	320.202	2.465	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)N(C)C[C@H]1CCCO1	ZINC000245864080	402492754	/nfs/dbraw/zinc/49/27/54/402492754.db2.gz	PQXRUPKQPZULHC-DOTOQJQBSA-N	0	3	319.449	2.327	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)N1CCC[C@@H](Cc2noc(C)n2)C1	ZINC000245912335	402496969	/nfs/dbraw/zinc/49/69/69/402496969.db2.gz	PLARXMAUTUFGQU-GJZGRUSLSA-N	0	3	320.437	2.034	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCc1nccn1C(F)F	ZINC000170682717	402513868	/nfs/dbraw/zinc/51/38/68/402513868.db2.gz	OUGZZJWSLMYXEE-LLVKDONJSA-N	0	3	317.384	2.054	10	0		DEAEHN
O=C(NC[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)N1CCN2CCC[C@@H]2C1	ZINC000178470154	402502039	/nfs/dbraw/zinc/50/20/39/402502039.db2.gz	SVUJMPIOTDYWTQ-SPUZQDLCSA-N	0	3	311.429	2.062	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000246038214	402504894	/nfs/dbraw/zinc/50/48/94/402504894.db2.gz	WNRRZMGFOSBGMF-DAXOMENPSA-N	0	3	315.417	2.057	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)n1	ZINC000246720575	402541980	/nfs/dbraw/zinc/54/19/80/402541980.db2.gz	OEKAVKGKOISMCY-BZUAXINKSA-N	0	3	304.438	2.004	10	0		DEAEHN
C[C@@H](C(=O)N1C[C@H](C)C[C@H](C)C1)N1CC[C@H]2OCCC[C@H]2C1	ZINC000246762269	402544090	/nfs/dbraw/zinc/54/40/90/402544090.db2.gz	QCSVAFAALGVPDZ-BQJWPVKWSA-N	0	3	308.466	2.380	10	0		DEAEHN
COc1cc(OC)cc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000246996950	402552718	/nfs/dbraw/zinc/55/27/18/402552718.db2.gz	FLFNQZRICADCDK-OCCSQVGLSA-N	0	3	304.390	2.013	10	0		DEAEHN
COC(=O)Nc1ccc(C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)cc1	ZINC000247066507	402555699	/nfs/dbraw/zinc/55/56/99/402555699.db2.gz	ISKKCTURWQPAAS-IUODEOHRSA-N	0	3	319.405	2.323	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)ccc1C	ZINC000247077956	402556414	/nfs/dbraw/zinc/55/64/14/402556414.db2.gz	JCWPUDRINXPBJS-DYVFJYSZSA-N	0	3	317.433	2.412	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC[C@H]1CCCC[C@@H]1C	ZINC000247222017	402560785	/nfs/dbraw/zinc/56/07/85/402560785.db2.gz	BYZUXKDTTXIOHA-ARFHVFGLSA-N	0	3	311.470	2.223	10	0		DEAEHN
CCOCCN1CCN(C[C@@H](O)c2ccccc2)C[C@H]1CC	ZINC000247238687	402560814	/nfs/dbraw/zinc/56/08/14/402560814.db2.gz	SBFHFYLWMGJQGZ-QZTJIDSGSA-N	0	3	306.450	2.153	10	0		DEAEHN
O=C1NCC[C@H]1NCC1(c2ccc3c(c2)OCO3)CCCCC1	ZINC000179065009	402569201	/nfs/dbraw/zinc/56/92/01/402569201.db2.gz	YSNWOMCHOVRMCL-CQSZACIVSA-N	0	3	316.401	2.095	10	0		DEAEHN
COc1ccc(C2(CN[C@@H]3CCNC3=O)CCCCC2)cc1	ZINC000179065208	402569769	/nfs/dbraw/zinc/56/97/69/402569769.db2.gz	AXDIFGAVKQDVEY-MRXNPFEDSA-N	0	3	302.418	2.375	10	0		DEAEHN
CCOCCCNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179084165	402571144	/nfs/dbraw/zinc/57/11/44/402571144.db2.gz	XDJXBUYQBCMENI-HZPDHXFCSA-N	0	3	305.422	2.158	10	0		DEAEHN
CCN(C(=O)[C@@H](C)N1CCN2CCC[C@H]2C1)C1CCCCC1	ZINC000246228844	402519250	/nfs/dbraw/zinc/51/92/50/402519250.db2.gz	CDBVHTGCRIJGIL-WBVHZDCISA-N	0	3	307.482	2.336	10	0		DEAEHN
C[C@H](NC(=O)CN1CCN2CCC[C@@H]2C1)c1ccccc1Cl	ZINC000178631266	402519821	/nfs/dbraw/zinc/51/98/21/402519821.db2.gz	IJCVIDMMLJFRNL-UONOGXRCSA-N	0	3	321.852	2.297	10	0		DEAEHN
CO[C@@H](C)[C@H](C)NC(=O)N[C@@H](C)CN(C)Cc1ccccc1	ZINC000188442552	402520437	/nfs/dbraw/zinc/52/04/37/402520437.db2.gz	MTZRTYUSBHNPIE-KKUMJFAQSA-N	0	3	307.438	2.230	10	0		DEAEHN
CCC[C@@H](C(=O)NCCn1c(C)nc2ccccc21)N(C)C	ZINC000178662294	402523139	/nfs/dbraw/zinc/52/31/39/402523139.db2.gz	PMDATYRNHPBLMR-INIZCTEOSA-N	0	3	302.422	2.191	10	0		DEAEHN
C[C@H]1c2ccccc2CCN1C[C@H]1CCCN(S(C)(=O)=O)C1	ZINC000246349282	402526654	/nfs/dbraw/zinc/52/66/54/402526654.db2.gz	OZNRKZYPHHQSLM-LSDHHAIUSA-N	0	3	322.474	2.277	10	0		DEAEHN
CCc1cccc(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000246447979	402531174	/nfs/dbraw/zinc/53/11/74/402531174.db2.gz	ILAQVSZTONKYFI-CZUORRHYSA-N	0	3	310.463	2.256	10	0		DEAEHN
Cc1nn(CC(C)C)c(C)c1CCC(=O)N1CC[C@H](N(C)C)C1	ZINC000170858599	402533655	/nfs/dbraw/zinc/53/36/55/402533655.db2.gz	ZRVMUHCMQBSYLH-INIZCTEOSA-N	0	3	320.481	2.251	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1[C@H](C)C[C@@H]2CCCC[C@@H]21	ZINC000246494249	402533915	/nfs/dbraw/zinc/53/39/15/402533915.db2.gz	IOONHVGEYUVELJ-TWMKSMIVSA-N	0	3	323.481	2.460	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(OC[C@H]3CCCO3)cc2)C1	ZINC000170861758	402534526	/nfs/dbraw/zinc/53/45/26/402534526.db2.gz	RYSOOCRJESVBPN-DOTOQJQBSA-N	0	3	318.417	2.021	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cc(C3CC3)n(C(C)(C)C)n2)C1	ZINC000170865516	402534983	/nfs/dbraw/zinc/53/49/83/402534983.db2.gz	FHLIFUNMOWINSH-ZDUSSCGKSA-N	0	3	304.438	2.292	10	0		DEAEHN
COC(=O)c1ccc(NC(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)cc1	ZINC000246523552	402535249	/nfs/dbraw/zinc/53/52/49/402535249.db2.gz	ULMHOIYPQUKFNN-IUODEOHRSA-N	0	3	319.405	2.323	10	0		DEAEHN
Cc1ccc(-c2nc(CC(=O)N3CC[C@H](N(C)C)C3)cs2)o1	ZINC000170866881	402535838	/nfs/dbraw/zinc/53/58/38/402535838.db2.gz	HWFJEIVCJRUCPA-ZDUSSCGKSA-N	0	3	319.430	2.417	10	0		DEAEHN
CCN(CC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)C1CC1	ZINC000248137037	402583515	/nfs/dbraw/zinc/58/35/15/402583515.db2.gz	XQQYFKKXCTWFTE-WMZOPIPTSA-N	0	3	301.434	2.032	10	0		DEAEHN
CC(C)N(Cc1ccccc1)C(=O)[C@H](C)N1CC[C@](C)(O)C1	ZINC000248342053	402586814	/nfs/dbraw/zinc/58/68/14/402586814.db2.gz	JHJOBOWAYHDRJL-YJBOKZPZSA-N	0	3	304.434	2.269	10	0		DEAEHN
CCCN(CCC)C(=O)CCCC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171470937	402588803	/nfs/dbraw/zinc/58/88/03/402588803.db2.gz	JPJUINRHVKAIGP-MRXNPFEDSA-N	0	3	323.481	2.112	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)C[C@H](C)c2nccs2)C1	ZINC000248452743	402591217	/nfs/dbraw/zinc/59/12/17/402591217.db2.gz	JSQOHDSOZMXNOT-STQMWFEESA-N	0	3	310.467	2.372	10	0		DEAEHN
CSCCN(C)C[C@@H](c1cccs1)N1CCOCC1	ZINC000171632655	402603762	/nfs/dbraw/zinc/60/37/62/402603762.db2.gz	CHIUNBJJACUHAM-ZDUSSCGKSA-N	0	3	300.493	2.416	10	0		DEAEHN
O=C1C[C@@H](c2ccccc2)N(C[C@H](O)C2CCCCC2)CCN1	ZINC000190499064	402605969	/nfs/dbraw/zinc/60/59/69/402605969.db2.gz	XYPNBXJHFGJJPW-ROUUACIJSA-N	0	3	316.445	2.491	10	0		DEAEHN
CCC[C@@H](C)CN1CCN(C[C@H]2CN(C(C)C)CCO2)CC1	ZINC000180089897	402606813	/nfs/dbraw/zinc/60/68/13/402606813.db2.gz	WQMJBMTYURUQPX-MSOLQXFVSA-N	0	3	311.514	2.149	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2ccc(F)c(COC)c2)C1	ZINC000171683132	402609604	/nfs/dbraw/zinc/60/96/04/402609604.db2.gz	UIOXVOSQUIKZTG-OAHLLOKOSA-N	0	3	323.412	2.256	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@H](CCO)c2ccco2)C12CCOCC2	ZINC000249053293	402619118	/nfs/dbraw/zinc/61/91/18/402619118.db2.gz	XBPXTALGBPITMZ-VNQPRFMTSA-N	0	3	309.406	2.267	10	0		DEAEHN
CC[C@@](C)(O)CN(C)C[C@H](c1cccs1)N1CCOCC1	ZINC000249086368	402620053	/nfs/dbraw/zinc/62/00/53/402620053.db2.gz	FMDDEWRKSZWLRS-GDBMZVCRSA-N	0	3	312.479	2.214	10	0		DEAEHN
Cc1c(F)cccc1NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000249152705	402622295	/nfs/dbraw/zinc/62/22/95/402622295.db2.gz	HQKXYUISLIYBRX-AAEUAGOBSA-N	0	3	321.396	2.014	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1C	ZINC000249264896	402624343	/nfs/dbraw/zinc/62/43/43/402624343.db2.gz	ZJMNGZFKOCQOBA-ZFWWWQNUSA-N	0	3	317.433	2.183	10	0		DEAEHN
C[C@H](CNC(=O)NC[C@H]1CCC(C)(C)O1)N1CCC[C@@H](C)C1	ZINC000249282215	402625048	/nfs/dbraw/zinc/62/50/48/402625048.db2.gz	PYNBIEFPDLDACD-RBSFLKMASA-N	0	3	311.470	2.364	10	0		DEAEHN
COC[C@H](C)CNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179150483	402576363	/nfs/dbraw/zinc/57/63/63/402576363.db2.gz	QKNPTPMAFPIPAA-FVQBIDKESA-N	0	3	305.422	2.014	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)NCCCc2ccccn2)C1	ZINC000179170854	402577559	/nfs/dbraw/zinc/57/75/59/402577559.db2.gz	LEVUMZOMRBPRBJ-OAHLLOKOSA-N	0	3	304.438	2.045	10	0		DEAEHN
COc1ccc(CN(C)C(=O)[C@@]2(C)CCCCN2)c(OC)c1	ZINC000180903345	402630096	/nfs/dbraw/zinc/63/00/96/402630096.db2.gz	AUCBSQJSJNGMML-QGZVFWFLSA-N	0	3	306.406	2.194	10	0		DEAEHN
C[C@]1(C(=O)Nc2cccc(N3CCOC3=O)c2)CCCCN1	ZINC000180925647	402630375	/nfs/dbraw/zinc/63/03/75/402630375.db2.gz	YNKNABFPRLDVSV-MRXNPFEDSA-N	0	3	303.362	2.114	10	0		DEAEHN
CC(C)c1cc(C(=O)N2CCCN(C3CC3)CC2)cc(=O)[nH]1	ZINC000180991856	402632200	/nfs/dbraw/zinc/63/22/00/402632200.db2.gz	WOTASVDYVWTYSU-UHFFFAOYSA-N	0	3	303.406	2.221	10	0		DEAEHN
CCOCc1ccc(CNC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000171900748	402632707	/nfs/dbraw/zinc/63/27/07/402632707.db2.gz	NSPSRDNLVMKTCJ-QGZVFWFLSA-N	0	3	317.433	2.213	10	0		DEAEHN
Cc1ccc([C@@H](C)NC[C@H](O)COC2CCOCC2)cc1F	ZINC000181343548	402642235	/nfs/dbraw/zinc/64/22/35/402642235.db2.gz	ZJUWBXGYVHNVPA-HIFRSBDPSA-N	0	3	311.397	2.341	10	0		DEAEHN
CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000172480150	402658392	/nfs/dbraw/zinc/65/83/92/402658392.db2.gz	RUGIDPFRDVUZGY-BZUAXINKSA-N	0	3	323.481	2.317	10	0		DEAEHN
COc1ccc(F)c(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1OC	ZINC000191160258	402646996	/nfs/dbraw/zinc/64/69/96/402646996.db2.gz	GBKCAAFWAFWNJV-NWDGAFQWSA-N	0	3	324.396	2.398	10	0		DEAEHN
Cc1cc(F)c2[nH]c(=O)cc(C(=O)N3CC[C@@H](N(C)C)C3)c2c1	ZINC000181502490	402647370	/nfs/dbraw/zinc/64/73/70/402647370.db2.gz	AYXCRQSQQGQXJT-LLVKDONJSA-N	0	3	317.364	2.164	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2cccnc2-n2cncn2)C12CCC2	ZINC000181504868	402647923	/nfs/dbraw/zinc/64/79/23/402647923.db2.gz	OZSASDDBKIFKJE-LSDHHAIUSA-N	0	3	313.405	2.100	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COc2cc(C)cc(C)c2)CC[C@H]1C	ZINC000251649639	402648966	/nfs/dbraw/zinc/64/89/66/402648966.db2.gz	HMEGIMIENHEYHW-JFIYKMOQSA-N	0	3	307.434	2.400	10	0		DEAEHN
O=C(Cc1ccccc1OC(F)F)N1CCN2CCC[C@H]2C1	ZINC000172380129	402653167	/nfs/dbraw/zinc/65/31/67/402653167.db2.gz	JMXHHXDEFWEHTH-ZDUSSCGKSA-N	0	3	310.344	2.137	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cccc(Br)c2F)C1	ZINC000192109774	402712039	/nfs/dbraw/zinc/71/20/39/402712039.db2.gz	SUQZSSZJCXFMEX-SECBINFHSA-N	0	3	315.186	2.364	10	0		DEAEHN
CO[C@](C)(C(=O)N1C[C@@H]2CCCN2C[C@@H]1C)c1ccccc1F	ZINC000253335840	402662265	/nfs/dbraw/zinc/66/22/65/402662265.db2.gz	ASTYJHGGRBGPJB-DEYYWGMASA-N	0	3	320.408	2.382	10	0		DEAEHN
Cc1cc(N2CC[C@@H](N3CC[C@H](CC(C)C)C3)C2=O)n(C)n1	ZINC000173910120	402718802	/nfs/dbraw/zinc/71/88/02/402718802.db2.gz	GQCYNGBPMCCPCP-HUUCEWRRSA-N	0	3	304.438	2.202	10	0		DEAEHN
CN1CC[C@H]2[C@H](CCCN2C(=O)c2snnc2C(C)(C)C)C1	ZINC000191457463	402671368	/nfs/dbraw/zinc/67/13/68/402671368.db2.gz	WVGFVPGZCLYSLB-NEPJUHHUSA-N	0	3	322.478	2.392	10	0		DEAEHN
CCc1cccc(OCCN2CC[C@H](N3CCOCC3)C2)c1	ZINC000173929736	402719380	/nfs/dbraw/zinc/71/93/80/402719380.db2.gz	IAUNUZZLRBVRLN-KRWDZBQOSA-N	0	3	304.434	2.034	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cnn(CCC(F)(F)F)c2)C1	ZINC000182367475	402683847	/nfs/dbraw/zinc/68/38/47/402683847.db2.gz	YKAZBHAEQBGHPE-LBPRGKRZSA-N	0	3	318.343	2.050	10	0		DEAEHN
Cc1ccc(C[C@@H](C)C(=O)NC[C@H](O)CN2CCCCC2)cc1	ZINC000182556931	402699654	/nfs/dbraw/zinc/69/96/54/402699654.db2.gz	IZDPOZBRSHKTHN-AEFFLSMTSA-N	0	3	318.461	2.137	10	0		DEAEHN
c1cn(CCCN2CCC[C@H](c3nncn3C3CC3)C2)cn1	ZINC000182963762	402730088	/nfs/dbraw/zinc/73/00/88/402730088.db2.gz	WJEMZGHDBBTABE-AWEZNQCLSA-N	0	3	300.410	2.079	10	0		DEAEHN
COc1cccc(F)c1[C@@H](C)NC(=O)NC[C@H]1CCCN1C	ZINC000174355589	402737915	/nfs/dbraw/zinc/73/79/15/402737915.db2.gz	DZUNFBSJBVBVJM-VXGBXAGGSA-N	0	3	309.385	2.289	10	0		DEAEHN
Cc1cccn2c(CN[C@H]3CCCN(c4cccnn4)C3)cnc12	ZINC000174361809	402737950	/nfs/dbraw/zinc/73/79/50/402737950.db2.gz	ODJNIADAGZPXIO-HNNXBMFYSA-N	0	3	322.416	2.191	10	0		DEAEHN
Cc1cccn2c(CN[C@@H]3CCCN(c4cccnn4)C3)cnc12	ZINC000174361798	402738005	/nfs/dbraw/zinc/73/80/05/402738005.db2.gz	ODJNIADAGZPXIO-OAHLLOKOSA-N	0	3	322.416	2.191	10	0		DEAEHN
Cc1ccc(O[C@H](C)c2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263135524	402744827	/nfs/dbraw/zinc/74/48/27/402744827.db2.gz	CAIOJPHALQYCDP-TZMCWYRMSA-N	0	3	302.378	2.094	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)[C@H](C)N[C@H](C)[C@@H]1CCCO1	ZINC000183217438	402747860	/nfs/dbraw/zinc/74/78/60/402747860.db2.gz	NKBGSOIUYTWVAQ-VYDXJSESSA-N	0	3	304.434	2.499	10	0		DEAEHN
Cc1csc([C@@H](C)NC(=O)N2CC[C@H](N3CC=CC3)C2)n1	ZINC000174661782	402751362	/nfs/dbraw/zinc/75/13/62/402751362.db2.gz	RMUVPCALZSCOSU-OLZOCXBDSA-N	0	3	306.435	2.168	10	0		DEAEHN
CSCc1cc(-c2nc([C@@H]3CNCCN3C)no2)ccc1F	ZINC000263267175	402752103	/nfs/dbraw/zinc/75/21/03/402752103.db2.gz	RSHVGNUYVKXWHB-ZDUSSCGKSA-N	0	3	322.409	2.315	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2ccc(Br)cc2)n1	ZINC000263266479	402752273	/nfs/dbraw/zinc/75/22/73/402752273.db2.gz	RQCIVPBTDIQFHE-NSHDSACASA-N	0	3	323.194	2.075	10	0		DEAEHN
CN1CCNC[C@H]1c1noc([C@@H]2Cc3ccccc3S2)n1	ZINC000263269676	402752922	/nfs/dbraw/zinc/75/29/22/402752922.db2.gz	SARWOIBWJNQOAP-AAEUAGOBSA-N	0	3	302.403	2.035	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cccc(C(=O)OC)c1	ZINC000174979622	402768849	/nfs/dbraw/zinc/76/88/49/402768849.db2.gz	VRRNYPMTZZTIQK-HZPDHXFCSA-N	0	3	316.401	2.172	10	0		DEAEHN
Cc1noc2ncc(C(=O)N[C@@H](CC(C)C)CN(C)C)cc12	ZINC000193269373	402769102	/nfs/dbraw/zinc/76/91/02/402769102.db2.gz	FQZLBEXCFMVQFF-ZDUSSCGKSA-N	0	3	304.394	2.237	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@@H](C)c2nc(C)cs2)C1	ZINC000183688473	402789267	/nfs/dbraw/zinc/78/92/67/402789267.db2.gz	OPJBIQFZHYDFQX-DGCLKSJQSA-N	0	3	310.467	2.339	10	0		DEAEHN
C[C@@H](Oc1ccccc1Cl)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000195329341	402842296	/nfs/dbraw/zinc/84/22/96/402842296.db2.gz	RPSCJOGAGKTFPL-CHWSQXEVSA-N	0	3	308.809	2.414	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)N(C)Cc1ccc(F)cc1	ZINC000175361749	402800031	/nfs/dbraw/zinc/80/00/31/402800031.db2.gz	ADLPBXBKAPNQCU-QGZVFWFLSA-N	0	3	321.440	2.200	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N(C)CCc1ccc(F)cc1	ZINC000175387341	402801755	/nfs/dbraw/zinc/80/17/55/402801755.db2.gz	WHCHDQQJQQVXDE-INIZCTEOSA-N	0	3	307.413	2.494	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC(C)(C)c2ncc(C)s2)C1	ZINC000175435940	402806771	/nfs/dbraw/zinc/80/67/71/402806771.db2.gz	IFHMRJURPRAHKO-LBPRGKRZSA-N	0	3	310.467	2.470	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccc(OC[C@@H]2CCCO2)cc1	ZINC000194746941	402814399	/nfs/dbraw/zinc/81/43/99/402814399.db2.gz	BMURQYZGWZOIEM-RDJZCZTQSA-N	0	3	318.417	2.068	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)CCc1cccc2c1OCO2	ZINC000184097195	402817868	/nfs/dbraw/zinc/81/78/68/402817868.db2.gz	ISACGHKGZQOLSP-OAHLLOKOSA-N	0	3	320.433	2.440	10	0		DEAEHN
O=C(Nc1cccc2c1OCC[C@H]2O)C1CCN(C2CC2)CC1	ZINC000194865389	402819821	/nfs/dbraw/zinc/81/98/21/402819821.db2.gz	FYGOQJUDEBROOG-MRXNPFEDSA-N	0	3	316.401	2.315	10	0		DEAEHN
COc1cc(CN[C@H]2CCc3nc(C(C)C)nn3C2)ccc1O	ZINC000194977511	402825183	/nfs/dbraw/zinc/82/51/83/402825183.db2.gz	PMACAMRFDGCBQN-ZDUSSCGKSA-N	0	3	316.405	2.220	10	0		DEAEHN
C[C@H]1C[C@@H](C(=O)NCC2CCN(CCO)CC2)CC(C)(C)C1	ZINC000184233652	402828870	/nfs/dbraw/zinc/82/88/70/402828870.db2.gz	VIWINJXNVRZKLS-GOEBONIOSA-N	0	3	310.482	2.269	10	0		DEAEHN
CCN1CCN(C[C@@H](C)CNC(=O)Nc2ccc(C)s2)CC1	ZINC000175782832	402832369	/nfs/dbraw/zinc/83/23/69/402832369.db2.gz	BPYHGNIDGVCTRJ-ZDUSSCGKSA-N	0	3	324.494	2.452	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)CC[C@@H]1CCOC1	ZINC000175834678	402836925	/nfs/dbraw/zinc/83/69/25/402836925.db2.gz	CCHKUCRVYZONLZ-SJORKVTESA-N	0	3	304.434	2.092	10	0		DEAEHN
COc1ccc2c(CC(=O)N3CCN4CCC[C@@H]4C3)coc2c1	ZINC000195310852	402841406	/nfs/dbraw/zinc/84/14/06/402841406.db2.gz	BVZYAAVYKDFYMH-CQSZACIVSA-N	0	3	314.385	2.291	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)CC[N@@H+]1C	ZINC000175191574	402786534	/nfs/dbraw/zinc/78/65/34/402786534.db2.gz	YSWATNWQTYDCEG-YPMHNXCESA-N	0	3	309.385	2.155	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)CC[N@H+]1C	ZINC000175191574	402786537	/nfs/dbraw/zinc/78/65/37/402786537.db2.gz	YSWATNWQTYDCEG-YPMHNXCESA-N	0	3	309.385	2.155	10	0		DEAEHN
CCc1csc([C@@H]2CCCN(C[C@H](O)Cn3cccn3)C2)n1	ZINC000195443014	402846090	/nfs/dbraw/zinc/84/60/90/402846090.db2.gz	GQBLHPZODRFTRL-HIFRSBDPSA-N	0	3	320.462	2.143	10	0		DEAEHN
Cc1nn(C)c(C)c1CCNC(=O)c1ccc(CN(C)C)cc1	ZINC000195473947	402846951	/nfs/dbraw/zinc/84/69/51/402846951.db2.gz	RIDNPNNUVORCSN-UHFFFAOYSA-N	0	3	314.433	2.071	10	0		DEAEHN
CCOC(=O)CC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000195492394	402847610	/nfs/dbraw/zinc/84/76/10/402847610.db2.gz	IZNIDMJCFVQDAK-MRXNPFEDSA-N	0	3	318.417	2.111	10	0		DEAEHN
Cn1nccc1C1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000195502049	402847643	/nfs/dbraw/zinc/84/76/43/402847643.db2.gz	UXMJCQVUNQBBSF-MRXNPFEDSA-N	0	3	315.417	2.039	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(COC(C)(C)C)on1	ZINC000184524837	402848786	/nfs/dbraw/zinc/84/87/86/402848786.db2.gz	DQJDCMCXOONIDF-CHWSQXEVSA-N	0	3	321.421	2.298	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@H](C)N1CC[C@H](CNc2cccc(C)n2)C1	ZINC000195516254	402849318	/nfs/dbraw/zinc/84/93/18/402849318.db2.gz	GSFDMQXPJKZFEL-CWRNSKLLSA-N	0	3	318.465	2.427	10	0		DEAEHN
O=C(CN1CCC[C@@H]1[C@@H]1CCCC[C@H]1O)NCc1ccccc1	ZINC000281310472	403063376	/nfs/dbraw/zinc/06/33/76/403063376.db2.gz	HZQSIGBWJQPRFL-RCCFBDPRSA-N	0	3	316.445	2.318	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)[C@H](C)N[C@H]1CCOC[C@@H]1C	ZINC000277544889	403229215	/nfs/dbraw/zinc/22/92/15/403229215.db2.gz	SHOGXOXSWKBXRO-HUBLWGQQSA-N	0	3	304.390	2.231	10	0		DEAEHN
CC(=O)N(C[C@@H]1CCCN1C[C@@H](O)Cc1ccccc1)C1CC1	ZINC000276598374	403190162	/nfs/dbraw/zinc/19/01/62/403190162.db2.gz	VHMPSIYCEBJHRS-OALUTQOASA-N	0	3	316.445	2.065	10	0		DEAEHN
CCN1CC[C@@H]2OCCN(CCc3ccc(F)c(F)c3)[C@H]2C1	ZINC000339385523	403379383	/nfs/dbraw/zinc/37/93/83/403379383.db2.gz	QLCLKJMTTJHKAC-IRXDYDNUSA-N	0	3	310.388	2.302	10	0		DEAEHN
CN1CC[C@H](NC(=O)N[C@@]2(C)CCCOC2)[C@H]1c1ccccc1	ZINC000332799474	403618493	/nfs/dbraw/zinc/61/84/93/403618493.db2.gz	PVWHXZUELBQWES-JZXOWHBKSA-N	0	3	317.433	2.300	10	0		DEAEHN
CNC(=O)c1cccnc1NC[C@@H](C)N(C)Cc1ccccc1	ZINC000301395050	403624063	/nfs/dbraw/zinc/62/40/63/403624063.db2.gz	LDACLBLYFGVUSD-CQSZACIVSA-N	0	3	312.417	2.374	10	0		DEAEHN
Cc1nn(C)c2sc([C@H](C)N[C@H]3CCC(=O)N(C)C3)cc12	ZINC000287876360	403684477	/nfs/dbraw/zinc/68/44/77/403684477.db2.gz	YENXQPBUMPRYDX-QWRGUYRKSA-N	0	3	306.435	2.215	10	0		DEAEHN
O=C(NCC1(CO)CC2(CCC2)C1)[C@@H]1CCCN1C1CCCC1	ZINC000333345406	403730121	/nfs/dbraw/zinc/73/01/21/403730121.db2.gz	UOCHWSVJPWMCLF-INIZCTEOSA-N	0	3	320.477	2.452	10	0		DEAEHN
Cc1ccc2ncnc(N[C@@H](CO)CN3CCCCC3)c2c1	ZINC000289185977	403866194	/nfs/dbraw/zinc/86/61/94/403866194.db2.gz	SLNUFZUBEGBENU-CQSZACIVSA-N	0	3	300.406	2.197	10	0		DEAEHN
Cn1cnc(CCNCc2cc(O)ccc2Br)c1	ZINC000315598631	404015512	/nfs/dbraw/zinc/01/55/12/404015512.db2.gz	PHOWRAJEHXPHQR-UHFFFAOYSA-N	0	3	310.195	2.221	10	0		DEAEHN
CC(=O)CCC(=O)N(C)c1ccc(OCCN2CCCC2)cc1	ZINC000337515009	404071238	/nfs/dbraw/zinc/07/12/38/404071238.db2.gz	HXNFEJZQKMFPDP-UHFFFAOYSA-N	0	3	318.417	2.493	10	0		DEAEHN
Cc1noc2nc(C)cc(C(=O)N(C)[C@H]3CN4CCC3CC4)c12	ZINC000329373481	404317939	/nfs/dbraw/zinc/31/79/39/404317939.db2.gz	NAMAXFMXQOPUTG-AWEZNQCLSA-N	0	3	314.389	2.006	10	0		DEAEHN
CC/C=C\CCN1CCN(c2nc(C)nc3c2cnn3C)CC1	ZINC000342205083	404441063	/nfs/dbraw/zinc/44/10/63/404441063.db2.gz	PQSIFQHVVMMBOI-WAYWQWQTSA-N	0	3	314.437	2.150	10	0		DEAEHN
CC1=CCN(CCNC(=O)N(CCN(C)C)C2CCCC2)CC1	ZINC000358690510	404771517	/nfs/dbraw/zinc/77/15/17/404771517.db2.gz	XTEJWWFWRREAGX-UHFFFAOYSA-N	0	3	322.497	2.154	10	0		DEAEHN
C[C@H](CN(C)C)NC(=O)N1CC2(CCOCC2)c2ccccc21	ZINC000358503348	404765319	/nfs/dbraw/zinc/76/53/19/404765319.db2.gz	QCUJCHFOADZMGD-CQSZACIVSA-N	0	3	317.433	2.215	10	0		DEAEHN
OCCN[C@H](Cc1ccc(F)cc1)[C@H]1COc2ccccc2O1	ZINC000366444579	404792322	/nfs/dbraw/zinc/79/23/22/404792322.db2.gz	RVLITGUENMARMJ-CRAIPNDOSA-N	0	3	317.360	2.159	10	0		DEAEHN
CCOC(=O)[C@@H]1CN([C@H](C)c2cccc(F)c2)CC12COC2	ZINC000451140292	404877369	/nfs/dbraw/zinc/87/73/69/404877369.db2.gz	TYTWANYZECUOLW-DOMZBBRYSA-N	0	3	307.365	2.398	10	0		DEAEHN
CN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)c1ncccc1N	ZINC000382721645	405031825	/nfs/dbraw/zinc/03/18/25/405031825.db2.gz	NIJTWJZBGSZTLX-MRXNPFEDSA-N	0	3	324.428	2.258	10	0		DEAEHN
COc1ccc(Br)c(CNC[C@@H]2[C@H]3COC[C@H]32)c1	ZINC000367575402	405089645	/nfs/dbraw/zinc/08/96/45/405089645.db2.gz	MNYYNROGWILEQM-XYYAHUGASA-N	0	3	312.207	2.440	10	0		DEAEHN
COCCCN(C)CCNC(=O)C[C@@H]1CCOc2ccccc21	ZINC000152437847	292334082	/nfs/dbraw/zinc/33/40/82/292334082.db2.gz	LWGHWKUKHUZVTP-HNNXBMFYSA-N	0	3	320.433	2.027	10	0		DEAEHN
Cn1nnc2cc(CN3CC[C@H](C(C)(C)C)[C@@H](O)C3)ccc21	ZINC000408198538	405136774	/nfs/dbraw/zinc/13/67/74/405136774.db2.gz	NHMZWAPSHPLXHM-BBRMVZONSA-N	0	3	302.422	2.197	10	0		DEAEHN
C[C@H](CCc1cccc(F)c1)C(=O)NCCNc1ccncc1	ZINC000439042370	405263829	/nfs/dbraw/zinc/26/38/29/405263829.db2.gz	UDBPMQPTTZOOEJ-CQSZACIVSA-N	0	3	315.392	2.440	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)N[C@H](C)CN1CCCCC1	ZINC000454620508	405372998	/nfs/dbraw/zinc/37/29/98/405372998.db2.gz	OSZLSOQFUHFUQF-GFCCVEGCSA-N	0	3	308.426	2.219	10	0		DEAEHN
O=C(NCCNc1ccncc1)Nc1ccccc1OCCF	ZINC000455724529	405446610	/nfs/dbraw/zinc/44/66/10/405446610.db2.gz	PEDKKGBMTRDPJN-UHFFFAOYSA-N	0	3	318.352	2.085	10	0		DEAEHN
c1c2cccnc2oc1CN1CCN(CC2CCOCC2)CC1	ZINC000449033181	405508041	/nfs/dbraw/zinc/50/80/41/405508041.db2.gz	CMQVNCIOMXBRAP-UHFFFAOYSA-N	0	3	315.417	2.372	10	0		DEAEHN
CCOC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(-c2cc[nH]n2)o1	ZINC000449581772	405625537	/nfs/dbraw/zinc/62/55/37/405625537.db2.gz	BVXWXMOKSWNNLG-OLZOCXBDSA-N	0	3	303.362	2.491	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)N(C)[C@H]1CCN(C(C)C)C1	ZINC000458810918	405603098	/nfs/dbraw/zinc/60/30/98/405603098.db2.gz	AUNNYNGTUKSFOD-ZDUSSCGKSA-N	0	3	308.426	2.170	10	0		DEAEHN
CSCC1CCC(NC(=O)NCCNc2ccncc2)CC1	ZINC000458934108	405661955	/nfs/dbraw/zinc/66/19/55/405661955.db2.gz	RRHBXMAYQNNMSN-UHFFFAOYSA-N	0	3	322.478	2.136	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N[C@H]2C[C@@H](N3CCCC3)C2)c1C	ZINC000636092233	405732660	/nfs/dbraw/zinc/73/26/60/405732660.db2.gz	REZZOLAAPFSUMN-OKILXGFUSA-N	0	3	303.406	2.191	10	0		DEAEHN
OC[C@H](CNCc1ccc(-c2cc[nH]n2)o1)Cc1ccco1	ZINC000559477838	405740580	/nfs/dbraw/zinc/74/05/80/405740580.db2.gz	GOEIHCPOROUWNI-LBPRGKRZSA-N	0	3	301.346	2.204	10	0		DEAEHN
CO[C@H]1C[C@@H](CN(C)C(=O)c2cc(Cl)c(Cl)[nH]2)N(C)C1	ZINC000583621101	405777687	/nfs/dbraw/zinc/77/76/87/405777687.db2.gz	HFPMWKYOIBXEQO-IUCAKERBSA-N	0	3	320.220	2.113	10	0		DEAEHN
CN(C)CC(C)(C)NC(=O)CCc1cc2ccccc2[nH]c1=O	ZINC000457241191	405764845	/nfs/dbraw/zinc/76/48/45/405764845.db2.gz	OVCBRPQJXGQSIQ-UHFFFAOYSA-N	0	3	315.417	2.329	10	0		DEAEHN
COc1ccc([C@@](C)(O)[C@H]2CCCN2Cc2cncn2C)cc1	ZINC000583615577	405774131	/nfs/dbraw/zinc/77/41/31/405774131.db2.gz	MGQURCSLMMMTBD-QZTJIDSGSA-N	0	3	315.417	2.301	10	0		DEAEHN
COc1ccc([C@@](C)(O)[C@@H]2CCCN2Cc2cncn2C)cc1	ZINC000583615579	405775152	/nfs/dbraw/zinc/77/51/52/405775152.db2.gz	MGQURCSLMMMTBD-ZWKOTPCHSA-N	0	3	315.417	2.301	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N[C@@H](C)CN2CCCCC2)c1	ZINC000457430747	405840182	/nfs/dbraw/zinc/84/01/82/405840182.db2.gz	BGQSXRICBFOWBX-AWEZNQCLSA-N	0	3	318.417	2.386	10	0		DEAEHN
c1cc(CNCCC[C@@H]2CCO2)c(OC[C@H]2CCOC2)cn1	ZINC000639184141	405953279	/nfs/dbraw/zinc/95/32/79/405953279.db2.gz	ISGLWNYOMRRBDT-GOEBONIOSA-N	0	3	306.406	2.156	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)c1	ZINC000457590295	405910241	/nfs/dbraw/zinc/91/02/41/405910241.db2.gz	FFRVYNLOPLTGMR-BBRMVZONSA-N	0	3	318.417	2.194	10	0		DEAEHN
c1nc(CNC[C@@H]2CC23CCSCC3)cc2c1OCCO2	ZINC000639274013	406014279	/nfs/dbraw/zinc/01/42/79/406014279.db2.gz	ULOBJZZDKJCXQH-LBPRGKRZSA-N	0	3	306.431	2.476	10	0		DEAEHN
c1cnc(N[C@@H]2CCN(Cc3ccc4nccnc4c3)C2)nc1	ZINC000639280830	406019869	/nfs/dbraw/zinc/01/98/69/406019869.db2.gz	FUASAWHTGNLAPF-CQSZACIVSA-N	0	3	306.373	2.106	10	0		DEAEHN
COc1cc(CN[C@H]2CCCN(Cc3ccccc3)C2)on1	ZINC000639325401	406045532	/nfs/dbraw/zinc/04/55/32/406045532.db2.gz	XEMHRQDVHPCNMK-HNNXBMFYSA-N	0	3	301.390	2.437	10	0		DEAEHN
c1nc2n(n1)[C@@H](CN1CC=C(c3c[nH]c4ncccc34)CC1)CC2	ZINC000639521561	406127335	/nfs/dbraw/zinc/12/73/35/406127335.db2.gz	FOUOVWRBJLBJRR-CQSZACIVSA-N	0	3	320.400	2.431	10	0		DEAEHN
O=C1[C@H](NCc2ccc3[nH]cnc3c2)CCN1c1ccccc1	ZINC000518302355	406134096	/nfs/dbraw/zinc/13/40/96/406134096.db2.gz	AEPSGCQSIPSEME-MRXNPFEDSA-N	0	3	306.369	2.458	10	0		DEAEHN
O=C1[C@H](NCc2ccc3nc[nH]c3c2)CCN1c1ccccc1	ZINC000518302355	406134097	/nfs/dbraw/zinc/13/40/97/406134097.db2.gz	AEPSGCQSIPSEME-MRXNPFEDSA-N	0	3	306.369	2.458	10	0		DEAEHN
CO[C@H]1CC[C@H](NC(=O)Nc2cccc(OCCN(C)C)c2)C1	ZINC000472339895	406138701	/nfs/dbraw/zinc/13/87/01/406138701.db2.gz	MNJJYAODFPRELQ-GJZGRUSLSA-N	0	3	321.421	2.316	10	0		DEAEHN
CO[C@@H]1CC[C@@H](NC(=O)Nc2cccc(OCCN(C)C)c2)C1	ZINC000472339897	406138921	/nfs/dbraw/zinc/13/89/21/406138921.db2.gz	MNJJYAODFPRELQ-HUUCEWRRSA-N	0	3	321.421	2.316	10	0		DEAEHN
c1cc(-c2noc(COc3ccc4c(c3)OCCNC4)n2)co1	ZINC000518517586	406142380	/nfs/dbraw/zinc/14/23/80/406142380.db2.gz	CQVOQTJJKFYJHM-UHFFFAOYSA-N	0	3	313.313	2.391	10	0		DEAEHN
O=C(NCCNc1ccncc1)NC[C@@H]1CCCc2ccccc21	ZINC000535259931	406217010	/nfs/dbraw/zinc/21/70/10/406217010.db2.gz	GAPZRVRZZRYBHR-INIZCTEOSA-N	0	3	324.428	2.335	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@@H]1CCC[C@@H]2OCC[C@@H]21	ZINC000487322192	406223997	/nfs/dbraw/zinc/22/39/97/406223997.db2.gz	PWVCPHWMUZFHCY-XWIASGKRSA-N	0	3	314.227	2.230	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N1CCCC(C)(C)C1	ZINC000637938705	406486955	/nfs/dbraw/zinc/48/69/55/406486955.db2.gz	RQQLBLYXSLKFOI-MRXNPFEDSA-N	0	3	303.450	2.094	10	0		DEAEHN
CC(=O)N(C)c1ccccc1NC(=O)[C@H]1CNCc2ccccc21	ZINC000570925447	406456518	/nfs/dbraw/zinc/45/65/18/406456518.db2.gz	ZYIIZSIXCCOFPL-INIZCTEOSA-N	0	3	323.396	2.495	10	0		DEAEHN
C[C@@H](N(C)C(=O)[C@@H](N)CN(C)Cc1ccccc1)C1(C)CC1	ZINC000638042284	406540009	/nfs/dbraw/zinc/54/00/09/406540009.db2.gz	QFBXULHXCZBLAX-ZBFHGGJFSA-N	0	3	303.450	2.093	10	0		DEAEHN
C[C@H](CCC1CC1)NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638308744	406689241	/nfs/dbraw/zinc/68/92/41/406689241.db2.gz	XHIDMJGZBQSAMY-PBHICJAKSA-N	0	3	303.450	2.141	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NC(C)(C1CC1)C1CC1	ZINC000638423669	406765432	/nfs/dbraw/zinc/76/54/32/406765432.db2.gz	CJTNTOOGYFOLKK-QGZVFWFLSA-N	0	3	315.461	2.141	10	0		DEAEHN
C[C@@H](N)C(=O)Nc1nnc(C23CC4CC(CC(C4)C2)C3)s1	ZINC000132614183	286907601	/nfs/dbraw/zinc/90/76/01/286907601.db2.gz	GAMXUHXJFSKTDR-HALIQOIHSA-N	0	3	306.435	2.292	10	0		DEAEHN
C[C@@H](NC[C@H](C)CS(C)(=O)=O)c1ccccc1-n1cccn1	ZINC000183164929	287035241	/nfs/dbraw/zinc/03/52/41/287035241.db2.gz	SIACWIIYCNHBMW-UONOGXRCSA-N	0	3	321.446	2.204	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)[C@@H](N)c1cccs1)c1ccccc1	ZINC000130565239	196091613	/nfs/dbraw/zinc/09/16/13/196091613.db2.gz	UJEZUSXTBUCONO-HIFRSBDPSA-N	0	3	303.431	2.167	10	0		DEAEHN
COc1ccccc1[C@@H](O)CN[C@H]1CCCc2c1cnn2C	ZINC000130602407	196094430	/nfs/dbraw/zinc/09/44/30/196094430.db2.gz	YZYREVJJBJGWAO-HOCLYGCPSA-N	0	3	301.390	2.129	10	0		DEAEHN
CCN[C@H](Cc1ccn(C)n1)c1ccc(Br)cn1	ZINC000130897425	196120887	/nfs/dbraw/zinc/12/08/87/196120887.db2.gz	YAUQKPNZLDRXJY-CYBMUJFWSA-N	0	3	309.211	2.471	10	0		DEAEHN
CN[C@@H](C)c1cccc(S(=O)(=O)NCC[C@@H](C)SC)c1	ZINC000130940902	196125115	/nfs/dbraw/zinc/12/51/15/196125115.db2.gz	YOIZZYMGZMGCDB-NEPJUHHUSA-N	0	3	316.492	2.387	10	0		DEAEHN
CCN[C@@H](CCCS(C)(=O)=O)c1cc(OC)ccc1OC	ZINC000131186925	196147636	/nfs/dbraw/zinc/14/76/36/196147636.db2.gz	ZFDMNZUFZDTAOM-AWEZNQCLSA-N	0	3	315.435	2.179	10	0		DEAEHN
Cc1ccc(S(=O)(=O)NCCCCC(F)(F)F)cc1CN	ZINC000131249068	196152977	/nfs/dbraw/zinc/15/29/77/196152977.db2.gz	XRTKFBSMEUGLFL-UHFFFAOYSA-N	0	3	324.368	2.465	10	0		DEAEHN
CCNCCS(=O)(=O)Nc1cccc(C)c1Br	ZINC000131724739	196194134	/nfs/dbraw/zinc/19/41/34/196194134.db2.gz	JNJMFGUYOALZQN-UHFFFAOYSA-N	0	3	321.240	2.109	10	0		DEAEHN
C[C@H](c1cccs1)N(C)c1nc(N)nc(N2CCCC2)n1	ZINC000131835573	196202429	/nfs/dbraw/zinc/20/24/29/196202429.db2.gz	WJHUQNIJQGTDLW-SNVBAGLBSA-N	0	3	304.423	2.313	10	0		DEAEHN
COCCN(CCOC)[C@@H](CN)c1cccc(C(F)F)c1	ZINC000131880931	196206663	/nfs/dbraw/zinc/20/66/63/196206663.db2.gz	PYDMNCZSRPFUOR-AWEZNQCLSA-N	0	3	302.365	2.219	10	0		DEAEHN
C[C@H](NCCn1c(=O)cccc1C(F)(F)F)[C@H]1CCCO1	ZINC000132827150	196287754	/nfs/dbraw/zinc/28/77/54/196287754.db2.gz	WDGGJKOBRVVWGR-WDEREUQCSA-N	0	3	304.312	2.024	10	0		DEAEHN
CCC[C@](C)(O)c1c(Br)cnn1CCN(C)C	ZINC000132857919	196291079	/nfs/dbraw/zinc/29/10/79/196291079.db2.gz	LWJVQWGTOPHNFD-LBPRGKRZSA-N	0	3	304.232	2.215	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](NC[C@@H]1CCCS1(=O)=O)CCC2	ZINC000133952222	196348297	/nfs/dbraw/zinc/34/82/97/196348297.db2.gz	ARLAHZJULHCRIZ-HOCLYGCPSA-N	0	3	309.431	2.239	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)N2CC[C@@]3(O)CCCC[C@H]3C2)C1	ZINC000246913187	287350505	/nfs/dbraw/zinc/35/05/05/287350505.db2.gz	FXPMEHCCHPIJIM-RYRKJORJSA-N	0	3	323.481	2.055	10	0		DEAEHN
CO[C@@H](C)[C@@H](C)N[C@H](C)c1cccc(NS(C)(=O)=O)c1	ZINC000572083597	292593135	/nfs/dbraw/zinc/59/31/35/292593135.db2.gz	OVXJCGITDKOZDR-UTUOFQBUSA-N	0	3	300.424	2.132	10	0		DEAEHN
CN(C)[C@H]1CCN(c2nnc(Cc3ccc(F)cc3)s2)C1	ZINC000302082054	230085397	/nfs/dbraw/zinc/08/53/97/230085397.db2.gz	CKUNDHFPNZXQSM-ZDUSSCGKSA-N	0	3	306.410	2.408	10	0		DEAEHN
c1ccc(OC2CCC2)c(CN[C@H](C2CC2)[C@H]2CNCCO2)c1	ZINC000422915785	230276239	/nfs/dbraw/zinc/27/62/39/230276239.db2.gz	YZNPRTDMNJKRAX-RTBURBONSA-N	0	3	316.445	2.475	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)Nc2cc(F)ccc2F)c1	ZINC000105881465	424849743	/nfs/dbraw/zinc/84/97/43/424849743.db2.gz	HBWKZRRGLNRNAW-NSHDSACASA-N	0	3	308.332	2.087	10	0		DEAEHN
Cc1ccc([C@H](C)NC(=O)NC[C@@H](O)CN2CCCCC2)cc1	ZINC000194452122	424875565	/nfs/dbraw/zinc/87/55/65/424875565.db2.gz	YSEYBUCWJNIEGJ-DOTOQJQBSA-N	0	3	319.449	2.202	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)COc2ccc(F)cc2Cl)C1	ZINC000194635345	424877604	/nfs/dbraw/zinc/87/76/04/424877604.db2.gz	LOYVJLONCQQKBH-LBPRGKRZSA-N	0	3	314.788	2.458	10	0		DEAEHN
Cn1cc(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)cn1	ZINC000153798330	424859851	/nfs/dbraw/zinc/85/98/51/424859851.db2.gz	YNJDFPAKPLPJPK-GOSISDBHSA-N	0	3	312.417	2.205	10	0		DEAEHN
Cc1nc(N)nc(N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)n1	ZINC000379686929	424907567	/nfs/dbraw/zinc/90/75/67/424907567.db2.gz	BYFJHDNUQYRWBW-WFASDCNBSA-N	0	3	312.421	2.227	10	0		DEAEHN
O[C@]1(CCNCc2cc(F)ccc2Br)CCOC1	ZINC000404188292	424926024	/nfs/dbraw/zinc/92/60/24/424926024.db2.gz	DYXFIJOBVDQRNR-CYBMUJFWSA-N	0	3	318.186	2.219	10	0		DEAEHN
C[C@H](CNC(=O)c1nscc1Br)N1CCCC1	ZINC000404888753	424929693	/nfs/dbraw/zinc/92/96/93/424929693.db2.gz	HGGUUJWVRULUIG-MRVPVSSYSA-N	0	3	318.240	2.120	10	0		DEAEHN
C[C@@H](NC(=O)N1CCC[C@@H]1CN1CCCCC1)c1csnn1	ZINC000334119641	269021664	/nfs/dbraw/zinc/02/16/64/269021664.db2.gz	KFEPXNKOOPXDGH-CHWSQXEVSA-N	0	3	323.466	2.259	10	0		DEAEHN
CCc1nc(C(C)(C)NC(=O)c2cccc(CN(C)C)c2)no1	ZINC000443369465	269136813	/nfs/dbraw/zinc/13/68/13/269136813.db2.gz	LIAFIPOGYFATBK-UHFFFAOYSA-N	0	3	316.405	2.359	10	0		DEAEHN
C[C@@H](O)CN1CCN(c2ncnc3cc(Cl)ccc32)C[C@H]1C	ZINC000264353953	274272957	/nfs/dbraw/zinc/27/29/57/274272957.db2.gz	STGBAFBBYNQXQY-VXGBXAGGSA-N	0	3	320.824	2.175	10	0		DEAEHN
Brc1cc2c(s1)CC[C@@H]2NCCn1cncn1	ZINC000293893736	275368270	/nfs/dbraw/zinc/36/82/70/275368270.db2.gz	WBSPAKXEQLEGOU-VIFPVBQESA-N	0	3	313.224	2.379	10	0		DEAEHN
CC(C)c1nn(C)cc1C(=O)N1CCN(C2CCC2)C[C@@H](C)C1	ZINC000344700563	276072086	/nfs/dbraw/zinc/07/20/86/276072086.db2.gz	PHPIBDTVDYOHSU-CQSZACIVSA-N	0	3	318.465	2.490	10	0		DEAEHN
CC1(C)C[C@H](NCC(=O)N2CCO[C@@H]3CCCC[C@@H]32)C(C)(C)O1	ZINC000132459376	276148199	/nfs/dbraw/zinc/14/81/99/276148199.db2.gz	XOQBRHQNYWVGNF-ZNMIVQPWSA-N	0	3	324.465	2.092	10	0		DEAEHN
CCN1CCC[C@@H](N[C@@H](C)c2cnc3cc(C)nn3c2C)C1	ZINC000194378985	276167709	/nfs/dbraw/zinc/16/77/09/276167709.db2.gz	PULRBHDLZPJKTQ-DZGCQCFKSA-N	0	3	301.438	2.481	10	0		DEAEHN
CC[C@@H](NCCc1nc(C)no1)c1ccc2c(c1)OCCO2	ZINC000089518342	276436283	/nfs/dbraw/zinc/43/62/83/276436283.db2.gz	HXJXTCLOTRACAX-CYBMUJFWSA-N	0	3	303.362	2.433	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)[C@@H]2COc3ccc(Cl)cc3C2)C1	ZINC000170858596	276795752	/nfs/dbraw/zinc/79/57/52/276795752.db2.gz	DQJGJVKASWPPOA-JSGCOSHPSA-N	0	3	308.809	2.054	10	0		DEAEHN
CN(C)[C@H]1Cc2ccccc2N(C(=O)/C=C/c2ccncn2)C1	ZINC000183874808	276878187	/nfs/dbraw/zinc/87/81/87/276878187.db2.gz	BEFPAPNJJMYZSP-WAVCKPEOSA-N	0	3	308.385	2.009	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(C(=O)NC3CCCCC3)C2)CC1	ZINC000093886167	277110302	/nfs/dbraw/zinc/11/03/02/277110302.db2.gz	MOPGPMSWDMMBLU-QGZVFWFLSA-N	0	3	322.497	2.131	10	0		DEAEHN
COC[C@H](C)C(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1	ZINC000186054250	277257009	/nfs/dbraw/zinc/25/70/09/277257009.db2.gz	OWYZNLRTLHPSKR-YOEHRIQHSA-N	0	3	304.434	2.296	10	0		DEAEHN
COc1cccc([C@H](C)N2C[C@H](N3CCOCC3)[C@@H](C)C2)c1	ZINC000177214204	278021670	/nfs/dbraw/zinc/02/16/70/278021670.db2.gz	YDPHHQPQKJVMNE-MPGHIAIKSA-N	0	3	304.434	2.409	10	0		DEAEHN
C[C@H](CNC(=O)N1CC[C@@H](C(F)(F)F)[C@H]1C)N(C)C1CC1	ZINC000471823019	278200568	/nfs/dbraw/zinc/20/05/68/278200568.db2.gz	CKKPXMUUACKDRP-CKYFFXLPSA-N	0	3	307.360	2.451	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cccc(F)n1	ZINC000271873983	278241581	/nfs/dbraw/zinc/24/15/81/278241581.db2.gz	YQYYYTTVXHNEHZ-ZDUSSCGKSA-N	0	3	301.365	2.471	10	0		DEAEHN
C[C@H](N[C@H]1CCCCC[C@H]1O)c1ccc(S(C)(=O)=O)cc1	ZINC000252884803	278280707	/nfs/dbraw/zinc/28/07/07/278280707.db2.gz	WZFADEFKDCBMKU-VBNZEHGJSA-N	0	3	311.447	2.434	10	0		DEAEHN
CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000251552699	279064416	/nfs/dbraw/zinc/06/44/16/279064416.db2.gz	HTVDMMMZJAXPNA-IKGGRYGDSA-N	0	3	321.465	2.236	10	0		DEAEHN
C[C@H](C(=O)N1CCCc2ccccc21)N1CCN2CCC[C@@H]2C1	ZINC000178625940	279197177	/nfs/dbraw/zinc/19/71/77/279197177.db2.gz	DCQCTJWPGQFQDX-NVXWUHKLSA-N	0	3	313.445	2.134	10	0		DEAEHN
CCN(CCNC(=O)N[C@H]1CCOc2ccccc21)C1CC1	ZINC000171154070	279202204	/nfs/dbraw/zinc/20/22/04/279202204.db2.gz	PCOIRCDFDYWSBB-HNNXBMFYSA-N	0	3	303.406	2.294	10	0		DEAEHN
C[C@H](CNC(=O)N(C)C[C@H]1CCCO1)N(C)Cc1ccccc1	ZINC000111875827	279328175	/nfs/dbraw/zinc/32/81/75/279328175.db2.gz	DYWWVGHMCMHJDF-NVXWUHKLSA-N	0	3	319.449	2.327	10	0		DEAEHN
C[C@H](O)CCCN[C@@H](Cn1ccccc1=O)c1ccccc1	ZINC000450921699	279558457	/nfs/dbraw/zinc/55/84/57/279558457.db2.gz	JPIIWGXYMXPNGU-RDJZCZTQSA-N	0	3	300.402	2.340	10	0		DEAEHN
CC(C)[C@@H](Cc1ccccc1)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000123041235	279868545	/nfs/dbraw/zinc/86/85/45/279868545.db2.gz	UTULDOPEFGURNY-QZTJIDSGSA-N	0	3	318.461	2.290	10	0		DEAEHN
CC[C@@H](O)CN1CCN(C[C@H](C)c2ccc(OC)cc2)CC1	ZINC000180163589	280207912	/nfs/dbraw/zinc/20/79/12/280207912.db2.gz	GHJZZDSKBVDTOA-DOTOQJQBSA-N	0	3	306.450	2.187	10	0		DEAEHN
Cc1ccc2c(c1)[C@@H](N[C@@H]1CCN(C3CCOCC3)C1=O)CC2	ZINC000358185241	281096304	/nfs/dbraw/zinc/09/63/04/281096304.db2.gz	XZPOZMJPOOOSNO-ZWKOTPCHSA-N	0	3	314.429	2.352	10	0		DEAEHN
Cc1cccc(C(C)C)c1NC(=O)C(=O)N1CC[C@H](N(C)C)C1	ZINC000170845123	281198152	/nfs/dbraw/zinc/19/81/52/281198152.db2.gz	MGLAZTSVZATLRC-AWEZNQCLSA-N	0	3	317.433	2.219	10	0		DEAEHN
Cc1csc2c1ncnc2NC[C@H](O)CN1CCCCC1	ZINC000192496290	281747008	/nfs/dbraw/zinc/74/70/08/281747008.db2.gz	LAHGZHIDEOEQTF-LBPRGKRZSA-N	0	3	306.435	2.258	10	0		DEAEHN
CCc1cc(C)c(C(=O)N(CCN(C)C)C[C@H]2CCCO2)o1	ZINC000127396441	281857043	/nfs/dbraw/zinc/85/70/43/281857043.db2.gz	ZIKNEEPUAVUHAG-OAHLLOKOSA-N	0	3	308.422	2.333	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@H]1C(=O)N(C)C[C@@H]1CCCN(C)C1	ZINC000117806910	289086385	/nfs/dbraw/zinc/08/63/85/289086385.db2.gz	GYDDULAJABNCQX-CKEIUWERSA-N	0	3	302.418	2.351	10	0		DEAEHN
CO[C@H](C)[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248888411	294328725	/nfs/dbraw/zinc/32/87/25/294328725.db2.gz	YHDMYIIVLVFHGJ-XNISGKROSA-N	0	3	305.422	2.154	10	0		DEAEHN
C[C@H]1CN(CCN2CCC[C@H]2c2ccc3c(c2)OCO3)CCO1	ZINC000249020479	300259623	/nfs/dbraw/zinc/25/96/23/300259623.db2.gz	KAWCXMUBMRNNQT-HOCLYGCPSA-N	0	3	318.417	2.273	10	0		DEAEHN
Cn1nccc1[C@H]1CCCCN1C(=O)C1CCN(C2CC2)CC1	ZINC000370687670	303086441	/nfs/dbraw/zinc/08/64/41/303086441.db2.gz	DHGFLUSRAWGAJA-QGZVFWFLSA-N	0	3	316.449	2.348	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2ccc(F)c(F)c2)C1	ZINC000188892434	333057866	/nfs/dbraw/zinc/05/78/66/333057866.db2.gz	XTCPNIGIMIPLEK-ZDUSSCGKSA-N	0	3	311.376	2.291	10	0		DEAEHN
C[C@@H](NCCOCC(F)(F)F)c1ccc(-n2ccnn2)cc1	ZINC000182006332	333174334	/nfs/dbraw/zinc/17/43/34/333174334.db2.gz	MCQJPLGNZKVMQX-LLVKDONJSA-N	0	3	314.311	2.497	10	0		DEAEHN
OC1CCN(CCCC2(c3ccc(F)cc3)OCCO2)CC1	ZINC000584636792	337379464	/nfs/dbraw/zinc/37/94/64/337379464.db2.gz	DLLRHKHMDMRZFE-UHFFFAOYSA-N	0	3	309.381	2.262	10	0		DEAEHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)c1cn2ccnc2s1	ZINC000248941213	533830549	/nfs/dbraw/zinc/83/05/49/533830549.db2.gz	OAEDKGXEYGXAQJ-NEPJUHHUSA-N	0	3	306.435	2.246	10	0		DEAEHN
Cc1c(Cl)cccc1C(=O)NC[C@H](O)CN1CCCCC1	ZINC000194778413	533877536	/nfs/dbraw/zinc/87/75/36/533877536.db2.gz	WHDWEZPTOYQKIC-ZDUSSCGKSA-N	0	3	310.825	2.225	10	0		DEAEHN
COC(=O)c1ccccc1OCCN1[C@H](C)CC(O)C[C@H]1C	ZINC000191153799	534294361	/nfs/dbraw/zinc/29/43/61/534294361.db2.gz	BUYZTFIBOCJVIZ-CHWSQXEVSA-N	0	3	307.390	2.086	10	0		DEAEHN
Cc1ccc2nccc(N3CCC(NS(C)(=O)=O)CC3)c2c1	ZINC000302143661	534521742	/nfs/dbraw/zinc/52/17/42/534521742.db2.gz	GJKWLZVLJIYVOJ-UHFFFAOYSA-N	0	3	319.430	2.061	10	0		DEAEHN
CCCC[C@@H](COC)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000157119782	521058511	/nfs/dbraw/zinc/05/85/11/521058511.db2.gz	GLJDHEYNJPWDFH-HOCLYGCPSA-N	0	3	305.422	2.372	10	0		DEAEHN
CCCC[C@@H](NCCn1cc(C)cn1)C(=O)Nc1cc(C)on1	ZINC000105881593	521099663	/nfs/dbraw/zinc/09/96/63/521099663.db2.gz	HDQPXOYOTQVSHJ-CQSZACIVSA-N	0	3	319.409	2.275	10	0		DEAEHN
CCCc1cc(NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)n(C)n1	ZINC000246390916	521372541	/nfs/dbraw/zinc/37/25/41/521372541.db2.gz	KXAQISZNWICVFF-JSGCOSHPSA-N	0	3	307.442	2.319	10	0		DEAEHN
CCN1CC[C@H](CNC(=O)CCC(=O)c2ccc(F)c(F)c2)C1	ZINC000124714437	521716230	/nfs/dbraw/zinc/71/62/30/521716230.db2.gz	UUTKNICXRKTCMF-GFCCVEGCSA-N	0	3	324.371	2.386	10	0		DEAEHN
CCc1nc(CNC(=O)NCCN2CCCC[C@@H]2C)cs1	ZINC000107721635	522332921	/nfs/dbraw/zinc/33/29/21/522332921.db2.gz	IIAKRCDSUZCRPH-LBPRGKRZSA-N	0	3	310.467	2.379	10	0		DEAEHN
COC[C@](C)(CCO)NCCOc1ccccc1C(F)(F)F	ZINC000132548852	522880440	/nfs/dbraw/zinc/88/04/40/522880440.db2.gz	IAVFOXYQJZDVFO-AWEZNQCLSA-N	0	3	321.339	2.461	10	0		DEAEHN
COCCN1CCC[C@H]1CN[C@@H](C)c1ccc(OC)cc1OC	ZINC000163420538	523835285	/nfs/dbraw/zinc/83/52/85/523835285.db2.gz	UJRWBTRGDKFIAA-GJZGRUSLSA-N	0	3	322.449	2.465	10	0		DEAEHN
COc1ccccc1NCC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000127557119	524634825	/nfs/dbraw/zinc/63/48/25/524634825.db2.gz	IYFWGXPYUGFDKU-UONOGXRCSA-N	0	3	305.422	2.048	10	0		DEAEHN
COc1ccc([C@@H](C)NCCn2ccnc2)cc1NC(C)=O	ZINC000155720529	525151589	/nfs/dbraw/zinc/15/15/89/525151589.db2.gz	IDAVQRTWYJAHRX-GFCCVEGCSA-N	0	3	302.378	2.201	10	0		DEAEHN
Cc1nnc(CCCN2CC[C@@H](n3cnc4c3CCCC4)C2)o1	ZINC000299741915	534866296	/nfs/dbraw/zinc/86/62/96/534866296.db2.gz	HSXKKPJJKYYMMC-CQSZACIVSA-N	0	3	315.421	2.333	10	0		DEAEHN
C=Cn1cc(CNCc2ccc(CN3CCOCC3)cc2)cn1	ZINC000447847648	526283416	/nfs/dbraw/zinc/28/34/16/526283416.db2.gz	GUUWFFLUAHAYQI-UHFFFAOYSA-N	0	3	312.417	2.106	10	0		DEAEHN
CC(C)C(CNC(=O)NC[C@H](O)CN1CCCCC1)C(C)C	ZINC000194356216	527582915	/nfs/dbraw/zinc/58/29/15/527582915.db2.gz	GHTNRXXFEASKHM-HNNXBMFYSA-N	0	3	313.486	2.061	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@H](C)C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000247465778	527643635	/nfs/dbraw/zinc/64/36/35/527643635.db2.gz	UUNBJHLDKNLTNT-AHIWAGSCSA-N	0	3	320.481	2.060	10	0		DEAEHN
CCN1CCC[C@H](Nc2ccc3nnc(C(C)(C)C)n3n2)C1	ZINC000302569705	529092089	/nfs/dbraw/zinc/09/20/89/529092089.db2.gz	OXOQILHTRCZWPF-LBPRGKRZSA-N	0	3	302.426	2.318	10	0		DEAEHN
CC(C)[C@H]1C[C@H](NCc2cccc(S(C)(=O)=O)c2)CCO1	ZINC000449251209	535264458	/nfs/dbraw/zinc/26/44/58/535264458.db2.gz	NWKWUYGHPLIQHE-GDBMZVCRSA-N	0	3	311.447	2.383	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)NCCN1CC=CCC1)CC2	ZINC000373624681	535382646	/nfs/dbraw/zinc/38/26/46/535382646.db2.gz	PLUGLOWKWDGOJM-CQSZACIVSA-N	0	3	316.449	2.016	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NCCN1CC=CCC1)C2	ZINC000373624681	535382647	/nfs/dbraw/zinc/38/26/47/535382647.db2.gz	PLUGLOWKWDGOJM-CQSZACIVSA-N	0	3	316.449	2.016	10	0		DEAEHN
CCO[C@@H]1C[C@](N)(C(=O)N[C@H]2C[C@@H]2c2ccccc2)C1(C)C	ZINC000262541427	535535567	/nfs/dbraw/zinc/53/55/67/535535567.db2.gz	RDSZMKZWMWOVQX-FSZRXZPDSA-N	0	3	302.418	2.191	10	0		DEAEHN
CCc1noc2ncc(C(=O)N(C)[C@H]3CCN(C)[C@@H](C)C3)cc12	ZINC000247382103	535901548	/nfs/dbraw/zinc/90/15/48/535901548.db2.gz	LLWNWRPQFYWKIG-AAEUAGOBSA-N	0	3	316.405	2.340	10	0		DEAEHN
COc1ccc(C(=O)N2CC[C@@H](N(C)C)C2)c(OC(F)F)c1	ZINC000191173374	536731640	/nfs/dbraw/zinc/73/16/40/536731640.db2.gz	GZLZNDUNXJCFJQ-SNVBAGLBSA-N	0	3	314.332	2.073	10	0		DEAEHN
COC(=O)[C@H](NC1CCN(Cc2ccc(F)cc2)CC1)C1CC1	ZINC000358834005	536732860	/nfs/dbraw/zinc/73/28/60/536732860.db2.gz	OIBPDBZXMFWHSD-QGZVFWFLSA-N	0	3	320.408	2.331	10	0		DEAEHN
CO[C@@H]1CN([C@@H](C)C(=O)N(C)Cc2ccccc2)CC[C@H]1C	ZINC000252059675	536737624	/nfs/dbraw/zinc/73/76/24/536737624.db2.gz	ZQLJPTHFNGKEGJ-HLLBOEOZSA-N	0	3	304.434	2.390	10	0		DEAEHN
CC(C)(C)OC(=O)NC1CCC2(CC1)NCCc1nc[nH]c12	ZINC000724100056	563496512	/nfs/dbraw/zinc/49/65/12/563496512.db2.gz	LNPUJBHUCGOTJA-UHFFFAOYSA-N	0	3	306.410	2.218	10	0		DEAEHN
CN1CCN([C@@]2(C)CCCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000685952326	568422154	/nfs/dbraw/zinc/42/21/54/568422154.db2.gz	GDIRCOGGYIWCCT-KRWDZBQOSA-N	0	3	311.470	2.414	10	0		DEAEHN
CCC[C@H]1CC(=O)N(CN2CCC[C@@H]2Cn2ccnc2C)C1	ZINC000176083419	624622150	/nfs/dbraw/zinc/62/21/50/624622150.db2.gz	IBYGZNRGQYFWGE-JKSUJKDBSA-N	0	3	304.438	2.262	10	0		DEAEHN
O=c1[nH]c2ccccc2cc1CN[C@H]1CCO[C@@H]1c1cc[nH]n1	ZINC000888077038	625054272	/nfs/dbraw/zinc/05/42/72/625054272.db2.gz	FLIHPFFFKJRRHF-HOCLYGCPSA-N	0	3	310.357	2.283	10	0		DEAEHN
CN(CCNS(=O)(=O)/C=C/c1ccccc1)C1CCCC1	ZINC000104755170	650717695	/nfs/dbraw/zinc/71/76/95/650717695.db2.gz	MJVLGHKHEZGNCH-SDNWHVSQSA-N	0	3	308.447	2.451	10	0		DEAEHN
CN(C)C(=O)CCCOC(=O)c1cccc(CN2CCCC2)c1	ZINC000806000622	644141116	/nfs/dbraw/zinc/14/11/16/644141116.db2.gz	ACEBBEIFZIXMHN-UHFFFAOYSA-N	0	3	318.417	2.308	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cc(Cl)c(N)cc2OC)C1	ZINC000165943406	646511260	/nfs/dbraw/zinc/51/12/60/646511260.db2.gz	OVWSRNXWIZZNCA-JTQLQIEISA-N	0	3	311.813	2.145	10	0		DEAEHN
COCC[C@H](N)C(=O)Nc1cccc(Br)c1C	ZINC000232211179	646796378	/nfs/dbraw/zinc/79/63/78/646796378.db2.gz	QQDLSMXENYEESX-JTQLQIEISA-N	0	3	301.184	2.060	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)c2cc(C)cc(C)c2)C[C@H]1C	ZINC000246696841	685134351	/nfs/dbraw/zinc/13/43/51/685134351.db2.gz	JBWJHKXRIXCOSJ-MJGOQNOKSA-N	0	3	320.477	2.379	10	0		DEAEHN
CCOCCN1CCN(C[C@@H](O)c2cc(C)cc(C)c2)C[C@@H]1C	ZINC000246696854	685134565	/nfs/dbraw/zinc/13/45/65/685134565.db2.gz	JBWJHKXRIXCOSJ-PKOBYXMFSA-N	0	3	320.477	2.379	10	0		DEAEHN
CC[C@@H]1CN(C[C@H](O)c2cc(C)cc(C)c2)CCN1C[C@H](C)O	ZINC000246797657	685136975	/nfs/dbraw/zinc/13/69/75/685136975.db2.gz	VEFCEHRBAXHPQE-UHOSZYNNSA-N	0	3	320.477	2.114	10	0		DEAEHN
Cc1cc(C)cc([C@@H](O)CN2CCN(CC(C)(C)O)[C@@H](C)C2)c1	ZINC000249431532	685179790	/nfs/dbraw/zinc/17/97/90/685179790.db2.gz	ZEWUUNZBCBDLGK-WMZOPIPTSA-N	0	3	320.477	2.114	10	0		DEAEHN
FC(F)(F)[C@@H]1CC[C@H](CN2CCC[C@@H](C3OCCO3)C2)O1	ZINC000721476228	777094734	/nfs/dbraw/zinc/09/47/34/777094734.db2.gz	LUEBMDCBRRFHFF-UTUOFQBUSA-N	0	3	309.328	2.181	10	0		DEAEHN
C[C@](O)(CN1CCC[C@](C)(O)CC1)C(F)(F)C(F)(F)F	ZINC000724041749	777228747	/nfs/dbraw/zinc/22/87/47/777228747.db2.gz	OVVRXXACHZSVGY-UWVGGRQHSA-N	0	3	305.287	2.172	10	0		DEAEHN
CO[C@]1(CN[C@H](C)c2ccc(Cl)cc2)CCS(=O)(=O)C1	ZINC000721258571	781017416	/nfs/dbraw/zinc/01/74/16/781017416.db2.gz	IDZPMQYSCJXICF-RISCZKNCSA-N	0	3	317.838	2.194	10	0		DEAEHN
Cc1ccc([C@@H](CNC(=O)N(C)CC2CC(O)C2)N(C)C)cc1	ZINC000190404173	786403294	/nfs/dbraw/zinc/40/32/94/786403294.db2.gz	WDICZNPJBWVXQK-BDVYOWHSSA-N	0	3	319.449	2.010	10	0		DEAEHN
Cc1nccnc1[C@H](C)NCC1CN(C(=O)OC(C)(C)C)C1	ZINC000397637161	790207698	/nfs/dbraw/zinc/20/76/98/790207698.db2.gz	PVPKSKOPQKAIQI-LBPRGKRZSA-N	0	3	306.410	2.303	10	0		DEAEHN
C[C@H](NCc1cn(C)nc1Br)[C@@H]1CCCOC1	ZINC000712397228	792186078	/nfs/dbraw/zinc/18/60/78/792186078.db2.gz	LYHYKSXLOXNXSH-VHSXEESVSA-N	0	3	302.216	2.087	10	0		DEAEHN
C[C@@H]1C[C@@H](CNCc2cn(C)nc2Br)[C@H](C)O1	ZINC000712499160	792190125	/nfs/dbraw/zinc/19/01/25/792190125.db2.gz	WHJFOYFZWHMAAX-UTLUCORTSA-N	0	3	302.216	2.086	10	0		DEAEHN
O=S(=O)(CC1CCCCC1)N1CCNCCC12CCC2	ZINC000713203439	792216896	/nfs/dbraw/zinc/21/68/96/792216896.db2.gz	GTTJBOQPBXHENK-UHFFFAOYSA-N	0	3	300.468	2.115	10	0		DEAEHN
CCCn1cc(CN[C@@H](C)CN(C)Cc2ccccc2)nn1	ZINC000714454329	792322499	/nfs/dbraw/zinc/32/24/99/792322499.db2.gz	CRHAPSXFHABTBP-HNNXBMFYSA-N	0	3	301.438	2.298	10	0		DEAEHN
Cc1nc(CNCC2CC(NC(=O)OC(C)(C)C)C2)[nH]c1C	ZINC000715092296	792381302	/nfs/dbraw/zinc/38/13/02/792381302.db2.gz	DRSSMXJOONVADB-UHFFFAOYSA-N	0	3	308.426	2.419	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@H]1C[C@H](NCc2cnccn2)C12CCC2	ZINC000404771841	802030723	/nfs/dbraw/zinc/03/07/23/802030723.db2.gz	ZQPPVODVYYSMOD-KBPBESRZSA-N	0	3	318.421	2.402	10	0		DEAEHN
Cc1nn(C)c(Cl)c1CN[C@H]1CCCN2CCSC[C@H]12	ZINC000720509196	1085261536	/nfs/dbraw/zinc/26/15/36/1085261536.db2.gz	GXXKFWYDYQEMCG-QWHCGFSZSA-N	0	3	314.886	2.051	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-]CC[C@@H]2C[NH2+]C[C@H]2C)sc1Cl	ZINC000721027169	1085590638	/nfs/dbraw/zinc/59/06/38/1085590638.db2.gz	JHUMVMUDGRVOKU-NXEZZACHSA-N	0	3	322.883	2.234	10	0		DEAEHN
CC[C@H](NCc1cn(C)nc1Br)[C@@H]1CCOC1	ZINC000720644359	1085808245	/nfs/dbraw/zinc/80/82/45/1085808245.db2.gz	AHIJUOMQESSRFH-KOLCDFICSA-N	0	3	302.216	2.087	10	0		DEAEHN
C[C@@H]1CCC[C@@H](CNCCS(=O)(=O)C2CCCCC2)O1	ZINC000700003529	1086300963	/nfs/dbraw/zinc/30/09/63/1086300963.db2.gz	DAEPWWOVOVPISG-KGLIPLIRSA-N	0	3	303.468	2.281	10	0		DEAEHN
Cc1nn(C)cc1CNCC12CC(C1)CN2C(=O)OC(C)(C)C	ZINC000701865164	1086387620	/nfs/dbraw/zinc/38/76/20/1086387620.db2.gz	PVPRBAZCPTYPCY-UHFFFAOYSA-N	0	3	320.437	2.218	10	0		DEAEHN
COC[C@H](C)OC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1	ZINC000704424496	1086580680	/nfs/dbraw/zinc/58/06/80/1086580680.db2.gz	LXSKSDKQEQSBCM-DZKIICNBSA-N	0	3	306.406	2.411	10	0		DEAEHN
Cn1nc(Br)cc1CNC[C@H]1CCC(C)(C)CO1	ZINC000711280886	1087045807	/nfs/dbraw/zinc/04/58/07/1087045807.db2.gz	JRYLDAJYGBXWQU-LLVKDONJSA-N	0	3	316.243	2.477	10	0		DEAEHN
Cn1nc(Br)cc1CNC[C@@H]1CCC2(CCC2)O1	ZINC000711437386	1087104905	/nfs/dbraw/zinc/10/49/05/1087104905.db2.gz	KQRIRYVDHAXYGC-NSHDSACASA-N	0	3	314.227	2.374	10	0		DEAEHN
O=C(NCc1cnc(Cl)s1)[C@H]1CNCc2ccccc21	ZINC000718165168	1088394759	/nfs/dbraw/zinc/39/47/59/1088394759.db2.gz	OKOAJSBDMIENCZ-LBPRGKRZSA-N	0	3	307.806	2.300	10	0		DEAEHN
C[C@H]1[C@H](NC(=O)c2csc(Br)c2)CCN1C	ZINC000719387043	1089057488	/nfs/dbraw/zinc/05/74/88/1089057488.db2.gz	WGPYBEXFNPIERV-IONNQARKSA-N	0	3	303.225	2.333	10	0		DEAEHN
C[C@@H]1[C@@H](NC(=O)c2cc(F)ccc2Br)CCN1C	ZINC000719384266	1089078465	/nfs/dbraw/zinc/07/84/65/1089078465.db2.gz	CPDCMGVRCSDJPF-PELKAZGASA-N	0	3	315.186	2.411	10	0		DEAEHN
CCOc1cccc(CCNC(=O)N[C@@H]2CCCN(CC)C2)c1	ZINC000136522382	282087784	/nfs/dbraw/zinc/08/77/84/282087784.db2.gz	VMFNNLDAFLTHBW-MRXNPFEDSA-N	0	3	319.449	2.411	10	0		DEAEHN
Cc1nc2n(n1)CCC[C@@H]2N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2	ZINC000194111664	282101956	/nfs/dbraw/zinc/10/19/56/282101956.db2.gz	ZZDWNYZLTYTCLZ-LXTVHRRPSA-N	0	3	302.422	2.359	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)Nc2cc(F)cc(Cl)c2)CCO1	ZINC000181239756	199269800	/nfs/dbraw/zinc/26/98/00/199269800.db2.gz	HXLABUAENSYFNY-ZDUSSCGKSA-N	0	3	315.776	2.273	10	0		DEAEHN
N[C@H](CSc1ccncn1)c1ccc2c(c1)OCCCO2	ZINC000081886661	192334701	/nfs/dbraw/zinc/33/47/01/192334701.db2.gz	LYABJRQKXKSIED-GFCCVEGCSA-N	0	3	303.387	2.430	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)C2=COCCC2)c2ccccc2O1	ZINC000372783084	282122547	/nfs/dbraw/zinc/12/25/47/282122547.db2.gz	HGHKSRWWWRJMHW-CQSZACIVSA-N	0	3	302.374	2.037	10	0		DEAEHN
CC(C)N1CCN(C(=O)c2[nH]nc3ccc(Cl)cc32)CC1	ZINC000278527735	214214847	/nfs/dbraw/zinc/21/48/47/214214847.db2.gz	DKKKJSRNVQTASK-UHFFFAOYSA-N	0	3	306.797	2.383	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)C2(Cc3ccccc3)CCC2)CCO1	ZINC000134365495	282136406	/nfs/dbraw/zinc/13/64/06/282136406.db2.gz	KDCZVUCYEZBYEP-KRWDZBQOSA-N	0	3	316.445	2.188	10	0		DEAEHN
N[C@H]1CCC[C@H]1S(=O)(=O)c1ccccc1Br	ZINC000081932215	192341583	/nfs/dbraw/zinc/34/15/83/192341583.db2.gz	ZRJMOIDTZCOAHG-GXSJLCMTSA-N	0	3	304.209	2.103	10	0		DEAEHN
CCC[C@H](N)[C@@H](CC)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000081935473	192343502	/nfs/dbraw/zinc/34/35/02/192343502.db2.gz	ZAZNDKOFLTVCRH-SWLSCSKDSA-N	0	3	313.419	2.138	10	0		DEAEHN
NC(=O)[C@@](CSc1ccc(Cl)cn1)(NC1CC1)C1CC1	ZINC000079447826	185172115	/nfs/dbraw/zinc/17/21/15/185172115.db2.gz	XVUCINRFZXUOFT-AWEZNQCLSA-N	0	3	311.838	2.213	10	0		DEAEHN
NC(=O)[C@](CSc1ncccc1Cl)(NC1CC1)C1CC1	ZINC000079448603	185172160	/nfs/dbraw/zinc/17/21/60/185172160.db2.gz	FFTJBWHKFZIBKY-CQSZACIVSA-N	0	3	311.838	2.213	10	0		DEAEHN
CC(C)[C@@H]1CCCN(S(=O)(=O)C[C@@H]2CCCCN2)CC1	ZINC000079382409	185167809	/nfs/dbraw/zinc/16/78/09/185167809.db2.gz	XNLHFSFMYGAMDE-CABCVRRESA-N	0	3	302.484	2.216	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N[C@H](C)CN1CCCCC1	ZINC000079527371	185173909	/nfs/dbraw/zinc/17/39/09/185173909.db2.gz	YTESPQWANLFEQF-CQSZACIVSA-N	0	3	305.422	2.473	10	0		DEAEHN
COc1ccc(OC)c([C@@H](C)NC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000170826751	282180700	/nfs/dbraw/zinc/18/07/00/282180700.db2.gz	VCMGRPNZBSMJFR-CHWSQXEVSA-N	0	3	321.421	2.110	10	0		DEAEHN
CC1(C)CCCN(S(=O)(=O)c2ccc(F)c(CN)c2)CC1	ZINC000087657291	185229787	/nfs/dbraw/zinc/22/97/87/185229787.db2.gz	AIODTZCEPHMFDM-UHFFFAOYSA-N	0	3	314.426	2.485	10	0		DEAEHN
COC(=O)CS(=O)(=O)[C@@H]1CCCCCCCCCC[C@@H]1N	ZINC000081976046	192347659	/nfs/dbraw/zinc/34/76/59/192347659.db2.gz	OQMXAQCYJXOAEZ-UONOGXRCSA-N	0	3	319.467	2.185	10	0		DEAEHN
O=C1[C@H](NC2CC2)CCN1c1ccc(Br)c(F)c1	ZINC000088085370	185239083	/nfs/dbraw/zinc/23/90/83/185239083.db2.gz	VIGKQXSTRSBOFE-GFCCVEGCSA-N	0	3	313.170	2.446	10	0		DEAEHN
CN[C@@H]1CCOC[C@@H]1S(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000088312118	185245316	/nfs/dbraw/zinc/24/53/16/185245316.db2.gz	FWONNEGZAKHQRP-NEPJUHHUSA-N	0	3	324.229	2.144	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccccc1CN)N(C)CCC(F)(F)F	ZINC000088417636	185249242	/nfs/dbraw/zinc/24/92/42/185249242.db2.gz	GXLMTEVNDLYPMJ-JTQLQIEISA-N	0	3	303.328	2.357	10	0		DEAEHN
CCOC(=O)[C@](C)(N)CCCN1CCC[C@H](C(F)(F)F)C1	ZINC000088435287	185250461	/nfs/dbraw/zinc/25/04/61/185250461.db2.gz	HTULHEIHQIXLOT-WCQYABFASA-N	0	3	310.360	2.321	10	0		DEAEHN
C[NH2+][C@](C)(CCCCN1CCC(C(F)(F)F)CC1)C(=O)[O-]	ZINC000088435635	185250583	/nfs/dbraw/zinc/25/05/83/185250583.db2.gz	DVQGXNKLVJDNCH-CYBMUJFWSA-N	0	3	310.360	2.494	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-]C[C@H](C)CSC)o1	ZINC000088551138	185257375	/nfs/dbraw/zinc/25/73/75/185257375.db2.gz	HWFGTCVOSFBORD-NSHDSACASA-N	0	3	320.480	2.057	10	0		DEAEHN
C[N-]S(=O)(=O)c1ccc(C[NH2+][C@H]2CCCCC[C@@H]2C)o1	ZINC000088541010	185255962	/nfs/dbraw/zinc/25/59/62/185255962.db2.gz	DOTPCDUUJKIKJJ-AAEUAGOBSA-N	0	3	300.424	2.246	10	0		DEAEHN
CC(C)C[NH2+]Cc1ccc(S(=O)(=O)[N-]CC(C)(C)C)o1	ZINC000088542822	185256470	/nfs/dbraw/zinc/25/64/70/185256470.db2.gz	DBJMILONAHGRLL-UHFFFAOYSA-N	0	3	302.440	2.350	10	0		DEAEHN
O=S(=O)(N[C@@H]1CC=CCC1)c1ccc(CNC2CC2)cc1	ZINC000088749075	185263946	/nfs/dbraw/zinc/26/39/46/185263946.db2.gz	ZUOPMIOMPNAZHQ-OAHLLOKOSA-N	0	3	306.431	2.326	10	0		DEAEHN
Cc1noc2nc(C)cc(C(=O)N(C)[C@@H]3CN4CCC3CC4)c12	ZINC000329373482	231513258	/nfs/dbraw/zinc/51/32/58/231513258.db2.gz	NAMAXFMXQOPUTG-CQSZACIVSA-N	0	3	314.389	2.006	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCN(Cc2ccccc2C)CC1)N(C)C	ZINC000179238848	282219564	/nfs/dbraw/zinc/21/95/64/282219564.db2.gz	RAEOSDHBHRJAJI-SFHVURJKSA-N	0	3	317.477	2.370	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1CC(=O)N(C)C1CCCCC1	ZINC000178313164	282217127	/nfs/dbraw/zinc/21/71/27/282217127.db2.gz	UHAWTSXAGMHJCK-QGZVFWFLSA-N	0	3	318.465	2.447	10	0		DEAEHN
C[C@@H](NC[C@H](O)CO)c1cc2cc(Br)ccc2o1	ZINC000090282334	185289222	/nfs/dbraw/zinc/28/92/22/185289222.db2.gz	VQJDSDMXTQQEBU-KCJUWKMLSA-N	0	3	314.179	2.199	10	0		DEAEHN
COC[C@@](C)(CO)NCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000613238247	362052557	/nfs/dbraw/zinc/05/25/57/362052557.db2.gz	FWNXPUSBCACCGV-QGZVFWFLSA-N	0	3	309.406	2.129	10	0		DEAEHN
N[C@H]1COC[C@H]1C(=O)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000090378786	185293600	/nfs/dbraw/zinc/29/36/00/185293600.db2.gz	NWRLQVUZIALKKI-APPZFPTMSA-N	0	3	308.687	2.271	10	0		DEAEHN
CN[C@H]1COC[C@H]1c1nc(Cc2c(F)cccc2Cl)no1	ZINC000090423967	185295730	/nfs/dbraw/zinc/29/57/30/185295730.db2.gz	PLTGEBPKYZERTP-SKDRFNHKSA-N	0	3	311.744	2.155	10	0		DEAEHN
CN[C@H]1COC[C@@H]1c1nc(Cc2c(F)cccc2Cl)no1	ZINC000090423963	185295750	/nfs/dbraw/zinc/29/57/50/185295750.db2.gz	PLTGEBPKYZERTP-CABZTGNLSA-N	0	3	311.744	2.155	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1ccc(SC(F)(F)F)cc1	ZINC000090433442	185296177	/nfs/dbraw/zinc/29/61/77/185296177.db2.gz	OELSYOSZDXZJAE-GHMZBOCLSA-N	0	3	320.336	2.471	10	0		DEAEHN
CCN(Cc1ccc(Cl)s1)C(=O)[C@]1(C)COC[C@@H]1N	ZINC000090590612	185305504	/nfs/dbraw/zinc/30/55/04/185305504.db2.gz	KLXXUPLFZAKYQO-GXFFZTMASA-N	0	3	302.827	2.114	10	0		DEAEHN
C[C@]1(c2nc(-c3ccc(Br)cc3)no2)COC[C@H]1N	ZINC000090573322	185304331	/nfs/dbraw/zinc/30/43/31/185304331.db2.gz	GSDMEUJYBQNVKN-MFKMUULPSA-N	0	3	324.178	2.114	10	0		DEAEHN
COC(=O)C1CCC(C(=O)N[C@@H](CC(C)C)CN(C)C)CC1	ZINC000179480400	282226358	/nfs/dbraw/zinc/22/63/58/282226358.db2.gz	LDWLIFVWWBAHSQ-NRXISQOPSA-N	0	3	312.454	2.058	10	0		DEAEHN
COc1ccc(C(=O)N2CCCSC[C@@H]2CN(C)C)cc1	ZINC000090699821	185310644	/nfs/dbraw/zinc/31/06/44/185310644.db2.gz	WGOUTKKINDBPSN-AWEZNQCLSA-N	0	3	308.447	2.205	10	0		DEAEHN
c1ccc2c(c1)CO[C@]21CCN(CCOC2CCOCC2)C1	ZINC000625327274	365731504	/nfs/dbraw/zinc/73/15/04/365731504.db2.gz	BQTKTKHKDWNQHT-SFHVURJKSA-N	0	3	303.402	2.313	10	0		DEAEHN
COCC[C@@H](C)N[C@@H](CO)c1cccc(Br)c1	ZINC000181390533	199288678	/nfs/dbraw/zinc/28/86/78/199288678.db2.gz	WJZITYMBTYEFID-MFKMUULPSA-N	0	3	302.212	2.497	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2ccc3c(c2)COC(C)(C)O3)CCO1	ZINC000186248660	282270642	/nfs/dbraw/zinc/27/06/42/282270642.db2.gz	PQCUOZMETGTDJQ-INIZCTEOSA-N	0	3	320.433	2.094	10	0		DEAEHN
CCO[C@H]1C[C@H](NCc2cn(C)nc2CC)C12CCOCC2	ZINC000186393212	282274631	/nfs/dbraw/zinc/27/46/31/282274631.db2.gz	CUWUZABGGAXQKK-HOTGVXAUSA-N	0	3	307.438	2.046	10	0		DEAEHN
Cn1cc([C@@H]2CCN(CCC(=O)OCc3ccccc3)C2)cn1	ZINC000181460453	199299691	/nfs/dbraw/zinc/29/96/91/199299691.db2.gz	HZIMCUFEYUCJFI-MRXNPFEDSA-N	0	3	313.401	2.343	10	0		DEAEHN
COC(=O)CNC(=O)CCN[C@H](C)c1ccc2ccccc2c1	ZINC000181497599	199307181	/nfs/dbraw/zinc/30/71/81/199307181.db2.gz	REJWFIWOPKNZFK-CYBMUJFWSA-N	0	3	314.385	2.170	10	0		DEAEHN
c1ccc(NC[C@H]2CCN(CCO[C@@H]3CCCCO3)C2)nc1	ZINC000181712678	199343122	/nfs/dbraw/zinc/34/31/22/199343122.db2.gz	ASCRIVCOWMTXMB-NVXWUHKLSA-N	0	3	305.422	2.359	10	0		DEAEHN
O=C1CC[C@H](CNCc2ccc(Br)cc2Cl)N1	ZINC000135189159	539513744	/nfs/dbraw/zinc/51/37/44/539513744.db2.gz	WIIIFPSWXCGZNH-SNVBAGLBSA-N	0	3	317.614	2.471	10	0		DEAEHN
C[C@H](NCc1nccn1C)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000279659960	215040746	/nfs/dbraw/zinc/04/07/46/215040746.db2.gz	DBGYAVRWKHUZAG-STQMWFEESA-N	0	3	308.426	2.155	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCc2ccccc2[C@@H]1CN	ZINC000616692358	362911524	/nfs/dbraw/zinc/91/15/24/362911524.db2.gz	OHGMEMUMENXUOJ-HNNXBMFYSA-N	0	3	305.422	2.069	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1cnn(CC2CC2)c1	ZINC000176382494	539626712	/nfs/dbraw/zinc/62/67/12/539626712.db2.gz	NIRJEOFMCWQKFN-OAHLLOKOSA-N	0	3	305.426	2.241	10	0		DEAEHN
Cc1ccc(CN)cc1S(=O)(=O)N1Cc2ccccc2C1	ZINC000070431156	190890901	/nfs/dbraw/zinc/89/09/01/190890901.db2.gz	ZGWVOSSVZJJYNV-UHFFFAOYSA-N	0	3	302.399	2.158	10	0		DEAEHN
C[C@@H](NC[C@H](O)CN1CCc2ccccc2C1)c1ccoc1	ZINC000177918738	539633114	/nfs/dbraw/zinc/63/31/14/539633114.db2.gz	YUTJNISXIXGEJF-KDOFPFPSSA-N	0	3	300.402	2.349	10	0		DEAEHN
CCOc1ccc(-c2cc3c(N4CCNCC4)nccn3n2)cc1	ZINC000070459148	190898223	/nfs/dbraw/zinc/89/82/23/190898223.db2.gz	ZQASGTGPACUKFM-UHFFFAOYSA-N	0	3	323.400	2.205	10	0		DEAEHN
COc1ccc([C@H](C)NC[C@@H](C)CS(C)(=O)=O)cc1OC	ZINC000180881696	539647231	/nfs/dbraw/zinc/64/72/31/539647231.db2.gz	MSBAIZXMCKCYNW-NEPJUHHUSA-N	0	3	315.435	2.035	10	0		DEAEHN
CC(=O)NC[C@@H]1CCCN(CCN(C)Cc2ccc(F)cc2)C1	ZINC000181662570	539652556	/nfs/dbraw/zinc/65/25/56/539652556.db2.gz	WNJDWCNHEYVUKA-KRWDZBQOSA-N	0	3	321.440	2.106	10	0		DEAEHN
CN[C@H](c1sc(C)cc1Br)[C@H]1COCCO1	ZINC000083678380	192378503	/nfs/dbraw/zinc/37/85/03/192378503.db2.gz	ZRCSAXKMQLGOEB-ZJUUUORDSA-N	0	3	306.225	2.495	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@H]1CCN(Cc2cncnc2)C1	ZINC000190457905	539694865	/nfs/dbraw/zinc/69/48/65/539694865.db2.gz	XMRXODMWJPXVHY-CQSZACIVSA-N	0	3	317.462	2.195	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(Cc2cncnc2)C1	ZINC000190457885	539695040	/nfs/dbraw/zinc/69/50/40/539695040.db2.gz	XMRXODMWJPXVHY-AWEZNQCLSA-N	0	3	317.462	2.195	10	0		DEAEHN
COc1cc(NC(=O)N2CCN3CCC2CC3)cc(OC)c1	ZINC000190888033	539697615	/nfs/dbraw/zinc/69/76/15/539697615.db2.gz	FOCMLQHGVJCVOF-UHFFFAOYSA-N	0	3	305.378	2.016	10	0		DEAEHN
CCC[C@@H](N)c1cn(Cc2ccc(Br)cn2)nn1	ZINC000229954669	539733271	/nfs/dbraw/zinc/73/32/71/539733271.db2.gz	DEINODULEGWFBU-LLVKDONJSA-N	0	3	310.199	2.284	10	0		DEAEHN
CCC[C@H](N)c1cn(Cc2ccc(Br)cn2)nn1	ZINC000229954676	539733514	/nfs/dbraw/zinc/73/35/14/539733514.db2.gz	DEINODULEGWFBU-NSHDSACASA-N	0	3	310.199	2.284	10	0		DEAEHN
CN(C)c1cccc2c1CN(CCc1nccs1)[C@H]2CN	ZINC000071683384	191006339	/nfs/dbraw/zinc/00/63/39/191006339.db2.gz	JBXLXPDNQDAVPQ-HNNXBMFYSA-N	0	3	302.447	2.267	10	0		DEAEHN
NCc1ccccc1C(=O)N1CCN(Cc2ccccc2)CC1	ZINC000071699995	191009325	/nfs/dbraw/zinc/00/93/25/191009325.db2.gz	JMTGQFPASOBTDU-UHFFFAOYSA-N	0	3	309.413	2.103	10	0		DEAEHN
CC1=NO[C@H](C(=O)N(C)Cc2ccccc2CN2CCCC2)C1	ZINC000071756925	191024734	/nfs/dbraw/zinc/02/47/34/191024734.db2.gz	UPHSSBSQNSWEGJ-KRWDZBQOSA-N	0	3	315.417	2.406	10	0		DEAEHN
CC(=O)NC1CCN([C@@H](CN)c2ccc(Cl)s2)CC1	ZINC000133720658	186009389	/nfs/dbraw/zinc/00/93/89/186009389.db2.gz	CQCORVNHTKSITF-NSHDSACASA-N	0	3	301.843	2.002	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@H](CC(C)C)C(=O)N2CCN(C)C)s1	ZINC000140032670	186025380	/nfs/dbraw/zinc/02/53/80/186025380.db2.gz	QOBTUIVOHDKCPI-UKRRQHHQSA-N	0	3	309.479	2.463	10	0		DEAEHN
CN[C@H](Cc1cccnc1N)c1ccc(Br)cn1	ZINC000140221425	186025829	/nfs/dbraw/zinc/02/58/29/186025829.db2.gz	OYTKLONYVAIRLN-GFCCVEGCSA-N	0	3	307.195	2.325	10	0		DEAEHN
CCCCCN(C)[C@@]1(CN)CCS(=O)(=O)c2ccccc21	ZINC000147643798	186040805	/nfs/dbraw/zinc/04/08/05/186040805.db2.gz	HTOSLCGXNJWFIM-MRXNPFEDSA-N	0	3	310.463	2.140	10	0		DEAEHN
CCc1nn(C)c(C[C@@H](N)c2cncs2)c1Br	ZINC000147550374	186040813	/nfs/dbraw/zinc/04/08/13/186040813.db2.gz	FPVWXVWYGIFCAZ-SSDOTTSWSA-N	0	3	315.240	2.444	10	0		DEAEHN
Cc1c(NN)ncnc1OCc1ccccc1Br	ZINC000147825695	186042058	/nfs/dbraw/zinc/04/20/58/186042058.db2.gz	ONFBPSZMNBKYTQ-UHFFFAOYSA-N	0	3	309.167	2.412	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)NCCCCC(C)C)nc1	ZINC000147919518	186042542	/nfs/dbraw/zinc/04/25/42/186042542.db2.gz	TWYPPQPEUPPJKT-UHFFFAOYSA-N	0	3	313.467	2.296	10	0		DEAEHN
Cc1cc(CNC2CC2)cc(S(=O)(=O)NCC(F)F)c1C	ZINC000148189540	186043880	/nfs/dbraw/zinc/04/38/80/186043880.db2.gz	SMNNSCSIFMAYKT-UHFFFAOYSA-N	0	3	318.389	2.099	10	0		DEAEHN
C[C@H](CN1C(=O)C2(CCCC2)N[C@H]1c1cccs1)N(C)C	ZINC000144941997	186035887	/nfs/dbraw/zinc/03/58/87/186035887.db2.gz	NFQQEWGKFRKAOH-TZMCWYRMSA-N	0	3	307.463	2.441	10	0		DEAEHN
Clc1cc(NC[C@@H]2CN3CCC[C@@H]3CO2)c(Cl)nn1	ZINC000149302284	186048966	/nfs/dbraw/zinc/04/89/66/186048966.db2.gz	YDIAMEPHDLLPNG-RKDXNWHRSA-N	0	3	303.193	2.059	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1cccc(Br)c1	ZINC000159570213	186127870	/nfs/dbraw/zinc/12/78/70/186127870.db2.gz	OCSFZDSRVQIGKG-LLVKDONJSA-N	0	3	301.184	2.142	10	0		DEAEHN
O=C(NCc1cccc(Cl)c1)N1CC[C@@H](N2CC=CC2)C1	ZINC000173287533	186172381	/nfs/dbraw/zinc/17/23/81/186172381.db2.gz	RTNHMHQMZCFBPJ-OAHLLOKOSA-N	0	3	305.809	2.496	10	0		DEAEHN
CN(C)CCN(C)c1ccc(C(F)(F)F)c(C(N)=S)c1	ZINC000164217026	186152812	/nfs/dbraw/zinc/15/28/12/186152812.db2.gz	AGFZXMSIWOFTLT-UHFFFAOYSA-N	0	3	305.369	2.337	10	0		DEAEHN
C[C@H](COCc1ccccc1)NC(=O)N1CCC[C@H](N(C)C)C1	ZINC000173344461	186178975	/nfs/dbraw/zinc/17/89/75/186178975.db2.gz	HPIBMPXOJMCGPG-WBVHZDCISA-N	0	3	319.449	2.327	10	0		DEAEHN
CN(C)C[C@H](NC(=O)[C@H]1Cc2ccccc2O1)c1ccccc1	ZINC000171888324	198001804	/nfs/dbraw/zinc/00/18/04/198001804.db2.gz	RXYJCCOGCNKCQN-FUHWJXTLSA-N	0	3	310.397	2.409	10	0		DEAEHN
CC(C)(C)c1ncc(NC(=O)N2CCN3CCC[C@H]3C2)cn1	ZINC000171891975	198003075	/nfs/dbraw/zinc/00/30/75/198003075.db2.gz	AOGLKTHBVDFDBH-ZDUSSCGKSA-N	0	3	303.410	2.086	10	0		DEAEHN
O=C(Nc1ccc(-c2ncon2)cc1)N1CCN2CCC[C@H]2C1	ZINC000171892888	198003411	/nfs/dbraw/zinc/00/34/11/198003411.db2.gz	VXHBNTGGFUMUTC-AWEZNQCLSA-N	0	3	313.361	2.049	10	0		DEAEHN
Cc1ccc(CCNC(=O)N2CCN3CCC[C@@H]3C2)c(C)c1	ZINC000171904791	198005145	/nfs/dbraw/zinc/00/51/45/198005145.db2.gz	DRPJWNRYMUUYHD-QGZVFWFLSA-N	0	3	301.434	2.336	10	0		DEAEHN
C[C@@H](Cc1ccccc1F)NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171903846	198005531	/nfs/dbraw/zinc/00/55/31/198005531.db2.gz	HPYKJBXDKFBRCC-DZGCQCFKSA-N	0	3	305.397	2.246	10	0		DEAEHN
CC(C)c1csc(NC(=O)N2CCO[C@H](CN(C)C)C2)n1	ZINC000172046661	198030215	/nfs/dbraw/zinc/03/02/15/198030215.db2.gz	RBPPMAJVJJYYAW-LLVKDONJSA-N	0	3	312.439	2.061	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2ccc(-c3ccccc3)[nH]2)CCO1	ZINC000172307651	198076976	/nfs/dbraw/zinc/07/69/76/198076976.db2.gz	NBAHDBJYYMBFPD-OAHLLOKOSA-N	0	3	313.401	2.084	10	0		DEAEHN
Cc1ncsc1CCN1CCC(Nc2cccnn2)CC1	ZINC000172535451	198111797	/nfs/dbraw/zinc/11/17/97/198111797.db2.gz	OKUQPWJYWUAACZ-UHFFFAOYSA-N	0	3	303.435	2.361	10	0		DEAEHN
O=C1CC[C@@H](CN[C@@H]2CCc3ccc(Br)cc32)N1	ZINC000302334529	539860758	/nfs/dbraw/zinc/86/07/58/539860758.db2.gz	GPMHQAJVSFPYDL-WCQYABFASA-N	0	3	309.207	2.305	10	0		DEAEHN
C[C@H]1C[C@H](N(C)CCCS(=O)(=O)c2ccccc2)CCN1C	ZINC000172846459	198157861	/nfs/dbraw/zinc/15/78/61/198157861.db2.gz	NQTFLDASUJODRU-JKSUJKDBSA-N	0	3	324.490	2.265	10	0		DEAEHN
CC(C)Nc1ncccc1C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000173180404	198193143	/nfs/dbraw/zinc/19/31/43/198193143.db2.gz	OHZZJEYZEXWZDT-UONOGXRCSA-N	0	3	304.438	2.457	10	0		DEAEHN
CCN1CC[C@H](N(C)S(=O)(=O)c2ccccc2F)[C@H](C)C1	ZINC000173257588	198203027	/nfs/dbraw/zinc/20/30/27/198203027.db2.gz	CCIZOMYJUGENNI-OCCSQVGLSA-N	0	3	314.426	2.177	10	0		DEAEHN
COc1cccc(CCNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000173748154	198247457	/nfs/dbraw/zinc/24/74/57/198247457.db2.gz	PLUVRKNMAAFLKM-HOCLYGCPSA-N	0	3	319.449	2.362	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCc2ccc(Cl)nc2)CCN1C	ZINC000174120539	198294216	/nfs/dbraw/zinc/29/42/16/198294216.db2.gz	MBXQVSJGYKVPKG-WCQYABFASA-N	0	3	310.829	2.359	10	0		DEAEHN
CN(Cc1nc2c(s1)CCCC2)C(=O)NC1CCN(C)CC1	ZINC000176147199	198551488	/nfs/dbraw/zinc/55/14/88/198551488.db2.gz	BJKLXVLJTXEQND-UHFFFAOYSA-N	0	3	322.478	2.258	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)[C@@H](C)Oc1ccc(OC)cc1	ZINC000055105831	354484653	/nfs/dbraw/zinc/48/46/53/354484653.db2.gz	LYRHMVXCDUWQJF-ZIAGYGMSSA-N	0	3	306.406	2.063	10	0		DEAEHN
CCCN(C[C@@H]1CCCCO1)C(=O)NC[C@@H]1CCCN1CC	ZINC000074493005	355032272	/nfs/dbraw/zinc/03/22/72/355032272.db2.gz	ATNMSHZLEDWKNC-HOTGVXAUSA-N	0	3	311.470	2.461	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3c(c2)OCCO3)C1	ZINC000246622596	283094644	/nfs/dbraw/zinc/09/46/44/283094644.db2.gz	KAFLHDFWLFCINT-LSDHHAIUSA-N	0	3	316.401	2.014	10	0		DEAEHN
CCn1cc(NC(=O)c2ccccc2OCCN(C)C)cn1	ZINC000080338344	355357793	/nfs/dbraw/zinc/35/77/93/355357793.db2.gz	XZYGVPMNVPYNQU-UHFFFAOYSA-N	0	3	302.378	2.096	10	0		DEAEHN
Cc1cccc(CNC(=O)NC[C@H](c2ccccc2)N(C)C)n1	ZINC000123793852	355807165	/nfs/dbraw/zinc/80/71/65/355807165.db2.gz	SENCNUGWIKFKQI-QGZVFWFLSA-N	0	3	312.417	2.492	10	0		DEAEHN
CN1CC[C@H](NC(=O)NO[C@@H]2CCCCO2)[C@H]1c1ccccc1	ZINC000251890546	283125944	/nfs/dbraw/zinc/12/59/44/283125944.db2.gz	WXWKPQNWPFCZEB-ARFHVFGLSA-N	0	3	319.405	2.189	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCc1ccccc1OC(F)F	ZINC000139494622	355877668	/nfs/dbraw/zinc/87/76/68/355877668.db2.gz	FVVFEXRYWOHBAO-LBPRGKRZSA-N	0	3	313.348	2.181	10	0		DEAEHN
COc1ccc([C@@H](C)NC(=O)N2CC[C@@H](N(C)C)C2)cc1F	ZINC000170826823	355994641	/nfs/dbraw/zinc/99/46/41/355994641.db2.gz	NWXKEIZYUVVVIE-DGCLKSJQSA-N	0	3	309.385	2.241	10	0		DEAEHN
Cc1cc(C)n2c(CN(C)C[C@H]3CCCC[C@@H]3O)cnc2n1	ZINC000181093378	356072710	/nfs/dbraw/zinc/07/27/10/356072710.db2.gz	LFYRXOKRSMYVPY-ZBFHGGJFSA-N	0	3	302.422	2.329	10	0		DEAEHN
CCC(CC)[C@@H]1C[C@H](NC(=O)NC[C@@H]2CCCN2C)CCO1	ZINC000181412287	356080385	/nfs/dbraw/zinc/08/03/85/356080385.db2.gz	FILFITAQTFKLBM-PMPSAXMXSA-N	0	3	311.470	2.364	10	0		DEAEHN
C[C@@H](N[C@@H]1CCCS(=O)(=O)C1)c1cccc(-n2ccnc2)c1	ZINC000183050704	356158085	/nfs/dbraw/zinc/15/80/85/356158085.db2.gz	POLNXLOWXCIYEM-UKRRQHHQSA-N	0	3	319.430	2.100	10	0		DEAEHN
C[C@@H](NC[C@H](C)CS(C)(=O)=O)c1cccc(-n2cccn2)c1	ZINC000183594678	356176838	/nfs/dbraw/zinc/17/68/38/356176838.db2.gz	JMCKXVNBCFJCCL-UONOGXRCSA-N	0	3	321.446	2.204	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)c2ccc3nnn(C)c3c2)c1	ZINC000182644301	356135288	/nfs/dbraw/zinc/13/52/88/356135288.db2.gz	KBRXMDZYTNVDIH-UHFFFAOYSA-N	0	3	309.373	2.282	10	0		DEAEHN
CC[C@@](C)(CO)NCC(=O)Nc1ccc(Br)cc1	ZINC000080108409	192001683	/nfs/dbraw/zinc/00/16/83/192001683.db2.gz	KQWQXRGWFDPJIC-ZDUSSCGKSA-N	0	3	315.211	2.138	10	0		DEAEHN
COc1ccc([C@H](C)N[C@@H](C)C[S@](C)=O)cc1NC(C)=O	ZINC000184307368	356189141	/nfs/dbraw/zinc/18/91/41/356189141.db2.gz	HHCZEVZYXNGXKS-HJTOQOCKSA-N	0	3	312.435	2.071	10	0		DEAEHN
NC[C@H](O)c1cc(Br)c(Br)s1	ZINC000227972280	356281386	/nfs/dbraw/zinc/28/13/86/356281386.db2.gz	IUGNVQVPVCQWMV-BYPYZUCNSA-N	0	3	301.003	2.265	10	0		DEAEHN
CCC[C@H](N)C(=O)Nc1ccc(Cl)c(C[S@@](C)=O)c1	ZINC000236936237	202080150	/nfs/dbraw/zinc/08/01/50/202080150.db2.gz	BBIUYQABKCXAKX-HXPMCKFVSA-N	0	3	302.827	2.284	10	0		DEAEHN
CCN[C@H](c1ccc2c(c1)C[C@H](C)O2)[C@@H]1CCS(=O)(=O)C1	ZINC000086021374	192544075	/nfs/dbraw/zinc/54/40/75/192544075.db2.gz	OFEBUSABYCXAEF-NORZTCDRSA-N	0	3	309.431	2.095	10	0		DEAEHN
CCOc1cccc(CNC)c1OCCCS(=O)(=O)CC	ZINC000086972779	192603820	/nfs/dbraw/zinc/60/38/20/192603820.db2.gz	CMQWHHIRRRGZGD-UHFFFAOYSA-N	0	3	315.435	2.008	10	0		DEAEHN
CC[C@@](C)(O)CNCC(=O)Nc1cccc(Br)c1	ZINC000087028029	192612899	/nfs/dbraw/zinc/61/28/99/192612899.db2.gz	IZTYJIDUHJZARQ-CYBMUJFWSA-N	0	3	315.211	2.138	10	0		DEAEHN
CC[C@H]1CCCCN1S(=O)(=O)c1ccc(CNC)s1	ZINC000088942478	192663156	/nfs/dbraw/zinc/66/31/56/192663156.db2.gz	LADUQKNWERIFEK-NSHDSACASA-N	0	3	302.465	2.421	10	0		DEAEHN
Cc1sc(CNC2CC2)cc1S(=O)(=O)N1CCC[C@@H]1C	ZINC000088972047	192675235	/nfs/dbraw/zinc/67/52/35/192675235.db2.gz	VANQHJUTLXUNPG-JTQLQIEISA-N	0	3	314.476	2.482	10	0		DEAEHN
CCC[C@H](C)N(C)S(=O)(=O)c1cc(CN)n(CCC)c1	ZINC000088964919	192673069	/nfs/dbraw/zinc/67/30/69/192673069.db2.gz	CDUNQVXTSNWGIP-LBPRGKRZSA-N	0	3	301.456	2.166	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@@H](CC(C)C)C(=O)OC(C)C	ZINC000358268246	535362143	/nfs/dbraw/zinc/36/21/43/535362143.db2.gz	XHRGRHYUJROJDP-LSDHHAIUSA-N	0	3	312.454	2.343	10	0		DEAEHN
COc1ccc(C[C@@H](C)CNC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000179511274	199047476	/nfs/dbraw/zinc/04/74/76/199047476.db2.gz	GWRUHOMDZZGIRJ-GDBMZVCRSA-N	0	3	319.449	2.219	10	0		DEAEHN
CC(C)C1CCC(NC(=O)NCCNc2ccncc2)CC1	ZINC000359157110	535377811	/nfs/dbraw/zinc/37/78/11/535377811.db2.gz	UASRUHCNFTUIGF-UHFFFAOYSA-N	0	3	304.438	2.429	10	0		DEAEHN
Cn1cc(-c2cc(CN[C@](C)(CO)C3CCCCC3)on2)cn1	ZINC000185008957	199795305	/nfs/dbraw/zinc/79/53/05/199795305.db2.gz	GVMNRCCKXVGVBC-QGZVFWFLSA-N	0	3	318.421	2.496	10	0		DEAEHN
O[C@H](COC[C@H]1CCCO1)CN1CCCc2sccc2C1	ZINC000593439713	358078990	/nfs/dbraw/zinc/07/89/90/358078990.db2.gz	BLZHSROVTVDHDV-LSDHHAIUSA-N	0	3	311.447	2.053	10	0		DEAEHN
COc1ccc([C@H](C)CN2CCN(C[C@@H](C)O)[C@H](C)C2)cc1	ZINC000180084691	199116056	/nfs/dbraw/zinc/11/60/56/199116056.db2.gz	QRVXRWLDQARHTO-BZUAXINKSA-N	0	3	306.450	2.186	10	0		DEAEHN
Cc1cc(C(=O)NC[C@@H]2CCCN2C)nn1-c1ccc(F)cc1	ZINC000180397686	199154091	/nfs/dbraw/zinc/15/40/91/199154091.db2.gz	HZKUSAVHWYGZCE-HNNXBMFYSA-N	0	3	316.380	2.144	10	0		DEAEHN
COc1cc([C@@H](C)NC[C@@H]2CN(C)CCO2)ccc1SC	ZINC000180498436	199167414	/nfs/dbraw/zinc/16/74/14/199167414.db2.gz	CRCSMUQUTKBLJY-TZMCWYRMSA-N	0	3	310.463	2.398	10	0		DEAEHN
C[C@H](c1cnn(C)c1)N(C)C(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000180791017	199209635	/nfs/dbraw/zinc/20/96/35/199209635.db2.gz	HQUNUAGKNYZUBH-LSDHHAIUSA-N	0	3	321.469	2.243	10	0		DEAEHN
C[C@@H](CNC(=O)N(C)[C@@H](C)c1cnn(C)c1)N1CCC(C)CC1	ZINC000180790983	199209894	/nfs/dbraw/zinc/20/98/94/199209894.db2.gz	HQUNUAGKNYZUBH-GJZGRUSLSA-N	0	3	321.469	2.243	10	0		DEAEHN
CCCC[C@@H](C)NS(=O)(=O)c1cc(CN)n(C(C)C)c1	ZINC000089022606	192703186	/nfs/dbraw/zinc/70/31/86/192703186.db2.gz	HNQMWFIATPWSRW-GFCCVEGCSA-N	0	3	301.456	2.385	10	0		DEAEHN
CCn1cc(S(=O)(=O)NC(CC)(CC)CC)cc1CNC	ZINC000089049348	192720092	/nfs/dbraw/zinc/72/00/92/192720092.db2.gz	LMQKDYCLGKWNMH-UHFFFAOYSA-N	0	3	315.483	2.475	10	0		DEAEHN
Cc1cc(C(=O)N(C)CCN(C)C2CC2)nn1-c1ccccc1	ZINC000186807058	200013944	/nfs/dbraw/zinc/01/39/44/200013944.db2.gz	KZISYRQOSJSWBS-UHFFFAOYSA-N	0	3	312.417	2.347	10	0		DEAEHN
CN1C(=O)CCc2cc(CNC[C@@H](O)Cc3ccccc3)ccc21	ZINC000187215031	200078082	/nfs/dbraw/zinc/07/80/82/200078082.db2.gz	HLYFQWSSHSCYQK-SFHVURJKSA-N	0	3	324.424	2.289	10	0		DEAEHN
CCC[C@H](C)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000187684739	200144042	/nfs/dbraw/zinc/14/40/42/200144042.db2.gz	SJWOLEOBRYCLLJ-DLBZAZTESA-N	0	3	306.450	2.233	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1cc(F)ccc1OC	ZINC000187744274	200151825	/nfs/dbraw/zinc/15/18/25/200151825.db2.gz	FUNSGFBZQVPFNU-HNNXBMFYSA-N	0	3	323.412	2.460	10	0		DEAEHN
COC(=O)c1coc(CN2C[C@@H](c3ccsc3)[C@H](CO)C2)c1	ZINC000188093762	200192841	/nfs/dbraw/zinc/19/28/41/200192841.db2.gz	PLMOXSBENHRIGQ-ZFWWWQNUSA-N	0	3	321.398	2.336	10	0		DEAEHN
C[C@@H]1OCCC[C@H]1C(=O)NCCCN1CCc2ccccc2C1	ZINC000188403877	200240413	/nfs/dbraw/zinc/24/04/13/200240413.db2.gz	YAPHEQCVDAIMLK-MAUKXSAKSA-N	0	3	316.445	2.366	10	0		DEAEHN
CN1CC[C@@H](NC(=O)Cc2cncs2)[C@@H]1c1ccccc1	ZINC000188651319	200281361	/nfs/dbraw/zinc/28/13/61/200281361.db2.gz	XKYNDNWKDVUKKU-ZBFHGGJFSA-N	0	3	301.415	2.247	10	0		DEAEHN
c1ccc(CSCCNC2CN(c3ccncn3)C2)cc1	ZINC000602744262	360532612	/nfs/dbraw/zinc/53/26/12/360532612.db2.gz	YTJSQZZNIVJXHZ-UHFFFAOYSA-N	0	3	300.431	2.188	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NC[C@H]1OCCc2ccccc21	ZINC000603343291	360800967	/nfs/dbraw/zinc/80/09/67/360800967.db2.gz	ZKLOOJNLBNUHAH-IAGOWNOFSA-N	0	3	302.418	2.291	10	0		DEAEHN
CC[C@@H](CN1CCCC1)NC(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000605523406	360976230	/nfs/dbraw/zinc/97/62/30/360976230.db2.gz	UTJMIJUSHFWNLH-KRWDZBQOSA-N	0	3	314.429	2.349	10	0		DEAEHN
O=C(Nc1ccc2nccn2c1)N1CC[C@H](N2CCCCC2)C1	ZINC000606582645	361023246	/nfs/dbraw/zinc/02/32/46/361023246.db2.gz	YCFMNFAVJNDZKY-HNNXBMFYSA-N	0	3	313.405	2.426	10	0		DEAEHN
COc1cc(CN(C)CCOC[C@H]2CCCO2)cc(OC)c1	ZINC000607357152	361083064	/nfs/dbraw/zinc/08/30/64/361083064.db2.gz	STYJJPLSYNIECG-OAHLLOKOSA-N	0	3	309.406	2.331	10	0		DEAEHN
C[C@@H]1CCNC(=O)[C@H]1NCc1ccc(SC(=O)N(C)C)cc1	ZINC000193635525	201091546	/nfs/dbraw/zinc/09/15/46/201091546.db2.gz	LQSKTXNBPINNBC-RISCZKNCSA-N	0	3	321.446	2.075	10	0		DEAEHN
Cc1ncc(CNC[C@@H]2CN(Cc3ccccc3)CCCO2)o1	ZINC000628252454	366782692	/nfs/dbraw/zinc/78/26/92/366782692.db2.gz	VUMHWAMOFUVHRF-GOSISDBHSA-N	0	3	315.417	2.364	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1nc2cccnc2s1	ZINC000193943288	201149691	/nfs/dbraw/zinc/14/96/91/201149691.db2.gz	MEXURVAJMKGKDQ-GHMZBOCLSA-N	0	3	302.403	2.000	10	0		DEAEHN
C[C@@H](NC(=O)C1(N)CCOCC1)C12CC3CC(CC(C3)C1)C2	ZINC000262107345	296040093	/nfs/dbraw/zinc/04/00/93/296040093.db2.gz	JLBUVPHHMQKWRW-JISDDCRVSA-N	0	3	306.450	2.215	10	0		DEAEHN
CCn1cc([C@H](C)N[C@@H]2CCCN(c3ncccn3)C2)cn1	ZINC000194983980	201322082	/nfs/dbraw/zinc/32/20/82/201322082.db2.gz	AEKJFPTWCLXBFL-DZGCQCFKSA-N	0	3	300.410	2.013	10	0		DEAEHN
CCOC(=O)[C@H](CC)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000195292739	201374985	/nfs/dbraw/zinc/37/49/85/201374985.db2.gz	SITDGDGMLQEAAH-SJORKVTESA-N	0	3	319.449	2.177	10	0		DEAEHN
CC(=O)N1CC[C@@H](NCCO[C@@H]2CC2(F)F)c2ccccc21	ZINC000621765391	364539543	/nfs/dbraw/zinc/53/95/43/364539543.db2.gz	XUEQFXPSFKTGKG-UKRRQHHQSA-N	0	3	310.344	2.498	10	0		DEAEHN
CCc1nn(C)c(Cl)c1CNC[C@@H]1CCc2nccn2C1	ZINC000275447851	212339192	/nfs/dbraw/zinc/33/91/92/212339192.db2.gz	GGXGZZUSMWLWNT-NSHDSACASA-N	0	3	307.829	2.185	10	0		DEAEHN
C[C@@H](Cc1c(F)cccc1F)NC(=O)C[C@@H]1CSCCN1	ZINC000091135444	193001779	/nfs/dbraw/zinc/00/17/79/193001779.db2.gz	RYOALWOWDLPLPI-WDEREUQCSA-N	0	3	314.401	2.107	10	0		DEAEHN
Cc1ccc(NC(=O)C[C@H]2CNCCO2)c(Br)c1	ZINC000091298889	193034474	/nfs/dbraw/zinc/03/44/74/193034474.db2.gz	NPOSDTINEXEYOE-JTQLQIEISA-N	0	3	313.195	2.075	10	0		DEAEHN
CN[C@H](Cc1ncnn1C)c1cc(F)cc(Br)c1	ZINC000091331022	193042204	/nfs/dbraw/zinc/04/22/04/193042204.db2.gz	FCGUNJBMDVBDIB-LLVKDONJSA-N	0	3	313.174	2.220	10	0		DEAEHN
COc1ccc(Br)cc1CNCC1CC(O)C1	ZINC000091425723	193054127	/nfs/dbraw/zinc/05/41/27/193054127.db2.gz	RQPBETAPPVZYJL-UHFFFAOYSA-N	0	3	300.196	2.318	10	0		DEAEHN
Cc1sc2[nH]c(Cn3cccc3[C@H](C)N)nc(=O)c2c1C	ZINC000091799959	193110358	/nfs/dbraw/zinc/11/03/58/193110358.db2.gz	QVPAXGXMSOUNPY-VIFPVBQESA-N	0	3	302.403	2.471	10	0		DEAEHN
Cc1sc2[nH]c(Cn3cccc3[C@@H](C)N)nc(=O)c2c1C	ZINC000091799958	193110375	/nfs/dbraw/zinc/11/03/75/193110375.db2.gz	QVPAXGXMSOUNPY-SECBINFHSA-N	0	3	302.403	2.471	10	0		DEAEHN
CCCNCc1ccccc1S(=O)(=O)N1C[C@H](C)[C@@H](C)C1	ZINC000092113894	193161495	/nfs/dbraw/zinc/16/14/95/193161495.db2.gz	RXCFNFSAUTXHLK-KBPBESRZSA-N	0	3	310.463	2.463	10	0		DEAEHN
CNCc1cc(C)c(C)c(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)c1	ZINC000092113949	193161508	/nfs/dbraw/zinc/16/15/08/193161508.db2.gz	ZYUVRHXWWLUXOS-BETUJISGSA-N	0	3	310.463	2.299	10	0		DEAEHN
CC[C@@H]1CCCN(S(=O)(=O)c2ccc(CNC)cc2F)C1	ZINC000092115712	193163417	/nfs/dbraw/zinc/16/34/17/193163417.db2.gz	RAQQXALJPAWSNH-GFCCVEGCSA-N	0	3	314.426	2.356	10	0		DEAEHN
CCN(c1ccccc1)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115537	193163590	/nfs/dbraw/zinc/16/35/90/193163590.db2.gz	XQSBMRHWJLYWBC-UHFFFAOYSA-N	0	3	308.378	2.500	10	0		DEAEHN
C[C@@H]1CCC[C@@H](C)N1S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115552	193163613	/nfs/dbraw/zinc/16/36/13/193163613.db2.gz	SZUIRZGPIKNCHB-GHMZBOCLSA-N	0	3	300.399	2.236	10	0		DEAEHN
c1c(CNC[C@H]2CC3CCC2CC3)nnn1C[C@@H]1CCOC1	ZINC000631166516	368056958	/nfs/dbraw/zinc/05/69/58/368056958.db2.gz	VGRKCDOTKWQUOB-BHDPWAOGSA-N	0	3	304.438	2.231	10	0		DEAEHN
OC(CNCc1ccncc1Br)(C1CC1)C1CC1	ZINC000631174551	368063003	/nfs/dbraw/zinc/06/30/03/368063003.db2.gz	CMHPKNUNYOMOTK-UHFFFAOYSA-N	0	3	311.223	2.485	10	0		DEAEHN
c1c(CN[C@@H]2CC[C@@H]3CCC[C@H]3C2)nnn1C[C@@H]1CCOC1	ZINC000631080230	368006626	/nfs/dbraw/zinc/00/66/26/368006626.db2.gz	XXFASAQEVWGJGI-YHUYYLMFSA-N	0	3	304.438	2.373	10	0		DEAEHN
c1cc(CN[C@H]2CCN(c3ccccn3)C2)n(CC2CCC2)n1	ZINC000631106784	368019076	/nfs/dbraw/zinc/01/90/76/368019076.db2.gz	QSQLJERUVREDNN-INIZCTEOSA-N	0	3	311.433	2.447	10	0		DEAEHN
COc1cc(CNCC[C@@H](O)C(F)F)cc(Cl)c1OC	ZINC000631220403	368086747	/nfs/dbraw/zinc/08/67/47/368086747.db2.gz	XPYKSZXUTGLJBP-SNVBAGLBSA-N	0	3	309.740	2.463	10	0		DEAEHN
CC[C@H](C(N)=S)N1CCN(CCSc2ccccc2)CC1	ZINC000092261139	193182598	/nfs/dbraw/zinc/18/25/98/193182598.db2.gz	UVRGITZFZAJDBT-OAHLLOKOSA-N	0	3	323.531	2.461	10	0		DEAEHN
NC[C@H](c1cc(Cl)cs1)N1CCN(c2ncccn2)CC1	ZINC000093095249	193203320	/nfs/dbraw/zinc/20/33/20/193203320.db2.gz	XXPGIWRGTXKCLV-GFCCVEGCSA-N	0	3	323.853	2.014	10	0		DEAEHN
C[S@@](=O)Cc1cc(NC(=O)[C@@H]2CCCCN2)ccc1Cl	ZINC000262483914	203305513	/nfs/dbraw/zinc/30/55/13/203305513.db2.gz	SYSKLFROWSSISX-RNODOKPDSA-N	0	3	314.838	2.299	10	0		DEAEHN
Cc1cccc(Oc2ccc(NC(=O)[C@H]3C[C@@H](O)CN3)cc2)c1	ZINC000262557971	203330599	/nfs/dbraw/zinc/33/05/99/203330599.db2.gz	VLQIKYFWUYPBNL-RHSMWYFYSA-N	0	3	312.369	2.449	10	0		DEAEHN
CC[NH2+][C@@]1(C(=O)[O-])CCC[C@H]1CCN(C)CCC(F)(F)F	ZINC000093596072	193270832	/nfs/dbraw/zinc/27/08/32/193270832.db2.gz	ATNXNSYUBZAUKN-AAEUAGOBSA-N	0	3	310.360	2.494	10	0		DEAEHN
CCCN[C@H]1CCCc2sc([C@@H]3CN(C)CCN3C)nc21	ZINC000093896270	193325507	/nfs/dbraw/zinc/32/55/07/193325507.db2.gz	PRMZQGUWIPVGMH-STQMWFEESA-N	0	3	308.495	2.438	10	0		DEAEHN
CCC[C@H](C)NC(=O)COc1c(F)cc(CNC)cc1F	ZINC000094346669	193363754	/nfs/dbraw/zinc/36/37/54/193363754.db2.gz	KVQYWWXXCFYENM-JTQLQIEISA-N	0	3	300.349	2.368	10	0		DEAEHN
COCCN(C)CCNc1ncc(Br)cc1C	ZINC000094050905	193341464	/nfs/dbraw/zinc/34/14/64/193341464.db2.gz	MGBPINAPSJPOKE-UHFFFAOYSA-N	0	3	302.216	2.143	10	0		DEAEHN
N[C@@H](C[S@](=O)c1cccc(F)c1)c1ccc2c(c1)OCO2	ZINC000094625457	193385545	/nfs/dbraw/zinc/38/55/45/193385545.db2.gz	UDABKWFYAVNIHB-YEJXKQKISA-N	0	3	307.346	2.362	10	0		DEAEHN
COc1ccccc1[C@](C)(N)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094640187	193388595	/nfs/dbraw/zinc/38/85/95/193388595.db2.gz	OZZRGJUFWSHNFL-DVOMOZLQSA-N	0	3	311.447	2.473	10	0		DEAEHN
CC(C)([C@H](O)[C@@H]1CCC[C@H](S(C)(=O)=O)C1)N1CCCCC1	ZINC000094641330	193388897	/nfs/dbraw/zinc/38/88/97/193388897.db2.gz	KUAWRUZZGIWMDV-QLFBSQMISA-N	0	3	317.495	2.215	10	0		DEAEHN
CN[C@H](C)c1c(C)nn([C@@H]2CCC[C@@H](S(C)(=O)=O)C2)c1C	ZINC000094643987	193390044	/nfs/dbraw/zinc/39/00/44/193390044.db2.gz	IMSHDHNJSMPGKM-LERXQTSPSA-N	0	3	313.467	2.309	10	0		DEAEHN
Brc1cn2ccnc2c(N[C@@H]2CCN(C3CC3)C2)n1	ZINC000094489927	193373870	/nfs/dbraw/zinc/37/38/70/193373870.db2.gz	RSSWWQFOPLIUHA-SECBINFHSA-N	0	3	322.210	2.140	10	0		DEAEHN
CCC[C@H](C[NH3+])C(=O)Nc1cc(Br)ccc1[O-]	ZINC000094573695	193381831	/nfs/dbraw/zinc/38/18/31/193381831.db2.gz	ZXLNGUNVHLOLSV-MRVPVSSYSA-N	0	3	301.184	2.468	10	0		DEAEHN
CCN1CCC[C@H]1CNc1nc2ccc(Br)cn2n1	ZINC000094602684	193383824	/nfs/dbraw/zinc/38/38/24/193383824.db2.gz	JCCZXDUPNQUKHX-NSHDSACASA-N	0	3	324.226	2.388	10	0		DEAEHN
CCCN[C@H](c1ccc(Br)o1)[C@@H]1COCCO1	ZINC000094840260	193402782	/nfs/dbraw/zinc/40/27/82/193402782.db2.gz	IHBAVQOXRNAHNY-CMPLNLGQSA-N	0	3	304.184	2.498	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)c1ccc2nnc(C(C)(C)C)n2n1	ZINC000274877047	212002981	/nfs/dbraw/zinc/00/29/81/212002981.db2.gz	GSZXBFADOGPDML-CYBMUJFWSA-N	0	3	316.453	2.342	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2ccccc2OC(F)F)C[C@H](C)O1	ZINC000019803236	182151491	/nfs/dbraw/zinc/15/14/91/182151491.db2.gz	YTYCUDHPYYWDSF-LOWVWBTDSA-N	0	3	300.349	2.397	10	0		DEAEHN
NCc1cccc(S(=O)(=O)N2CCCc3ccccc32)c1	ZINC000020009236	182177059	/nfs/dbraw/zinc/17/70/59/182177059.db2.gz	IOXCWKSOJWBEQP-UHFFFAOYSA-N	0	3	302.399	2.287	10	0		DEAEHN
C[C@@H]1CN([C@H](CN)c2ccc(OC(F)F)cc2)C[C@H](C)O1	ZINC000020081640	182185229	/nfs/dbraw/zinc/18/52/29/182185229.db2.gz	ZUOUGDPMBANCCL-UHIISALHSA-N	0	3	300.349	2.397	10	0		DEAEHN
Cc1ccc(CNS(=O)(=O)c2cc(CN)ccc2C)cc1	ZINC000020189404	182195309	/nfs/dbraw/zinc/19/53/09/182195309.db2.gz	UTWYEAIBLUVFLA-UHFFFAOYSA-N	0	3	304.415	2.241	10	0		DEAEHN
C[C@H](CCN1CCN(C)CC1)NC(=O)NCC1CCCCCC1	ZINC000454826835	246177941	/nfs/dbraw/zinc/17/79/41/246177941.db2.gz	ZFELOGJAQUNOSF-MRXNPFEDSA-N	0	3	324.513	2.282	10	0		DEAEHN
C[C@@H](C(=O)NC[C@H](c1ccccc1)N(C)C)C1CCOCC1	ZINC000158555272	291642994	/nfs/dbraw/zinc/64/29/94/291642994.db2.gz	HMBHCGFAVVQTKL-RHSMWYFYSA-N	0	3	304.434	2.468	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2c3ncsc3ccc2Cl)C1	ZINC000040632736	183112063	/nfs/dbraw/zinc/11/20/63/183112063.db2.gz	JEDIJPLIOFRBRF-CBAPKCEASA-N	0	3	311.794	2.265	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1ccc(Cl)nn1)c1ccccc1	ZINC000040802326	183135914	/nfs/dbraw/zinc/13/59/14/183135914.db2.gz	CFXJPCZJQHXFJW-ZDUSSCGKSA-N	0	3	304.781	2.163	10	0		DEAEHN
Cc1ccc(-n2nc(C(=O)NCCN(C)C)cc2C2CC2)cc1	ZINC000041453261	183192075	/nfs/dbraw/zinc/19/20/75/183192075.db2.gz	FHUZFGOOKIZRMQ-UHFFFAOYSA-N	0	3	312.417	2.350	10	0		DEAEHN
COc1ccc2c(ncnc2N(C)C2CCN(C)CC2)c1OC	ZINC000041475103	183193964	/nfs/dbraw/zinc/19/39/64/183193964.db2.gz	VKMRAVDBRNCUJS-UHFFFAOYSA-N	0	3	316.405	2.177	10	0		DEAEHN
CC1CC(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000681765589	542203881	/nfs/dbraw/zinc/20/38/81/542203881.db2.gz	WPPYXMPHKWPDNP-KVWWFHCMSA-N	0	3	316.445	2.128	10	0		DEAEHN
CCN(CCOC)[C@@H](CN)c1ccc(Br)s1	ZINC000042318059	183253704	/nfs/dbraw/zinc/25/37/04/183253704.db2.gz	PKDMXWZHTOHSIF-VIFPVBQESA-N	0	3	307.257	2.479	10	0		DEAEHN
C[C@@H](CN1CCCC1)NC(=O)c1cc(Br)cn1C	ZINC000042371345	183260785	/nfs/dbraw/zinc/26/07/85/183260785.db2.gz	GOAIUJWGOJDJPK-JTQLQIEISA-N	0	3	314.227	2.002	10	0		DEAEHN
C[C@@H](N)[C@@H](c1cccc(Cl)c1)N(C)CC(=O)N1CCCC1	ZINC000043015469	183327521	/nfs/dbraw/zinc/32/75/21/183327521.db2.gz	AWHKBPKHLYISHS-WBMJQRKESA-N	0	3	309.841	2.283	10	0		DEAEHN
C[C@H](N)[C@H](c1cccc(Cl)c1)N(C)CC(=O)N1CCCC1	ZINC000043015472	183327715	/nfs/dbraw/zinc/32/77/15/183327715.db2.gz	AWHKBPKHLYISHS-BLLLJJGKSA-N	0	3	309.841	2.283	10	0		DEAEHN
CC[C@H](N)[C@H](c1sccc1C)N(C)CC(=O)N1CCCC1	ZINC000043248500	183346972	/nfs/dbraw/zinc/34/69/72/183346972.db2.gz	HWPLOMQDTDAMGR-DZGCQCFKSA-N	0	3	309.479	2.389	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(C)s1)N(C)CC(=O)N1CCCC1	ZINC000043242123	183347190	/nfs/dbraw/zinc/34/71/90/183347190.db2.gz	HLWJVIBSENESCM-XJKSGUPXSA-N	0	3	309.479	2.389	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)s1)N(CC(N)=O)C(C)C	ZINC000043253848	183348102	/nfs/dbraw/zinc/34/81/02/183348102.db2.gz	DCPYARSVOUEUML-TVQRCGJNSA-N	0	3	303.859	2.376	10	0		DEAEHN
N[C@H](c1cc(Br)ccc1F)[C@H]1CCS(=O)(=O)C1	ZINC000043299756	183351678	/nfs/dbraw/zinc/35/16/78/183351678.db2.gz	XLFFUEWUIFDXEZ-CPCISQLKSA-N	0	3	322.199	2.023	10	0		DEAEHN
CN[C@@H](c1ccccc1Br)[C@@H]1CCS(=O)(=O)C1	ZINC000043300416	183352485	/nfs/dbraw/zinc/35/24/85/183352485.db2.gz	MMIPAHJMZRJOBK-BXKDBHETSA-N	0	3	318.236	2.144	10	0		DEAEHN
N[C@H](c1ccccc1OC(F)(F)F)[C@H]1CCS(=O)(=O)C1	ZINC000043300044	183352738	/nfs/dbraw/zinc/35/27/38/183352738.db2.gz	VCLCQEYSXYHCJV-KWQFWETISA-N	0	3	309.309	2.020	10	0		DEAEHN
CCCN[C@@H](c1ccc2c(c1)CCO2)[C@H]1CCS(=O)(=O)C1	ZINC000043301495	183352810	/nfs/dbraw/zinc/35/28/10/183352810.db2.gz	YKBHTLVXNSYNCV-HOCLYGCPSA-N	0	3	309.431	2.097	10	0		DEAEHN
Cc1ccc([C@@H](Oc2ccc(S(C)(=O)=O)cc2)[C@@H](C)N)o1	ZINC000043366990	183357687	/nfs/dbraw/zinc/35/76/87/183357687.db2.gz	UJBJXWSZZTXMIH-ABAIWWIYSA-N	0	3	309.387	2.459	10	0		DEAEHN
CN1CCC[C@@H]1CNC(=O)c1ccc(-n2cccc2)c(F)c1	ZINC000104866991	194048704	/nfs/dbraw/zinc/04/87/04/194048704.db2.gz	BYAHVDHCWSIDGG-CQSZACIVSA-N	0	3	301.365	2.440	10	0		DEAEHN
CSCCC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000104925085	194053076	/nfs/dbraw/zinc/05/30/76/194053076.db2.gz	SETJGNBGMTTWSS-UHFFFAOYSA-N	0	3	322.474	2.013	10	0		DEAEHN
CC[C@@H]1CN(CCc2ccc(OC)cc2)CCN1C[C@@H](C)O	ZINC000105826294	194136864	/nfs/dbraw/zinc/13/68/64/194136864.db2.gz	NKGJYNLGUOBCMR-NVXWUHKLSA-N	0	3	306.450	2.015	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)N1CCC[C@H](n2cc(C)cn2)C1	ZINC000105860111	194148301	/nfs/dbraw/zinc/14/83/01/194148301.db2.gz	DUXDQVLVGZNOHQ-HOTGVXAUSA-N	0	3	304.438	2.229	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)Nc2cccc(C)c2C)c1	ZINC000105881613	194155450	/nfs/dbraw/zinc/15/54/50/194155450.db2.gz	ZTCYTUQIDQFTKP-HNNXBMFYSA-N	0	3	300.406	2.425	10	0		DEAEHN
CC1CCN(CCNC(=O)[C@@H](Cc2ccccc2)N(C)C)CC1	ZINC000106431821	194213280	/nfs/dbraw/zinc/21/32/80/194213280.db2.gz	JDNZULOLQRWZPV-GOSISDBHSA-N	0	3	317.477	2.007	10	0		DEAEHN
CC(C)NCCS(=O)(=O)N(Cc1ccsc1)C1CC1	ZINC000049644917	183751282	/nfs/dbraw/zinc/75/12/82/183751282.db2.gz	NSVSRDMJXAIZRO-UHFFFAOYSA-N	0	3	302.465	2.040	10	0		DEAEHN
COCC[C@H](N)C(=O)Nc1ccc(C)c(Br)c1	ZINC000109436529	194263297	/nfs/dbraw/zinc/26/32/97/194263297.db2.gz	SCQRMTLJCSAMRD-NSHDSACASA-N	0	3	301.184	2.060	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1cc(C)ccc1OC	ZINC000110085466	194309293	/nfs/dbraw/zinc/30/92/93/194309293.db2.gz	LTRANRWXKXTDRF-CQSZACIVSA-N	0	3	321.421	2.236	10	0		DEAEHN
CN[C@H](CCN1CCS(=O)CC1)c1cccc(Cl)c1	ZINC000054019980	183920289	/nfs/dbraw/zinc/92/02/89/183920289.db2.gz	FEFXVIZMTRZTHW-CQSZACIVSA-N	0	3	300.855	2.055	10	0		DEAEHN
CCOC(=O)c1cc(C)sc1NC(=O)[C@@H](N)CCSC	ZINC000110777581	194358077	/nfs/dbraw/zinc/35/80/77/194358077.db2.gz	VBLCEBPUCSYDNC-JTQLQIEISA-N	0	3	316.448	2.252	10	0		DEAEHN
CN(C[C@@H]1CCCOC1)[C@@H](CN)c1ccc(Br)o1	ZINC000111157814	194396208	/nfs/dbraw/zinc/39/62/08/194396208.db2.gz	ISHFIAQHFMGXRJ-QWRGUYRKSA-N	0	3	317.227	2.400	10	0		DEAEHN
Fc1cc(CN2CCCN(C3CC3)CC2)c2c(c1)COCO2	ZINC000061041328	184161021	/nfs/dbraw/zinc/16/10/21/184161021.db2.gz	QVYJLQUAZCSQGF-UHFFFAOYSA-N	0	3	306.381	2.362	10	0		DEAEHN
[NH3+]Cc1ccc(S(=O)(=O)[N-]c2cc(F)cc(F)c2F)cc1	ZINC000061118194	184162703	/nfs/dbraw/zinc/16/27/03/184162703.db2.gz	HUNAQGZOTVHRRV-UHFFFAOYSA-N	0	3	316.304	2.363	10	0		DEAEHN
CCCN[C@@](C)(CSc1nc2cc(C)ccc2[nH]1)C(N)=O	ZINC000061440841	184171067	/nfs/dbraw/zinc/17/10/67/184171067.db2.gz	UKRJZEQXTDCSEZ-HNNXBMFYSA-N	0	3	306.435	2.207	10	0		DEAEHN
CCCN[C@@](C)(CSc1nc2ccc(C)cc2[nH]1)C(N)=O	ZINC000061440841	184171069	/nfs/dbraw/zinc/17/10/69/184171069.db2.gz	UKRJZEQXTDCSEZ-HNNXBMFYSA-N	0	3	306.435	2.207	10	0		DEAEHN
COc1ccc(Br)cc1[C@@H](N)C[C@H](C)CC(N)=O	ZINC000061830211	184188964	/nfs/dbraw/zinc/18/89/64/184188964.db2.gz	ZDUJJEUIJNGLAD-KWQFWETISA-N	0	3	315.211	2.359	10	0		DEAEHN
Cc1ccc(S(=O)(=O)NCc2ccccc2CN)cc1C	ZINC000061841262	184189371	/nfs/dbraw/zinc/18/93/71/184189371.db2.gz	LQYGBEWENIFHRT-UHFFFAOYSA-N	0	3	304.415	2.241	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2ccc(OC(F)F)cc2)CCCO1	ZINC000061916324	184195090	/nfs/dbraw/zinc/19/50/90/184195090.db2.gz	YBNVONLEORGPKC-RISCZKNCSA-N	0	3	300.349	2.399	10	0		DEAEHN
Cc1ccc([C@@H]([C@H](C)N)N2CCN(CC(F)(F)F)CC2)o1	ZINC000061940774	184197431	/nfs/dbraw/zinc/19/74/31/184197431.db2.gz	QMQORBULLIBWOP-WCQYABFASA-N	0	3	305.344	2.156	10	0		DEAEHN
COCCN1C(=O)CC[C@@H](N)[C@@H]1c1c(F)cccc1Cl	ZINC000062213714	184222198	/nfs/dbraw/zinc/22/21/98/184222198.db2.gz	GPFIHYJXOHVICC-BXUZGUMPSA-N	0	3	300.761	2.116	10	0		DEAEHN
CNCc1sc(N2CCn3ccnc3C2)nc1C(C)(C)C	ZINC000062328098	184231171	/nfs/dbraw/zinc/23/11/71/184231171.db2.gz	HXLILDWOGZZVRQ-UHFFFAOYSA-N	0	3	305.451	2.377	10	0		DEAEHN
COCCNCc1ccc(-n2cc(Br)cn2)cc1	ZINC000062738738	184251857	/nfs/dbraw/zinc/25/18/57/184251857.db2.gz	MYJGMOZEYOQHRT-UHFFFAOYSA-N	0	3	310.195	2.371	10	0		DEAEHN
CCCNCc1cc(OC)ccc1OCCCS(C)(=O)=O	ZINC000063014293	184266485	/nfs/dbraw/zinc/26/64/85/184266485.db2.gz	UXPXUQXZAMDXRW-UHFFFAOYSA-N	0	3	315.435	2.008	10	0		DEAEHN
CS(=O)(=O)CCCOc1ccc(Cl)cc1CNC1CC1	ZINC000063014324	184266509	/nfs/dbraw/zinc/26/65/09/184266509.db2.gz	PEVBHZHSEMPUFB-UHFFFAOYSA-N	0	3	317.838	2.406	10	0		DEAEHN
[NH3+][C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000063175826	184276588	/nfs/dbraw/zinc/27/65/88/184276588.db2.gz	GGEREEBUWAXNRJ-ZJUUUORDSA-N	0	3	309.218	2.152	10	0		DEAEHN
[NH3+][C@H]1CCC[C@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000063176011	184276674	/nfs/dbraw/zinc/27/66/74/184276674.db2.gz	OVHOBPUVVMNWEX-VHSXEESVSA-N	0	3	309.218	2.152	10	0		DEAEHN
CCN1CCN(c2ccccc2NC(=O)CN(C)C(C)C)CC1	ZINC000063501791	184283722	/nfs/dbraw/zinc/28/37/22/184283722.db2.gz	BZBKDHYZNAZPTJ-UHFFFAOYSA-N	0	3	318.465	2.107	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)Cc1cn(C)c2ncccc12	ZINC000065156015	184312778	/nfs/dbraw/zinc/31/27/78/184312778.db2.gz	CMFSOCBZPKIDMF-CQSZACIVSA-N	0	3	314.433	2.106	10	0		DEAEHN
CN(C)C(=O)CCc1ccc(NC(=O)CNC(C)(C)C)cc1	ZINC000066212443	184397166	/nfs/dbraw/zinc/39/71/66/184397166.db2.gz	ZRMNAFDDYLUITK-UHFFFAOYSA-N	0	3	305.422	2.034	10	0		DEAEHN
CCCNCc1ccc(OC)cc1OC[C@H](O)C(F)(F)F	ZINC000068877041	184498559	/nfs/dbraw/zinc/49/85/59/184498559.db2.gz	JTALRWQBGLLCNF-ZDUSSCGKSA-N	0	3	307.312	2.497	10	0		DEAEHN
CC1(C)CNCCN1c1ccccc1S(=O)(=O)C(F)(F)F	ZINC000113210626	194563873	/nfs/dbraw/zinc/56/38/73/194563873.db2.gz	AXWCVFYERSGIOV-UHFFFAOYSA-N	0	3	322.352	2.168	10	0		DEAEHN
Cn1ccc(CNC2CCC3(CC2)c2ccccc2NC3=O)n1	ZINC000536836090	284977950	/nfs/dbraw/zinc/97/79/50/284977950.db2.gz	QMZPYCNEUGTLGA-UHFFFAOYSA-N	0	3	310.401	2.342	10	0		DEAEHN
C/C(=C/C(=O)N1CCO[C@H](CN(C)C)C1)c1ccc(F)cc1	ZINC000116787317	194770387	/nfs/dbraw/zinc/77/03/87/194770387.db2.gz	LLYOSNFJEVOEQY-IVOILVROSA-N	0	3	306.381	2.018	10	0		DEAEHN
O=C1[C@H](N[C@H]2CCCc3ccccc32)CCN1C1CCOCC1	ZINC000358190448	285005238	/nfs/dbraw/zinc/00/52/38/285005238.db2.gz	NXMMTRVINIUMAN-ZWKOTPCHSA-N	0	3	314.429	2.434	10	0		DEAEHN
COc1ccccc1N1CC[C@@H](N[C@@H](C)c2cnn(C)c2)C1	ZINC000119664709	195012098	/nfs/dbraw/zinc/01/20/98/195012098.db2.gz	LJPTWPVWJAJBFV-DZGCQCFKSA-N	0	3	300.406	2.358	10	0		DEAEHN
CCCNCc1cc(S(=O)(=O)NCCC)cc(C)c1F	ZINC000159078057	197325228	/nfs/dbraw/zinc/32/52/28/197325228.db2.gz	MPEDOVACXHDDCE-UHFFFAOYSA-N	0	3	302.415	2.322	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC2CCCCC2)cc(CN)c1F	ZINC000159076859	197324736	/nfs/dbraw/zinc/32/47/36/197324736.db2.gz	UQVZUIQJLFQTSR-UHFFFAOYSA-N	0	3	300.399	2.204	10	0		DEAEHN
CCC(CC)N(C)S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159072242	197324451	/nfs/dbraw/zinc/32/44/51/197324451.db2.gz	ZJVHBMFQHYKPSY-UHFFFAOYSA-N	0	3	302.415	2.402	10	0		DEAEHN
CCCN(C)S(=O)(=O)c1cc(C)c(F)c(CNCC)c1	ZINC000159064270	197323323	/nfs/dbraw/zinc/32/33/23/197323323.db2.gz	JJGHQTSEWGBTAY-UHFFFAOYSA-N	0	3	302.415	2.274	10	0		DEAEHN
C[C@H](CNCc1ccc(F)c(Br)c1)[S@@](C)=O	ZINC000159809692	197366562	/nfs/dbraw/zinc/36/65/62/197366562.db2.gz	MXCUFABDGUYPCP-BCTVWOGZSA-N	0	3	308.216	2.445	10	0		DEAEHN
C[C@@H]([C@H](O)c1c(Br)cnn1CCN(C)C)C1CC1	ZINC000158856218	197306527	/nfs/dbraw/zinc/30/65/27/197306527.db2.gz	AURLOYXPMFCPMH-RNCFNFMXSA-N	0	3	316.243	2.287	10	0		DEAEHN
Cc1cc([C@H](CN)N(C)[C@@H]2CCOC2)ccc1Br	ZINC000158668757	197292761	/nfs/dbraw/zinc/29/27/61/197292761.db2.gz	YLBLCRCKOTTXAM-OCCSQVGLSA-N	0	3	313.239	2.478	10	0		DEAEHN
CCN[C@@H](C[C@H]1CCCO1)c1c(Br)cnn1C	ZINC000158656946	197291834	/nfs/dbraw/zinc/29/18/34/197291834.db2.gz	HXMSRDJNQPOQPE-KOLCDFICSA-N	0	3	302.216	2.402	10	0		DEAEHN
CCc1ccsc1[C@@H](O)c1c(OC)cnn1CCN(C)C	ZINC000158765388	197300437	/nfs/dbraw/zinc/30/04/37/197300437.db2.gz	RQGNKDUSINVKSZ-AWEZNQCLSA-N	0	3	309.435	2.159	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)c1ccc(C)cc1)[C@H]1CCOC1	ZINC000158725295	197297380	/nfs/dbraw/zinc/29/73/80/197297380.db2.gz	WVIDRLKQVOXQHP-HOCLYGCPSA-N	0	3	311.447	2.173	10	0		DEAEHN
CCN[C@@H](CS(=O)(=O)c1ccc(C)c(C)c1)[C@@H]1CCOC1	ZINC000158731109	197296647	/nfs/dbraw/zinc/29/66/47/197296647.db2.gz	OJNUVCHBUKRZMB-ZBFHGGJFSA-N	0	3	311.447	2.092	10	0		DEAEHN
CC(C)(C)[C@@H](NC[C@@H](O)CN1CCOCC1)c1ccc(F)cc1	ZINC000157829643	197218262	/nfs/dbraw/zinc/21/82/62/197218262.db2.gz	PFEQOABGKSXIAS-SJORKVTESA-N	0	3	324.440	2.196	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)c2ccc3nc(N)sc3c2)CCN1C	ZINC000157826261	197219089	/nfs/dbraw/zinc/21/90/89/197219089.db2.gz	MQVQJNQEKFVCQO-ONGXEEELSA-N	0	3	304.419	2.091	10	0		DEAEHN
C[C@](F)(Cc1ccc(Br)cn1)C[C@H]1COCCN1	ZINC000157601971	197201007	/nfs/dbraw/zinc/20/10/07/197201007.db2.gz	JNTLVLWCHUDFRX-STQMWFEESA-N	0	3	317.202	2.493	10	0		DEAEHN
CCNc1nc(NC[C@H]2CCCS2)nc(N2CCCC2)n1	ZINC000157651101	197204718	/nfs/dbraw/zinc/20/47/18/197204718.db2.gz	FIBUXJXTQHISPB-LLVKDONJSA-N	0	3	308.455	2.211	10	0		DEAEHN
CCCN[C@](C)(C[C@H](C)N(C)CCOC(C)C)C(=O)OC	ZINC000157519703	197193097	/nfs/dbraw/zinc/19/30/97/197193097.db2.gz	LYSJRTPJOGAICI-GOEBONIOSA-N	0	3	302.459	2.053	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@@H](C)N[C@H](C)CN1CCOCC1	ZINC000156743914	197137537	/nfs/dbraw/zinc/13/75/37/197137537.db2.gz	YHGUMSBUDQAYQY-ZIAGYGMSSA-N	0	3	308.470	2.318	10	0		DEAEHN
CCOc1ccccc1OCC(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000155607245	197070988	/nfs/dbraw/zinc/07/09/88/197070988.db2.gz	TVJMXHHEWHKMLF-LSDHHAIUSA-N	0	3	320.433	2.309	10	0		DEAEHN
CCCC1(CNC(=O)NC[C@@H](O)CN2CCCCC2)CCC1	ZINC000155317758	197042912	/nfs/dbraw/zinc/04/29/12/197042912.db2.gz	RSCOHHXJMVILIN-OAHLLOKOSA-N	0	3	311.470	2.103	10	0		DEAEHN
Cc1cc(C(=O)N2Cc3cncn3[C@@H](CN(C)C)C2)sc1C	ZINC000248112285	257109437	/nfs/dbraw/zinc/10/94/37/257109437.db2.gz	KKSSBJALEVANHP-AWEZNQCLSA-N	0	3	318.446	2.320	10	0		DEAEHN
Cc1nnc(C[C@@]23COC[C@@H]2CN(Cc2cccs2)C3)o1	ZINC000247989904	257111632	/nfs/dbraw/zinc/11/16/32/257111632.db2.gz	AEKNTLSZLVHTHK-SWLSCSKDSA-N	0	3	305.403	2.131	10	0		DEAEHN
O=C(NC1CCC1)[C@]12CCO[C@H]1CCN(Cc1ccsc1)C2	ZINC000247744058	257118476	/nfs/dbraw/zinc/11/84/76/257118476.db2.gz	PPEIANDIDOMCBS-RDJZCZTQSA-N	0	3	320.458	2.398	10	0		DEAEHN
CC1(C)Cc2cc(CN3CC[C@H](N4CCOCC4)C3)ccc2O1	ZINC000121002793	195277679	/nfs/dbraw/zinc/27/76/79/195277679.db2.gz	LKKGJQSVYUBYJI-KRWDZBQOSA-N	0	3	316.445	2.307	10	0		DEAEHN
Cc1ccc(F)cc1NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000121821076	195355839	/nfs/dbraw/zinc/35/58/39/195355839.db2.gz	MEOWFCQXBUGFTC-CQSZACIVSA-N	0	3	323.412	2.165	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C)c(F)c1	ZINC000121828300	195356636	/nfs/dbraw/zinc/35/66/36/195356636.db2.gz	AIEKAIPPKZHRSL-ZDUSSCGKSA-N	0	3	323.412	2.165	10	0		DEAEHN
CCOc1ccc(CN2CCN(C[C@@](C)(O)CC)CC2)cc1	ZINC000123254720	195561097	/nfs/dbraw/zinc/56/10/97/195561097.db2.gz	RBGZWMMMQQICKX-SFHVURJKSA-N	0	3	306.450	2.364	10	0		DEAEHN
NS(=O)(=O)CCCN[C@H]1CCCc2sc(Cl)cc21	ZINC000128186513	195943509	/nfs/dbraw/zinc/94/35/09/195943509.db2.gz	WXOUKABJUIEICY-VIFPVBQESA-N	0	3	308.856	2.047	10	0		DEAEHN
COc1ccc(CN2CCN(CCO)[C@H](C)C2)c2ccccc12	ZINC000190248819	533561012	/nfs/dbraw/zinc/56/10/12/533561012.db2.gz	OMPAIIWJVKHKLI-OAHLLOKOSA-N	0	3	314.429	2.347	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)Nc1ccc(C(N)=O)c(Cl)c1	ZINC000232952320	132554117	/nfs/dbraw/zinc/55/41/17/132554117.db2.gz	HTMDKCYVHDDARS-LBPRGKRZSA-N	0	3	309.797	2.156	10	0		DEAEHN
Cn1cc(CN2CC[C@H]3OCCC[C@H]3C2)c(-c2cccnc2)n1	ZINC000245730880	132570088	/nfs/dbraw/zinc/57/00/88/132570088.db2.gz	JTUFDYLXCROURQ-DOTOQJQBSA-N	0	3	312.417	2.483	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCC(C)(c2nc(C)no2)CC1	ZINC000357920916	133109697	/nfs/dbraw/zinc/10/96/97/133109697.db2.gz	FADBNRUNMOYUHU-CQSZACIVSA-N	0	3	320.437	2.133	10	0		DEAEHN
O=C1[C@@H](N[C@@H]2CCc3ccccc32)CCN1C1CCOCC1	ZINC000358201221	133128070	/nfs/dbraw/zinc/12/80/70/133128070.db2.gz	JKTWXPCNBJDWBP-SJORKVTESA-N	0	3	300.402	2.043	10	0		DEAEHN
CCOC(=O)C[C@@H](C)N(C)Cc1ccc(-n2ccnc2)nc1	ZINC000182666548	144919547	/nfs/dbraw/zinc/91/95/47/144919547.db2.gz	BWTXHYGDDJJUPN-CYBMUJFWSA-N	0	3	302.378	2.041	10	0		DEAEHN
C[C@@H]1CCC[C@@H]1CC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000187660479	145001838	/nfs/dbraw/zinc/00/18/38/145001838.db2.gz	XHHNQBFTAHLQLT-KURKYZTESA-N	0	3	321.509	2.441	10	0		DEAEHN
CCc1nn(C)c(CC)c1CC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000188041731	145006173	/nfs/dbraw/zinc/00/61/73/145006173.db2.gz	WIQCPWPNAUEKNS-KGLIPLIRSA-N	0	3	320.481	2.029	10	0		DEAEHN
O=C([C@H]1C[C@@H]1c1cc(F)ccc1F)N1CCN2CCC1CC2	ZINC000188617786	145014332	/nfs/dbraw/zinc/01/43/32/145014332.db2.gz	JIDIWHDOFOXGRI-HIFRSBDPSA-N	0	3	306.356	2.375	10	0		DEAEHN
O=C([C@@H]1C[C@@H]1c1cc(F)ccc1F)N1CCN2CCC1CC2	ZINC000188617836	145014513	/nfs/dbraw/zinc/01/45/13/145014513.db2.gz	JIDIWHDOFOXGRI-UKRRQHHQSA-N	0	3	306.356	2.375	10	0		DEAEHN
O=C([C@H]1C[C@H]1c1ccc(F)c(F)c1)N1CCN2CCC1CC2	ZINC000188642042	145015045	/nfs/dbraw/zinc/01/50/45/145015045.db2.gz	QOABVIUMFLNYJS-KBPBESRZSA-N	0	3	306.356	2.375	10	0		DEAEHN
Cc1oc(-c2ccco2)nc1CC(=O)N1CCN2CCC1CC2	ZINC000188649354	145015078	/nfs/dbraw/zinc/01/50/78/145015078.db2.gz	YSXWXAJYGDQWHH-UHFFFAOYSA-N	0	3	315.373	2.092	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1cc(-c2ccncc2)on1	ZINC000188740450	145016855	/nfs/dbraw/zinc/01/68/55/145016855.db2.gz	JDCAWRCVUYNWMH-UHFFFAOYSA-N	0	3	320.352	2.270	10	0		DEAEHN
O=C(c1c[nH]nc1-c1ccc(F)cc1)N1CCN2CCC1CC2	ZINC000188864467	145018808	/nfs/dbraw/zinc/01/88/08/145018808.db2.gz	KNHYNMRVNCWFOV-UHFFFAOYSA-N	0	3	314.364	2.136	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)Nc1ccc(OCCN(C)C)cc1	ZINC000188956814	145020183	/nfs/dbraw/zinc/02/01/83/145020183.db2.gz	AFFQPCJQJBQKIE-BBRMVZONSA-N	0	3	306.406	2.381	10	0		DEAEHN
Cc1oncc1CN(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000189658599	145031580	/nfs/dbraw/zinc/03/15/80/145031580.db2.gz	OGPIJAPQJQQDBR-SFHVURJKSA-N	0	3	315.417	2.052	10	0		DEAEHN
Cc1cccc2c1OCC[C@@H]2NC(=O)NC[C@@H]1CCCN1C	ZINC000190347259	145041084	/nfs/dbraw/zinc/04/10/84/145041084.db2.gz	HTMPSMDFPHGXSC-ZFWWWQNUSA-N	0	3	303.406	2.212	10	0		DEAEHN
COc1ccc(C(=O)N2CCN3CCC[C@@H]3C2)c(OC(C)C)c1	ZINC000191584386	145060946	/nfs/dbraw/zinc/06/09/46/145060946.db2.gz	YQPNNCBDBHIVTL-CQSZACIVSA-N	0	3	318.417	2.403	10	0		DEAEHN
CCc1nc(C2CCN(Cc3cccc(OC)n3)CC2)n[nH]1	ZINC000191693504	145063036	/nfs/dbraw/zinc/06/30/36/145063036.db2.gz	TTYSQEJRZDDZOD-UHFFFAOYSA-N	0	3	301.394	2.150	10	0		DEAEHN
CCc1n[nH]c(C2CCN(Cc3cccc(OC)n3)CC2)n1	ZINC000191693504	145063037	/nfs/dbraw/zinc/06/30/37/145063037.db2.gz	TTYSQEJRZDDZOD-UHFFFAOYSA-N	0	3	301.394	2.150	10	0		DEAEHN
CCc1nnc(C2CCN(Cc3cccc(OC)n3)CC2)[nH]1	ZINC000191693504	145063038	/nfs/dbraw/zinc/06/30/38/145063038.db2.gz	TTYSQEJRZDDZOD-UHFFFAOYSA-N	0	3	301.394	2.150	10	0		DEAEHN
Cn1ccnc1CC1CCN(C[C@@H]2CC3(CCC3)C(=O)O2)CC1	ZINC000192007056	145069014	/nfs/dbraw/zinc/06/90/14/145069014.db2.gz	RBWNLLBXULWMRY-HNNXBMFYSA-N	0	3	317.433	2.160	10	0		DEAEHN
Cc1csc(C2CCN(CCN3CCOC[C@@H]3C)CC2)n1	ZINC000192705784	145077741	/nfs/dbraw/zinc/07/77/41/145077741.db2.gz	YNXFCUPJKDYSAQ-AWEZNQCLSA-N	0	3	309.479	2.352	10	0		DEAEHN
c1coc(-c2ncc(CNC[C@H]3CN(C4CC4)CCO3)s2)c1	ZINC000193093394	145082575	/nfs/dbraw/zinc/08/25/75/145082575.db2.gz	VRABNVSOQXLQQE-ZDUSSCGKSA-N	0	3	319.430	2.356	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1OCCNC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000246141954	145093800	/nfs/dbraw/zinc/09/38/00/145093800.db2.gz	JONUNPZVCDKNJE-ZACQAIPSSA-N	0	3	321.465	2.237	10	0		DEAEHN
CCOCCNC(=O)CN1C[C@@H](c2ccccc2C)C[C@H]1C	ZINC000246292532	145097131	/nfs/dbraw/zinc/09/71/31/145097131.db2.gz	AKBPIDQXEACMAT-CVEARBPZSA-N	0	3	304.434	2.326	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000246441179	145102761	/nfs/dbraw/zinc/10/27/61/145102761.db2.gz	UJXPYOHURFQYGG-KCYZZUKISA-N	0	3	308.466	2.380	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N2CCC[C@@H](c3cc[nH]n3)C2)C1	ZINC000246434781	145103060	/nfs/dbraw/zinc/10/30/60/145103060.db2.gz	NLYZWYQRIDYRPW-IIAWOOMASA-N	0	3	319.453	2.027	10	0		DEAEHN
O[C@H](COc1ccccc1Cl)CN1CCN2CCCC[C@H]2C1	ZINC000246545953	145106489	/nfs/dbraw/zinc/10/64/89/145106489.db2.gz	KDZSNJVMUTXLBD-GJZGRUSLSA-N	0	3	324.852	2.250	10	0		DEAEHN
CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NCc1ccc([O-])c(F)c1	ZINC000246565442	145106943	/nfs/dbraw/zinc/10/69/43/145106943.db2.gz	ZFLRWQZYWCGJGV-KGLIPLIRSA-N	0	3	321.396	2.300	10	0		DEAEHN
CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccc([O-])c(F)c1	ZINC000246565442	145106945	/nfs/dbraw/zinc/10/69/45/145106945.db2.gz	ZFLRWQZYWCGJGV-KGLIPLIRSA-N	0	3	321.396	2.300	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1C	ZINC000246591115	145107838	/nfs/dbraw/zinc/10/78/38/145107838.db2.gz	YWPFYJWYMDAAGJ-CZUORRHYSA-N	0	3	317.433	2.087	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCO[C@@H](c3ccsc3)C2)C1	ZINC000246632330	145108855	/nfs/dbraw/zinc/10/88/55/145108855.db2.gz	OIPGEKAFAWMPRD-HUUCEWRRSA-N	0	3	323.462	2.315	10	0		DEAEHN
CCOc1ccc(OCC(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1	ZINC000246789773	145114502	/nfs/dbraw/zinc/11/45/02/145114502.db2.gz	CRSPZHOJWWZJCA-PBHICJAKSA-N	0	3	320.433	2.309	10	0		DEAEHN
Cc1ccc(F)c(OCC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000246837455	145116054	/nfs/dbraw/zinc/11/60/54/145116054.db2.gz	ATHJNYNWIDWXBQ-UONOGXRCSA-N	0	3	308.397	2.454	10	0		DEAEHN
Cc1ccc(F)c(OCC(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000246952253	145120280	/nfs/dbraw/zinc/12/02/80/145120280.db2.gz	IIWRKIKAEQXADF-ZIAGYGMSSA-N	0	3	306.381	2.208	10	0		DEAEHN
CCC1(CC)[C@H](OC)C[C@@H]1N(C)C[C@H](C)CS(C)(=O)=O	ZINC000246951417	145120386	/nfs/dbraw/zinc/12/03/86/145120386.db2.gz	NXFWVGJQCPDSRN-MELADBBJSA-N	0	3	305.484	2.193	10	0		DEAEHN
CC[C@H]1CCCCN1C(=O)CN1CCC[C@H]1Cn1ccnc1C	ZINC000247005703	145122660	/nfs/dbraw/zinc/12/26/60/145122660.db2.gz	LBAKERFAEJAZOF-IRXDYDNUSA-N	0	3	318.465	2.447	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCCN2c2nccs2)CCN1C	ZINC000247151994	145127857	/nfs/dbraw/zinc/12/78/57/145127857.db2.gz	ADLUKWCEWRJZFF-MGPQQGTHSA-N	0	3	322.478	2.053	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN([C@H](C)C(=O)N2CCCCC2)C1	ZINC000247236077	145129290	/nfs/dbraw/zinc/12/92/90/145129290.db2.gz	RUEUPRMCKCYMDT-CVEARBPZSA-N	0	3	318.465	2.483	10	0		DEAEHN
CCOCCN1CCN(C[C@@H](O)Cc2ccccc2)C[C@H]1CC	ZINC000247251241	145130703	/nfs/dbraw/zinc/13/07/03/145130703.db2.gz	UABCTPMNXYBCIV-MOPGFXCFSA-N	0	3	320.477	2.023	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000247518682	145140192	/nfs/dbraw/zinc/14/01/92/145140192.db2.gz	WMSOGDJGYFHSRF-DHXZDTOLSA-N	0	3	314.429	2.494	10	0		DEAEHN
O=C([C@@H]1C[C@H]1c1cc(F)ccc1F)N1CCN2CCC[C@H]2C1	ZINC000247517693	145140417	/nfs/dbraw/zinc/14/04/17/145140417.db2.gz	WFEUCGRNPOLRHD-KCQAQPDRSA-N	0	3	306.356	2.375	10	0		DEAEHN
COC(=O)c1coc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)c1	ZINC000248429845	145154713	/nfs/dbraw/zinc/15/47/13/145154713.db2.gz	QVDGSQGFCHHRNX-KGLIPLIRSA-N	0	3	320.389	2.154	10	0		DEAEHN
CC[C@@H]1CN(C[C@@H](O)CCc2ccccc2)CCN1CCOC	ZINC000248581080	145159249	/nfs/dbraw/zinc/15/92/49/145159249.db2.gz	OTLTVZWOJRZHPF-MOPGFXCFSA-N	0	3	320.477	2.023	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1	ZINC000248651792	145163211	/nfs/dbraw/zinc/16/32/11/145163211.db2.gz	NAROCYUJUKZADN-CABCVRRESA-N	0	3	322.453	2.039	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCC[C@H]1CCCCO1	ZINC000248734110	145165644	/nfs/dbraw/zinc/16/56/44/145165644.db2.gz	OECUYCXWRVDNNN-HZPDHXFCSA-N	0	3	311.470	2.461	10	0		DEAEHN
C[C@@H](Oc1ccccc1Cl)C(=O)N1CCN2CCC[C@H]2C1	ZINC000249835030	145191089	/nfs/dbraw/zinc/19/10/89/145191089.db2.gz	RPSCJOGAGKTFPL-OLZOCXBDSA-N	0	3	308.809	2.414	10	0		DEAEHN
COc1ccccc1[C@@H]1CNCCN1Cc1noc(C(C)C)n1	ZINC000261601324	145209367	/nfs/dbraw/zinc/20/93/67/145209367.db2.gz	AHWKAHWWTIMALY-AWEZNQCLSA-N	0	3	316.405	2.348	10	0		DEAEHN
C[C@H](C(=O)N1C[C@@H]2CCCCN2C[C@@H]1C)[C@@H](N)c1ccccc1	ZINC000261737742	145221881	/nfs/dbraw/zinc/22/18/81/145221881.db2.gz	NQEHMCIDXFYYSS-UOVPBQLFSA-N	0	3	315.461	2.408	10	0		DEAEHN
O=C(CN1CCNC[C@@H]1c1cccc(F)c1)NC1CCCCC1	ZINC000261790336	145226734	/nfs/dbraw/zinc/22/67/34/145226734.db2.gz	QBXJZOQYMLJRHP-QGZVFWFLSA-N	0	3	319.424	2.221	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)Nc1ccc2c[nH]nc2c1	ZINC000261823499	145230433	/nfs/dbraw/zinc/23/04/33/145230433.db2.gz	HOMYKGBMAMUOKU-DXCKQFNASA-N	0	3	314.389	2.034	10	0		DEAEHN
CN(C[C@H]1COc2ccccc2O1)C(=O)[C@H]1NCCCC1(C)C	ZINC000261864346	145235735	/nfs/dbraw/zinc/23/57/35/145235735.db2.gz	KRQIHGCAELIESA-XJKSGUPXSA-N	0	3	318.417	2.063	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)NCCc1cccc(F)c1	ZINC000261876651	145236987	/nfs/dbraw/zinc/23/69/87/145236987.db2.gz	LYFSNGYGWRJNLR-DAYGRLMNSA-N	0	3	320.408	2.017	10	0		DEAEHN
CN(Cc1csc2ccccc12)C(=O)C1(N)CCOCC1	ZINC000261883043	145237008	/nfs/dbraw/zinc/23/70/08/145237008.db2.gz	PMROFGBHYUIAAV-UHFFFAOYSA-N	0	3	304.415	2.368	10	0		DEAEHN
N[C@@H](C(=O)Nc1cc(C2CCCCC2)[nH]n1)C1CCOCC1	ZINC000261916761	145241466	/nfs/dbraw/zinc/24/14/66/145241466.db2.gz	YEBHJEDUOPRFBH-OAHLLOKOSA-N	0	3	306.410	2.150	10	0		DEAEHN
N[C@H](C(=O)NC[C@@H]1CCCC[C@H]1C(F)(F)F)C1CCOCC1	ZINC000261940369	145244818	/nfs/dbraw/zinc/24/48/18/145244818.db2.gz	JHRRVEQQQINXQZ-XQQFMLRXSA-N	0	3	322.371	2.225	10	0		DEAEHN
CCc1ccc(C(C)(C)CNC(=O)C2(N)CCOCC2)cc1	ZINC000261943582	145244914	/nfs/dbraw/zinc/24/49/14/145244914.db2.gz	XYCGYIIXWUHJPL-UHFFFAOYSA-N	0	3	304.434	2.151	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@H]2CN1C(=O)C[C@@H](N)c1ccccc1	ZINC000262041472	145256075	/nfs/dbraw/zinc/25/60/75/145256075.db2.gz	BYHLWYRMMOBOMR-HYVNUMGLSA-N	0	3	301.434	2.162	10	0		DEAEHN
NC1(C(=O)Nc2ccc(OC3CCCC3)cc2)CCOCC1	ZINC000262065155	145258061	/nfs/dbraw/zinc/25/80/61/145258061.db2.gz	FIGMKNZJCBSSOR-UHFFFAOYSA-N	0	3	304.390	2.454	10	0		DEAEHN
Cc1csc([C@H](C)NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)n1	ZINC000262430871	145283473	/nfs/dbraw/zinc/28/34/73/145283473.db2.gz	FVFSPKVCQPMUNZ-XSUJLISDSA-N	0	3	323.462	2.161	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)NCc1cccc(Cl)c1	ZINC000262537324	145291383	/nfs/dbraw/zinc/29/13/83/145291383.db2.gz	QMLSSGFYHNOWSA-JJRVBVJISA-N	0	3	322.836	2.489	10	0		DEAEHN
C[C@@H](O)C1CCN(C(=O)NCC(C)(C)N2CCCCC2)CC1	ZINC000304249045	145340004	/nfs/dbraw/zinc/34/00/04/145340004.db2.gz	BBGAHSOFWRBWIM-CQSZACIVSA-N	0	3	311.470	2.053	10	0		DEAEHN
Brc1cnc(CN[C@H]2CCc3nc[nH]c3C2)s1	ZINC000565333704	292154880	/nfs/dbraw/zinc/15/48/80/292154880.db2.gz	ZRPORNLWCZYBMK-ZETCQYMHSA-N	0	3	313.224	2.276	10	0		DEAEHN
Brc1cnc(CN[C@H]2CCc3[nH]cnc3C2)s1	ZINC000565333704	292154882	/nfs/dbraw/zinc/15/48/82/292154882.db2.gz	ZRPORNLWCZYBMK-ZETCQYMHSA-N	0	3	313.224	2.276	10	0		DEAEHN
O=C(N[C@@H]1CCN(C2CC2)C1)[C@@H]1C[C@H]1c1cc(F)ccc1F	ZINC000357056629	147032365	/nfs/dbraw/zinc/03/23/65/147032365.db2.gz	SLBXDLLDUJIRKH-OSAQELSMSA-N	0	3	306.356	2.421	10	0		DEAEHN
Cn1ccc([C@H](NCCN2CCCC2)c2ccc(F)cc2)n1	ZINC000359224707	147286346	/nfs/dbraw/zinc/28/63/46/147286346.db2.gz	FOCVRHOWQCFKEF-QGZVFWFLSA-N	0	3	302.397	2.334	10	0		DEAEHN
CC[C@@H](C)N[C@@H](CNC(=O)Cn1nc(C)cc1C)c1ccco1	ZINC000359536785	147346452	/nfs/dbraw/zinc/34/64/52/147346452.db2.gz	KOZSZTROZKRKQC-DOMZBBRYSA-N	0	3	318.421	2.339	10	0		DEAEHN
COCC1(C)CN(C(=O)Nc2cccc(N3CCOCC3)c2)C1	ZINC000565635919	292174055	/nfs/dbraw/zinc/17/40/55/292174055.db2.gz	KNEKUKLYBNRYBM-UHFFFAOYSA-N	0	3	319.405	2.023	10	0		DEAEHN
O=C([C@@H]1CCN(CCOc2ccc(F)cc2)C1)N1CCCC1	ZINC000370683831	148044405	/nfs/dbraw/zinc/04/44/05/148044405.db2.gz	WPZTZZMRNCOEMV-CQSZACIVSA-N	0	3	306.381	2.149	10	0		DEAEHN
O=C(NC1CCN([C@H]2CCOC2)CC1)c1ccoc1C1CC1	ZINC000374230135	148220731	/nfs/dbraw/zinc/22/07/31/148220731.db2.gz	MORGAUGGVFHQNY-AWEZNQCLSA-N	0	3	304.390	2.140	10	0		DEAEHN
Cc1nccn1CCCN1CC[C@@H](c2nc(C3CC3)no2)C1	ZINC000375463573	148375979	/nfs/dbraw/zinc/37/59/79/148375979.db2.gz	CSASPTLROYXLDU-CQSZACIVSA-N	0	3	301.394	2.332	10	0		DEAEHN
CC[C@@H]1c2ccsc2CCN1C[C@H](O)CN1CCCC1=O	ZINC000111683880	401720650	/nfs/dbraw/zinc/72/06/50/401720650.db2.gz	MNPXWTQCNWDQQA-GXTWGEPZSA-N	0	3	308.447	2.041	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NCc1ccc(C)cc1C	ZINC000111832616	401725248	/nfs/dbraw/zinc/72/52/48/401725248.db2.gz	CVOWXNZVVCEFBX-QGZVFWFLSA-N	0	3	319.449	2.213	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CC[C@H](Nc2ccccc2)C1	ZINC000074497774	401740588	/nfs/dbraw/zinc/74/05/88/401740588.db2.gz	AXWQXGQJYFMSJS-IRXDYDNUSA-N	0	3	316.449	2.367	10	0		DEAEHN
Cc1cnn(CCC(=O)N[C@H](CN(C)C)c2ccccc2)c1	ZINC000126555777	401699002	/nfs/dbraw/zinc/69/90/02/401699002.db2.gz	YVDIYHWEVATTMJ-MRXNPFEDSA-N	0	3	300.406	2.001	10	0		DEAEHN
Nc1c(Cl)cc(C(=O)N2CCN3CCC[C@@H]3C2)cc1Cl	ZINC000126643821	401703022	/nfs/dbraw/zinc/70/30/22/401703022.db2.gz	JQZISKUVMKEIGV-SNVBAGLBSA-N	0	3	314.216	2.496	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@H](Cc1ccccc1)N(C)C	ZINC000112881638	401760654	/nfs/dbraw/zinc/76/06/54/401760654.db2.gz	FUVZWEQIFNOUGK-MSOLQXFVSA-N	0	3	319.493	2.252	10	0		DEAEHN
COCCOc1cccc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000113225537	401770360	/nfs/dbraw/zinc/77/03/60/401770360.db2.gz	JDQVFEJHTQDHJE-GOEBONIOSA-N	0	3	318.417	2.021	10	0		DEAEHN
CCc1noc2ncc(C(=O)N3C[C@H]4CCCN4C[C@@H]3C)cc12	ZINC000113223918	401770574	/nfs/dbraw/zinc/77/05/74/401770574.db2.gz	NQUWQBCEFONPHT-WCQYABFASA-N	0	3	314.389	2.094	10	0		DEAEHN
COc1ccc(SCC(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1	ZINC000113226679	401770809	/nfs/dbraw/zinc/77/08/09/401770809.db2.gz	OESOVVQAXFSGEN-ZIAGYGMSSA-N	0	3	320.458	2.482	10	0		DEAEHN
Cc1nn(-c2ccccc2)cc1C(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000113229913	401771838	/nfs/dbraw/zinc/77/18/38/401771838.db2.gz	DHMFGRKHINCNFR-WMLDXEAASA-N	0	3	324.428	2.489	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)N(C)[C@@H](C)CO)c1ccccc1	ZINC000128388352	401774657	/nfs/dbraw/zinc/77/46/57/401774657.db2.gz	NYIGPUDFZIOHKX-GOEBONIOSA-N	0	3	307.438	2.092	10	0		DEAEHN
Cc1cc(C)n2c(CN3CC[C@@H](c4cnn(C)c4)C3)cnc2n1	ZINC000128451249	401777100	/nfs/dbraw/zinc/77/71/00/401777100.db2.gz	HKLZIFHRBRROIP-CQSZACIVSA-N	0	3	310.405	2.069	10	0		DEAEHN
C[C@H](NC(C)(C)CNC(=O)NCC1(C)COC1)c1ccccc1	ZINC000113622443	401784088	/nfs/dbraw/zinc/78/40/88/401784088.db2.gz	UTICEPMYWAMUIE-AWEZNQCLSA-N	0	3	319.449	2.452	10	0		DEAEHN
C[C@@H](O)CCNCc1cc(Br)cc2c1OCC2	ZINC000128789187	401791954	/nfs/dbraw/zinc/79/19/54/401791954.db2.gz	YLGFMJNMEFKSTL-SECBINFHSA-N	0	3	300.196	2.245	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2cc(Cl)cc(Cl)c2)CCO1	ZINC000116798185	401859703	/nfs/dbraw/zinc/85/97/03/401859703.db2.gz	GUYQZOJRLFTLGR-ZDUSSCGKSA-N	0	3	317.216	2.396	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)Cc2ccc3ccccc3c2)CCO1	ZINC000116796546	401859825	/nfs/dbraw/zinc/85/98/25/401859825.db2.gz	PEOBPPHKVVNOGZ-GOSISDBHSA-N	0	3	312.413	2.171	10	0		DEAEHN
CCCn1cc(CNCC2(N3CCOCC3)CCCCC2)cn1	ZINC000116912194	401864432	/nfs/dbraw/zinc/86/44/32/401864432.db2.gz	ZQRFHKOUSQTHII-UHFFFAOYSA-N	0	3	320.481	2.418	10	0		DEAEHN
C[C@H](CO)[C@H](C)NCc1cc2c(c(Br)c1)OCO2	ZINC000077423445	401815168	/nfs/dbraw/zinc/81/51/68/401815168.db2.gz	BYNJJJNKVLQFRW-BDAKNGLRSA-N	0	3	316.195	2.284	10	0		DEAEHN
CCOc1ccc(S(=O)(=O)NC[C@H](C)N(CC)CC)cc1	ZINC000032073231	401876205	/nfs/dbraw/zinc/87/62/05/401876205.db2.gz	ODZZFPYMWBXLIC-ZDUSSCGKSA-N	0	3	314.451	2.094	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCCC[C@H]1C(C)C	ZINC000117495194	401878473	/nfs/dbraw/zinc/87/84/73/401878473.db2.gz	BVDSJTAIEHRLMF-CVEARBPZSA-N	0	3	311.470	2.317	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(OC)cc1C	ZINC000118019030	401889147	/nfs/dbraw/zinc/88/91/47/401889147.db2.gz	QXIRWHLOYUNJKL-CQSZACIVSA-N	0	3	321.421	2.236	10	0		DEAEHN
COc1ccc([C@@H]2NC(=O)c3cccc4c3N2CC[C@H]4N)cc1	ZINC000034161846	401892423	/nfs/dbraw/zinc/89/24/23/401892423.db2.gz	AFSXGZYGBBFNKI-NVXWUHKLSA-N	0	3	309.369	2.347	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Cc2ccccc2OC(F)F)C1	ZINC000118333801	401895870	/nfs/dbraw/zinc/89/58/70/401895870.db2.gz	ZISUAJBZBPDSMU-ZDUSSCGKSA-N	0	3	312.360	2.431	10	0		DEAEHN
Cc1ccc(CN[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1	ZINC000035230389	401897129	/nfs/dbraw/zinc/89/71/29/401897129.db2.gz	JOCJCYBWIJPVBI-ZDUSSCGKSA-N	0	3	304.415	2.493	10	0		DEAEHN
CN(C)CCN(Cc1cccs1)C(=O)N[C@@H]1CCCOC1	ZINC000084438075	401905337	/nfs/dbraw/zinc/90/53/37/401905337.db2.gz	HFPXXOLBQYGURM-CYBMUJFWSA-N	0	3	311.451	2.000	10	0		DEAEHN
CO[C@H](C)c1cccc(NC(=O)N2CCO[C@@H](CN(C)C)C2)c1	ZINC000118816198	401909650	/nfs/dbraw/zinc/90/96/50/401909650.db2.gz	PXVSYMRWRXQSQL-CJNGLKHVSA-N	0	3	321.421	2.188	10	0		DEAEHN
CC(=O)NCCCN1CCC[C@H]1CC(=O)c1ccc(F)cc1	ZINC000134832148	401916374	/nfs/dbraw/zinc/91/63/74/401916374.db2.gz	FSTUASOGHDMLSO-INIZCTEOSA-N	0	3	306.381	2.389	10	0		DEAEHN
C[C@@](CO)(NC[C@@H]1CCCO1)c1ccc(Br)cc1	ZINC000038114609	401922994	/nfs/dbraw/zinc/92/29/94/401922994.db2.gz	ORHDUHOOOVTKFM-KBPBESRZSA-N	0	3	314.223	2.425	10	0		DEAEHN
CC1CCN(CCNC(=O)Cc2ccc(O)cc2Cl)CC1	ZINC000136165104	401961588	/nfs/dbraw/zinc/96/15/88/401961588.db2.gz	SMPNNNXZYQRFCA-UHFFFAOYSA-N	0	3	310.825	2.436	10	0		DEAEHN
C[C@H]1CCCN(CCNC(=O)Cc2ccc(O)cc2Cl)C1	ZINC000136167262	401961818	/nfs/dbraw/zinc/96/18/18/401961818.db2.gz	DQWWUOOKBQRMRM-LBPRGKRZSA-N	0	3	310.825	2.436	10	0		DEAEHN
C[C@H]1CCC[N@H+](CCNC(=O)Cc2ccc([O-])cc2Cl)C1	ZINC000136167262	401961820	/nfs/dbraw/zinc/96/18/20/401961820.db2.gz	DQWWUOOKBQRMRM-LBPRGKRZSA-N	0	3	310.825	2.436	10	0		DEAEHN
C[C@H]1CCC[N@@H+](CCNC(=O)Cc2ccc([O-])cc2Cl)C1	ZINC000136167262	401961823	/nfs/dbraw/zinc/96/18/23/401961823.db2.gz	DQWWUOOKBQRMRM-LBPRGKRZSA-N	0	3	310.825	2.436	10	0		DEAEHN
CCCN(CCC(=O)NC(C)C)C[C@@H]1COc2ccccc2O1	ZINC000046781526	401973195	/nfs/dbraw/zinc/97/31/95/401973195.db2.gz	UNURFIRGCZYQJJ-OAHLLOKOSA-N	0	3	320.433	2.453	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)NC[C@]1(C)CCCO1	ZINC000119988968	401973383	/nfs/dbraw/zinc/97/33/83/401973383.db2.gz	MRQYVPKMWAIRHY-WMZOPIPTSA-N	0	3	319.449	2.028	10	0		DEAEHN
CO[C@@H]1CC[C@@H]2OCCN(C(=O)[C@H](C)N3CCCCCC3)[C@H]2C1	ZINC000120111953	401978389	/nfs/dbraw/zinc/97/83/89/401978389.db2.gz	RKMIYUISLDAMGC-YVSFHVDLSA-N	0	3	324.465	2.046	10	0		DEAEHN
Cc1nc(CCNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)sc1C	ZINC000120696980	401999253	/nfs/dbraw/zinc/99/92/53/401999253.db2.gz	OZKLBNWRHOOGKI-BXUZGUMPSA-N	0	3	324.494	2.427	10	0		DEAEHN
C[C@@H]1CCC[C@H](NC(=O)CN2CCCN(C3CC3)CC2)[C@@H]1C	ZINC000145754346	401991723	/nfs/dbraw/zinc/99/17/23/401991723.db2.gz	MXGIERQLMWWQQY-INMHGKMJSA-N	0	3	307.482	2.097	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCCc2ccc(Cl)nc2)CCN1C	ZINC000119305393	401939775	/nfs/dbraw/zinc/93/97/75/401939775.db2.gz	XJNRHRJCCBAYGO-GXTWGEPZSA-N	0	3	324.856	2.402	10	0		DEAEHN
CN(C)CCOc1cc(CNC(=O)NCC2(C)CCC2)ccn1	ZINC000135592931	401946737	/nfs/dbraw/zinc/94/67/37/401946737.db2.gz	UIZGCJDMJUTHLA-UHFFFAOYSA-N	0	3	320.437	2.011	10	0		DEAEHN
CCn1nc(C)c(NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1C	ZINC000089480797	401949595	/nfs/dbraw/zinc/94/95/95/401949595.db2.gz	NLWUJOVRPIDZFI-BXUZGUMPSA-N	0	3	307.442	2.466	10	0		DEAEHN
CC(C)N(C)CCNS(=O)(=O)c1cccc2ccccc21	ZINC000121036324	402011897	/nfs/dbraw/zinc/01/18/97/402011897.db2.gz	IJQWQAAYRPPXBW-UHFFFAOYSA-N	0	3	306.431	2.458	10	0		DEAEHN
Cc1cccc([C@@H](O)CNC(=O)N[C@H](CC(C)C)CN(C)C)c1	ZINC000121392014	402032923	/nfs/dbraw/zinc/03/29/23/402032923.db2.gz	UQOMLDJWXOJNPY-SJORKVTESA-N	0	3	321.465	2.304	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC[C@@H]2c2ccncc2)C1	ZINC000052592768	402044193	/nfs/dbraw/zinc/04/41/93/402044193.db2.gz	XVOPTNGZAKRZRH-HZPDHXFCSA-N	0	3	302.422	2.412	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)CCOc2ccc(C)cc2)C1	ZINC000052593547	402044201	/nfs/dbraw/zinc/04/42/01/402044201.db2.gz	ZOBNMWXTFSITJA-MRXNPFEDSA-N	0	3	319.449	2.500	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N(CCO)Cc1ccccc1	ZINC000121669226	402048106	/nfs/dbraw/zinc/04/81/06/402048106.db2.gz	YMBOKAOFLPKRMA-KRWDZBQOSA-N	0	3	321.465	2.167	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](N[C@H](C(=O)NC2CC2)c2ccccc2)C1	ZINC000151843034	402060608	/nfs/dbraw/zinc/06/06/08/402060608.db2.gz	VFGACBOMCKLDIW-JLSDUUJJSA-N	0	3	315.461	2.325	10	0		DEAEHN
COC(=O)c1cccc(NC(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000150860107	402000646	/nfs/dbraw/zinc/00/06/46/402000646.db2.gz	PEHPKIVQSAXLIX-WFASDCNBSA-N	0	3	319.405	2.323	10	0		DEAEHN
c1cc2c(c(CN3CCCC[C@@H]3CN3CCOCC3)c1)OCO2	ZINC000093011355	402010382	/nfs/dbraw/zinc/01/03/82/402010382.db2.gz	HOKPUGKFFCLFIE-MRXNPFEDSA-N	0	3	318.417	2.102	10	0		DEAEHN
CCc1noc(CC)c1CNC(=O)N[C@H]1CCCN(CC)C1	ZINC000122650295	402088823	/nfs/dbraw/zinc/08/88/23/402088823.db2.gz	KWNAAWMGLAEZTR-LBPRGKRZSA-N	0	3	308.426	2.083	10	0		DEAEHN
CN1CCC(Oc2ccc(NC(=O)[C@@]3(C)CCCO3)cn2)CC1	ZINC000152990206	402120995	/nfs/dbraw/zinc/12/09/95/402120995.db2.gz	VDJWBRZSCUGHFB-QGZVFWFLSA-N	0	3	319.405	2.062	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cccnc2N2CCCC2)CCN1C	ZINC000123025240	402106581	/nfs/dbraw/zinc/10/65/81/402106581.db2.gz	GLQZYJWXLHHSDR-CABCVRRESA-N	0	3	316.449	2.237	10	0		DEAEHN
CN[C@H](C)C(=O)N[C@@H](C)c1ccc(OC)c(Br)c1	ZINC000054074378	402062644	/nfs/dbraw/zinc/06/26/44/402062644.db2.gz	NTNOCCLPMBWIDQ-DTWKUNHWSA-N	0	3	315.211	2.243	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1cccc2c1OCO2)c1ccccc1	ZINC000097496913	402126143	/nfs/dbraw/zinc/12/61/43/402126143.db2.gz	YKLYFTGOIQLWHC-HNNXBMFYSA-N	0	3	312.369	2.448	10	0		DEAEHN
C[C@H](C(=O)NCCc1cccs1)N1CC[C@H]2OCCC[C@@H]2C1	ZINC000153027014	402122728	/nfs/dbraw/zinc/12/27/28/402122728.db2.gz	JPDHYOAAVCWURF-IIAWOOMASA-N	0	3	322.474	2.296	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)Cc1cccc(O)c1	ZINC000101649926	402153327	/nfs/dbraw/zinc/15/33/27/402153327.db2.gz	VNPGOERZNJYTMJ-KRWDZBQOSA-N	0	3	312.413	2.224	10	0		DEAEHN
CC(=O)CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000103469169	402190829	/nfs/dbraw/zinc/19/08/29/402190829.db2.gz	CSXQOGIZEXQTGU-UHFFFAOYSA-N	0	3	309.797	2.365	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1)N(C)C	ZINC000154080981	402191518	/nfs/dbraw/zinc/19/15/18/402191518.db2.gz	VQQOQOIUSCWUPJ-OCCSQVGLSA-N	0	3	324.856	2.160	10	0		DEAEHN
CCN(CCNC(=O)N[C@@H](C)c1ccc2c(c1)OCO2)C1CC1	ZINC000101978152	402160134	/nfs/dbraw/zinc/16/01/34/402160134.db2.gz	JHRGDIHRLKRHCF-LBPRGKRZSA-N	0	3	319.405	2.260	10	0		DEAEHN
C[C@H]1NC(=S)N(C[C@H]2CCCCN2Cc2ccccc2)C1=O	ZINC000067507291	402161436	/nfs/dbraw/zinc/16/14/36/402161436.db2.gz	MFFDYRUZQZYPEZ-UKRRQHHQSA-N	0	3	317.458	2.146	10	0		DEAEHN
COC(=O)c1cccc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000124095124	402163892	/nfs/dbraw/zinc/16/38/92/402163892.db2.gz	PXWWMSXSSXOLRH-DOMZBBRYSA-N	0	3	304.390	2.028	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)COc1cc(C)ccc1F	ZINC000124187989	402168060	/nfs/dbraw/zinc/16/80/60/402168060.db2.gz	XHZHJXDEFWJACV-CQSZACIVSA-N	0	3	308.397	2.456	10	0		DEAEHN
CCOCCNC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000153850628	402174793	/nfs/dbraw/zinc/17/47/93/402174793.db2.gz	RUYAOVQMPGKXJP-GOSISDBHSA-N	0	3	319.449	2.377	10	0		DEAEHN
CCCN(Cc1cc(=O)n2ccccc2n1)C[C@H]1CCCCO1	ZINC000106866351	402218554	/nfs/dbraw/zinc/21/85/54/402218554.db2.gz	GSLDVTHITGPTQV-MRXNPFEDSA-N	0	3	315.417	2.476	10	0		DEAEHN
COC(=O)[C@H](NC[C@H]1CCCN1CC(C)C)c1cccnc1	ZINC000155212914	402248787	/nfs/dbraw/zinc/24/87/87/402248787.db2.gz	MVTKXDWLLGSVDW-HZPDHXFCSA-N	0	3	305.422	2.006	10	0		DEAEHN
CCc1noc(CC)c1CNC(=O)N(C)C[C@H]1CCCN1CC	ZINC000125905915	402256109	/nfs/dbraw/zinc/25/61/09/402256109.db2.gz	QWELHSGKBHLZGX-CYBMUJFWSA-N	0	3	322.453	2.425	10	0		DEAEHN
CCc1ccc(OCC(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1	ZINC000155540534	402260114	/nfs/dbraw/zinc/26/01/14/402260114.db2.gz	PYVOIPRJEGPQIN-WMLDXEAASA-N	0	3	304.434	2.473	10	0		DEAEHN
COc1cc(C)ccc1OCC(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000155610338	402262767	/nfs/dbraw/zinc/26/27/67/402262767.db2.gz	IBPALDMTRBGTPR-GJZGRUSLSA-N	0	3	320.433	2.227	10	0		DEAEHN
CN(C[C@@H]1CCN(C)C1)C(=O)c1nc(Cl)ccc1Cl	ZINC000071189312	402271116	/nfs/dbraw/zinc/27/11/16/402271116.db2.gz	RZFYUYONTSIVDA-SECBINFHSA-N	0	3	302.205	2.412	10	0		DEAEHN
CN1CCC(Oc2ccc(NC(=O)c3ccncc3)cn2)CC1	ZINC000071564906	402275774	/nfs/dbraw/zinc/27/57/74/402275774.db2.gz	JRYIQKZGCIIAOR-UHFFFAOYSA-N	0	3	312.373	2.202	10	0		DEAEHN
CC(C)N(C)CC(=O)NCc1nc2ccccc2n1C1CC1	ZINC000185103364	402324725	/nfs/dbraw/zinc/32/47/25/402324725.db2.gz	JKHMLEGAOOMWHF-UHFFFAOYSA-N	0	3	300.406	2.328	10	0		DEAEHN
O=C(NC[C@@H]1CCCCN1Cc1ccccc1)C1(O)CCC1	ZINC000184709868	402293779	/nfs/dbraw/zinc/29/37/79/402293779.db2.gz	MUCHJAYMPOPTID-INIZCTEOSA-N	0	3	302.418	2.072	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)NCCc2cc(F)ccc2F)C1	ZINC000176344124	402301774	/nfs/dbraw/zinc/30/17/74/402301774.db2.gz	LRNWELVCFCANNP-GFCCVEGCSA-N	0	3	311.376	2.148	10	0		DEAEHN
C[C@@H](c1ccccc1)[C@@](C)(O)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000176430629	402308817	/nfs/dbraw/zinc/30/88/17/402308817.db2.gz	WYKKYLTWMLBLQB-LORHWOILSA-N	0	3	318.461	2.482	10	0		DEAEHN
Cc1oc2ccccc2c1C(=O)NCCCN1CCN(C)CC1	ZINC000184944936	402311427	/nfs/dbraw/zinc/31/14/27/402311427.db2.gz	FDGNPQVEHHURHF-UHFFFAOYSA-N	0	3	315.417	2.109	10	0		DEAEHN
CCC(CC)(CNCc1cc(-c2cnn(C)c2)no1)C(=O)OC	ZINC000185041793	402319319	/nfs/dbraw/zinc/31/93/19/402319319.db2.gz	NJGOSKMOSAGCPO-UHFFFAOYSA-N	0	3	320.393	2.144	10	0		DEAEHN
CCC[C@H](N)C(=O)N1CCC([C@@H](O)c2ccc(F)cc2)CC1	ZINC000159288752	402321008	/nfs/dbraw/zinc/32/10/08/402321008.db2.gz	BGDGZGXIFMPOGF-HOTGVXAUSA-N	0	3	308.397	2.225	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1cc(C)ccc1F	ZINC000176895323	402347503	/nfs/dbraw/zinc/34/75/03/402347503.db2.gz	KZCYXUPPJIYIEQ-ZDUSSCGKSA-N	0	3	321.396	2.015	10	0		DEAEHN
COc1cccc(C(=O)N[C@@H](C)C[NH+]2CCCCCC2)c1[O-]	ZINC000185431434	402352023	/nfs/dbraw/zinc/35/20/23/402352023.db2.gz	ZZXXYFYPVYYELL-ZDUSSCGKSA-N	0	3	306.406	2.395	10	0		DEAEHN
CCc1cccc(S(=O)(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000176951556	402353547	/nfs/dbraw/zinc/35/35/47/402353547.db2.gz	ILAQVSZTONKYFI-BBRMVZONSA-N	0	3	310.463	2.256	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CNC(=O)CCC1CCCC1	ZINC000176971133	402355241	/nfs/dbraw/zinc/35/52/41/402355241.db2.gz	CQJPZYAOLJAXSI-INIZCTEOSA-N	0	3	323.481	2.016	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)NCCc1cc(F)ccc1F	ZINC000185499341	402357080	/nfs/dbraw/zinc/35/70/80/402357080.db2.gz	SZMUHFIVMWGRDQ-UHFFFAOYSA-N	0	3	311.376	2.243	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(-c2ccco2)on1	ZINC000177004956	402358822	/nfs/dbraw/zinc/35/88/22/402358822.db2.gz	PWXGDZFCYVXFIY-LBPRGKRZSA-N	0	3	303.362	2.491	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@@H](C)Cc1c(C)nn(C)c1C	ZINC000177044636	402363601	/nfs/dbraw/zinc/36/36/01/402363601.db2.gz	PPSCZMYYISXHFA-BBRMVZONSA-N	0	3	320.481	2.158	10	0		DEAEHN
O=C([C@@H]1CCCc2n[nH]cc21)N1CCCN(C2CCCC2)CC1	ZINC000177365770	402394958	/nfs/dbraw/zinc/39/49/58/402394958.db2.gz	QQSXITDYHCGOLK-OAHLLOKOSA-N	0	3	316.449	2.307	10	0		DEAEHN
COCCOCCN1CC[C@H](c2cc(OC)cc(OC)c2)C1	ZINC000177411940	402399989	/nfs/dbraw/zinc/39/99/89/402399989.db2.gz	BIERZUUYETXLTF-AWEZNQCLSA-N	0	3	309.406	2.156	10	0		DEAEHN
Cc1nn(C)c(C)c1CCNC(=O)[C@@H](C)[C@H](N)c1ccccc1	ZINC000237571762	402413599	/nfs/dbraw/zinc/41/35/99/402413599.db2.gz	LZRSJFLATHBHPQ-SJCJKPOMSA-N	0	3	314.433	2.032	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)COc2ccc3c(c2)CCCC3)C1	ZINC000162604990	402426059	/nfs/dbraw/zinc/42/60/59/402426059.db2.gz	LSIIJPZLKUHAES-MRXNPFEDSA-N	0	3	302.418	2.107	10	0		DEAEHN
O=C(c1[nH]nc2ccccc21)N1CCCN(c2ccccn2)CC1	ZINC000186439711	402431311	/nfs/dbraw/zinc/43/13/11/402431311.db2.gz	OWHFGBDXUXBGMF-UHFFFAOYSA-N	0	3	321.384	2.310	10	0		DEAEHN
Cc1cc(=O)[nH]cc1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000186472816	402433892	/nfs/dbraw/zinc/43/38/92/402433892.db2.gz	PVWHDSWTTDSTEL-DYVFJYSZSA-N	0	3	313.401	2.105	10	0		DEAEHN
Cn1c(CN2CCN(C3CCCCC3)CC2)nnc1C1CC1	ZINC000162848622	402434250	/nfs/dbraw/zinc/43/42/50/402434250.db2.gz	SMIYPYXQDSVYRQ-UHFFFAOYSA-N	0	3	303.454	2.143	10	0		DEAEHN
C[C@H](c1nc(-c2cccnc2)no1)N1CCN2CCCC[C@@H]2C1	ZINC000177777410	402435491	/nfs/dbraw/zinc/43/54/91/402435491.db2.gz	WRIDYCPGCHQRMV-UKRRQHHQSA-N	0	3	313.405	2.363	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1nc(COC)cs1	ZINC000177883071	402442347	/nfs/dbraw/zinc/44/23/47/402442347.db2.gz	VPNVYCMEVPKLEH-OLZOCXBDSA-N	0	3	324.450	2.380	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN([C@H]2CCN(C(C)C)C2=O)C1	ZINC000245469647	402463757	/nfs/dbraw/zinc/46/37/57/402463757.db2.gz	MAXACAXGTWJAQV-CABCVRRESA-N	0	3	304.438	2.092	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN([C@H](C)C(=O)N(C)C(C)C)C2)n1	ZINC000245473237	402464670	/nfs/dbraw/zinc/46/46/70/402464670.db2.gz	PUXDFTZAGUYNFQ-CVEARBPZSA-N	0	3	318.465	2.379	10	0		DEAEHN
CCOc1cc(CN2C[C@H](C(N)=O)CC[C@H]2C)ccc1OC	ZINC000245513632	402467317	/nfs/dbraw/zinc/46/73/17/402467317.db2.gz	DFDMFRLEZGGIQR-TZMCWYRMSA-N	0	3	306.406	2.180	10	0		DEAEHN
Cc1ccc(CCNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cn1	ZINC000246135505	402512497	/nfs/dbraw/zinc/51/24/97/402512497.db2.gz	JDDIWWCUWYQTFC-GOEBONIOSA-N	0	3	304.438	2.057	10	0		DEAEHN
CN(c1cccnn1)C1CCN(C[C@@H]2CCC(C)(C)O2)CC1	ZINC000186964706	402474659	/nfs/dbraw/zinc/47/46/59/402474659.db2.gz	MCGFSGYZJBYMQZ-HNNXBMFYSA-N	0	3	304.438	2.335	10	0		DEAEHN
COCCN1CCN(C[C@H](C)c2ccc(OC)cc2)C[C@@H]1C	ZINC000245650579	402476563	/nfs/dbraw/zinc/47/65/63/402476563.db2.gz	HHKKTGWKZJRMAV-HOTGVXAUSA-N	0	3	306.450	2.451	10	0		DEAEHN
CC(C)N1CCCC[C@H]1C(=O)N[C@H](C)c1nnc2n1CCCC2	ZINC000245673393	402478835	/nfs/dbraw/zinc/47/88/35/402478835.db2.gz	INRYOFNDTSRFAZ-KGLIPLIRSA-N	0	3	319.453	2.055	10	0		DEAEHN
CCC(CC)NC(=O)[C@H](C)N1CCC[C@@H]1Cn1ccnc1C	ZINC000178291102	402480432	/nfs/dbraw/zinc/48/04/32/402480432.db2.gz	ZVENWRRONOBTEM-XJKSGUPXSA-N	0	3	306.454	2.349	10	0		DEAEHN
Cc1c(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cnn1CC(C)C	ZINC000245703485	402480574	/nfs/dbraw/zinc/48/05/74/402480574.db2.gz	CTQGWRYOOPHXTI-DZGCQCFKSA-N	0	3	306.454	2.402	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2ccc(F)c(Cl)c2)C[C@H]1C	ZINC000245709977	402481421	/nfs/dbraw/zinc/48/14/21/402481421.db2.gz	FVAMBEZDMZNQCX-NEPJUHHUSA-N	0	3	300.805	2.366	10	0		DEAEHN
C[C@H](CNC(=O)NC[C@H]1CCC(C)(C)O1)N1CCC(C)CC1	ZINC000187077025	402481526	/nfs/dbraw/zinc/48/15/26/402481526.db2.gz	QJYPABCUEMTJAR-HUUCEWRRSA-N	0	3	311.470	2.364	10	0		DEAEHN
Cc1nn(C)c2ncc(CN3CCC[C@@H]3Cn3ccnc3C)cc12	ZINC000178303539	402481898	/nfs/dbraw/zinc/48/18/98/402481898.db2.gz	XWWXDJQWFVOTEC-MRXNPFEDSA-N	0	3	324.432	2.446	10	0		DEAEHN
CC(C)CCn1cccc1CN1CCN(C[C@H](C)O)[C@H](C)C1	ZINC000245786111	402488238	/nfs/dbraw/zinc/48/82/38/402488238.db2.gz	VFUDTDXKUXOYHA-SJORKVTESA-N	0	3	307.482	2.421	10	0		DEAEHN
CCCn1nc(C)c(CN2C[C@@H](C)[C@@H](N3CCOCC3)C2)c1C	ZINC000245798109	402488899	/nfs/dbraw/zinc/48/88/99/402488899.db2.gz	XKAIBTCDGKHAIF-KDOFPFPSSA-N	0	3	320.481	2.062	10	0		DEAEHN
CCCCOC(=O)CCN1CC[C@H]2[C@@H](CCC(=O)N2C2CC2)C1	ZINC000245928354	402498197	/nfs/dbraw/zinc/49/81/97/402498197.db2.gz	XXDNVZPVJGLYHG-HOCLYGCPSA-N	0	3	322.449	2.195	10	0		DEAEHN
COC[C@@H](C)CN1CCN(Cc2cc(OC)cc(OC)c2)CC1	ZINC000187425025	402500190	/nfs/dbraw/zinc/50/01/90/402500190.db2.gz	IIFMDWDRGIFBLQ-HNNXBMFYSA-N	0	3	322.449	2.104	10	0		DEAEHN
C[C@H](NC(C)(C)CNC(=O)CCCCC(N)=O)c1ccccc1	ZINC000187482282	402502281	/nfs/dbraw/zinc/50/22/81/402502281.db2.gz	MJSAUDPLMBSXNV-AWEZNQCLSA-N	0	3	319.449	2.278	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)Cc1ccccc1	ZINC000246047414	402505239	/nfs/dbraw/zinc/50/52/39/402505239.db2.gz	BYDXWZPKAGOZCW-HOTGVXAUSA-N	0	3	308.447	2.075	10	0		DEAEHN
COc1ccc2nc(N3CCN(C[C@H](C)O)[C@@H](C)C3)ccc2c1	ZINC000246092136	402509404	/nfs/dbraw/zinc/50/94/04/402509404.db2.gz	GTQAVKKSTAHOFJ-KBPBESRZSA-N	0	3	315.417	2.135	10	0		DEAEHN
CN(C)C(=O)[C@H](c1ccccc1)N1CC[C@@H]2OCCC[C@H]2C1	ZINC000246739521	402542742	/nfs/dbraw/zinc/54/27/42/402542742.db2.gz	PCAHDJYQDUUYBI-ULQDDVLXSA-N	0	3	302.418	2.317	10	0		DEAEHN
C[C@H]1OCCC[C@@H]1C(=O)N(CCN(C)C)Cc1cccc(O)c1	ZINC000189549057	402544703	/nfs/dbraw/zinc/54/47/03/402544703.db2.gz	VSYFQMAZOAMOGB-PBHICJAKSA-N	0	3	320.433	2.098	10	0		DEAEHN
CC1(C)[C@@H]2CN(CC(=O)N3CCC[C@@H](C(F)(F)F)C3)C[C@@H]21	ZINC000246936809	402550114	/nfs/dbraw/zinc/55/01/14/402550114.db2.gz	QOMUNFUPWBMJBB-UTUOFQBUSA-N	0	3	304.356	2.375	10	0		DEAEHN
Cc1cc(C)cc(OC[C@H](O)CN2CCN3CCCC[C@@H]3C2)c1	ZINC000178973067	402560546	/nfs/dbraw/zinc/56/05/46/402560546.db2.gz	SMQLJNPDELQLPY-QZTJIDSGSA-N	0	3	318.461	2.213	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1coc(Br)c1	ZINC000247234077	402560611	/nfs/dbraw/zinc/56/06/11/402560611.db2.gz	MTVMKWNLLXGJLW-KOLCDFICSA-N	0	3	313.195	2.351	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1c(Cl)nc2ccccn21	ZINC000247313732	402563617	/nfs/dbraw/zinc/56/36/17/402563617.db2.gz	OFLKTOZYRCDGJK-RYUDHWBXSA-N	0	3	318.808	2.296	10	0		DEAEHN
COc1ccccc1/C(C)=C/C(=O)N1CCN2CCC[C@H]2C1	ZINC000171192551	402565421	/nfs/dbraw/zinc/56/54/21/402565421.db2.gz	PAESVMQMIJHZSI-ZQHYZAEZSA-N	0	3	300.402	2.405	10	0		DEAEHN
Cc1nc(C)n(C[C@H]2CCCN(C[C@@H](O)c3ccccc3)C2)n1	ZINC000247397482	402566101	/nfs/dbraw/zinc/56/61/01/402566101.db2.gz	XZHWRJYVZGSIBB-FUHWJXTLSA-N	0	3	314.433	2.341	10	0		DEAEHN
OCCC1(CNCc2cnc3ccc(Br)cn23)CC1	ZINC000189991105	402568945	/nfs/dbraw/zinc/56/89/45/402568945.db2.gz	DEBKRTMNIFFIOO-UHFFFAOYSA-N	0	3	324.222	2.349	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)[C@H]1CCOc2ccccc21	ZINC000247538414	402571802	/nfs/dbraw/zinc/57/18/02/402571802.db2.gz	YECHKHWNRWYYFC-FMKPAKJESA-N	0	3	300.402	2.248	10	0		DEAEHN
COc1cc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc(OC)c1C	ZINC000247559547	402572138	/nfs/dbraw/zinc/57/21/38/402572138.db2.gz	ZXXLPMYFNMEIJJ-DOMZBBRYSA-N	0	3	318.417	2.321	10	0		DEAEHN
CC(C)c1ccccc1OC[C@H](O)CN(C)CC1(CO)CC1	ZINC000190041665	402572800	/nfs/dbraw/zinc/57/28/00/402572800.db2.gz	HTVQDDJPGQVHPR-OAHLLOKOSA-N	0	3	307.434	2.254	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)c2n[nH]c3c2CCCCC3)[C@@H](C)C1	ZINC000188194357	402516473	/nfs/dbraw/zinc/51/64/73/402516473.db2.gz	HZVXNLPMXXQUQM-WFASDCNBSA-N	0	3	304.438	2.137	10	0		DEAEHN
CO[C@H]1CN(Cc2cn(C)nc2-c2cccnc2)CC[C@H]1C	ZINC000188298320	402518765	/nfs/dbraw/zinc/51/87/65/402518765.db2.gz	QCIKNQVDNLBTKY-CJNGLKHVSA-N	0	3	300.406	2.339	10	0		DEAEHN
CCN(CC)C(=O)[C@@H](c1ccccc1)N1CCN2CCC[C@H]2C1	ZINC000246258016	402521733	/nfs/dbraw/zinc/52/17/33/402521733.db2.gz	FYHIYKZILKTDDY-ZWKOTPCHSA-N	0	3	315.461	2.376	10	0		DEAEHN
CCC[C@H](C(=O)NCc1cc(OC)c(OC)cc1OC)N(C)C	ZINC000178655926	402522077	/nfs/dbraw/zinc/52/20/77/402522077.db2.gz	KJHGOMQFUVTHIW-CYBMUJFWSA-N	0	3	324.421	2.059	10	0		DEAEHN
COCC[C@H](C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179144940	402575960	/nfs/dbraw/zinc/57/59/60/402575960.db2.gz	XZDPQHLIPFIURC-CWRNSKLLSA-N	0	3	305.422	2.156	10	0		DEAEHN
CCCN(CC)c1ccc(C(=O)NC[C@@H]2CCCN2C)cn1	ZINC000171275582	402573610	/nfs/dbraw/zinc/57/36/10/402573610.db2.gz	MFBHYQGNASTVFZ-HNNXBMFYSA-N	0	3	304.438	2.142	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H](C)Oc2ccc(F)cc2)C1	ZINC000246307693	402524119	/nfs/dbraw/zinc/52/41/19/402524119.db2.gz	NMXBPVRJAKDTCG-ZFWWWQNUSA-N	0	3	323.412	2.377	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)Nc2nnc(C(F)F)s2)C1	ZINC000246362388	402527512	/nfs/dbraw/zinc/52/75/12/402527512.db2.gz	IMHBDZYACUAPNA-HTQZYQBOSA-N	0	3	319.381	2.326	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)C1CCN(CCOCC(F)F)CC1	ZINC000188964084	402529061	/nfs/dbraw/zinc/52/90/61/402529061.db2.gz	WOSXHZVHGHNWHC-LBPRGKRZSA-N	0	3	306.397	2.141	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NC[C@H](O)C1CCCCC1	ZINC000170840175	402531967	/nfs/dbraw/zinc/53/19/67/402531967.db2.gz	YQUJCJSZPDCVBY-HOTGVXAUSA-N	0	3	313.486	2.203	10	0		DEAEHN
CCOCCC1(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)CC1	ZINC000246483822	402533468	/nfs/dbraw/zinc/53/34/68/402533468.db2.gz	GDOZBXDKMZDREL-LSDHHAIUSA-N	0	3	311.470	2.317	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)COc2ccc(F)cc2Cl)C1	ZINC000170859835	402533710	/nfs/dbraw/zinc/53/37/10/402533710.db2.gz	FABLIOOXJTZOOA-LLVKDONJSA-N	0	3	300.761	2.020	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cnn(-c3cccc(Cl)c3)c2)C1	ZINC000170864810	402534966	/nfs/dbraw/zinc/53/49/66/402534966.db2.gz	IETYHGJXKXWZNM-OAHLLOKOSA-N	0	3	318.808	2.302	10	0		DEAEHN
O=C(c1ccccc1OCC1CC1)N1CCN2CCC[C@@H]2C1	ZINC000171279106	402574133	/nfs/dbraw/zinc/57/41/33/402574133.db2.gz	YRBJKEYNHWFOSY-OAHLLOKOSA-N	0	3	300.402	2.396	10	0		DEAEHN
CCOCCN1CCN(Cc2cccc(OC)n2)C[C@@H]1CC	ZINC000171828716	402626523	/nfs/dbraw/zinc/62/65/23/402626523.db2.gz	RCLAVNBQQREUSU-INIZCTEOSA-N	0	3	307.438	2.023	10	0		DEAEHN
O=C(/C=C/c1ccc(Cl)nc1)N1CCCN(C2CC2)CC1	ZINC000179216286	402581760	/nfs/dbraw/zinc/58/17/60/402581760.db2.gz	WNTRFZVLHPAMKE-XVNBXDOJSA-N	0	3	305.809	2.445	10	0		DEAEHN
C[C@@H]1CN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)CCS1	ZINC000171429952	402587071	/nfs/dbraw/zinc/58/70/71/402587071.db2.gz	RSFRYGRTVUCZAK-GDBMZVCRSA-N	0	3	321.490	2.306	10	0		DEAEHN
CCCN(CCC)C(=O)CCCC(=O)N1CCN2CCC[C@H]2C1	ZINC000171470945	402588724	/nfs/dbraw/zinc/58/87/24/402588724.db2.gz	JPJUINRHVKAIGP-INIZCTEOSA-N	0	3	323.481	2.112	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2cc(F)cc(OC)c2)C1	ZINC000179463474	402590779	/nfs/dbraw/zinc/59/07/79/402590779.db2.gz	ULOSHCAPXLCTFE-AWEZNQCLSA-N	0	3	309.385	2.118	10	0		DEAEHN
Cc1nc(C)n(C[C@@H]2CCCN(Cc3cnn4ccccc34)C2)n1	ZINC000179530852	402593509	/nfs/dbraw/zinc/59/35/09/402593509.db2.gz	LONRWUCRQQGIPL-MRXNPFEDSA-N	0	3	324.432	2.455	10	0		DEAEHN
CC(C)(CNC(=O)N1CCCN(C2CC2)CC1)c1ccncc1	ZINC000179536565	402593581	/nfs/dbraw/zinc/59/35/81/402593581.db2.gz	NDRYYVIFCWFMPY-UHFFFAOYSA-N	0	3	316.449	2.239	10	0		DEAEHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)N[C@H]1CCCOC1	ZINC000171610684	402601433	/nfs/dbraw/zinc/60/14/33/402601433.db2.gz	VFUPQBUXXATPSZ-KRWDZBQOSA-N	0	3	319.449	2.459	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(Cc2csnn2)C1	ZINC000190468428	402603578	/nfs/dbraw/zinc/60/35/78/402603578.db2.gz	URNSRIBZJXYHIE-LBPRGKRZSA-N	0	3	323.491	2.257	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@H](C)N2CCN3CCC[C@@H]3C2)c(F)c1	ZINC000171640413	402605065	/nfs/dbraw/zinc/60/50/65/402605065.db2.gz	GBJVUHJTBMQMSG-ZIAGYGMSSA-N	0	3	305.397	2.241	10	0		DEAEHN
C[C@H](c1ccc(F)cc1)N(C)C(=O)CN1CCN2CCC[C@@H]2C1	ZINC000171641225	402605084	/nfs/dbraw/zinc/60/50/84/402605084.db2.gz	IFBLTKNAWBICKX-RHSMWYFYSA-N	0	3	319.424	2.125	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](C)c1ccccc1)N1CCN2CCC[C@@H]2C1	ZINC000171641025	402605290	/nfs/dbraw/zinc/60/52/90/402605290.db2.gz	BENTYPUMPWCUCO-ZMSDIMECSA-N	0	3	301.434	2.032	10	0		DEAEHN
CCC(CC)N1C[C@@H](C(=O)NCCN2CCCC[C@H]2C)CC1=O	ZINC000248743584	402606610	/nfs/dbraw/zinc/60/66/10/402606610.db2.gz	CDOWFMVMFSSYBX-CABCVRRESA-N	0	3	323.481	2.014	10	0		DEAEHN
CCC(CC)N1C[C@H](C(=O)NCCN2CCCC[C@H]2C)CC1=O	ZINC000248743588	402606662	/nfs/dbraw/zinc/60/66/62/402606662.db2.gz	CDOWFMVMFSSYBX-HUUCEWRRSA-N	0	3	323.481	2.014	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@](C)(OC)c2ccccc2F)C1	ZINC000248846197	402611290	/nfs/dbraw/zinc/61/12/90/402611290.db2.gz	RUCKTAKWJJOCGI-GUYCJALGSA-N	0	3	308.397	2.288	10	0		DEAEHN
COc1ccc(OCCCN2CCC[C@@H](n3cncn3)C2)cc1	ZINC000171703544	402612224	/nfs/dbraw/zinc/61/22/24/402612224.db2.gz	IZPPGZYYPRSKAD-OAHLLOKOSA-N	0	3	316.405	2.393	10	0		DEAEHN
C[C@@H](CC(=O)Nc1cccc(F)c1)NCC1(C)OCCCO1	ZINC000190650767	402615945	/nfs/dbraw/zinc/61/59/45/402615945.db2.gz	XEMCSFNJEVMHBM-LBPRGKRZSA-N	0	3	310.369	2.286	10	0		DEAEHN
CCC[C@H](CC)NC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000180437161	402616863	/nfs/dbraw/zinc/61/68/63/402616863.db2.gz	QDQSZLWAFPCUDZ-IRXDYDNUSA-N	0	3	324.513	2.377	10	0		DEAEHN
CN(Cc1cccnc1)C[C@H]1CCN(C(=O)NC2CCCC2)C1	ZINC000190678873	402617648	/nfs/dbraw/zinc/61/76/48/402617648.db2.gz	LXIUGVXXIIRDEN-MRXNPFEDSA-N	0	3	316.449	2.488	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)NC(C)C)C1	ZINC000190676129	402617913	/nfs/dbraw/zinc/61/79/13/402617913.db2.gz	ZDBWHTYGZQZWSL-ZDUSSCGKSA-N	0	3	310.467	2.323	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)N[C@@H]1CCOc2ccc(F)cc21	ZINC000171759651	402619309	/nfs/dbraw/zinc/61/93/09/402619309.db2.gz	QGJROKRHGXYITQ-GXTWGEPZSA-N	0	3	307.369	2.043	10	0		DEAEHN
CC[C@](C)(O)CN(C)C[C@H](c1cccs1)N1CCOCC1	ZINC000249086371	402620123	/nfs/dbraw/zinc/62/01/23/402620123.db2.gz	FMDDEWRKSZWLRS-ZBFHGGJFSA-N	0	3	312.479	2.214	10	0		DEAEHN
Cc1nc(C)c(CCNC(=O)N2CCCN(C3CC3)CC2)s1	ZINC000171767444	402620357	/nfs/dbraw/zinc/62/03/57/402620357.db2.gz	HYEVJWLDOKYWBF-UHFFFAOYSA-N	0	3	322.478	2.182	10	0		DEAEHN
C[C@@H](NCC(=O)NCC1CCC1)c1cccc(-n2ccnc2)c1	ZINC000180662394	402622808	/nfs/dbraw/zinc/62/28/08/402622808.db2.gz	FAMNNMCVIFVUOQ-CQSZACIVSA-N	0	3	312.417	2.439	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@H](C)N(C)c2ccccc2)C1	ZINC000249756855	402640677	/nfs/dbraw/zinc/64/06/77/402640677.db2.gz	IDERMVVXMQGHCL-JKSUJKDBSA-N	0	3	318.465	2.295	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)N[C@H](c2ccccc2)C2CC2)CCO1	ZINC000172118668	402641386	/nfs/dbraw/zinc/64/13/86/402641386.db2.gz	FHMAXBSIQQNWRW-DLBZAZTESA-N	0	3	317.433	2.110	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)C1CCN(CCc2cccnc2)CC1	ZINC000172158562	402642878	/nfs/dbraw/zinc/64/28/78/402642878.db2.gz	TYWRZAVGFWTVNL-HNNXBMFYSA-N	0	3	303.450	2.497	10	0		DEAEHN
CC(C)[C@H](C)C(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000172222952	402645833	/nfs/dbraw/zinc/64/58/33/402645833.db2.gz	RSMOSYTVRXTHFP-HNNXBMFYSA-N	0	3	318.465	2.084	10	0		DEAEHN
COC(=O)c1cccc(OCCN2[C@@H](C)CC(O)C[C@@H]2C)c1	ZINC000191160666	402647035	/nfs/dbraw/zinc/64/70/35/402647035.db2.gz	CINZZVXKHOLYQV-STQMWFEESA-N	0	3	307.390	2.086	10	0		DEAEHN
Cc1ccc(OC2CCN(C(=O)CN(C)C(C)C)CC2)nc1	ZINC000181565576	402650490	/nfs/dbraw/zinc/65/04/90/402650490.db2.gz	VJMOIMJSYANCBR-UHFFFAOYSA-N	0	3	305.422	2.100	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccccc2N(C)C)CCN1C[C@@H](C)O	ZINC000173677396	402708210	/nfs/dbraw/zinc/70/82/10/402708210.db2.gz	LHGNNMACVCARJM-NVXWUHKLSA-N	0	3	305.466	2.030	10	0		DEAEHN
O=C(CN1CC[C@H]2[C@@H](CCCN2C2CC2)C1)Nc1nccs1	ZINC000252692395	402660812	/nfs/dbraw/zinc/66/08/12/402660812.db2.gz	BGXJZWWQMWENNP-JSGCOSHPSA-N	0	3	320.462	2.030	10	0		DEAEHN
C[C@H](C(=O)Nc1c(F)cccc1F)N1CCCN(C2CC2)CC1	ZINC000172541147	402661646	/nfs/dbraw/zinc/66/16/46/402661646.db2.gz	VKYZZLTYJDFVOE-GFCCVEGCSA-N	0	3	323.387	2.462	10	0		DEAEHN
Cc1ccccc1CNC(=O)[C@@H](C)N1CCCN(C2CC2)CC1	ZINC000172543556	402662150	/nfs/dbraw/zinc/66/21/50/402662150.db2.gz	SFZRRQIBWCWEFO-MRXNPFEDSA-N	0	3	315.461	2.170	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)c2snnc2C(C)(C)C)C1	ZINC000191457493	402671349	/nfs/dbraw/zinc/67/13/49/402671349.db2.gz	WVGFVPGZCLYSLB-VXGBXAGGSA-N	0	3	322.478	2.392	10	0		DEAEHN
COCCN1CCN(CCCOCc2ccccc2)C[C@@H]1C	ZINC000182341584	402682527	/nfs/dbraw/zinc/68/25/27/402682527.db2.gz	QEZIJVSSMAZNMT-KRWDZBQOSA-N	0	3	306.450	2.246	10	0		DEAEHN
CN1CC[C@H]2[C@H](CCCN2C(=O)NCCc2ccsc2)C1	ZINC000182350002	402682770	/nfs/dbraw/zinc/68/27/70/402682770.db2.gz	FHUUSOOKMDZRLZ-CABCVRRESA-N	0	3	307.463	2.416	10	0		DEAEHN
CN(C[C@H]1CCCN(C)C1)C(=O)c1snnc1C(C)(C)C	ZINC000191956513	402700565	/nfs/dbraw/zinc/70/05/65/402700565.db2.gz	VJBMQUCAIXKUGB-NSHDSACASA-N	0	3	310.467	2.249	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)c1ncc(F)cc1F	ZINC000191957559	402700770	/nfs/dbraw/zinc/70/07/70/402700770.db2.gz	WZIDLBCNRSYYQW-AWEZNQCLSA-N	0	3	319.355	2.263	10	0		DEAEHN
C[C@@H]1C[NH2+]CC[C@H]1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000262765622	402730743	/nfs/dbraw/zinc/73/07/43/402730743.db2.gz	KRVKJDNMSNXDNF-PRHODGIISA-N	0	3	323.245	2.270	10	0		DEAEHN
CC[C@@H](C)NC(=O)CN[C@H](C)c1ccccc1-n1cccn1	ZINC000183156371	402743250	/nfs/dbraw/zinc/74/32/50/402743250.db2.gz	NVDPPLCQFRBJNJ-ZIAGYGMSSA-N	0	3	300.406	2.438	10	0		DEAEHN
C[C@H](CN[C@H](C)c1ccccc1-n1cccn1)CS(C)(=O)=O	ZINC000183164944	402744101	/nfs/dbraw/zinc/74/41/01/402744101.db2.gz	SIACWIIYCNHBMW-ZIAGYGMSSA-N	0	3	321.446	2.204	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(CCc2cc(Cl)cs2)n1	ZINC000263231573	402747780	/nfs/dbraw/zinc/74/77/80/402747780.db2.gz	NMGBJPRETYJHHD-LLVKDONJSA-N	0	3	312.826	2.146	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@]23CCCc2ccccc23)n1	ZINC000263228123	402747795	/nfs/dbraw/zinc/74/77/95/402747795.db2.gz	NCCNIDAIPYIBES-FCEWJHQRSA-N	0	3	324.428	2.407	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(C(C)(C)c2cccc(F)c2)n1	ZINC000263271385	402752583	/nfs/dbraw/zinc/75/25/83/402752583.db2.gz	SEHNYUDMINDVFA-ZDUSSCGKSA-N	0	3	304.369	2.111	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2ccc(OC3CCC3)cc2)n1	ZINC000263295476	402755382	/nfs/dbraw/zinc/75/53/82/402755382.db2.gz	WGHMCAPSDQXZFQ-HNNXBMFYSA-N	0	3	314.389	2.244	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC[C@H]2CCCN2CC(C)C)c(C)o1	ZINC000183326784	402757207	/nfs/dbraw/zinc/75/72/07/402757207.db2.gz	ZODMEBQTYLNTFC-CQSZACIVSA-N	0	3	314.451	2.295	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@]2(C)CCc3ccccc3C2)n1	ZINC000263316724	402757835	/nfs/dbraw/zinc/75/78/35/402757835.db2.gz	ZNQQNEMVVPYUSU-CRAIPNDOSA-N	0	3	312.417	2.092	10	0		DEAEHN
Cc1nc(C)c(CCNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)s1	ZINC000174804620	402758044	/nfs/dbraw/zinc/75/80/44/402758044.db2.gz	VWLFWBRBHMTZPZ-RISCZKNCSA-N	0	3	324.494	2.427	10	0		DEAEHN
Cc1cc(COCC(=O)N(CCN(C)C)C2CCCCC2)on1	ZINC000193518945	402771667	/nfs/dbraw/zinc/77/16/67/402771667.db2.gz	ZXEXNIXPCUPRCV-UHFFFAOYSA-N	0	3	323.437	2.223	10	0		DEAEHN
CCNC(=O)c1ccc(NC(=O)N[C@H]2CCCN(CC)C2)cc1	ZINC000194344641	402793424	/nfs/dbraw/zinc/79/34/24/402793424.db2.gz	UDTAWLLEIYFHQG-HNNXBMFYSA-N	0	3	318.421	2.042	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)NCc1cccc(C)c1	ZINC000175334139	402797837	/nfs/dbraw/zinc/79/78/37/402797837.db2.gz	AIXIYHCPAVFMNM-KRWDZBQOSA-N	0	3	303.450	2.027	10	0		DEAEHN
CC1(C)CN(C(=O)Cc2ccc(Br)s2)CCN1	ZINC000175396724	402803276	/nfs/dbraw/zinc/80/32/76/402803276.db2.gz	FCTUXVFTRNRTER-UHFFFAOYSA-N	0	3	317.252	2.264	10	0		DEAEHN
C[C@H](CC1CCCCC1)NC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000194621920	402805802	/nfs/dbraw/zinc/80/58/02/402805802.db2.gz	YFCABZAZVONBMY-ZBFHGGJFSA-N	0	3	311.470	2.317	10	0		DEAEHN
Cc1cc(C)cc(OC[C@H](O)CN2CCCN(C3CC3)CC2)c1	ZINC000195339200	402842965	/nfs/dbraw/zinc/84/29/65/402842965.db2.gz	TXCOQZFWRYHFEC-GOSISDBHSA-N	0	3	318.461	2.213	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000175477733	402810167	/nfs/dbraw/zinc/81/01/67/402810167.db2.gz	KTJSRKMMRZWZNK-HUUCEWRRSA-N	0	3	321.469	2.163	10	0		DEAEHN
CC(C)C(=O)Nc1ccc(C(=O)NC[C@@H]2CCCN2C)cc1	ZINC000194705464	402811813	/nfs/dbraw/zinc/81/18/13/402811813.db2.gz	MRHWTKIJVGMGJZ-HNNXBMFYSA-N	0	3	303.406	2.105	10	0		DEAEHN
C[C@@H]1CN(CCC2CCN(C(=O)NC3CC3)CC2)C[C@H](C)O1	ZINC000175621124	402822093	/nfs/dbraw/zinc/82/20/93/402822093.db2.gz	UIBFNHLMRBVQFS-OKILXGFUSA-N	0	3	309.454	2.070	10	0		DEAEHN
Cn1c2ccc(CN3CCN(CC4CC4)CC3)cc2sc1=O	ZINC000194991931	402825487	/nfs/dbraw/zinc/82/54/87/402825487.db2.gz	MXPSWECRECRQTC-UHFFFAOYSA-N	0	3	317.458	2.128	10	0		DEAEHN
COC(=O)C[C@@H]1CCCN1Cc1ccc2c(c1)sc(=O)n2C	ZINC000195031477	402827923	/nfs/dbraw/zinc/82/79/23/402827923.db2.gz	CUBMUXICCZFZOI-LBPRGKRZSA-N	0	3	320.414	2.128	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@H](C)Oc2ccc(F)c(F)c2)C1	ZINC000195309217	402840906	/nfs/dbraw/zinc/84/09/06/402840906.db2.gz	XPFYLDRFHHVWDF-NEPJUHHUSA-N	0	3	312.360	2.333	10	0		DEAEHN
Cc1nn(-c2ccccc2)c(C)c1C(=O)N1CCN2CCC[C@H]2C1	ZINC000195311138	402841588	/nfs/dbraw/zinc/84/15/88/402841588.db2.gz	IJGWZOSWEFLLQD-KRWDZBQOSA-N	0	3	324.428	2.409	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCc1cccc2c1OCO2	ZINC000194152631	402786378	/nfs/dbraw/zinc/78/63/78/402786378.db2.gz	KYNAQYKEPDERHN-CQSZACIVSA-N	0	3	321.421	2.191	10	0		DEAEHN
O=C(COc1ccc(F)cc1Cl)N1CCN2CCC[C@H]2C1	ZINC000195318061	402841776	/nfs/dbraw/zinc/84/17/76/402841776.db2.gz	PGAZYTXQDICLGI-LBPRGKRZSA-N	0	3	312.772	2.165	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2ncc(-c3cccc(F)c3)o2)CCO1	ZINC000175205452	402787897	/nfs/dbraw/zinc/78/78/97/402787897.db2.gz	BKUVRQXBMKWUAF-HNNXBMFYSA-N	0	3	319.380	2.243	10	0		DEAEHN
CNC(=O)[C@@H](NCCC(=O)Nc1cccc(Cl)c1)C(C)C	ZINC000183679717	402788113	/nfs/dbraw/zinc/78/81/13/402788113.db2.gz	SCRAZBJVXFUSCE-AWEZNQCLSA-N	0	3	311.813	2.029	10	0		DEAEHN
Cc1nccn1-c1ccc([C@H](C)NCC(=O)N2CCCC2)cc1	ZINC000183681226	402788194	/nfs/dbraw/zinc/78/81/94/402788194.db2.gz	RIMUHKNDPZMWFF-AWEZNQCLSA-N	0	3	312.417	2.454	10	0		DEAEHN
Cc1cn(-c2ccccc2)nc1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000184471929	402845974	/nfs/dbraw/zinc/84/59/74/402845974.db2.gz	ICJRFRODSKUZMW-MRXNPFEDSA-N	0	3	310.401	2.101	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000176004946	402847156	/nfs/dbraw/zinc/84/71/56/402847156.db2.gz	AKLMZVIBFXVDAK-UONOGXRCSA-N	0	3	305.422	2.424	10	0		DEAEHN
CCCCNC(=O)CN1CC[C@H](CNc2cccc(C)n2)C1	ZINC000195516111	402849778	/nfs/dbraw/zinc/84/97/78/402849778.db2.gz	BVNHCMRWKMIRMB-OAHLLOKOSA-N	0	3	304.438	2.040	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N(C)C[C@@H]2CCCN(C)C2)cc1	ZINC000278964612	402890932	/nfs/dbraw/zinc/89/09/32/402890932.db2.gz	GYVHCODEMGZEPP-OAHLLOKOSA-N	0	3	317.433	2.083	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1Nc1cn[nH]c(=O)c1Cl	ZINC000274128247	403029555	/nfs/dbraw/zinc/02/95/55/403029555.db2.gz	DQDTWUJPTJNRMX-BXUZGUMPSA-N	0	3	318.808	2.356	10	0		DEAEHN
CN(c1cc(Cl)nc(N)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000268494362	403088269	/nfs/dbraw/zinc/08/82/69/403088269.db2.gz	PTPHGYRPVHZVGJ-ZDUSSCGKSA-N	0	3	317.824	2.423	10	0		DEAEHN
CC(=O)N(C[C@@H]1CCCN1C[C@@H](O)c1ccc(F)cc1)C1CC1	ZINC000276339563	403165694	/nfs/dbraw/zinc/16/56/94/403165694.db2.gz	HBVVFFODJDKDDQ-ZWKOTPCHSA-N	0	3	320.408	2.334	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@@H]1NCc1ccc(Br)cc1F	ZINC000282262641	403137609	/nfs/dbraw/zinc/13/76/09/403137609.db2.gz	HCIXSCSNBCVYAX-PELKAZGASA-N	0	3	315.186	2.345	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)c2ncnc3c2ncn3C2CC2)CCN1C	ZINC000292665057	403374310	/nfs/dbraw/zinc/37/43/10/403374310.db2.gz	HKPMGIKHCCZAAZ-AAEUAGOBSA-N	0	3	300.410	2.080	10	0		DEAEHN
Cc1cc(N2C[C@@H]3OCCN(C)[C@H]3C2)c2cc(F)ccc2n1	ZINC000301717892	403668665	/nfs/dbraw/zinc/66/86/65/403668665.db2.gz	OGCUVRDVLSXOSR-IRXDYDNUSA-N	0	3	301.365	2.202	10	0		DEAEHN
CCc1ncnc(N2CC[C@H](OCCN3CCCCC3)C2)c1F	ZINC000301953555	403704801	/nfs/dbraw/zinc/70/48/01/403704801.db2.gz	JUVHFESZLNLNFQ-AWEZNQCLSA-N	0	3	322.428	2.259	10	0		DEAEHN
O=C(Nc1ccc2c(c1)CNCC2)N1CCc2cc[nH]c(=O)c2C1	ZINC000333273559	403712776	/nfs/dbraw/zinc/71/27/76/403712776.db2.gz	GMDRZZOJMGXFBH-UHFFFAOYSA-N	0	3	324.384	2.023	10	0		DEAEHN
c1ncc(N2CCN3CCC2CC3)nc1OC1CCCCC1	ZINC000302781059	403725132	/nfs/dbraw/zinc/72/51/32/403725132.db2.gz	RQPWPUJTFMPQPM-UHFFFAOYSA-N	0	3	302.422	2.473	10	0		DEAEHN
NCc1cccnc1NC(=O)N1CCOC2(C1)CCCCCC2	ZINC000333351054	403731847	/nfs/dbraw/zinc/73/18/47/403731847.db2.gz	RKWUYNFZBNLGLF-UHFFFAOYSA-N	0	3	318.421	2.497	10	0		DEAEHN
C[C@H]1CC[C@@H](NC(=O)N2CCOC3(CNC3)C2)c2ccccc21	ZINC000333454511	403755238	/nfs/dbraw/zinc/75/52/38/403755238.db2.gz	YAWPGRLLVHBUCB-XJKSGUPXSA-N	0	3	315.417	2.009	10	0		DEAEHN
c1ccc2c(c1)CO[C@]21CCCN(CCCN2CCOCC2)C1	ZINC000369011528	403937769	/nfs/dbraw/zinc/93/77/69/403937769.db2.gz	ULUKZKJBQGSMDH-IBGZPJMESA-N	0	3	316.445	2.230	10	0		DEAEHN
Cc1cccc(S(=O)(=O)[N-]C2(C[NH3+])CCCCC2)c1F	ZINC000313214377	403979081	/nfs/dbraw/zinc/97/90/81/403979081.db2.gz	YUSOTXDBISPXEF-UHFFFAOYSA-N	0	3	300.399	2.074	10	0		DEAEHN
CCn1nccc1CCN1C[C@@H](O)C[C@H]1c1ccc(F)cc1	ZINC000338569244	404409611	/nfs/dbraw/zinc/40/96/11/404409611.db2.gz	HSXMQAAJBKFNPH-IRXDYDNUSA-N	0	3	303.381	2.393	10	0		DEAEHN
O=C1[C@@H](N[C@H]2CCCc3ccccc32)CCN1C1CCOCC1	ZINC000358190446	404756197	/nfs/dbraw/zinc/75/61/97/404756197.db2.gz	NXMMTRVINIUMAN-ROUUACIJSA-N	0	3	314.429	2.434	10	0		DEAEHN
CC(C)(C)OC(=O)c1ccc(CNCCNC(=O)C2CC2)cc1	ZINC000360967220	404864383	/nfs/dbraw/zinc/86/43/83/404864383.db2.gz	VZOOZTCURBTFHU-UHFFFAOYSA-N	0	3	318.417	2.258	10	0		DEAEHN
CCC(C)(C)CCN1CCN(c2ccnc(N(C)C)n2)CC1	ZINC000435053856	404954057	/nfs/dbraw/zinc/95/40/57/404954057.db2.gz	WYVFQGQKSOBSOS-UHFFFAOYSA-N	0	3	305.470	2.491	10	0		DEAEHN
NC(=O)CC[C@H]1CCCN(Cc2ccc(-c3cc[nH]n3)o2)C1	ZINC000435136165	404959004	/nfs/dbraw/zinc/95/90/04/404959004.db2.gz	YZMRCABZXAYFQI-GFCCVEGCSA-N	0	3	302.378	2.147	10	0		DEAEHN
CC(=O)c1cccc(CN2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)c1	ZINC000451304287	404948341	/nfs/dbraw/zinc/94/83/41/404948341.db2.gz	ODWNJHKNECWAIX-KZNAEPCWSA-N	0	3	303.402	2.251	10	0		DEAEHN
COCCCN(C)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000179264239	292331655	/nfs/dbraw/zinc/33/16/55/292331655.db2.gz	MDXAECCBIPIIEY-HOTGVXAUSA-N	0	3	305.422	2.110	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)c2ncccc2N)CN1Cc1ccccc1	ZINC000398036984	405059750	/nfs/dbraw/zinc/05/97/50/405059750.db2.gz	JDVQFNVVSRRDKK-UKRRQHHQSA-N	0	3	310.401	2.057	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ncccc1N	ZINC000398032042	405060558	/nfs/dbraw/zinc/06/05/58/405060558.db2.gz	GYWMUSRNFALGGQ-PBHICJAKSA-N	0	3	324.428	2.304	10	0		DEAEHN
CC(=O)[C@](C)(O)CN1CCC(CCc2ccc(O)cc2)CC1	ZINC000568355530	292332951	/nfs/dbraw/zinc/33/29/51/292332951.db2.gz	FAAJKYVDHFVPDB-GOSISDBHSA-N	0	3	305.418	2.377	10	0		DEAEHN
COC(=O)c1ccc(C)c(NC(=O)CC2CCN(C)CC2)c1O	ZINC000436702648	405126067	/nfs/dbraw/zinc/12/60/67/405126067.db2.gz	DMNPJQQFNJLRGH-UHFFFAOYSA-N	0	3	320.389	2.158	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)Nc1cccc([S@](C)=O)c1	ZINC000408296961	405165597	/nfs/dbraw/zinc/16/55/97/405165597.db2.gz	FBPHBXOCUJOMBQ-OQQHHNTDSA-N	0	3	321.446	2.124	10	0		DEAEHN
O=C(Nc1c[nH]nc1[C@H]1CCCN(CCCO)C1)C1CCCC1	ZINC000368033336	405219673	/nfs/dbraw/zinc/21/96/73/405219673.db2.gz	FPSWNBNWWDUVOL-AWEZNQCLSA-N	0	3	320.437	2.100	10	0		DEAEHN
Cc1ccc2[nH]c(C(=O)NCCNc3ccncc3)cc2c1C	ZINC000439039214	405263391	/nfs/dbraw/zinc/26/33/91/405263391.db2.gz	LEFNNDYUPIYOMT-UHFFFAOYSA-N	0	3	308.385	2.444	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000454623333	405373593	/nfs/dbraw/zinc/37/35/93/405373593.db2.gz	ANSAUNQORVOFNA-ZDUSSCGKSA-N	0	3	322.453	2.465	10	0		DEAEHN
O[C@H](COC[C@H]1CCCO1)CN1CCC=C(c2ccccc2)C1	ZINC000556506002	405486081	/nfs/dbraw/zinc/48/60/81/405486081.db2.gz	SORQBDZVIGSERC-RBUKOAKNSA-N	0	3	317.429	2.332	10	0		DEAEHN
CS(=O)(=O)[C@H]1CCC[C@@H](NCc2ccc(-c3cc[nH]n3)o2)C1	ZINC000577816116	405517585	/nfs/dbraw/zinc/51/75/85/405517585.db2.gz	GAGWYPYHKLHPKA-YPMHNXCESA-N	0	3	323.418	2.115	10	0		DEAEHN
Cc1cc(CCNC(=O)NC[C@H](C)N2CCCC[C@H]2C)on1	ZINC000557777807	405628371	/nfs/dbraw/zinc/62/83/71/405628371.db2.gz	UWZPVRKAUTYTFJ-KGLIPLIRSA-N	0	3	308.426	2.088	10	0		DEAEHN
COC(=O)C(C)(C)N1CCN(C[C@H](C)c2ccccc2)CC1	ZINC000494385523	405687843	/nfs/dbraw/zinc/68/78/43/405687843.db2.gz	KRGOWPVWLCRTNH-HNNXBMFYSA-N	0	3	304.434	2.359	10	0		DEAEHN
CC(=O)[C@](C)(O)CN1CCN(Cc2ccccc2)[C@@H](C(C)C)C1	ZINC000528643052	405695700	/nfs/dbraw/zinc/69/57/00/405695700.db2.gz	ZAICCXDYYYSHSA-RTBURBONSA-N	0	3	318.461	2.169	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N[C@H]2C[C@H]([NH+](C)C)C2(C)C)cc1[O-]	ZINC000636090500	405731785	/nfs/dbraw/zinc/73/17/85/405731785.db2.gz	GOABVOMIKMLJHF-GJZGRUSLSA-N	0	3	304.390	2.053	10	0		DEAEHN
Cc1cc(NC(=O)NC[C@H]2C[C@@H]2C)n(C2CCN(C)CC2)n1	ZINC000531189474	405923012	/nfs/dbraw/zinc/92/30/12/405923012.db2.gz	BIJKJYCUYYOEDY-WCQYABFASA-N	0	3	305.426	2.236	10	0		DEAEHN
COc1cccc2c1CCN(CCOC[C@@H]1CCCO1)CC2	ZINC000562333954	405986913	/nfs/dbraw/zinc/98/69/13/405986913.db2.gz	FJYCXLHHSYJZFH-INIZCTEOSA-N	0	3	305.418	2.291	10	0		DEAEHN
C[C@@H]1CCN(CCNC(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC000562402855	406003311	/nfs/dbraw/zinc/00/33/11/406003311.db2.gz	FZGXJBFQXPMEKW-GFCCVEGCSA-N	0	3	303.381	2.389	10	0		DEAEHN
c1c2c(nnc1N1CCCC1)CCN(CCC[C@@H]1CCO1)C2	ZINC000639341743	406056734	/nfs/dbraw/zinc/05/67/34/406056734.db2.gz	ZWGKYPNHQATIAT-OAHLLOKOSA-N	0	3	302.422	2.004	10	0		DEAEHN
CC(C)N(C)CC(=O)N1CCC[C@@H](CC(=O)OC(C)(C)C)C1	ZINC000532379332	406072023	/nfs/dbraw/zinc/07/20/23/406072023.db2.gz	HMLRRNNTYYGDIK-AWEZNQCLSA-N	0	3	312.454	2.297	10	0		DEAEHN
c1nc2n(n1)[C@H](CN1CCC[C@]3(C1)OCc1ccccc13)CC2	ZINC000639593872	406160577	/nfs/dbraw/zinc/16/05/77/406160577.db2.gz	WVJJUTRSYLLYHS-MAUKXSAKSA-N	0	3	310.401	2.287	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@H]1CCCc2sccc21	ZINC000533817857	406163558	/nfs/dbraw/zinc/16/35/58/406163558.db2.gz	LIQCEZZITIWHTJ-AWEZNQCLSA-N	0	3	301.415	2.213	10	0		DEAEHN
C(c1noc(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)n1)C1CC1	ZINC000639543746	406138792	/nfs/dbraw/zinc/13/87/92/406138792.db2.gz	OUOFUCJGWRDUKS-ZBFHGGJFSA-N	0	3	316.449	2.471	10	0		DEAEHN
CC(C)N1CCCN(C(=O)c2cccc3ccc(=O)[nH]c32)CC1	ZINC000568134548	406195596	/nfs/dbraw/zinc/19/55/96/406195596.db2.gz	DBIXFYPDKAQCRM-UHFFFAOYSA-N	0	3	313.401	2.497	10	0		DEAEHN
CSC[C@H](O)CN1CCC[C@H](CC(=O)OC(C)(C)C)C1	ZINC000548296160	406497382	/nfs/dbraw/zinc/49/73/82/406497382.db2.gz	WCVJKUZQOXZADF-CHWSQXEVSA-N	0	3	303.468	2.154	10	0		DEAEHN
c1ccc(OCCN2CCN(CCC[C@@H]3CCO3)CC2)cc1	ZINC000637867432	406454046	/nfs/dbraw/zinc/45/40/46/406454046.db2.gz	ILQBROIKAPEWNJ-GOSISDBHSA-N	0	3	304.434	2.252	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N1CCCc2ccccc21	ZINC000637869388	406455014	/nfs/dbraw/zinc/45/50/14/406455014.db2.gz	VCPANHUINLAINY-GOSISDBHSA-N	0	3	323.440	2.425	10	0		DEAEHN
CC(C)[C@@H]1CCCCN1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638001146	406517942	/nfs/dbraw/zinc/51/79/42/406517942.db2.gz	OXSKPSRMIGVPCT-MSOLQXFVSA-N	0	3	317.477	2.483	10	0		DEAEHN
C1CCN([C@H]2CCN(c3nnc(C4CCOCC4)s3)C2)C1	ZINC000549489290	406586316	/nfs/dbraw/zinc/58/63/16/406586316.db2.gz	VLDBRILIQFOIPJ-ZDUSSCGKSA-N	0	3	308.451	2.107	10	0		DEAEHN
CCC(C)(C)[C@@H](C)NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638408509	406754541	/nfs/dbraw/zinc/75/45/41/406754541.db2.gz	ZJSNRFFSIDMTOV-GDBMZVCRSA-N	0	3	305.466	2.387	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)N2CCC(C3CCOCC3)CC2)CCN1C	ZINC000554587493	406814582	/nfs/dbraw/zinc/81/45/82/406814582.db2.gz	ARXMABWECISCFK-PBHICJAKSA-N	0	3	323.481	2.317	10	0		DEAEHN
Brc1cccc(-c2noc([C@@H]3CNCCOC3)n2)c1	ZINC000644511192	407133082	/nfs/dbraw/zinc/13/30/82/407133082.db2.gz	FFBNAEBCYIBJOO-SNVBAGLBSA-N	0	3	324.178	2.203	10	0		DEAEHN
CC(=O)CCN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000129385941	196044312	/nfs/dbraw/zinc/04/43/12/196044312.db2.gz	OLOVMUAICALUAY-UHFFFAOYSA-N	0	3	300.402	2.267	10	0		DEAEHN
CC(C)(CN[C@@H]1CCc2sc(Cl)cc21)NS(C)(=O)=O	ZINC000129666675	196066057	/nfs/dbraw/zinc/06/60/57/196066057.db2.gz	SSMWVMCTKIASTL-SECBINFHSA-N	0	3	322.883	2.306	10	0		DEAEHN
CN(Cc1ccc(F)c(Br)c1)C[C@H]1CNCCO1	ZINC000131057961	196135506	/nfs/dbraw/zinc/13/55/06/196135506.db2.gz	FDFXEFBJZMGRDW-LLVKDONJSA-N	0	3	317.202	2.008	10	0		DEAEHN
CN(Cc1ccc(F)c(Br)c1)C[C@@H]1CNCCO1	ZINC000131057712	196135855	/nfs/dbraw/zinc/13/58/55/196135855.db2.gz	FDFXEFBJZMGRDW-NSHDSACASA-N	0	3	317.202	2.008	10	0		DEAEHN
CCN[C@H](C)c1cccc(S(=O)(=O)NC[C@@H](C)OCC)c1	ZINC000131229843	196152498	/nfs/dbraw/zinc/15/24/98/196152498.db2.gz	CMAVAVVKOGXHNJ-CHWSQXEVSA-N	0	3	314.451	2.060	10	0		DEAEHN
COc1ccc2c(N)c(C(=O)NC[C@H](C)N(C)C)sc2c1	ZINC000131247888	196153188	/nfs/dbraw/zinc/15/31/88/196153188.db2.gz	KMIRWHKBJZOZCX-VIFPVBQESA-N	0	3	307.419	2.172	10	0		DEAEHN
C[C@@H](CN(C)C)N1C(=O)C2(CCCC2)N[C@H]1c1cccs1	ZINC000131648864	196186796	/nfs/dbraw/zinc/18/67/96/196186796.db2.gz	YPBRUAAYBFEXKP-GXTWGEPZSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCNc1nc(NCC[C@@H](C)SC)nc(N2CCCC2)n1	ZINC000131671770	196190151	/nfs/dbraw/zinc/19/01/51/196190151.db2.gz	HCNBIXWSDJCEFT-LLVKDONJSA-N	0	3	310.471	2.457	10	0		DEAEHN
CCN[C@H](C)c1ccc(O[C@H]2CCS(=O)(=O)C2)c(F)c1	ZINC000131750781	196196032	/nfs/dbraw/zinc/19/60/32/196196032.db2.gz	DVFYNSLASQNICH-PWSUYJOCSA-N	0	3	301.383	2.062	10	0		DEAEHN
NC1(C(=O)Nc2ccc(OC(F)(F)F)cc2)CCOCC1	ZINC000132062604	196222818	/nfs/dbraw/zinc/22/28/18/196222818.db2.gz	HDDQLFJMLHSGPH-UHFFFAOYSA-N	0	3	304.268	2.032	10	0		DEAEHN
CCCn1nc(C)c(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1C	ZINC000132179538	196233841	/nfs/dbraw/zinc/23/38/41/196233841.db2.gz	UJBDBCSHGZNPIC-IUODEOHRSA-N	0	3	306.454	2.465	10	0		DEAEHN
C[C@@H]1CNC[C@H](COCc2cccc(F)c2Br)O1	ZINC000132495191	196259167	/nfs/dbraw/zinc/25/91/67/196259167.db2.gz	OXTFFPOEXQSJRV-MWLCHTKSSA-N	0	3	318.186	2.482	10	0		DEAEHN
C[C@@H]1CNC[C@H](COCc2ccc(Br)cc2F)O1	ZINC000132703284	196277453	/nfs/dbraw/zinc/27/74/53/196277453.db2.gz	OGJDLLQLAPFXAI-BXKDBHETSA-N	0	3	318.186	2.482	10	0		DEAEHN
CCN[C@H](C[C@H]1CCCN(S(C)(=O)=O)C1)c1occc1C	ZINC000133190727	196319736	/nfs/dbraw/zinc/31/97/36/196319736.db2.gz	GANNZJBDVUVLLB-ZIAGYGMSSA-N	0	3	314.451	2.300	10	0		DEAEHN
C[C@@H](NCCc1cc(F)cc(F)c1)C(=O)NCC(F)(F)F	ZINC000133823362	196338891	/nfs/dbraw/zinc/33/88/91/196338891.db2.gz	FIKMAYFMGYOQFV-MRVPVSSYSA-N	0	3	310.266	2.164	10	0		DEAEHN
C[C@H](NCCc1cc(F)cc(F)c1)C(=O)NCC(F)(F)F	ZINC000133823165	196338925	/nfs/dbraw/zinc/33/89/25/196338925.db2.gz	FIKMAYFMGYOQFV-QMMMGPOBSA-N	0	3	310.266	2.164	10	0		DEAEHN
CCN[C@H](c1c(Br)cnn1C)[C@@H]1CCO[C@@H]1C	ZINC000133862992	196341091	/nfs/dbraw/zinc/34/10/91/196341091.db2.gz	CSPIATZILCEYFZ-KKZNHRDASA-N	0	3	302.216	2.258	10	0		DEAEHN
NCc1ccc(-c2nn3c(nnc3C3CCCC3)s2)nc1	ZINC000134030807	196354887	/nfs/dbraw/zinc/35/48/87/196354887.db2.gz	JFRDAMNPVUEZAK-UHFFFAOYSA-N	0	3	300.391	2.364	10	0		DEAEHN
N[C@@H](Cc1ccc(Cl)cc1F)[C@@H]1CCCCS1(=O)=O	ZINC000134222695	196372231	/nfs/dbraw/zinc/37/22/31/196372231.db2.gz	LGYXDICJTJWYQH-STQMWFEESA-N	0	3	305.802	2.316	10	0		DEAEHN
Cc1ccn(-c2ccccc2NC(=O)N2CC[C@H](N(C)C)C2)n1	ZINC000151228474	196651117	/nfs/dbraw/zinc/65/11/17/196651117.db2.gz	OZHMAVWRSAZZLG-AWEZNQCLSA-N	0	3	313.405	2.349	10	0		DEAEHN
CCS(=O)(=O)N1CC(CNc2cc(C)nc3ccccc32)C1	ZINC000302521598	230282791	/nfs/dbraw/zinc/28/27/91/230282791.db2.gz	BVGAKXOTLFFKJM-UHFFFAOYSA-N	0	3	319.430	2.237	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)c1ccc2c(c1)OCCCO2	ZINC000046860219	424822112	/nfs/dbraw/zinc/82/21/12/424822112.db2.gz	WHDPYMGSQNDICM-AWEZNQCLSA-N	0	3	318.417	2.452	10	0		DEAEHN
Cc1cc(NC(=O)N[C@H](CN(C)C)c2ccccc2)n(C)n1	ZINC000043434520	424811696	/nfs/dbraw/zinc/81/16/96/424811696.db2.gz	DGQDALQCBBDIGH-CQSZACIVSA-N	0	3	301.394	2.153	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)Nc2ccc(C)cc2F)c1	ZINC000105881658	424849335	/nfs/dbraw/zinc/84/93/35/424849335.db2.gz	GKMKABGSKTZWOO-ZDUSSCGKSA-N	0	3	304.369	2.256	10	0		DEAEHN
COc1ccc(CCC(=O)N2CCN3CCC[C@H]3C2)cc1F	ZINC000195323559	424882338	/nfs/dbraw/zinc/88/23/38/424882338.db2.gz	PKLSOLLITSUGEK-AWEZNQCLSA-N	0	3	306.381	2.074	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1nc(C)c(C)s1	ZINC000177560007	424863545	/nfs/dbraw/zinc/86/35/45/424863545.db2.gz	ZKSWXZZOTKNCTJ-ZDUSSCGKSA-N	0	3	310.467	2.386	10	0		DEAEHN
Cc1cc(Br)ccc1CNC1COCCOC1	ZINC000395171667	424920488	/nfs/dbraw/zinc/92/04/88/424920488.db2.gz	DBYRVYVQPHYNPF-UHFFFAOYSA-N	0	3	300.196	2.263	10	0		DEAEHN
O[C@]1(CCNCc2cccc(F)c2Br)CCOC1	ZINC000404197244	424925984	/nfs/dbraw/zinc/92/59/84/424925984.db2.gz	PSFUTDIEEXTMLC-CYBMUJFWSA-N	0	3	318.186	2.219	10	0		DEAEHN
CNc1ncc(C(=O)NC[C@H]2CCCN2C2CCCCC2)s1	ZINC000373839300	424888027	/nfs/dbraw/zinc/88/80/27/424888027.db2.gz	NCIYDHYIWGHFCI-CYBMUJFWSA-N	0	3	322.478	2.712	10	0		DEAEHN
CNC(=O)[C@@H](NCCOc1ccc(F)cc1Cl)C(C)C	ZINC000183638329	267628782	/nfs/dbraw/zinc/62/87/82/267628782.db2.gz	JZMXQAFIZMQAOW-ZDUSSCGKSA-N	0	3	302.777	2.218	10	0		DEAEHN
O=C(NCCC1=CCCCCC1)NC[C@H](O)CN1CCCCC1	ZINC000185265198	267644493	/nfs/dbraw/zinc/64/44/93/267644493.db2.gz	ZRBBKSOGZYQACB-KRWDZBQOSA-N	0	3	323.481	2.413	10	0		DEAEHN
CC1(CC(=O)NCC2(O)CCN(Cc3ccccc3)CC2)CC1	ZINC000401300805	269112197	/nfs/dbraw/zinc/11/21/97/269112197.db2.gz	KRAMFQYKGQIUBU-UHFFFAOYSA-N	0	3	316.445	2.320	10	0		DEAEHN
CO[C@@H]1CN([C@H](C)C(=O)N2CCc3ccccc3C2)CC[C@H]1C	ZINC000251525387	274066609	/nfs/dbraw/zinc/06/66/09/274066609.db2.gz	CXPRUWLDSXWYMT-IIDMSEBBSA-N	0	3	316.445	2.317	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)Nc2cc(C)cc(C)c2)c1	ZINC000105881638	274830204	/nfs/dbraw/zinc/83/02/04/274830204.db2.gz	DLXGJWIOWQTOQD-OAHLLOKOSA-N	0	3	300.406	2.425	10	0		DEAEHN
O=C([C@@H]1COc2ccc(Cl)cc2C1)N1CCN2CCC[C@H]2C1	ZINC000249825363	275006284	/nfs/dbraw/zinc/00/62/84/275006284.db2.gz	JUDCAEKZPOSTTK-ZFWWWQNUSA-N	0	3	320.820	2.198	10	0		DEAEHN
c1ccc2c(c1)CC[C@H](CN1CCN(c3cccnn3)CC1)C2	ZINC000359603892	275069880	/nfs/dbraw/zinc/06/98/80/275069880.db2.gz	CLWJXQWPFIPQJC-INIZCTEOSA-N	0	3	308.429	2.404	10	0		DEAEHN
CC(C)c1ccc([C@H](C)N[C@@H](C)C(=O)N2CCNC2=O)cc1	ZINC000067127589	275748077	/nfs/dbraw/zinc/74/80/77/275748077.db2.gz	NZBBQCQUDLERIV-STQMWFEESA-N	0	3	303.406	2.401	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(-n3cccn3)cc2)C1	ZINC000246424355	277155672	/nfs/dbraw/zinc/15/56/72/277155672.db2.gz	ARNCWOWBZVZXLE-FUHWJXTLSA-N	0	3	324.428	2.429	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@H]2CNCCC2(F)F)c2ccccc2C1	ZINC000423481287	278057493	/nfs/dbraw/zinc/05/74/93/278057493.db2.gz	NZELBEIEUOTMPC-HOTGVXAUSA-N	0	3	323.387	2.067	10	0		DEAEHN
C[C@H](C1CC1)N(C(=O)CN1CC[C@@H]2OCCC[C@H]2C1)C1CC1	ZINC000246565089	278160195	/nfs/dbraw/zinc/16/01/95/278160195.db2.gz	HKHJPBFVELLBBH-KMFMINBZSA-N	0	3	306.450	2.277	10	0		DEAEHN
C[C@H](CN1CCCC[C@@H]1[C@H]1CCCC[C@H]1O)CS(C)(=O)=O	ZINC000368269122	278188792	/nfs/dbraw/zinc/18/87/92/278188792.db2.gz	FDWBLXGISSKIAZ-KLHDSHLOSA-N	0	3	317.495	2.073	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NC[C@@]1(C)CCCC[C@@H]1O	ZINC000178563333	279127502	/nfs/dbraw/zinc/12/75/02/279127502.db2.gz	MQVCRHQYLWPNSZ-HLLBOEOZSA-N	0	3	313.486	2.203	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1n[nH]c2c1CCCCC2	ZINC000190272109	279133233	/nfs/dbraw/zinc/13/32/33/279133233.db2.gz	SIYMIAOYOWJQMP-CYBMUJFWSA-N	0	3	306.454	2.385	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1C(=O)[C@@H]1CCCc2[nH]ncc21	ZINC000134469611	279173599	/nfs/dbraw/zinc/17/35/99/279173599.db2.gz	PSVZJJAJZDHBTI-ZIAGYGMSSA-N	0	3	313.405	2.026	10	0		DEAEHN
C[C@H](C(=O)N1CCCC[C@H]1c1nc[nH]n1)[C@H](N)c1ccccc1	ZINC000245776963	279193597	/nfs/dbraw/zinc/19/35/97/279193597.db2.gz	YFYSXOINBMRISR-QEJZJMRPSA-N	0	3	313.405	2.194	10	0		DEAEHN
C[C@H]1Oc2ccc(NC(=O)[C@H]3NCCCC3(C)C)cc2NC1=O	ZINC000261935758	280080227	/nfs/dbraw/zinc/08/02/27/280080227.db2.gz	TZMVBYGCISIQII-QMTHXVAHSA-N	0	3	317.389	2.123	10	0		DEAEHN
Cc1c(C(=O)N2CCCC[C@@H](N3CCCC3)C2)nnn1C(C)C	ZINC000328801629	280204784	/nfs/dbraw/zinc/20/47/84/280204784.db2.gz	AJIOGUBPGXOFRL-OAHLLOKOSA-N	0	3	319.453	2.258	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cnc2onc(C)c2c1	ZINC000174973822	281194078	/nfs/dbraw/zinc/19/40/78/281194078.db2.gz	MCRAFMGVPCHSBB-UONOGXRCSA-N	0	3	314.389	2.230	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NCc1cscn1)c1ccccc1	ZINC000051749756	281471436	/nfs/dbraw/zinc/47/14/36/281471436.db2.gz	CWWRFLQNNUXCAL-CQSZACIVSA-N	0	3	304.419	2.245	10	0		DEAEHN
Cc1ncc(CNCC[C@@H](C)[S@](C)=O)n1-c1ccccc1	ZINC000129317700	281909379	/nfs/dbraw/zinc/90/93/79/281909379.db2.gz	GMESAEGRBBTVBC-LRTDBIEQSA-N	0	3	305.447	2.427	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)N1C[C@H](N(C)C)Cc2ccccc21	ZINC000191536813	288865760	/nfs/dbraw/zinc/86/57/60/288865760.db2.gz	JSVZSLOPWSWHTG-IMJJTQAJSA-N	0	3	302.418	2.321	10	0		DEAEHN
C[C@@]1(C(N)=O)CCCCN1CCC(=O)Nc1cccc(Cl)c1	ZINC000185922736	289155432	/nfs/dbraw/zinc/15/54/32/289155432.db2.gz	ADACWYJPTKRZRR-INIZCTEOSA-N	0	3	323.824	2.399	10	0		DEAEHN
Cc1csc(NC(=O)CN[C@@H]2CCCC[C@H]2n2cccn2)n1	ZINC000129106661	293041805	/nfs/dbraw/zinc/04/18/05/293041805.db2.gz	WPIXXQCZULNZCP-CHWSQXEVSA-N	0	3	319.434	2.360	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cn(C)nc1C(C)(C)C	ZINC000092472525	300314830	/nfs/dbraw/zinc/31/48/30/300314830.db2.gz	BFKMRVNXJPJNGD-QWHCGFSZSA-N	0	3	304.438	2.026	10	0		DEAEHN
Cc1c(C(=O)N2CC[C@H](N(C)C)C2)[nH]c2c1C(=O)CC(C)(C)C2	ZINC000170858311	300930789	/nfs/dbraw/zinc/93/07/89/300930789.db2.gz	YBHVOEMYGPUCFD-LBPRGKRZSA-N	0	3	317.433	2.254	10	0		DEAEHN
CCCN1CCC(CNS(=O)(=O)CCc2ccccc2)CC1	ZINC000171098406	325717211	/nfs/dbraw/zinc/71/72/11/325717211.db2.gz	AENOJOOQLBHEKC-UHFFFAOYSA-N	0	3	324.490	2.271	10	0		DEAEHN
O=c1ccccn1Cc1ccc(CNCC2=CCCOC2)cc1	ZINC000176830778	325750676	/nfs/dbraw/zinc/75/06/76/325750676.db2.gz	VPDXPTBRCFGHDV-UHFFFAOYSA-N	0	3	310.397	2.333	10	0		DEAEHN
CN1CCC(O)(CNCc2ccsc2Br)CC1	ZINC000397501372	337266809	/nfs/dbraw/zinc/26/68/09/337266809.db2.gz	AIUKPVUHKQHDCV-UHFFFAOYSA-N	0	3	319.268	2.057	10	0		DEAEHN
O=C(NC[C@@H]1CCCCN1C1CC1)c1cccc2nccnc21	ZINC000584564037	337363048	/nfs/dbraw/zinc/36/30/48/337363048.db2.gz	LIVXXXYVDCCSIL-AWEZNQCLSA-N	0	3	310.401	2.377	10	0		DEAEHN
COc1cccc([C@@H]2[C@H](N[C@H]3CCNC3=O)CCN2C2CC2)c1	ZINC000328721879	533759876	/nfs/dbraw/zinc/75/98/76/533759876.db2.gz	XDQZAHKDOYQLOG-IXDOHACOSA-N	0	3	315.417	2.291	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000247272958	519785151	/nfs/dbraw/zinc/78/51/51/519785151.db2.gz	JYSYQGFIXGHARH-UONOGXRCSA-N	0	3	305.422	2.327	10	0		DEAEHN
CCO[C@@H]1C[C@](N)(C(=O)N[C@H](CC)c2nccs2)C1(C)C	ZINC000249112390	520453010	/nfs/dbraw/zinc/45/30/10/520453010.db2.gz	NEUFZBRCMQEDNR-HFAKWTLXSA-N	0	3	311.451	2.243	10	0		DEAEHN
CCOc1ccc(OCCN2CCC(n3cncn3)CC2)cc1	ZINC000156592167	521172487	/nfs/dbraw/zinc/17/24/87/521172487.db2.gz	QLABPUOIRMESFV-UHFFFAOYSA-N	0	3	316.405	2.393	10	0		DEAEHN
CCOc1ccccc1OCC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000124247765	521558440	/nfs/dbraw/zinc/55/84/40/521558440.db2.gz	NJAMYNDNTHNMDQ-HUUCEWRRSA-N	0	3	320.433	2.405	10	0		DEAEHN
CCCn1nc(C)c(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1C	ZINC000246424393	521666633	/nfs/dbraw/zinc/66/66/33/521666633.db2.gz	JXYNLWSDKMIEIA-DOMZBBRYSA-N	0	3	306.454	2.368	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)N(C)[C@H]1CCCN(c2ccccc2)C1=O	ZINC000246567887	521826149	/nfs/dbraw/zinc/82/61/49/521826149.db2.gz	UVKMUQGMBCDSKX-CWRNSKLLSA-N	0	3	317.433	2.014	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCCCCOc2ccc(F)cc2)C1	ZINC000170827206	522101924	/nfs/dbraw/zinc/10/19/24/522101924.db2.gz	PYVYRVGSDNEIPN-HNNXBMFYSA-N	0	3	323.412	2.330	10	0		DEAEHN
CC[C@H](C(=O)N(C)Cc1cnn(-c2ccccc2)c1)N(C)C	ZINC000124603005	523753277	/nfs/dbraw/zinc/75/32/77/523753277.db2.gz	WLXNKXKBSGSZNB-MRXNPFEDSA-N	0	3	300.406	2.171	10	0		DEAEHN
C[C@H](CNC(=O)N(C)[C@H](C)c1cnn(C)c1)N1CCC[C@@H](C)C1	ZINC000245920172	524395238	/nfs/dbraw/zinc/39/52/38/524395238.db2.gz	QKDIZYGRUNDJLW-RBSFLKMASA-N	0	3	321.469	2.243	10	0		DEAEHN
C[C@@H](CCn1cccn1)NCc1cn(C)nc1C(F)(F)F	ZINC000159134867	524554483	/nfs/dbraw/zinc/55/44/83/524554483.db2.gz	ZHPIMSHRPIXFMG-JTQLQIEISA-N	0	3	301.316	2.204	10	0		DEAEHN
Cc1ccc(OC[C@@H](O)CN2[C@H](C)C[C@@H](O)C[C@@H]2C)c(C)c1	ZINC000248841287	525428700	/nfs/dbraw/zinc/42/87/00/525428700.db2.gz	PTGMPQZQWSWRGE-YVSFHVDLSA-N	0	3	307.434	2.277	10	0		DEAEHN
Cc1ccc(OC[C@H](O)CN2[C@H](C)C[C@@H](O)C[C@@H]2C)c(C)c1	ZINC000248841291	525439946	/nfs/dbraw/zinc/43/99/46/525439946.db2.gz	PTGMPQZQWSWRGE-YYIAUSFCSA-N	0	3	307.434	2.277	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(CCCN1CCOCC1)CC2	ZINC000374379518	534882261	/nfs/dbraw/zinc/88/22/61/534882261.db2.gz	HETGUNWMBTYINU-UHFFFAOYSA-N	0	3	316.445	2.012	10	0		DEAEHN
C[C@@H]1CC(O)C[C@@H](C)N1C[C@@H](O)COc1ccc(Cl)cc1	ZINC000248748840	526228886	/nfs/dbraw/zinc/22/88/86/526228886.db2.gz	FWLAHVHGNZINCG-LALPHHSUSA-N	0	3	313.825	2.313	10	0		DEAEHN
COc1ccc(C[C@@H](C)NCc2nnc3n2CCCC3)cc1	ZINC000368186876	536503354	/nfs/dbraw/zinc/50/33/54/536503354.db2.gz	BODUINSFQNPWJX-CYBMUJFWSA-N	0	3	300.406	2.344	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@H](C)N[C@@H](C)CN1CCOCC1	ZINC000156743795	527589160	/nfs/dbraw/zinc/58/91/60/527589160.db2.gz	YHGUMSBUDQAYQY-KBPBESRZSA-N	0	3	308.470	2.318	10	0		DEAEHN
CC(C)OC1CC(N[C@@H](C)Cn2ncc3ccccc3c2=O)C1	ZINC000189553470	527881970	/nfs/dbraw/zinc/88/19/70/527881970.db2.gz	XPROTJMWCLAZIA-JEYLPNPQSA-N	0	3	315.417	2.331	10	0		DEAEHN
CCCn1ccnc1CCCN(C)CC(=O)NC(C)(C)CC	ZINC000191516986	528861219	/nfs/dbraw/zinc/86/12/19/528861219.db2.gz	ACZAPUDOZNEDKW-UHFFFAOYSA-N	0	3	308.470	2.462	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccc(NC(=O)C3CC3)cc2)C1	ZINC000328913444	529056237	/nfs/dbraw/zinc/05/62/37/529056237.db2.gz	PNIORELAZYBXBW-MRXNPFEDSA-N	0	3	315.417	2.249	10	0		DEAEHN
CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)N1CCN2CCC[C@H]2C1	ZINC000251779034	535293963	/nfs/dbraw/zinc/29/39/63/535293963.db2.gz	ROHZLBCPHPRJGP-JYJNAYRXSA-N	0	3	309.454	2.070	10	0		DEAEHN
CCO[C@@H]1C[C@](N)(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1(C)C	ZINC000262541420	535535769	/nfs/dbraw/zinc/53/57/69/535535769.db2.gz	RDSZMKZWMWOVQX-BORJPKMPSA-N	0	3	302.418	2.191	10	0		DEAEHN
CCOc1ccnc(N2CCCN(C[C@H]3CCC=CO3)CC2)n1	ZINC000249055844	535556884	/nfs/dbraw/zinc/55/68/84/535556884.db2.gz	YPSTWNMXMCLUQM-OAHLLOKOSA-N	0	3	318.421	2.080	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)[C@H]1C[C@@H]1c1cccc(OC)c1	ZINC000246285028	535566414	/nfs/dbraw/zinc/56/64/14/535566414.db2.gz	BDIQCMUXCOWRTH-OIISXLGYSA-N	0	3	302.418	2.399	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](C)[C@H]2COc3ccccc32)C1	ZINC000247028130	535576905	/nfs/dbraw/zinc/57/69/05/535576905.db2.gz	UUPUXMASRZCRDK-OFQRWUPVSA-N	0	3	317.433	2.335	10	0		DEAEHN
CCN1CCN(CCCNc2ncnc3c(C)csc32)CC1	ZINC000192494572	535698692	/nfs/dbraw/zinc/69/86/92/535698692.db2.gz	GAQKSYBEDKSIRK-UHFFFAOYSA-N	0	3	319.478	2.439	10	0		DEAEHN
CN(C(=O)C[C@H]1CCOc2ccccc21)[C@H]1CCCN(C)C1	ZINC000247441863	536005391	/nfs/dbraw/zinc/00/53/91/536005391.db2.gz	PNKOMVWPOYMXCU-CABCVRRESA-N	0	3	302.418	2.495	10	0		DEAEHN
CN(CCOc1ccccc1F)C(=O)[C@H]1NCCCC1(C)C	ZINC000261980414	536402573	/nfs/dbraw/zinc/40/25/73/536402573.db2.gz	AHOSPUWRNGFKII-OAHLLOKOSA-N	0	3	308.397	2.441	10	0		DEAEHN
COc1ccc(Br)cc1CN[C@H]1CN(C)C[C@H]1C	ZINC000358102839	536639758	/nfs/dbraw/zinc/63/97/58/536639758.db2.gz	WRPPZHVEQMKRMW-MFKMUULPSA-N	0	3	313.239	2.497	10	0		DEAEHN
CCCC(=O)NCC(=O)O[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000183201436	625296792	/nfs/dbraw/zinc/29/67/92/625296792.db2.gz	OHRJKGOAKMMXCO-MRXNPFEDSA-N	0	3	318.417	2.111	10	0		DEAEHN
C[C@H](CCO)CN(C(=O)OC(C)(C)C)c1ccc(CN)nc1	ZINC000757134770	623076334	/nfs/dbraw/zinc/07/63/34/623076334.db2.gz	OSAHFMKZRVLHPO-GFCCVEGCSA-N	0	3	309.410	2.300	10	0		DEAEHN
CC(C)c1ccoc1-c1noc(CN2CCCC[C@@H](N)C2=O)n1	ZINC000888078432	625059200	/nfs/dbraw/zinc/05/92/00/625059200.db2.gz	QQYSUGZWMBGUSH-GFCCVEGCSA-N	0	3	318.377	2.293	10	0		DEAEHN
CCN(CC)C(=O)[C@@H]1CCCN1C[C@H](C)CBr	ZINC000248736592	634454262	/nfs/dbraw/zinc/45/42/62/634454262.db2.gz	QXLYLCMWBFXSHA-NEPJUHHUSA-N	0	3	305.260	2.350	10	0		DEAEHN
O=C(NCCN1CCCC1)c1cc(-c2ccc(F)c(F)c2)on1	ZINC000222714206	636372629	/nfs/dbraw/zinc/37/26/29/636372629.db2.gz	VTFHOTCDOVRTDM-UHFFFAOYSA-N	0	3	321.327	2.445	10	0		DEAEHN
C[Si](C)(C)c1ccc(CN2CCC(OCCO)CC2)cc1	ZINC000801935784	645464994	/nfs/dbraw/zinc/46/49/94/645464994.db2.gz	FHQURGGBXFCTQM-UHFFFAOYSA-N	0	3	307.510	2.205	10	0		DEAEHN
CCCCCCN(C)CC(=O)N1CC(O)(c2ccc(F)cc2)C1	ZINC000802627399	645537675	/nfs/dbraw/zinc/53/76/75/645537675.db2.gz	VXGHOSCOTPZQQZ-UHFFFAOYSA-N	0	3	322.424	2.368	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@@H]2CN1c1nc(Cl)nc2nc[nH]c21	ZINC000165506979	646500270	/nfs/dbraw/zinc/50/02/70/646500270.db2.gz	YHRIHFYIDRDJIE-NXEZZACHSA-N	0	3	306.801	2.069	10	0		DEAEHN
COC(=O)c1coc(CNCCCNC(=O)OC(C)(C)C)c1	ZINC000230683842	646744180	/nfs/dbraw/zinc/74/41/80/646744180.db2.gz	JMTXPKPPMAIQEL-UHFFFAOYSA-N	0	3	312.366	2.071	10	0		DEAEHN
Cc1cc2ncn(CN3CC[C@@H](N4CCOCC4)C3)c2cc1C	ZINC000172959329	646756822	/nfs/dbraw/zinc/75/68/22/646756822.db2.gz	SQWLUQNFZDUUIF-MRXNPFEDSA-N	0	3	314.433	2.017	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000185301273	649491226	/nfs/dbraw/zinc/49/12/26/649491226.db2.gz	WVCFMTTULFVSEH-ZDUSSCGKSA-N	0	3	302.758	2.125	10	0		DEAEHN
CCc1nn(C)cc1CN[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000381596684	685400964	/nfs/dbraw/zinc/40/09/64/685400964.db2.gz	KGEHXNYHRCNYQD-NWDGAFQWSA-N	0	3	310.442	2.374	10	0		DEAEHN
CC1(C)CN(Cc2cnc(N)cn2)CCN1Cc1ccccc1	ZINC000382850421	685405856	/nfs/dbraw/zinc/40/58/56/685405856.db2.gz	JSMBWZMDVPYYAV-UHFFFAOYSA-N	0	3	311.433	2.155	10	0		DEAEHN
Cn1ccc(CNC[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)n1	ZINC000394794091	685458269	/nfs/dbraw/zinc/45/82/69/685458269.db2.gz	AKNHVCVZXISNLQ-OLZOCXBDSA-N	0	3	308.426	2.203	10	0		DEAEHN
C[C@@](CO)(NC[C@@H]1CCCO1)c1cccc(Br)c1	ZINC000038114501	683886962	/nfs/dbraw/zinc/88/69/62/683886962.db2.gz	YIQPNODIINXMMA-KBPBESRZSA-N	0	3	314.223	2.425	10	0		DEAEHN
Cn1nccc1CCC(=O)O[C@H]1CCN(Cc2ccccc2)C1	ZINC000125904006	684149627	/nfs/dbraw/zinc/14/96/27/684149627.db2.gz	VLHWVWSTPLNNGU-KRWDZBQOSA-N	0	3	313.401	2.170	10	0		DEAEHN
Cc1cc(C)c(N2CC[C@@H](N[C@H]3CCCOC3)C2=O)c(C)c1	ZINC000189457687	684380925	/nfs/dbraw/zinc/38/09/25/684380925.db2.gz	UCWNUXRAFUMXTG-JKSUJKDBSA-N	0	3	302.418	2.486	10	0		DEAEHN
O=C(N[C@H]1COc2ccccc21)N1CCN(C2CCCC2)CC1	ZINC000195198251	685089610	/nfs/dbraw/zinc/08/96/10/685089610.db2.gz	PPNGLHJQQLROKO-INIZCTEOSA-N	0	3	315.417	2.390	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@H]1N(C)S(=O)(=O)/C=C/c1ccccc1	ZINC000246200098	685125930	/nfs/dbraw/zinc/12/59/30/685125930.db2.gz	OPCZEWDUSTZLTC-RHRXWLLISA-N	0	3	308.447	2.259	10	0		DEAEHN
CCOCCN1CCN(C[C@@H](O)c2ccc(C)cc2)C[C@H]1C	ZINC000246730286	685135036	/nfs/dbraw/zinc/13/50/36/685135036.db2.gz	MWOGXXPZIXOUJJ-SJLPKXTDSA-N	0	3	306.450	2.071	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@H]2CN1c1nc(Cl)nc2nc[nH]c21	ZINC000252837549	685194439	/nfs/dbraw/zinc/19/44/39/685194439.db2.gz	YHRIHFYIDRDJIE-ZJUUUORDSA-N	0	3	306.801	2.069	10	0		DEAEHN
CO[C@@H]1CN(Cc2cc3ccccc3o2)C[C@H]1c1cn(C)nn1	ZINC000886093760	692002032	/nfs/dbraw/zinc/00/20/32/692002032.db2.gz	GUITXNKJAFNZMA-WMLDXEAASA-N	0	3	312.373	2.176	10	0		DEAEHN
C[C@@H](NCc1cn[nH]n1)[C@H]1CCCCN1C(=O)OC(C)(C)C	ZINC000398397537	790269820	/nfs/dbraw/zinc/26/98/20/790269820.db2.gz	AOIOIJKUNZONGD-DGCLKSJQSA-N	0	3	309.414	2.072	10	0		DEAEHN
C[C@@H](NCc1c[nH]nn1)[C@H]1CCCCN1C(=O)OC(C)(C)C	ZINC000398397537	790269824	/nfs/dbraw/zinc/26/98/24/790269824.db2.gz	AOIOIJKUNZONGD-DGCLKSJQSA-N	0	3	309.414	2.072	10	0		DEAEHN
COc1cc(CNCCCNC(=O)OC(C)(C)C)sn1	ZINC000399186455	790331223	/nfs/dbraw/zinc/33/12/23/790331223.db2.gz	VQQREVMZPRLKTG-UHFFFAOYSA-N	0	3	301.412	2.156	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@H]1CN[C@H]1CCCc2n[nH]cc21	ZINC000724915357	777518916	/nfs/dbraw/zinc/51/89/16/777518916.db2.gz	SUSCHUFEVRNYKP-AAEUAGOBSA-N	0	3	306.410	2.386	10	0		DEAEHN
OC1CC2(C[C@@H]2NCc2cc(Br)cc3c2OCC3)C1	ZINC000724999657	777551387	/nfs/dbraw/zinc/55/13/87/777551387.db2.gz	SCQVOLCJBHOFRH-OWYJLGKBSA-N	0	3	324.218	2.387	10	0		DEAEHN
NC(=O)c1csc(CNC[C@H]2CC[C@H](C(F)(F)F)O2)c1	ZINC000722402697	778707632	/nfs/dbraw/zinc/70/76/32/778707632.db2.gz	JLUBCPZLUNYECA-PSASIEDQSA-N	0	3	308.325	2.047	10	0		DEAEHN
CC1(C)C[NH2+]C[C@@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000721889559	781574937	/nfs/dbraw/zinc/57/49/37/781574937.db2.gz	PTYQIDFJPWTTSA-NSHDSACASA-N	0	3	323.245	2.270	10	0		DEAEHN
O=S(=O)(c1cccc(Cl)c1)N1CCNCCC12CCC2	ZINC000713209555	792216575	/nfs/dbraw/zinc/21/65/75/792216575.db2.gz	CSFRZMQBXRVWIJ-UHFFFAOYSA-N	0	3	314.838	2.247	10	0		DEAEHN
NC(=O)C1CC(NCc2cc(Cl)ccc2Br)C1	ZINC000716715568	793003479	/nfs/dbraw/zinc/00/34/79/793003479.db2.gz	IEHRSYMUEMTTRS-UHFFFAOYSA-N	0	3	317.614	2.456	10	0		DEAEHN
Cn1ncc(Br)c1CNCC[C@H]1CC(C)(C)CO1	ZINC000717325340	799380617	/nfs/dbraw/zinc/38/06/17/799380617.db2.gz	GASNOSCMCMECIN-JTQLQIEISA-N	0	3	316.243	2.477	10	0		DEAEHN
C[C@@H](O)[C@H](O)CNCc1cccc(OCc2ccccc2)c1	ZINC000717337998	799381416	/nfs/dbraw/zinc/38/14/16/799381416.db2.gz	AVQSVWMWVQKVKQ-RDTXWAMCSA-N	0	3	301.386	2.097	10	0		DEAEHN
Cc1nc(CN[C@H]2CCN(C)[C@@H]2C)sc1Br	ZINC000719602894	1089324802	/nfs/dbraw/zinc/32/48/02/1089324802.db2.gz	QFTYSZQTZZOKSN-BDAKNGLRSA-N	0	3	304.257	2.396	10	0		DEAEHN
CN(C)C(=O)CCCNCc1sccc1Br	ZINC000087575683	1080792130	/nfs/dbraw/zinc/79/21/30/1080792130.db2.gz	MWBTYJCIBKECAW-UHFFFAOYSA-N	0	3	305.241	2.469	10	0		DEAEHN
OCC1(CNCc2ccccc2I)CC1	ZINC000080246538	1080958031	/nfs/dbraw/zinc/95/80/31/1080958031.db2.gz	JCOFHAGJCLILIU-UHFFFAOYSA-N	0	3	317.170	2.153	10	0		DEAEHN
C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1NCCS(=O)(=O)C1CCCCC1	ZINC000701028036	1086348025	/nfs/dbraw/zinc/34/80/25/1086348025.db2.gz	VWIRHCTXLJWJFB-XPCVCDNBSA-N	0	3	303.468	2.135	10	0		DEAEHN
COC(OC)C(=O)N[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000709631013	1086683739	/nfs/dbraw/zinc/68/37/39/1086683739.db2.gz	AJXKVHRXBQJOGN-INIZCTEOSA-N	0	3	320.433	2.166	10	0		DEAEHN
C[C@@H](NC1CC(CC(N)=O)C1)c1ccc(Br)cn1	ZINC000718397926	1088504465	/nfs/dbraw/zinc/50/44/65/1088504465.db2.gz	LGVBXJSJVGQTJR-FKTRJACZSA-N	0	3	312.211	2.149	10	0		DEAEHN
C[C@H]1[C@@H](NC(=O)c2ccc(Br)c(F)c2)CCN1C	ZINC000719384709	1089053880	/nfs/dbraw/zinc/05/38/80/1089053880.db2.gz	DPOGMKSDGOXIRW-UFBFGSQYSA-N	0	3	315.186	2.411	10	0		DEAEHN
C(N[C@@H]1CCCN2CCSC[C@@H]12)c1nc2c(s1)CCC2	ZINC000719530666	1089287016	/nfs/dbraw/zinc/28/70/16/1089287016.db2.gz	NVCJRGXDFOQQNP-YPMHNXCESA-N	0	3	309.504	2.301	10	0		DEAEHN
Cc1nc(CN[C@@H]2CCN(C)[C@H]2C)sc1Br	ZINC000719602896	1089325256	/nfs/dbraw/zinc/32/52/56/1089325256.db2.gz	QFTYSZQTZZOKSN-DTWKUNHWSA-N	0	3	304.257	2.396	10	0		DEAEHN
C[C@@H](NC[C@@](C)(O)C(F)(F)C(F)(F)F)c1cnn(C)c1	ZINC000724024391	1143896477	/nfs/dbraw/zinc/89/64/77/1143896477.db2.gz	PYIHBYINKRSOMZ-VXNVDRBHSA-N	0	3	301.259	2.019	10	0		DEAEHN
CC(=O)N(C)C1CCN(CCN2CCCc3ccccc32)CC1	ZINC000136372881	282087006	/nfs/dbraw/zinc/08/70/06/282087006.db2.gz	XHRITMPACVXEJG-UHFFFAOYSA-N	0	3	315.461	2.382	10	0		DEAEHN
CCCOc1ccc([C@@H](N)CSCCS(C)(=O)=O)cc1	ZINC000081768325	192322984	/nfs/dbraw/zinc/32/29/84/192322984.db2.gz	BIMLROOUNYNOLF-AWEZNQCLSA-N	0	3	317.476	2.253	10	0		DEAEHN
CCOc1ccc([C@@H](CSCCS(C)(=O)=O)NC)cc1	ZINC000081768797	192323041	/nfs/dbraw/zinc/32/30/41/192323041.db2.gz	AINJDFWKNOYZGX-CQSZACIVSA-N	0	3	317.476	2.124	10	0		DEAEHN
Cc1cc(C)c([C@H](N)CSCCS(C)(=O)=O)c(C)c1	ZINC000081768843	192323479	/nfs/dbraw/zinc/32/34/79/192323479.db2.gz	QFVMDWHIHXTAGU-CYBMUJFWSA-N	0	3	301.477	2.389	10	0		DEAEHN
N[C@H](CSc1ncccn1)c1ccc2c(c1)OCCCO2	ZINC000081871164	192333378	/nfs/dbraw/zinc/33/33/78/192333378.db2.gz	FKFMELHATKZXNA-GFCCVEGCSA-N	0	3	303.387	2.430	10	0		DEAEHN
c1c(C2CC2)[nH]nc1N1CCN(CC[C@@H]2CCCCO2)CC1	ZINC000426773481	230816342	/nfs/dbraw/zinc/81/63/42/230816342.db2.gz	JWKUQSSPHBKTTL-HNNXBMFYSA-N	0	3	304.438	2.368	10	0		DEAEHN
CN[C@@H](C)[C@@H](C)S(=O)(=O)c1ccc(Br)cc1	ZINC000081933451	192341232	/nfs/dbraw/zinc/34/12/32/192341232.db2.gz	QMWDEENYHGCFGF-DTWKUNHWSA-N	0	3	306.225	2.219	10	0		DEAEHN
N[C@@H]1CCCC[C@@H]1S(=O)(=O)c1ccc(Br)cc1	ZINC000081933828	192341706	/nfs/dbraw/zinc/34/17/06/192341706.db2.gz	DEQFBIQIBIFBGC-NEPJUHHUSA-N	0	3	318.236	2.493	10	0		DEAEHN
C[C@H](NCc1csc2ccccc12)C(=O)N1CCOCC1	ZINC000079304481	185164049	/nfs/dbraw/zinc/16/40/49/185164049.db2.gz	GZODROYOISQTNH-LBPRGKRZSA-N	0	3	304.415	2.238	10	0		DEAEHN
CN1C[C@@H](NCc2cc(Br)cs2)CCC1=O	ZINC000082756549	185202720	/nfs/dbraw/zinc/20/27/20/185202720.db2.gz	NXSJPTOGOAXSAY-VIFPVBQESA-N	0	3	303.225	2.221	10	0		DEAEHN
COc1ccc(Br)cc1CN[C@@H]1CN(C)C[C@@H]1C	ZINC000358102836	536638806	/nfs/dbraw/zinc/63/88/06/536638806.db2.gz	WRPPZHVEQMKRMW-GXFFZTMASA-N	0	3	313.239	2.497	10	0		DEAEHN
CCN[C@H](CC(N)=O)c1ccc(OC(F)F)c(OCC)c1	ZINC000087549606	185228189	/nfs/dbraw/zinc/22/81/89/185228189.db2.gz	VREQQJNMPHNRPL-SNVBAGLBSA-N	0	3	302.321	2.213	10	0		DEAEHN
COc1ccc(Br)cc1[C@@H](N)CC(C)(C)C(N)=O	ZINC000087722131	185230855	/nfs/dbraw/zinc/23/08/55/185230855.db2.gz	PMPMQYKNRSOXLM-JTQLQIEISA-N	0	3	315.211	2.359	10	0		DEAEHN
NN=c1cc(Sc2ccc(Br)cc2)[nH]c(N)n1	ZINC000087889364	185234799	/nfs/dbraw/zinc/23/47/99/185234799.db2.gz	GVSSPJDCPSSIEE-UHFFFAOYSA-N	0	3	312.196	2.258	10	0		DEAEHN
CNCc1ccnn1Cc1cc(OC)ccc1Br	ZINC000087799496	185232345	/nfs/dbraw/zinc/23/23/45/185232345.db2.gz	RPHSTGZNNRQSRN-UHFFFAOYSA-N	0	3	310.195	2.422	10	0		DEAEHN
CC(C)CNCc1ccc(S(=O)(=O)N(C)CC(C)C)o1	ZINC000088543729	185256826	/nfs/dbraw/zinc/25/68/26/185256826.db2.gz	HSWDHNUIHKUIHL-UHFFFAOYSA-N	0	3	302.440	2.302	10	0		DEAEHN
CCC(CC)[C@@H](C)NCc1ccc(S(=O)(=O)N(C)C)o1	ZINC000088540790	185255704	/nfs/dbraw/zinc/25/57/04/185255704.db2.gz	NJOYODWQBJXCMN-LLVKDONJSA-N	0	3	302.440	2.444	10	0		DEAEHN
CC[C@H]([N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1)C(C)C	ZINC000088542976	185256419	/nfs/dbraw/zinc/25/64/19/185256419.db2.gz	QFRRQFOCIJHGBA-ZDUSSCGKSA-N	0	3	302.440	2.491	10	0		DEAEHN
CC[C@H](NS(=O)(=O)c1ccc(CNC(C)C)o1)C(C)C	ZINC000088542976	185256420	/nfs/dbraw/zinc/25/64/20/185256420.db2.gz	QFRRQFOCIJHGBA-ZDUSSCGKSA-N	0	3	302.440	2.491	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N(S(=O)(=O)c2ccc(F)c(CN)c2)C1	ZINC000088704763	185262607	/nfs/dbraw/zinc/26/26/07/185262607.db2.gz	NVFOBKMUDIOJJC-MNOVXSKESA-N	0	3	300.399	2.094	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N[C@@H]1CCCC[C@H]1C	ZINC000247187224	282214657	/nfs/dbraw/zinc/21/46/57/282214657.db2.gz	WGLOVZNKDYYPRO-HYVNUMGLSA-N	0	3	318.465	2.351	10	0		DEAEHN
CCCN[C@H](CS(=O)(=O)C1CCOCC1)c1ccccc1	ZINC000081989718	192350369	/nfs/dbraw/zinc/35/03/69/192350369.db2.gz	OUSQTXBQDXPRJJ-MRXNPFEDSA-N	0	3	311.447	2.321	10	0		DEAEHN
CC(C)(C)[C@@H]1CC[C@@H](N)[C@H](S(=O)(=O)C2CCOCC2)C1	ZINC000081989754	192350579	/nfs/dbraw/zinc/35/05/79/192350579.db2.gz	DVGSZUNWQQVWMD-MRVWCRGKSA-N	0	3	303.468	2.122	10	0		DEAEHN
CN(C)CCN[C@H](CO)c1cc(Cl)ccc1Br	ZINC000090252640	185288288	/nfs/dbraw/zinc/28/82/88/185288288.db2.gz	UOUBNCHWOHFOMB-GFCCVEGCSA-N	0	3	321.646	2.287	10	0		DEAEHN
N[C@@H]1COC[C@H]1c1nc(Cc2c(Cl)cccc2Cl)no1	ZINC000090364595	185292850	/nfs/dbraw/zinc/29/28/50/185292850.db2.gz	QGDSQTQMWZTUSS-LDYMZIIASA-N	0	3	314.172	2.408	10	0		DEAEHN
N[C@@H]1COC[C@@H]1C(=O)Nc1ccc(C(F)(F)F)cc1Cl	ZINC000090380501	185293555	/nfs/dbraw/zinc/29/35/55/185293555.db2.gz	CMVABRZEWQCGQO-IONNQARKSA-N	0	3	308.687	2.271	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1ccc(OC(C)C)c(Cl)c1	ZINC000090433700	185296434	/nfs/dbraw/zinc/29/64/34/185296434.db2.gz	XIMDZKXHXLGCAQ-YPMHNXCESA-N	0	3	312.797	2.300	10	0		DEAEHN
C[C@@]1(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)COC[C@H]1N	ZINC000090599248	185305923	/nfs/dbraw/zinc/30/59/23/185305923.db2.gz	FRHSYZLNQRFVGS-ZWNOBZJWSA-N	0	3	320.723	2.244	10	0		DEAEHN
C[C@]1(c2nc(-c3ccc(Br)cc3)no2)COC[C@@H]1N	ZINC000090573318	185304434	/nfs/dbraw/zinc/30/44/34/185304434.db2.gz	GSDMEUJYBQNVKN-GWCFXTLKSA-N	0	3	324.178	2.114	10	0		DEAEHN
CCCC(CCC)(C(N)=S)C(=O)N(C)C[C@@H]1CCCN1C	ZINC000092631785	185330543	/nfs/dbraw/zinc/33/05/43/185330543.db2.gz	XMXVMNHEYXJWLU-ZDUSSCGKSA-N	0	3	313.511	2.412	10	0		DEAEHN
COCCC[C@H](C)C(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000181403913	199292032	/nfs/dbraw/zinc/29/20/32/199292032.db2.gz	XTFMNUHEARHJQS-RDJZCZTQSA-N	0	3	306.450	2.338	10	0		DEAEHN
O=C(CCN1CCC[C@H](n2cncn2)C1)OCc1ccccc1	ZINC000181453307	199298853	/nfs/dbraw/zinc/29/88/53/199298853.db2.gz	AMHYKXDJSCXOAB-INIZCTEOSA-N	0	3	314.389	2.049	10	0		DEAEHN
C[C@@H](C1CC1)N(C(=O)CN(C)[C@]1(CO)CC[C@@H](C)C1)C1CC1	ZINC000188019040	282295728	/nfs/dbraw/zinc/29/57/28/282295728.db2.gz	XXUSTPCPXUGXMY-QWQRMKEZSA-N	0	3	308.466	2.259	10	0		DEAEHN
CC1(OCC(=O)Nc2ccc(-c3nccs3)cc2)CNC1	ZINC000098060482	539436022	/nfs/dbraw/zinc/43/60/22/539436022.db2.gz	QZZZFIMNVDZFJF-UHFFFAOYSA-N	0	3	303.387	2.127	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)N1C[C@@H](N(C)C)Cc2ccccc21	ZINC000248879119	282535568	/nfs/dbraw/zinc/53/55/68/282535568.db2.gz	ROZFCUWSINBCMK-KBMXLJTQSA-N	0	3	302.418	2.179	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)c2coc(Br)c2)CN1C1CC1	ZINC000177185253	539629504	/nfs/dbraw/zinc/62/95/04/539629504.db2.gz	PYCPSSTWRRXZDF-WPRPVWTQSA-N	0	3	313.195	2.397	10	0		DEAEHN
CNc1cc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc(Cl)n1	ZINC000083552805	192372121	/nfs/dbraw/zinc/37/21/21/192372121.db2.gz	CCLQVQBLYLHJGX-CMPLNLGQSA-N	0	3	308.813	2.085	10	0		DEAEHN
CN(C(=O)c1c[nH]nc1-c1ccc(F)cc1)[C@@H]1CCCN(C)C1	ZINC000080482590	192160615	/nfs/dbraw/zinc/16/06/15/192160615.db2.gz	QADWTPBYIIKBDK-CQSZACIVSA-N	0	3	316.380	2.382	10	0		DEAEHN
Cc1cc(N2CCC[C@@H](NCc3cccc(C)c3)C2=O)n(C)n1	ZINC000080526934	192165065	/nfs/dbraw/zinc/16/50/65/192165065.db2.gz	DZRFDAHWVTZLMK-MRXNPFEDSA-N	0	3	312.417	2.322	10	0		DEAEHN
CN(C)C1(CNC(=O)[C@@H]2C[C@]23CCOc2ccccc23)CCC1	ZINC000277374758	213479292	/nfs/dbraw/zinc/47/92/92/213479292.db2.gz	ZPKGXMNBBVKSCK-KXBFYZLASA-N	0	3	314.429	2.327	10	0		DEAEHN
Cc1ccc2c(N3C[C@@H]4C[C@@H](O)[C@@H](O)C[C@@H]4C3)ccnc2c1C	ZINC000071714453	191010429	/nfs/dbraw/zinc/01/04/29/191010429.db2.gz	GMASWNVTVOUEQX-PURYLZLUSA-N	0	3	312.413	2.420	10	0		DEAEHN
C[C@@H]1C[C@H](C)CN(S(=O)(=O)c2cc(CN)cc(F)c2F)C1	ZINC000138347328	186016418	/nfs/dbraw/zinc/01/64/18/186016418.db2.gz	IDWBTLVMYLFOHV-AOOOYVTPSA-N	0	3	318.389	2.090	10	0		DEAEHN
CC(C)[C@H](C)N(C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138523190	186017940	/nfs/dbraw/zinc/01/79/40/186017940.db2.gz	RXDWVDUVWQHKQC-VIFPVBQESA-N	0	3	306.378	2.089	10	0		DEAEHN
CCN[C@H](C)c1ccc(OC)cc1OCCS(=O)(=O)CC	ZINC000138536312	186017975	/nfs/dbraw/zinc/01/79/75/186017975.db2.gz	QHHOUXKQFYYAFH-GFCCVEGCSA-N	0	3	315.435	2.179	10	0		DEAEHN
CC[C@H](C)[C@H]1N[C@@H](c2ccc(C)s2)N(CCN(C)C)C1=O	ZINC000139968919	186025073	/nfs/dbraw/zinc/02/50/73/186025073.db2.gz	FVBSWQHTNBBBMB-NILFDRSVSA-N	0	3	309.479	2.463	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2ccsc2)N(C[C@@H]2CCCCN2C)C1=O	ZINC000144372302	186035121	/nfs/dbraw/zinc/03/51/21/186035121.db2.gz	GOKRGXJHTJEIBD-SOUVJXGZSA-N	0	3	307.463	2.441	10	0		DEAEHN
N[C@H](Cc1nc(-c2ccccc2)cs1)[C@H]1CCS(=O)(=O)C1	ZINC000150002038	186054144	/nfs/dbraw/zinc/05/41/44/186054144.db2.gz	SSVZVNYXZSRYLS-QWHCGFSZSA-N	0	3	322.455	2.115	10	0		DEAEHN
N[C@H](c1cccc(OC(F)(F)F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000150018611	186054200	/nfs/dbraw/zinc/05/42/00/186054200.db2.gz	KMGXRNVLMFTQNZ-MWLCHTKSSA-N	0	3	309.309	2.020	10	0		DEAEHN
CC[C@H]1CN(Cc2cccc(OC)c2F)CCN1C[C@H](C)O	ZINC000249455354	539780418	/nfs/dbraw/zinc/78/04/18/539780418.db2.gz	XQSIPOWJYXZJBV-ZFWWWQNUSA-N	0	3	310.413	2.111	10	0		DEAEHN
CN(CC(=O)N1CCC[C@H](C(F)(F)F)C1)CC1CCOCC1	ZINC000155840442	186116728	/nfs/dbraw/zinc/11/67/28/186116728.db2.gz	HKEHPMJOHWSXFL-ZDUSSCGKSA-N	0	3	322.371	2.146	10	0		DEAEHN
COc1ccc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1OC	ZINC000155687514	186103130	/nfs/dbraw/zinc/10/31/30/186103130.db2.gz	BHCHYLOVBJDDOB-OCCSQVGLSA-N	0	3	306.406	2.162	10	0		DEAEHN
Fc1cc(Br)cc(COC[C@@H]2CNCCO2)c1	ZINC000164005676	186145261	/nfs/dbraw/zinc/14/52/61/186145261.db2.gz	XGVMJOYMXZHNRC-LBPRGKRZSA-N	0	3	304.159	2.093	10	0		DEAEHN
Fc1cc(Br)cc(COC[C@H]2CNCCO2)c1	ZINC000164005789	186145606	/nfs/dbraw/zinc/14/56/06/186145606.db2.gz	XGVMJOYMXZHNRC-GFCCVEGCSA-N	0	3	304.159	2.093	10	0		DEAEHN
COCCN(C)[C@@H](CN)c1ccc(C)cc1Br	ZINC000164069022	186147911	/nfs/dbraw/zinc/14/79/11/186147911.db2.gz	LXPQKQNTGXWCPR-ZDUSSCGKSA-N	0	3	301.228	2.336	10	0		DEAEHN
COc1cc(CNC[C@@H](C)[S@](C)=O)cc(Cl)c1OC	ZINC000159692483	186135535	/nfs/dbraw/zinc/13/55/35/186135535.db2.gz	SLNMNGBDUSLLQT-AYLIAGHASA-N	0	3	305.827	2.214	10	0		DEAEHN
O=S1(=O)CCC[C@@H]1CNCc1c[nH]c2cc(Cl)ccc12	ZINC000163895619	186141699	/nfs/dbraw/zinc/14/16/99/186141699.db2.gz	XPPVDURZVWUSDD-GFCCVEGCSA-N	0	3	312.822	2.488	10	0		DEAEHN
C[C@@H](C[S@@](C)=O)NCc1ccc(Br)c(F)c1	ZINC000164321956	186156067	/nfs/dbraw/zinc/15/60/67/186156067.db2.gz	RLCZBHHEYUVWKA-PWJLMRLQSA-N	0	3	308.216	2.445	10	0		DEAEHN
N[C@@H](C[C@H]1CCS(=O)(=O)C1)c1cscc1Br	ZINC000164381980	186158039	/nfs/dbraw/zinc/15/80/39/186158039.db2.gz	SWPVFICRSZIOFN-XCBNKYQSSA-N	0	3	324.265	2.335	10	0		DEAEHN
CCC[C@H](NCC(=O)NC(N)=O)c1cccc(C(F)(F)F)c1	ZINC000181867990	186213112	/nfs/dbraw/zinc/21/31/12/186213112.db2.gz	WKGKZPBPKAKMHU-NSHDSACASA-N	0	3	317.311	2.331	10	0		DEAEHN
CCCc1cc(NC(=O)N(C)C[C@H]2CCCN2CC)n(C)n1	ZINC000179693274	186206352	/nfs/dbraw/zinc/20/63/52/186206352.db2.gz	PKCAMXYJEZUTAU-CQSZACIVSA-N	0	3	307.442	2.321	10	0		DEAEHN
C[C@H]1CC[C@@](CO)(N(C)Cc2cc(-c3cnn(C)c3)no2)C1	ZINC000187992549	186240218	/nfs/dbraw/zinc/24/02/18/186240218.db2.gz	NUQJRBKEVQHXIF-BLLLJJGKSA-N	0	3	304.394	2.058	10	0		DEAEHN
Cc1ccccc1CNC(=O)CN(C)[C@]1(CO)CC[C@H](C)C1	ZINC000187990108	186240548	/nfs/dbraw/zinc/24/05/48/186240548.db2.gz	CCTGEXIOFKZYBH-KBXCAEBGSA-N	0	3	304.434	2.094	10	0		DEAEHN
Cc1csc2nc(CN(C)[C@@]3(CO)CC[C@H](C)C3)cc(=O)n12	ZINC000188001892	186242039	/nfs/dbraw/zinc/24/20/39/186242039.db2.gz	JRMJLTSUFSGYTE-ZBEGNZNMSA-N	0	3	321.446	2.047	10	0		DEAEHN
CN(C)C1(CN(C)C(=O)c2ccc(-c3ncon3)cc2)CCC1	ZINC000187988618	186240151	/nfs/dbraw/zinc/24/01/51/186240151.db2.gz	HOJJNLLGXZTABO-UHFFFAOYSA-N	0	3	314.389	2.293	10	0		DEAEHN
O=C(NCCc1ccc(Cl)cc1)N1CCN2CCC[C@H]2C1	ZINC000171897369	198004507	/nfs/dbraw/zinc/00/45/07/198004507.db2.gz	ZBGRZLJPBWGMEI-HNNXBMFYSA-N	0	3	307.825	2.372	10	0		DEAEHN
Cc1ccccc1C[C@H](C)NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171902860	198004851	/nfs/dbraw/zinc/00/48/51/198004851.db2.gz	XZWLVSGQOFKKCI-DOTOQJQBSA-N	0	3	301.434	2.416	10	0		DEAEHN
Cc1ccc(CCNC(=O)N2CCN3CCC[C@H]3C2)c(C)c1	ZINC000171904792	198005314	/nfs/dbraw/zinc/00/53/14/198005314.db2.gz	DRPJWNRYMUUYHD-KRWDZBQOSA-N	0	3	301.434	2.336	10	0		DEAEHN
O=C(NCCc1ccccc1Cl)N1CCN2CCC[C@@H]2C1	ZINC000171905013	198005431	/nfs/dbraw/zinc/00/54/31/198005431.db2.gz	AYMNJVFHTFBESL-CQSZACIVSA-N	0	3	307.825	2.372	10	0		DEAEHN
O=C(NCC1(c2ccc(F)cc2)CC1)N1CCN2CCC[C@@H]2C1	ZINC000171902050	198005526	/nfs/dbraw/zinc/00/55/26/198005526.db2.gz	RNLKJXUEJIMENU-MRXNPFEDSA-N	0	3	317.408	2.347	10	0		DEAEHN
COC(C)(C)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000171948299	198013435	/nfs/dbraw/zinc/01/34/35/198013435.db2.gz	TZMRYFBPYKEAIQ-UHFFFAOYSA-N	0	3	314.495	2.279	10	0		DEAEHN
COc1cc(CN2CCN(CC(C)C)CC2)cc2c1OCCO2	ZINC000171926502	198008863	/nfs/dbraw/zinc/00/88/63/198008863.db2.gz	OFFKJLOTKASABX-UHFFFAOYSA-N	0	3	320.433	2.240	10	0		DEAEHN
COC(=O)c1oc(CN2CC[C@@H](c3cnn(C)c3)C2)cc1C	ZINC000172057009	198031964	/nfs/dbraw/zinc/03/19/64/198031964.db2.gz	WZOARPPFFFGCJD-GFCCVEGCSA-N	0	3	303.362	2.098	10	0		DEAEHN
C/C(=C\C(=O)N1CCO[C@@H](CN(C)C)C1)c1cccc(F)c1	ZINC000172308043	198077215	/nfs/dbraw/zinc/07/72/15/198077215.db2.gz	CUEYGTAANHYLHC-WQMJKPAKSA-N	0	3	306.381	2.018	10	0		DEAEHN
CCc1ccc([C@H]2CCCCN2CCC(=O)NC(=O)NC)o1	ZINC000172871231	198160022	/nfs/dbraw/zinc/16/00/22/198160022.db2.gz	FWVBKUYXSRCFSW-CYBMUJFWSA-N	0	3	307.394	2.215	10	0		DEAEHN
O=C([C@H]1SCCc2sccc21)N1CCN2CCC[C@@H]2C1	ZINC000173098821	198184953	/nfs/dbraw/zinc/18/49/53/198184953.db2.gz	BFVAWRJTKAVOAD-RISCZKNCSA-N	0	3	308.472	2.385	10	0		DEAEHN
CC(C)Nc1ncccc1C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000173180391	198193167	/nfs/dbraw/zinc/19/31/67/198193167.db2.gz	OHZZJEYZEXWZDT-ZIAGYGMSSA-N	0	3	304.438	2.457	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCCc2ccccc2F)CCN1C	ZINC000173441492	198215757	/nfs/dbraw/zinc/21/57/57/198215757.db2.gz	NFCHJFZKIJOORC-ZFWWWQNUSA-N	0	3	307.413	2.492	10	0		DEAEHN
C[C@@H](CCc1ccccc1F)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000173522584	198223857	/nfs/dbraw/zinc/22/38/57/198223857.db2.gz	LDTMNMKMXACDEL-HOCLYGCPSA-N	0	3	322.424	2.183	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000173830552	198258364	/nfs/dbraw/zinc/25/83/64/198258364.db2.gz	CXOAJCRHIUUIBQ-ZIAGYGMSSA-N	0	3	312.410	2.073	10	0		DEAEHN
CCCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000174018589	198281440	/nfs/dbraw/zinc/28/14/40/198281440.db2.gz	RMXFDLPTMQNESN-KRWDZBQOSA-N	0	3	319.449	2.141	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCc2cccc3c2OCO3)CCN1C	ZINC000174224976	198308177	/nfs/dbraw/zinc/30/81/77/198308177.db2.gz	VGZKJXRNGBTJDB-TZMCWYRMSA-N	0	3	319.405	2.039	10	0		DEAEHN
CN1CC[C@@H](NC(=O)N2CCSCC2)[C@H]1c1ccccc1	ZINC000245695606	283049154	/nfs/dbraw/zinc/04/91/54/283049154.db2.gz	YCRWGTUXMVEPFI-HUUCEWRRSA-N	0	3	305.447	2.190	10	0		DEAEHN
c1cc(-c2ccc(CN3CCOC4(CCOCC4)CC3)o2)n[nH]1	ZINC000363747604	283095184	/nfs/dbraw/zinc/09/51/84/283095184.db2.gz	MPUYESSADYDRII-UHFFFAOYSA-N	0	3	317.389	2.441	10	0		DEAEHN
CN[C@H](C)C(=O)N1C[C@H](C)N(Cc2ccccc2)[C@H](C)[C@H]1C	ZINC000404312541	540144614	/nfs/dbraw/zinc/14/46/14/540144614.db2.gz	MCWKTBQRNVSWPL-ZJIFWQFVSA-N	0	3	303.450	2.104	10	0		DEAEHN
NC[C@@H](NC(=O)c1ccc(Br)s1)C(F)(F)F	ZINC000401756223	540142626	/nfs/dbraw/zinc/14/26/26/540142626.db2.gz	RGWHTCIXNCPGFX-RXMQYKEDSA-N	0	3	317.130	2.130	10	0		DEAEHN
CN(C)[C@@H]1CN(Cc2ccccn2)CC[C@]1(O)c1ccccc1	ZINC000097942724	355706878	/nfs/dbraw/zinc/70/68/78/355706878.db2.gz	CGGNRAOIUSDJPZ-MOPGFXCFSA-N	0	3	311.429	2.105	10	0		DEAEHN
COc1ccc([C@@H](C)NC(=O)NC[C@@H]2CCCN2C)cc1OC	ZINC000139681684	355878761	/nfs/dbraw/zinc/87/87/61/355878761.db2.gz	JIVQUUWISMBGOD-OCCSQVGLSA-N	0	3	321.421	2.158	10	0		DEAEHN
COc1ccc(F)cc1[C@H](C)NC[C@@H](C)CS(C)(=O)=O	ZINC000179948401	356036999	/nfs/dbraw/zinc/03/69/99/356036999.db2.gz	IREAILPCEYIMAP-MNOVXSKESA-N	0	3	303.399	2.166	10	0		DEAEHN
CCC[C@H](C)CN1CCN([C@@H](C)C(=O)NC2CCCC2)CC1	ZINC000180046510	356040968	/nfs/dbraw/zinc/04/09/68/356040968.db2.gz	KMJRNHWBRONHDG-HOTGVXAUSA-N	0	3	309.498	2.488	10	0		DEAEHN
CC(C)[C@@H](C)CNC(=O)NCc1ccnc(OCCN(C)C)c1	ZINC000179375875	356024159	/nfs/dbraw/zinc/02/41/59/356024159.db2.gz	URNOHGCUPOSFPV-AWEZNQCLSA-N	0	3	322.453	2.113	10	0		DEAEHN
C[C@H](C(=O)NC1CCCCC1)N(CC(N)=S)C1CCCC1	ZINC000080222905	192013846	/nfs/dbraw/zinc/01/38/46/192013846.db2.gz	GBHTZKSABUYBRK-GFCCVEGCSA-N	0	3	311.495	2.355	10	0		DEAEHN
CCS(=O)(=O)C[C@@H](C)NCCc1c[nH]c2cccc(C)c12	ZINC000182808090	356146591	/nfs/dbraw/zinc/14/65/91/356146591.db2.gz	DLPUEVJUURXUJH-CYBMUJFWSA-N	0	3	308.447	2.432	10	0		DEAEHN
CC[C@@](C)(CO)NCC(=O)Nc1ccccc1Br	ZINC000080108415	192001698	/nfs/dbraw/zinc/00/16/98/192001698.db2.gz	JNFUFIHAAOZJIR-ZDUSSCGKSA-N	0	3	315.211	2.138	10	0		DEAEHN
NCc1nc(OC(F)(F)F)ccc1I	ZINC000238594616	356304022	/nfs/dbraw/zinc/30/40/22/356304022.db2.gz	NOLNOVFBHDEBNH-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
NCc1c(I)cncc1OC(F)(F)F	ZINC000238613708	356304458	/nfs/dbraw/zinc/30/44/58/356304458.db2.gz	PTODKWFFUDGTKD-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
O=C(Nc1cc2c(cc1Cl)NC(=O)C2)[C@@H]1CCCCCN1	ZINC000080994850	192209937	/nfs/dbraw/zinc/20/99/37/192209937.db2.gz	RLOJTTFIXZEVBE-NSHDSACASA-N	0	3	307.781	2.305	10	0		DEAEHN
C[C@@H](NCc1ccn(C)n1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000400499451	283157524	/nfs/dbraw/zinc/15/75/24/283157524.db2.gz	ICXWIJSDHBPEAF-CHWSQXEVSA-N	0	3	308.426	2.155	10	0		DEAEHN
NCc1cncc(I)c1C(F)(F)F	ZINC000306718714	356405074	/nfs/dbraw/zinc/40/50/74/356405074.db2.gz	JEEOGSYYRHGPEZ-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
Cc1c([C@H]2OCC[C@@H]2NC[C@H](O)c2ccccc2C)cnn1C	ZINC000328618757	356460910	/nfs/dbraw/zinc/46/09/10/356460910.db2.gz	FAWRPXQQGNLPJY-OKZBNKHCSA-N	0	3	315.417	2.190	10	0		DEAEHN
CCc1ccc(C(=O)N2CCO[C@@H](CN(C)CC3CC3)C2)o1	ZINC000328651460	356466888	/nfs/dbraw/zinc/46/68/88/356466888.db2.gz	VXQKIISTBQXZLI-HNNXBMFYSA-N	0	3	306.406	2.025	10	0		DEAEHN
CN[C@@H](c1ccc2c(c1)CC(C)(C)O2)[C@H]1CCS(=O)(=O)C1	ZINC000086022660	192545937	/nfs/dbraw/zinc/54/59/37/192545937.db2.gz	MDFLKMVDPDMXAU-WFASDCNBSA-N	0	3	309.431	2.095	10	0		DEAEHN
CC/C=C\CCN1CCN(C[C@@H]2CN(C(C)C)CCO2)CC1	ZINC000588475926	540258150	/nfs/dbraw/zinc/25/81/50/540258150.db2.gz	DKKXSNZCFMFZBB-OOFWQKGWSA-N	0	3	309.498	2.070	10	0		DEAEHN
CCCCN(CC)S(=O)(=O)c1cc(CNC)ccc1OC	ZINC000088916311	192656158	/nfs/dbraw/zinc/65/61/58/192656158.db2.gz	FRHWHBCZFMGJTL-UHFFFAOYSA-N	0	3	314.451	2.225	10	0		DEAEHN
CCN(C1CC1)S(=O)(=O)c1cc(CNC)ccc1Cl	ZINC000088940840	192661344	/nfs/dbraw/zinc/66/13/44/192661344.db2.gz	ABOMAMYTESZPOR-UHFFFAOYSA-N	0	3	302.827	2.232	10	0		DEAEHN
O=C(NCCNc1ccncc1)c1c[nH]c2cc(Cl)ccc12	ZINC000588927428	357435535	/nfs/dbraw/zinc/43/55/35/357435535.db2.gz	WUJLUMSPPUWWNV-UHFFFAOYSA-N	0	3	314.776	2.480	10	0		DEAEHN
Cc1n[nH]c(C)c1CC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179454395	199038674	/nfs/dbraw/zinc/03/86/74/199038674.db2.gz	REJHLSDBVVVYJV-SJLPKXTDSA-N	0	3	312.417	2.131	10	0		DEAEHN
COc1ccc(C[C@H](C)CNC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000179511249	199047259	/nfs/dbraw/zinc/04/72/59/199047259.db2.gz	GWRUHOMDZZGIRJ-HOCLYGCPSA-N	0	3	319.449	2.219	10	0		DEAEHN
COc1ccc(CN)cc1S(=O)(=O)N(C)[C@H](C)CC(C)C	ZINC000089004900	192691934	/nfs/dbraw/zinc/69/19/34/192691934.db2.gz	SBLXAQZXPIJAAU-GFCCVEGCSA-N	0	3	314.451	2.209	10	0		DEAEHN
CCOCCN1CCN(Cc2cccc3nccn32)C[C@@H]1CC	ZINC000180087667	199116000	/nfs/dbraw/zinc/11/60/00/199116000.db2.gz	UJKOURNXIWGTGI-INIZCTEOSA-N	0	3	316.449	2.267	10	0		DEAEHN
CC[C@@H](C)Oc1cc(C(=O)N2CCN3CCC[C@@H]3C2)ccn1	ZINC000180285160	199141598	/nfs/dbraw/zinc/14/15/98/199141598.db2.gz	RCMGPYFQOCAAHQ-UKRRQHHQSA-N	0	3	303.406	2.179	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)NCCN2CCCC[C@H]2C)c1F	ZINC000180408474	199155393	/nfs/dbraw/zinc/15/53/93/199155393.db2.gz	YKQVPLIZBLFRSJ-CYBMUJFWSA-N	0	3	321.396	2.063	10	0		DEAEHN
Cc1nccn1-c1ccc([C@H](C)NC[C@H]2CN(C)CCO2)cc1	ZINC000180490601	199166428	/nfs/dbraw/zinc/16/64/28/199166428.db2.gz	RJQNBVXBHLPOOF-KSSFIOAISA-N	0	3	314.433	2.162	10	0		DEAEHN
CNc1cc(N2CCC[C@H]2CN[C@H](C)c2ccco2)ncn1	ZINC000180574769	199178680	/nfs/dbraw/zinc/17/86/80/199178680.db2.gz	GDSMTAPEGZDSIR-OLZOCXBDSA-N	0	3	301.394	2.431	10	0		DEAEHN
CNc1cc(N2CCC[C@@H]2CN[C@@H](C)c2ccco2)ncn1	ZINC000180574786	199178837	/nfs/dbraw/zinc/17/88/37/199178837.db2.gz	GDSMTAPEGZDSIR-QWHCGFSZSA-N	0	3	301.394	2.431	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)N[C@H]3CCN(CC4CC4)C3)cc2)c1	ZINC000594695177	358320748	/nfs/dbraw/zinc/32/07/48/358320748.db2.gz	MJUOVQASFOUTJL-KRWDZBQOSA-N	0	3	324.428	2.395	10	0		DEAEHN
C(c1noc2c1CCCC2)N1CCCN(C[C@H]2CCCO2)CC1	ZINC000595720389	358532260	/nfs/dbraw/zinc/53/22/60/358532260.db2.gz	LZDOGYURVSWKAR-OAHLLOKOSA-N	0	3	319.449	2.240	10	0		DEAEHN
CCc1nn(C)c(CNCC(C)(C)N(C)C)c1Br	ZINC000089318082	192765575	/nfs/dbraw/zinc/76/55/75/192765575.db2.gz	LZLSGNWESSCJFD-UHFFFAOYSA-N	0	3	317.275	2.175	10	0		DEAEHN
COCc1cccc(CC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000188226199	200212402	/nfs/dbraw/zinc/21/24/02/200212402.db2.gz	NRRDTXAQYSLPEC-YOEHRIQHSA-N	0	3	304.434	2.317	10	0		DEAEHN
CC(C)C[C@@H](CO)N(C)C(=O)NCCN(C)Cc1ccccc1	ZINC000188491095	200255594	/nfs/dbraw/zinc/25/55/94/200255594.db2.gz	GZMRMABZSWHGMO-KRWDZBQOSA-N	0	3	321.465	2.167	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1C	ZINC000188646770	200280414	/nfs/dbraw/zinc/28/04/14/200280414.db2.gz	HICAZQLXUUOISK-YVEFUNNKSA-N	0	3	317.433	2.412	10	0		DEAEHN
COCCO[C@@H]1CCN(Cc2cnc(-c3ccccc3)[nH]2)C1	ZINC000188828842	200308620	/nfs/dbraw/zinc/30/86/20/200308620.db2.gz	AAOHPNKHXVTFHU-MRXNPFEDSA-N	0	3	301.390	2.314	10	0		DEAEHN
CN1CCC[C@H]1CNCc1cnn(Cc2ccc(F)cc2)c1	ZINC000189083478	200346061	/nfs/dbraw/zinc/34/60/61/200346061.db2.gz	MCVQKHMNYJSESL-KRWDZBQOSA-N	0	3	302.397	2.254	10	0		DEAEHN
COC[C@@H](NC[C@@H](C)N1CCOCC1)c1ccc(Cl)cc1	ZINC000193957516	201153564	/nfs/dbraw/zinc/15/35/64/201153564.db2.gz	INGMWVPMQDUHKV-CZUORRHYSA-N	0	3	312.841	2.338	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1nc2cccnc2s1	ZINC000193972250	201156710	/nfs/dbraw/zinc/15/67/10/201156710.db2.gz	LKOFNHNLFRLFQP-LLVKDONJSA-N	0	3	304.419	2.248	10	0		DEAEHN
COC(=O)C(C)(C)[C@H](NCCn1ccnc1)c1ccccc1	ZINC000611405440	361593367	/nfs/dbraw/zinc/59/33/67/361593367.db2.gz	DQWMUMULKYHUEJ-OAHLLOKOSA-N	0	3	301.390	2.413	10	0		DEAEHN
CN(C)CCN(C)C(=O)c1ccc(OC(F)(F)Cl)cc1	ZINC000194719113	201276329	/nfs/dbraw/zinc/27/63/29/201276329.db2.gz	BCIQVGVVRWIXLY-UHFFFAOYSA-N	0	3	306.740	2.488	10	0		DEAEHN
CC(=O)N1CC[C@H](NCCc2cncc(C)n2)c2ccccc21	ZINC000621764563	364538986	/nfs/dbraw/zinc/53/89/86/364538986.db2.gz	IIJSOHQCDRAITQ-KRWDZBQOSA-N	0	3	310.401	2.415	10	0		DEAEHN
NC(=O)c1cccc(CN[C@H]2CCCO[C@@H]2c2ccncc2)c1	ZINC000275426302	212325810	/nfs/dbraw/zinc/32/58/10/212325810.db2.gz	DZMYKIXSTDWMNQ-DLBZAZTESA-N	0	3	311.385	2.190	10	0		DEAEHN
COc1cccc2c1N(C(=O)C[C@@H]1CSCCN1)CCC2	ZINC000091137040	193003104	/nfs/dbraw/zinc/00/31/04/193003104.db2.gz	UGGAHLALHQSKDN-CYBMUJFWSA-N	0	3	306.431	2.070	10	0		DEAEHN
CCC(=O)Nc1cccc(NC(=O)C[C@@H]2CSCCN2)c1	ZINC000091138021	193003294	/nfs/dbraw/zinc/00/32/94/193003294.db2.gz	JUTPNIJIVOOYGY-CYBMUJFWSA-N	0	3	307.419	2.069	10	0		DEAEHN
C[C@H](NC[C@H]1COCCN1C)c1ccc(Br)s1	ZINC000623713381	365141794	/nfs/dbraw/zinc/14/17/94/365141794.db2.gz	ZNTYHROHAZZTRH-UWVGGRQHSA-N	0	3	319.268	2.492	10	0		DEAEHN
CC[C@](C)([C@H](NC)c1cc(Cl)cnc1N)N1CCOCC1	ZINC000091612314	193079514	/nfs/dbraw/zinc/07/95/14/193079514.db2.gz	PYGMOOMRUARWFY-UKRRQHHQSA-N	0	3	312.845	2.079	10	0		DEAEHN
Cc1cc([C@@H](CN)N2CCCOCC2)ccc1Br	ZINC000091471077	193060289	/nfs/dbraw/zinc/06/02/89/193060289.db2.gz	RYKMSLQMKVNHIX-CQSZACIVSA-N	0	3	313.239	2.480	10	0		DEAEHN
c1ccc2sc(CNC[C@H]3CN4CCC[C@@H]4CO3)nc2c1	ZINC000091668828	193087757	/nfs/dbraw/zinc/08/77/57/193087757.db2.gz	VMEXGQDPHLBFGZ-OLZOCXBDSA-N	0	3	303.431	2.249	10	0		DEAEHN
C[C@@H]1CC[C@@H]([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)C[NH2+]1	ZINC000624406933	365413663	/nfs/dbraw/zinc/41/36/63/365413663.db2.gz	PPVFKDIOMQKPJP-PSASIEDQSA-N	0	3	323.245	2.412	10	0		DEAEHN
c1cnn(Cc2cccc(-c3ccc(N4CCNCC4)nc3)c2)c1	ZINC000629707860	367309868	/nfs/dbraw/zinc/30/98/68/367309868.db2.gz	SYLJDCVFGYBBMS-UHFFFAOYSA-N	0	3	319.412	2.403	10	0		DEAEHN
c1c(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)nnn1CC1CC1	ZINC000450605018	242007894	/nfs/dbraw/zinc/00/78/94/242007894.db2.gz	YDAHVZBHLBPXMF-CRAIPNDOSA-N	0	3	315.465	2.137	10	0		DEAEHN
CC(C)NCc1cccc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)c1	ZINC000092113713	193161246	/nfs/dbraw/zinc/16/12/46/193161246.db2.gz	RGXUGPWQZWUELZ-KBPBESRZSA-N	0	3	310.463	2.461	10	0		DEAEHN
Cc1ccc(CN(C)S(=O)(=O)c2ccc(CN)cc2F)o1	ZINC000092115663	193163093	/nfs/dbraw/zinc/16/30/93/193163093.db2.gz	YVCUUWGENYMTFN-UHFFFAOYSA-N	0	3	312.366	2.007	10	0		DEAEHN
CN(CC1CCCC1)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092116177	193164417	/nfs/dbraw/zinc/16/44/17/193164417.db2.gz	VUFIIQBKEGOJLK-UHFFFAOYSA-N	0	3	300.399	2.095	10	0		DEAEHN
C[C@H]1CCCC[C@H]1N(C)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115975	193164510	/nfs/dbraw/zinc/16/45/10/193164510.db2.gz	VRVBLUKWXVQWNH-SMDDNHRTSA-N	0	3	314.426	2.484	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c(C)c1	ZINC000249266193	202794288	/nfs/dbraw/zinc/79/42/88/202794288.db2.gz	ZMOAZKBNUSMWSC-GJZGRUSLSA-N	0	3	317.433	2.183	10	0		DEAEHN
CCN(CC(C)(C)O)c1nc2sccn2c1CNC1CC1	ZINC000092971228	193190383	/nfs/dbraw/zinc/19/03/83/193190383.db2.gz	LZRZMGFYSJSYDH-UHFFFAOYSA-N	0	3	308.451	2.245	10	0		DEAEHN
Cc1ccc(Oc2ccc(NC(=O)[C@@H]3C[C@H](O)CN3)cc2)cc1	ZINC000261786558	203116017	/nfs/dbraw/zinc/11/60/17/203116017.db2.gz	SLZRRSDRTUIGOL-YOEHRIQHSA-N	0	3	312.369	2.449	10	0		DEAEHN
COCc1ccc(CN2CCCN(c3cccnn3)CC2)cc1	ZINC000093150238	193208231	/nfs/dbraw/zinc/20/82/31/193208231.db2.gz	QJBAQEOPMRSXMV-UHFFFAOYSA-N	0	3	312.417	2.335	10	0		DEAEHN
CCC[C@](C)(N)C(=O)Nc1cccc(-c2nnc(C)n2C)c1	ZINC000262522674	203318213	/nfs/dbraw/zinc/31/82/13/203318213.db2.gz	FMAURVLZJTZLDF-INIZCTEOSA-N	0	3	301.394	2.247	10	0		DEAEHN
CN[C@H](Cc1ccc(OC)c(Br)c1)C(OC)OC	ZINC000093304948	193227859	/nfs/dbraw/zinc/22/78/59/193227859.db2.gz	KSJGWWCVIDYZGZ-LLVKDONJSA-N	0	3	318.211	2.207	10	0		DEAEHN
CN[C@]1(C(=O)OC)CCC[C@H]1CCN(C)CCC(F)(F)F	ZINC000093596100	193270667	/nfs/dbraw/zinc/27/06/67/193270667.db2.gz	AXJVCBISPJOTNW-WCQYABFASA-N	0	3	310.360	2.192	10	0		DEAEHN
CN[C@@H](C[C@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1F	ZINC000093700275	193294203	/nfs/dbraw/zinc/29/42/03/193294203.db2.gz	ULEBUHQJMRRBLH-DOMZBBRYSA-N	0	3	314.426	2.148	10	0		DEAEHN
CCC[NH2+][C@]1(C(=O)[O-])CCC[C@@H](N(CC)[C@@H](C)COC)C1	ZINC000093751443	193300713	/nfs/dbraw/zinc/30/07/13/193300713.db2.gz	YYMWCFACUIZHEF-SQWLQELKSA-N	0	3	300.443	2.109	10	0		DEAEHN
Cc1nn([C@H]2CCC[C@@](NC3CC3)(C(N)=O)C2)c(C)c1Cl	ZINC000093759587	193301553	/nfs/dbraw/zinc/30/15/53/193301553.db2.gz	BLUVUUNMEDRXIG-WFASDCNBSA-N	0	3	310.829	2.245	10	0		DEAEHN
NC(=O)[C@]1(N)CCC[C@@H](Oc2ccccc2C(F)(F)F)C1	ZINC000093773818	193304422	/nfs/dbraw/zinc/30/44/22/193304422.db2.gz	RGTHJCFHKYZNIS-RNCFNFMXSA-N	0	3	302.296	2.210	10	0		DEAEHN
CN[C@H](c1ccc(Cl)c(OC)c1)[C@@H]1CN2CCC[C@@H]2CO1	ZINC000094009079	193338474	/nfs/dbraw/zinc/33/84/74/193338474.db2.gz	MQQHZLQQZGIFDK-UHOFOFEASA-N	0	3	310.825	2.472	10	0		DEAEHN
COC(=O)[C@]1(NC(C)C)CC[C@H](N(C)CCC(F)(F)F)C1	ZINC000093831809	193314660	/nfs/dbraw/zinc/31/46/60/193314660.db2.gz	JVGFNFGBFGPPJK-AAEUAGOBSA-N	0	3	310.360	2.333	10	0		DEAEHN
CCCN[C@]1(C(=O)OC)CC[C@H](N(C)CCC(F)(F)F)C1	ZINC000093831862	193314701	/nfs/dbraw/zinc/31/47/01/193314701.db2.gz	GOLDLXKAIDQKKJ-WCQYABFASA-N	0	3	310.360	2.335	10	0		DEAEHN
CC1(C)CCC[C@@H]1NS(=O)(=O)c1cccc2c1CCNC2	ZINC000094330101	193359099	/nfs/dbraw/zinc/35/90/99/193359099.db2.gz	MXMYNPFBXMMGRT-HNNXBMFYSA-N	0	3	308.447	2.189	10	0		DEAEHN
NCc1ccc(C(F)(F)F)nc1N1CCO[C@H]2CCC[C@@H]21	ZINC000094334239	193360230	/nfs/dbraw/zinc/36/02/30/193360230.db2.gz	SZASFRRNBSNXEG-QWRGUYRKSA-N	0	3	301.312	2.317	10	0		DEAEHN
CCCN[C@H](CCCS(=O)(=O)CC)c1ccc(F)cn1	ZINC000094048077	193341506	/nfs/dbraw/zinc/34/15/06/193341506.db2.gz	UPUTZMKSSVXMMV-CYBMUJFWSA-N	0	3	302.415	2.476	10	0		DEAEHN
CCN[C@H](c1cc(C)c(F)cc1F)[C@H]1CCS(=O)(=O)C1	ZINC000094077966	193344174	/nfs/dbraw/zinc/34/41/74/193344174.db2.gz	ZFQRTMAGRWTXCM-HZMBPMFUSA-N	0	3	303.374	2.359	10	0		DEAEHN
NC(=S)c1ccc(CN2CCN3CCCC[C@@H]3C2)c(F)c1	ZINC000094439551	193369305	/nfs/dbraw/zinc/36/93/05/193369305.db2.gz	OAOVXECHKVFOLI-CQSZACIVSA-N	0	3	307.438	2.130	10	0		DEAEHN
CCOC(=O)C[C@@]1(N2CCN(C)CC2)CSCCC1(C)C	ZINC000094485594	193372884	/nfs/dbraw/zinc/37/28/84/193372884.db2.gz	HLISKKTWJKWPGD-MRXNPFEDSA-N	0	3	314.495	2.089	10	0		DEAEHN
CCOC(=O)COC[C@H](N)c1cc(C)c(Br)s1	ZINC000094539544	193378118	/nfs/dbraw/zinc/37/81/18/193378118.db2.gz	AIECTXIZXGAXGZ-QMMMGPOBSA-N	0	3	322.224	2.399	10	0		DEAEHN
C[C@@H](CN1CCCC1)Nc1nc2c(Br)cccn2n1	ZINC000094604223	193383614	/nfs/dbraw/zinc/38/36/14/193383614.db2.gz	JRWIIGOHJHRGOC-JTQLQIEISA-N	0	3	324.226	2.388	10	0		DEAEHN
COc1ccc(CS(=O)(=O)c2cccc(F)c2)cc1CN	ZINC000094627236	193385056	/nfs/dbraw/zinc/38/50/56/193385056.db2.gz	FZRRGOVCFCWSBO-UHFFFAOYSA-N	0	3	309.362	2.267	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2ccc(N(C)C)nc2)CCN1C	ZINC000266361452	205293391	/nfs/dbraw/zinc/29/33/91/205293391.db2.gz	JGLWMKHUFHBHGT-TZMCWYRMSA-N	0	3	305.426	2.094	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)Nc2ccc(N(C)C)nc2)CCN1C	ZINC000266361449	205293638	/nfs/dbraw/zinc/29/36/38/205293638.db2.gz	JGLWMKHUFHBHGT-GXTWGEPZSA-N	0	3	305.426	2.094	10	0		DEAEHN
CCN1CCN([C@H](CN)c2ccccc2C(F)(F)F)CC1	ZINC000019996882	182175415	/nfs/dbraw/zinc/17/54/15/182175415.db2.gz	GBPHXPOMGWZFBO-CQSZACIVSA-N	0	3	301.356	2.343	10	0		DEAEHN
CCN1CCN([C@@H](CN)c2ccccc2C(F)(F)F)CC1	ZINC000019996878	182175628	/nfs/dbraw/zinc/17/56/28/182175628.db2.gz	GBPHXPOMGWZFBO-AWEZNQCLSA-N	0	3	301.356	2.343	10	0		DEAEHN
CCN(c1ccccc1)S(=O)(=O)c1ccc(F)c(CN)c1	ZINC000020189246	182195482	/nfs/dbraw/zinc/19/54/82/182195482.db2.gz	AQWSWBCADPDMPS-UHFFFAOYSA-N	0	3	308.378	2.500	10	0		DEAEHN
Cc1ccc(CN)cc1S(=O)(=O)N[C@H](C)c1ccccc1	ZINC000020189406	182195668	/nfs/dbraw/zinc/19/56/68/182195668.db2.gz	BWCNUYBGNJCIJW-CYBMUJFWSA-N	0	3	304.415	2.493	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1ccc(C)c(Br)c1	ZINC000159923570	197373286	/nfs/dbraw/zinc/37/32/86/197373286.db2.gz	HNINMKHWSPPVGW-GFCCVEGCSA-N	0	3	315.211	2.450	10	0		DEAEHN
COc1ccc(CN(C)CCn2ccnc2C)c(OC)c1OC	ZINC000020600735	182236208	/nfs/dbraw/zinc/23/62/08/182236208.db2.gz	LIBUJPCJFAAQCK-UHFFFAOYSA-N	0	3	319.405	2.349	10	0		DEAEHN
O=C1C[C@H](NC2Cc3ccccc3C2)C(=O)N1c1ccc(F)cc1	ZINC000021344553	182272612	/nfs/dbraw/zinc/27/26/12/182272612.db2.gz	JAHFEOVUHHMXDE-KRWDZBQOSA-N	0	3	324.355	2.215	10	0		DEAEHN
O=S(=O)(Nc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCNC1	ZINC000021813353	182292965	/nfs/dbraw/zinc/29/29/65/182292965.db2.gz	DRZCBRQSTLDXGF-LLVKDONJSA-N	0	3	324.324	2.079	10	0		DEAEHN
Cc1ccc(Cl)cc1NC(=O)CN1CCN2CCC[C@@H]2C1	ZINC000023249642	182354247	/nfs/dbraw/zinc/35/42/47/182354247.db2.gz	QGAISVFBPMRVAJ-CQSZACIVSA-N	0	3	307.825	2.367	10	0		DEAEHN
COc1cc(C[NH2+]C[C@H]2CCOC2)cc(Br)c1[O-]	ZINC000037738273	182921917	/nfs/dbraw/zinc/92/19/17/182921917.db2.gz	XGKVBUOMJXRGGZ-SECBINFHSA-N	0	3	316.195	2.289	10	0		DEAEHN
CO[C@@H](C)[C@H](C)N[C@H](C)c1cccc(NS(C)(=O)=O)c1	ZINC000467382174	248700149	/nfs/dbraw/zinc/70/01/49/248700149.db2.gz	OVXJCGITDKOZDR-TUAOUCFPSA-N	0	3	300.424	2.132	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2cc(Br)ccc2C)C1	ZINC000040633596	183111437	/nfs/dbraw/zinc/11/14/37/183111437.db2.gz	XXVXRRWKIDAVHI-PWSUYJOCSA-N	0	3	313.195	2.073	10	0		DEAEHN
CCCNC(=O)[C@H](C)Oc1c(Br)cccc1CN	ZINC000042411321	183264986	/nfs/dbraw/zinc/26/49/86/183264986.db2.gz	HXDLXTFRPRTAJW-VIFPVBQESA-N	0	3	315.211	2.201	10	0		DEAEHN
COCCN(C)[C@@H](CN)c1cc(Br)ccc1F	ZINC000042458656	183272961	/nfs/dbraw/zinc/27/29/61/183272961.db2.gz	HNXMVLCLYNLPCA-LBPRGKRZSA-N	0	3	305.191	2.166	10	0		DEAEHN
COC[C@H](O)CN(C)Cc1ccc(F)c(Br)c1	ZINC000042514074	183278488	/nfs/dbraw/zinc/27/84/88/183278488.db2.gz	BWBZLJRZLOAUQT-SNVBAGLBSA-N	0	3	306.175	2.027	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)cc1)N1CCCC[C@@H]1C(N)=O	ZINC000042946467	183320586	/nfs/dbraw/zinc/32/05/86/183320586.db2.gz	NRGSUZIVQQOQER-RBSFLKMASA-N	0	3	309.841	2.458	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccccc1Cl)N1CCC[C@@H]1C(=O)NC	ZINC000043052322	183333053	/nfs/dbraw/zinc/33/30/53/183333053.db2.gz	NJGGABSHIPYHST-RBSFLKMASA-N	0	3	309.841	2.329	10	0		DEAEHN
NC[C@H](c1ccc(Br)s1)N1CCCC[C@@H]1CO	ZINC000043261299	183349105	/nfs/dbraw/zinc/34/91/05/183349105.db2.gz	WENDTQMOQCAMAL-NXEZZACHSA-N	0	3	319.268	2.357	10	0		DEAEHN
NC[C@@H](c1cc(Br)cs1)N1CCC(CO)CC1	ZINC000043285136	183350278	/nfs/dbraw/zinc/35/02/78/183350278.db2.gz	BDGQIKRACZLTEO-NSHDSACASA-N	0	3	319.268	2.215	10	0		DEAEHN
COCCN(C)[C@@H](c1cc(Br)cs1)[C@@H](C)N	ZINC000043286637	183350800	/nfs/dbraw/zinc/35/08/00/183350800.db2.gz	DTGNXDUSRJEZTE-LDYMZIIASA-N	0	3	307.257	2.477	10	0		DEAEHN
CCCN[C@H](c1ccc(F)cc1F)[C@H]1CCS(=O)(=O)C1	ZINC000043301240	183352556	/nfs/dbraw/zinc/35/25/56/183352556.db2.gz	MCAYHRALHRHKHE-HZMBPMFUSA-N	0	3	303.374	2.440	10	0		DEAEHN
COc1ccc2ccccc2c1[C@H](N)[C@H]1CCS(=O)(=O)C1	ZINC000043300091	183352560	/nfs/dbraw/zinc/35/25/60/183352560.db2.gz	KBYFAIVAUSEYKZ-BLLLJJGKSA-N	0	3	305.399	2.283	10	0		DEAEHN
CN[C@H](c1ccc(Br)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000043300258	183352592	/nfs/dbraw/zinc/35/25/92/183352592.db2.gz	VQZGDMUGKLTQRL-ZYHUDNBSSA-N	0	3	318.236	2.144	10	0		DEAEHN
CCCN[C@H](c1cc(F)ccc1F)[C@H]1CCS(=O)(=O)C1	ZINC000043301290	183352722	/nfs/dbraw/zinc/35/27/22/183352722.db2.gz	GWHAAWVRHCIKAB-HZMBPMFUSA-N	0	3	303.374	2.440	10	0		DEAEHN
CNCc1c(N2CCO[C@@H]3CCCC[C@@H]32)nc2sccn12	ZINC000043426697	183361746	/nfs/dbraw/zinc/36/17/46/183361746.db2.gz	FHFRXNBQJFJITL-WCQYABFASA-N	0	3	306.435	2.263	10	0		DEAEHN
Cc1ccc(OCCCN2CCN(C[C@@H](C)O)[C@H](C)C2)cc1C	ZINC000105823876	194138909	/nfs/dbraw/zinc/13/89/09/194138909.db2.gz	YYCQFOMMNUKDAK-QZTJIDSGSA-N	0	3	320.477	2.459	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(C(=O)[C@@H]2CCCCN2CC)C1	ZINC000105852812	194146318	/nfs/dbraw/zinc/14/63/18/194146318.db2.gz	GVAUMRZHBWMOMV-CVEARBPZSA-N	0	3	318.465	2.483	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)NCCC2=CCCCC2)c1	ZINC000105881349	194155851	/nfs/dbraw/zinc/15/58/51/194155851.db2.gz	VJZWDOSZBLLPDA-OAHLLOKOSA-N	0	3	304.438	2.176	10	0		DEAEHN
O=C(c1ncncc1Cl)N1CCC[C@H]1CN1CCCCC1	ZINC000176157717	296307015	/nfs/dbraw/zinc/30/70/15/296307015.db2.gz	WGMRMEBVMGEDKW-LBPRGKRZSA-N	0	3	308.813	2.221	10	0		DEAEHN
CCc1ccc(CN2CCN([C@H](CC)C(N)=S)CC2)cc1	ZINC000109469088	194267362	/nfs/dbraw/zinc/26/73/62/194267362.db2.gz	KKXMWUIEADTXRB-MRXNPFEDSA-N	0	3	305.491	2.431	10	0		DEAEHN
CN(Cc1cc(F)cc(C(F)(F)F)c1)C[C@@H]1CNCCO1	ZINC000159325568	197345999	/nfs/dbraw/zinc/34/59/99/197345999.db2.gz	ZIQKDYBRADNTOH-ZDUSSCGKSA-N	0	3	306.303	2.265	10	0		DEAEHN
CNC(=O)[C@@H](C)N[C@@H]1CCc2cc(Br)ccc2C1	ZINC000110822301	194360702	/nfs/dbraw/zinc/36/07/02/194360702.db2.gz	IEXUVURJTLHFNV-NOZJJQNGSA-N	0	3	311.223	2.031	10	0		DEAEHN
C[NH2+][C@@H](C)c1cccc(S(=O)(=O)[N-]c2ccncc2C)c1	ZINC000111043901	194385922	/nfs/dbraw/zinc/38/59/22/194385922.db2.gz	JRFHBMNAULXDQE-LBPRGKRZSA-N	0	3	305.403	2.471	10	0		DEAEHN
CN(C)CCN(C)CCNc1ccccc1Br	ZINC000111150585	194396561	/nfs/dbraw/zinc/39/65/61/194396561.db2.gz	MERWYAKJPBJQCJ-UHFFFAOYSA-N	0	3	300.244	2.354	10	0		DEAEHN
CN(C)CCN(C)CCNc1cccc(Br)c1	ZINC000111150680	194396939	/nfs/dbraw/zinc/39/69/39/194396939.db2.gz	JBUDMBXGPBXCOV-UHFFFAOYSA-N	0	3	300.244	2.354	10	0		DEAEHN
O=C1CCCN1C[C@@H](O)CN[C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000127986998	296319297	/nfs/dbraw/zinc/31/92/97/296319297.db2.gz	PMDHFXMTWKQMIT-DOTOQJQBSA-N	0	3	322.836	2.364	10	0		DEAEHN
COCCNCc1sc(N(C)CCOC(C)C)nc1C	ZINC000157735195	197211395	/nfs/dbraw/zinc/21/13/95/197211395.db2.gz	VQFPKQXPFKYKDI-UHFFFAOYSA-N	0	3	301.456	2.049	10	0		DEAEHN
Cc1ccccc1[C@@H](N)CN1CCN(CC(F)(F)F)CC1	ZINC000061941108	184197618	/nfs/dbraw/zinc/19/76/18/184197618.db2.gz	XUZRADFCMNRDPQ-AWEZNQCLSA-N	0	3	301.356	2.175	10	0		DEAEHN
COCCN1C(=O)C[C@H](N)[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000062210259	184221048	/nfs/dbraw/zinc/22/10/48/184221048.db2.gz	RIBLIBKEOYYMCA-WCQYABFASA-N	0	3	303.189	2.241	10	0		DEAEHN
COCCN1C(=O)CC[C@@H](N)[C@H]1c1c(F)cccc1Cl	ZINC000062213712	184221994	/nfs/dbraw/zinc/22/19/94/184221994.db2.gz	GPFIHYJXOHVICC-RISCZKNCSA-N	0	3	300.761	2.116	10	0		DEAEHN
COCCNCc1cc(Br)ccc1OCCOC	ZINC000062730069	184250437	/nfs/dbraw/zinc/25/04/37/184250437.db2.gz	FVWWHAITLHUNAZ-UHFFFAOYSA-N	0	3	318.211	2.210	10	0		DEAEHN
CN(C)[C@H]1CCN(CC(=O)c2ccc(Br)s2)C1	ZINC000062966551	184262737	/nfs/dbraw/zinc/26/27/37/184262737.db2.gz	SEODIBRYANTQQL-VIFPVBQESA-N	0	3	317.252	2.329	10	0		DEAEHN
CCCNc1cc(C(=O)N2CC[C@@H](N(C)C)C2)cc(Cl)n1	ZINC000062984773	184264956	/nfs/dbraw/zinc/26/49/56/184264956.db2.gz	PDUGEJVRNXABFN-GFCCVEGCSA-N	0	3	310.829	2.333	10	0		DEAEHN
CC1(C)C[C@H](N)c2ccc(OCCCS(C)(=O)=O)cc2O1	ZINC000063014434	184266504	/nfs/dbraw/zinc/26/65/04/184266504.db2.gz	SMGPFPVKTOFGKS-ZDUSSCGKSA-N	0	3	313.419	2.061	10	0		DEAEHN
CCN(CC)[C@@H](CNCCCS(C)(=O)=O)c1ccccc1	ZINC000063014741	184267045	/nfs/dbraw/zinc/26/70/45/184267045.db2.gz	FCDBQKYVYMEOBU-INIZCTEOSA-N	0	3	312.479	2.094	10	0		DEAEHN
CS(=O)(=O)CCC[C@@H](N)c1ccccc1Br	ZINC000063017155	184267082	/nfs/dbraw/zinc/26/70/82/184267082.db2.gz	BBYKTERAPCOELO-LLVKDONJSA-N	0	3	306.225	2.274	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@@H]1CCSc2ccccc21	ZINC000536017769	284929351	/nfs/dbraw/zinc/92/93/51/284929351.db2.gz	PRFWFFHBUYHOGC-OAHLLOKOSA-N	0	3	313.426	2.311	10	0		DEAEHN
CC[C@H]1CN(c2ccccc2)CCN1CCC(=O)N(C)CC	ZINC000184021343	207364387	/nfs/dbraw/zinc/36/43/87/207364387.db2.gz	HKTFVKPTRQAIPJ-INIZCTEOSA-N	0	3	303.450	2.456	10	0		DEAEHN
CCCS(=O)(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccccc1	ZINC000360721916	207399707	/nfs/dbraw/zinc/39/97/07/207399707.db2.gz	RPCOTUJCWFGSNO-SJORKVTESA-N	0	3	322.474	2.465	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N([C@@H](C)C(C)C)C1CC1	ZINC000086396083	285020368	/nfs/dbraw/zinc/02/03/68/285020368.db2.gz	RDMYTKXFIQAPBY-GOEBONIOSA-N	0	3	311.470	2.316	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cc(Cl)c(N)c(Cl)c2)C1	ZINC000119162675	194984466	/nfs/dbraw/zinc/98/44/66/194984466.db2.gz	PMCOJRHKQQBREN-VIFPVBQESA-N	0	3	302.205	2.352	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(C(=O)[C@H]3CCCCN3)C2)c1	ZINC000119789039	195036421	/nfs/dbraw/zinc/03/64/21/195036421.db2.gz	OZSDTCAOZVYYKJ-CXAGYDPISA-N	0	3	318.417	2.162	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2)N(C)C	ZINC000119811091	195042057	/nfs/dbraw/zinc/04/20/57/195042057.db2.gz	NSCJWOXPAURUMH-ABAIWWIYSA-N	0	3	303.406	2.089	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)c2sc3cccnc3c2N)CCN1C	ZINC000159160324	197332116	/nfs/dbraw/zinc/33/21/16/197332116.db2.gz	XYIHBEQQYLHICU-NXEZZACHSA-N	0	3	304.419	2.091	10	0		DEAEHN
CCN[C@H](Cc1ccncc1)c1c(Br)cnn1C	ZINC000159223601	197336970	/nfs/dbraw/zinc/33/69/70/197336970.db2.gz	XXAFQLMNMFPOFU-GFCCVEGCSA-N	0	3	309.211	2.471	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)C)cc(CNC(C)(C)C)c1F	ZINC000159057260	197323033	/nfs/dbraw/zinc/32/30/33/197323033.db2.gz	SJXWMLBYEPEVLX-UHFFFAOYSA-N	0	3	302.415	2.273	10	0		DEAEHN
COCCn1ncc(Br)c1[C@H](N)C1CCCC1	ZINC000158833944	197304365	/nfs/dbraw/zinc/30/43/65/197304365.db2.gz	NNZOEAFDRDVNGF-LLVKDONJSA-N	0	3	302.216	2.482	10	0		DEAEHN
CC1(C)CN([C@H](CN)c2ccc3c(c2)OCCO3)CCS1	ZINC000158669592	197292934	/nfs/dbraw/zinc/29/29/34/197292934.db2.gz	QRCXUBUIRJWZMK-CYBMUJFWSA-N	0	3	308.447	2.285	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)cs1	ZINC000158756192	197298976	/nfs/dbraw/zinc/29/89/76/197298976.db2.gz	MUULRSJBCGZXQN-RYUDHWBXSA-N	0	3	314.476	2.278	10	0		DEAEHN
CN1CCCN(c2cc(Br)c(F)cc2N)CC1	ZINC000157762665	197213804	/nfs/dbraw/zinc/21/38/04/197213804.db2.gz	BUOZBTYXMYTWNP-UHFFFAOYSA-N	0	3	302.191	2.312	10	0		DEAEHN
CNc1nc(NCc2cscc2C)nc(N2CCCC2)n1	ZINC000157521185	197194801	/nfs/dbraw/zinc/19/48/01/197194801.db2.gz	BPVLDKYYXITZGU-UHFFFAOYSA-N	0	3	304.423	2.496	10	0		DEAEHN
CCN[C@@](C)(C[C@H](C)N(C)CCOC(C)C)C(=O)OCC	ZINC000157527791	197194252	/nfs/dbraw/zinc/19/42/52/197194252.db2.gz	JSCLCPAMERVPPO-HOCLYGCPSA-N	0	3	302.459	2.053	10	0		DEAEHN
CCCNc1nnc(C(=O)N[C@H](CC(C)C)CN(C)C)s1	ZINC000157335087	197179665	/nfs/dbraw/zinc/17/96/65/197179665.db2.gz	YDHAGGRXOAJASB-LLVKDONJSA-N	0	3	313.471	2.066	10	0		DEAEHN
C[C@@](O)(Cc1ccc(Br)cc1)C[C@H]1COCCN1	ZINC000156909555	197148984	/nfs/dbraw/zinc/14/89/84/197148984.db2.gz	ZHXGFDPHHCLFOX-UONOGXRCSA-N	0	3	314.223	2.121	10	0		DEAEHN
Cc1cc(Sc2nnnn2C2CCCC2)c(CN)c(C)n1	ZINC000156844996	197144588	/nfs/dbraw/zinc/14/45/88/197144588.db2.gz	AOHJMYZYNGPJNF-UHFFFAOYSA-N	0	3	304.423	2.410	10	0		DEAEHN
CC1CCC2(CSC(NC[C@@H]3CCCS3(=O)=O)=N2)CC1	ZINC000155417742	197053404	/nfs/dbraw/zinc/05/34/04/197053404.db2.gz	OVUWZEXSEKMKFR-LXVYMNJGSA-N	0	3	316.492	2.205	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc(COC)cc2)CCN1C[C@@H](C)O	ZINC000120709512	195221438	/nfs/dbraw/zinc/22/14/38/195221438.db2.gz	XWMJDVBCBAHSRB-QAPCUYQASA-N	0	3	306.450	2.110	10	0		DEAEHN
CCOCCN1CCN(Cc2ccc(NC(C)=O)cc2)C[C@@H]1C	ZINC000120879117	195256019	/nfs/dbraw/zinc/25/60/19/195256019.db2.gz	QWWOXVKSVRPGJC-HNNXBMFYSA-N	0	3	319.449	2.188	10	0		DEAEHN
Cc1cccc(CN2CCN3C[C@@H](OCC4CC4)C[C@H]3C2)n1	ZINC000503720654	257207698	/nfs/dbraw/zinc/20/76/98/257207698.db2.gz	UQEOYSQOQUWWGW-ROUUACIJSA-N	0	3	301.434	2.075	10	0		DEAEHN
Cc1c([C@H]2OCC[C@@H]2NC[C@H](O)c2cccc(F)c2)cnn1C	ZINC000328619963	257264544	/nfs/dbraw/zinc/26/45/44/257264544.db2.gz	GONMBVNMVKDKSN-YESZJQIVSA-N	0	3	319.380	2.021	10	0		DEAEHN
C[C@H](CN1CCCC1)N1C(=O)C2(CC2)N[C@@H]1c1cccs1	ZINC000121955617	195381243	/nfs/dbraw/zinc/38/12/43/195381243.db2.gz	BRECEUSTWUKIRJ-OCCSQVGLSA-N	0	3	305.447	2.195	10	0		DEAEHN
C[C@@H](CN1CCCC1)N1C(=O)C2(CC2)N[C@@H]1c1cccs1	ZINC000121955437	195381378	/nfs/dbraw/zinc/38/13/78/195381378.db2.gz	BRECEUSTWUKIRJ-JSGCOSHPSA-N	0	3	305.447	2.195	10	0		DEAEHN
CN[C@H](CS(=O)(=O)c1ccc(Br)cc1)C(C)C	ZINC000124133344	195606692	/nfs/dbraw/zinc/60/66/92/195606692.db2.gz	VVHCETHEYDHHQN-GFCCVEGCSA-N	0	3	320.252	2.467	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@H]1C[C@@]12CCCc1ccccc12	ZINC000562450598	291985977	/nfs/dbraw/zinc/98/59/77/291985977.db2.gz	RQTUZAQEYVUIRW-UYAOXDASSA-N	0	3	321.424	2.326	10	0		DEAEHN
O=C(CNC[C@@H]1CCCO1)NCc1ccc(Cl)cc1Cl	ZINC000232741519	132553905	/nfs/dbraw/zinc/55/39/05/132553905.db2.gz	RILZQSLTMDJECJ-LBPRGKRZSA-N	0	3	317.216	2.378	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCO[C@@H](c3ccc(C)o3)C2)C1	ZINC000246092849	132576556	/nfs/dbraw/zinc/57/65/56/132576556.db2.gz	CNOPXZJWMCWFLH-GDBMZVCRSA-N	0	3	321.421	2.155	10	0		DEAEHN
Cc1ccsc1[C@@H](C)N[C@H]1CCN(C2CCOCC2)C1=O	ZINC000358208578	133128399	/nfs/dbraw/zinc/12/83/99/133128399.db2.gz	WGFXKXSBFIMFMU-OCCSQVGLSA-N	0	3	308.447	2.487	10	0		DEAEHN
c1ccc2c(c1)CC[C@@H](CN1CCN(c3cnccn3)CC1)C2	ZINC000359586949	133132761	/nfs/dbraw/zinc/13/27/61/133132761.db2.gz	DKYLYXUYENWTNO-MRXNPFEDSA-N	0	3	308.429	2.404	10	0		DEAEHN
O=C(NC[C@H](CO)C1CC1)c1cccc(CN2CCCC2)c1	ZINC000359823129	133147197	/nfs/dbraw/zinc/14/71/97/133147197.db2.gz	ODSULXKZOYZGJX-QGZVFWFLSA-N	0	3	302.418	2.031	10	0		DEAEHN
CC(C)N(CCN(C)C)C(=O)NCc1ccc2cc[nH]c2n1	ZINC000360490658	133185381	/nfs/dbraw/zinc/18/53/81/133185381.db2.gz	KXPQTAVXHCBJHA-UHFFFAOYSA-N	0	3	303.410	2.045	10	0		DEAEHN
CN(CCCC(=O)OC(C)(C)C)C(=O)CC1CCN(C)CC1	ZINC000362714074	133247506	/nfs/dbraw/zinc/24/75/06/133247506.db2.gz	CYCOEBRPDIBFAR-UHFFFAOYSA-N	0	3	312.454	2.299	10	0		DEAEHN
CCOC(=O)[C@@H](NC(=O)CC1CCN(C)CC1)c1ccccc1	ZINC000362869805	133256280	/nfs/dbraw/zinc/25/62/80/133256280.db2.gz	WNYYSZICOGGHSH-KRWDZBQOSA-N	0	3	318.417	2.139	10	0		DEAEHN
c1ccc(OCCOCCN2CCS[C@H]3COCC[C@H]32)cc1	ZINC000362959637	133258536	/nfs/dbraw/zinc/25/85/36/133258536.db2.gz	BUPOMMCRTNYVFS-SJORKVTESA-N	0	3	323.458	2.288	10	0		DEAEHN
O=C(c1cccc(CN2CCCC2)c1)N1CC([C@@H]2CCOC2)C1	ZINC000377060749	133317392	/nfs/dbraw/zinc/31/73/92/133317392.db2.gz	HWRJVSGHRWWSOT-QGZVFWFLSA-N	0	3	314.429	2.391	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCCOCC1CCC1	ZINC000564668885	292104680	/nfs/dbraw/zinc/10/46/80/292104680.db2.gz	RIQSUTUOODNTIS-CVEARBPZSA-N	0	3	309.454	2.071	10	0		DEAEHN
COC(=O)c1coc(C(=O)N2CCC[C@@H]2CN2CCCCC2)c1	ZINC000183520973	144929854	/nfs/dbraw/zinc/92/98/54/144929854.db2.gz	NHXOXMNNIPMIHW-CQSZACIVSA-N	0	3	320.389	2.157	10	0		DEAEHN
CC(C)=C(F)C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000188158542	145007587	/nfs/dbraw/zinc/00/75/87/145007587.db2.gz	OPHXTZGUYWJWDB-SFHVURJKSA-N	0	3	320.408	2.345	10	0		DEAEHN
COc1ccc(O)cc1C(=O)N[C@H](C)CN1CCC[C@H](C)C1	ZINC000188744052	145016565	/nfs/dbraw/zinc/01/65/65/145016565.db2.gz	PVXMWTJWPFACOG-QWHCGFSZSA-N	0	3	306.406	2.251	10	0		DEAEHN
CCN1CCN([C@@H](C)CNc2ncnc3c(C)csc32)CC1	ZINC000189973396	145036508	/nfs/dbraw/zinc/03/65/08/145036508.db2.gz	LRHWMABXEMTXJA-ZDUSSCGKSA-N	0	3	319.478	2.438	10	0		DEAEHN
CCc1nc(C2CCN([C@H](C)C(=O)NCCC(C)C)CC2)n[nH]1	ZINC000190662640	145045518	/nfs/dbraw/zinc/04/55/18/145045518.db2.gz	BQRXVGCJOORWLZ-CYBMUJFWSA-N	0	3	321.469	2.097	10	0		DEAEHN
CCc1n[nH]c(C2CCN([C@H](C)C(=O)NCCC(C)C)CC2)n1	ZINC000190662640	145045519	/nfs/dbraw/zinc/04/55/19/145045519.db2.gz	BQRXVGCJOORWLZ-CYBMUJFWSA-N	0	3	321.469	2.097	10	0		DEAEHN
CCc1nnc(C2CCN([C@H](C)C(=O)NCCC(C)C)CC2)[nH]1	ZINC000190662640	145045520	/nfs/dbraw/zinc/04/55/20/145045520.db2.gz	BQRXVGCJOORWLZ-CYBMUJFWSA-N	0	3	321.469	2.097	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2ccc(OCC3CC3)cc2)C[C@@H]1C	ZINC000191335890	145056435	/nfs/dbraw/zinc/05/64/35/145056435.db2.gz	YPYOGQMKOYNXBH-JKSUJKDBSA-N	0	3	318.461	2.362	10	0		DEAEHN
C[C@H](N[C@@H]1CCOC[C@@H]1C)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000191824215	145065002	/nfs/dbraw/zinc/06/50/02/145065002.db2.gz	XOEJUUVWTZCJFT-COPLHBTASA-N	0	3	315.410	2.305	10	0		DEAEHN
Cc1cnn([C@H]2CCCN(C[C@@H]3CC4(CCC4)C(=O)O3)C2)c1	ZINC000192009891	145068939	/nfs/dbraw/zinc/06/89/39/145068939.db2.gz	TUVUVKUGGOHVBU-GJZGRUSLSA-N	0	3	303.406	2.314	10	0		DEAEHN
Cc1cc(=O)[nH]c([C@@H](C)N2CCC(Cc3nccn3C)CC2)n1	ZINC000192576839	145075368	/nfs/dbraw/zinc/07/53/68/145075368.db2.gz	SURPQNGIYDFFJF-CYBMUJFWSA-N	0	3	315.421	2.240	10	0		DEAEHN
COc1ccc(OC)c([C@@H](C)NCCCN2CCCC2=O)c1	ZINC000193478362	145086403	/nfs/dbraw/zinc/08/64/03/145086403.db2.gz	PXZVRUCWOSILPQ-CYBMUJFWSA-N	0	3	306.406	2.367	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)[C@@H]1OCCc2ccccc21	ZINC000246285414	145097228	/nfs/dbraw/zinc/09/72/28/145097228.db2.gz	OANVQDWGOWCYLI-WMLDXEAASA-N	0	3	302.418	2.291	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NC[C@@H]2CCCO[C@H]2C(C)(C)C)C1	ZINC000246301819	145097670	/nfs/dbraw/zinc/09/76/70/145097670.db2.gz	FICXVLWVRQCNCM-RRFJBIMHSA-N	0	3	311.470	2.173	10	0		DEAEHN
C[C@H]1CN(Cc2ccc3c(c2)CCC3)C[C@H]1N1CCOCC1	ZINC000246374423	145100679	/nfs/dbraw/zinc/10/06/79/145100679.db2.gz	HQRCLTBFXOGQGH-HNAYVOBHSA-N	0	3	300.446	2.328	10	0		DEAEHN
COc1cccc([C@H](C)N2C[C@H](C)[C@H](N3CCOCC3)C2)c1	ZINC000246611550	145108146	/nfs/dbraw/zinc/10/81/46/145108146.db2.gz	YDPHHQPQKJVMNE-RLFYNMQTSA-N	0	3	304.434	2.409	10	0		DEAEHN
C[C@H](C(=O)NCCc1cccs1)N1CC[C@H]2OCCC[C@H]2C1	ZINC000246613066	145108675	/nfs/dbraw/zinc/10/86/75/145108675.db2.gz	JPDHYOAAVCWURF-IJEWVQPXSA-N	0	3	322.474	2.296	10	0		DEAEHN
CN(C)C(=O)[C@@H](c1ccccc1)N1CC[C@H](c2cnn(C)c2)C1	ZINC000246815665	145115799	/nfs/dbraw/zinc/11/57/99/145115799.db2.gz	BSYQKRFJLQQWGS-DOTOQJQBSA-N	0	3	312.417	2.039	10	0		DEAEHN
CCC[C@]1(C)CCCN([C@H](C)C(=O)N(C)CC(=O)NC2CC2)C1	ZINC000246947809	145120599	/nfs/dbraw/zinc/12/05/99/145120599.db2.gz	ARUHFQGDSWHZMM-RDTXWAMCSA-N	0	3	323.481	2.014	10	0		DEAEHN
C[C@@H](C(=O)Nc1c(F)cccc1F)N1CCN2CCC[C@H]2C1	ZINC000247021580	145123798	/nfs/dbraw/zinc/12/37/98/145123798.db2.gz	CRDLERLYOSLBCJ-RYUDHWBXSA-N	0	3	309.360	2.072	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H]2CCc3ccccc32)C1	ZINC000247512100	145139940	/nfs/dbraw/zinc/13/99/40/145139940.db2.gz	PXLAMAVLMFGKST-CVEARBPZSA-N	0	3	301.434	2.500	10	0		DEAEHN
Cc1ccccc1C[C@@H](C)NC(=O)N1CCN2CCC[C@H]2C1	ZINC000247655362	145142643	/nfs/dbraw/zinc/14/26/43/145142643.db2.gz	XZWLVSGQOFKKCI-WBVHZDCISA-N	0	3	301.434	2.416	10	0		DEAEHN
CN(C(=O)CN1CC[C@@]2(O)CCCC[C@H]2C1)C1CCCCC1	ZINC000248043512	145147239	/nfs/dbraw/zinc/14/72/39/145147239.db2.gz	UGIFMCUSAGUZFN-YJBOKZPZSA-N	0	3	308.466	2.405	10	0		DEAEHN
Cc1ccc(C)c(OC[C@@H](O)CN2CCN3CCCC[C@H]3C2)c1	ZINC000248343956	145151135	/nfs/dbraw/zinc/15/11/35/145151135.db2.gz	KYNUXFBYWDGHBB-ROUUACIJSA-N	0	3	318.461	2.213	10	0		DEAEHN
Cc1nc(C[C@@H]2CCCN(CCO[C@H]3CCCCO3)C2)no1	ZINC000248578667	145159354	/nfs/dbraw/zinc/15/93/54/145159354.db2.gz	OAWRTQOROVMVJC-HOCLYGCPSA-N	0	3	309.410	2.176	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)NCCc1ccc(F)cc1	ZINC000261649028	145213374	/nfs/dbraw/zinc/21/33/74/145213374.db2.gz	FNNXFSCOIRRICK-IIDMSEBBSA-N	0	3	320.408	2.017	10	0		DEAEHN
C[C@]1(c2ccccc2)CCCN(C(=O)C2(N)CCOCC2)C1	ZINC000261695717	145217879	/nfs/dbraw/zinc/21/78/79/145217879.db2.gz	DNFQWGOKPHQZQA-KRWDZBQOSA-N	0	3	302.418	2.075	10	0		DEAEHN
COc1ccc(CN2CCNC[C@@H]2c2cccnc2)cc1OC	ZINC000261728439	145220675	/nfs/dbraw/zinc/22/06/75/145220675.db2.gz	NZCGCFLANIPUBF-MRXNPFEDSA-N	0	3	313.401	2.245	10	0		DEAEHN
Cc1ccc(NC(=O)CN2CCNC[C@H]2c2cccnc2)cc1C	ZINC000261759434	145223451	/nfs/dbraw/zinc/22/34/51/145223451.db2.gz	NWVVLLZRDACGNI-SFHVURJKSA-N	0	3	324.428	2.283	10	0		DEAEHN
Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)C2(N)CCOCC2)C1	ZINC000261868182	145235178	/nfs/dbraw/zinc/23/51/78/145235178.db2.gz	NWWKGXSABSCRSC-HUUCEWRRSA-N	0	3	302.418	2.207	10	0		DEAEHN
CC(=O)Nc1cccc(N[C@@H]2CCC[C@@H]2[C@@H]2COCCN2)c1	ZINC000261952215	145246632	/nfs/dbraw/zinc/24/66/32/145246632.db2.gz	OLOHDWZWYPDLIA-BBWFWOEESA-N	0	3	303.406	2.214	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)NCCc1ccccc1F	ZINC000261958525	145246780	/nfs/dbraw/zinc/24/67/80/145246780.db2.gz	XKAUKDGLVBPWKU-SIIHOXLZSA-N	0	3	320.408	2.017	10	0		DEAEHN
CN(Cc1ccc(F)cc1)C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C	ZINC000261974003	145248812	/nfs/dbraw/zinc/24/88/12/145248812.db2.gz	ZJYWFYKKGDZVSU-RLFYNMQTSA-N	0	3	320.408	2.317	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)N1CCN(Cc2cccs2)CC1	ZINC000262392046	145280608	/nfs/dbraw/zinc/28/06/08/145280608.db2.gz	BJVNYLINCHVKBC-HNNXBMFYSA-N	0	3	321.490	2.171	10	0		DEAEHN
C[C@H](Cc1cccs1)NC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000262399837	145281528	/nfs/dbraw/zinc/28/15/28/145281528.db2.gz	CDPBLEOHFMRECV-MBMVNNNZSA-N	0	3	322.474	2.328	10	0		DEAEHN
NC1(C(=O)N2CCC[C@@H](c3noc(C4CC4)n3)C2)CCCCC1	ZINC000262475751	145286444	/nfs/dbraw/zinc/28/64/44/145286444.db2.gz	PNNNEOVDYZRKAR-CYBMUJFWSA-N	0	3	318.421	2.315	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)NCc1ccc(Cl)cc1	ZINC000262498034	145288019	/nfs/dbraw/zinc/28/80/19/145288019.db2.gz	LRASTTIFBPIFRY-JJRVBVJISA-N	0	3	322.836	2.489	10	0		DEAEHN
COCCNCCNC(=O)[C@@H](Sc1ccccc1)C(C)C	ZINC000262665266	145298838	/nfs/dbraw/zinc/29/88/38/145298838.db2.gz	OJFGTTYSCIYONG-HNNXBMFYSA-N	0	3	310.463	2.156	10	0		DEAEHN
C[C@@H]1NCCN(C(=O)c2cnn(-c3cccc(Cl)c3)c2)[C@H]1C	ZINC000262787966	145304949	/nfs/dbraw/zinc/30/49/49/145304949.db2.gz	MSVSBQCRAOEAIW-RYUDHWBXSA-N	0	3	318.808	2.348	10	0		DEAEHN
C[C@H]1NCCN(C(=O)c2ccn(-c3cccc(Cl)c3)n2)[C@H]1C	ZINC000262787903	145305143	/nfs/dbraw/zinc/30/51/43/145305143.db2.gz	MQABGMXTYMLVOK-NEPJUHHUSA-N	0	3	318.808	2.348	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(Cc2ccc3c(c2)CCCC3)n1	ZINC000263125141	145327697	/nfs/dbraw/zinc/32/76/97/145327697.db2.gz	BFEVHRGFYSPIBV-INIZCTEOSA-N	0	3	312.417	2.115	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2cc3c(s2)CCCC3)n1	ZINC000263150699	145330483	/nfs/dbraw/zinc/33/04/83/145330483.db2.gz	DBECTJWKPOQXEX-LLVKDONJSA-N	0	3	304.419	2.253	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(CCc2ccc(Cl)s2)n1	ZINC000263210062	145336460	/nfs/dbraw/zinc/33/64/60/145336460.db2.gz	KEJMYSGZWQNWMR-JTQLQIEISA-N	0	3	312.826	2.146	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2cccc(C(F)(F)F)c2)n1	ZINC000263210915	145336465	/nfs/dbraw/zinc/33/64/65/145336465.db2.gz	KHXHLDIZGGCSHK-LLVKDONJSA-N	0	3	312.295	2.332	10	0		DEAEHN
Cc1ccc2nc(C)c(-c3nc([C@@H]4CNCCN4C)no3)cc2c1	ZINC000263221673	145338010	/nfs/dbraw/zinc/33/80/10/145338010.db2.gz	LYWFMIRSYSSWSD-INIZCTEOSA-N	0	3	323.400	2.478	10	0		DEAEHN
C[C@@H](Cc1ccccc1F)c1nc([C@@H]2CNCCN2C)no1	ZINC000263227211	145338493	/nfs/dbraw/zinc/33/84/93/145338493.db2.gz	MZLSMISFBVSHJN-FZMZJTMJSA-N	0	3	304.369	2.131	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2ccccc2OCC2CC2)n1	ZINC000263228091	145338878	/nfs/dbraw/zinc/33/88/78/145338878.db2.gz	NBMZIGOXAVTXRJ-AWEZNQCLSA-N	0	3	314.389	2.102	10	0		DEAEHN
CC(=O)c1ccc(CC(=O)N(C)[C@@H]2CCN(C3CC3)C2)cc1	ZINC000347006152	146178069	/nfs/dbraw/zinc/17/80/69/146178069.db2.gz	MPYNJTFWEIEOQR-QGZVFWFLSA-N	0	3	300.402	2.127	10	0		DEAEHN
O[C@@H](CCNCc1cnn(Cc2ccccc2)c1)C(F)(F)F	ZINC000349317781	146367658	/nfs/dbraw/zinc/36/76/58/146367658.db2.gz	QEEDWJIQJCQTMP-AWEZNQCLSA-N	0	3	313.323	2.334	10	0		DEAEHN
CCOc1ccccc1-n1nnnc1SC[C@H](C)N(C)C	ZINC000358848294	147218163	/nfs/dbraw/zinc/21/81/63/147218163.db2.gz	AOEJPPRYIBPYOP-NSHDSACASA-N	0	3	307.423	2.103	10	0		DEAEHN
CCCN(CCN1CCCCCC1)C(=O)NCc1ccn(C)n1	ZINC000358944693	147235492	/nfs/dbraw/zinc/23/54/92/147235492.db2.gz	XZTWIBFHZSLPSZ-UHFFFAOYSA-N	0	3	321.469	2.218	10	0		DEAEHN
CCCc1occc1C(=O)NC1CCN([C@H]2CCOC2)CC1	ZINC000374232263	148221100	/nfs/dbraw/zinc/22/11/00/148221100.db2.gz	RUOFNJLGUHGBEW-AWEZNQCLSA-N	0	3	306.406	2.215	10	0		DEAEHN
C[C@H]1COCCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000374362638	148235229	/nfs/dbraw/zinc/23/52/29/148235229.db2.gz	RRCVVCLMUSMKHI-OAHLLOKOSA-N	0	3	302.418	2.391	10	0		DEAEHN
CCc1ccccc1CNC(=O)NC[C@H]1CCCN1CCOC	ZINC000127248180	401726017	/nfs/dbraw/zinc/72/60/17/401726017.db2.gz	AHZTWACZXRBSOI-QGZVFWFLSA-N	0	3	319.449	2.159	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(CC(C)C)CC(C)C	ZINC000111867152	401726415	/nfs/dbraw/zinc/72/64/15/401726415.db2.gz	UJICDOJKCGJQND-MRXNPFEDSA-N	0	3	313.486	2.421	10	0		DEAEHN
CCCCCC(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000114415280	401798637	/nfs/dbraw/zinc/79/86/37/401798637.db2.gz	JTQOHQHXMYPZRS-UHFFFAOYSA-N	0	3	318.465	2.372	10	0		DEAEHN
CC(C)CC1(CNC(=O)N2CCO[C@H](CN(C)C)C2)CCC1	ZINC000129750721	401808176	/nfs/dbraw/zinc/80/81/76/401808176.db2.gz	BTVAABBODSSSMJ-OAHLLOKOSA-N	0	3	311.470	2.175	10	0		DEAEHN
CCN(CC)CC(=O)N[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000075262721	401756615	/nfs/dbraw/zinc/75/66/15/401756615.db2.gz	QNUOWSWOADIWCE-CQSZACIVSA-N	0	3	300.406	2.391	10	0		DEAEHN
O=C(CN[C@@H]1CCCC[C@H]1n1cccn1)NC1CCCCC1	ZINC000128166935	401765836	/nfs/dbraw/zinc/76/58/36/401765836.db2.gz	LPYHHBZIZFBWFU-HZPDHXFCSA-N	0	3	304.438	2.405	10	0		DEAEHN
Cc1ccc(OCC(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1C	ZINC000113232232	401771162	/nfs/dbraw/zinc/77/11/62/401771162.db2.gz	PAWQQTHDTBZAGY-HOTGVXAUSA-N	0	3	302.418	2.377	10	0		DEAEHN
CC[C@@H](CO)N1CCN(CCCOc2cc(C)cc(C)c2)CC1	ZINC000075961991	401775523	/nfs/dbraw/zinc/77/55/23/401775523.db2.gz	CPRKTNUKEMKYKP-SFHVURJKSA-N	0	3	320.477	2.461	10	0		DEAEHN
Cc1ccc(C)c(S(=O)(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000113305815	401775992	/nfs/dbraw/zinc/77/59/92/401775992.db2.gz	GGIHQRMQDBNPFR-GJZGRUSLSA-N	0	3	308.447	2.161	10	0		DEAEHN
CC[C@@H]1CCC[C@H](NC(=O)NC[C@@H]2CCCN2CCOC)C1	ZINC000077581494	401821175	/nfs/dbraw/zinc/82/11/75/401821175.db2.gz	PBXQEAMIDZBNNR-PMPSAXMXSA-N	0	3	311.470	2.365	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@@H]1COc2ccccc2C1	ZINC000077729995	401827832	/nfs/dbraw/zinc/82/78/32/401827832.db2.gz	UISSMDHSUFKBJB-JKSUJKDBSA-N	0	3	304.434	2.330	10	0		DEAEHN
COC(=O)[C@H](C)CN(CCn1ccnc1)Cc1ccccc1	ZINC000131417403	401849748	/nfs/dbraw/zinc/84/97/48/401849748.db2.gz	GZJDDALKRCRRGJ-OAHLLOKOSA-N	0	3	301.390	2.194	10	0		DEAEHN
Cc1ccc(C(C)(C)C(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000116787027	401859439	/nfs/dbraw/zinc/85/94/39/401859439.db2.gz	MIMGHJCZXUNNKL-INIZCTEOSA-N	0	3	304.434	2.062	10	0		DEAEHN
Cc1cc(F)cc2[nH]c(C(=O)N3CCO[C@H](CN(C)C)C3)cc21	ZINC000116797038	401859809	/nfs/dbraw/zinc/85/98/09/401859809.db2.gz	AIGQQMZNCBDBRN-CYBMUJFWSA-N	0	3	319.380	2.018	10	0		DEAEHN
C[C@@H](O)CCNCc1cc2c(cc1Br)OCO2	ZINC000078781456	401865869	/nfs/dbraw/zinc/86/58/69/401865869.db2.gz	OHDTWXFYQYAFRP-MRVPVSSYSA-N	0	3	302.168	2.038	10	0		DEAEHN
C[C@@H](O)CCNCc1cc2c(c(Br)c1)OCO2	ZINC000078781120	401865995	/nfs/dbraw/zinc/86/59/95/401865995.db2.gz	MXYLTVYXYXPRFF-MRVPVSSYSA-N	0	3	302.168	2.038	10	0		DEAEHN
Cc1ccc([C@H](C)NC(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000117036182	401866933	/nfs/dbraw/zinc/86/69/33/401866933.db2.gz	JTUCIAPJLLBRDU-HOCLYGCPSA-N	0	3	305.422	2.028	10	0		DEAEHN
CC[C@@](C)(O)C[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000087013609	401925581	/nfs/dbraw/zinc/92/55/81/401925581.db2.gz	RRPUFAYFIFFRCF-CYBMUJFWSA-N	0	3	318.211	2.414	10	0		DEAEHN
CCOc1ccc(S(=O)(=O)NC[C@@H](C)N(CC)CC)cc1	ZINC000032073228	401876182	/nfs/dbraw/zinc/87/61/82/401876182.db2.gz	ODZZFPYMWBXLIC-CYBMUJFWSA-N	0	3	314.451	2.094	10	0		DEAEHN
Cc1cc(C)n(Cc2ccc(C(=O)N(C)CCN(C)C)cc2)n1	ZINC000080391317	401889421	/nfs/dbraw/zinc/88/94/21/401889421.db2.gz	YJTVSAXMNGLENV-UHFFFAOYSA-N	0	3	314.433	2.182	10	0		DEAEHN
C[C@H](CNCCS(=O)(=O)NCC1CCC1)Cc1ccccc1	ZINC000133814611	401894932	/nfs/dbraw/zinc/89/49/32/401894932.db2.gz	ILLAGQFVOCKEIT-HNNXBMFYSA-N	0	3	324.490	2.174	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(CCC(=O)NC(C)C)C2)c1	ZINC000083249912	401900721	/nfs/dbraw/zinc/90/07/21/401900721.db2.gz	DDTNDHBBWSAVMS-AWEZNQCLSA-N	0	3	320.433	2.408	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1ccc(OC)cc1C	ZINC000036076760	401901722	/nfs/dbraw/zinc/90/17/22/401901722.db2.gz	HFDHEWGQSJNUKP-ZDUSSCGKSA-N	0	3	314.451	2.012	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1ccc(F)c(C)c1	ZINC000036076758	401901876	/nfs/dbraw/zinc/90/18/76/401901876.db2.gz	HTEOBGLGSFMISL-GFCCVEGCSA-N	0	3	302.415	2.143	10	0		DEAEHN
CCCC(=O)OC[C@@H](O)CN(CCOC)Cc1ccccc1C	ZINC000036099892	401902579	/nfs/dbraw/zinc/90/25/79/401902579.db2.gz	BQGOCEOYOCOTQJ-KRWDZBQOSA-N	0	3	323.433	2.148	10	0		DEAEHN
CC(C)(C)OC[C@@H](O)CN(CCc1ccccc1)[C@@H]1CCOC1	ZINC000084496774	401905763	/nfs/dbraw/zinc/90/57/63/401905763.db2.gz	HKJSXDZZHVZCEK-MSOLQXFVSA-N	0	3	321.461	2.496	10	0		DEAEHN
C[C@@H](CCc1ccc(OC(F)F)cc1)NCC(=O)N(C)C	ZINC000037225379	401911362	/nfs/dbraw/zinc/91/13/62/401911362.db2.gz	KWILUMLIBRMRPQ-NSHDSACASA-N	0	3	300.349	2.287	10	0		DEAEHN
O=C(c1ccc(Br)cc1)N1CCN2CCC[C@H]2C1	ZINC000037503243	401914237	/nfs/dbraw/zinc/91/42/37/401914237.db2.gz	ALVVEJBBQCEHFW-ZDUSSCGKSA-N	0	3	309.207	2.369	10	0		DEAEHN
CCN(CC)C(=O)[C@@H]1CCCN1CCN(C)c1ccccc1	ZINC000085797143	401919277	/nfs/dbraw/zinc/91/92/77/401919277.db2.gz	MORATNYPIIPVMJ-KRWDZBQOSA-N	0	3	303.450	2.456	10	0		DEAEHN
C[C@H](NC[C@@H]1CCCC[C@@H]1O)c1ccc(S(C)(=O)=O)cc1	ZINC000085962765	401919809	/nfs/dbraw/zinc/91/98/09/401919809.db2.gz	KGMGNJXQJXQMBW-NOLJZWGESA-N	0	3	311.447	2.292	10	0		DEAEHN
C[C@@H](C(=O)N1CC[C@H](Oc2cccnc2)C1)N1[C@H](C)CC[C@@H]1C	ZINC000119604148	401961547	/nfs/dbraw/zinc/96/15/47/401961547.db2.gz	BYTLBUJNFZEGFE-IVSAIRAKSA-N	0	3	317.433	2.323	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H](c2ccccc2)CN(C[C@@H]2CCCO2)C1	ZINC000135459842	401940879	/nfs/dbraw/zinc/94/08/79/401940879.db2.gz	VNRCAVXMQWQXIN-ZACQAIPSSA-N	0	3	303.402	2.444	10	0		DEAEHN
Cc1cccc([C@@H](C)CNC(=O)N2CCO[C@H](CN(C)C)C2)c1	ZINC000121028623	402011076	/nfs/dbraw/zinc/01/10/76/402011076.db2.gz	HODNTLCQVDRJTE-DOTOQJQBSA-N	0	3	319.449	2.071	10	0		DEAEHN
CCC(CC)CN1CCN(C[C@@H]2CN(C(C)C)CCO2)CC1	ZINC000121070503	402013409	/nfs/dbraw/zinc/01/34/09/402013409.db2.gz	PCTMDCTUNWSIBI-GOSISDBHSA-N	0	3	311.514	2.149	10	0		DEAEHN
O=[S@@](C[C@@H]1CCCCN1)c1cccc(Br)n1	ZINC000095092392	402025951	/nfs/dbraw/zinc/02/59/51/402025951.db2.gz	MMLIHXRXBDAPCP-XXFAHNHDSA-N	0	3	303.225	2.094	10	0		DEAEHN
COC(=O)c1ccc(CN2CC[C@@H](c3cnn(C)c3)C2)cc1F	ZINC000151539569	402042081	/nfs/dbraw/zinc/04/20/81/402042081.db2.gz	MYRCJMZMGJOAFE-CYBMUJFWSA-N	0	3	317.364	2.335	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCCOc2ccccc2)C1	ZINC000052519359	402042955	/nfs/dbraw/zinc/04/29/55/402042955.db2.gz	PRHXFDHUVJZEIB-OAHLLOKOSA-N	0	3	305.422	2.239	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](Cc1ccccc1)CN(C)C)C1CCOCC1	ZINC000121585795	402045337	/nfs/dbraw/zinc/04/53/37/402045337.db2.gz	MCTQQRDTMOEXNW-YJBOKZPZSA-N	0	3	318.461	2.338	10	0		DEAEHN
CC(C)CN(CCN(C)C)C(=O)CCc1nc(C(C)(C)C)no1	ZINC000120737061	402000511	/nfs/dbraw/zinc/00/05/11/402000511.db2.gz	WBBHXRHIVORUFU-UHFFFAOYSA-N	0	3	324.469	2.346	10	0		DEAEHN
COc1cccc(OCC(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000120963251	402008607	/nfs/dbraw/zinc/00/86/07/402008607.db2.gz	UFRQONJICQRORS-AWEZNQCLSA-N	0	3	308.422	2.167	10	0		DEAEHN
COCCN(CC(=O)N1CCC[C@@H](C(F)(F)F)C1)CC(C)C	ZINC000122909611	402100723	/nfs/dbraw/zinc/10/07/23/402100723.db2.gz	QRCXBIHBTSSAED-CYBMUJFWSA-N	0	3	324.387	2.392	10	0		DEAEHN
CCO[C@H]1C[C@@H](N(C)C(=O)NC2CCN(C)CC2)C12CCCC2	ZINC000152899433	402115834	/nfs/dbraw/zinc/11/58/34/402115834.db2.gz	OMIKTXLUOZEKET-CVEARBPZSA-N	0	3	323.481	2.460	10	0		DEAEHN
COc1ccc(NC(=O)N2CC[C@H](N(C)C)C2)c2cccnc12	ZINC000123230229	402116798	/nfs/dbraw/zinc/11/67/98/402116798.db2.gz	NYSFHZKSBWTSFB-LBPRGKRZSA-N	0	3	314.389	2.411	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)NC[C@@H](O)C(C)C)c1ccccc1	ZINC000152952282	402118514	/nfs/dbraw/zinc/11/85/14/402118514.db2.gz	RJSWKOJVCZBERV-IAGOWNOFSA-N	0	3	321.465	2.386	10	0		DEAEHN
COC(=O)c1[nH]c(C)c(C(=O)NCCN2CCCC[C@H]2C)c1C	ZINC000153015761	402122420	/nfs/dbraw/zinc/12/24/20/402122420.db2.gz	PTELHMVVMKRKCL-LLVKDONJSA-N	0	3	321.421	2.022	10	0		DEAEHN
CN[C@H](C)C(=O)N(C)Cc1cc(Br)ccc1OC	ZINC000054074716	402062672	/nfs/dbraw/zinc/06/26/72/402062672.db2.gz	FRELQTSAGKUALA-SECBINFHSA-N	0	3	315.211	2.024	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1cnc(C(F)(F)F)nc1	ZINC000123532862	402133066	/nfs/dbraw/zinc/13/30/66/402133066.db2.gz	DMHWYYSLEWMBLZ-NSHDSACASA-N	0	3	318.343	2.202	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCc1ccc(Cl)nc1	ZINC000123557265	402133999	/nfs/dbraw/zinc/13/39/99/402133999.db2.gz	OQUJLRDGAZBMLZ-CQSZACIVSA-N	0	3	324.856	2.403	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCc1ccc(Cl)nc1	ZINC000123557500	402134523	/nfs/dbraw/zinc/13/45/23/402134523.db2.gz	OQUJLRDGAZBMLZ-AWEZNQCLSA-N	0	3	324.856	2.403	10	0		DEAEHN
C[C@H](CN[C@@H](C)c1cc(F)c(F)c(F)c1)N1CCOCC1	ZINC000123359781	402123956	/nfs/dbraw/zinc/12/39/56/402123956.db2.gz	IAKAHRJMYDSNNC-MNOVXSKESA-N	0	3	302.340	2.475	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)CSC[C@@H]2CCCCO2)CCN1C	ZINC000123765162	402144792	/nfs/dbraw/zinc/14/47/92/402144792.db2.gz	PNPONEWIJXXZAI-ILXRZTDVSA-N	0	3	314.495	2.230	10	0		DEAEHN
Cc1cc(C)nc(SCC(=O)N[C@@H](CC(C)C)CN(C)C)n1	ZINC000068223001	402188033	/nfs/dbraw/zinc/18/80/33/402188033.db2.gz	JBPRSIVSZJPVMD-AWEZNQCLSA-N	0	3	324.494	2.278	10	0		DEAEHN
CCC(CC)(CO)CNC(=O)c1ccccc1OCCN(C)C	ZINC000154032759	402188305	/nfs/dbraw/zinc/18/83/05/402188305.db2.gz	VLOPXTLQBUHAAD-UHFFFAOYSA-N	0	3	322.449	2.156	10	0		DEAEHN
CCN(CCNC(=O)N1CCC(OCC(C)C)CC1)C1CC1	ZINC000102064993	402162449	/nfs/dbraw/zinc/16/24/49/402162449.db2.gz	WRTXTRDPNGDQEH-UHFFFAOYSA-N	0	3	311.470	2.317	10	0		DEAEHN
O=C(CN1CCC[C@@H]1C1CCC1)N1CCO[C@@H]2CCCC[C@H]21	ZINC000102927446	402175013	/nfs/dbraw/zinc/17/50/13/402175013.db2.gz	WHZIJCHFYCOVSB-BRWVUGGUSA-N	0	3	306.450	2.421	10	0		DEAEHN
CC(C)COc1ccc(CC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000106770338	402215780	/nfs/dbraw/zinc/21/57/80/402215780.db2.gz	GSOUKYXLCSWBHY-MRXNPFEDSA-N	0	3	304.434	2.426	10	0		DEAEHN
CCc1ccc(CN2CCN(C(=O)[C@H](CC)N(C)C)CC2)s1	ZINC000154570932	402218883	/nfs/dbraw/zinc/21/88/83/402218883.db2.gz	GDXREJNNJVXARB-INIZCTEOSA-N	0	3	323.506	2.295	10	0		DEAEHN
CC(=O)Nc1cccc([C@@H](C)NC[C@@]2(CCO)CCOC2)c1	ZINC000125436532	402232698	/nfs/dbraw/zinc/23/26/98/402232698.db2.gz	NIBLYOZBSHBBOK-CXAGYDPISA-N	0	3	306.406	2.085	10	0		DEAEHN
C[C@H](NC(=O)NC[C@H]1CCCN(C)C1)c1ccc2c(c1)OCO2	ZINC000108546615	402256265	/nfs/dbraw/zinc/25/62/65/402256265.db2.gz	GKNIFHNDRVIMNI-QWHCGFSZSA-N	0	3	319.405	2.117	10	0		DEAEHN
Clc1cccc(-c2cc3c(N4CCNCC4)nccn3n2)c1	ZINC000070459143	402261375	/nfs/dbraw/zinc/26/13/75/402261375.db2.gz	YFRMDGAYFCGSOW-UHFFFAOYSA-N	0	3	313.792	2.459	10	0		DEAEHN
Cc1nn(C)c2sc(C(=O)N[C@@H]3CN(C(C)C)C[C@@H]3C)cc12	ZINC000155615772	402262797	/nfs/dbraw/zinc/26/27/97/402262797.db2.gz	WXIMRUVCQVZQLD-GXFFZTMASA-N	0	3	320.462	2.402	10	0		DEAEHN
CN(C[C@@H]1CCN(C)C1)C(=O)c1ccccc1Br	ZINC000071190420	402271431	/nfs/dbraw/zinc/27/14/31/402271431.db2.gz	AIYGFVNTDDSFPA-LLVKDONJSA-N	0	3	311.223	2.473	10	0		DEAEHN
COCCC1(CNC(=O)NCCN2CCCC[C@H]2C)CCC1	ZINC000156513831	402283835	/nfs/dbraw/zinc/28/38/35/402283835.db2.gz	JCBRUWHERZSWLX-OAHLLOKOSA-N	0	3	311.470	2.367	10	0		DEAEHN
C[C@H](NCC(=O)Nc1ccc(C(=O)N(C)C)cc1)C1CCCC1	ZINC000184669986	402290048	/nfs/dbraw/zinc/29/00/48/402290048.db2.gz	KTKXDSHAHUYREM-ZDUSSCGKSA-N	0	3	317.433	2.495	10	0		DEAEHN
CCO[C@@H](CCNC(=O)NC[C@@H]1CCCN1C)C1CCCC1	ZINC000176272381	402295554	/nfs/dbraw/zinc/29/55/54/402295554.db2.gz	KGLYRQZVRAMFMY-HOTGVXAUSA-N	0	3	311.470	2.365	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1ccc(C(N)=O)c(C)c1	ZINC000176347007	402301562	/nfs/dbraw/zinc/30/15/62/402301562.db2.gz	AOLNFCOWDOYJRO-CQSZACIVSA-N	0	3	318.421	2.042	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H](C)c1ccncc1	ZINC000176348878	402301674	/nfs/dbraw/zinc/30/16/74/402301674.db2.gz	HCROUIZMTFEJJY-IMJJTQAJSA-N	0	3	302.422	2.411	10	0		DEAEHN
Cc1ccc2ncnc(N[C@H](C)CCN3CCN(C)CC3)c2c1	ZINC000184827319	402302359	/nfs/dbraw/zinc/30/23/59/402302359.db2.gz	YRIDLDOBSWPWCY-OAHLLOKOSA-N	0	3	313.449	2.376	10	0		DEAEHN
CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)NCc1ccc([O-])c(F)c1	ZINC000176390000	402305471	/nfs/dbraw/zinc/30/54/71/402305471.db2.gz	FKDPXTQRJAQMFQ-CYBMUJFWSA-N	0	3	309.385	2.157	10	0		DEAEHN
CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NCc1ccc([O-])c(F)c1	ZINC000176390000	402305474	/nfs/dbraw/zinc/30/54/74/402305474.db2.gz	FKDPXTQRJAQMFQ-CYBMUJFWSA-N	0	3	309.385	2.157	10	0		DEAEHN
Cc1cc2c(cc1C)[C@H](C(=O)N1CCN3CCC[C@@H]3C1)CO2	ZINC000184881015	402306433	/nfs/dbraw/zinc/30/64/33/402306433.db2.gz	DYPUKQQRGKEOEE-GDBMZVCRSA-N	0	3	300.402	2.086	10	0		DEAEHN
C[C@H](C(=O)NC[C@H](c1ccccc1)N(C)C)C1CCOCC1	ZINC000158555125	402308304	/nfs/dbraw/zinc/30/83/04/402308304.db2.gz	HMBHCGFAVVQTKL-WMLDXEAASA-N	0	3	304.434	2.468	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)NC[C@@H](C)N(C)C2CC2)s1	ZINC000176438012	402309460	/nfs/dbraw/zinc/30/94/60/402309460.db2.gz	VZHSWCKFWNFPOJ-MWLCHTKSSA-N	0	3	311.451	2.371	10	0		DEAEHN
CCN(CCNC(=O)c1sc([C@@H](C)OC)nc1C)C1CC1	ZINC000176458351	402311323	/nfs/dbraw/zinc/31/13/23/402311323.db2.gz	DGEBBFPMZOJJRX-LLVKDONJSA-N	0	3	311.451	2.373	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)N(C)C	ZINC000158991231	402315526	/nfs/dbraw/zinc/31/55/26/402315526.db2.gz	DTXCLPIVPHQDPC-QZTJIDSGSA-N	0	3	317.477	2.498	10	0		DEAEHN
Cn1cc(-c2cc(CN3CC[C@]4(O)CCCC[C@@H]4C3)on2)cn1	ZINC000185026908	402318059	/nfs/dbraw/zinc/31/80/59/402318059.db2.gz	DZQVKTUJGWNQMX-RHSMWYFYSA-N	0	3	316.405	2.202	10	0		DEAEHN
CCS(=O)(=O)NCCNc1c(C)cnc2c(C)cccc21	ZINC000185291087	402341562	/nfs/dbraw/zinc/34/15/62/402341562.db2.gz	XBRQDMIYZPFHFM-UHFFFAOYSA-N	0	3	307.419	2.203	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1ccc(C)cc1C	ZINC000176894826	402347420	/nfs/dbraw/zinc/34/74/20/402347420.db2.gz	BJICERXQZOWZDD-OAHLLOKOSA-N	0	3	317.433	2.185	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)NCCCc1cccc(F)c1	ZINC000185371392	402347837	/nfs/dbraw/zinc/34/78/37/402347837.db2.gz	QQEBADNYVKNZJO-UHFFFAOYSA-N	0	3	307.413	2.494	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1c(C)cccc1C	ZINC000176905508	402348603	/nfs/dbraw/zinc/34/86/03/402348603.db2.gz	KLGLCYXETWLOBC-HNNXBMFYSA-N	0	3	317.433	2.185	10	0		DEAEHN
C[C@H]1CN(C2CCN(CCN(C)c3ccccc3)CC2)CCO1	ZINC000177280052	402387266	/nfs/dbraw/zinc/38/72/66/402387266.db2.gz	BJCMUPHGXDTYFI-KRWDZBQOSA-N	0	3	317.477	2.308	10	0		DEAEHN
C[C@@H](CC(F)(F)F)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000231791485	402356092	/nfs/dbraw/zinc/35/60/92/402356092.db2.gz	IYBVUUSOUGSVSP-IUCAKERBSA-N	0	3	310.341	2.326	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)COc1cccc(C(C)=O)c1	ZINC000176985322	402356853	/nfs/dbraw/zinc/35/68/53/402356853.db2.gz	VXISDMIRHIWUMP-INIZCTEOSA-N	0	3	318.417	2.211	10	0		DEAEHN
CO[C@@H](C)c1nc(C)c(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)s1	ZINC000177007793	402358752	/nfs/dbraw/zinc/35/87/52/402358752.db2.gz	SSFZJLPMPGPXJA-XQQFMLRXSA-N	0	3	323.462	2.468	10	0		DEAEHN
COC[C@@H](CNCc1ccc(Br)c(F)c1)OC	ZINC000227707895	402333260	/nfs/dbraw/zinc/33/32/60/402333260.db2.gz	MYKHJTJLZFQOLU-SNVBAGLBSA-N	0	3	306.175	2.339	10	0		DEAEHN
O=C([C@H]1CCCc2n[nH]cc21)N1CCCN(C2CCCC2)CC1	ZINC000177365754	402394998	/nfs/dbraw/zinc/39/49/98/402394998.db2.gz	QQSXITDYHCGOLK-HNNXBMFYSA-N	0	3	316.449	2.307	10	0		DEAEHN
CCC[C@@H]1CCCCN1C(=O)NC[C@H]1CCCN1CCOC	ZINC000186139576	402405037	/nfs/dbraw/zinc/40/50/37/402405037.db2.gz	RBIXTBLTCQFEEY-HZPDHXFCSA-N	0	3	311.470	2.461	10	0		DEAEHN
COC(=O)c1coc(C(=O)NCc2ccccc2CN(C)C)c1	ZINC000186148912	402405409	/nfs/dbraw/zinc/40/54/09/402405409.db2.gz	RACVOLQLFIJJJB-UHFFFAOYSA-N	0	3	316.357	2.058	10	0		DEAEHN
C[C@@H](c1ccccc1Cl)N1CCN(C(=O)C2(N)CC2)CC1	ZINC000237485932	402409563	/nfs/dbraw/zinc/40/95/63/402409563.db2.gz	OUUGFFMMOMRFRQ-LBPRGKRZSA-N	0	3	307.825	2.037	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H](C)c1nc2ccccc2n1C)N(C)C	ZINC000162209336	402413371	/nfs/dbraw/zinc/41/33/71/402413371.db2.gz	JUNHWPTWAUKUFK-IUODEOHRSA-N	0	3	302.422	2.481	10	0		DEAEHN
CC(C)OCCN1CCC(NC(=O)NCC2(C)CCC2)CC1	ZINC000177590403	402418537	/nfs/dbraw/zinc/41/85/37/402418537.db2.gz	FPUDACCWZVYFOD-UHFFFAOYSA-N	0	3	311.470	2.365	10	0		DEAEHN
CC(=O)c1cc(C(=O)N[C@@H](C)CN2CCCCCC2)n(C)c1	ZINC000186295457	402418725	/nfs/dbraw/zinc/41/87/25/402418725.db2.gz	WFYCUYSJANJYEX-ZDUSSCGKSA-N	0	3	305.422	2.222	10	0		DEAEHN
COC(CN1CCC[C@H](c2nc(-c3ccccc3)n[nH]2)C1)OC	ZINC000162493202	402422270	/nfs/dbraw/zinc/42/22/70/402422270.db2.gz	BDOPENGCHQUZBT-AWEZNQCLSA-N	0	3	316.405	2.270	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)NCc1ccc(Cl)cc1	ZINC000177697112	402427798	/nfs/dbraw/zinc/42/77/98/402427798.db2.gz	ORQOCCSFKGLRJC-MRXNPFEDSA-N	0	3	323.868	2.372	10	0		DEAEHN
O=C(C[C@H]1CSCCN1)N(C[C@@H]1CCCO1)C1CCCC1	ZINC000238078995	402436883	/nfs/dbraw/zinc/43/68/83/402436883.db2.gz	FETUMKVSKGLOKZ-ZFWWWQNUSA-N	0	3	312.479	2.032	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2CC(=O)Nc1ccccc1F	ZINC000177314275	402390568	/nfs/dbraw/zinc/39/05/68/402390568.db2.gz	MPRVZAFGBADFFG-KGLIPLIRSA-N	0	3	305.397	2.323	10	0		DEAEHN
CC(C)c1nc([C@@H]2CCCN2C(=O)NC2CCN(C)CC2)no1	ZINC000177350403	402393907	/nfs/dbraw/zinc/39/39/07/402393907.db2.gz	WWFMXJRMJNHMHU-ZDUSSCGKSA-N	0	3	321.425	2.134	10	0		DEAEHN
C[C@@]1(O)CCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000178021923	402453276	/nfs/dbraw/zinc/45/32/76/402453276.db2.gz	YAXJUEFJVQIWKL-IINYFYTJSA-N	0	3	320.216	2.190	10	0		DEAEHN
C[C@]1(O)CCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000178021912	402453427	/nfs/dbraw/zinc/45/34/27/402453427.db2.gz	YAXJUEFJVQIWKL-HZMBPMFUSA-N	0	3	320.216	2.190	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)NC[C@H]1CCCS1	ZINC000164391051	402461583	/nfs/dbraw/zinc/46/15/83/402461583.db2.gz	ONGQDLYEPGGRHX-JKSUJKDBSA-N	0	3	321.490	2.354	10	0		DEAEHN
C[C@H](c1ccccc1)[C@H](C)NC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000245471222	402463903	/nfs/dbraw/zinc/46/39/03/402463903.db2.gz	NRRZFULLJIIWEE-ZOBUZTSGSA-N	0	3	319.449	2.151	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@H](COC)c1ccccc1	ZINC000245468314	402463913	/nfs/dbraw/zinc/46/39/13/402463913.db2.gz	KOQKWWQUYONUTH-IAGOWNOFSA-N	0	3	319.449	2.500	10	0		DEAEHN
Cc1cc(Cl)ccc1NC(=O)CN1CCN2CCC[C@H]2C1	ZINC000245474335	402464510	/nfs/dbraw/zinc/46/45/10/402464510.db2.gz	QVFSQCFPFOUKKQ-AWEZNQCLSA-N	0	3	307.825	2.367	10	0		DEAEHN
COCCOc1cccc(CN2CCN3CCCC[C@H]3C2)c1	ZINC000245553525	402469782	/nfs/dbraw/zinc/46/97/82/402469782.db2.gz	FROIIDCMIVYCDM-KRWDZBQOSA-N	0	3	304.434	2.382	10	0		DEAEHN
O=C1NCC[C@H]1N1CCC(c2c[nH]c3cc(F)ccc32)CC1	ZINC000178201795	402470440	/nfs/dbraw/zinc/47/04/40/402470440.db2.gz	BVNVEBPUAZPXAF-MRXNPFEDSA-N	0	3	301.365	2.375	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1ccccc1SC	ZINC000186955559	402473918	/nfs/dbraw/zinc/47/39/18/402473918.db2.gz	XTNKLFZGPXOMPQ-LBPRGKRZSA-N	0	3	316.492	2.417	10	0		DEAEHN
COCCCCNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000245621105	402474260	/nfs/dbraw/zinc/47/42/60/402474260.db2.gz	FBVNBHSJKFPKBW-JKSUJKDBSA-N	0	3	305.422	2.158	10	0		DEAEHN
CS[C@H](C)CNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245629513	402474992	/nfs/dbraw/zinc/47/49/92/402474992.db2.gz	HIZKFQBDCKMSLW-YUELXQCFSA-N	0	3	307.463	2.483	10	0		DEAEHN
NC1(C(=O)Nc2cccc(-n3ccnc3)c2)Cc2ccccc2C1	ZINC000165448083	402476228	/nfs/dbraw/zinc/47/62/28/402476228.db2.gz	PLVMFAOYDUUYPK-UHFFFAOYSA-N	0	3	318.380	2.307	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@@H]1CCN(c2ccccc2)C1=O	ZINC000178296574	402481152	/nfs/dbraw/zinc/48/11/52/402481152.db2.gz	SMIFZRXUANJBPU-QZTJIDSGSA-N	0	3	324.428	2.461	10	0		DEAEHN
CC[C@H]1CN(Cc2cc(F)c(F)c(F)c2)CCN1C[C@H](C)O	ZINC000245755594	402485576	/nfs/dbraw/zinc/48/55/76/402485576.db2.gz	ONNXXNRQRCLLIG-AAEUAGOBSA-N	0	3	316.367	2.381	10	0		DEAEHN
CC(C)N1CCO[C@H](CN2CCN(C[C@@H]3CC=CCC3)CC2)C1	ZINC000245764999	402486123	/nfs/dbraw/zinc/48/61/23/402486123.db2.gz	QLUXXUBMRHXYLX-RTBURBONSA-N	0	3	321.509	2.070	10	0		DEAEHN
CCOc1cccc(CN2CCN(C[C@H](C)O)[C@@H](CC)C2)c1	ZINC000245769519	402487183	/nfs/dbraw/zinc/48/71/83/402487183.db2.gz	RLVYEZJSSVELLJ-RDJZCZTQSA-N	0	3	306.450	2.362	10	0		DEAEHN
CCCn1nc(C)c(CN2CCN(C[C@H](C)O)[C@H](CC)C2)c1C	ZINC000245781254	402487462	/nfs/dbraw/zinc/48/74/62/402487462.db2.gz	UHHJMFYPAGPBQK-WMLDXEAASA-N	0	3	322.497	2.187	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc(COC)cc2)CCN1C[C@H](C)O	ZINC000245801721	402489022	/nfs/dbraw/zinc/48/90/22/402489022.db2.gz	XWMJDVBCBAHSRB-YJBOKZPZSA-N	0	3	306.450	2.110	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cc(C(=O)OC)cs2)C1	ZINC000178436372	402498179	/nfs/dbraw/zinc/49/81/79/402498179.db2.gz	MVAIWJDBLXQOHB-LLVKDONJSA-N	0	3	311.407	2.141	10	0		DEAEHN
c1ccc2nc(CN3CCN(C[C@@H]4CCOC4)CC3)ccc2c1	ZINC000178472879	402502206	/nfs/dbraw/zinc/50/22/06/402502206.db2.gz	MTFNRIDXADPBFU-INIZCTEOSA-N	0	3	311.429	2.389	10	0		DEAEHN
COc1cc(CN(C)C[C@H]2CCCC[C@H]2O)cc2c1OCCO2	ZINC000245991222	402502426	/nfs/dbraw/zinc/50/24/26/402502426.db2.gz	QUASEJRATYKPGH-HUUCEWRRSA-N	0	3	321.417	2.449	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NC[C@H](C)N2CCC[C@@H](C)C2)CC[C@@H]1C	ZINC000187524092	402503723	/nfs/dbraw/zinc/50/37/23/402503723.db2.gz	PAFHNRGQJPDBBW-FXUDXRNXSA-N	0	3	311.470	2.173	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)Nc1nnc(C(F)F)s1	ZINC000246089658	402508846	/nfs/dbraw/zinc/50/88/46/402508846.db2.gz	INNBNZTXHOBOJN-SFYZADRCSA-N	0	3	317.365	2.176	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCO[C@@H](c3ccc(C)o3)C2)C1	ZINC000246092863	402509090	/nfs/dbraw/zinc/50/90/90/402509090.db2.gz	CNOPXZJWMCWFLH-GOEBONIOSA-N	0	3	321.421	2.155	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)[C@H](C)[C@@H](N)c1ccccc1	ZINC000178809729	402542959	/nfs/dbraw/zinc/54/29/59/402542959.db2.gz	QMHDGIIYCMXBAT-RHSMWYFYSA-N	0	3	314.433	2.491	10	0		DEAEHN
CCc1nc(CNC(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)cs1	ZINC000246753073	402543126	/nfs/dbraw/zinc/54/31/26/402543126.db2.gz	ZMQAXXMTCJKVHW-DGCLKSJQSA-N	0	3	310.467	2.187	10	0		DEAEHN
COC[C@@H](C)C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000246865181	402548035	/nfs/dbraw/zinc/54/80/35/402548035.db2.gz	SZKPJXIMQXXGJR-CVEARBPZSA-N	0	3	304.434	2.392	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2ccc(OC)c(F)c2)C1	ZINC000171104494	402558256	/nfs/dbraw/zinc/55/82/56/402558256.db2.gz	MGUKSYNLBPQJHO-AWEZNQCLSA-N	0	3	323.412	2.160	10	0		DEAEHN
Cc1cccc(OC[C@@H](C)NC(=O)NC[C@@H]2CCCN2C)c1	ZINC000171193324	402566036	/nfs/dbraw/zinc/56/60/36/402566036.db2.gz	KZXRKBKUGIRTJT-CABCVRRESA-N	0	3	305.422	2.156	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(-c2ccco2)on1	ZINC000247460145	402567356	/nfs/dbraw/zinc/56/73/56/402567356.db2.gz	QSXFJVITDHPGGU-RYUDHWBXSA-N	0	3	301.346	2.243	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@H]1CCOc2ccccc21	ZINC000246324707	402525423	/nfs/dbraw/zinc/52/54/23/402525423.db2.gz	NEONIFQZFMDFSN-KBMXLJTQSA-N	0	3	317.433	2.492	10	0		DEAEHN
CO[C@H]1CCCN(C[C@H](O)COCc2ccc(Cl)cc2)C1	ZINC000170817580	402528273	/nfs/dbraw/zinc/52/82/73/402528273.db2.gz	OYTCTJBNMZSICU-HOTGVXAUSA-N	0	3	313.825	2.328	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NC[C@H]2CCCc3ccccc32)C1	ZINC000170830487	402530362	/nfs/dbraw/zinc/53/03/62/402530362.db2.gz	GXQYAYUWIMKBLG-HZPDHXFCSA-N	0	3	301.434	2.452	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000170833404	402530831	/nfs/dbraw/zinc/53/08/31/402530831.db2.gz	BONXARGSDADHKJ-KRWDZBQOSA-N	0	3	316.449	2.001	10	0		DEAEHN
CCN(CCNC(=O)NCCc1cc(C)c(O)c(C)c1)C1CC1	ZINC000189257646	402532438	/nfs/dbraw/zinc/53/24/38/402532438.db2.gz	XLWJDINPUGELTI-UHFFFAOYSA-N	0	3	319.449	2.335	10	0		DEAEHN
Cc1nc(C)c(CCNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)s1	ZINC000246483459	402533045	/nfs/dbraw/zinc/53/30/45/402533045.db2.gz	VWLFWBRBHMTZPZ-FZMZJTMJSA-N	0	3	324.494	2.427	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000170866551	402535049	/nfs/dbraw/zinc/53/50/49/402535049.db2.gz	WNRRZMGFOSBGMF-UHOFOFEASA-N	0	3	315.417	2.057	10	0		DEAEHN
Cc1ccc(-c2nc(C(=O)N3CC[C@H](N(C)C)C3)cs2)o1	ZINC000170866389	402535075	/nfs/dbraw/zinc/53/50/75/402535075.db2.gz	MINPCFRHPCSNAE-NSHDSACASA-N	0	3	305.403	2.488	10	0		DEAEHN
c1nn2ccccc2c1CN1CCCC[C@H]1CN1CCOCC1	ZINC000179393097	402588589	/nfs/dbraw/zinc/58/85/89/402588589.db2.gz	SYJPMMKSXIYKAH-KRWDZBQOSA-N	0	3	314.433	2.021	10	0		DEAEHN
COc1cc(OC)c(OC)cc1CN1CCCN(C2CC2)CC1	ZINC000179730966	402599095	/nfs/dbraw/zinc/59/90/95/402599095.db2.gz	DOYMEFUVKHXXSI-UHFFFAOYSA-N	0	3	320.433	2.383	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](C)c1ccc(F)cc1)N1CCN2CCC[C@@H]2C1	ZINC000171639519	402604336	/nfs/dbraw/zinc/60/43/36/402604336.db2.gz	XJZUBZQCNGFKLU-JJRVBVJISA-N	0	3	319.424	2.171	10	0		DEAEHN
C[C@H](C(=O)Nc1ccc(F)c(F)c1)N1CCN2CCC[C@@H]2C1	ZINC000171639066	402604642	/nfs/dbraw/zinc/60/46/42/402604642.db2.gz	ZZSPSXBSSGXPSN-DGCLKSJQSA-N	0	3	309.360	2.072	10	0		DEAEHN
COc1cc(CNCc2cccc(-n3cncn3)c2)ccc1O	ZINC000180145985	402608329	/nfs/dbraw/zinc/60/83/29/402608329.db2.gz	LAJXGPCOEXYCOD-UHFFFAOYSA-N	0	3	310.357	2.271	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248840639	402610738	/nfs/dbraw/zinc/61/07/38/402610738.db2.gz	QNZNMKLTLBCBCR-IWCQGFGOSA-N	0	3	302.418	2.221	10	0		DEAEHN
CCc1ccccc1NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000249149829	402622375	/nfs/dbraw/zinc/62/23/75/402622375.db2.gz	HBLLJAVERXQYLL-DZGCQCFKSA-N	0	3	317.433	2.129	10	0		DEAEHN
COCCN(C)CCNC(=O)N[C@H]1c2cc(C)ccc2C[C@H]1C	ZINC000181201183	402637668	/nfs/dbraw/zinc/63/76/68/402637668.db2.gz	IVNJDUSLNVCHKM-RHSMWYFYSA-N	0	3	319.449	2.106	10	0		DEAEHN
C[C@]1(c2ccccc2)CC[C@H](N2CC[C@@H](NS(C)(=O)=O)C2)C1	ZINC000249942001	402643957	/nfs/dbraw/zinc/64/39/57/402643957.db2.gz	TUGBNZNCHYEFJB-IKGGRYGDSA-N	0	3	322.474	2.120	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NC(=O)N(C)C[C@@H]2CCCN2CC)C12CCC2	ZINC000245464743	286257803	/nfs/dbraw/zinc/25/78/03/286257803.db2.gz	ICWCKAWQAAMEQD-ARFHVFGLSA-N	0	3	323.481	2.460	10	0		DEAEHN
CC(C)C[C@@H]1OCCC[C@H]1NC(=O)N1CCN2CCC[C@H]2C1	ZINC000251779036	402650195	/nfs/dbraw/zinc/65/01/95/402650195.db2.gz	ROHZLBCPHPRJGP-XHSDSOJGSA-N	0	3	309.454	2.070	10	0		DEAEHN
C[C@@H](C(=O)Nc1cc(F)ccc1F)N1CCCN(C2CC2)CC1	ZINC000172345995	402651200	/nfs/dbraw/zinc/65/12/00/402651200.db2.gz	SQHFQBMYKMIEMO-LBPRGKRZSA-N	0	3	323.387	2.462	10	0		DEAEHN
C[C@@H](C(=O)NCc1ccc(F)cc1)N1CCCN(C2CC2)CC1	ZINC000172347016	402651211	/nfs/dbraw/zinc/65/12/11/402651211.db2.gz	ZJLQNPLFFTYKST-AWEZNQCLSA-N	0	3	319.424	2.001	10	0		DEAEHN
COCC(C)(C)NCC(=O)N1CCC[C@@H]1c1ccc(OC)cc1	ZINC000173640062	402706225	/nfs/dbraw/zinc/70/62/25/402706225.db2.gz	QXJOLAOAXIVOOV-MRXNPFEDSA-N	0	3	320.433	2.373	10	0		DEAEHN
COc1cc(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)ccc1O	ZINC000173709737	402709267	/nfs/dbraw/zinc/70/92/67/402709267.db2.gz	OMNGAZWLIWHDLV-TZMCWYRMSA-N	0	3	321.421	2.025	10	0		DEAEHN
CCOC(=O)[C@H](c1ccccc1)N1CCCN(C2CC2)CC1	ZINC000172540675	402661722	/nfs/dbraw/zinc/66/17/22/402661722.db2.gz	HJUOPRVBQMRFMG-KRWDZBQOSA-N	0	3	302.418	2.461	10	0		DEAEHN
Cc1c([C@H](C)NC[C@]2(CCO)CCOC2)cnn1C(C)(C)C	ZINC000191344677	402662619	/nfs/dbraw/zinc/66/26/19/402662619.db2.gz	CBBDVMLUNLYIIY-GUYCJALGSA-N	0	3	309.454	2.386	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@H]2Oc3ccccc3O[C@H]2C)CCN1C	ZINC000172619340	402666711	/nfs/dbraw/zinc/66/67/11/402666711.db2.gz	UQWFOXUOYFFRGV-OEUWWYETSA-N	0	3	318.417	2.156	10	0		DEAEHN
C[C@@H]1CN(CC2CCN(C(=O)C3=CCCCO3)CC2)C[C@@H](C)O1	ZINC000172747570	402673086	/nfs/dbraw/zinc/67/30/86/402673086.db2.gz	NIJKIFCHXBOMFW-HUUCEWRRSA-N	0	3	322.449	2.029	10	0		DEAEHN
Cc1nc(CC2CC2)sc1C(=O)NC[C@@H]1CCCN(C)C1	ZINC000191571659	402679049	/nfs/dbraw/zinc/67/90/49/402679049.db2.gz	QXSTWFBAIGUTAZ-ZDUSSCGKSA-N	0	3	307.463	2.476	10	0		DEAEHN
CC[C@H]1CN(C[C@H](O)CCc2ccccc2)CCN1CCOC	ZINC000182341784	402682240	/nfs/dbraw/zinc/68/22/40/402682240.db2.gz	OTLTVZWOJRZHPF-RBUKOAKNSA-N	0	3	320.477	2.023	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(C(C)C)nn1C	ZINC000173493090	402699924	/nfs/dbraw/zinc/69/99/24/402699924.db2.gz	DNFBFPVLJQOERT-UONOGXRCSA-N	0	3	304.438	2.242	10	0		DEAEHN
CCc1cnc(CCNC(=O)NCCN(CC)C2CC2)s1	ZINC000174163386	402729451	/nfs/dbraw/zinc/72/94/51/402729451.db2.gz	HFFUMUUKNNVHPH-UHFFFAOYSA-N	0	3	310.467	2.032	10	0		DEAEHN
C[C@@H](C(=O)N[C@H](Cc1ccccc1)CN(C)C)c1cccnc1	ZINC000174171122	402729805	/nfs/dbraw/zinc/72/98/05/402729805.db2.gz	OHESIYXNOXXJKO-CRAIPNDOSA-N	0	3	311.429	2.474	10	0		DEAEHN
CC[N@H+](Cc1ccc(C(=O)Nc2nnc(OC)[n-]2)cc1)C(C)C	ZINC000182993864	402731779	/nfs/dbraw/zinc/73/17/79/402731779.db2.gz	HJFFZCXMZQTUNM-UHFFFAOYSA-N	0	3	317.393	2.296	10	0		DEAEHN
CC[N@@H+](Cc1ccc(C(=O)Nc2nnc(OC)[n-]2)cc1)C(C)C	ZINC000182993864	402731781	/nfs/dbraw/zinc/73/17/81/402731781.db2.gz	HJFFZCXMZQTUNM-UHFFFAOYSA-N	0	3	317.393	2.296	10	0		DEAEHN
CC[N@H+](Cc1ccc(C(=O)Nc2n[n-]c(OC)n2)cc1)C(C)C	ZINC000182993864	402731784	/nfs/dbraw/zinc/73/17/84/402731784.db2.gz	HJFFZCXMZQTUNM-UHFFFAOYSA-N	0	3	317.393	2.296	10	0		DEAEHN
CC[N@@H+](Cc1ccc(C(=O)Nc2n[n-]c(OC)n2)cc1)C(C)C	ZINC000182993864	402731786	/nfs/dbraw/zinc/73/17/86/402731786.db2.gz	HJFFZCXMZQTUNM-UHFFFAOYSA-N	0	3	317.393	2.296	10	0		DEAEHN
CC[N@H+](Cc1ccc(C(=O)Nc2nc(OC)n[n-]2)cc1)C(C)C	ZINC000182993864	402731789	/nfs/dbraw/zinc/73/17/89/402731789.db2.gz	HJFFZCXMZQTUNM-UHFFFAOYSA-N	0	3	317.393	2.296	10	0		DEAEHN
CC[N@@H+](Cc1ccc(C(=O)Nc2nc(OC)n[n-]2)cc1)C(C)C	ZINC000182993864	402731790	/nfs/dbraw/zinc/73/17/90/402731790.db2.gz	HJFFZCXMZQTUNM-UHFFFAOYSA-N	0	3	317.393	2.296	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H](C)c2nc(C(C)(C)C)no2)C1	ZINC000174239309	402733213	/nfs/dbraw/zinc/73/32/13/402733213.db2.gz	RQPDGBVJNMGUJL-NWDGAFQWSA-N	0	3	323.441	2.212	10	0		DEAEHN
COc1ccc2nc(C(=O)N(C)C3CCN(C)CC3)ccc2c1	ZINC000192553115	402736576	/nfs/dbraw/zinc/73/65/76/402736576.db2.gz	KWSSSUQSPQWPKE-UHFFFAOYSA-N	0	3	313.401	2.410	10	0		DEAEHN
CCCCNC(=O)[C@@H](C)N[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000192622350	402740956	/nfs/dbraw/zinc/74/09/56/402740956.db2.gz	OJFLHIJTDYFIIQ-UONOGXRCSA-N	0	3	315.421	2.223	10	0		DEAEHN
CCCOc1ccc(CNC(=O)CN[C@@H](C)[C@H]2CCCO2)cc1	ZINC000183138603	402742078	/nfs/dbraw/zinc/74/20/78/402742078.db2.gz	MDYGCSMXTCAVSD-WMLDXEAASA-N	0	3	320.433	2.249	10	0		DEAEHN
CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@@H](C)[C@@H]2CCCO2)c1	ZINC000183142358	402742629	/nfs/dbraw/zinc/74/26/29/402742629.db2.gz	FVFSHXAHSBBSSM-MKBNYLNASA-N	0	3	319.405	2.129	10	0		DEAEHN
Cc1ccc(SCc2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263265590	402752015	/nfs/dbraw/zinc/75/20/15/402752015.db2.gz	RLWMEASHINFMFV-CYBMUJFWSA-N	0	3	304.419	2.246	10	0		DEAEHN
CCCN(C)c1ccc(-c2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263299239	402755925	/nfs/dbraw/zinc/75/59/25/402755925.db2.gz	WWODNMNOTVBRMV-OAHLLOKOSA-N	0	3	315.421	2.159	10	0		DEAEHN
C[C@@H](OC1CCCCCC1)c1nc([C@H]2CNCCN2C)no1	ZINC000263318519	402758323	/nfs/dbraw/zinc/75/83/23/402758323.db2.gz	ZVWCKBLWZSXJOO-TZMCWYRMSA-N	0	3	308.426	2.446	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)NCCCc2ccccn2)C1	ZINC000183344695	402758508	/nfs/dbraw/zinc/75/85/08/402758508.db2.gz	KFYSFLFNEFFYIH-NVXWUHKLSA-N	0	3	316.449	2.140	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(Cc3ccc(Cl)nc3)C2)CC1	ZINC000174881306	402760669	/nfs/dbraw/zinc/76/06/69/402760669.db2.gz	URDRUQKFIGJNTK-MRXNPFEDSA-N	0	3	322.884	2.337	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(Cc3ccc(F)cc3)C2)CC1	ZINC000174878139	402761163	/nfs/dbraw/zinc/76/11/63/402761163.db2.gz	WSFULJGVHKHPGM-GOSISDBHSA-N	0	3	305.441	2.428	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1CC[C@H](C(=O)OC(C)(C)C)C1	ZINC000174890961	402761783	/nfs/dbraw/zinc/76/17/83/402761783.db2.gz	JCVUYYBCDNCWEC-UONOGXRCSA-N	0	3	310.438	2.051	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cccc2c1OCCO2	ZINC000174962936	402766878	/nfs/dbraw/zinc/76/68/78/402766878.db2.gz	SOXVLFSLXKHSQI-UONOGXRCSA-N	0	3	316.401	2.157	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cnc2onc(C)c2c1	ZINC000174973806	402768068	/nfs/dbraw/zinc/76/80/68/402768068.db2.gz	MCRAFMGVPCHSBB-ZIAGYGMSSA-N	0	3	314.389	2.230	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cn(CCC(C)C)nn1	ZINC000175004814	402770758	/nfs/dbraw/zinc/77/07/58/402770758.db2.gz	MKMDBQYGQXZMAW-LSDHHAIUSA-N	0	3	319.453	2.023	10	0		DEAEHN
COc1cccc(OC)c1C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000175104719	402779471	/nfs/dbraw/zinc/77/94/71/402779471.db2.gz	QUGAXLBULRNIMJ-OLZOCXBDSA-N	0	3	306.406	2.259	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000194340757	402792870	/nfs/dbraw/zinc/79/28/70/402792870.db2.gz	UJQBUQAGVSMXHH-OAHLLOKOSA-N	0	3	317.437	2.288	10	0		DEAEHN
CC(C)OCCNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000183801903	402798554	/nfs/dbraw/zinc/79/85/54/402798554.db2.gz	HVSUIAHQYXDNAR-JKSUJKDBSA-N	0	3	305.422	2.156	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)COc1ccc(F)c(Cl)c1	ZINC000194707139	402811920	/nfs/dbraw/zinc/81/19/20/402811920.db2.gz	DSMGSWZKDDRGOT-JTQLQIEISA-N	0	3	300.761	2.068	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)CCc1ccc(OC(F)F)cc1	ZINC000194707383	402812011	/nfs/dbraw/zinc/81/20/11/402812011.db2.gz	WZQSBTGYKJPZCL-ZDUSSCGKSA-N	0	3	312.360	2.431	10	0		DEAEHN
Cc1cc(C(=O)NC[C@@H]2CCCN2C)c2cnn(C(C)C)c2n1	ZINC000194715910	402812352	/nfs/dbraw/zinc/81/23/52/402812352.db2.gz	AIOVJDQRAYDVHS-ZDUSSCGKSA-N	0	3	315.421	2.145	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)Cc1ccc(C)c(F)c1	ZINC000184043064	402813724	/nfs/dbraw/zinc/81/37/24/402813724.db2.gz	DCBJGOIVQQTNOH-ZDUSSCGKSA-N	0	3	316.442	2.284	10	0		DEAEHN
Cc1oc2ccccc2c1C(=O)NCCCN1CCC(O)CC1	ZINC000184081128	402816595	/nfs/dbraw/zinc/81/65/95/402816595.db2.gz	ZWWMGWLGBCUKIE-UHFFFAOYSA-N	0	3	316.401	2.318	10	0		DEAEHN
COCCN1CCCN(CC[C@@H](C)c2ccccc2)CC1=O	ZINC000194846572	402818159	/nfs/dbraw/zinc/81/81/59/402818159.db2.gz	RIXWYGFWUUOKKZ-MRXNPFEDSA-N	0	3	304.434	2.361	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC[C@H](CC(=O)OC(C)C)C1)N(C)C	ZINC000184283594	402832690	/nfs/dbraw/zinc/83/26/90/402832690.db2.gz	DNUDAGWIHZYYLC-CABCVRRESA-N	0	3	312.454	2.297	10	0		DEAEHN
CNC(=O)[C@@H](NCCCc1nc(-c2ccccc2)no1)C(C)C	ZINC000183663517	402786481	/nfs/dbraw/zinc/78/64/81/402786481.db2.gz	AKBLWSQGNYKHJO-HNNXBMFYSA-N	0	3	316.405	2.029	10	0		DEAEHN
CN(C)C[C@@H]1CN(CCc2c(F)cccc2Cl)CCO1	ZINC000175204741	402787381	/nfs/dbraw/zinc/78/73/81/402787381.db2.gz	JJWVIPDUSABLHH-GFCCVEGCSA-N	0	3	300.805	2.284	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN([C@@H]2CCN(C(C)C)C2=O)C1	ZINC000175202477	402787447	/nfs/dbraw/zinc/78/74/47/402787447.db2.gz	MAXACAXGTWJAQV-LSDHHAIUSA-N	0	3	304.438	2.092	10	0		DEAEHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NCCOCC1CCC1	ZINC000566536167	292249640	/nfs/dbraw/zinc/24/96/40/292249640.db2.gz	NKGFJAHXKMLDAK-CABCVRRESA-N	0	3	311.470	2.223	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1cc(N(C)C)ccn1)c1ccccc1	ZINC000195488170	402847349	/nfs/dbraw/zinc/84/73/49/402847349.db2.gz	QDTGMXKEYGRLGF-KRWDZBQOSA-N	0	3	312.417	2.180	10	0		DEAEHN
O=C(NC[C@H](O)CN1CCCCC1)Nc1ccc2[nH]ccc2c1	ZINC000195527725	402850669	/nfs/dbraw/zinc/85/06/69/402850669.db2.gz	AYRZWHMZBFROCP-HNNXBMFYSA-N	0	3	316.405	2.136	10	0		DEAEHN
CCO[C@H]1C[C@@H](NCc2cc(OC)cc(C)n2)C12CCOCC2	ZINC000274400826	403051824	/nfs/dbraw/zinc/05/18/24/403051824.db2.gz	FPSDKJARBAGNJF-SJORKVTESA-N	0	3	320.433	2.462	10	0		DEAEHN
CC(=O)N(C[C@H]1CCC[N@@H+]1Cc1nc(C)ccc1[O-])C1CC1	ZINC000275541583	403104310	/nfs/dbraw/zinc/10/43/10/403104310.db2.gz	FMOBBGMJSLIYNS-OAHLLOKOSA-N	0	3	303.406	2.071	10	0		DEAEHN
CC(=O)N(C[C@H]1CCC[N@H+]1Cc1nc(C)ccc1[O-])C1CC1	ZINC000275541583	403104312	/nfs/dbraw/zinc/10/43/12/403104312.db2.gz	FMOBBGMJSLIYNS-OAHLLOKOSA-N	0	3	303.406	2.071	10	0		DEAEHN
OCc1cn([C@@H]2CCCC[C@@H]2NCc2cccc(F)c2)nn1	ZINC000276340105	403165569	/nfs/dbraw/zinc/16/55/69/403165569.db2.gz	TVFRIQAERWOWAN-JKSUJKDBSA-N	0	3	304.369	2.183	10	0		DEAEHN
COc1ccc(F)cc1[C@H](C)NC(=O)N1CC[C@H](N(C)C)C1	ZINC000170830862	286322339	/nfs/dbraw/zinc/32/23/39/286322339.db2.gz	XNDHLKYVIIQQID-AAEUAGOBSA-N	0	3	309.385	2.241	10	0		DEAEHN
CN1CC[C@H](NC(=O)[C@H]2CCn3cncc3C2)[C@H]1c1ccccc1	ZINC000332759186	403613640	/nfs/dbraw/zinc/61/36/40/403613640.db2.gz	ZEYJLAYZGWUORE-RYQLBKOJSA-N	0	3	324.428	2.007	10	0		DEAEHN
Cc1ccc2c(c1C)OC[C@H]2NC(=O)N[C@H]1CCN(C2CC2)C1	ZINC000332834920	403623161	/nfs/dbraw/zinc/62/31/61/403623161.db2.gz	YFVZBMOAEFTOMV-XJKSGUPXSA-N	0	3	315.417	2.273	10	0		DEAEHN
Cc1nn(C)c2sc([C@H](C)N[C@@H]3CCC(=O)N(C)C3)cc12	ZINC000287876366	403683967	/nfs/dbraw/zinc/68/39/67/403683967.db2.gz	YENXQPBUMPRYDX-WDEREUQCSA-N	0	3	306.435	2.215	10	0		DEAEHN
CCc1ncnc(N2CC[C@@H](OCCN3CCCCC3)C2)c1F	ZINC000301953556	403705280	/nfs/dbraw/zinc/70/52/80/403705280.db2.gz	JUVHFESZLNLNFQ-CQSZACIVSA-N	0	3	322.428	2.259	10	0		DEAEHN
CC(C)c1nc([C@H](C)N[C@@H]2CCc3nnnn3CC2)cs1	ZINC000333714878	403829412	/nfs/dbraw/zinc/82/94/12/403829412.db2.gz	IWEWIGNBJLPQJU-WDEREUQCSA-N	0	3	306.439	2.309	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)[C@@H](C)N[C@@H]1CCOC1(C)C	ZINC000295366570	403884440	/nfs/dbraw/zinc/88/44/40/403884440.db2.gz	ZOLGPKRSWHLLAA-IAQYHMDHSA-N	0	3	304.390	2.373	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@H](C)N[C@H]2CCOC2(C)C)c1	ZINC000295372416	403887399	/nfs/dbraw/zinc/88/73/99/403887399.db2.gz	ZZHKMUOPYSMVGD-NHYWBVRUSA-N	0	3	304.390	2.373	10	0		DEAEHN
OC1CCN(CCNCc2ccsc2Br)CC1	ZINC000321791792	404078053	/nfs/dbraw/zinc/07/80/53/404078053.db2.gz	KODQCRFYJQZQRO-UHFFFAOYSA-N	0	3	319.268	2.057	10	0		DEAEHN
CC(C)[C@H](C(=O)N1CCC[C@H](c2nnc[n-]2)C1)[NH+]1CCCCC1	ZINC000364090274	404315808	/nfs/dbraw/zinc/31/58/08/404315808.db2.gz	QXGRTPPQLAWZIW-LSDHHAIUSA-N	0	3	319.453	2.021	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(-c2nc([C@@H]3CC(=O)N(C)C3)no2)s1	ZINC000329748022	404438853	/nfs/dbraw/zinc/43/88/53/404438853.db2.gz	ZUAWINOIZMDPEH-RKDXNWHRSA-N	0	3	322.390	2.155	10	0		DEAEHN
CC1(C)CN(CCCOCC(F)(F)F)C[C@]2(CCOC2)O1	ZINC000373795787	404591756	/nfs/dbraw/zinc/59/17/56/404591756.db2.gz	GEBKKGKQRGJTNV-ZDUSSCGKSA-N	0	3	311.344	2.225	10	0		DEAEHN
c1ccc(CN2CC[C@H](N3CCO[C@]4(CCCOC4)C3)C2)cc1	ZINC000297285858	404534332	/nfs/dbraw/zinc/53/43/32/404534332.db2.gz	ACTSGTHRVZVUGL-RBUKOAKNSA-N	0	3	316.445	2.142	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN([C@@H](C)CN1CCOCC1)CC2	ZINC000364907452	404544054	/nfs/dbraw/zinc/54/40/54/404544054.db2.gz	XZEWOYVRAYWMJN-HNNXBMFYSA-N	0	3	316.445	2.011	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(CC[C@H]1CCOC1=O)CC2	ZINC000374329578	404704694	/nfs/dbraw/zinc/70/46/94/404704694.db2.gz	MAOTXIJLDCPWBS-HNNXBMFYSA-N	0	3	301.386	2.243	10	0		DEAEHN
C/C(=C\c1ccc(Cl)cc1)CNCCS(=O)(=O)N(C)C	ZINC000353095012	404742291	/nfs/dbraw/zinc/74/22/91/404742291.db2.gz	OULBEBBOVBKARI-ZRDIBKRKSA-N	0	3	316.854	2.224	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@H](C)N2CCCC[C@H]2C)C1	ZINC000358604977	404768584	/nfs/dbraw/zinc/76/85/84/404768584.db2.gz	MTGKRFHUYRZGQE-CABCVRRESA-N	0	3	311.470	2.317	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCc2cccc(OC)c2CC1	ZINC000376083612	404800107	/nfs/dbraw/zinc/80/01/07/404800107.db2.gz	ORRFWLDUIOUWQT-INIZCTEOSA-N	0	3	307.434	2.273	10	0		DEAEHN
C[C@](O)(C(=O)N1CCc2c1cccc2CN1CCCC1)C1CC1	ZINC000376170369	404812852	/nfs/dbraw/zinc/81/28/52/404812852.db2.gz	CHJYRIZLECGXQE-LJQANCHMSA-N	0	3	314.429	2.333	10	0		DEAEHN
COC[C@H](O)CN1CCC(c2nc(C(F)(F)F)cs2)CC1	ZINC000451294745	404943776	/nfs/dbraw/zinc/94/37/76/404943776.db2.gz	KXIKCLRTOFJLKK-SNVBAGLBSA-N	0	3	324.368	2.349	10	0		DEAEHN
CN(C)[C@H](CNC(=O)N1CCC12CCC2)Cc1ccccc1	ZINC000435580039	404991118	/nfs/dbraw/zinc/99/11/18/404991118.db2.gz	OKBIVWQHYUINOD-INIZCTEOSA-N	0	3	301.434	2.497	10	0		DEAEHN
CCN1C[C@H](C)N(Cc2nc3oc(C)c(C)c3c(N)n2)C[C@H]1C	ZINC000408048647	405098293	/nfs/dbraw/zinc/09/82/93/405098293.db2.gz	ZABMLCLISHIGME-MNOVXSKESA-N	0	3	317.437	2.336	10	0		DEAEHN
Nc1cccnc1C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000390766594	405047693	/nfs/dbraw/zinc/04/76/93/405047693.db2.gz	FRTFUNFLQZYSKN-OAHLLOKOSA-N	0	3	310.401	2.058	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)NCC2C[C@@H](C)O[C@H](C)C2)CN1C1CC1	ZINC000408181478	405132610	/nfs/dbraw/zinc/13/26/10/405132610.db2.gz	CYDPOVDIXSAITC-RGCMKSIDSA-N	0	3	309.454	2.114	10	0		DEAEHN
C[NH+](C)[C@H]1CCCN(C(=O)c2ccc3c(c2[O-])OC(C)(C)C3)C1	ZINC000408404813	405197597	/nfs/dbraw/zinc/19/75/97/405197597.db2.gz	ARCJUPIJNITBEO-ZDUSSCGKSA-N	0	3	318.417	2.272	10	0		DEAEHN
CCOC(=O)CC(C)(C)CCN1CCO[C@@]2(CCCOC2)C1	ZINC000367866205	405177473	/nfs/dbraw/zinc/17/74/73/405177473.db2.gz	SIVGCWUEKKETHK-KRWDZBQOSA-N	0	3	313.438	2.237	10	0		DEAEHN
COc1ccccc1/C=C\CN1CCN(CC(C)(C)O)C[C@@H]1C	ZINC000438257997	405239884	/nfs/dbraw/zinc/23/98/84/405239884.db2.gz	RNOMRCGDSIQORN-GQSKFBFOSA-N	0	3	318.461	2.485	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NC[C@@H](Cc1ccccc1)OC	ZINC000452834667	405249385	/nfs/dbraw/zinc/24/93/85/405249385.db2.gz	YXERAWKRKZBKJD-IAGOWNOFSA-N	0	3	304.434	2.235	10	0		DEAEHN
Cc1cc(C[C@@H](C)NC(=O)NCCN2CCCC(C)(C)C2)[nH]n1	ZINC000445222163	405349533	/nfs/dbraw/zinc/34/95/33/405349533.db2.gz	KATOIMZWVQRILJ-CYBMUJFWSA-N	0	3	321.469	2.070	10	0		DEAEHN
CCN(Cc1ccoc1)C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638446734	405474070	/nfs/dbraw/zinc/47/40/70/405474070.db2.gz	ZLQUJLZOZNZEQE-QGZVFWFLSA-N	0	3	315.417	2.087	10	0		DEAEHN
CO[C@](C)(CNC(=O)CC1CCN(C)CC1)c1ccccc1	ZINC000456139766	405514082	/nfs/dbraw/zinc/51/40/82/405514082.db2.gz	ZRDOCGJFUJKGHK-GOSISDBHSA-N	0	3	304.434	2.396	10	0		DEAEHN
COC(=O)C(C)(C)N1CCN(CCCc2ccc(C)cc2)CC1	ZINC000494487438	405709582	/nfs/dbraw/zinc/70/95/82/405709582.db2.gz	WOMYEIZCDYIQCL-UHFFFAOYSA-N	0	3	318.461	2.497	10	0		DEAEHN
CC(C)n1cc(CN2CCC[C@@H]2[C@@H]2COCC[C@@]2(C)O)cn1	ZINC000583618800	405775801	/nfs/dbraw/zinc/77/58/01/405775801.db2.gz	NRHGXMNLSYMAAH-GVDBMIGSSA-N	0	3	307.438	2.216	10	0		DEAEHN
Cn1cccc1[C@@H]1CCCCN1C[C@H](O)COC[C@@H]1CCCO1	ZINC000530867732	405874500	/nfs/dbraw/zinc/87/45/00/405874500.db2.gz	KUCAECKXJFZBPP-BQFCYCMXSA-N	0	3	322.449	2.109	10	0		DEAEHN
CO[C@@H](CNC[C@H]1CCCCS1(=O)=O)C1CCCCC1	ZINC000639035632	405833020	/nfs/dbraw/zinc/83/30/20/405833020.db2.gz	FUINKMUMGYHYLX-CABCVRRESA-N	0	3	303.468	2.139	10	0		DEAEHN
CC(=O)N1CCC[C@@H](CNCc2nc3ccccc3nc2C)C1	ZINC000639123610	405901909	/nfs/dbraw/zinc/90/19/09/405901909.db2.gz	MKZOYWISRRPHED-HNNXBMFYSA-N	0	3	312.417	2.286	10	0		DEAEHN
OCC[C@H]1CSCCN1CCc1nc(-c2ccccc2)no1	ZINC000531840938	406014033	/nfs/dbraw/zinc/01/40/33/406014033.db2.gz	GIPPYCWOVKKEMC-AWEZNQCLSA-N	0	3	319.430	2.079	10	0		DEAEHN
COCCOCCN1CCC[C@@H](CC(=O)OC(C)(C)C)C1	ZINC000531614804	405984884	/nfs/dbraw/zinc/98/48/84/405984884.db2.gz	FRYSZDFPMKSSHD-AWEZNQCLSA-N	0	3	301.427	2.093	10	0		DEAEHN
FC(F)(F)CN1CC[C@@H](NCc2ccc(-c3cc[nH]n3)o2)C1	ZINC000562416277	406005879	/nfs/dbraw/zinc/00/58/79/406005879.db2.gz	DIMVDLFEBKGAPI-SNVBAGLBSA-N	0	3	314.311	2.396	10	0		DEAEHN
c1nc2n(n1)[C@@H](CN(Cc1ccccc1)C[C@H]1CCCO1)CC2	ZINC000639460030	406098367	/nfs/dbraw/zinc/09/83/67/406098367.db2.gz	QSAXDXQJHURARD-IAGOWNOFSA-N	0	3	312.417	2.447	10	0		DEAEHN
Cn1ncnc1CN[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000639362603	406064829	/nfs/dbraw/zinc/06/48/29/406064829.db2.gz	ONTIATRREVGPPO-QGZVFWFLSA-N	0	3	313.449	2.350	10	0		DEAEHN
C[C@H](CNC(=O)N1CC[C@H](C(F)(F)F)[C@H]1C)N(C)C1CC1	ZINC000471823020	406121175	/nfs/dbraw/zinc/12/11/75/406121175.db2.gz	CKKPXMUUACKDRP-FOGDFJRCSA-N	0	3	307.360	2.451	10	0		DEAEHN
c1cn(-c2ccc(CN3CC[C@@H](Nc4ncccn4)C3)cc2)cn1	ZINC000567905306	406158416	/nfs/dbraw/zinc/15/84/16/406158416.db2.gz	QZATVZQEEGBSLA-MRXNPFEDSA-N	0	3	320.400	2.349	10	0		DEAEHN
C[C@H](NC(=O)[C@@H](N)CN(C)Cc1ccccc1)c1ccccc1	ZINC000637868005	406453973	/nfs/dbraw/zinc/45/39/73/406453973.db2.gz	LFWNSPOWOQCFMF-YJBOKZPZSA-N	0	3	311.429	2.323	10	0		DEAEHN
CC(C)[C@@H]1CCCCN1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638001148	406517806	/nfs/dbraw/zinc/51/78/06/406517806.db2.gz	OXSKPSRMIGVPCT-ROUUACIJSA-N	0	3	317.477	2.483	10	0		DEAEHN
Cc1ccncc1CNCCN1CCN(c2ccccc2)CC1	ZINC000527513815	406646498	/nfs/dbraw/zinc/64/64/98/406646498.db2.gz	UVSRJGZUGSFJPK-UHFFFAOYSA-N	0	3	310.445	2.302	10	0		DEAEHN
c1nc(CNC[C@@H]2CCN2C2CCCC2)sc1C1OCCO1	ZINC000527807660	406759279	/nfs/dbraw/zinc/75/92/79/406759279.db2.gz	HQFBLMLUGUPUEX-ZDUSSCGKSA-N	0	3	323.462	2.295	10	0		DEAEHN
CC1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638429981	406766374	/nfs/dbraw/zinc/76/63/74/406766374.db2.gz	LAMOYWOMXRXRGC-NXCDMZCRSA-N	0	3	315.461	2.235	10	0		DEAEHN
C[C@H](NC(=O)[C@@H]1CNCCOC1)c1ccc(Cl)cc1Cl	ZINC000643619217	407018248	/nfs/dbraw/zinc/01/82/48/407018248.db2.gz	PTOZSDXONZXTQU-VHSXEESVSA-N	0	3	317.216	2.407	10	0		DEAEHN
CCN(CC)c1ncc(CNCC[C@@H](C)[S@@](C)=O)s1	ZINC000129399511	196044607	/nfs/dbraw/zinc/04/46/07/196044607.db2.gz	MZEBODCLPCSDEG-WYRIXSBYSA-N	0	3	303.497	2.236	10	0		DEAEHN
CCOCCNCCOc1ccc(OC)cc1Br	ZINC000129644571	196064895	/nfs/dbraw/zinc/06/48/95/196064895.db2.gz	NIGKBUUHJUTEKY-UHFFFAOYSA-N	0	3	318.211	2.463	10	0		DEAEHN
Cc1cc(Br)cc2nc(C[C@@H]3COCCN3)[nH]c21	ZINC000129662763	196065895	/nfs/dbraw/zinc/06/58/95/196065895.db2.gz	JPFPGONGJUZZJD-SNVBAGLBSA-N	0	3	310.195	2.165	10	0		DEAEHN
Cc1cc(Br)cc2[nH]c(C[C@@H]3COCCN3)nc21	ZINC000129662763	196065896	/nfs/dbraw/zinc/06/58/96/196065896.db2.gz	JPFPGONGJUZZJD-SNVBAGLBSA-N	0	3	310.195	2.165	10	0		DEAEHN
CCCn1ncnc1C[C@@H](N)c1ccc(Br)cn1	ZINC000130795391	196111368	/nfs/dbraw/zinc/11/13/68/196111368.db2.gz	HHRLLPUMIBHUFF-SNVBAGLBSA-N	0	3	310.199	2.088	10	0		DEAEHN
CS[C@H](C)CCNS(=O)(=O)c1cccc([C@@H](C)N)c1	ZINC000130935307	196123674	/nfs/dbraw/zinc/12/36/74/196123674.db2.gz	OPQUMDDVVXFXDQ-GHMZBOCLSA-N	0	3	302.465	2.126	10	0		DEAEHN
Cc1nc(-c2ccc(Br)cn2)nc2c1CNCC2	ZINC000130956200	196126782	/nfs/dbraw/zinc/12/67/82/196126782.db2.gz	DMDYHASUWJYMLE-UHFFFAOYSA-N	0	3	305.179	2.255	10	0		DEAEHN
CCc1nn(CCCS(=O)(=O)CC)c(CC)c1[C@H](N)CC	ZINC000131002984	196130471	/nfs/dbraw/zinc/13/04/71/196130471.db2.gz	QINDRALAPMWWIA-GFCCVEGCSA-N	0	3	315.483	2.243	10	0		DEAEHN
NCc1ccc(Cl)c(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)c1	ZINC000132208854	196235375	/nfs/dbraw/zinc/23/53/75/196235375.db2.gz	IFGQPHAUVIOSNP-TXEJJXNPSA-N	0	3	314.838	2.219	10	0		DEAEHN
Cc1nc(-c2ccc(Br)cn2)nc2c1CCNC2	ZINC000132119407	196227884	/nfs/dbraw/zinc/22/78/84/196227884.db2.gz	XNHOIBOXJMBNQJ-UHFFFAOYSA-N	0	3	305.179	2.255	10	0		DEAEHN
NC1(C(=O)Nc2cccc(-c3nccs3)c2)CCOCC1	ZINC000132151007	196230502	/nfs/dbraw/zinc/23/05/02/196230502.db2.gz	QZQIWWBMLNALGG-UHFFFAOYSA-N	0	3	303.387	2.257	10	0		DEAEHN
C[C@H]1CNC[C@H](COCc2ccc(Br)cc2F)O1	ZINC000132703500	196277037	/nfs/dbraw/zinc/27/70/37/196277037.db2.gz	OGJDLLQLAPFXAI-JOYOIKCWSA-N	0	3	318.186	2.482	10	0		DEAEHN
CCNCc1c(N2CCCCC[C@H]2CO)nc2sccn12	ZINC000133862578	196341296	/nfs/dbraw/zinc/34/12/96/196341296.db2.gz	LXNLRJGNQBGRCL-LBPRGKRZSA-N	0	3	308.451	2.247	10	0		DEAEHN
CC(C)c1ccc([C@H](O)CNC[C@H]2CCCS2(=O)=O)cc1	ZINC000134097925	196360619	/nfs/dbraw/zinc/36/06/19/196360619.db2.gz	YNEOFCOIUHJWAU-HZPDHXFCSA-N	0	3	311.447	2.010	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@@H]1NC(=O)c1cnc(Cl)c(Cl)c1	ZINC000134354522	196381392	/nfs/dbraw/zinc/38/13/92/196381392.db2.gz	DBEMMUHGPYYMKO-KCJUWKMLSA-N	0	3	302.205	2.458	10	0		DEAEHN
CCC(CO)(CO)N[C@@H](C)c1ccc(Br)s1	ZINC000134466325	196394223	/nfs/dbraw/zinc/39/42/23/196394223.db2.gz	JOSLCGIPLPJDBR-QMMMGPOBSA-N	0	3	308.241	2.295	10	0		DEAEHN
C[C@](CN)(NS(=O)(=O)CC1CCCCC1)c1ccccc1	ZINC000134472727	196394677	/nfs/dbraw/zinc/39/46/77/196394677.db2.gz	RPMZTLKLOMYVHP-MRXNPFEDSA-N	0	3	310.463	2.360	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)N(CCN(C)C)Cc1ccccc1	ZINC000193885150	225169272	/nfs/dbraw/zinc/16/92/72/225169272.db2.gz	ACYWAIRJYCDECL-NVXWUHKLSA-N	0	3	304.434	2.249	10	0		DEAEHN
COc1ccc([C@@H]2CCCN2C(=O)[C@]2(F)CCNC2)c(OC)c1	ZINC000408513565	227236202	/nfs/dbraw/zinc/23/62/02/227236202.db2.gz	QDDFDIWNRVQSPV-YOEHRIQHSA-N	0	3	322.380	2.069	10	0		DEAEHN
CC(C)Cc1ccc([C@H](C)NC(=O)C(C)S(C)(=O)=O)cc1	ZINC000045765847	424818480	/nfs/dbraw/zinc/81/84/80/424818480.db2.gz	CDCLEDDNDKIMPK-STQMWFEESA-N	0	3	311.447	2.495	10	0		DEAEHN
CCN1CCC[C@H](Nc2cc(C(F)(F)F)nc3ncnn32)C1	ZINC000193717218	424870597	/nfs/dbraw/zinc/87/05/97/424870597.db2.gz	ZERAJQBGQAEGCW-VIFPVBQESA-N	0	3	314.315	2.039	10	0		DEAEHN
Cc1cc(CNC2COCCOC2)ccc1Br	ZINC000382493095	424909543	/nfs/dbraw/zinc/90/95/43/424909543.db2.gz	OALXNHFVWHMCQU-UHFFFAOYSA-N	0	3	300.196	2.263	10	0		DEAEHN
Brc1ccc2c(c1)[C@@H](NC1COCCOC1)CC2	ZINC000386259017	424911890	/nfs/dbraw/zinc/91/18/90/424911890.db2.gz	FFHGYYDDMMBHCA-AWEZNQCLSA-N	0	3	312.207	2.441	10	0		DEAEHN
Cc1ncc(-c2noc([C@H]3CCCN3C3CCCC3)n2)c(N)n1	ZINC000333158751	424919437	/nfs/dbraw/zinc/91/94/37/424919437.db2.gz	HYHJRZOMIRHAIV-CYBMUJFWSA-N	0	3	314.393	2.497	10	0		DEAEHN
CCCC(=O)N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21	ZINC000404139309	424925620	/nfs/dbraw/zinc/92/56/20/424925620.db2.gz	GMJGGIWWEMKKGY-DLBZAZTESA-N	0	3	302.418	2.288	10	0		DEAEHN
O[C@@]1(CCNCc2cc(F)ccc2Br)CCOC1	ZINC000404188298	424925892	/nfs/dbraw/zinc/92/58/92/424925892.db2.gz	DYXFIJOBVDQRNR-ZDUSSCGKSA-N	0	3	318.186	2.219	10	0		DEAEHN
O[C@@]1(CCNCc2ccc(F)c(Br)c2)CCOC1	ZINC000404197587	424926014	/nfs/dbraw/zinc/92/60/14/424926014.db2.gz	IITIVBCGKRXEIE-ZDUSSCGKSA-N	0	3	318.186	2.219	10	0		DEAEHN
c1cc(-c2nnc(NC3CC(N4CCCCC4)C3)s2)no1	ZINC000376391579	424896211	/nfs/dbraw/zinc/89/62/11/424896211.db2.gz	MCGTXJBGVRJQKF-UHFFFAOYSA-N	0	3	305.407	2.622	10	0		DEAEHN
CCOC(=O)C[C@H](N)c1ccccc1I	ZINC000575439304	424946790	/nfs/dbraw/zinc/94/67/90/424946790.db2.gz	SAWBGPVIIFGCIO-JTQLQIEISA-N	0	3	319.142	2.244	10	0		DEAEHN
CCN1CC[C@@H](N(C)CCS(=O)(=O)c2ccccc2)[C@H](C)C1	ZINC000081095292	267378803	/nfs/dbraw/zinc/37/88/03/267378803.db2.gz	DPZJVEGEGMAYNE-NVXWUHKLSA-N	0	3	324.490	2.122	10	0		DEAEHN
CN1C[C@H](CNCc2c(F)cccc2Br)CC1=O	ZINC000657694849	425386640	/nfs/dbraw/zinc/38/66/40/425386640.db2.gz	HOCZXVSPVREICS-VIFPVBQESA-N	0	3	315.186	2.156	10	0		DEAEHN
CN1C[C@H](CNCc2cc(Br)ccc2F)CC1=O	ZINC000657694404	425387416	/nfs/dbraw/zinc/38/74/16/425387416.db2.gz	LRMAKZDJZZIJNJ-VIFPVBQESA-N	0	3	315.186	2.156	10	0		DEAEHN
C[C@H]1CC[C@@](CO)(N(C)CC(=O)N(C2CC2)C2CCCC2)C1	ZINC000187922714	267668143	/nfs/dbraw/zinc/66/81/43/267668143.db2.gz	DKRQRROQJPYSPH-KBXCAEBGSA-N	0	3	308.466	2.403	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)Nc1ccc2c(c1)NC(=O)CS2	ZINC000262551330	273580001	/nfs/dbraw/zinc/58/00/01/273580001.db2.gz	SNAZAVURKAWYPP-AWEZNQCLSA-N	0	3	319.430	2.448	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@H]1OCCc2ccccc21	ZINC000123819089	276181400	/nfs/dbraw/zinc/18/14/00/276181400.db2.gz	VECAGOCHGDJJLR-RDJZCZTQSA-N	0	3	302.418	2.243	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H]1COC2(CCCCCC2)O1)N(C)C	ZINC000180874345	276282222	/nfs/dbraw/zinc/28/22/22/276282222.db2.gz	JGGMEZOBCUFNRE-LSDHHAIUSA-N	0	3	312.454	2.299	10	0		DEAEHN
CCOCCOCC(=O)N1C[C@H]2CCCN2Cc2ccccc21	ZINC000123523851	276326268	/nfs/dbraw/zinc/32/62/68/276326268.db2.gz	HSQSMADEUBNBTD-MRXNPFEDSA-N	0	3	318.417	2.051	10	0		DEAEHN
COC(=O)[C@H](c1ccccc1F)N1CCN2CCCC[C@H]2C1	ZINC000248345035	277122900	/nfs/dbraw/zinc/12/29/00/277122900.db2.gz	MHKDBKKQTNZPRR-BBRMVZONSA-N	0	3	306.381	2.210	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)N[C@H]2COc3ccccc32)C1	ZINC000245995318	277155324	/nfs/dbraw/zinc/15/53/24/277155324.db2.gz	RFUIITOZQHAUMI-CWRNSKLLSA-N	0	3	315.417	2.246	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCC(C)(C)CCO)[C@H]1c1ccccc1	ZINC000179487210	277166259	/nfs/dbraw/zinc/16/62/59/277166259.db2.gz	GUDWFADEPIGBNV-JKSUJKDBSA-N	0	3	319.449	2.140	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)[C@H]1C[C@H]1C1CCCCC1	ZINC000247429327	277221480	/nfs/dbraw/zinc/22/14/80/277221480.db2.gz	ONCUQGKHJPJGTA-IKGGRYGDSA-N	0	3	308.466	2.430	10	0		DEAEHN
CC(=O)N1CC[C@@H](N[C@H]2CNCCC2(F)F)c2ccccc2C1	ZINC000423481285	278052593	/nfs/dbraw/zinc/05/25/93/278052593.db2.gz	NZELBEIEUOTMPC-CVEARBPZSA-N	0	3	323.387	2.067	10	0		DEAEHN
CC(=O)NCCCN1[C@H](C(=O)OC(C)(C)C)C[C@H]2CCCC[C@@H]21	ZINC000249463074	278100772	/nfs/dbraw/zinc/10/07/72/278100772.db2.gz	ROGXHOPBABFTJR-PMPSAXMXSA-N	0	3	324.465	2.487	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NCc1cnc(N(C)C)n1C	ZINC000309933157	278242338	/nfs/dbraw/zinc/24/23/38/278242338.db2.gz	ZTXZYYJJJYEINS-HNNXBMFYSA-N	0	3	315.465	2.096	10	0		DEAEHN
C[C@@H](CN[C@@H](C)c1ccccc1-n1cccn1)CS(C)(=O)=O	ZINC000183164890	278284365	/nfs/dbraw/zinc/28/43/65/278284365.db2.gz	SIACWIIYCNHBMW-KBPBESRZSA-N	0	3	321.446	2.204	10	0		DEAEHN
C[C@@H](N[C@@H]1CCc2ncnn2C1)c1ccc(F)cc1N(C)C	ZINC000180594387	278376289	/nfs/dbraw/zinc/37/62/89/278376289.db2.gz	GCCRCVNPHYUXEW-DGCLKSJQSA-N	0	3	303.385	2.149	10	0		DEAEHN
CC(C)C1CCN(C(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)CC1	ZINC000262426550	278712391	/nfs/dbraw/zinc/71/23/91/278712391.db2.gz	FLRMLCSDVCHXIC-IIDMSEBBSA-N	0	3	308.466	2.414	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H](c1ccc(C)cc1)N(C)C)N(C)C	ZINC000161802792	278855747	/nfs/dbraw/zinc/85/57/47/278855747.db2.gz	SEGLHAHQSXSERL-DLBZAZTESA-N	0	3	305.466	2.444	10	0		DEAEHN
CC(C)C[C@H](C)S(=O)(=O)N1CC[C@H]2[C@H](CCCN2C)C1	ZINC000246845022	279118492	/nfs/dbraw/zinc/11/84/92/279118492.db2.gz	CIIKSKWOEMYWTR-ZNMIVQPWSA-N	0	3	302.484	2.167	10	0		DEAEHN
C[C@H](CS(C)(=O)=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000182677505	279364720	/nfs/dbraw/zinc/36/47/20/279364720.db2.gz	UPDPIUOCTNXYBZ-NVXWUHKLSA-N	0	3	324.490	2.064	10	0		DEAEHN
CCC[NH+]1CCC(CNC(=O)c2cccc(OC)c2[O-])CC1	ZINC000133283365	282012815	/nfs/dbraw/zinc/01/28/15/282012815.db2.gz	BSYFXZJJXVQPQY-UHFFFAOYSA-N	0	3	306.406	2.253	10	0		DEAEHN
C[C@@H](NCCC(=O)N1CCOCC1)c1ccc(Cl)s1	ZINC000135133259	282062898	/nfs/dbraw/zinc/06/28/98/282062898.db2.gz	QGSANKVEDDCTMT-SNVBAGLBSA-N	0	3	302.827	2.301	10	0		DEAEHN
NC1(C(=O)N2CC[C@@H](c3ccc(Cl)cc3)C2)CCOCC1	ZINC000261797103	295201877	/nfs/dbraw/zinc/20/18/77/295201877.db2.gz	INSXOQALLPZCSG-CYBMUJFWSA-N	0	3	308.809	2.164	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2n[nH]c3c2CCCCC3)CCN1C	ZINC000191856285	297258695	/nfs/dbraw/zinc/25/86/95/297258695.db2.gz	ZMXORJQSPBNZTG-OLZOCXBDSA-N	0	3	304.438	2.233	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@]2(O)CCCC[C@@H]2C1)N1CCCCCC1	ZINC000121043153	298087970	/nfs/dbraw/zinc/08/79/70/298087970.db2.gz	CFPCVABGLLAIHU-JFIYKMOQSA-N	0	3	308.466	2.405	10	0		DEAEHN
C[C@H](C(=O)N1C[C@@]2(CCOC2)OC(C)(C)C1)N1CCCCCC1	ZINC000358228810	298100369	/nfs/dbraw/zinc/10/03/69/298100369.db2.gz	SZPPYKBPZFRRNA-CRAIPNDOSA-N	0	3	324.465	2.047	10	0		DEAEHN
NC(=O)CCCCC(=O)NC[C@@H](c1cccs1)N1CCCC1	ZINC000187179357	303242784	/nfs/dbraw/zinc/24/27/84/303242784.db2.gz	DRPUMILDROYGHI-ZDUSSCGKSA-N	0	3	323.462	2.047	10	0		DEAEHN
COc1cccc([C@@H]2[C@@H](N[C@H]3CCNC3=O)CCN2C2CC2)c1	ZINC000328721882	533759358	/nfs/dbraw/zinc/75/93/58/533759358.db2.gz	XDQZAHKDOYQLOG-YESZJQIVSA-N	0	3	315.417	2.291	10	0		DEAEHN
COCc1nc2n(n1)CCC[C@@H]2N[C@H](C)C1CCSCC1	ZINC000187306236	518100566	/nfs/dbraw/zinc/10/05/66/518100566.db2.gz	QMESQFSFTPIYCX-YPMHNXCESA-N	0	3	310.467	2.381	10	0		DEAEHN
CC(=O)Nc1ccc(C)c(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000249059748	519712137	/nfs/dbraw/zinc/71/21/37/519712137.db2.gz	GKOLZQCSFHZRFT-DYVFJYSZSA-N	0	3	317.433	2.412	10	0		DEAEHN
Cc1ccsc1CCCC(=O)NCCNc1ccncc1	ZINC000440119083	534459559	/nfs/dbraw/zinc/45/95/59/534459559.db2.gz	HAJQKXNREAIYTM-UHFFFAOYSA-N	0	3	303.431	2.424	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000195418445	534484461	/nfs/dbraw/zinc/48/44/61/534484461.db2.gz	CNMQMUXIIDIKCN-NXHRZFHOSA-N	0	3	316.445	2.440	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)N[C@H](C)c1ccc(N2CCCC2=O)cc1	ZINC000246178562	521839646	/nfs/dbraw/zinc/83/96/46/521839646.db2.gz	BZASJCRBEPWVIF-OGHNNQOOSA-N	0	3	317.433	2.364	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2ccc(CSC(F)F)o2)CCO1	ZINC000128077083	521880722	/nfs/dbraw/zinc/88/07/22/521880722.db2.gz	IRVAFKQDAAFHTR-ZDUSSCGKSA-N	0	3	320.405	2.498	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2ncc(-c3cccs3)o2)CCO1	ZINC000109133102	521881518	/nfs/dbraw/zinc/88/15/18/521881518.db2.gz	LRSSMGGJVMAZJP-LBPRGKRZSA-N	0	3	307.419	2.166	10	0		DEAEHN
O=C(CN[C@@H]1CCC(=O)N[C@@H]1C1CC1)Nc1ccc(F)cc1	ZINC000328929025	534595472	/nfs/dbraw/zinc/59/54/72/534595472.db2.gz	YGVSQGAIJZBDDE-CZUORRHYSA-N	0	3	305.353	2.251	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)CCc2cccc(OC(C)(C)C)n2)C1	ZINC000130457417	522102814	/nfs/dbraw/zinc/10/28/14/522102814.db2.gz	NVSKBLRRQFLRKA-HNNXBMFYSA-N	0	3	319.449	2.354	10	0		DEAEHN
CN(Cc1ccccc1)C(=O)CN1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000128413554	523325412	/nfs/dbraw/zinc/32/54/12/523325412.db2.gz	UVXOYTYXLDMHJK-IEBWSBKVSA-N	0	3	316.445	2.272	10	0		DEAEHN
COc1ccccc1NCC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000127557543	524635136	/nfs/dbraw/zinc/63/51/36/524635136.db2.gz	IYFWGXPYUGFDKU-KBPBESRZSA-N	0	3	305.422	2.048	10	0		DEAEHN
C[C@@H](CNC(=O)c1csc(C(F)(F)F)n1)N(C)C1CC1	ZINC000188889272	524731175	/nfs/dbraw/zinc/73/11/75/524731175.db2.gz	HFFNTXILMZUQQB-ZETCQYMHSA-N	0	3	307.341	2.374	10	0		DEAEHN
CC(C)[C@@H]1OCCC[C@H]1CNC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000247203253	535292605	/nfs/dbraw/zinc/29/26/05/535292605.db2.gz	XKGSCWFHLTYDOY-BBWFWOEESA-N	0	3	321.465	2.093	10	0		DEAEHN
CC(C)C(=O)N1CCC(NC(=O)[C@H](N)CC2CCCCC2)CC1	ZINC000261894057	535372894	/nfs/dbraw/zinc/37/28/94/535372894.db2.gz	ODMFDAQHPVEEDB-MRXNPFEDSA-N	0	3	323.481	2.047	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)N1CC[C@@]2(O)CCCC[C@H]2C1	ZINC000247188144	535484088	/nfs/dbraw/zinc/48/40/88/535484088.db2.gz	ZQTNMAYOCBRKDM-JZXOWHBKSA-N	0	3	323.481	2.197	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C[C@H](C)NC(=O)C1CCCC1	ZINC000245437460	535545771	/nfs/dbraw/zinc/54/57/71/535545771.db2.gz	WLBBQHRYNLTGJY-GOEBONIOSA-N	0	3	323.481	2.014	10	0		DEAEHN
CCO[C@H](C)c1nc(CN2CCO[C@@H](CN(C)C)C2)cs1	ZINC000246814739	535563109	/nfs/dbraw/zinc/56/31/09/535563109.db2.gz	RXABHOUKVHCCHH-OCCSQVGLSA-N	0	3	313.467	2.003	10	0		DEAEHN
CCn1nccc1CN1CCNC[C@H]1c1ccccc1OC	ZINC000261831283	535869843	/nfs/dbraw/zinc/86/98/43/535869843.db2.gz	YVDHDFUJBUOXFD-INIZCTEOSA-N	0	3	300.406	2.058	10	0		DEAEHN
CCn1c(C)nnc1CN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1	ZINC000246450949	535974403	/nfs/dbraw/zinc/97/44/03/535974403.db2.gz	DXNMMQQJNVZPBV-GOEBONIOSA-N	0	3	303.454	2.055	10	0		DEAEHN
COc1cc(CN(C)C(=O)[C@@H]2NCCCC2(C)C)ccc1O	ZINC000262395606	536743506	/nfs/dbraw/zinc/74/35/06/536743506.db2.gz	BTYLFNLTPPLZGC-HNNXBMFYSA-N	0	3	306.406	2.137	10	0		DEAEHN
COCc1ccccc1C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000246541902	536809672	/nfs/dbraw/zinc/80/96/72/536809672.db2.gz	SKVHXXDNZJOQDO-YOEHRIQHSA-N	0	3	302.418	2.389	10	0		DEAEHN
COC[C@@H](C)C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000247121932	536863660	/nfs/dbraw/zinc/86/36/60/536863660.db2.gz	WOQPFLXNLAMQFV-CVEARBPZSA-N	0	3	304.434	2.392	10	0		DEAEHN
COCCCN(C(=O)[C@H]1[C@@H]2CCCC[C@@H]21)C1CCN(C)CC1	ZINC000358222523	536888039	/nfs/dbraw/zinc/88/80/39/536888039.db2.gz	HCESYCQMFQCMLG-FVQHAEBGSA-N	0	3	308.466	2.382	10	0		DEAEHN
COc1ccccc1C1(CNC(=O)[C@H]2C[C@H](F)CN2)CCCC1	ZINC000188428853	537011808	/nfs/dbraw/zinc/01/18/08/537011808.db2.gz	UEYKARQDTHGLPH-DZGCQCFKSA-N	0	3	320.408	2.323	10	0		DEAEHN
CCC[C@@H](N)C(=O)N(Cc1ccccc1)C[C@H](O)c1ccco1	ZINC000236901053	625412259	/nfs/dbraw/zinc/41/22/59/625412259.db2.gz	JHEJZZWONBURBW-CVEARBPZSA-N	0	3	316.401	2.469	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2S(=O)(=O)/C=C\c2ccccc2)C1	ZINC000255275286	624076660	/nfs/dbraw/zinc/07/66/60/624076660.db2.gz	IUQFFBPAIKRDIY-YVYLTUATSA-N	0	3	320.458	2.403	10	0		DEAEHN
Cc1cc2ncn(CN3CCC(C(=O)N(C)C)CC3)c2cc1C	ZINC000120069874	624868209	/nfs/dbraw/zinc/86/82/09/624868209.db2.gz	OAWWETYKZKFACD-UHFFFAOYSA-N	0	3	314.433	2.411	10	0		DEAEHN
c1cn(-c2ccc(CN3CCC(c4cc[nH]n4)CC3)cn2)cn1	ZINC000177091864	625771859	/nfs/dbraw/zinc/77/18/59/625771859.db2.gz	BXTVTHNWXIXTIH-UHFFFAOYSA-N	0	3	308.389	2.370	10	0		DEAEHN
CN(Cc1ccc(C(=O)N2CCCC2)cc1)CC1(CO)CC1	ZINC000186768991	636561339	/nfs/dbraw/zinc/56/13/39/636561339.db2.gz	RJKARYQYCOHLMP-UHFFFAOYSA-N	0	3	302.418	2.127	10	0		DEAEHN
O=C(CC/C=C\c1ccccc1)NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000737819579	637366439	/nfs/dbraw/zinc/36/64/39/637366439.db2.gz	DFEIKOZASOMXPN-CPRJUCLXSA-N	0	3	314.429	2.459	10	0		DEAEHN
C[C@@H](OC(=O)c1cccc(CN2CCCC2)c1)c1nncn1C	ZINC000805542371	642027562	/nfs/dbraw/zinc/02/75/62/642027562.db2.gz	NWKRXBAAGBFPHP-CYBMUJFWSA-N	0	3	314.389	2.329	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NC[C@H](O)c1ccc(CC)cc1	ZINC000804156949	645733512	/nfs/dbraw/zinc/73/35/12/645733512.db2.gz	XPSPLCUOCBNLAH-SJORKVTESA-N	0	3	304.434	2.273	10	0		DEAEHN
CCCN(CCN1CCCCC1)C(=O)[C@@H]1CCCC12OCCO2	ZINC000804567335	645791361	/nfs/dbraw/zinc/79/13/61/645791361.db2.gz	LXMNRFKPZXAPAP-INIZCTEOSA-N	0	3	324.465	2.254	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1ccc(NC=O)cc1)c1ccccc1	ZINC000173723462	646777453	/nfs/dbraw/zinc/77/74/53/646777453.db2.gz	CSUPDCJUZISZJG-QGZVFWFLSA-N	0	3	311.385	2.288	10	0		DEAEHN
COCC[C@H](N)C(=O)Nc1cc(C)c(Br)c(C)c1	ZINC000232036832	646788632	/nfs/dbraw/zinc/78/86/32/646788632.db2.gz	KPIJABZTAGOGBJ-NSHDSACASA-N	0	3	315.211	2.368	10	0		DEAEHN
O=C(CN1CCC2(CCCC2)C1)N1CCO[C@@H]2CCCC[C@@H]21	ZINC000174276904	646802949	/nfs/dbraw/zinc/80/29/49/646802949.db2.gz	BNAUSICILHDISS-JKSUJKDBSA-N	0	3	306.450	2.423	10	0		DEAEHN
O=C(CCn1cccn1)O[C@H]1CCCN(Cc2ccccc2)C1	ZINC000183170491	649044850	/nfs/dbraw/zinc/04/48/50/649044850.db2.gz	SIODHJYHIPVCMU-KRWDZBQOSA-N	0	3	313.401	2.481	10	0		DEAEHN
CCC[C@H](C(=O)N(C)CCOc1ccccc1OC)N(C)C	ZINC000137231592	684243688	/nfs/dbraw/zinc/24/36/88/684243688.db2.gz	XXOVRHHOFSBPDU-CQSZACIVSA-N	0	3	308.422	2.263	10	0		DEAEHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@H]2CCCO[C@@H]2C)c1	ZINC000192196672	684444309	/nfs/dbraw/zinc/44/43/09/684444309.db2.gz	DRUQBVADSXCZOE-BYCMXARLSA-N	0	3	316.357	2.158	10	0		DEAEHN
Cn1cc([C@H]2CCN(C[C@@H](O)c3ccc(F)c(F)c3)C2)cn1	ZINC000247576574	685150912	/nfs/dbraw/zinc/15/09/12/685150912.db2.gz	XRUGIPKYSCIPFQ-BLLLJJGKSA-N	0	3	307.344	2.221	10	0		DEAEHN
Cn1cc([C@@H]2CCN(C[C@@H](O)c3ccc(F)c(F)c3)C2)cn1	ZINC000247576579	685150926	/nfs/dbraw/zinc/15/09/26/685150926.db2.gz	XRUGIPKYSCIPFQ-MLGOLLRUSA-N	0	3	307.344	2.221	10	0		DEAEHN
C[C@H](O)[C@H]1CCCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724061015	777233379	/nfs/dbraw/zinc/23/33/79/777233379.db2.gz	ICVYFHYHDVAJOS-LPEHRKFASA-N	0	3	305.287	2.028	10	0		DEAEHN
C[C@@](O)(CN1CCC12CCOCC2)C(F)(F)C(F)(F)F	ZINC000724118062	777245804	/nfs/dbraw/zinc/24/58/04/777245804.db2.gz	QRDKYGRPCYCMEB-SECBINFHSA-N	0	3	303.271	2.190	10	0		DEAEHN
COc1ncc(CNCCCNC(=O)OC(C)(C)C)s1	ZINC000393915267	789601607	/nfs/dbraw/zinc/60/16/07/789601607.db2.gz	SDKYGSIVVHNXFB-UHFFFAOYSA-N	0	3	301.412	2.156	10	0		DEAEHN
[NH3+]C1CC(C[N-]S(=O)(=O)c2cccc(Cl)c2Cl)C1	ZINC000715109331	792382769	/nfs/dbraw/zinc/38/27/69/792382769.db2.gz	MMNJKPCXDKWEOX-UHFFFAOYSA-N	0	3	309.218	2.009	10	0		DEAEHN
CO[C@H]1CCC[C@H](NCc2cn(C)nc2Br)C1	ZINC000720645730	1085803238	/nfs/dbraw/zinc/80/32/38/1085803238.db2.gz	LZIFYTOSECNBSV-QWRGUYRKSA-N	0	3	302.216	2.230	10	0		DEAEHN
CC[C@@H](NCc1cn(C)nc1Br)[C@@H]1CCOC1	ZINC000720644361	1085807677	/nfs/dbraw/zinc/80/76/77/1085807677.db2.gz	AHIJUOMQESSRFH-MWLCHTKSSA-N	0	3	302.216	2.087	10	0		DEAEHN
CCn1nccc1CN[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C	ZINC000700737146	1086332135	/nfs/dbraw/zinc/33/21/35/1086332135.db2.gz	UGFCRRISNPGYNN-GXTWGEPZSA-N	0	3	308.426	2.391	10	0		DEAEHN
CCn1nccc1CNCC12CC(C1)CN2C(=O)OC(C)(C)C	ZINC000701866012	1086388349	/nfs/dbraw/zinc/38/83/49/1086388349.db2.gz	YWVUXCVCEGVRTK-UHFFFAOYSA-N	0	3	320.437	2.392	10	0		DEAEHN
CCOc1cccc(CCNC(=O)N[C@H]2CCCN(CC)C2)c1	ZINC000136522328	282087770	/nfs/dbraw/zinc/08/77/70/282087770.db2.gz	VMFNNLDAFLTHBW-INIZCTEOSA-N	0	3	319.449	2.411	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)NC[C@H](CC(C)C)N(C)C)cc1	ZINC000278385916	214133590	/nfs/dbraw/zinc/13/35/90/214133590.db2.gz	BCATUIGZUXGUJD-KRWDZBQOSA-N	0	3	319.449	2.375	10	0		DEAEHN
CCC[C@H]1CCCN(C(=O)NC[C@@H]2CCCN2CCOC)C1	ZINC000150887545	282107154	/nfs/dbraw/zinc/10/71/54/282107154.db2.gz	ILXSAYIESJIPJD-HOTGVXAUSA-N	0	3	311.470	2.319	10	0		DEAEHN
CN[C@H](C)[C@H](C)S(=O)(=O)c1ccccc1Br	ZINC000081931608	192340652	/nfs/dbraw/zinc/34/06/52/192340652.db2.gz	NOBJQKMATTWVFM-BDAKNGLRSA-N	0	3	306.225	2.219	10	0		DEAEHN
CN[C@H](C)[C@@H](C)S(=O)(=O)c1ccccc1Br	ZINC000081931601	192340978	/nfs/dbraw/zinc/34/09/78/192340978.db2.gz	NOBJQKMATTWVFM-RKDXNWHRSA-N	0	3	306.225	2.219	10	0		DEAEHN
C[C@@H](NCCCS(N)(=O)=O)c1ccc(-c2cccnc2)cc1	ZINC000181282361	199275703	/nfs/dbraw/zinc/27/57/03/199275703.db2.gz	RRGZDPUFWMMFKT-CYBMUJFWSA-N	0	3	319.430	2.078	10	0		DEAEHN
Cc1cnc([C@@H](C)NC(=O)N2CCCN(C3CC3)CC2)s1	ZINC000079086404	185155879	/nfs/dbraw/zinc/15/58/79/185155879.db2.gz	QKBJTHFORARQMW-GFCCVEGCSA-N	0	3	308.451	2.392	10	0		DEAEHN
O=C(CN(C[C@H]1CCCO1)C1CCCC1)NCC(F)(F)F	ZINC000152921661	282157570	/nfs/dbraw/zinc/15/75/70/282157570.db2.gz	AUFAZBVSXLYKBO-GFCCVEGCSA-N	0	3	308.344	2.089	10	0		DEAEHN
O=C(c1ccc(I)cc1)[C@H]1CCCN1	ZINC000082954550	185209574	/nfs/dbraw/zinc/20/95/74/185209574.db2.gz	SRRJFVVYAGWFTN-SNVBAGLBSA-N	0	3	301.127	2.226	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CCC2(C1)CCCCC2	ZINC000173173258	282188332	/nfs/dbraw/zinc/18/83/32/282188332.db2.gz	KPUQAOVOADQUFR-INIZCTEOSA-N	0	3	323.481	2.463	10	0		DEAEHN
NC[C@H](NC[C@H]1CCCO1)c1ccccc1OC(F)(F)F	ZINC000087928561	185237617	/nfs/dbraw/zinc/23/76/17/185237617.db2.gz	PXOMHDBGJNOACU-PWSUYJOCSA-N	0	3	304.312	2.354	10	0		DEAEHN
C[C@@H]1CCC[C@H](C)N1C(=O)CN[C@H]1CCC(=O)N[C@H]1C1CC1	ZINC000328919433	231387040	/nfs/dbraw/zinc/38/70/40/231387040.db2.gz	SLTWYJZKKOXZHY-IFOZYUSPSA-N	0	3	307.438	2.263	10	0		DEAEHN
CCC[N@H+](C)C[C@@H]1CCN(C(=O)c2cccc(OC)c2[O-])C1	ZINC000175313113	282194504	/nfs/dbraw/zinc/19/45/04/282194504.db2.gz	GTQFTCPIPLSZEX-ZDUSSCGKSA-N	0	3	306.406	2.205	10	0		DEAEHN
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cccc(OC)c2[O-])C1	ZINC000175313113	282194506	/nfs/dbraw/zinc/19/45/06/282194506.db2.gz	GTQFTCPIPLSZEX-ZDUSSCGKSA-N	0	3	306.406	2.205	10	0		DEAEHN
CC[C@@H]1CC[C@H](NCc2ccc(S(=O)(=O)N(C)C)o2)[C@@H]1C	ZINC000088540955	185255605	/nfs/dbraw/zinc/25/56/05/185255605.db2.gz	PECFKYFFOMDOGX-BZPMIXESSA-N	0	3	314.451	2.444	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@H](C)[C@H](C)CC)o1	ZINC000088542911	185256338	/nfs/dbraw/zinc/25/63/38/185256338.db2.gz	RBHICWPDJULRCL-VXGBXAGGSA-N	0	3	302.440	2.492	10	0		DEAEHN
CC[C@@H](C)[C@@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000088542940	185256479	/nfs/dbraw/zinc/25/64/79/185256479.db2.gz	AJTHHDFXRQWKJC-VXGBXAGGSA-N	0	3	302.440	2.491	10	0		DEAEHN
CC[C@@H](C)[C@@H](C)NS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000088542940	185256480	/nfs/dbraw/zinc/25/64/80/185256480.db2.gz	AJTHHDFXRQWKJC-VXGBXAGGSA-N	0	3	302.440	2.491	10	0		DEAEHN
Cc1cc(C)c2c(N)c(C(=O)NC[C@H](C)N(C)C)sc2n1	ZINC000088642589	185261223	/nfs/dbraw/zinc/26/12/23/185261223.db2.gz	TUAHBYBTIPMRSQ-JTQLQIEISA-N	0	3	306.435	2.175	10	0		DEAEHN
CCOC(=O)COC[C@@H](N)c1cc(Br)sc1C	ZINC000088648312	185261517	/nfs/dbraw/zinc/26/15/17/185261517.db2.gz	GYBGIQWTRKMXOX-SECBINFHSA-N	0	3	322.224	2.399	10	0		DEAEHN
N[C@H]1CCC[C@@H]1S(=O)(=O)c1cccc(Br)c1	ZINC000081982902	192349608	/nfs/dbraw/zinc/34/96/08/192349608.db2.gz	MALSJWIGRFPKLF-QWRGUYRKSA-N	0	3	304.209	2.103	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(CCOC1CCOCC1)CC2	ZINC000625264664	365703381	/nfs/dbraw/zinc/70/33/81/365703381.db2.gz	HJTGZUUETXWRRH-UHFFFAOYSA-N	0	3	317.429	2.485	10	0		DEAEHN
CCCN(c1ccc(S(=O)(=O)C(F)(F)F)cc1)C1CNC1	ZINC000090294238	185289977	/nfs/dbraw/zinc/28/99/77/185289977.db2.gz	QIYXCLILBDYHKR-UHFFFAOYSA-N	0	3	322.352	2.168	10	0		DEAEHN
N[C@@H]1COC[C@@H]1c1nc(CSc2ccc(Cl)cc2)no1	ZINC000090365064	185292677	/nfs/dbraw/zinc/29/26/77/185292677.db2.gz	CTEPPMZYCDNDTI-WDEREUQCSA-N	0	3	311.794	2.456	10	0		DEAEHN
N[C@@H]1COC[C@@H]1c1nc(Cc2ccc(Cl)cc2Cl)no1	ZINC000090364355	185292900	/nfs/dbraw/zinc/29/29/00/185292900.db2.gz	JGNJKGUCKPJVHU-GXSJLCMTSA-N	0	3	314.172	2.408	10	0		DEAEHN
CN(C)C[C@H]1CSCCCN1C(=O)c1ccc(F)cc1F	ZINC000090700057	185310408	/nfs/dbraw/zinc/31/04/08/185310408.db2.gz	JQNDKQMYLLEORQ-LBPRGKRZSA-N	0	3	314.401	2.474	10	0		DEAEHN
CN(C)C[C@@H]1CSCCCN1C(=O)c1cc(C2CC2)on1	ZINC000090700168	185310499	/nfs/dbraw/zinc/31/04/99/185310499.db2.gz	OZESDRCBGCOFQS-GFCCVEGCSA-N	0	3	309.435	2.061	10	0		DEAEHN
CC(C)CN(CCN(C)C)c1ncncc1Br	ZINC000090782022	185311840	/nfs/dbraw/zinc/31/18/40/185311840.db2.gz	NHPVHENRAMLRDR-UHFFFAOYSA-N	0	3	301.232	2.263	10	0		DEAEHN
CCN(Cc1cc(OC)c2c(c1)OCCO2)C[C@@H]1CCCO1	ZINC000092407164	185316537	/nfs/dbraw/zinc/31/65/37/185316537.db2.gz	JTGBGNNLJJUZBM-AWEZNQCLSA-N	0	3	307.390	2.467	10	0		DEAEHN
Cc1ccn2c(CN3CCC[C@H](CCC(N)=O)C3)cnc2c1	ZINC000092660226	185332043	/nfs/dbraw/zinc/33/20/43/185332043.db2.gz	WMEGTCBDDZFMIW-CQSZACIVSA-N	0	3	300.406	2.120	10	0		DEAEHN
C[NH+](C)[C@H]1CCN(C(=O)c2cc([O-])ccc2C(F)(F)F)C1	ZINC000193137695	282263761	/nfs/dbraw/zinc/26/37/61/282263761.db2.gz	URYAHZINJQXEFW-VIFPVBQESA-N	0	3	302.296	2.187	10	0		DEAEHN
CSc1ccc(CNCc2ccc(S(N)(=O)=O)cc2)cc1	ZINC000021518254	539330256	/nfs/dbraw/zinc/33/02/56/539330256.db2.gz	MRLHTHUODYXWQN-UHFFFAOYSA-N	0	3	322.455	2.346	10	0		DEAEHN
C[C@H]1C[C@@H](NCc2cc(C(N)=O)co2)CN1Cc1ccccc1	ZINC000189411360	282309201	/nfs/dbraw/zinc/30/92/01/282309201.db2.gz	MPEBUXJYLNVPRL-XJKSGUPXSA-N	0	3	313.401	2.131	10	0		DEAEHN
CCNC(=O)NC(=O)CN[C@H]1c2ccccc2CCC1(C)C	ZINC000183130096	199542831	/nfs/dbraw/zinc/54/28/31/199542831.db2.gz	UQXFOQZOLLQVLD-HNNXBMFYSA-N	0	3	303.406	2.135	10	0		DEAEHN
CN(CCn1ccnc1)C[C@@H]1C[C@H](F)CN1Cc1cccs1	ZINC000328649866	529940902	/nfs/dbraw/zinc/94/09/02/529940902.db2.gz	VHKDDOBZDWPMFR-GJZGRUSLSA-N	0	3	322.453	2.489	10	0		DEAEHN
CNC(=O)c1cccnc1N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000302163229	529951921	/nfs/dbraw/zinc/95/19/21/529951921.db2.gz	ILSVKWXOTFSTCM-WMLDXEAASA-N	0	3	324.428	2.374	10	0		DEAEHN
CNC(=O)c1cccnc1N[C@H](C)CN(C)Cc1ccccc1	ZINC000301999529	529951961	/nfs/dbraw/zinc/95/19/61/529951961.db2.gz	IMJSKFHOVTZHPD-CQSZACIVSA-N	0	3	312.417	2.374	10	0		DEAEHN
Cc1cnc([C@H](C)CNC(=O)N2CC[C@H](N3CC=CC3)C2)s1	ZINC000183192998	199553554	/nfs/dbraw/zinc/55/35/54/199553554.db2.gz	NPUIRPNOXRHMJG-OCCSQVGLSA-N	0	3	320.462	2.211	10	0		DEAEHN
CN1CCC[C@H](CNc2ccc3nnnn3n2)[C@H]1c1ccccc1	ZINC000252477143	530061155	/nfs/dbraw/zinc/06/11/55/530061155.db2.gz	IYCRVFMRRVYHFZ-RHSMWYFYSA-N	0	3	323.404	2.014	10	0		DEAEHN
CN(Cc1cc(Br)ccc1F)C[C@@H]1CNCCO1	ZINC000125359708	539473091	/nfs/dbraw/zinc/47/30/91/539473091.db2.gz	QZBONGLHHKILOL-LBPRGKRZSA-N	0	3	317.202	2.008	10	0		DEAEHN
CC(C)(C)OC(=O)NCC[C@@H]1c2ccccc2CCN1CCO	ZINC000616679770	362908866	/nfs/dbraw/zinc/90/88/66/362908866.db2.gz	WXASBCGQDYVVEF-MRXNPFEDSA-N	0	3	320.433	2.493	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)/C=C\c2nc3ccccc3s2)C1	ZINC000255076829	282613747	/nfs/dbraw/zinc/61/37/47/282613747.db2.gz	CZUXPKRRNQLOOU-QDZRJHCZSA-N	0	3	301.415	2.472	10	0		DEAEHN
C[C@H](NC[C@H](O)CN1CCc2ccccc2C1)c1ccoc1	ZINC000177918722	539633287	/nfs/dbraw/zinc/63/32/87/539633287.db2.gz	YUTJNISXIXGEJF-KSSFIOAISA-N	0	3	300.402	2.349	10	0		DEAEHN
Cc1cccc(OCCCNC(=O)CN[C@@H](C)[C@@H]2CCCO2)c1	ZINC000183197287	539660459	/nfs/dbraw/zinc/66/04/59/539660459.db2.gz	VCENULKSKXABJG-RDJZCZTQSA-N	0	3	320.433	2.037	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2cc(C(F)(F)F)ccn2)C1	ZINC000192424575	539706286	/nfs/dbraw/zinc/70/62/86/539706286.db2.gz	UMQUIVXYKVAIFT-JTQLQIEISA-N	0	3	302.300	2.268	10	0		DEAEHN
N[C@H](C[S@](=O)c1cccs1)c1ccc2c(c1)OCCO2	ZINC000084030530	192396055	/nfs/dbraw/zinc/39/60/55/192396055.db2.gz	ZZHCSZPSVCSUHK-BIBXISHDSA-N	0	3	309.412	2.327	10	0		DEAEHN
CN[C@H](C[S@](=O)CCOC)c1cccc(C(F)(F)F)c1	ZINC000084035325	192396691	/nfs/dbraw/zinc/39/66/91/192396691.db2.gz	XKZWKIMUXBNGGO-ODXCJYRJSA-N	0	3	309.353	2.361	10	0		DEAEHN
COc1ccc2cc(C(=O)N3CC[C@@H](N(C)C)C3)c(C)nc2c1	ZINC000170857278	197837597	/nfs/dbraw/zinc/83/75/97/197837597.db2.gz	NLMURDMGJWFBDQ-CQSZACIVSA-N	0	3	313.401	2.328	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CC[C@@H](OCCC(C)C)C2)C1	ZINC000246153874	539761571	/nfs/dbraw/zinc/76/15/71/539761571.db2.gz	PPNLPXFPNDDDJN-HZPDHXFCSA-N	0	3	311.470	2.317	10	0		DEAEHN
CC[C@H](C(N)=S)N1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000147661450	186040648	/nfs/dbraw/zinc/04/06/48/186040648.db2.gz	RIJPUVPDLRNASS-CQSZACIVSA-N	0	3	313.417	2.147	10	0		DEAEHN
COCc1c(Br)cccc1NC(=O)C1(N)CCC1	ZINC000148064629	186043378	/nfs/dbraw/zinc/04/33/78/186043378.db2.gz	FSDUOQKGQRKEIY-UHFFFAOYSA-N	0	3	313.195	2.415	10	0		DEAEHN
CCN[C@H](C)c1cccc(S(=O)(=O)NN2CCCCC2)c1	ZINC000148539035	186044873	/nfs/dbraw/zinc/04/48/73/186044873.db2.gz	VEZBLDTWKQKFHA-CYBMUJFWSA-N	0	3	311.451	2.036	10	0		DEAEHN
CC[C@@H](NC)c1cccc(S(=O)(=O)NN2CCCCC2)c1	ZINC000148540703	186045063	/nfs/dbraw/zinc/04/50/63/186045063.db2.gz	SSZVQHIFTFOFQZ-OAHLLOKOSA-N	0	3	311.451	2.036	10	0		DEAEHN
C[C@@H](Cc1cccs1)Nc1nc(N)nc(N2CCCC2)n1	ZINC000150236927	186056360	/nfs/dbraw/zinc/05/63/60/186056360.db2.gz	MKHAKOUQVRZONU-JTQLQIEISA-N	0	3	304.423	2.159	10	0		DEAEHN
COc1cccc(CNC[C@H](C)[S@@](C)=O)c1OC(F)F	ZINC000159670529	186134055	/nfs/dbraw/zinc/13/40/55/186134055.db2.gz	WLTIDMRCPBQHMS-LXGOIASLSA-N	0	3	307.362	2.153	10	0		DEAEHN
O=C(NCc1cccc(Cl)c1)N1CC[C@H](N2CC=CC2)C1	ZINC000173287520	186172448	/nfs/dbraw/zinc/17/24/48/186172448.db2.gz	RTNHMHQMZCFBPJ-HNNXBMFYSA-N	0	3	305.809	2.496	10	0		DEAEHN
CN[C@@H](c1cccc2cnccc21)[C@H]1CCCCS1(=O)=O	ZINC000164322705	186156136	/nfs/dbraw/zinc/15/61/36/186156136.db2.gz	PXVTUQPLQLNBHK-CVEARBPZSA-N	0	3	304.415	2.463	10	0		DEAEHN
Cc1ccc(OCCNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1	ZINC000173334876	186177577	/nfs/dbraw/zinc/17/75/77/186177577.db2.gz	JBDLRHWQUIZCEQ-HZPDHXFCSA-N	0	3	319.449	2.498	10	0		DEAEHN
CCC[C@@H](C(=O)NCCc1nc2ccccc2n1CC)N(C)C	ZINC000179693310	186207048	/nfs/dbraw/zinc/20/70/48/186207048.db2.gz	UPHFXNPITDFZAY-INIZCTEOSA-N	0	3	316.449	2.445	10	0		DEAEHN
O=C(C(=O)N1CCCC[C@@H](N2CCCC2)C1)c1ccccc1	ZINC000194279321	186276078	/nfs/dbraw/zinc/27/60/78/186276078.db2.gz	VRLKZJSKSIHDHT-MRXNPFEDSA-N	0	3	300.402	2.346	10	0		DEAEHN
O=C(N[C@H](Cc1ccccc1)C1CC1)N1CCN2CCC[C@@H]2C1	ZINC000172495039	198105401	/nfs/dbraw/zinc/10/54/01/198105401.db2.gz	ZVXZVIRHZQNKKU-QZTJIDSGSA-N	0	3	313.445	2.497	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N[C@H]2CCN(C(C)(C)C)C2)cc1	ZINC000617345057	363100254	/nfs/dbraw/zinc/10/02/54/363100254.db2.gz	WJTYKBOEMYISAF-HNNXBMFYSA-N	0	3	317.433	2.272	10	0		DEAEHN
Cc1c(F)cccc1NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000072616912	191203054	/nfs/dbraw/zinc/20/30/54/191203054.db2.gz	LGZWGPUURGWXIE-CYBMUJFWSA-N	0	3	323.412	2.165	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCCc2ccc(F)cc2)CCN1C	ZINC000173189837	198193510	/nfs/dbraw/zinc/19/35/10/198193510.db2.gz	JBDOOZUYFSGHAT-CZUORRHYSA-N	0	3	307.413	2.492	10	0		DEAEHN
Cc1ccccc1O[C@H](C)CNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000173209484	198196501	/nfs/dbraw/zinc/19/65/01/198196501.db2.gz	RMORKUUJKDPKNQ-HZPDHXFCSA-N	0	3	317.433	2.252	10	0		DEAEHN
C[C@H]1C[C@H](N(C)S(=O)(=O)Cc2ccccc2F)CCN1C	ZINC000173269511	198204847	/nfs/dbraw/zinc/20/48/47/198204847.db2.gz	KQVGHWDQZCBYKL-GXTWGEPZSA-N	0	3	314.426	2.070	10	0		DEAEHN
COc1ccc([C@@H](C)C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1	ZINC000174642594	198363836	/nfs/dbraw/zinc/36/38/36/198363836.db2.gz	BWVKKSCHDHVPOJ-BMFZPTHFSA-N	0	3	302.418	2.494	10	0		DEAEHN
CC[C@@H]1CN(C[C@H](O)c2ccc(C)cc2)CCN1CCOC	ZINC000174782611	198384918	/nfs/dbraw/zinc/38/49/18/198384918.db2.gz	XHXNLUSSHDAJPV-MSOLQXFVSA-N	0	3	306.450	2.071	10	0		DEAEHN
CC(C)CN1CCN(CC(=O)N[C@@H](C)c2ccc(F)cc2)CC1	ZINC000049970047	354364761	/nfs/dbraw/zinc/36/47/61/354364761.db2.gz	LTTDLJLXCRGBLH-HNNXBMFYSA-N	0	3	321.440	2.277	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NC[C@@H]1CCCOC1)c1ccccc1	ZINC000057162124	354558975	/nfs/dbraw/zinc/55/89/75/354558975.db2.gz	DACZVJQWGRBFKM-GOEBONIOSA-N	0	3	305.422	2.015	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H](C)N(C)c2ccccc2)C1	ZINC000062646741	354636894	/nfs/dbraw/zinc/63/68/94/354636894.db2.gz	IDERMVVXMQGHCL-HOTGVXAUSA-N	0	3	318.465	2.295	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCN(C[C@@H](N)c2ccccc2)CC1	ZINC000059732133	354606606	/nfs/dbraw/zinc/60/66/06/354606606.db2.gz	KMDNYUVRSIBFGI-OAHLLOKOSA-N	0	3	305.422	2.239	10	0		DEAEHN
Cc1nnc2cc(N3CCN(CC4CCCCC4)CC3)cnn12	ZINC000065282498	354681590	/nfs/dbraw/zinc/68/15/90/354681590.db2.gz	FLWLUPLSFPMETM-UHFFFAOYSA-N	0	3	314.437	2.135	10	0		DEAEHN
C[C@@H](CCc1cccn1C)NC(=O)N1CCCN(C2CC2)CC1	ZINC000074746710	191354675	/nfs/dbraw/zinc/35/46/75/191354675.db2.gz	CAQFOHBPLHVATQ-HNNXBMFYSA-N	0	3	318.465	2.226	10	0		DEAEHN
NC[C@@H](NC(=O)c1cccn1Cc1ccccc1)C(F)(F)F	ZINC000401765472	540142616	/nfs/dbraw/zinc/14/26/16/540142616.db2.gz	YBCQETZBOJPJFY-CYBMUJFWSA-N	0	3	311.307	2.156	10	0		DEAEHN
NC[C@H](NC(=O)c1ccc(Br)s1)C(F)(F)F	ZINC000401756224	540142739	/nfs/dbraw/zinc/14/27/39/540142739.db2.gz	RGWHTCIXNCPGFX-YFKPBYRVSA-N	0	3	317.130	2.130	10	0		DEAEHN
Cc1cc(C)n2c(CN(C)C[C@@H]3CCCC[C@@H]3O)cnc2n1	ZINC000181093354	356071949	/nfs/dbraw/zinc/07/19/49/356071949.db2.gz	LFYRXOKRSMYVPY-HOCLYGCPSA-N	0	3	302.422	2.329	10	0		DEAEHN
COCCN1CCC(NC(=O)c2c[nH]c3cc(F)ccc23)CC1	ZINC000181180991	356074499	/nfs/dbraw/zinc/07/44/99/356074499.db2.gz	BVDNAMNTJFBCKM-UHFFFAOYSA-N	0	3	319.380	2.148	10	0		DEAEHN
Cc1cccc(CNC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)n1	ZINC000182419693	356126433	/nfs/dbraw/zinc/12/64/33/356126433.db2.gz	VILJLPLTPLSXRT-HOCLYGCPSA-N	0	3	302.422	2.016	10	0		DEAEHN
CCOCCN1CCN(CCCC(=O)OC(C)(C)C)C[C@@H]1C	ZINC000181818112	356097487	/nfs/dbraw/zinc/09/74/87/356097487.db2.gz	PMMAXOCWRYZCEN-HNNXBMFYSA-N	0	3	314.470	2.151	10	0		DEAEHN
CCS(=O)(=O)C[C@@H](C)NC[C@H](C)c1ccc(F)cc1F	ZINC000183051816	356158189	/nfs/dbraw/zinc/15/81/89/356158189.db2.gz	UTRHDWZEZFNOGW-WDEREUQCSA-N	0	3	305.390	2.481	10	0		DEAEHN
COC(=O)c1ccc(CNCC[C@@H](C)O)c(Br)c1	ZINC000226715145	356279390	/nfs/dbraw/zinc/27/93/90/356279390.db2.gz	YQZOMBODUYUOJN-SECBINFHSA-N	0	3	316.195	2.096	10	0		DEAEHN
NCc1c(I)ccnc1OC(F)(F)F	ZINC000238612009	356304163	/nfs/dbraw/zinc/30/41/63/356304163.db2.gz	JWFNXJSLZYYDOZ-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
CCC[C@@H](C)CN(C)CC(=O)N1CCC[C@@H](C(=O)OCC)C1	ZINC000245948472	356311025	/nfs/dbraw/zinc/31/10/25/356311025.db2.gz	WGGSMOYHWMFYIM-HUUCEWRRSA-N	0	3	312.454	2.156	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(C)cc(OC)c1O	ZINC000177424551	198721856	/nfs/dbraw/zinc/72/18/56/198721856.db2.gz	OAXFNXHITVVRPE-CYBMUJFWSA-N	0	3	306.406	2.266	10	0		DEAEHN
CCn1cnnc1CN[C@@H](C)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000400469327	283157166	/nfs/dbraw/zinc/15/71/66/283157166.db2.gz	XEVPYIZFGXOIQA-STQMWFEESA-N	0	3	323.441	2.033	10	0		DEAEHN
C[C@H]1CC[C@@](N)(c2ncc(I)cn2)C1	ZINC000306647142	356404451	/nfs/dbraw/zinc/40/44/51/356404451.db2.gz	PFBKFJTXSFDKFT-XVKPBYJWSA-N	0	3	303.147	2.055	10	0		DEAEHN
O=C(CNCCCOCc1ccccc1)NCc1ccccc1	ZINC000306891743	356406037	/nfs/dbraw/zinc/40/60/37/356406037.db2.gz	WZWZNSUNALIQBZ-UHFFFAOYSA-N	0	3	312.413	2.499	10	0		DEAEHN
Brc1ccc(CN2CC[C@@H]3OCCN[C@@H]3C2)s1	ZINC000404284206	283165059	/nfs/dbraw/zinc/16/50/59/283165059.db2.gz	WTHSUJONCCOBOP-MNOVXSKESA-N	0	3	317.252	2.073	10	0		DEAEHN
CC[C@H]1[C@H](CO)CCN1CC(=O)N(CC)Cc1ccccc1	ZINC000385934450	356693102	/nfs/dbraw/zinc/69/31/02/356693102.db2.gz	VHEAZUQQOWAGQD-IRXDYDNUSA-N	0	3	304.434	2.128	10	0		DEAEHN
C=Cn1cc(CNC[C@H](CO)Cc2ccc(F)c(F)c2)cn1	ZINC000578143810	356769661	/nfs/dbraw/zinc/76/96/61/356769661.db2.gz	UHSYPOOLHJSPSQ-CYBMUJFWSA-N	0	3	307.344	2.203	10	0		DEAEHN
COc1nc2sccn2c1CNC[C@@]1(O)CCC[C@H](C)C1	ZINC000087050856	192618059	/nfs/dbraw/zinc/61/80/59/192618059.db2.gz	UYOBLNJPBDYXNJ-XHDPSFHLSA-N	0	3	309.435	2.435	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)c2ncsc2Br)CCN1C	ZINC000581962734	357276228	/nfs/dbraw/zinc/27/62/28/357276228.db2.gz	ACKCSGCTKLFMGE-YUMQZZPRSA-N	0	3	318.240	2.118	10	0		DEAEHN
CCc1ccc(CN)cc1S(=O)(=O)NCc1cccs1	ZINC000088974733	192678153	/nfs/dbraw/zinc/67/81/53/192678153.db2.gz	NJFQYUOIRKOGMD-UHFFFAOYSA-N	0	3	310.444	2.248	10	0		DEAEHN
C[C@@H]1CN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)C[C@@H](C)O1	ZINC000179274718	199009059	/nfs/dbraw/zinc/00/90/59/199009059.db2.gz	ZANPUTGZHODSPZ-MUIFIZLQSA-N	0	3	317.433	2.251	10	0		DEAEHN
C[C@@H]1CN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)C[C@H](C)O1	ZINC000179274701	199009071	/nfs/dbraw/zinc/00/90/71/199009071.db2.gz	ZANPUTGZHODSPZ-YALNPMBYSA-N	0	3	317.433	2.251	10	0		DEAEHN
CC[C@@H]1CN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CCO1	ZINC000179268080	199007093	/nfs/dbraw/zinc/00/70/93/199007093.db2.gz	VJQGXCFAPMPSKQ-BRWVUGGUSA-N	0	3	317.433	2.252	10	0		DEAEHN
C[C@H]1CCCN(CCNC(=O)NCc2ccc(Cl)cn2)C1	ZINC000180544985	199173348	/nfs/dbraw/zinc/17/33/48/199173348.db2.gz	OGTLHUAYYLNJJJ-LBPRGKRZSA-N	0	3	310.829	2.266	10	0		DEAEHN
CCN(CC(F)(F)F)S(=O)(=O)c1cc(CNC)cs1	ZINC000089007643	192693697	/nfs/dbraw/zinc/69/36/97/192693697.db2.gz	QTRZRAJTKLCBBO-UHFFFAOYSA-N	0	3	316.370	2.040	10	0		DEAEHN
CCn1cc([C@@H](C)NCCCNC(=O)c2cccs2)cn1	ZINC000180833654	199215246	/nfs/dbraw/zinc/21/52/46/199215246.db2.gz	PXEGJPTWLKHVHK-GFCCVEGCSA-N	0	3	306.435	2.435	10	0		DEAEHN
CCn1cc(S(=O)(=O)NC(C)(C)CC(C)(C)C)cc1CN	ZINC000089010467	192697142	/nfs/dbraw/zinc/69/71/42/192697142.db2.gz	RALNWLQPVVWSFE-UHFFFAOYSA-N	0	3	315.483	2.460	10	0		DEAEHN
CCCC[C@@H](C)NS(=O)(=O)c1cc(CNCCC)n(C)c1	ZINC000089022592	192702902	/nfs/dbraw/zinc/70/29/02/192702902.db2.gz	LSEWHSZFVNGVOF-CYBMUJFWSA-N	0	3	315.483	2.382	10	0		DEAEHN
CCNC[C@@H](C)S(=O)(=O)N1CCC2(CCCCC2)CC1	ZINC000089027027	192706736	/nfs/dbraw/zinc/70/67/36/192706736.db2.gz	OPLIUJMXZJPZQI-CQSZACIVSA-N	0	3	302.484	2.361	10	0		DEAEHN
Cc1ccc2cc(CN3CCN(C[C@@H](C)O)[C@H](C)C3)ccc2n1	ZINC000187209414	200078078	/nfs/dbraw/zinc/07/80/78/200078078.db2.gz	ZBNPFZHMVBFMDF-HZPDHXFCSA-N	0	3	313.445	2.430	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H]1COC2(CCCCCC2)O1)N(C)C	ZINC000180874288	283473794	/nfs/dbraw/zinc/47/37/94/283473794.db2.gz	JGGMEZOBCUFNRE-CABCVRRESA-N	0	3	312.454	2.299	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N(C)[C@H]1CCN(C)C[C@H]1C	ZINC000187910858	200175402	/nfs/dbraw/zinc/17/54/02/200175402.db2.gz	CSKJYRJADICPIT-DOMZBBRYSA-N	0	3	323.412	2.316	10	0		DEAEHN
NC(=O)c1cccc(CN2C[C@@H](c3ccsc3)[C@H](CO)C2)c1	ZINC000188122987	200197470	/nfs/dbraw/zinc/19/74/70/200197470.db2.gz	NBLWGABHCYARPK-HOTGVXAUSA-N	0	3	316.426	2.055	10	0		DEAEHN
CCSc1cc(CNC(=O)N2CCN3CCC[C@H]3C2)ccn1	ZINC000188104451	200193813	/nfs/dbraw/zinc/19/38/13/200193813.db2.gz	BBNBQRUHDSZKHJ-AWEZNQCLSA-N	0	3	320.462	2.183	10	0		DEAEHN
COCc1cccc(CC(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000188619365	200276038	/nfs/dbraw/zinc/27/60/38/200276038.db2.gz	MYOGQSSFTNCEIK-KRWDZBQOSA-N	0	3	306.450	2.468	10	0		DEAEHN
C[C@H]1OCCC[C@@H]1C(=O)N(CCN(C)C)Cc1cccs1	ZINC000189149883	200356717	/nfs/dbraw/zinc/35/67/17/200356717.db2.gz	MULQOPXUWLAKLP-HIFRSBDPSA-N	0	3	310.463	2.453	10	0		DEAEHN
CC[C@@H](OC1CCCC1)C(=O)Nc1cnn(CCN(C)C)c1	ZINC000603086834	360694178	/nfs/dbraw/zinc/69/41/78/360694178.db2.gz	KTWBIEUCOBILLK-OAHLLOKOSA-N	0	3	308.426	2.121	10	0		DEAEHN
COc1cccc(C[C@@H](C)NC(=O)N[C@H]2CCN(C3CC3)C2)c1	ZINC000604199806	360890294	/nfs/dbraw/zinc/89/02/94/360890294.db2.gz	QFGJRHCBSYUFRA-HIFRSBDPSA-N	0	3	317.433	2.162	10	0		DEAEHN
CC(C)(O)CCNCc1c(C(F)(F)F)nc2n1CCCC2	ZINC000606445545	361010158	/nfs/dbraw/zinc/01/01/58/361010158.db2.gz	YYIIDKWBOWHHGJ-UHFFFAOYSA-N	0	3	305.344	2.489	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)Nc1ccc2nccn2c1	ZINC000606581420	361023330	/nfs/dbraw/zinc/02/33/30/361023330.db2.gz	CFUSVGQFHQPPGX-ZDUSSCGKSA-N	0	3	301.394	2.330	10	0		DEAEHN
CC(=O)Nc1cccc([C@H](C)NC[C@@H](O)COC(C)(C)C)c1	ZINC000193430537	201049963	/nfs/dbraw/zinc/04/99/63/201049963.db2.gz	SSBIEJXKKANGKA-BLLLJJGKSA-N	0	3	308.422	2.472	10	0		DEAEHN
CCCn1cc(CN2CCCN(C[C@@H]3CCC=CO3)CC2)cn1	ZINC000193909648	201143478	/nfs/dbraw/zinc/14/34/78/201143478.db2.gz	UJHZNANHUUDKNG-SFHVURJKSA-N	0	3	318.465	2.494	10	0		DEAEHN
Cc1ccc([C@@H](O)CNC(=O)N[C@@H](CC(C)C)CN(C)C)cc1	ZINC000194190983	201195720	/nfs/dbraw/zinc/19/57/20/201195720.db2.gz	BNYPVMCCKPQVRB-IRXDYDNUSA-N	0	3	321.465	2.304	10	0		DEAEHN
COC(=O)[C@@H](C1CC1)N1CCCN(Cc2ccccc2C)CC1	ZINC000611660063	361653892	/nfs/dbraw/zinc/65/38/92/361653892.db2.gz	NMLMMVRYLBADGM-GOSISDBHSA-N	0	3	316.445	2.454	10	0		DEAEHN
CCc1nn(C)c(Cl)c1CNC[C@H]1CCc2nccn2C1	ZINC000275447850	212339440	/nfs/dbraw/zinc/33/94/40/212339440.db2.gz	GGXGZZUSMWLWNT-LLVKDONJSA-N	0	3	307.829	2.185	10	0		DEAEHN
NC(=O)N1CCC(NCc2ccsc2C(F)(F)F)CC1	ZINC000623418063	365024042	/nfs/dbraw/zinc/02/40/42/365024042.db2.gz	AQGWQONKJGQODK-UHFFFAOYSA-N	0	3	307.341	2.400	10	0		DEAEHN
c1nnn(-c2ccccc2)c1CNC[C@@H]1Cc2ccccc2CO1	ZINC000623602790	365096635	/nfs/dbraw/zinc/09/66/35/365096635.db2.gz	CBABAWLSJWOKRW-IBGZPJMESA-N	0	3	320.396	2.498	10	0		DEAEHN
C(=C\c1ccccc1)\CN[C@@H]1CCN(c2ccc3nncn3n2)C1	ZINC000623652616	365117721	/nfs/dbraw/zinc/11/77/21/365117721.db2.gz	LFACVIXKZCJXHG-HQQUCIOCSA-N	0	3	320.400	2.006	10	0		DEAEHN
O[C@H]1COCC[C@H]1NCc1cc(Br)ccc1Cl	ZINC000623767573	365168353	/nfs/dbraw/zinc/16/83/53/365168353.db2.gz	YDJGIFXPAXLURF-NEPJUHHUSA-N	0	3	320.614	2.342	10	0		DEAEHN
Cc1ccc(CNC[C@H]2COCCN2C)cc1Br	ZINC000623711431	365142175	/nfs/dbraw/zinc/14/21/75/365142175.db2.gz	FBFOPIGKWJWVSF-ZDUSSCGKSA-N	0	3	313.239	2.178	10	0		DEAEHN
CN(CC1CC(O)C1)[C@@H](CN)c1cc(Br)cs1	ZINC000091450816	193057435	/nfs/dbraw/zinc/05/74/35/193057435.db2.gz	HVIJZDSYGXNBHD-RFBVYIQQSA-N	0	3	319.268	2.213	10	0		DEAEHN
CN(Cc1ccccc1Br)c1cncc(CN)n1	ZINC000091420281	193054474	/nfs/dbraw/zinc/05/44/74/193054474.db2.gz	CDGAWFLDAAMGTJ-UHFFFAOYSA-N	0	3	307.195	2.334	10	0		DEAEHN
CC[C@](C)(C(=O)Cc1c(Br)c(C)nn1C)N(C)C	ZINC000091568809	193074418	/nfs/dbraw/zinc/07/44/18/193074418.db2.gz	SKFMISRQQBWXLF-CYBMUJFWSA-N	0	3	316.243	2.333	10	0		DEAEHN
CCNCCS(=O)(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000091480433	193062637	/nfs/dbraw/zinc/06/26/37/193062637.db2.gz	ANSPXYMXXMCTJZ-UHFFFAOYSA-N	0	3	310.341	2.365	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@H]1O)c1sccc1Br	ZINC000624237379	365346539	/nfs/dbraw/zinc/34/65/39/365346539.db2.gz	WCNNAHYCUQNTIC-UJNFCWOMSA-N	0	3	306.225	2.311	10	0		DEAEHN
C[C@@H]1CC[C@H](C(N)=O)CN1CCOc1ccc(F)cc1Cl	ZINC000091741662	193100262	/nfs/dbraw/zinc/10/02/62/193100262.db2.gz	XRKWUTXBPVQMSN-MNOVXSKESA-N	0	3	314.788	2.444	10	0		DEAEHN
C[C@H]1CC[C@@H](C(N)=O)CN1CCOc1ccc(F)cc1Cl	ZINC000091741670	193100720	/nfs/dbraw/zinc/10/07/20/193100720.db2.gz	XRKWUTXBPVQMSN-WDEREUQCSA-N	0	3	314.788	2.444	10	0		DEAEHN
CNC(=O)CCCN(C)C[C@@H]1CC(c2ccc(Cl)cc2)=NO1	ZINC000091982480	193135573	/nfs/dbraw/zinc/13/55/73/193135573.db2.gz	KLDUAEKKIPJOPR-AWEZNQCLSA-N	0	3	323.824	2.291	10	0		DEAEHN
CC[C@@H](COC)NCc1cnc2cnc(Br)cn12	ZINC000092050117	193147939	/nfs/dbraw/zinc/14/79/39/193147939.db2.gz	WKBPGMPZCUNJPT-VIFPVBQESA-N	0	3	313.199	2.006	10	0		DEAEHN
Cc1ccccc1[C@@H](C)N(C)C[C@@H](O)CC1(O)CCOCC1	ZINC000630039920	367449328	/nfs/dbraw/zinc/44/93/28/367449328.db2.gz	ZKKCRMHUADQDMR-CVEARBPZSA-N	0	3	307.434	2.280	10	0		DEAEHN
CNCc1sc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)cc1C	ZINC000092113839	193161156	/nfs/dbraw/zinc/16/11/56/193161156.db2.gz	JXIGPMXMWFNAJZ-GHMZBOCLSA-N	0	3	302.465	2.052	10	0		DEAEHN
CNCc1sc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)cc1C	ZINC000092113838	193161512	/nfs/dbraw/zinc/16/15/12/193161512.db2.gz	JXIGPMXMWFNAJZ-PHIMTYICSA-N	0	3	302.465	2.052	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N(C)C2CCCC2)c(F)c1	ZINC000092115599	193163003	/nfs/dbraw/zinc/16/30/03/193163003.db2.gz	HFKBXPUFSXAQMH-UHFFFAOYSA-N	0	3	300.399	2.108	10	0		DEAEHN
CC(C)CN(C(C)C)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115967	193164304	/nfs/dbraw/zinc/16/43/04/193164304.db2.gz	TZBQTDMZDOUBIY-UHFFFAOYSA-N	0	3	302.415	2.340	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)c(F)c1	ZINC000092116291	193164342	/nfs/dbraw/zinc/16/43/42/193164342.db2.gz	XBARQPMVDFEAMN-TXEJJXNPSA-N	0	3	314.426	2.212	10	0		DEAEHN
c1c(CNCCCCc2ccccc2)nnn1C[C@H]1CCOC1	ZINC000631036371	367980989	/nfs/dbraw/zinc/98/09/89/367980989.db2.gz	MHSZSHMKJHGFIC-QGZVFWFLSA-N	0	3	314.433	2.427	10	0		DEAEHN
c1ccc([C@H](C[C@@H]2CCOC2)NC2CN(c3ccncn3)C2)cc1	ZINC000631747333	368366858	/nfs/dbraw/zinc/36/68/58/368366858.db2.gz	FEKSICIEXTWAFL-YJBOKZPZSA-N	0	3	324.428	2.423	10	0		DEAEHN
O=C(N[C@@H]1CCCc2occc21)N1CC[C@@H](N2CC=CC2)C1	ZINC000173950928	284046293	/nfs/dbraw/zinc/04/62/93/284046293.db2.gz	GXKBNEOWEVVYRG-UKRRQHHQSA-N	0	3	301.390	2.313	10	0		DEAEHN
CCN(CC(C)(C)O)[C@H](C)C(=O)Nc1ccc(Cl)cc1N	ZINC000092964564	193189939	/nfs/dbraw/zinc/18/99/39/193189939.db2.gz	ASWPJEYZTBEACF-SNVBAGLBSA-N	0	3	313.829	2.342	10	0		DEAEHN
CCOc1cccc(CN2CC[C@H](N3CCN(CC)CC3)C2)c1	ZINC000093132629	193205862	/nfs/dbraw/zinc/20/58/62/193205862.db2.gz	JYQLREJWWKPYFL-SFHVURJKSA-N	0	3	317.477	2.297	10	0		DEAEHN
COCOc1ccc(OC)cc1CN1C[C@H]2CCC[C@@H](C1)C2O	ZINC000093479855	193257122	/nfs/dbraw/zinc/25/71/22/193257122.db2.gz	XUAUAGDNFCUFDW-UUVAVEHKSA-N	0	3	321.417	2.271	10	0		DEAEHN
CC1CCC2(CSC(NCC(C)(C)S(C)(=O)=O)=N2)CC1	ZINC000093524729	193263691	/nfs/dbraw/zinc/26/36/91/193263691.db2.gz	XUTBZQOIIWZEHR-UHFFFAOYSA-N	0	3	318.508	2.451	10	0		DEAEHN
CC(C)(CNC1=NC[C@@H](c2ccccc2)S1)S(C)(=O)=O	ZINC000093524731	193263961	/nfs/dbraw/zinc/26/39/61/193263961.db2.gz	GRQRDACWOONUHI-LBPRGKRZSA-N	0	3	312.460	2.243	10	0		DEAEHN
COC(=O)C(C)(C)COc1c(Br)cccc1CN	ZINC000093714647	193296573	/nfs/dbraw/zinc/29/65/73/193296573.db2.gz	DNXBPWCPAJHGIO-UHFFFAOYSA-N	0	3	316.195	2.486	10	0		DEAEHN
CCN[C@@H](Cc1c(F)cccc1Cl)[C@@H]1CN(C)CCN1C	ZINC000093895495	193324777	/nfs/dbraw/zinc/32/47/77/193324777.db2.gz	MZOSCTHQNVASSY-HOTGVXAUSA-N	0	3	313.848	2.246	10	0		DEAEHN
CC(C)N1CCN(c2nc(C(F)(F)F)ccc2CN)CC1	ZINC000094334127	193360398	/nfs/dbraw/zinc/36/03/98/193360398.db2.gz	WMCYQQNNEBPGHJ-UHFFFAOYSA-N	0	3	302.344	2.090	10	0		DEAEHN
CCNCc1cc(F)c(O[C@H](C)C(=O)NC(C)C)c(F)c1	ZINC000094346900	193363409	/nfs/dbraw/zinc/36/34/09/193363409.db2.gz	BJHATEAEHCYKBP-SNVBAGLBSA-N	0	3	300.349	2.366	10	0		DEAEHN
CN(C)C1([C@H](O)[C@@H]2CCC[C@H](S(C)(=O)=O)C2)CCCCC1	ZINC000094641358	193389035	/nfs/dbraw/zinc/38/90/35/193389035.db2.gz	DLUILSXPPPSRRH-QLFBSQMISA-N	0	3	317.495	2.215	10	0		DEAEHN
N[C@H]1COC[C@H]1C(=O)Nc1ccc(Cl)c(Br)c1	ZINC000094670422	193390747	/nfs/dbraw/zinc/39/07/47/193390747.db2.gz	FGYDPMAZCUCEQA-XCBNKYQSSA-N	0	3	319.586	2.015	10	0		DEAEHN
CC[C@H]1CN(CCCS(=O)(=O)CC)c2ccccc2CN1	ZINC000094421312	193368966	/nfs/dbraw/zinc/36/89/66/193368966.db2.gz	KAONSLPOTAINEG-HNNXBMFYSA-N	0	3	310.463	2.200	10	0		DEAEHN
CCCNc1snnc1CN1C[C@H]2CCCCN2C[C@@H]1C	ZINC000094442194	193370106	/nfs/dbraw/zinc/37/01/06/193370106.db2.gz	JEVCGBOLRPGEMF-QWHCGFSZSA-N	0	3	309.483	2.419	10	0		DEAEHN
CCN1CCC[C@H](Nc2nc3c(Br)cccn3n2)C1	ZINC000094603789	193383870	/nfs/dbraw/zinc/38/38/70/193383870.db2.gz	NWBBNHBJFOQLIS-JTQLQIEISA-N	0	3	324.226	2.388	10	0		DEAEHN
COc1ccc(F)c([N-]S(=O)(=O)c2ccc(C[NH3+])cc2)c1	ZINC000094854686	193403233	/nfs/dbraw/zinc/40/32/33/193403233.db2.gz	QFOIVQIVBYYHJS-UHFFFAOYSA-N	0	3	310.350	2.094	10	0		DEAEHN
CC1(CNCC(=O)Nc2ccc(Br)cc2)COC1	ZINC000094722226	193393624	/nfs/dbraw/zinc/39/36/24/193393624.db2.gz	FCHQRRYMPRNBEW-UHFFFAOYSA-N	0	3	313.195	2.014	10	0		DEAEHN
COc1ccc(C[C@H](C)N[C@@H]2C[C@H]3CCCCN3C2=O)cc1	ZINC000453429539	245135909	/nfs/dbraw/zinc/13/59/09/245135909.db2.gz	IKAPJWWRKGZZNX-YSVLISHTSA-N	0	3	302.418	2.369	10	0		DEAEHN
c1[nH]nc(-c2ccc3c(c2)OCO3)c1CN[C@H]1CCCOC1	ZINC000288396112	220129857	/nfs/dbraw/zinc/12/98/57/220129857.db2.gz	HLVOURWOIPYCCN-ZDUSSCGKSA-N	0	3	301.346	2.074	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)C1CCN(CCc2ccncc2)CC1	ZINC000153842999	291577373	/nfs/dbraw/zinc/57/73/73/291577373.db2.gz	QLSBVGHAGHWUBA-HNNXBMFYSA-N	0	3	303.450	2.497	10	0		DEAEHN
Cc1ncc2c(c1-c1noc([C@@H]3CCCCN3C)n1)CCNC2	ZINC000020535761	182227975	/nfs/dbraw/zinc/22/79/75/182227975.db2.gz	STDKMBGNCQERCD-AWEZNQCLSA-N	0	3	313.405	2.243	10	0		DEAEHN
CCCN1CCC(N(C)C(=O)c2nnc(Cl)s2)CC1	ZINC000159842236	197367817	/nfs/dbraw/zinc/36/78/17/197367817.db2.gz	NOZODSUCPRNIHS-UHFFFAOYSA-N	0	3	302.831	2.138	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N(C)C[C@H](C)C(=O)OC(C)(C)C	ZINC000458369638	248278574	/nfs/dbraw/zinc/27/85/74/248278574.db2.gz	WCYHREOBHFJHQF-KBPBESRZSA-N	0	3	312.454	2.297	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2cc(Br)ccc2C)C1	ZINC000040633595	183111673	/nfs/dbraw/zinc/11/16/73/183111673.db2.gz	XXVXRRWKIDAVHI-CMPLNLGQSA-N	0	3	313.195	2.073	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2ccc(-c3nccs3)cc2)C1	ZINC000040634080	183111738	/nfs/dbraw/zinc/11/17/38/183111738.db2.gz	CXTIHTREPYZXBF-STQMWFEESA-N	0	3	303.387	2.126	10	0		DEAEHN
CCOC(=O)C(=O)NC[C@H](c1ccc(C)cc1)N1CCCCC1	ZINC000040615576	183109557	/nfs/dbraw/zinc/10/95/57/183109557.db2.gz	CXEFHHWGMIVTTN-MRXNPFEDSA-N	0	3	318.417	2.201	10	0		DEAEHN
COCCN(C)[C@H](CN)c1ccc(Br)cc1F	ZINC000042458536	183272641	/nfs/dbraw/zinc/27/26/41/183272641.db2.gz	PLWZQWRBDIRTKD-GFCCVEGCSA-N	0	3	305.191	2.166	10	0		DEAEHN
COCCN(C)[C@H](CN)c1cc(Br)ccc1OC	ZINC000042458844	183273135	/nfs/dbraw/zinc/27/31/35/183273135.db2.gz	FAJCSRMLVDRNBV-GFCCVEGCSA-N	0	3	317.227	2.036	10	0		DEAEHN
CCN(CCOc1ccc(CC(N)=S)cc1)[C@H](C)COC	ZINC000042765879	183306141	/nfs/dbraw/zinc/30/61/41/183306141.db2.gz	SMNAOTKANKZJSL-CYBMUJFWSA-N	0	3	310.463	2.251	10	0		DEAEHN
CC[C@H](N)[C@@H](c1cccc(Cl)c1)N1CCCC[C@@H]1C(N)=O	ZINC000043015841	183328017	/nfs/dbraw/zinc/32/80/17/183328017.db2.gz	RVYCIOCETNYYOA-RRFJBIMHSA-N	0	3	309.841	2.458	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccccc1Cl)N1CCS(=O)CC1	ZINC000043052235	183332915	/nfs/dbraw/zinc/33/29/15/183332915.db2.gz	AJZUYSQENTXJLW-ZIAGYGMSSA-N	0	3	300.855	2.183	10	0		DEAEHN
NC[C@H](c1cc(Br)cs1)N1CCCC[C@@H]1CO	ZINC000043286345	183350284	/nfs/dbraw/zinc/35/02/84/183350284.db2.gz	DFWJFEFQIIVRJO-GHMZBOCLSA-N	0	3	319.268	2.357	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccco1)N1CCN(c2nccs2)CC1	ZINC000043334568	183356157	/nfs/dbraw/zinc/35/61/57/183356157.db2.gz	ORLQLYRPQCKOFA-TZMCWYRMSA-N	0	3	306.435	2.337	10	0		DEAEHN
Cc1ccc([C@@H](CN)Sc2nnnn2-c2ccccc2)o1	ZINC000043367383	183357603	/nfs/dbraw/zinc/35/76/03/183357603.db2.gz	VRKKOBYZMDZADI-CYBMUJFWSA-N	0	3	301.375	2.356	10	0		DEAEHN
CN[C@@H](CN1C(=O)CCC1=O)c1cccc(C(F)(F)F)c1	ZINC000043993527	183391974	/nfs/dbraw/zinc/39/19/74/183391974.db2.gz	BCQSHZVKNZYNLO-NSHDSACASA-N	0	3	300.280	2.115	10	0		DEAEHN
N[C@@H]1C[C@@H]1NC(=O)c1cc(C(F)(F)F)ccc1Br	ZINC000159798102	197365004	/nfs/dbraw/zinc/36/50/04/197365004.db2.gz	QXVOUSCJPBAULR-BDAKNGLRSA-N	0	3	323.112	2.297	10	0		DEAEHN
CC(C)N[C@@](C)(CSc1ccc(C(F)(F)F)cn1)C(N)=O	ZINC000045559362	183515876	/nfs/dbraw/zinc/51/58/76/183515876.db2.gz	UCAJHFWTLGVDGO-LBPRGKRZSA-N	0	3	321.368	2.435	10	0		DEAEHN
O[C@H](CN1CCC(Cn2cccn2)CC1)c1ccc(F)cc1	ZINC000105886798	194157773	/nfs/dbraw/zinc/15/77/73/194157773.db2.gz	ZKGCPNUOSLGERE-QGZVFWFLSA-N	0	3	303.381	2.468	10	0		DEAEHN
C[C@H](NC[C@H]1CN(C)CCO1)c1ccc(OC(F)F)cc1	ZINC000105932391	194172539	/nfs/dbraw/zinc/17/25/39/194172539.db2.gz	RCCTTWJFWLFVMT-FZMZJTMJSA-N	0	3	300.349	2.269	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cscc2Br)C1	ZINC000285316575	218379531	/nfs/dbraw/zinc/37/95/31/218379531.db2.gz	MMRMJSORFYZLNS-MRVPVSSYSA-N	0	3	303.225	2.287	10	0		DEAEHN
CC[C@@H]1C(=O)NCCN1c1cccc(Cl)c1CNC1CC1	ZINC000110682702	194349600	/nfs/dbraw/zinc/34/96/00/194349600.db2.gz	LKENMEFJUMWAPF-CQSZACIVSA-N	0	3	307.825	2.307	10	0		DEAEHN
CCCN([C@H]1CCCNC1)S(=O)(=O)c1ccc(Cl)cc1	ZINC000110942398	194372046	/nfs/dbraw/zinc/37/20/46/194372046.db2.gz	YNPRXSUFKNDRTO-ZDUSSCGKSA-N	0	3	316.854	2.493	10	0		DEAEHN
CCN([C@@H]1CCCNC1)S(=O)(=O)c1cc(Cl)ccc1C	ZINC000110941360	194372608	/nfs/dbraw/zinc/37/26/08/194372608.db2.gz	VTLQBPGXZRHDOS-CYBMUJFWSA-N	0	3	316.854	2.411	10	0		DEAEHN
Cc1sc(CN)cc1S(=O)(=O)N1CCSC(C)(C)C1	ZINC000159321808	197344869	/nfs/dbraw/zinc/34/48/69/197344869.db2.gz	AVLRUULFASVNNM-UHFFFAOYSA-N	0	3	320.505	2.031	10	0		DEAEHN
Cc1nnc(NC(=O)N[C@H](Cc2ccccc2)CN(C)C)s1	ZINC000056557091	184015569	/nfs/dbraw/zinc/01/55/69/184015569.db2.gz	YUQIAULXBGNUOB-CYBMUJFWSA-N	0	3	319.434	2.141	10	0		DEAEHN
CNC(C)(C)C(=O)Nc1ccc(I)cc1	ZINC000061300340	184167877	/nfs/dbraw/zinc/16/78/77/184167877.db2.gz	JDBOLNCTTYZZMZ-UHFFFAOYSA-N	0	3	318.158	2.228	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCc3cc(OC)ccc32)C1	ZINC000060558699	184152053	/nfs/dbraw/zinc/15/20/53/184152053.db2.gz	FKKBJOJRIZDOCT-AWEZNQCLSA-N	0	3	303.406	2.252	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(NC[C@H]2CCCCN2C)n1	ZINC000061540840	184173416	/nfs/dbraw/zinc/17/34/16/184173416.db2.gz	DKHKLIQWSHXNKM-LLVKDONJSA-N	0	3	312.849	2.267	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(NC[C@@H]2CCCCN2C)n1	ZINC000061540838	184173774	/nfs/dbraw/zinc/17/37/74/184173774.db2.gz	DKHKLIQWSHXNKM-NSHDSACASA-N	0	3	312.849	2.267	10	0		DEAEHN
COCCNC[C@](C)(O)c1ccc(F)c(Br)c1	ZINC000061689981	184182968	/nfs/dbraw/zinc/18/29/68/184182968.db2.gz	WQTAXSJPKDSAFJ-LBPRGKRZSA-N	0	3	306.175	2.032	10	0		DEAEHN
C[C@H]1CN(CCC(=O)Nc2cc(Cl)ccc2N)CCCO1	ZINC000061912877	184195076	/nfs/dbraw/zinc/19/50/76/184195076.db2.gz	QHCJWALTPKARGY-NSHDSACASA-N	0	3	311.813	2.362	10	0		DEAEHN
NC[C@H](c1ccc(Br)cc1F)N1CCCOCC1	ZINC000061916419	184195340	/nfs/dbraw/zinc/19/53/40/184195340.db2.gz	JFNJSQYAIABTKJ-CYBMUJFWSA-N	0	3	317.202	2.310	10	0		DEAEHN
C[C@H]1CN([C@@H](CN)c2ccccc2OC(F)F)CCCO1	ZINC000061916123	184195379	/nfs/dbraw/zinc/19/53/79/184195379.db2.gz	DLSGCMANMGAJKC-AAEUAGOBSA-N	0	3	300.349	2.399	10	0		DEAEHN
CC(C)CN1C(=O)C[C@H](N)[C@H]1c1ccc(Br)o1	ZINC000062209883	184220271	/nfs/dbraw/zinc/22/02/71/184220271.db2.gz	RAHUNXUMXRYVGE-UFBFGSQYSA-N	0	3	301.184	2.299	10	0		DEAEHN
CS(=O)(=O)c1ccc([C@@H](N)c2ccc3c(c2)COC3)cc1	ZINC000062332440	184230816	/nfs/dbraw/zinc/23/08/16/184230816.db2.gz	QCUUTPGUBOMAPJ-MRXNPFEDSA-N	0	3	303.383	2.168	10	0		DEAEHN
CC(C)(C)NCc1c(N2CCC[C@@H]2CO)nc2sccn12	ZINC000062736777	184251047	/nfs/dbraw/zinc/25/10/47/184251047.db2.gz	ZKUCGDZKBJPUOU-LLVKDONJSA-N	0	3	308.451	2.245	10	0		DEAEHN
CCOC(=O)COc1ccc(Cl)cc1CNCCOC	ZINC000062731064	184251549	/nfs/dbraw/zinc/25/15/49/184251549.db2.gz	CXHQXXJZNKSBMX-UHFFFAOYSA-N	0	3	301.770	2.018	10	0		DEAEHN
CCOC(=O)[C@H](C)Oc1ccc(CNCCOC)cc1Cl	ZINC000062730589	184251606	/nfs/dbraw/zinc/25/16/06/184251606.db2.gz	RRJKDFHPFCMMMN-NSHDSACASA-N	0	3	315.797	2.406	10	0		DEAEHN
CCN[C@@H](C)c1ccc(F)cc1O[C@@H]1CCS(=O)(=O)C1	ZINC000062746694	184251982	/nfs/dbraw/zinc/25/19/82/184251982.db2.gz	DUDKALOEFQQUFK-CMPLNLGQSA-N	0	3	301.383	2.062	10	0		DEAEHN
CC[NH2+][C@H](C)c1ccccc1[N-]S(=O)(=O)CCOCC	ZINC000063153870	184274436	/nfs/dbraw/zinc/27/44/36/184274436.db2.gz	AODSELAYPBKHBX-GFCCVEGCSA-N	0	3	300.424	2.135	10	0		DEAEHN
[NH3+][C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000063175824	184276636	/nfs/dbraw/zinc/27/66/36/184276636.db2.gz	GGEREEBUWAXNRJ-NXEZZACHSA-N	0	3	309.218	2.152	10	0		DEAEHN
CCc1ncc(CNC[C@H]2CCC3(CCOCC3)[C@H]2O)s1	ZINC000554936445	291784104	/nfs/dbraw/zinc/78/41/04/291784104.db2.gz	QRODCIMKHDZVMR-DOMZBBRYSA-N	0	3	310.463	2.363	10	0		DEAEHN
CC[C@H](NC[C@H]1Cc2ccccc2O1)C(=O)Nc1cc(C)on1	ZINC000065401542	184337520	/nfs/dbraw/zinc/33/75/20/184337520.db2.gz	GMBWRPRDYKEZLV-KGLIPLIRSA-N	0	3	315.373	2.293	10	0		DEAEHN
CCCN(C1CC1)S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159063821	197323634	/nfs/dbraw/zinc/32/36/34/197323634.db2.gz	JFQNWDZKOZBFDH-UHFFFAOYSA-N	0	3	300.399	2.156	10	0		DEAEHN
C[C@H](CCO)NC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000119161797	207355679	/nfs/dbraw/zinc/35/56/79/207355679.db2.gz	MEZQKHPSTXCROM-CRAIPNDOSA-N	0	3	319.449	2.111	10	0		DEAEHN
C[C@H]1CNC[C@H](C)N1C(=O)Cc1cccc(Br)c1	ZINC000069133142	184499779	/nfs/dbraw/zinc/49/97/79/184499779.db2.gz	IFJICARTWWSXTA-QWRGUYRKSA-N	0	3	311.223	2.200	10	0		DEAEHN
C[C@@H]1OCC[C@H]1N[C@@H](CO)c1ccc(Br)cc1	ZINC000536831840	284977903	/nfs/dbraw/zinc/97/79/03/284977903.db2.gz	ISTOYRDBEQRAIS-BIMULSAOSA-N	0	3	300.196	2.250	10	0		DEAEHN
CC(=O)N1CC[C@H](NCCc2nc(C)no2)c2ccccc2C1	ZINC000538713745	285052120	/nfs/dbraw/zinc/05/21/20/285052120.db2.gz	IIFRKXAJBWERPP-INIZCTEOSA-N	0	3	314.389	2.004	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1cc(OC)c(OC)cc1Cl	ZINC000159199125	197334617	/nfs/dbraw/zinc/33/46/17/197334617.db2.gz	DNQKAEAXXZHIRX-JTQLQIEISA-N	0	3	316.785	2.050	10	0		DEAEHN
CN([C@@H](CN)c1ccccc1OC(F)(F)F)[C@@H]1CCOC1	ZINC000158701384	197294442	/nfs/dbraw/zinc/29/44/42/197294442.db2.gz	UZAGVMURDJFZOW-PWSUYJOCSA-N	0	3	304.312	2.306	10	0		DEAEHN
Cc1cc(CN)cc(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)c1C	ZINC000158765250	197299605	/nfs/dbraw/zinc/29/96/05/197299605.db2.gz	ZWTMZIFYIQXWCH-GJZGRUSLSA-N	0	3	308.447	2.183	10	0		DEAEHN
N[C@@H](CS(=O)(=O)c1cc(Cl)ccc1Cl)[C@H]1CCOC1	ZINC000158741033	197298147	/nfs/dbraw/zinc/29/81/47/197298147.db2.gz	UWWHAPMHUOJHQG-KWQFWETISA-N	0	3	324.229	2.131	10	0		DEAEHN
C[C@@H]1C[C@H](Nc2nc(Cl)nc(N3CCCC3)n2)CCN1C	ZINC000158605564	197287455	/nfs/dbraw/zinc/28/74/55/197287455.db2.gz	OMPZOUNAKMGZEN-GHMZBOCLSA-N	0	3	310.833	2.020	10	0		DEAEHN
C[C@@H]1C[C@@H](Nc2nc(Br)cn3ccnc23)CCN1C	ZINC000158595599	197286405	/nfs/dbraw/zinc/28/64/05/197286405.db2.gz	PQDWDXQEOCGNBS-ZJUUUORDSA-N	0	3	324.226	2.386	10	0		DEAEHN
COCCNCc1cnc(N2C[C@@H](C)S[C@@H](C)C2)c(C)c1	ZINC000158278053	197258635	/nfs/dbraw/zinc/25/86/35/197258635.db2.gz	JISRCAWPMDIGDL-OKILXGFUSA-N	0	3	309.479	2.456	10	0		DEAEHN
CN[C@@H](C)c1cccc(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)c1	ZINC000158211142	197253591	/nfs/dbraw/zinc/25/35/91/197253591.db2.gz	YVJPRQBKMJJHQF-AEGPPILISA-N	0	3	308.447	2.388	10	0		DEAEHN
C[C@H]1C[C@@H](Nc2nc3c(cc2C(N)=S)CCC3)CCN1C	ZINC000158060069	197239763	/nfs/dbraw/zinc/23/97/63/197239763.db2.gz	JOIJUUWXZILAMG-JQWIXIFHSA-N	0	3	304.463	2.099	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)c2ccc3nc(N)sc3c2)CCN1C	ZINC000157825991	197219110	/nfs/dbraw/zinc/21/91/10/197219110.db2.gz	MQVQJNQEKFVCQO-GXSJLCMTSA-N	0	3	304.419	2.091	10	0		DEAEHN
Cc1ccc(CNC2CC2)cc1S(=O)(=O)N(C)C1CCC1	ZINC000157234509	197171886	/nfs/dbraw/zinc/17/18/86/197171886.db2.gz	WMCCRRQEQCHKRE-UHFFFAOYSA-N	0	3	308.447	2.420	10	0		DEAEHN
CN(C)c1nc(CN2CCN(C3CCCCC3)CC2)ns1	ZINC000157198074	197169514	/nfs/dbraw/zinc/16/95/14/197169514.db2.gz	KHKOBEUNDCAWLS-UHFFFAOYSA-N	0	3	309.483	2.054	10	0		DEAEHN
CN(C)CCN1CCC(Nc2noc(-c3ccccc3)n2)CC1	ZINC000157044250	197158615	/nfs/dbraw/zinc/15/86/15/197158615.db2.gz	DOSJVAQEEAJOIY-UHFFFAOYSA-N	0	3	315.421	2.175	10	0		DEAEHN
O=C1C[C@@H](NC[C@H]2CCCCS2)C(=O)N1c1ccccc1	ZINC000156412908	197110853	/nfs/dbraw/zinc/11/08/53/197110853.db2.gz	JJAFUSXANNMFAB-ZIAGYGMSSA-N	0	3	304.415	2.194	10	0		DEAEHN
C[C@H](N)c1cccc(S(=O)(=O)NC[C@H]2CCCCS2)c1	ZINC000156468871	197115620	/nfs/dbraw/zinc/11/56/20/197115620.db2.gz	PVKLESURKRKQIB-WCQYABFASA-N	0	3	314.476	2.270	10	0		DEAEHN
C[C@H](N)c1cccc(S(=O)(=O)NC[C@@H]2CCCCS2)c1	ZINC000156468620	197115261	/nfs/dbraw/zinc/11/52/61/197115261.db2.gz	PVKLESURKRKQIB-AAEUAGOBSA-N	0	3	314.476	2.270	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCC(C)(C)[C@H](O)C(C)C	ZINC000156148635	197089475	/nfs/dbraw/zinc/08/94/75/197089475.db2.gz	SOOLDUARFSIPBT-LSDHHAIUSA-N	0	3	315.502	2.305	10	0		DEAEHN
COc1cc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc(OC)c1C	ZINC000155608476	197071457	/nfs/dbraw/zinc/07/14/57/197071457.db2.gz	ASTUDWJQULQKPZ-SWLSCSKDSA-N	0	3	320.433	2.471	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000155572253	197068398	/nfs/dbraw/zinc/06/83/98/197068398.db2.gz	SMUVGUJAYHRBCO-BZNIZROVSA-N	0	3	321.396	2.243	10	0		DEAEHN
O=C(Nc1cccc(CN2CCCCC2)c1)[C@@H]1CSC(=O)N1	ZINC000155008650	197013382	/nfs/dbraw/zinc/01/33/82/197013382.db2.gz	ABRKVHDZRFWEIS-AWEZNQCLSA-N	0	3	319.430	2.436	10	0		DEAEHN
CC[C@@H]1CN(Cc2cccc3[nH]ccc32)CCN1C[C@@H](C)O	ZINC000120764480	195232318	/nfs/dbraw/zinc/23/23/18/195232318.db2.gz	HEUIZFTUTMCJIY-GDBMZVCRSA-N	0	3	301.434	2.445	10	0		DEAEHN
O=C(NC[C@@H]1OC[C@H]2CCN(Cc3ccsc3)C[C@@H]12)C1CC1	ZINC000247447239	257119700	/nfs/dbraw/zinc/11/97/00/257119700.db2.gz	YWCKEDWJJQVKRI-OAGGEKHMSA-N	0	3	320.458	2.111	10	0		DEAEHN
CC[C@@]1(C)N[C@@H](c2ccsc2)N(CCN2CCCC2)C1=O	ZINC000123381171	195575056	/nfs/dbraw/zinc/57/50/56/195575056.db2.gz	ABZABRTVFYUBOU-GDBMZVCRSA-N	0	3	307.463	2.443	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2ccc3c(c2)CCC(=O)N3)CCN1C	ZINC000127462529	195879609	/nfs/dbraw/zinc/87/96/09/195879609.db2.gz	JUXAOEFXOFQNDV-WFASDCNBSA-N	0	3	315.417	2.126	10	0		DEAEHN
COC[C@@](C)(O)CNCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000545199441	285398200	/nfs/dbraw/zinc/39/82/00/285398200.db2.gz	DQTSZVZKNFPALZ-KRWDZBQOSA-N	0	3	309.406	2.129	10	0		DEAEHN
COCCCN1C[C@@]2(C[C@@H]2N)c2cc(Br)ccc21	ZINC000725247280	542769810	/nfs/dbraw/zinc/76/98/10/542769810.db2.gz	LUINRVMLHZSZST-KBPBESRZSA-N	0	3	311.223	2.274	10	0		DEAEHN
CCOC(=O)C1C(=O)Nc2c1c(Br)ccc2F	ZINC000725255757	542770671	/nfs/dbraw/zinc/77/06/71/542770671.db2.gz	LTVGJKXIDSQTSP-MRVPVSSYSA-N	0	3	302.099	2.187	10	0		DEAEHN
Cn1ccc(CNC2CCN(c3ccc(F)cc3F)CC2)n1	ZINC000358267492	133132254	/nfs/dbraw/zinc/13/22/54/133132254.db2.gz	QHAKCOZPQKTKQL-UHFFFAOYSA-N	0	3	306.360	2.457	10	0		DEAEHN
Cc1nc(C2(NC(=O)C3CCN(C)CC3)CCCCCC2)no1	ZINC000360104957	133162373	/nfs/dbraw/zinc/16/23/73/133162373.db2.gz	OYLYDXKMLGBGGJ-UHFFFAOYSA-N	0	3	320.437	2.386	10	0		DEAEHN
Cc1nccn1CCCN1CCO[C@H](COc2ccccc2)C1	ZINC000361984899	133203437	/nfs/dbraw/zinc/20/34/37/133203437.db2.gz	LWSTYBIZMYUFDZ-SFHVURJKSA-N	0	3	315.417	2.361	10	0		DEAEHN
CC(C)[C@@H](NC(=O)CC1CCN(C)CC1)C(=O)OC(C)(C)C	ZINC000362881879	133256885	/nfs/dbraw/zinc/25/68/85/133256885.db2.gz	BZFCIYUQUSHMBW-OAHLLOKOSA-N	0	3	312.454	2.201	10	0		DEAEHN
O=C(C[C@H]1CCOc2ccccc21)N1CCN2CCC1CC2	ZINC000188617472	145014669	/nfs/dbraw/zinc/01/46/69/145014669.db2.gz	UJKPPYIEEJDCSD-CQSZACIVSA-N	0	3	300.402	2.249	10	0		DEAEHN
CCn1cc(C2CCN(C[C@H](O)CC(F)(F)F)CC2)cn1	ZINC000188990122	145020647	/nfs/dbraw/zinc/02/06/47/145020647.db2.gz	YPKQSUOZOFXFEJ-CYBMUJFWSA-N	0	3	305.344	2.396	10	0		DEAEHN
O=S(=O)([N-]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(F)cc1F	ZINC000189210154	145024010	/nfs/dbraw/zinc/02/40/10/145024010.db2.gz	BLNLNYBUKFPXTM-UHFFFAOYSA-N	0	3	324.352	2.047	10	0		DEAEHN
Cc1cc(-n2ccnc2)ccc1CN(CC(N)=O)CC(C)C	ZINC000191934562	145068255	/nfs/dbraw/zinc/06/82/55/145068255.db2.gz	YKIKMHVMNNBLFF-UHFFFAOYSA-N	0	3	300.406	2.124	10	0		DEAEHN
COc1ccnc(NC2CCN(CCOC(C)(C)C)CC2)n1	ZINC000192866165	145079977	/nfs/dbraw/zinc/07/99/77/145079977.db2.gz	NZEAIXFLJNBMGZ-UHFFFAOYSA-N	0	3	308.426	2.177	10	0		DEAEHN
CCCCOC[C@@H](O)CN[C@@H](C)c1cccc(NC(C)=O)c1	ZINC000193241396	145083606	/nfs/dbraw/zinc/08/36/06/145083606.db2.gz	XBUVLGQNZJJECO-GUYCJALGSA-N	0	3	308.422	2.473	10	0		DEAEHN
Cc1ccc(NC(=O)CN2CCN3CCC[C@H]3C2)c(Cl)c1	ZINC000246293777	145097355	/nfs/dbraw/zinc/09/73/55/145097355.db2.gz	IPKKNDGNPQHZKE-ZDUSSCGKSA-N	0	3	307.825	2.367	10	0		DEAEHN
Cc1ccccc1OCCCN1CCN(C[C@H](C)O)[C@H](C)C1	ZINC000246310325	145098139	/nfs/dbraw/zinc/09/81/39/145098139.db2.gz	AJAKBBGYLCOBEQ-SJORKVTESA-N	0	3	306.450	2.151	10	0		DEAEHN
C[C@H](CCc1cccn1C)NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000246399208	145101618	/nfs/dbraw/zinc/10/16/18/145101618.db2.gz	RKOKKDGDHZQEKN-BFYDXBDKSA-N	0	3	320.481	2.470	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)C(=O)Nc2cccc(Cl)c2)C1	ZINC000246529277	145105844	/nfs/dbraw/zinc/10/58/44/145105844.db2.gz	UTBTXCRQQJFTHA-SMDDNHRTSA-N	0	3	323.824	2.123	10	0		DEAEHN
C[N@@H+]1CCC[C@@H]2CN(C(=O)NCc3ccc([O-])c(F)c3)CC[C@H]21	ZINC000246711424	145111586	/nfs/dbraw/zinc/11/15/86/145111586.db2.gz	FHXLPXPLEKRCBI-UKRRQHHQSA-N	0	3	321.396	2.157	10	0		DEAEHN
C[N@H+]1CCC[C@@H]2CN(C(=O)NCc3ccc([O-])c(F)c3)CC[C@H]21	ZINC000246711424	145111587	/nfs/dbraw/zinc/11/15/87/145111587.db2.gz	FHXLPXPLEKRCBI-UKRRQHHQSA-N	0	3	321.396	2.157	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(-c2ccncc2)on1	ZINC000246770484	145113520	/nfs/dbraw/zinc/11/35/20/145113520.db2.gz	AVWHASIPSBEUDO-JSGCOSHPSA-N	0	3	312.373	2.045	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@H](C)Sc2ccccn2)C1	ZINC000247044854	145124645	/nfs/dbraw/zinc/12/46/45/145124645.db2.gz	IDAMVOPVYAMWHF-RDBSUJKOSA-N	0	3	307.463	2.407	10	0		DEAEHN
Cc1cc(C)cc(OCCCN2CCN(C[C@H](C)O)[C@H](C)C2)c1	ZINC000247214882	145129867	/nfs/dbraw/zinc/12/98/67/145129867.db2.gz	PYXGSKRNQVNDFM-MSOLQXFVSA-N	0	3	320.477	2.459	10	0		DEAEHN
CCC(CC)NC(=O)[C@@H](C)N1CCC[C@H]1Cn1ccnc1C	ZINC000247239469	145129970	/nfs/dbraw/zinc/12/99/70/145129970.db2.gz	ZVENWRRONOBTEM-CJNGLKHVSA-N	0	3	306.454	2.349	10	0		DEAEHN
O=C([C@@H]1CCCN(C/C=C/c2ccccc2)C1)N1CCOCC1	ZINC000247800881	145143963	/nfs/dbraw/zinc/14/39/63/145143963.db2.gz	FWDYCFFNQYNLTC-SBLNNXNXSA-N	0	3	314.429	2.271	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1C(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000248430542	145155010	/nfs/dbraw/zinc/15/50/10/145155010.db2.gz	AWUQPXFBLTYZLQ-OCCSQVGLSA-N	0	3	304.438	2.255	10	0		DEAEHN
Cc1ccc(C(=O)CCN2C[C@H](N3CCOCC3)[C@@H](C)C2)cc1	ZINC000248548845	145158446	/nfs/dbraw/zinc/15/84/46/145158446.db2.gz	GZEFVOPJCJMSQF-WMZOPIPTSA-N	0	3	316.445	2.220	10	0		DEAEHN
CO[C@@H]1CC[C@@H]2OCCN(C[C@@H](O)CCc3ccccc3)[C@@H]2C1	ZINC000248564083	145158508	/nfs/dbraw/zinc/15/85/08/145158508.db2.gz	KFBICOVQQYDEEV-MANSERQUSA-N	0	3	319.445	2.248	10	0		DEAEHN
c1ccc(-c2nnc(CN3CCN4CCC[C@H]4C3)s2)cc1	ZINC000248613338	145161555	/nfs/dbraw/zinc/16/15/55/145161555.db2.gz	HNQKZGXXZVFRNL-AWEZNQCLSA-N	0	3	300.431	2.485	10	0		DEAEHN
CCN1CC[C@H](N(C)C(=O)C(=O)c2ccccc2OC)[C@@H](C)C1	ZINC000248740109	145166271	/nfs/dbraw/zinc/16/62/71/145166271.db2.gz	QILLFFVIINWFDK-ZFWWWQNUSA-N	0	3	318.417	2.067	10	0		DEAEHN
COc1ccc(C)nc1NC(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000248833712	145169481	/nfs/dbraw/zinc/16/94/81/145169481.db2.gz	MUWJUESTESNEMO-OLZOCXBDSA-N	0	3	304.394	2.099	10	0		DEAEHN
c1ccc(N2CCCN(CCO[C@H]3CCCCO3)CC2)nc1	ZINC000248830428	145169583	/nfs/dbraw/zinc/16/95/83/145169583.db2.gz	LQORRWJKKRBHAF-KRWDZBQOSA-N	0	3	305.422	2.137	10	0		DEAEHN
Cc1ccc(N2CCCN(C[C@@H](O)CC3CCCC3)CC2)nn1	ZINC000248904380	145172642	/nfs/dbraw/zinc/17/26/42/145172642.db2.gz	LMXWBBIPIPJJOM-KRWDZBQOSA-N	0	3	318.465	2.238	10	0		DEAEHN
FC(F)(F)C(F)(F)COCCN1CCN2CCCC[C@@H]2C1	ZINC000249296895	145182518	/nfs/dbraw/zinc/18/25/18/145182518.db2.gz	NBUHBSQOEDKYPH-LLVKDONJSA-N	0	3	316.314	2.371	10	0		DEAEHN
CN1c2ccc(CN3CCN4CCCC[C@H]4C3)cc2CCC1=O	ZINC000249466531	145185048	/nfs/dbraw/zinc/18/50/48/145185048.db2.gz	SLLBOCSMAICSGE-KRWDZBQOSA-N	0	3	313.445	2.266	10	0		DEAEHN
C[C@H]1CN(CCC(=O)c2ccc(F)cc2)C[C@H]1N1CCOCC1	ZINC000252734103	145199955	/nfs/dbraw/zinc/19/99/55/145199955.db2.gz	SIGOMSCWPBBEKQ-WMLDXEAASA-N	0	3	320.408	2.051	10	0		DEAEHN
C/C=C\c1ccc(OCC(=O)N2CC[C@H](N(C)C)C2)c(OC)c1	ZINC000255625374	145204422	/nfs/dbraw/zinc/20/44/22/145204422.db2.gz	WPISYVFWEHUHFL-YVACAVLKSA-N	0	3	318.417	2.270	10	0		DEAEHN
CC(C)(C)NC(=O)CN1CCNC[C@@H]1c1cccc(Cl)c1	ZINC000261611268	145210271	/nfs/dbraw/zinc/21/02/71/145210271.db2.gz	CDANKCJZMSJPFO-CQSZACIVSA-N	0	3	309.841	2.201	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)Nc1cccc(Cn2cncn2)c1	ZINC000261626146	145211602	/nfs/dbraw/zinc/21/16/02/145211602.db2.gz	COGZLPYIMPJXOD-HNNXBMFYSA-N	0	3	313.405	2.043	10	0		DEAEHN
N[C@@H](C(=O)N1CC2(CCC2)c2c1cccc2F)C1CCOCC1	ZINC000261644965	145213086	/nfs/dbraw/zinc/21/30/86/145213086.db2.gz	DSBMOYYYPHIYIV-MRXNPFEDSA-N	0	3	318.392	2.348	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)NCc1cc(F)ccc1F	ZINC000261649232	145213980	/nfs/dbraw/zinc/21/39/80/145213980.db2.gz	FPZRADJOHIRLQE-DXCKQFNASA-N	0	3	324.371	2.114	10	0		DEAEHN
COc1ccccc1[C@@H]1CNCCN1Cc1cncc(F)c1	ZINC000261767621	145224141	/nfs/dbraw/zinc/22/41/41/145224141.db2.gz	RVKXDINFLBBLPV-INIZCTEOSA-N	0	3	301.365	2.376	10	0		DEAEHN
C[C@H](NC(=O)C1(N)CCOCC1)c1ccc(F)c(Cl)c1	ZINC000261775133	145225008	/nfs/dbraw/zinc/22/50/08/145225008.db2.gz	GZODAFNVFXTCEF-VIFPVBQESA-N	0	3	300.761	2.164	10	0		DEAEHN
CN(Cc1c(Cl)cccc1Cl)C(=O)C1(N)CCOCC1	ZINC000261829262	145231132	/nfs/dbraw/zinc/23/11/32/145231132.db2.gz	KSFJYBYTBWPXKL-UHFFFAOYSA-N	0	3	317.216	2.460	10	0		DEAEHN
Cc1ccc(NC(=O)CN2CCNC[C@@H]2c2cccnc2)c(C)c1	ZINC000261854865	145233654	/nfs/dbraw/zinc/23/36/54/145233654.db2.gz	VWDOUYHWLHOEPX-GOSISDBHSA-N	0	3	324.428	2.283	10	0		DEAEHN
N[C@@H](C(=O)NCc1csc2ccccc12)C1CCOCC1	ZINC000261909944	145240296	/nfs/dbraw/zinc/24/02/96/145240296.db2.gz	XKGAJHFLNPRICN-OAHLLOKOSA-N	0	3	304.415	2.271	10	0		DEAEHN
CN(CC(=O)N1CCNCC1)C1c2ccccc2-c2ccccc21	ZINC000261915470	145241310	/nfs/dbraw/zinc/24/13/10/145241310.db2.gz	QSVQDFUAKJOFJH-UHFFFAOYSA-N	0	3	321.424	2.120	10	0		DEAEHN
NC1(C(=O)NCC2(c3ccccc3)CCCC2)CCOCC1	ZINC000261916476	145241897	/nfs/dbraw/zinc/24/18/97/145241897.db2.gz	UMMVPNMZPPMAIJ-UHFFFAOYSA-N	0	3	302.418	2.123	10	0		DEAEHN
C[C@@H](C[C@@H]1COCCN1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000262101504	145261707	/nfs/dbraw/zinc/26/17/07/145261707.db2.gz	IUQPGCCULMRHDF-BLLLJJGKSA-N	0	3	303.406	2.214	10	0		DEAEHN
Fc1ccccc1OCCN1CCNC[C@H]1c1cccnc1	ZINC000262117976	145263274	/nfs/dbraw/zinc/26/32/74/145263274.db2.gz	BSUVJVNSUVXRPY-INIZCTEOSA-N	0	3	301.365	2.246	10	0		DEAEHN
C[C@H](C(=O)NCc1ccc(CO)c(F)c1)[C@@H](N)c1ccccc1	ZINC000262305630	145275119	/nfs/dbraw/zinc/27/51/19/145275119.db2.gz	OPMCOXCQVYIASF-YVEFUNNKSA-N	0	3	316.376	2.270	10	0		DEAEHN
NC1(C(=O)Nc2ccc(OCC(F)(F)F)cc2)CCOCC1	ZINC000262367071	145279295	/nfs/dbraw/zinc/27/92/95/145279295.db2.gz	XFARRUCKADZJKV-UHFFFAOYSA-N	0	3	318.295	2.074	10	0		DEAEHN
Cc1cccc(N(C)C(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)c1	ZINC000262412806	145281819	/nfs/dbraw/zinc/28/18/19/145281819.db2.gz	DHKLPTNHSQISPW-IIDMSEBBSA-N	0	3	302.418	2.490	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)Nc1ccc(F)cc1F	ZINC000262498274	145287943	/nfs/dbraw/zinc/28/79/43/145287943.db2.gz	LSHAECINLLVCCZ-WNMQOVRZSA-N	0	3	310.344	2.436	10	0		DEAEHN
CC[C@@H](C)[C@H](N)C(=O)Nc1cccc(-c2nnc(C)n2C)c1	ZINC000262509870	145288769	/nfs/dbraw/zinc/28/87/69/145288769.db2.gz	AYOQKCBTAKKJHP-YGRLFVJLSA-N	0	3	301.394	2.102	10	0		DEAEHN
NC1(C(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2)CCCCC1	ZINC000262644094	145297852	/nfs/dbraw/zinc/29/78/52/145297852.db2.gz	MVFLEVGXDYCYRC-GFCCVEGCSA-N	0	3	323.387	2.321	10	0		DEAEHN
Cc1cccc2[nH]c(CCC(=O)N3CCN[C@@H](C)[C@H]3C)nc21	ZINC000262772908	145304035	/nfs/dbraw/zinc/30/40/35/145304035.db2.gz	LNIIDQFUSGBRBZ-QWHCGFSZSA-N	0	3	300.406	2.013	10	0		DEAEHN
Cc1cccc2nc(CCC(=O)N3CCN[C@@H](C)[C@H]3C)[nH]c21	ZINC000262772908	145304037	/nfs/dbraw/zinc/30/40/37/145304037.db2.gz	LNIIDQFUSGBRBZ-QWHCGFSZSA-N	0	3	300.406	2.013	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@H]2CC[NH2+][C@@H](C)C2)c(Cl)cc1F	ZINC000262763242	145304377	/nfs/dbraw/zinc/30/43/77/145304377.db2.gz	GNPORYCHMRLEEL-UWVGGRQHSA-N	0	3	320.817	2.206	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@H]2CC[NH2+]C[C@H]2C)c(Cl)cc1F	ZINC000262787405	145304847	/nfs/dbraw/zinc/30/48/47/145304847.db2.gz	QRIYRDBKKLOHQM-SKDRFNHKSA-N	0	3	320.817	2.064	10	0		DEAEHN
CCOc1ccc(/C=C/c2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263213557	145336472	/nfs/dbraw/zinc/33/64/72/145336472.db2.gz	KNFYCTADOHXIRR-PPYMECGQSA-N	0	3	314.389	2.215	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2C[C@@]23CCc2ccccc23)n1	ZINC000263221640	145337994	/nfs/dbraw/zinc/33/79/94/145337994.db2.gz	LXSXRUDPQYCDAJ-IIDMSEBBSA-N	0	3	310.401	2.017	10	0		DEAEHN
C[C@@H](O)CN(CCO)CCOc1c(Cl)cccc1Cl	ZINC000311464563	145354234	/nfs/dbraw/zinc/35/42/34/145354234.db2.gz	WRWFDZQIKYUCMD-SNVBAGLBSA-N	0	3	308.205	2.047	10	0		DEAEHN
C[C@H](OC[C@H]1CCCCO1)C(=O)N[C@H]1CCN(C2CCCC2)C1	ZINC000332798498	145388501	/nfs/dbraw/zinc/38/85/01/145388501.db2.gz	NSGSWJGBSAZQCT-YQQAZPJKSA-N	0	3	324.465	2.094	10	0		DEAEHN
Cc1nc(CC2CC2)oc1C(=O)N1CC[C@]2(CCN(C)C2)C1	ZINC000346289831	146055433	/nfs/dbraw/zinc/05/54/33/146055433.db2.gz	HAHRRKPEJYDYQH-KRWDZBQOSA-N	0	3	303.406	2.103	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N1CC(=O)NCc1ccnc(OC(F)F)c1	ZINC000356985309	147015928	/nfs/dbraw/zinc/01/59/28/147015928.db2.gz	NVYJEJUMYFUGSF-PHIMTYICSA-N	0	3	313.348	2.172	10	0		DEAEHN
COCCOC[C@H](C)NC(=O)c1cccc(CN2CCCC2)c1	ZINC000359341688	147310624	/nfs/dbraw/zinc/31/06/24/147310624.db2.gz	FBOWHAYRKDEUEP-HNNXBMFYSA-N	0	3	320.433	2.064	10	0		DEAEHN
O=C(NC1CCN([C@H]2CCOC2)CC1)C1CCC(F)(F)CC1	ZINC000360738121	147376205	/nfs/dbraw/zinc/37/62/05/147376205.db2.gz	ZAMBNTSGPIIJMI-AWEZNQCLSA-N	0	3	316.392	2.181	10	0		DEAEHN
CCN1CC[C@H]2OCCN(c3nc4cc(OC)ccc4o3)[C@H]2C1	ZINC000565477506	292164765	/nfs/dbraw/zinc/16/47/65/292164765.db2.gz	BSKGEYAVXNURFU-GOEBONIOSA-N	0	3	317.389	2.136	10	0		DEAEHN
Cc1ccc(OC[C@H](O)CN2CCC[C@H](c3cc[nH]n3)C2)cc1	ZINC000193847200	292167932	/nfs/dbraw/zinc/16/79/32/292167932.db2.gz	MLACEKLCXCNXDH-JKSUJKDBSA-N	0	3	315.417	2.337	10	0		DEAEHN
Cc1ccc(OC[C@H](O)CN2CC[C@]3(O)CCCC[C@H]3C2)cc1	ZINC000247985994	292168216	/nfs/dbraw/zinc/16/82/16/292168216.db2.gz	IUNRXFXFYKHBFA-YQVWRLOYSA-N	0	3	319.445	2.362	10	0		DEAEHN
F[C@H]1C[C@@H](CNc2ccnc3ccccc32)N(c2cccnn2)C1	ZINC000374543189	148259914	/nfs/dbraw/zinc/25/99/14/148259914.db2.gz	JOKGIGDZACUCNV-KBPBESRZSA-N	0	3	323.375	2.476	10	0		DEAEHN
Cn1ccc([C@H](NC2CCN(C)CC2)c2ccc(F)cc2)n1	ZINC000374982678	148311908	/nfs/dbraw/zinc/31/19/08/148311908.db2.gz	UHSOOEYOHVUEAV-QGZVFWFLSA-N	0	3	302.397	2.332	10	0		DEAEHN
O=C(CCN1CC[C@H](c2nc(C3CC3)no2)C1)NC1CCCC1	ZINC000375446574	148373816	/nfs/dbraw/zinc/37/38/16/148373816.db2.gz	XOQKAMYPUGAQBX-ZDUSSCGKSA-N	0	3	318.421	2.185	10	0		DEAEHN
Cc1cnc2cc(C(=O)NC[C@H]3CCCCN3C3CC3)ccn12	ZINC000565959675	292194348	/nfs/dbraw/zinc/19/43/48/292194348.db2.gz	QKUIFDMFGUYMCQ-MRXNPFEDSA-N	0	3	312.417	2.389	10	0		DEAEHN
CCOCCOCC(=O)N1C[C@@H]2CCCN2Cc2ccccc21	ZINC000123523618	286101585	/nfs/dbraw/zinc/10/15/85/286101585.db2.gz	HSQSMADEUBNBTD-INIZCTEOSA-N	0	3	318.417	2.051	10	0		DEAEHN
COC[C@H](C)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000112186868	401732389	/nfs/dbraw/zinc/73/23/89/401732389.db2.gz	OXYUFJSYXJLRFO-AWEZNQCLSA-N	0	3	314.495	2.137	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1ccccc1SCC(N)=O)C(C)(C)C	ZINC000074316993	401735189	/nfs/dbraw/zinc/73/51/89/401735189.db2.gz	IAZCHAPJWJYCES-LLVKDONJSA-N	0	3	323.462	2.227	10	0		DEAEHN
CC(C)CNC(=O)NC1CCN(CCc2ccncc2)CC1	ZINC000072076495	401702872	/nfs/dbraw/zinc/70/28/72/401702872.db2.gz	MGLWMURGMOFKTG-UHFFFAOYSA-N	0	3	304.438	2.044	10	0		DEAEHN
CC(C)[C@](O)(C(=O)OCC1=CCN(C)CC1)c1ccccc1	ZINC000002009043	401711777	/nfs/dbraw/zinc/71/17/77/401711777.db2.gz	VZCBERXKHILZBM-GOSISDBHSA-N	0	3	303.402	2.335	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)N[C@@H]1COc2ccccc21	ZINC000111481523	401716786	/nfs/dbraw/zinc/71/67/86/401716786.db2.gz	OYYHUGHORQMIBO-DZGCQCFKSA-N	0	3	303.406	2.294	10	0		DEAEHN
CCC(CC)[C@H](O)CNC(=O)c1ccccc1OCCN(C)C	ZINC000111655457	401719564	/nfs/dbraw/zinc/71/95/64/401719564.db2.gz	QOTXGYCJKGQVSY-MRXNPFEDSA-N	0	3	322.449	2.154	10	0		DEAEHN
C[C@@H](C(=O)NC(=O)NC1CC1)N1CCC[C@@]2(CC=CCC2)C1	ZINC000114493972	401802467	/nfs/dbraw/zinc/80/24/67/401802467.db2.gz	NPMPMWKOXITLPO-GUYCJALGSA-N	0	3	305.422	2.185	10	0		DEAEHN
CC1(CNC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)COC1	ZINC000112693831	401753934	/nfs/dbraw/zinc/75/39/34/401753934.db2.gz	LVSZHFPJCVMQMS-OAHLLOKOSA-N	0	3	320.408	2.190	10	0		DEAEHN
COc1ccccc1NCC(=O)NCCN1CCCC[C@@H]1C	ZINC000112869227	401760234	/nfs/dbraw/zinc/76/02/34/401760234.db2.gz	HWDQPFSUTYWRCM-AWEZNQCLSA-N	0	3	305.422	2.098	10	0		DEAEHN
CC[S@@](=O)c1ccccc1C(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000113225126	401770668	/nfs/dbraw/zinc/77/06/68/401770668.db2.gz	IFBOKQXTFLURDG-VVYDWRJNSA-N	0	3	320.458	2.123	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(-c2cccs2)n[nH]1	ZINC000113224291	401770861	/nfs/dbraw/zinc/77/08/61/401770861.db2.gz	MJEJCBBFRSLERQ-VXGBXAGGSA-N	0	3	316.430	2.447	10	0		DEAEHN
COC(=O)Nc1ccccc1C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000113231346	401771677	/nfs/dbraw/zinc/77/16/77/401771677.db2.gz	AJWXBTWPTSTWNQ-CHWSQXEVSA-N	0	3	317.389	2.174	10	0		DEAEHN
O=C(CN[C@H]1CCCC[C@@H]1n1cccn1)NCc1cccs1	ZINC000128357024	401772867	/nfs/dbraw/zinc/77/28/67/401772867.db2.gz	FLVIBDCMXXELSA-GJZGRUSLSA-N	0	3	318.446	2.334	10	0		DEAEHN
CN1C[C@@H]2C[C@@H](c3cccn3-c3ccccn3)N3CCC[C@@]23C1=O	ZINC000012305969	401783151	/nfs/dbraw/zinc/78/31/51/401783151.db2.gz	OAFQOAQWHGYQKY-QOKNQOGYSA-N	0	3	322.412	2.240	10	0		DEAEHN
COc1ccc([C@H]2C[C@@H](C)N(CC(=O)N(C)C3CC3)C2)cc1	ZINC000076389120	401793576	/nfs/dbraw/zinc/79/35/76/401793576.db2.gz	IYOGAYVDXBVBHC-HIFRSBDPSA-N	0	3	302.418	2.494	10	0		DEAEHN
COc1ccccc1OCCN1CC[C@H](c2cnn(C)c2)C1	ZINC000116313643	401849661	/nfs/dbraw/zinc/84/96/61/401849661.db2.gz	SMQBQZBYBHHGBC-AWEZNQCLSA-N	0	3	301.390	2.297	10	0		DEAEHN
COCCN(CCN(C)C)C(=O)c1cc2c(cc(F)cc2C)[nH]1	ZINC000116752796	401858102	/nfs/dbraw/zinc/85/81/02/401858102.db2.gz	BLPWBJUIFKOBCY-UHFFFAOYSA-N	0	3	321.396	2.266	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2csc3ccccc23)CCO1	ZINC000116789936	401859340	/nfs/dbraw/zinc/85/93/40/401859340.db2.gz	KTBDIBWOEQVXKX-GFCCVEGCSA-N	0	3	304.415	2.304	10	0		DEAEHN
C[C@@H]1CCc2sc(C(=O)N3CCO[C@@H](CN(C)C)C3)cc2C1	ZINC000116788332	401859360	/nfs/dbraw/zinc/85/93/60/401859360.db2.gz	JIWKOLUQXDXXSD-OCCSQVGLSA-N	0	3	322.474	2.276	10	0		DEAEHN
Cc1ccccc1[C@@H](C)NC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000117023033	401867201	/nfs/dbraw/zinc/86/72/01/401867201.db2.gz	YOKCKVILYVFJHW-HUUCEWRRSA-N	0	3	305.422	2.028	10	0		DEAEHN
C[C@@H]1CC[C@H](C(=O)NCCCN2CCc3ccccc3C2)O1	ZINC000129960869	401813322	/nfs/dbraw/zinc/81/33/22/401813322.db2.gz	UKAYDBXVLHJPDW-RHSMWYFYSA-N	0	3	302.418	2.119	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)CCC(=O)c2ccc(F)c(F)c2)C1	ZINC000087330472	401931195	/nfs/dbraw/zinc/93/11/95/401931195.db2.gz	QWDVRJMBBWGTFT-GFCCVEGCSA-N	0	3	324.371	2.386	10	0		DEAEHN
COCCOCCN1CCC(CN2CCc3ccccc32)CC1	ZINC000079434117	401873327	/nfs/dbraw/zinc/87/33/27/401873327.db2.gz	TUGZWZSLPUPMTA-UHFFFAOYSA-N	0	3	318.461	2.424	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)NCCN1CCCC[C@@H]1C	ZINC000079531308	401875160	/nfs/dbraw/zinc/87/51/60/401875160.db2.gz	CZBNHFYNIVKNJA-AWEZNQCLSA-N	0	3	305.422	2.473	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CCCC[C@H]1C(C)C	ZINC000117495188	401878328	/nfs/dbraw/zinc/87/83/28/401878328.db2.gz	BVDSJTAIEHRLMF-HOTGVXAUSA-N	0	3	311.470	2.317	10	0		DEAEHN
CN(CCOCC1CC1)C[C@@H](c1cccs1)N1CCOCC1	ZINC000119231673	401934812	/nfs/dbraw/zinc/93/48/12/401934812.db2.gz	GBIAZNOSAYMTGH-INIZCTEOSA-N	0	3	324.490	2.480	10	0		DEAEHN
CN(C)[C@H]1CCCN(C(=O)C[C@@H]2CCOc3ccccc32)C1	ZINC000117783716	401884323	/nfs/dbraw/zinc/88/43/23/401884323.db2.gz	INTXIWWGELFYIH-GJZGRUSLSA-N	0	3	302.418	2.495	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1ccc(OC)cc1C	ZINC000118019027	401888904	/nfs/dbraw/zinc/88/89/04/401888904.db2.gz	QXIRWHLOYUNJKL-AWEZNQCLSA-N	0	3	321.421	2.236	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(Br)o1	ZINC000083550348	401901172	/nfs/dbraw/zinc/90/11/72/401901172.db2.gz	UISOAWGHZJELHW-VHSXEESVSA-N	0	3	313.195	2.351	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCC(C)(C)c2cccc(F)c2)C1	ZINC000118585465	401901188	/nfs/dbraw/zinc/90/11/88/401901188.db2.gz	VZIIKBIMFMSVBE-HNNXBMFYSA-N	0	3	307.413	2.449	10	0		DEAEHN
[NH3+]C1(C[N-]S(=O)(=O)c2ccccc2F)CCCCCC1	ZINC000036266842	401903863	/nfs/dbraw/zinc/90/38/63/401903863.db2.gz	HCCCSAGTIHBZGE-UHFFFAOYSA-N	0	3	300.399	2.156	10	0		DEAEHN
CC[C@@H](O)CN(Cc1ccccc1)C[C@H](O)COC(C)(C)C	ZINC000134508706	401904754	/nfs/dbraw/zinc/90/47/54/401904754.db2.gz	HBOUQSJBGGFZSY-SJORKVTESA-N	0	3	309.450	2.436	10	0		DEAEHN
C[C@H](NC[C@@H](O)Cn1cccn1)c1cccc(Br)c1	ZINC000038012401	401920228	/nfs/dbraw/zinc/92/02/28/401920228.db2.gz	OMWDVJFAIGZDIZ-SMDDNHRTSA-N	0	3	324.222	2.357	10	0		DEAEHN
O=C(c1nc(Cl)ccc1Cl)N1CCN2CCC[C@@H]2C1	ZINC000038107477	401922166	/nfs/dbraw/zinc/92/21/66/401922166.db2.gz	NCSUTGPCMPOUNC-SECBINFHSA-N	0	3	300.189	2.309	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N([C@H](C)C(C)C)C1CC1	ZINC000086396080	401922504	/nfs/dbraw/zinc/92/25/04/401922504.db2.gz	RDMYTKXFIQAPBY-GDBMZVCRSA-N	0	3	311.470	2.316	10	0		DEAEHN
COc1cccc(CN2CCCC[C@H](N3CCN(C)CC3)C2)c1	ZINC000136067184	401959213	/nfs/dbraw/zinc/95/92/13/401959213.db2.gz	RUBRCIYFCJSXCC-SFHVURJKSA-N	0	3	317.477	2.297	10	0		DEAEHN
C[C@H]1CC[C@@H](C(N)=O)CN1Cc1ccc2c(c1)CC(C)(C)O2	ZINC000136381191	401966705	/nfs/dbraw/zinc/96/67/05/401966705.db2.gz	BGHXTLRGSHJEEH-GXTWGEPZSA-N	0	3	302.418	2.486	10	0		DEAEHN
CC(C)c1noc(CCC(=O)NCCN2CCCC[C@H]2C)n1	ZINC000046860526	401974380	/nfs/dbraw/zinc/97/43/80/401974380.db2.gz	FMBUPUJZPXBMOQ-CYBMUJFWSA-N	0	3	308.426	2.116	10	0		DEAEHN
COc1cc(CN(C)C[C@@H]2CCC[C@@H]2O)cc2c1OCCO2	ZINC000091899088	401998698	/nfs/dbraw/zinc/99/86/98/401998698.db2.gz	GLSJBZLVLXLMMI-KBPBESRZSA-N	0	3	307.390	2.059	10	0		DEAEHN
C[C@H](NCCOc1ccccc1)c1ccc(S(N)(=O)=O)cc1	ZINC000120143334	401979886	/nfs/dbraw/zinc/97/98/86/401979886.db2.gz	IJGCZUIZQMUDLY-ZDUSSCGKSA-N	0	3	320.414	2.064	10	0		DEAEHN
C[C@@H](NC[C@H](O)Cn1cccn1)c1ccccc1Br	ZINC000148932325	401992312	/nfs/dbraw/zinc/99/23/12/401992312.db2.gz	BKZQFFJRISULIJ-NEPJUHHUSA-N	0	3	324.222	2.357	10	0		DEAEHN
Cc1nn(C)c(C)c1-c1ccnc(N[C@H]2CCCN(C)C2)n1	ZINC000048159277	401995052	/nfs/dbraw/zinc/99/50/52/401995052.db2.gz	IGIXQMKIHJAWSU-ZDUSSCGKSA-N	0	3	300.410	2.000	10	0		DEAEHN
CCCC[C@@H](COC)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000091343686	401996251	/nfs/dbraw/zinc/99/62/51/401996251.db2.gz	HRWHJKIBOYMLDM-OCCSQVGLSA-N	0	3	314.451	2.190	10	0		DEAEHN
CCCC[C@@H](COC)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000091343684	401996558	/nfs/dbraw/zinc/99/65/58/401996558.db2.gz	HRWHJKIBOYMLDM-JSGCOSHPSA-N	0	3	314.451	2.190	10	0		DEAEHN
Cc1cnc(CCN(C)C(=O)NC[C@H](C)N(C)C2CC2)s1	ZINC000121314698	402027915	/nfs/dbraw/zinc/02/79/15/402027915.db2.gz	LMDLSMRFZMOSGR-NSHDSACASA-N	0	3	310.467	2.118	10	0		DEAEHN
O=C1NCCC[C@@H]1N[C@@H]1CCc2cc(Br)ccc21	ZINC000050395467	402028075	/nfs/dbraw/zinc/02/80/75/402028075.db2.gz	VYVNKMUKUSFSOF-OLZOCXBDSA-N	0	3	309.207	2.305	10	0		DEAEHN
CC(C)C[C@H](C)S(=O)(=O)N1CC[C@H](CN2CCCC2)C1	ZINC000151622296	402046850	/nfs/dbraw/zinc/04/68/50/402046850.db2.gz	TTXIDHDZRGPQRI-LSDHHAIUSA-N	0	3	302.484	2.169	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H](C)Oc1ccc(OC)cc1)N(C)C	ZINC000121666690	402047474	/nfs/dbraw/zinc/04/74/74/402047474.db2.gz	KYRYSWCOWFSUGR-CJNGLKHVSA-N	0	3	308.422	2.309	10	0		DEAEHN
COC(=O)C(C)(C)CN[C@H](C)C(=O)N[C@@H](C)c1ccccc1	ZINC000151802265	402057378	/nfs/dbraw/zinc/05/73/78/402057378.db2.gz	HQZCJKNUHOTBSE-QWHCGFSZSA-N	0	3	306.406	2.041	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC[C@@H](C)CN2CCCC2)c(C)s1	ZINC000048672349	402006132	/nfs/dbraw/zinc/00/61/32/402006132.db2.gz	XVEZVUYGUWKQTP-LLVKDONJSA-N	0	3	316.492	2.375	10	0		DEAEHN
CCc1nn(C)c(CC)c1CN1CCN(CCOC)[C@H](CC)C1	ZINC000120980539	402009375	/nfs/dbraw/zinc/00/93/75/402009375.db2.gz	UZFIOTBRUQQBTP-OAHLLOKOSA-N	0	3	322.497	2.088	10	0		DEAEHN
O[C@H](Cn1cnc2ccccc21)CN1CCc2ccccc2C1	ZINC000058137199	402098838	/nfs/dbraw/zinc/09/88/38/402098838.db2.gz	DQPOZPIVWUOICX-KRWDZBQOSA-N	0	3	307.397	2.456	10	0		DEAEHN
COc1cccc(OCC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000123008306	402105725	/nfs/dbraw/zinc/10/57/25/402105725.db2.gz	GIPDBMSVHPKOEJ-UONOGXRCSA-N	0	3	306.406	2.015	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000123257407	402118153	/nfs/dbraw/zinc/11/81/53/402118153.db2.gz	JLJPNLOBWWPCSJ-SMDDNHRTSA-N	0	3	321.396	2.339	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCCN(C)c1ccccc1	ZINC000097413454	402124560	/nfs/dbraw/zinc/12/45/60/402124560.db2.gz	OUVRRXDVYHIBEP-INIZCTEOSA-N	0	3	320.481	2.398	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)CCOc1cccc(C=O)c1	ZINC000068279513	402190635	/nfs/dbraw/zinc/19/06/35/402190635.db2.gz	WCYJIIFDQZKJKO-OAHLLOKOSA-N	0	3	318.417	2.259	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCCNc2ccccc2)C1	ZINC000067631995	402165942	/nfs/dbraw/zinc/16/59/42/402165942.db2.gz	VUAIZFAMTMFWHO-INIZCTEOSA-N	0	3	304.438	2.272	10	0		DEAEHN
Cc1ccc(CNC(=O)[C@@H]2CCCN2C2CCOCC2)cc1F	ZINC000153744098	402167381	/nfs/dbraw/zinc/16/73/81/402167381.db2.gz	BYQZURSHNLREII-KRWDZBQOSA-N	0	3	320.408	2.394	10	0		DEAEHN
CC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1	ZINC000124273463	402172125	/nfs/dbraw/zinc/17/21/25/402172125.db2.gz	GAMRRTRACOJABQ-MLGOLLRUSA-N	0	3	303.406	2.200	10	0		DEAEHN
CN(C)Cc1cccc(CNC(=O)N(C)C[C@H]2CCCO2)c1	ZINC000102903629	402174241	/nfs/dbraw/zinc/17/42/41/402174241.db2.gz	JILAIDFAEAFKCA-MRXNPFEDSA-N	0	3	305.422	2.069	10	0		DEAEHN
CC(C)NC(=O)CCN1CCC[C@H]1c1ccc2c(c1)OCO2	ZINC000102929114	402174792	/nfs/dbraw/zinc/17/47/92/402174792.db2.gz	XETUIIAILIPKOF-AWEZNQCLSA-N	0	3	304.390	2.467	10	0		DEAEHN
CC(C)N(C)CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2	ZINC000102915308	402175221	/nfs/dbraw/zinc/17/52/21/402175221.db2.gz	AUROPWODEXDBAA-CQSZACIVSA-N	0	3	304.390	2.419	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN(CC(=O)NCC3CCC3)C2)n1	ZINC000108858402	402263319	/nfs/dbraw/zinc/26/33/19/402263319.db2.gz	OAIYFADRJDIXQW-MRXNPFEDSA-N	0	3	316.449	2.040	10	0		DEAEHN
CN(C)C[C@@H]1CCCCN1C(=O)c1ccc(-c2ncon2)cc1	ZINC000107248349	402228501	/nfs/dbraw/zinc/22/85/01/402228501.db2.gz	DPTGAVCMYIADAQ-HNNXBMFYSA-N	0	3	314.389	2.293	10	0		DEAEHN
C[C@]1(CNC(=O)N[C@@H]2CCOC2)CCCN1Cc1ccccc1	ZINC000344996474	404490569	/nfs/dbraw/zinc/49/05/69/404490569.db2.gz	CIEZBZLJQBEWNR-SJLPKXTDSA-N	0	3	317.433	2.129	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccncc1Br	ZINC000154813766	402233750	/nfs/dbraw/zinc/23/37/50/402233750.db2.gz	UIUDJGLLJKKMGX-WDEREUQCSA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCO[C@@H](c2ccsc2)C1)N(C)C1CC1	ZINC000124968427	402206243	/nfs/dbraw/zinc/20/62/43/402206243.db2.gz	HNDRSOXAQKMQIB-SWLSCSKDSA-N	0	3	323.462	2.314	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@@H](C)Oc2cccc(C(C)=O)c2)C1	ZINC000068845494	402207397	/nfs/dbraw/zinc/20/73/97/402207397.db2.gz	ZJLVVOPPFXCEHV-GDBMZVCRSA-N	0	3	318.417	2.257	10	0		DEAEHN
CCc1ccc(C(C)(C)C(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000176608448	402323135	/nfs/dbraw/zinc/32/31/35/402323135.db2.gz	QTWCMMIYOAPNTB-QGZVFWFLSA-N	0	3	318.461	2.316	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)C1	ZINC000176289199	402297249	/nfs/dbraw/zinc/29/72/49/402297249.db2.gz	CNRMMWPSNZNWAQ-INIZCTEOSA-N	0	3	311.385	2.022	10	0		DEAEHN
CCN1CC[C@H](NC(=O)[C@@H](C)N)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000158199937	402303256	/nfs/dbraw/zinc/30/32/56/402303256.db2.gz	SZUYHMYZKJBIJM-IIMNLJJBSA-N	0	3	313.804	2.078	10	0		DEAEHN
Cc1oc2ccccc2c1C(=O)N1CCN(CCN(C)C)CC1	ZINC000184945036	402311293	/nfs/dbraw/zinc/31/12/93/402311293.db2.gz	OEEQGEPRNODOQZ-UHFFFAOYSA-N	0	3	315.417	2.061	10	0		DEAEHN
Cc1nc([C@@H](N[C@H](C)CCn2cccn2)c2ccccc2)n[nH]1	ZINC000158809635	402312752	/nfs/dbraw/zinc/31/27/52/402312752.db2.gz	YDUVCUQLUWUEJV-CJNGLKHVSA-N	0	3	310.405	2.467	10	0		DEAEHN
C[C@H](CCn1cccn1)N[C@H]1CCCN(c2ccccc2)C1=O	ZINC000158845554	402313360	/nfs/dbraw/zinc/31/33/60/402313360.db2.gz	KIBGTIHIMPESIE-WBVHZDCISA-N	0	3	312.417	2.447	10	0		DEAEHN
CCO[C@H](CCNC(=O)N1CC[C@@H](N(C)C)C1)C1CCCC1	ZINC000176504736	402315832	/nfs/dbraw/zinc/31/58/32/402315832.db2.gz	ORCFXENCBDKSLS-HZPDHXFCSA-N	0	3	311.470	2.317	10	0		DEAEHN
CCOC[C@H]1CCCN(Cc2cc(-c3cnn(C)c3)no2)C1	ZINC000185005030	402316467	/nfs/dbraw/zinc/31/64/67/402316467.db2.gz	GJQHDRAGOGKRBJ-ZDUSSCGKSA-N	0	3	304.394	2.324	10	0		DEAEHN
COC1(CNC(=O)N2CCCN(C3CC3)CC2)CCCCC1	ZINC000185896437	402386862	/nfs/dbraw/zinc/38/68/62/402386862.db2.gz	ZISBGSZJVQYJOZ-UHFFFAOYSA-N	0	3	309.454	2.215	10	0		DEAEHN
COC[C@H](C)OC[C@@H](O)CN[C@H](C)c1cccc(Cl)c1	ZINC000234756117	402360685	/nfs/dbraw/zinc/36/06/85/402360685.db2.gz	YMGLCSLLSWCIRV-ZOWXZIJZSA-N	0	3	301.814	2.403	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cccc(-n2cccn2)c1	ZINC000177032767	402361265	/nfs/dbraw/zinc/36/12/65/402361265.db2.gz	XRFWQPAOMKQDGV-QGZVFWFLSA-N	0	3	312.417	2.429	10	0		DEAEHN
Cc1oc2ccccc2c1C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000185592146	402363343	/nfs/dbraw/zinc/36/33/43/402363343.db2.gz	SYOZUJQBEBUOGX-CYBMUJFWSA-N	0	3	302.374	2.144	10	0		DEAEHN
CNC(=O)[C@H](C)CN(C)Cc1ccc(SC(=O)N(C)C)cc1	ZINC000177084600	402367994	/nfs/dbraw/zinc/36/79/94/402367994.db2.gz	BGTROBWYUMKQDC-GFCCVEGCSA-N	0	3	323.462	2.274	10	0		DEAEHN
c1[nH]nc(-c2ccc3c(c2)OCCO3)c1CN[C@@H]1CCCOC1	ZINC000236715186	402377057	/nfs/dbraw/zinc/37/70/57/402377057.db2.gz	QUFASPLNLZALMZ-CQSZACIVSA-N	0	3	315.373	2.117	10	0		DEAEHN
c1[nH]nc(-c2ccc3c(c2)OCCO3)c1CN[C@H]1CCCOC1	ZINC000236714465	402377298	/nfs/dbraw/zinc/37/72/98/402377298.db2.gz	QUFASPLNLZALMZ-AWEZNQCLSA-N	0	3	315.373	2.117	10	0		DEAEHN
CCCNC(=O)[C@@H](C)N[C@H](C)c1ccccc1-n1cccn1	ZINC000177185625	402379552	/nfs/dbraw/zinc/37/95/52/402379552.db2.gz	MVCZPPDYYAXJKZ-ZIAGYGMSSA-N	0	3	300.406	2.438	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCOc1cccc(F)c1	ZINC000177362974	402394799	/nfs/dbraw/zinc/39/47/99/402394799.db2.gz	HRKLLNCTFPYQFK-HNNXBMFYSA-N	0	3	323.412	2.330	10	0		DEAEHN
COc1cc(N2CCN(c3ccnc4ccccc43)CC2)ncn1	ZINC000185992077	402395553	/nfs/dbraw/zinc/39/55/53/402395553.db2.gz	MLQVRAPGERPDCR-UHFFFAOYSA-N	0	3	321.384	2.360	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccc(-n2ccnc2)c(F)c1)N(C)C	ZINC000161774024	402398362	/nfs/dbraw/zinc/39/83/62/402398362.db2.gz	UQUKTGCIJMHBQK-INIZCTEOSA-N	0	3	318.396	2.358	10	0		DEAEHN
COCCN1CCC(NC(=O)[C@H]2C[C@@H]2C2CCCCC2)CC1	ZINC000161793422	402399710	/nfs/dbraw/zinc/39/97/10/402399710.db2.gz	TZKSBYNOXYSWHV-SJORKVTESA-N	0	3	308.466	2.430	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H]1COc2ccccc21	ZINC000177449200	402403448	/nfs/dbraw/zinc/40/34/48/402403448.db2.gz	UWMJKCOMSHVYDL-UKRRQHHQSA-N	0	3	303.406	2.246	10	0		DEAEHN
Cc1ccc(CNC(=O)[C@]2(F)CCNC2)c(OC(C)(C)C)c1	ZINC000161912344	402403556	/nfs/dbraw/zinc/40/35/56/402403556.db2.gz	GNLKUWJTZHOCJQ-KRWDZBQOSA-N	0	3	308.397	2.490	10	0		DEAEHN
CCC[C@@H](C(=O)NCCc1ccc(NC(C)=O)cc1)N(C)C	ZINC000162008459	402406738	/nfs/dbraw/zinc/40/67/38/402406738.db2.gz	XRWDDFUPFGCIII-INIZCTEOSA-N	0	3	305.422	2.034	10	0		DEAEHN
C[C@H]1CN(C2CCN(Cc3cc(O)cc(F)c3)CC2)CCO1	ZINC000186191967	402409057	/nfs/dbraw/zinc/40/90/57/402409057.db2.gz	DLBMVYTUMREQTF-ZDUSSCGKSA-N	0	3	308.397	2.216	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)NCc1cccs1	ZINC000177695998	402427242	/nfs/dbraw/zinc/42/72/42/402427242.db2.gz	PKUKICRGUIFFKW-KBPBESRZSA-N	0	3	309.479	2.169	10	0		DEAEHN
CCO[C@H]1C[C@@H](NCc2cccc(N(C)C)n2)C12CCOCC2	ZINC000186433422	402430678	/nfs/dbraw/zinc/43/06/78/402430678.db2.gz	JNRQUBGFSDYKGQ-CVEARBPZSA-N	0	3	319.449	2.211	10	0		DEAEHN
COC(=O)c1cccc(OCCN2CCN3CCCC[C@@H]3C2)c1	ZINC000177775841	402435427	/nfs/dbraw/zinc/43/54/27/402435427.db2.gz	DCRFFWRHMRBJNK-MRXNPFEDSA-N	0	3	318.417	2.022	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2CC(=O)Nc1cc(F)cc(F)c1	ZINC000177323630	402391524	/nfs/dbraw/zinc/39/15/24/402391524.db2.gz	YQPKJLYYDYYXKC-CVEARBPZSA-N	0	3	323.387	2.462	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)NCCN1CCCCC1	ZINC000186724432	402459526	/nfs/dbraw/zinc/45/95/26/402459526.db2.gz	HUOLMEPVMOLXHB-UHFFFAOYSA-N	0	3	309.385	2.119	10	0		DEAEHN
C[C@@H](c1ccccc1)[C@](C)(O)C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000245427371	402459626	/nfs/dbraw/zinc/45/96/26/402459626.db2.gz	VZTMZTUKOFYDFL-GFIVTLFCSA-N	0	3	316.445	2.236	10	0		DEAEHN
C[C@H](c1ccccc1)[C@@](C)(O)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000245428248	402459866	/nfs/dbraw/zinc/45/98/66/402459866.db2.gz	WYKKYLTWMLBLQB-FXRXJOCMSA-N	0	3	318.461	2.482	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN([C@H](C)C(=O)N(C)C(C)C)C2)n1	ZINC000245473238	402464899	/nfs/dbraw/zinc/46/48/99/402464899.db2.gz	PUXDFTZAGUYNFQ-HZPDHXFCSA-N	0	3	318.465	2.379	10	0		DEAEHN
Cc1cc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)n(C)n1	ZINC000245624375	402475128	/nfs/dbraw/zinc/47/51/28/402475128.db2.gz	GBCLOIWTHJKUTN-HOCLYGCPSA-N	0	3	313.405	2.295	10	0		DEAEHN
Cc1c(C(=O)N2C[C@H]3CCCN3C[C@H]2C)cnn1CC(C)C	ZINC000245746043	402484950	/nfs/dbraw/zinc/48/49/50/402484950.db2.gz	MUQABUXFFRSHRI-UKRRQHHQSA-N	0	3	304.438	2.156	10	0		DEAEHN
O=C1CC[C@@H]2CN(C[C@@H](O)c3ccccc3)CC[C@@H]2N1C1CC1	ZINC000245936746	402498916	/nfs/dbraw/zinc/49/89/16/402498916.db2.gz	ZPXURCSZXNUNGZ-BPQIPLTHSA-N	0	3	314.429	2.195	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NC[C@H](C)N2CCC(C)CC2)CC[C@H]1C	ZINC000187621695	402506738	/nfs/dbraw/zinc/50/67/38/402506738.db2.gz	ZUXHJLAULCCRDL-OWCLPIDISA-N	0	3	311.470	2.173	10	0		DEAEHN
C[C@H]1CC[C@@](CO)(N(C)CC(=O)NCCC2=CCCCC2)C1	ZINC000187968022	402514319	/nfs/dbraw/zinc/51/43/19/402514319.db2.gz	UXQKZTYOLMOLQO-MAUKXSAKSA-N	0	3	308.466	2.476	10	0		DEAEHN
C(CN1CCO[C@@H]2CCCC[C@@H]21)N1CCO[C@H]2CCCC[C@H]21	ZINC000246714968	402541965	/nfs/dbraw/zinc/54/19/65/402541965.db2.gz	MCWCTGOGKOQFQX-FZDBZEDMSA-N	0	3	308.466	2.273	10	0		DEAEHN
CC[C@H]1CN(Cc2cn3c(cccc3C)n2)CCN1CCOC	ZINC000170940369	402543666	/nfs/dbraw/zinc/54/36/66/402543666.db2.gz	MBVKWOOODPQEJT-KRWDZBQOSA-N	0	3	316.449	2.185	10	0		DEAEHN
O=C(CN1CCC[C@@H]2CCC[C@@H]21)N1CCO[C@H]2CCCC[C@@H]21	ZINC000247700733	402574829	/nfs/dbraw/zinc/57/48/29/402574829.db2.gz	XUXCOLHXGUTGAN-QAETUUGQSA-N	0	3	306.450	2.421	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1Cc1nc(-c2ccsc2)no1	ZINC000247162420	402558903	/nfs/dbraw/zinc/55/89/03/402558903.db2.gz	KKMVXHOHWPVFNG-YPMHNXCESA-N	0	3	304.419	2.467	10	0		DEAEHN
CCc1cccc(S(=O)(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c1	ZINC000247340118	402564815	/nfs/dbraw/zinc/56/48/15/402564815.db2.gz	HNYOXOLNUBYNCH-NVXWUHKLSA-N	0	3	322.474	2.354	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(Br)c[nH]1	ZINC000247469586	402568369	/nfs/dbraw/zinc/56/83/69/402568369.db2.gz	RNMMSMJOTSEJAI-KOLCDFICSA-N	0	3	312.211	2.086	10	0		DEAEHN
O=C1NCC[C@@H]1NCC1(c2ccc3c(c2)OCO3)CCCCC1	ZINC000179065018	402569843	/nfs/dbraw/zinc/56/98/43/402569843.db2.gz	YSNWOMCHOVRMCL-AWEZNQCLSA-N	0	3	316.401	2.095	10	0		DEAEHN
C[C@@H]1CN(C(=O)CN(C[C@H]2CCCO2)C2CCCC2)C[C@H](C)O1	ZINC000247523047	402571069	/nfs/dbraw/zinc/57/10/69/402571069.db2.gz	NOJDMJIVNVAAQT-HLLBOEOZSA-N	0	3	324.465	2.046	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)ccc1C	ZINC000247559202	402572263	/nfs/dbraw/zinc/57/22/63/402572263.db2.gz	ZXAZEECMVZKPLR-CJNGLKHVSA-N	0	3	315.417	2.262	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCCc2cccnc2)[C@@H]1c1ccccc1	ZINC000179098677	402572762	/nfs/dbraw/zinc/57/27/62/402572762.db2.gz	QJDNTCJRCIPASE-MSOLQXFVSA-N	0	3	324.428	2.369	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cccc(F)c1	ZINC000246194972	402517586	/nfs/dbraw/zinc/51/75/86/402517586.db2.gz	OIAVGKOOHYHIFW-KBPBESRZSA-N	0	3	312.410	2.073	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](N[C@@H](C(=O)N(C)C)c2ccccc2)C1	ZINC000246264534	402522180	/nfs/dbraw/zinc/52/21/80/402522180.db2.gz	RJFAEWQZLQIZMM-HYVNUMGLSA-N	0	3	303.450	2.134	10	0		DEAEHN
CC(C)C[C@@H](C)S(=O)(=O)N1CCC[C@H]1CN1CCCC1	ZINC000246324140	402524983	/nfs/dbraw/zinc/52/49/83/402524983.db2.gz	FXLNARXQJUMJAH-CABCVRRESA-N	0	3	302.484	2.311	10	0		DEAEHN
CCOC[C@H](O)CN[C@@H](C)c1cnn(-c2ccc(F)cc2)c1C	ZINC000178710105	402529203	/nfs/dbraw/zinc/52/92/03/402529203.db2.gz	ILDWKTFKSMHFAI-BLLLJJGKSA-N	0	3	321.396	2.368	10	0		DEAEHN
Cc1cc(C)c(CCNC(=O)N2CC[C@H](N(C)C)C2)c(C)c1	ZINC000170831874	402530912	/nfs/dbraw/zinc/53/09/12/402530912.db2.gz	PTNJVLIZKSSKLN-INIZCTEOSA-N	0	3	303.450	2.500	10	0		DEAEHN
CC(C)c1nc(CCNC(=O)N2CC[C@H](N(C)C)C2)cs1	ZINC000170836594	402531370	/nfs/dbraw/zinc/53/13/70/402531370.db2.gz	QZTWQYWRGAFEIW-ZDUSSCGKSA-N	0	3	310.467	2.155	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Cn2ccc3ccc(Cl)cc32)C1	ZINC000170855743	402533101	/nfs/dbraw/zinc/53/31/01/402533101.db2.gz	MOOQHRXEERNPSI-AWEZNQCLSA-N	0	3	305.809	2.457	10	0		DEAEHN
CCN1CCN(C[C@H](C)CNC(=O)N2C[C@@H](C)CC[C@H]2C)CC1	ZINC000246485496	402533279	/nfs/dbraw/zinc/53/32/79/402533279.db2.gz	VYQSFPDJMRIYJR-GVDBMIGSSA-N	0	3	324.513	2.090	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000170857421	402533600	/nfs/dbraw/zinc/53/36/00/402533600.db2.gz	CTEIOAKOZCYGLF-ZDUSSCGKSA-N	0	3	300.324	2.410	10	0		DEAEHN
COc1ccc2c(CC(=O)N3CC[C@@H](N(C)C)C3)coc2c1	ZINC000170861483	402534216	/nfs/dbraw/zinc/53/42/16/402534216.db2.gz	RHHYEEKUIIYBDS-CYBMUJFWSA-N	0	3	302.374	2.146	10	0		DEAEHN
CCOc1ccc2cc(C(=O)N3CC[C@@H](N(C)C)C3)[nH]c2c1	ZINC000170865157	402534816	/nfs/dbraw/zinc/53/48/16/402534816.db2.gz	AYGLMDKYENVJRB-CYBMUJFWSA-N	0	3	301.390	2.343	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1csc(C(F)(F)F)n1	ZINC000189382639	402535399	/nfs/dbraw/zinc/53/53/99/402535399.db2.gz	NPAXTZPTXVADBU-RKDXNWHRSA-N	0	3	319.352	2.471	10	0		DEAEHN
CN(CC1CCN(C)CC1)C(=O)N[C@@H]1COc2ccccc21	ZINC000170880657	402536892	/nfs/dbraw/zinc/53/68/92/402536892.db2.gz	PPIZWTDNDBBNQY-OAHLLOKOSA-N	0	3	303.406	2.103	10	0		DEAEHN
CN1CC[C@H](NC(=O)CC[C@H]2CCOC2)[C@@H]1c1ccccc1	ZINC000247974359	402579410	/nfs/dbraw/zinc/57/94/10/402579410.db2.gz	GDVJKJBAPXNWAN-ZVZYQTTQSA-N	0	3	302.418	2.365	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2cc(COC(C)(C)C)on2)C1	ZINC000248644982	402601108	/nfs/dbraw/zinc/60/11/08/402601108.db2.gz	QTEIYYLRSWIEBR-SWLSCSKDSA-N	0	3	323.437	2.448	10	0		DEAEHN
CCOC(=O)[C@@H](CC)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000248657355	402602210	/nfs/dbraw/zinc/60/22/10/402602210.db2.gz	SITDGDGMLQEAAH-DLBZAZTESA-N	0	3	319.449	2.177	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@H]1CCN(Cc2nccn2C)C1	ZINC000190470109	402603536	/nfs/dbraw/zinc/60/35/36/402603536.db2.gz	ZXZGGRFGPPQNAU-CQSZACIVSA-N	0	3	319.478	2.139	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccoc1Br	ZINC000248765420	402607935	/nfs/dbraw/zinc/60/79/35/402607935.db2.gz	KRBRPFHDVPZLDG-ZJUUUORDSA-N	0	3	313.195	2.351	10	0		DEAEHN
Cc1cccc(C)c1OC[C@@H](O)CN1[C@H](C)C[C@@H](O)C[C@@H]1C	ZINC000248823203	402610092	/nfs/dbraw/zinc/61/00/92/402610092.db2.gz	JMXOSSFRTCNOQU-YVSFHVDLSA-N	0	3	307.434	2.277	10	0		DEAEHN
C[C@@H]1C[C@@H](O)C[C@H](C)N1C[C@@H](O)COc1ccccc1Cl	ZINC000248840462	402610648	/nfs/dbraw/zinc/61/06/48/402610648.db2.gz	PGOWTFVMUSSSET-XJFOESAGSA-N	0	3	313.825	2.313	10	0		DEAEHN
O=C(CCN1CCC[C@@H](n2cncn2)C1)Nc1cccc(F)c1	ZINC000171701885	402612274	/nfs/dbraw/zinc/61/22/74/402612274.db2.gz	LYWIFMQZPLAYFF-OAHLLOKOSA-N	0	3	317.368	2.083	10	0		DEAEHN
CCC[C@@H](CC)NC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000180437178	402616612	/nfs/dbraw/zinc/61/66/12/402616612.db2.gz	QDQSZLWAFPCUDZ-IAGOWNOFSA-N	0	3	324.513	2.377	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)NCC2CC2)C1	ZINC000190689385	402618285	/nfs/dbraw/zinc/61/82/85/402618285.db2.gz	KVHXIYALHYFYBI-CQSZACIVSA-N	0	3	322.478	2.325	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1noc2c1CCCCC2	ZINC000249091245	402620277	/nfs/dbraw/zinc/62/02/77/402620277.db2.gz	VVFQXYLHSIDHBF-OLZOCXBDSA-N	0	3	303.406	2.252	10	0		DEAEHN
O=C(Nc1ccc2oc(=O)ccc2c1)N1CCN2CCC[C@H]2C1	ZINC000171806840	402624031	/nfs/dbraw/zinc/62/40/31/402624031.db2.gz	MASYKSZVFPFYRQ-AWEZNQCLSA-N	0	3	313.357	2.105	10	0		DEAEHN
O=C(N[C@@H]1CCc2cc(F)ccc21)N1CCN2CCC[C@@H]2C1	ZINC000171904234	402632644	/nfs/dbraw/zinc/63/26/44/402632644.db2.gz	FPNLBTLPWYMIEN-GDBMZVCRSA-N	0	3	303.381	2.303	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000249751783	402640776	/nfs/dbraw/zinc/64/07/76/402640776.db2.gz	DKAIBFDLCLFOPX-NEPJUHHUSA-N	0	3	307.360	2.455	10	0		DEAEHN
CC[C@@H](CNC(=O)N1CCO[C@H](CN(C)C)C1)c1ccccc1	ZINC000172116832	402640894	/nfs/dbraw/zinc/64/08/94/402640894.db2.gz	QHMAVLMIYYZMDA-DOTOQJQBSA-N	0	3	319.449	2.152	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)NCc1cscn1	ZINC000181329296	402641764	/nfs/dbraw/zinc/64/17/64/402641764.db2.gz	ZTEOBJDEHFMGQA-ZDUSSCGKSA-N	0	3	318.446	2.463	10	0		DEAEHN
COC(=O)c1cccc(OCCN2[C@H](C)CC(O)C[C@H]2C)c1	ZINC000191160683	402647151	/nfs/dbraw/zinc/64/71/51/402647151.db2.gz	CINZZVXKHOLYQV-CHWSQXEVSA-N	0	3	307.390	2.086	10	0		DEAEHN
CC(C)[C@H](C)CNC(=O)N1CCN(CC2CCOCC2)CC1	ZINC000172507801	402659805	/nfs/dbraw/zinc/65/98/05/402659805.db2.gz	IPYVKNZPNUXRJD-OAHLLOKOSA-N	0	3	311.470	2.032	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CCC([C@H]3CCCO3)CC2)C1	ZINC000251898664	402650894	/nfs/dbraw/zinc/65/08/94/402650894.db2.gz	QVBLMDFOVQTCAW-HYVNUMGLSA-N	0	3	323.481	2.316	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)[C@H](C)N1CCCN(C2CC2)CC1	ZINC000172347892	402651706	/nfs/dbraw/zinc/65/17/06/402651706.db2.gz	ZBQDDMMCSBMMRK-JKSUJKDBSA-N	0	3	307.482	2.336	10	0		DEAEHN
C[C@H]1CN2CCCC[C@H]2CN1c1ncc(Br)cn1	ZINC000252662404	402660217	/nfs/dbraw/zinc/66/02/17/402660217.db2.gz	YPNJLVNWJJUXOG-JQWIXIFHSA-N	0	3	311.227	2.302	10	0		DEAEHN
CC[C@H]1CN(Cc2ccccc2N(C)C)CCN1C[C@@H](C)O	ZINC000173677405	402708543	/nfs/dbraw/zinc/70/85/43/402708543.db2.gz	LHGNNMACVCARJM-WBVHZDCISA-N	0	3	305.466	2.030	10	0		DEAEHN
Cc1ncsc1CN1C[C@@H](F)C[C@H]1CN(C)[C@H]1CCOC1	ZINC000253416908	402664846	/nfs/dbraw/zinc/66/48/46/402664846.db2.gz	OJJAVWHXEYLDHK-IHRRRGAJSA-N	0	3	313.442	2.085	10	0		DEAEHN
C[C@H]1C[C@H](NCC2(C)OCCCO2)CN1Cc1ccccc1	ZINC000192248586	402719023	/nfs/dbraw/zinc/71/90/23/402719023.db2.gz	WHJMHXQRLZMGNJ-RDJZCZTQSA-N	0	3	304.434	2.392	10	0		DEAEHN
CC[C@H](O)CN1CCN(c2ccc3cc(OC)ccc3n2)CC1	ZINC000172761553	402674169	/nfs/dbraw/zinc/67/41/69/402674169.db2.gz	XCHVNTHNIXSGJX-HNNXBMFYSA-N	0	3	315.417	2.136	10	0		DEAEHN
Fc1ccccc1SCCN1CC[C@@H](N2CCOCC2)C1	ZINC000173934303	402719835	/nfs/dbraw/zinc/71/98/35/402719835.db2.gz	BKBXIHUBNFOQPY-CQSZACIVSA-N	0	3	310.438	2.324	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1C(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000182430591	402689241	/nfs/dbraw/zinc/68/92/41/402689241.db2.gz	AWUQPXFBLTYZLQ-JSGCOSHPSA-N	0	3	304.438	2.255	10	0		DEAEHN
CC[C@@H](O)CN1CCN(C/C=C\c2ccccc2OC)CC1	ZINC000255512986	402689886	/nfs/dbraw/zinc/68/98/86/402689886.db2.gz	FJOKTHNIZFOPJW-BQLWYNFJSA-N	0	3	304.434	2.097	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCCC[C@@H]1c1cn[nH]c1	ZINC000183069263	402736493	/nfs/dbraw/zinc/73/64/93/402736493.db2.gz	OVMZPZMHYYVUNH-HUUCEWRRSA-N	0	3	305.426	2.131	10	0		DEAEHN
CCCNc1ccc(CNC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000192580477	402738333	/nfs/dbraw/zinc/73/83/33/402738333.db2.gz	MKDUFHUIRKVNIN-MRXNPFEDSA-N	0	3	304.438	2.354	10	0		DEAEHN
Cn1c2ccc(CNCCC(=O)OC(C)(C)C)cc2sc1=O	ZINC000192593340	402739208	/nfs/dbraw/zinc/73/92/08/402739208.db2.gz	KFIDBEKZAKQVCA-UHFFFAOYSA-N	0	3	322.430	2.421	10	0		DEAEHN
C[C@H](NCC(=O)NCc1ccc(Cl)s1)[C@@H]1CCCO1	ZINC000183138285	402742225	/nfs/dbraw/zinc/74/22/25/402742225.db2.gz	RCXUDTLHKWNLCE-ONGXEEELSA-N	0	3	302.827	2.175	10	0		DEAEHN
CCN(C)C(=O)CCN[C@@H](C)c1ccccc1-n1cccn1	ZINC000183158712	402743993	/nfs/dbraw/zinc/74/39/93/402743993.db2.gz	VTXZALUYFHUPMJ-AWEZNQCLSA-N	0	3	300.406	2.391	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2C[C@@H]2c2cccc(F)c2F)n1	ZINC000263251785	402750811	/nfs/dbraw/zinc/75/08/11/402750811.db2.gz	PZJIHOBXWBZNLR-NTZNESFSSA-N	0	3	320.343	2.195	10	0		DEAEHN
Cc1cccc(O[C@@H](C)c2nc([C@@H]3CNCCN3C)no2)c1	ZINC000263263010	402751466	/nfs/dbraw/zinc/75/14/66/402751466.db2.gz	RECJTIYTFDRTFW-JSGCOSHPSA-N	0	3	302.378	2.094	10	0		DEAEHN
Cc1cccc(CSCc2nc([C@H]3CNCCN3C)no2)c1	ZINC000263299897	402755856	/nfs/dbraw/zinc/75/58/56/402755856.db2.gz	WXROHBBERUIUCC-CQSZACIVSA-N	0	3	318.446	2.388	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(CSc2ccc(F)cc2)n1	ZINC000263307525	402757105	/nfs/dbraw/zinc/75/71/05/402757105.db2.gz	YDGBTMVQGUKWRR-LBPRGKRZSA-N	0	3	308.382	2.077	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2scnc2C(C)(C)C)n1	ZINC000263314852	402757818	/nfs/dbraw/zinc/75/78/18/402757818.db2.gz	ZIKHJTWYTORYGS-VIFPVBQESA-N	0	3	307.423	2.067	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2C[C@H]2c2c(F)cccc2F)n1	ZINC000263314709	402758036	/nfs/dbraw/zinc/75/80/36/402758036.db2.gz	ZIAFMXAONAANBI-GBIKHYSHSA-N	0	3	320.343	2.195	10	0		DEAEHN
Cc1c(F)cccc1NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000175027282	402772647	/nfs/dbraw/zinc/77/26/47/402772647.db2.gz	PHCOYMKTWRKOEI-ZDUSSCGKSA-N	0	3	309.385	2.102	10	0		DEAEHN
CCCCO[C@@H]1C[C@H](NC(=O)N2CC[C@H](N(C)C)C2)C1(C)C	ZINC000175910813	402842259	/nfs/dbraw/zinc/84/22/59/402842259.db2.gz	AQQDGKZZDPUTRK-SOUVJXGZSA-N	0	3	311.470	2.316	10	0		DEAEHN
COC[C@@H](NC(=O)N[C@H](CC(C)C)CN(C)C)c1ccco1	ZINC000175315306	402796554	/nfs/dbraw/zinc/79/65/54/402796554.db2.gz	RHPHKZBFIXFMOA-ZIAGYGMSSA-N	0	3	311.426	2.243	10	0		DEAEHN
O=C(c1cc(-c2cccs2)n[nH]1)N1CCN2CCC[C@H]2C1	ZINC000195333039	402842394	/nfs/dbraw/zinc/84/23/94/402842394.db2.gz	LKAYGLDWPUZCQF-NSHDSACASA-N	0	3	302.403	2.058	10	0		DEAEHN
CCCCOCCNC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000194506681	402801034	/nfs/dbraw/zinc/80/10/34/402801034.db2.gz	NDTFPZFJIYVUQG-INIZCTEOSA-N	0	3	307.438	2.405	10	0		DEAEHN
CCOc1ccc(CCC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000195337474	402842557	/nfs/dbraw/zinc/84/25/57/402842557.db2.gz	ZJFPBOUJRQWZSD-INIZCTEOSA-N	0	3	302.418	2.325	10	0		DEAEHN
O=C(NCc1ccc(Cl)nc1)N1CCCN(C2CC2)CC1	ZINC000194668813	402809228	/nfs/dbraw/zinc/80/92/28/402809228.db2.gz	KAQGCWAHNFDUQH-UHFFFAOYSA-N	0	3	308.813	2.115	10	0		DEAEHN
COc1nc(C(=O)N2CCN3CCC[C@H]3C2)cc2ccccc21	ZINC000195338529	402843033	/nfs/dbraw/zinc/84/30/33/402843033.db2.gz	FTHBRRBFGHVVBZ-AWEZNQCLSA-N	0	3	311.385	2.164	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cnn(-c2ccc(Cl)cc2)c1	ZINC000194696322	402810972	/nfs/dbraw/zinc/81/09/72/402810972.db2.gz	PONTVFIFHOYXIH-HNNXBMFYSA-N	0	3	318.808	2.350	10	0		DEAEHN
Cc1ccc([C@H]2CN(C(=O)C3CCN(C4CC4)CC3)CCO2)o1	ZINC000194806694	402816422	/nfs/dbraw/zinc/81/64/22/402816422.db2.gz	RSCIINAZFSEHHI-QGZVFWFLSA-N	0	3	318.417	2.362	10	0		DEAEHN
COc1ccnc(NC2CCN(C[C@H]3CCC=CO3)CC2)n1	ZINC000194841332	402818094	/nfs/dbraw/zinc/81/80/94/402818094.db2.gz	RBQFPRFNIPRIJT-CQSZACIVSA-N	0	3	304.394	2.054	10	0		DEAEHN
C[C@@H](O)C[C@@H]1CCCN1Cc1ccc2c(c1)sc(=O)n2C	ZINC000195024968	402827428	/nfs/dbraw/zinc/82/74/28/402827428.db2.gz	IQUUBMDWZPDYML-YPMHNXCESA-N	0	3	306.431	2.335	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)Nc1ccc([S@](C)=O)cc1	ZINC000175787718	402832858	/nfs/dbraw/zinc/83/28/58/402832858.db2.gz	PJLAWZLDQUJMTB-XMHCIUCPSA-N	0	3	323.462	2.420	10	0		DEAEHN
O=C(N[C@@H]1C[C@H]1c1ccc(F)cc1)N1CC[C@@H](N2CC=CC2)C1	ZINC000195246109	402839135	/nfs/dbraw/zinc/83/91/35/402839135.db2.gz	CGAVVRHWQUYHSO-IXDOHACOSA-N	0	3	315.392	2.337	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC(OCC(C)C)CC2)C1	ZINC000194169699	402786950	/nfs/dbraw/zinc/78/69/50/402786950.db2.gz	DMTDDNPSTRSPFN-OAHLLOKOSA-N	0	3	311.470	2.317	10	0		DEAEHN
Cc1ccc(NC(=O)CN2CCN3CCC[C@@H]3C2)cc1Cl	ZINC000175205626	402788255	/nfs/dbraw/zinc/78/82/55/402788255.db2.gz	QRCUQTBXLPNGNH-CQSZACIVSA-N	0	3	307.825	2.367	10	0		DEAEHN
CCNC(=O)CCN[C@H](C)c1ccc(-n2ccnc2C)cc1	ZINC000183686383	402788557	/nfs/dbraw/zinc/78/85/57/402788557.db2.gz	FZJMWUAUOMTHKF-CYBMUJFWSA-N	0	3	300.406	2.358	10	0		DEAEHN
C[C@@H]1CCC[C@H](C(=O)N2CCCC[C@H](N3CCN(C)CC3)C2)C1	ZINC000175981677	402845806	/nfs/dbraw/zinc/84/58/06/402845806.db2.gz	JWWSWOHHAIITGT-SQNIBIBYSA-N	0	3	321.509	2.441	10	0		DEAEHN
CC(C)CCNC(=O)[C@@H](C)N1CC[C@H](CNc2ccccn2)C1	ZINC000195515889	402848837	/nfs/dbraw/zinc/84/88/37/402848837.db2.gz	AAUOTJHZEUEAMH-HZPDHXFCSA-N	0	3	318.465	2.366	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N[C@@H](C)C2=CCN(C)CC2)cc1	ZINC000280285483	402983845	/nfs/dbraw/zinc/98/38/45/402983845.db2.gz	PRUNHVWZJOAJDP-ZDUSSCGKSA-N	0	3	315.417	2.050	10	0		DEAEHN
C[C@@H]1NC(=O)CC[C@H]1NCc1cc(F)cc(Br)c1	ZINC000282389880	403149084	/nfs/dbraw/zinc/14/90/84/403149084.db2.gz	OXAUHYSSTLHMFQ-QPUJVOFHSA-N	0	3	315.186	2.345	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)N[C@H]2CCOC[C@@H]2C)c1C	ZINC000277963945	403275377	/nfs/dbraw/zinc/27/53/77/403275377.db2.gz	SFLXYWJATIITPU-WFBYXXMGSA-N	0	3	306.406	2.420	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CCO1	ZINC000271266510	403283869	/nfs/dbraw/zinc/28/38/69/403283869.db2.gz	NMMIMCIDCPRUIW-MWQQHZPXSA-N	0	3	317.433	2.299	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)C12CCC2	ZINC000246109471	286347727	/nfs/dbraw/zinc/34/77/27/286347727.db2.gz	HREUFLGZELPWDJ-YHUYYLMFSA-N	0	3	323.481	2.458	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N2CC[C@H](N(C)C)C2)C12CCCCC2	ZINC000177621913	286354664	/nfs/dbraw/zinc/35/46/64/286354664.db2.gz	GWONHEWGXRSZRZ-HRCADAONSA-N	0	3	323.481	2.460	10	0		DEAEHN
Fc1cc2c(c(F)c1F)[C@H](N[C@@H]1CCc3nnnn3CC1)CC2	ZINC000333510894	403769688	/nfs/dbraw/zinc/76/96/88/403769688.db2.gz	JCRJMHDZJHNKOJ-MWLCHTKSSA-N	0	3	323.322	2.072	10	0		DEAEHN
COCCN1CCC[C@H]1CNc1ncnc2c(F)cccc12	ZINC000302916615	403743694	/nfs/dbraw/zinc/74/36/94/403743694.db2.gz	WGJOLXWLQMTRCM-LBPRGKRZSA-N	0	3	304.369	2.292	10	0		DEAEHN
CO[C@H]1C[C@@H](CO)N(Cc2cccc(OCC(F)(F)F)c2)C1	ZINC000343977743	403819762	/nfs/dbraw/zinc/81/97/62/403819762.db2.gz	JZVFWLKTDWGQKW-JSGCOSHPSA-N	0	3	319.323	2.209	10	0		DEAEHN
Cn1cc(C[C@@H]2CCN(Cc3ccc(-c4cc[nH]n4)o3)C2)cn1	ZINC000369484986	404112862	/nfs/dbraw/zinc/11/28/62/404112862.db2.gz	OQBLCOFCAUWWID-ZDUSSCGKSA-N	0	3	311.389	2.468	10	0		DEAEHN
O=C(CC/C=C/c1ccccc1)NC[C@@H]1CN2CCC[C@H]2CO1	ZINC000369566283	404144903	/nfs/dbraw/zinc/14/49/03/404144903.db2.gz	DFEIKOZASOMXPN-LHSROVBZSA-N	0	3	314.429	2.459	10	0		DEAEHN
C[C@@H]1CN(C2CCOCC2)CCN1C(=O)NC1CCCCC1	ZINC000369651825	404178303	/nfs/dbraw/zinc/17/83/03/404178303.db2.gz	ALYWZRVZVLCBHX-CQSZACIVSA-N	0	3	309.454	2.214	10	0		DEAEHN
Cc1ccnc(C2CCN(C[C@H]3CC4(CCC4)C(=O)O3)CC2)n1	ZINC000365273872	404595125	/nfs/dbraw/zinc/59/51/25/404595125.db2.gz	KZAJHIMCFZGWNR-OAHLLOKOSA-N	0	3	315.417	2.450	10	0		DEAEHN
O=C(CN1CCCC[C@H](CO)C1)NCc1ccc(Cl)cc1	ZINC000374053791	404681387	/nfs/dbraw/zinc/68/13/87/404681387.db2.gz	ZGGVLWYMCHPTRE-AWEZNQCLSA-N	0	3	310.825	2.051	10	0		DEAEHN
C[C@@H]1[C@H](C)N(C)CCN1C(=O)c1cccc(CN2CCCC2)c1	ZINC000356886080	404717027	/nfs/dbraw/zinc/71/70/27/404717027.db2.gz	SRBCWNQXDMNFPR-JKSUJKDBSA-N	0	3	315.461	2.447	10	0		DEAEHN
CCCCN(C)CCNC(=O)N1CCCC[C@H]1c1ccnn1C	ZINC000359676998	404801655	/nfs/dbraw/zinc/80/16/55/404801655.db2.gz	FQPGSDVWFPNIHI-INIZCTEOSA-N	0	3	321.469	2.389	10	0		DEAEHN
C/C(=C\c1cccc(C(F)(F)F)c1)CN[C@@H]1COC[C@H]1O	ZINC000451229266	404910359	/nfs/dbraw/zinc/91/03/59/404910359.db2.gz	LFMFUDUSEWLOLJ-UXTPFJKYSA-N	0	3	301.308	2.458	10	0		DEAEHN
CN1CCC2(CCCN2C(=O)Cn2ncc3ccccc32)CC1	ZINC000367352131	405020138	/nfs/dbraw/zinc/02/01/38/405020138.db2.gz	XWXNVORPVADNEA-UHFFFAOYSA-N	0	3	312.417	2.123	10	0		DEAEHN
Cc1cc(C(=O)NC2CCN(C[C@H](O)C(C)C)CC2)c(C)o1	ZINC000367382835	405033553	/nfs/dbraw/zinc/03/35/53/405033553.db2.gz	ZSDWBIFZSNUAAX-INIZCTEOSA-N	0	3	308.422	2.108	10	0		DEAEHN
Cn1nccc1CCN1CCC(COc2ccccn2)CC1	ZINC000367252377	404982780	/nfs/dbraw/zinc/98/27/80/404982780.db2.gz	MLSYROZXEJHRQN-UHFFFAOYSA-N	0	3	300.406	2.149	10	0		DEAEHN
C[C@H](C[S@@](C)=O)NCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000361270247	405000970	/nfs/dbraw/zinc/00/09/70/405000970.db2.gz	DKYKNLUIOMORJR-XUSGNXJCSA-N	0	3	311.447	2.499	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)c2ncccc2N)CN1Cc1ccccc1	ZINC000398036985	405060464	/nfs/dbraw/zinc/06/04/64/405060464.db2.gz	JDVQFNVVSRRDKK-ZFWWWQNUSA-N	0	3	310.401	2.057	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N[C@H]1CCc2cn(C(C)C)nc2C1	ZINC000361456534	405082331	/nfs/dbraw/zinc/08/23/31/405082331.db2.gz	IDPQZKAXCQELFX-RDJZCZTQSA-N	0	3	318.465	2.312	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)NCC2C[C@@H](C)O[C@H](C)C2)CN1C1CC1	ZINC000408181476	405132988	/nfs/dbraw/zinc/13/29/88/405132988.db2.gz	CYDPOVDIXSAITC-KYEXWDHISA-N	0	3	309.454	2.114	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)Nc1cccc([S@](C)=O)c1	ZINC000408296957	405165510	/nfs/dbraw/zinc/16/55/10/405165510.db2.gz	FBPHBXOCUJOMBQ-BWFKNJDFSA-N	0	3	321.446	2.124	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)CC[N@@H+]1C	ZINC000408410587	405200612	/nfs/dbraw/zinc/20/06/12/405200612.db2.gz	VCFIFIAMXSZUQM-AAEUAGOBSA-N	0	3	318.417	2.318	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)CC[N@H+]1C	ZINC000408410587	405200618	/nfs/dbraw/zinc/20/06/18/405200618.db2.gz	VCFIFIAMXSZUQM-AAEUAGOBSA-N	0	3	318.417	2.318	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cc3nc[nH]c3cc2F)CCN1C	ZINC000408464600	405212892	/nfs/dbraw/zinc/21/28/92/405212892.db2.gz	FJVKRGHOFAJHNA-MNOVXSKESA-N	0	3	304.369	2.257	10	0		DEAEHN
COC[C@H](C)CNCc1snc(OC)c1Br	ZINC000638445363	405472680	/nfs/dbraw/zinc/47/26/80/405472680.db2.gz	NJAVKWSHZNLKRT-SSDOTTSWSA-N	0	3	309.229	2.286	10	0		DEAEHN
CN(CCCN1CCN(C)CC1)C(=O)NCC1CCCCCC1	ZINC000459034894	405705800	/nfs/dbraw/zinc/70/58/00/405705800.db2.gz	VPDPXPCBXZEDCX-UHFFFAOYSA-N	0	3	324.513	2.236	10	0		DEAEHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)N[C@@H]1CCCC(F)(F)C1	ZINC000495036682	405802970	/nfs/dbraw/zinc/80/29/70/405802970.db2.gz	NVDZSMQUWBZHAY-NQBHXWOUSA-N	0	3	301.381	2.346	10	0		DEAEHN
COc1nsc(CNC[C@@H]2CC[C@@H](O)C2)c1Br	ZINC000639096108	405878611	/nfs/dbraw/zinc/87/86/11/405878611.db2.gz	AOIYTGAAEPEHAB-HTQZYQBOSA-N	0	3	321.240	2.165	10	0		DEAEHN
CC(C)(O)C(=O)N[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000633888085	405890259	/nfs/dbraw/zinc/89/02/59/405890259.db2.gz	KOQNHZIGQTYNQK-MRXNPFEDSA-N	0	3	304.434	2.318	10	0		DEAEHN
CC(C)(C)OC(=O)[C@@]1(C)CCN(C[C@@H](O)CC(F)(F)F)C1	ZINC000459565788	405958256	/nfs/dbraw/zinc/95/82/56/405958256.db2.gz	SJGWGFRKKWIRQW-GWCFXTLKSA-N	0	3	311.344	2.353	10	0		DEAEHN
COc1nsc(CNCCC2CC(O)C2)c1Br	ZINC000639122964	405901934	/nfs/dbraw/zinc/90/19/34/405901934.db2.gz	VJILCQUOPFAEJJ-UHFFFAOYSA-N	0	3	321.240	2.165	10	0		DEAEHN
C[C@@H](NC[C@@H](O)Cn1ccnn1)c1ccccc1C(F)(F)F	ZINC000459710802	406015189	/nfs/dbraw/zinc/01/51/89/406015189.db2.gz	ZPPRNYFULFFNFD-GHMZBOCLSA-N	0	3	314.311	2.009	10	0		DEAEHN
O=C([C@H]1CCCN1C1CC1)N1CCC(C2CCOCC2)CC1	ZINC000562370921	405995517	/nfs/dbraw/zinc/99/55/17/405995517.db2.gz	MZBFADFSDWULAA-QGZVFWFLSA-N	0	3	306.450	2.278	10	0		DEAEHN
CN(Cc1ncc(Br)s1)[C@@H]1CN2CCC1CC2	ZINC000639399904	406083005	/nfs/dbraw/zinc/08/30/05/406083005.db2.gz	VCOMHIIBQWHQGP-SNVBAGLBSA-N	0	3	316.268	2.432	10	0		DEAEHN
CC(=O)CCc1ccc(OC[C@H](O)CNCC(C)(C)F)cc1	ZINC000634723326	406247742	/nfs/dbraw/zinc/24/77/42/406247742.db2.gz	KNCFHWJLVHOWLX-OAHLLOKOSA-N	0	3	311.397	2.286	10	0		DEAEHN
c1ccc2c(c1)CCN2c1cc(N2CCN3CCC2CC3)ncn1	ZINC000487761986	406261451	/nfs/dbraw/zinc/26/14/51/406261451.db2.gz	MVTZQIXIQLGSLQ-UHFFFAOYSA-N	0	3	321.428	2.455	10	0		DEAEHN
CCS(=O)(=O)NCCN[C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000109324668	286687041	/nfs/dbraw/zinc/68/70/41/286687041.db2.gz	MHVIZNIPUGLNRR-CQSZACIVSA-N	0	3	316.854	2.320	10	0		DEAEHN
CC[C@H](Oc1cccc(C)c1)C(=O)NCCNc1ccncc1	ZINC000488580092	406332468	/nfs/dbraw/zinc/33/24/68/406332468.db2.gz	KLLTVAIFZUNLHN-KRWDZBQOSA-N	0	3	313.401	2.198	10	0		DEAEHN
CCc1ccc([C@H](C)NC(=O)CN2CC[C@@H](CO)[C@@H]2C)cc1	ZINC000488806594	406349681	/nfs/dbraw/zinc/34/96/81/406349681.db2.gz	VFEXURUWGSXIAX-ZQIUZPCESA-N	0	3	304.434	2.129	10	0		DEAEHN
C[C@@H](N[C@H]1CCC(=O)N(C)C1)c1cncc(Br)c1	ZINC000569121953	292392147	/nfs/dbraw/zinc/39/21/47/292392147.db2.gz	OLFPHGBGPUSXNG-SKDRFNHKSA-N	0	3	312.211	2.116	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)[C@H]2CNCc3ccccc32)c1	ZINC000570680023	406425937	/nfs/dbraw/zinc/42/59/37/406425937.db2.gz	GWKHQYRAXTZEBH-SFHVURJKSA-N	0	3	323.396	2.495	10	0		DEAEHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)c1ccnc2ccncc21	ZINC000548075739	406477977	/nfs/dbraw/zinc/47/79/77/406477977.db2.gz	RINBTISWBFWEEZ-INIZCTEOSA-N	0	3	312.417	2.480	10	0		DEAEHN
CC(C)[C@H]1CCCN1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637920611	406478178	/nfs/dbraw/zinc/47/81/78/406478178.db2.gz	OGQWLDKVGBVGHR-DLBZAZTESA-N	0	3	303.450	2.093	10	0		DEAEHN
CC[C@H]1CCCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)C1	ZINC000637935767	406485146	/nfs/dbraw/zinc/48/51/46/406485146.db2.gz	UVNRTTDTKVLZRU-DOTOQJQBSA-N	0	3	303.450	2.094	10	0		DEAEHN
C[C@@H](NC(=O)[C@H](N)CN(C)Cc1ccccc1)c1ccccc1	ZINC000637868002	406454312	/nfs/dbraw/zinc/45/43/12/406454312.db2.gz	LFWNSPOWOQCFMF-CRAIPNDOSA-N	0	3	311.429	2.323	10	0		DEAEHN
CCC[N@@H+]1CCC[C@@H]1C(=O)N[C@@H](C)c1nnc([C@H](C)CC)[n-]1	ZINC000490355862	406462958	/nfs/dbraw/zinc/46/29/58/406462958.db2.gz	WEGPIPHEDXZJJM-FRRDWIJNSA-N	0	3	307.442	2.370	10	0		DEAEHN
CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H](C)c1nnc([C@H](C)CC)[n-]1	ZINC000490355862	406462962	/nfs/dbraw/zinc/46/29/62/406462962.db2.gz	WEGPIPHEDXZJJM-FRRDWIJNSA-N	0	3	307.442	2.370	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@@H](C)c1nnc([C@H](C)CC)[nH]1	ZINC000490355862	406462967	/nfs/dbraw/zinc/46/29/67/406462967.db2.gz	WEGPIPHEDXZJJM-FRRDWIJNSA-N	0	3	307.442	2.370	10	0		DEAEHN
c1nc(CN2CCC[C@H]([C@@H]3CCOC3)C2)cc2c1OCCO2	ZINC000638182212	406610896	/nfs/dbraw/zinc/61/08/96/406610896.db2.gz	RFENCKGYHPQVIF-UONOGXRCSA-N	0	3	304.390	2.101	10	0		DEAEHN
C[C@H]1CCCCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)C1	ZINC000638313509	406693129	/nfs/dbraw/zinc/69/31/29/406693129.db2.gz	XJGBCSKFEFTSTQ-RDJZCZTQSA-N	0	3	303.450	2.094	10	0		DEAEHN
CCC(C)(C)[C@@H](C)NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638408512	406755322	/nfs/dbraw/zinc/75/53/22/406755322.db2.gz	ZJSNRFFSIDMTOV-ZBFHGGJFSA-N	0	3	305.466	2.387	10	0		DEAEHN
C[C@@H]1CCN(S(=O)(=O)c2ccc(CN)c(Cl)c2)C[C@@H]1C	ZINC000129715762	196070609	/nfs/dbraw/zinc/07/06/09/196070609.db2.gz	HJIYSQGOTSGEQY-MNOVXSKESA-N	0	3	316.854	2.465	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2cccs2)N(C[C@@H](C)N2CCCC2)C1=O	ZINC000130779738	196108921	/nfs/dbraw/zinc/10/89/21/196108921.db2.gz	RJWUYDPUSUJIGM-VNHYZAJKSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCCn1ncnc1C[C@H](N)c1ccc(Br)cn1	ZINC000130795194	196111416	/nfs/dbraw/zinc/11/14/16/196111416.db2.gz	HHRLLPUMIBHUFF-JTQLQIEISA-N	0	3	310.199	2.088	10	0		DEAEHN
Cc1cc(CN)cc(S(=O)(=O)NCCCC(F)(F)F)c1C	ZINC000131230578	196152260	/nfs/dbraw/zinc/15/22/60/196152260.db2.gz	VWZFGHIHKPQEIY-UHFFFAOYSA-N	0	3	324.368	2.383	10	0		DEAEHN
COCCN(CCOC)[C@H](CN)c1ccc(C(F)F)cc1	ZINC000131423150	196166903	/nfs/dbraw/zinc/16/69/03/196166903.db2.gz	GCIRYFWUIICLGM-CQSZACIVSA-N	0	3	302.365	2.219	10	0		DEAEHN
C[C@@H](NCCNC(=O)N(C)C)c1ccc(Br)cc1	ZINC000132281390	196241409	/nfs/dbraw/zinc/24/14/09/196241409.db2.gz	DVKHOBNEUMPJNU-SNVBAGLBSA-N	0	3	314.227	2.371	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)c2sc3cccnc3c2N)C1	ZINC000132312157	196244602	/nfs/dbraw/zinc/24/46/02/196244602.db2.gz	XXYDOWVUEJNIGK-SNVBAGLBSA-N	0	3	304.419	2.045	10	0		DEAEHN
CCCN[C@H](Cc1cc(C)ccc1OC)[C@@H](C)S(C)(=O)=O	ZINC000133155816	196317437	/nfs/dbraw/zinc/31/74/37/196317437.db2.gz	XDPRCBMIBMWZLP-UKRRQHHQSA-N	0	3	313.463	2.347	10	0		DEAEHN
Cc1cc(CNC[C@H]2CCCS2(=O)=O)c2ccccc2n1	ZINC000133958606	196349615	/nfs/dbraw/zinc/34/96/15/196349615.db2.gz	LUEOXKJIECROJD-CQSZACIVSA-N	0	3	304.415	2.210	10	0		DEAEHN
C[C@@H]1CNC[C@@H](COc2ncc(Cl)cc2Br)O1	ZINC000133853039	196340713	/nfs/dbraw/zinc/34/07/13/196340713.db2.gz	NZYKSGPZYXQVJF-APPZFPTMSA-N	0	3	321.602	2.253	10	0		DEAEHN
C[C@](CN)(Nc1ccc(S(C)(=O)=O)cc1)c1ccccc1	ZINC000134476036	196395068	/nfs/dbraw/zinc/39/50/68/196395068.db2.gz	OUFIMFPEISHFBJ-MRXNPFEDSA-N	0	3	304.415	2.376	10	0		DEAEHN
CC[C@H]1CCSC(NCc2ccc(S(C)(=O)=O)cc2)=N1	ZINC000134481339	196395347	/nfs/dbraw/zinc/39/53/47/196395347.db2.gz	YHPKUUOCXACPJZ-LBPRGKRZSA-N	0	3	312.460	2.451	10	0		DEAEHN
CCC[C@@H](C)NC(=O)[C@@H](C)N1CCC(Cc2nccn2C)CC1	ZINC000105876276	424849554	/nfs/dbraw/zinc/84/95/54/424849554.db2.gz	SHIGFVAOIGEGMK-HUUCEWRRSA-N	0	3	320.481	2.368	10	0		DEAEHN
Cc1nc(C)n(C[C@@H]2CCCN(C[C@H](O)c3ccccc3)C2)n1	ZINC000105885078	424849564	/nfs/dbraw/zinc/84/95/64/424849564.db2.gz	XZHWRJYVZGSIBB-AEFFLSMTSA-N	0	3	314.433	2.341	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NCc1cccc(O)c1	ZINC000194476658	424875847	/nfs/dbraw/zinc/87/58/47/424875847.db2.gz	LVAFCRLSYVRYHM-UHFFFAOYSA-N	0	3	314.385	2.263	10	0		DEAEHN
Cc1nccn1C[C@@H](C)CNC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000194895954	424879740	/nfs/dbraw/zinc/87/97/40/424879740.db2.gz	WOOIQXBVEDEXDO-HOCLYGCPSA-N	0	3	323.485	2.103	10	0		DEAEHN
O=C([C@@H]1COc2ccc(Cl)cc2C1)N1CCN2CCC[C@@H]2C1	ZINC000195321649	424881941	/nfs/dbraw/zinc/88/19/41/424881941.db2.gz	JUDCAEKZPOSTTK-DZGCQCFKSA-N	0	3	320.820	2.198	10	0		DEAEHN
Brc1cccc2c1CC[C@H]2NC1COCCOC1	ZINC000381280099	424909138	/nfs/dbraw/zinc/90/91/38/424909138.db2.gz	UQRRQCNHHDJRQP-CQSZACIVSA-N	0	3	312.207	2.441	10	0		DEAEHN
[NH3+]CC1(CC[N-]S(=O)(=O)c2cc(Cl)ccc2Cl)CC1	ZINC000404641616	424927824	/nfs/dbraw/zinc/92/78/24/424927824.db2.gz	MADNKVSJSSLPRH-UHFFFAOYSA-N	0	3	323.245	2.401	10	0		DEAEHN
CCN1CCC(NC(=O)c2nscc2Br)CC1	ZINC000404837592	424929720	/nfs/dbraw/zinc/92/97/20/424929720.db2.gz	MORROBJMEQLVPQ-UHFFFAOYSA-N	0	3	318.240	2.120	10	0		DEAEHN
CC[C@H](C)n1nc(NC(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1C	ZINC000408113238	424933424	/nfs/dbraw/zinc/93/34/24/424933424.db2.gz	UKMHVDGNEANNAF-AEGPPILISA-N	0	3	319.453	2.863	10	0		DEAEHN
NC[C@@H](NC(=O)CCOc1cccc(Cl)c1)C(F)(F)F	ZINC000655509959	425586867	/nfs/dbraw/zinc/58/68/67/425586867.db2.gz	QNLBSPQWDNEMBE-SNVBAGLBSA-N	0	3	310.703	2.115	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2nnc(CC(C)C)s2)C1	ZINC000194320489	267782815	/nfs/dbraw/zinc/78/28/15/267782815.db2.gz	PXWJUDWJTFCPBO-LLVKDONJSA-N	0	3	311.455	2.342	10	0		DEAEHN
Cc1noc(CN2CCN(C[C@@H]3C(C)=CCC[C@H]3C)CC2)n1	ZINC000443404520	269137374	/nfs/dbraw/zinc/13/73/74/269137374.db2.gz	GHBGWMOTDOPZDY-GDBMZVCRSA-N	0	3	304.438	2.488	10	0		DEAEHN
CC(C)[C@H]1OCC[C@@H]1CN[C@H](C(=O)N(C)C)c1ccccc1	ZINC000275322237	275716653	/nfs/dbraw/zinc/71/66/53/275716653.db2.gz	PDSWPAJXBIVFLT-IXDOHACOSA-N	0	3	304.434	2.467	10	0		DEAEHN
CCN1CCN(C[C@@H](C)CNC(=O)N[C@@H](C)C2CCCC2)CC1	ZINC000174920216	276195528	/nfs/dbraw/zinc/19/55/28/276195528.db2.gz	UKZHCWZZGOTSNF-HOTGVXAUSA-N	0	3	324.513	2.138	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1)N(C)C	ZINC000187680968	276281754	/nfs/dbraw/zinc/28/17/54/276281754.db2.gz	IXOMFWYCGWXBJE-OUCADQQQSA-N	0	3	324.387	2.317	10	0		DEAEHN
CCC[C@@H](C(=O)N(C)Cc1ncc(C)c(OC)c1C)N(C)C	ZINC000179719280	278853292	/nfs/dbraw/zinc/85/32/92/278853292.db2.gz	ABQGAVPALMKGQC-HNNXBMFYSA-N	0	3	307.438	2.396	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@H]1Cc2cc(F)ccc2O1	ZINC000076962947	279131751	/nfs/dbraw/zinc/13/17/51/279131751.db2.gz	AVPSVSYPAFWEOL-GDBMZVCRSA-N	0	3	308.397	2.222	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCOC[C@H]2c2ccc(C)o2)C1	ZINC000247209040	279318838	/nfs/dbraw/zinc/31/88/38/279318838.db2.gz	ULNSNXMAGZRBLF-GJZGRUSLSA-N	0	3	321.421	2.155	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)C1	ZINC000246898569	279321197	/nfs/dbraw/zinc/32/11/97/279321197.db2.gz	RKRRLUXILOPPRT-ZJIFWQFVSA-N	0	3	321.465	2.118	10	0		DEAEHN
O=C(CN[C@H]1CCCC[C@H]1n1cccn1)N1CCCCCC1	ZINC000128695171	279783841	/nfs/dbraw/zinc/78/38/41/279783841.db2.gz	UMDHSBRQQSPXIR-JKSUJKDBSA-N	0	3	304.438	2.359	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN(C[C@@H](O)COC(C)(C)C)C2)n1	ZINC000247440106	281245312	/nfs/dbraw/zinc/24/53/12/281245312.db2.gz	XQUQOJNQFWHDFW-JKSUJKDBSA-N	0	3	321.465	2.300	10	0		DEAEHN
CC1(C)C[C@H](NC(=O)N2CCCN(C3CC3)CC2)C(C)(C)O1	ZINC000183589920	281341306	/nfs/dbraw/zinc/34/13/06/281341306.db2.gz	ICXVYLTUXMTYKH-AWEZNQCLSA-N	0	3	309.454	2.212	10	0		DEAEHN
Cc1ccccc1NC(=O)C[C@@H](C)NCC1(C)OCCCO1	ZINC000190665181	281349774	/nfs/dbraw/zinc/34/97/74/281349774.db2.gz	PWLHJDGTBVZJBH-CQSZACIVSA-N	0	3	306.406	2.455	10	0		DEAEHN
Cc1nc2cc(F)ccc2cc1C(=O)N1CC[C@H](N(C)C)C1	ZINC000170857111	282051438	/nfs/dbraw/zinc/05/14/38/282051438.db2.gz	JKBXSDMCBYLHKB-AWEZNQCLSA-N	0	3	301.365	2.458	10	0		DEAEHN
C[C@@H]1OCC[C@@H]1N[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1	ZINC000245580954	288893143	/nfs/dbraw/zinc/89/31/43/288893143.db2.gz	HDHKMEPAJVGPNH-BWPSIRRCSA-N	0	3	308.809	2.379	10	0		DEAEHN
CN1CCN(C(=O)[C@H]2CCCc3[nH]ncc32)[C@H](c2ccccc2)C1	ZINC000246653199	290026666	/nfs/dbraw/zinc/02/66/66/290026666.db2.gz	VPZVMNLJLSFUGT-YJBOKZPZSA-N	0	3	324.428	2.345	10	0		DEAEHN
Cc1ncc([C@@H]2C[C@H]3CN(C4CCCC4)C(=O)[C@]34CCCN24)[nH]1	ZINC000012433609	293375709	/nfs/dbraw/zinc/37/57/09/293375709.db2.gz	MCBNDVGZSYGNKO-OWQGQXMQSA-N	0	3	314.433	2.399	10	0		DEAEHN
Cc1nc2ccccn2c1CN1CCNC[C@@H]1c1cccnc1	ZINC000261638239	293486672	/nfs/dbraw/zinc/48/66/72/293486672.db2.gz	FKLXXARZVANWCO-MRXNPFEDSA-N	0	3	307.401	2.184	10	0		DEAEHN
COc1cccc(CNCC[C@H]2COc3ccccc3O2)n1	ZINC000574892414	326197387	/nfs/dbraw/zinc/19/73/87/326197387.db2.gz	QHHCEKLPPUPAEH-AWEZNQCLSA-N	0	3	300.358	2.410	10	0		DEAEHN
CCOc1cccc(CNC[C@H]2CCC3(CCOCC3)[C@@H]2O)n1	ZINC000577126305	326344741	/nfs/dbraw/zinc/34/47/41/326344741.db2.gz	KRDFGDRBCJVCJS-RHSMWYFYSA-N	0	3	320.433	2.138	10	0		DEAEHN
Cc1cc(C)n2c(CNCCC(=O)OC(C)(C)C)cnc2n1	ZINC000178911321	341970912	/nfs/dbraw/zinc/97/09/12/341970912.db2.gz	YRQFFRAUSPXMFL-UHFFFAOYSA-N	0	3	304.394	2.168	10	0		DEAEHN
COC(=O)c1cc2c(o1)c(OC)ccc2CN(C)CCCO	ZINC000442970403	533936761	/nfs/dbraw/zinc/93/67/61/533936761.db2.gz	UHHFVCWAFHFHCS-UHFFFAOYSA-N	0	3	307.346	2.042	10	0		DEAEHN
CCC[C@H](C)CN1CCC(S(=O)(=O)N2CCCC2)CC1	ZINC000374359804	535609009	/nfs/dbraw/zinc/60/90/09/535609009.db2.gz	LXVODOIWSIKIMZ-AWEZNQCLSA-N	0	3	302.484	2.313	10	0		DEAEHN
C[C@H]1COCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccccc1	ZINC000193885132	534030090	/nfs/dbraw/zinc/03/00/90/534030090.db2.gz	ACYWAIRJYCDECL-RDJZCZTQSA-N	0	3	304.434	2.249	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1ccc(F)c(C)c1	ZINC000036076757	517642322	/nfs/dbraw/zinc/64/23/22/517642322.db2.gz	HTEOBGLGSFMISL-LBPRGKRZSA-N	0	3	302.415	2.143	10	0		DEAEHN
CCCOc1ccc(CNC(=O)N[C@H]2CCCN(CC)C2)cn1	ZINC000107838139	520359620	/nfs/dbraw/zinc/35/96/20/520359620.db2.gz	SNPAVUMSVATOBX-HNNXBMFYSA-N	0	3	320.437	2.154	10	0		DEAEHN
CCN(CC)C(=O)[C@@H]1CCCN1CCCCCn1cccn1	ZINC000104948648	520529710	/nfs/dbraw/zinc/52/97/10/520529710.db2.gz	HHFPFKMDVJQIHP-INIZCTEOSA-N	0	3	306.454	2.386	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2cccc(-c3ccoc3)c2)CCO1	ZINC000127955777	521882653	/nfs/dbraw/zinc/88/26/53/521882653.db2.gz	DYSYXTCHDSKIGY-KRWDZBQOSA-N	0	3	314.385	2.349	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(C[C@H](O)COC(C)(C)C)C1	ZINC000105922602	522595081	/nfs/dbraw/zinc/59/50/81/522595081.db2.gz	GAMGQJJCPOMWPN-CABCVRRESA-N	0	3	309.454	2.258	10	0		DEAEHN
CCc1nn(C)c(CC)c1CN1CCC[C@@H](Cn2cncn2)C1	ZINC000156677666	522651989	/nfs/dbraw/zinc/65/19/89/522651989.db2.gz	UFLYBMXXZYYTES-CQSZACIVSA-N	0	3	316.453	2.049	10	0		DEAEHN
CCn1cc(C2CCN(C[C@@H](O)CC(F)(F)F)CC2)cn1	ZINC000188990141	523355615	/nfs/dbraw/zinc/35/56/15/523355615.db2.gz	YPKQSUOZOFXFEJ-ZDUSSCGKSA-N	0	3	305.344	2.396	10	0		DEAEHN
COc1ccc(CN2CCC[C@@H](Cn3cncn3)C2)cc1OC	ZINC000128481659	524027647	/nfs/dbraw/zinc/02/76/47/524027647.db2.gz	WFTNLQXSYMNHJP-OAHLLOKOSA-N	0	3	316.405	2.208	10	0		DEAEHN
COc1ccc(OC)c(CC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000124169106	524811923	/nfs/dbraw/zinc/81/19/23/524811923.db2.gz	RJGPYWXXSBUABG-UKRRQHHQSA-N	0	3	320.433	2.187	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(C[C@H](O)COCC(C)C)CC2	ZINC000374347433	534882445	/nfs/dbraw/zinc/88/24/45/534882445.db2.gz	CCOFFFHAIKVOHA-IBGZPJMESA-N	0	3	319.445	2.323	10	0		DEAEHN
CC(=O)c1cccc(CN2CCCC[C@H]2[C@@H]2CNC(=O)C2)c1	ZINC000450640206	534888219	/nfs/dbraw/zinc/88/82/19/534888219.db2.gz	GAOJLZBKTNOLAV-IRXDYDNUSA-N	0	3	300.402	2.380	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)CN(C)[C@@H]2CCN(C)[C@@H](C)C2)c1C	ZINC000299378134	527158861	/nfs/dbraw/zinc/15/88/61/527158861.db2.gz	SKSSJMTXRJXFNH-XHDPSFHLSA-N	0	3	319.449	2.431	10	0		DEAEHN
Cc1nccn1CCCN(C)CC(=O)Nc1cccc(C)c1	ZINC000130796008	527407648	/nfs/dbraw/zinc/40/76/48/527407648.db2.gz	LXTAUUAOBJUEAL-UHFFFAOYSA-N	0	3	300.406	2.461	10	0		DEAEHN
CC1(C(=O)NCC2(O)CCN(Cc3ccccc3)CC2)CCC1	ZINC000412772812	528853160	/nfs/dbraw/zinc/85/31/60/528853160.db2.gz	HSNYZNDECCTDSY-UHFFFAOYSA-N	0	3	316.445	2.320	10	0		DEAEHN
CCOCCCNC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000248803588	535536719	/nfs/dbraw/zinc/53/67/19/535536719.db2.gz	JWHVKNBWZQFTEY-NVXWUHKLSA-N	0	3	319.449	2.233	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)S(=O)(=O)CCc1cccs1	ZINC000189685157	535547122	/nfs/dbraw/zinc/54/71/22/535547122.db2.gz	XBXLGOSBFVLEKE-CYBMUJFWSA-N	0	3	316.492	2.037	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](CCCO)c2ccccc2)C1	ZINC000247281559	535576274	/nfs/dbraw/zinc/57/62/74/535576274.db2.gz	SVQJRWOSNZHONT-DLBZAZTESA-N	0	3	319.449	2.284	10	0		DEAEHN
CCOC(=O)C1CCC(NC(=O)[C@@H]2NCCCC2(C)C)CC1	ZINC000262534243	535593172	/nfs/dbraw/zinc/59/31/72/535593172.db2.gz	QAJRVGVWZFESGF-RUXDESIVSA-N	0	3	310.438	2.003	10	0		DEAEHN
CCCn1ccc2ccc(NC(=O)C3(N)CCOCC3)cc21	ZINC000261763032	535616671	/nfs/dbraw/zinc/61/66/71/535616671.db2.gz	GCMHGUMYVUKSCZ-UHFFFAOYSA-N	0	3	301.390	2.498	10	0		DEAEHN
CCS(=O)(=O)CCCCCN1CC[C@@]2(O)CCCC[C@@H]2C1	ZINC000190723937	535618782	/nfs/dbraw/zinc/61/87/82/535618782.db2.gz	RWFVFYUVDOCMRO-CVEARBPZSA-N	0	3	317.495	2.218	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)NC[C@@H]1N(C)CCCC1(C)C	ZINC000454876790	535881273	/nfs/dbraw/zinc/88/12/73/535881273.db2.gz	PRYHQNBJLKLCEM-HNNXBMFYSA-N	0	3	322.453	2.465	10	0		DEAEHN
CCc1ccccc1S(=O)(=O)N1CC[C@@H]2[C@@H](CCCN2C)C1	ZINC000249487411	535973087	/nfs/dbraw/zinc/97/30/87/535973087.db2.gz	XIMZGFUEUZATSM-JKSUJKDBSA-N	0	3	322.474	2.354	10	0		DEAEHN
COC[C@@H](NC(=O)CC1CCN(C)CC1)c1ccc(F)cc1	ZINC000362869190	536685150	/nfs/dbraw/zinc/68/51/50/536685150.db2.gz	UGKOHLPYVFHLER-MRXNPFEDSA-N	0	3	308.397	2.361	10	0		DEAEHN
COc1ccc(C(=O)N2CC[C@@H](N(C)C)C2)c(OC(C)C)c1	ZINC000191173806	536730888	/nfs/dbraw/zinc/73/08/88/536730888.db2.gz	MXYRRORESBNOKF-CYBMUJFWSA-N	0	3	306.406	2.259	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)N3C[C@@H]4CCCN4C[C@H]3C)cc2c1	ZINC000248768175	536958908	/nfs/dbraw/zinc/95/89/08/536958908.db2.gz	ABLYZWGTSOULGU-OCCSQVGLSA-N	0	3	313.401	2.485	10	0		DEAEHN
F[C@H]1CC2(CC[C@H]1N1CCC(c3cc[nH]n3)CC1)OCCO2	ZINC000891891045	624647106	/nfs/dbraw/zinc/64/71/06/624647106.db2.gz	KXKSXUAHCDABHW-DZGCQCFKSA-N	0	3	309.385	2.223	10	0		DEAEHN
CO[C@@H]1CCN([C@H]2CCC[C@H]2NC(=O)c2cncc(Cl)c2)C1	ZINC000888076785	625054430	/nfs/dbraw/zinc/05/44/30/625054430.db2.gz	CTWNGTZVKPKOLR-KFWWJZLASA-N	0	3	323.824	2.107	10	0		DEAEHN
COCC[C@@H](N)C(=O)N(C)Cc1cccc(Cl)c1Cl	ZINC000052808244	625105959	/nfs/dbraw/zinc/10/59/59/625105959.db2.gz	HGHWEGQGEAPQSD-LLVKDONJSA-N	0	3	305.205	2.316	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@@H]1CCCc2nc(C)ncc21	ZINC000734823796	633430095	/nfs/dbraw/zinc/43/00/95/633430095.db2.gz	DXKMBCFIZVINAR-HZPDHXFCSA-N	0	3	302.422	2.153	10	0		DEAEHN
CCN(C[C@H]1CCN(C/C=C(/C)C(=O)OC)C1)CC(F)(F)F	ZINC000748825825	638595941	/nfs/dbraw/zinc/59/59/41/638595941.db2.gz	ZHAFJWWACVXBKR-QWGHSUKYSA-N	0	3	322.371	2.312	10	0		DEAEHN
CCOC(=O)[C@@H](CC1CC1)NC(=O)[C@H](C)N1CCCCCC1	ZINC000752385033	639178533	/nfs/dbraw/zinc/17/85/33/639178533.db2.gz	DWKZCBYOIFOBEW-DZGCQCFKSA-N	0	3	310.438	2.099	10	0		DEAEHN
COC(=O)c1ccc2c(cnn2CN2CCC[C@@H]2C[C@H](C)O)c1	ZINC000752803326	639222409	/nfs/dbraw/zinc/22/24/09/639222409.db2.gz	IMSYUEJFKFMBHF-SWLSCSKDSA-N	0	3	317.389	2.016	10	0		DEAEHN
CC(C)(C)OC(=O)N(Cc1cc[nH]n1)c1ccc(CN)nc1	ZINC000757135578	645929297	/nfs/dbraw/zinc/92/92/97/645929297.db2.gz	WAEUNOLSTJAVQH-UHFFFAOYSA-N	0	3	303.366	2.205	10	0		DEAEHN
Cc1cc(C)cc([C@@H](O)CN2CCC(NC(=O)C3CC3)CC2)c1	ZINC000174730258	646996947	/nfs/dbraw/zinc/99/69/47/646996947.db2.gz	UTTDGEBHLQCGDJ-SFHVURJKSA-N	0	3	316.445	2.327	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)c1cc(Cl)nc(N(C)C)c1	ZINC000733154759	647892864	/nfs/dbraw/zinc/89/28/64/647892864.db2.gz	IHHNAHUFCBBIBI-CYBMUJFWSA-N	0	3	324.856	2.405	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)C[C@H](O)c2ccc(Cl)cc2)C1	ZINC000179814298	648422885	/nfs/dbraw/zinc/42/28/85/648422885.db2.gz	BWURVULUHSCUPK-GJZGRUSLSA-N	0	3	310.825	2.364	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000183206488	649048368	/nfs/dbraw/zinc/04/83/68/649048368.db2.gz	XBEWPYBZFQOSDB-OAGGEKHMSA-N	0	3	317.385	2.003	10	0		DEAEHN
CC(C)[C@@H](N)c1cn(Cc2ncccc2Br)nn1	ZINC000381189386	685400377	/nfs/dbraw/zinc/40/03/77/685400377.db2.gz	WRIPEGNFOUEAIB-GFCCVEGCSA-N	0	3	310.199	2.140	10	0		DEAEHN
COC[C@H](C)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000187530050	684340208	/nfs/dbraw/zinc/34/02/08/684340208.db2.gz	LQWWVVNIJWJUTL-MRXNPFEDSA-N	0	3	321.465	2.007	10	0		DEAEHN
CCCCCCNC(=O)[C@@H]1CCCN(C[C@@H](O)C(F)(F)F)C1	ZINC000248397676	685158244	/nfs/dbraw/zinc/15/82/44/685158244.db2.gz	SBSPHRSZBLHPOV-CHWSQXEVSA-N	0	3	324.387	2.318	10	0		DEAEHN
C[C@@H](N[C@H]1CON(C(=O)OC(C)(C)C)C1)[C@H]1CCCCO1	ZINC000724660082	777442823	/nfs/dbraw/zinc/44/28/23/777442823.db2.gz	IPFHIHQPNSICER-JHJVBQTASA-N	0	3	300.399	2.085	10	0		DEAEHN
COC[C@H](CNCc1cn(C)nc1Br)C(C)C	ZINC000721813833	779291908	/nfs/dbraw/zinc/29/19/08/779291908.db2.gz	LRCYGNFAOAOEHK-NSHDSACASA-N	0	3	304.232	2.191	10	0		DEAEHN
C[C@H](NCc1cn(C)nc1Br)[C@H]1CCCOC1	ZINC000712397227	792185229	/nfs/dbraw/zinc/18/52/29/792185229.db2.gz	LYHYKSXLOXNXSH-UWVGGRQHSA-N	0	3	302.216	2.087	10	0		DEAEHN
Cn1cc(CNCCC2SCCS2)c(Br)n1	ZINC000712448667	792188491	/nfs/dbraw/zinc/18/84/91/792188491.db2.gz	GQWZKKGQRWLRPP-UHFFFAOYSA-N	0	3	322.297	2.468	10	0		DEAEHN
CN1CCC[C@@H]2[C@@H]1CCN2C(=O)c1ccc(Br)cn1	ZINC000720819087	1086169639	/nfs/dbraw/zinc/16/96/39/1086169639.db2.gz	YFTOEBIZYRDAMV-QWHCGFSZSA-N	0	3	324.222	2.153	10	0		DEAEHN
CN1CCC[C@H]2[C@@H]1CCN2C(=O)c1ccnc(Br)c1	ZINC000720828901	1086183790	/nfs/dbraw/zinc/18/37/90/1086183790.db2.gz	JVDSXZVCWUCPPP-RYUDHWBXSA-N	0	3	324.222	2.153	10	0		DEAEHN
Cc1cc(CNC[C@H]2COCCN2C(=O)OC(C)(C)C)ccn1	ZINC000703509177	1086499362	/nfs/dbraw/zinc/49/93/62/1086499362.db2.gz	XDFPYWIVVBHESZ-HNNXBMFYSA-N	0	3	321.421	2.116	10	0		DEAEHN
Cc1cc(CNC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)ccn1	ZINC000703461851	1086499490	/nfs/dbraw/zinc/49/94/90/1086499490.db2.gz	IEXOSPHVGCJFBE-HNNXBMFYSA-N	0	3	321.421	2.116	10	0		DEAEHN
Cn1nncc1CNC1(CNC(=O)OC(C)(C)C)CCCCC1	ZINC000705567785	1086619162	/nfs/dbraw/zinc/61/91/62/1086619162.db2.gz	FRNHMNMQWSZOOB-UHFFFAOYSA-N	0	3	323.441	2.132	10	0		DEAEHN
C[C@H]1[C@@H](NC(=O)c2cccc(Br)c2F)CCN1C	ZINC000719388420	1089070519	/nfs/dbraw/zinc/07/05/19/1089070519.db2.gz	PUNULPKRVUODET-KWQFWETISA-N	0	3	315.186	2.411	10	0		DEAEHN
COc1ccc(CNCCOC(F)(F)C(F)(F)F)cn1	ZINC000720225452	1089535618	/nfs/dbraw/zinc/53/56/18/1089535618.db2.gz	RMURDZLOAZFWFM-UHFFFAOYSA-N	0	3	300.227	2.352	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)C1CCN(C)CC1	ZINC000137316197	282095456	/nfs/dbraw/zinc/09/54/56/282095456.db2.gz	BONUOQDHDGUFDR-GFCCVEGCSA-N	0	3	306.454	2.466	10	0		DEAEHN
CCN[C@H](CSCC(=O)OC)c1ccc(OC)c(OC)c1	ZINC000081793991	192324584	/nfs/dbraw/zinc/32/45/84/192324584.db2.gz	SFCVQARMFPIUMS-GFCCVEGCSA-N	0	3	313.419	2.261	10	0		DEAEHN
CN[C@H]1c2ccccc2CC[C@H]1Sc1nnnn1C1CC1	ZINC000081867649	192332576	/nfs/dbraw/zinc/33/25/76/192332576.db2.gz	HBDJBVSLZCDKAA-KGLIPLIRSA-N	0	3	301.419	2.376	10	0		DEAEHN
CC(=O)N[C@H](CC(=O)N(CCN(C)C)C(C)C)c1ccccc1	ZINC000151871362	282128421	/nfs/dbraw/zinc/12/84/21/282128421.db2.gz	VMDLSQPOEDWTLW-QGZVFWFLSA-N	0	3	319.449	2.053	10	0		DEAEHN
CN[C@@H](C)[C@@H](C)S(=O)(=O)c1ccccc1Br	ZINC000081931597	192341369	/nfs/dbraw/zinc/34/13/69/192341369.db2.gz	NOBJQKMATTWVFM-DTWKUNHWSA-N	0	3	306.225	2.219	10	0		DEAEHN
O=C1[C@H](NC2CC2)CCN1c1ccc(F)c(Br)c1	ZINC000164510317	197655113	/nfs/dbraw/zinc/65/51/13/197655113.db2.gz	HSUULXWKEWJBSP-GFCCVEGCSA-N	0	3	313.170	2.446	10	0		DEAEHN
CCCN[C@](CSc1ccc(Cl)cn1)(C(N)=O)C1CC1	ZINC000079448473	185172321	/nfs/dbraw/zinc/17/23/21/185172321.db2.gz	XHRLWBXXHARYDP-AWEZNQCLSA-N	0	3	313.854	2.461	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(CCn3cccn3)C2)c1	ZINC000083402940	185222139	/nfs/dbraw/zinc/22/21/39/185222139.db2.gz	GWUUOCCIUCCZAF-AWEZNQCLSA-N	0	3	301.390	2.390	10	0		DEAEHN
CC(C)[C@H](N)CS(=O)(=O)c1cccc(Br)c1	ZINC000087540075	185228158	/nfs/dbraw/zinc/22/81/58/185228158.db2.gz	ZFPYMJVANOVOHS-LLVKDONJSA-N	0	3	306.225	2.206	10	0		DEAEHN
CC[C@H](N)CS(=O)(=O)Cc1ccc(Br)s1	ZINC000088075080	185238846	/nfs/dbraw/zinc/23/88/46/185238846.db2.gz	RLCFJGRSQFFRRX-ZETCQYMHSA-N	0	3	312.254	2.163	10	0		DEAEHN
CC(C)[C@@H](CN(C)C)NC(=O)c1ccc2nc(N)sc2c1	ZINC000087847498	185233417	/nfs/dbraw/zinc/23/34/17/185233417.db2.gz	XOIYVSNFIWSMHT-GFCCVEGCSA-N	0	3	306.435	2.195	10	0		DEAEHN
N[C@@H]1CCCN(c2c(F)cc(Br)cc2F)C1=O	ZINC000088172865	185240944	/nfs/dbraw/zinc/24/09/44/185240944.db2.gz	LWZWBQHLRWXMTM-SECBINFHSA-N	0	3	305.122	2.181	10	0		DEAEHN
CN(C)C[C@@H](O)CNc1cc(Cl)ccc1Br	ZINC000088123117	185240107	/nfs/dbraw/zinc/24/01/07/185240107.db2.gz	AVOYDAPTYYIAHF-VIFPVBQESA-N	0	3	307.619	2.437	10	0		DEAEHN
CCN[C@@H]1CCN(c2cc(OC)ccc2Br)C1=O	ZINC000088320398	185245422	/nfs/dbraw/zinc/24/54/22/185245422.db2.gz	UYNWVSYRCVQLJF-LLVKDONJSA-N	0	3	313.195	2.173	10	0		DEAEHN
CN[C@](C)(C[C@@H](C)N1CCC[C@H](C(F)(F)F)C1)C(=O)OC	ZINC000088435246	185250355	/nfs/dbraw/zinc/25/03/55/185250355.db2.gz	KOTAFHLFJSFLOG-NTZNESFSSA-N	0	3	310.360	2.190	10	0		DEAEHN
COc1cc(C[NH2+][C@H](C)CCCO)cc(Br)c1[O-]	ZINC000088503445	185254346	/nfs/dbraw/zinc/25/43/46/185254346.db2.gz	YKRDQDWIGMNQCN-SECBINFHSA-N	0	3	318.211	2.414	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1ccccc1COC	ZINC000177349920	282204736	/nfs/dbraw/zinc/20/47/36/282204736.db2.gz	MSCUBMQWSBQPRV-QGZVFWFLSA-N	0	3	319.449	2.459	10	0		DEAEHN
CC(C)C[C@@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000088542298	185256433	/nfs/dbraw/zinc/25/64/33/185256433.db2.gz	SWZOCRUWJOQAMM-GFCCVEGCSA-N	0	3	302.440	2.491	10	0		DEAEHN
CC(C)C[C@@H](C)NS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000088542298	185256434	/nfs/dbraw/zinc/25/64/34/185256434.db2.gz	SWZOCRUWJOQAMM-GFCCVEGCSA-N	0	3	302.440	2.491	10	0		DEAEHN
CN[C@H]1c2ccccc2CCC[C@@H]1S(=O)(=O)CCCOC	ZINC000081985272	192348861	/nfs/dbraw/zinc/34/88/61/192348861.db2.gz	APWQVULISPAEGD-HOTGVXAUSA-N	0	3	311.447	2.103	10	0		DEAEHN
CCN[C@H](C)CS(=O)(=O)c1cccc(Br)c1	ZINC000081982732	192349411	/nfs/dbraw/zinc/34/94/11/192349411.db2.gz	SDZQMYNHBBNJAP-SECBINFHSA-N	0	3	306.225	2.221	10	0		DEAEHN
N[C@@H]1COC[C@@H]1c1nc(Cc2ccc(Cl)c(Cl)c2)no1	ZINC000090364624	185292690	/nfs/dbraw/zinc/29/26/90/185292690.db2.gz	OXVMHKTZXOFAGF-GZMMTYOYSA-N	0	3	314.172	2.408	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1ccccc1SC(F)(F)F	ZINC000090432890	185296175	/nfs/dbraw/zinc/29/61/75/185296175.db2.gz	XOEDFDGKEVFALQ-WCBMZHEXSA-N	0	3	320.336	2.471	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000090434114	185296324	/nfs/dbraw/zinc/29/63/24/185296324.db2.gz	HPAWBYLTZFVHFI-ZWNOBZJWSA-N	0	3	305.765	2.061	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1ccc(C)c(C(F)(F)F)c1	ZINC000090436991	185296338	/nfs/dbraw/zinc/29/63/38/185296338.db2.gz	LWNHPBYDXFAOQU-ZYHUDNBSSA-N	0	3	302.296	2.187	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1c2ncsc2ccc1Cl	ZINC000090432864	185296415	/nfs/dbraw/zinc/29/64/15/185296415.db2.gz	FSAASTYZGUFZJV-VXNVDRBHSA-N	0	3	311.794	2.123	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N[C@H]1CCCS(=O)(=O)C1)CCC2	ZINC000092384061	185315380	/nfs/dbraw/zinc/31/53/80/185315380.db2.gz	ZBYPNIFRJWBIJJ-BBRMVZONSA-N	0	3	309.431	2.239	10	0		DEAEHN
Cc1ccc(F)c(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)c1	ZINC000179890551	282233653	/nfs/dbraw/zinc/23/36/53/282233653.db2.gz	XNSKURQADJKCIX-OAHLLOKOSA-N	0	3	320.408	2.205	10	0		DEAEHN
CCN(Cc1cc(OC)c2c(c1)OCCO2)C[C@H]1CCCO1	ZINC000092407166	185316456	/nfs/dbraw/zinc/31/64/56/185316456.db2.gz	JTGBGNNLJJUZBM-CQSZACIVSA-N	0	3	307.390	2.467	10	0		DEAEHN
CCNc1ccnc(CN2CCN(CC(F)(F)F)CC2)c1	ZINC000092419050	185317124	/nfs/dbraw/zinc/31/71/24/185317124.db2.gz	LRUNUHVUTJJQLC-UHFFFAOYSA-N	0	3	302.344	2.193	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)N[C@H]2CCCOc3cc(F)ccc32)C1	ZINC000180595574	282262299	/nfs/dbraw/zinc/26/22/99/282262299.db2.gz	RIFMXUQFWBROQZ-ZFWWWQNUSA-N	0	3	321.396	2.385	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000181551830	199315466	/nfs/dbraw/zinc/31/54/66/199315466.db2.gz	OWVPIHHAWMTOKQ-PBHICJAKSA-N	0	3	319.449	2.097	10	0		DEAEHN
CNC(=O)c1cccnc1N[C@@H](C)CN(C)Cc1ccccc1	ZINC000301999527	529951924	/nfs/dbraw/zinc/95/19/24/529951924.db2.gz	IMJSKFHOVTZHPD-AWEZNQCLSA-N	0	3	312.417	2.374	10	0		DEAEHN
CC[C@H](O)CN(CCN1CCOCC1)Cc1cc(C)ccc1C	ZINC000036103818	190662477	/nfs/dbraw/zinc/66/24/77/190662477.db2.gz	HKFIDFJMIDRHJH-IBGZPJMESA-N	0	3	320.477	2.209	10	0		DEAEHN
CN1CCC[C@]2(CCN(c3ncnc4c3ncn4C3CC3)C2)C1	ZINC000292924487	530065684	/nfs/dbraw/zinc/06/56/84/530065684.db2.gz	YUPAEMDGJJDYDB-KRWDZBQOSA-N	0	3	312.421	2.083	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)NC[C@H](C)N2CCC(C)CC2)n1	ZINC000195067457	282368205	/nfs/dbraw/zinc/36/82/05/282368205.db2.gz	GCJFJPZVFUQASY-JKSUJKDBSA-N	0	3	306.454	2.298	10	0		DEAEHN
CC1(OCC(=O)Nc2cccc(-c3nccs3)c2)CNC1	ZINC000098060180	539435971	/nfs/dbraw/zinc/43/59/71/539435971.db2.gz	XQYAOIQDDLWHNK-UHFFFAOYSA-N	0	3	303.387	2.127	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCCC[C@H](n2ccnc2)C1	ZINC000616603935	362896450	/nfs/dbraw/zinc/89/64/50/362896450.db2.gz	YSLRIODBVVMFON-AWEZNQCLSA-N	0	3	308.426	2.435	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)[C@H](C)N[C@H](C)[C@@H]2CCCO2)cc1	ZINC000183224010	539660362	/nfs/dbraw/zinc/66/03/62/539660362.db2.gz	BHWHWLNAAIVXTN-WQGACYEGSA-N	0	3	304.390	2.373	10	0		DEAEHN
Cc1cccc(OCCCNC(=O)CN[C@H](C)[C@H]2CCCO2)c1	ZINC000183197348	539660405	/nfs/dbraw/zinc/66/04/05/539660405.db2.gz	VCENULKSKXABJG-NVXWUHKLSA-N	0	3	320.433	2.037	10	0		DEAEHN
COC[C@@H](C)CN1CCN(Cc2cnn(C(C)(C)C)c2)CC1	ZINC000187227692	539678608	/nfs/dbraw/zinc/67/86/08/539678608.db2.gz	CFQWYWXVLRSZDD-HNNXBMFYSA-N	0	3	308.470	2.038	10	0		DEAEHN
N[C@@H](C[S@@](=O)c1cccs1)c1ccc2c(c1)OCCO2	ZINC000084030529	192396426	/nfs/dbraw/zinc/39/64/26/192396426.db2.gz	ZZHCSZPSVCSUHK-YBTHPKLGSA-N	0	3	309.412	2.327	10	0		DEAEHN
CN[C@H](C[S@@](=O)C1CCCC1)c1ccc2c(c1)OCCO2	ZINC000084052354	192397920	/nfs/dbraw/zinc/39/79/20/192397920.db2.gz	PBHXRHTVWKUVEY-SZNDQCEHSA-N	0	3	309.431	2.410	10	0		DEAEHN
Cc1oc(-c2ccsc2)nc1CC(=O)N1CC[C@H](N(C)C)C1	ZINC000170868356	197841925	/nfs/dbraw/zinc/84/19/25/197841925.db2.gz	RWXBOFCGBXPPTQ-ZDUSSCGKSA-N	0	3	319.430	2.417	10	0		DEAEHN
CCNCc1cc(F)c(F)c(S(=O)(=O)N(C)CC(C)C)c1	ZINC000138456270	186016975	/nfs/dbraw/zinc/01/69/75/186016975.db2.gz	HGBMOMMCCURBBR-UHFFFAOYSA-N	0	3	320.405	2.351	10	0		DEAEHN
CCN(C1CCCC1)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138493138	186017253	/nfs/dbraw/zinc/01/72/53/186017253.db2.gz	UEVQPWSDZPUGRL-UHFFFAOYSA-N	0	3	318.389	2.377	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N2CCC(C)(C)C2)c1	ZINC000139200274	186020773	/nfs/dbraw/zinc/02/07/73/186020773.db2.gz	ZMHAJLDFOWFOCZ-UHFFFAOYSA-N	0	3	318.389	2.105	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2cccs2)N(C[C@@H]2CCCN2CC)C1=O	ZINC000140298506	186026179	/nfs/dbraw/zinc/02/61/79/186026179.db2.gz	SXJHZMOASBURJL-KCQAQPDRSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCN1CCC[C@H]1CN1C(=O)C2(CC2)N[C@H]1c1ccsc1	ZINC000140284894	186026408	/nfs/dbraw/zinc/02/64/08/186026408.db2.gz	QZFYXDDRBLXALQ-UONOGXRCSA-N	0	3	305.447	2.195	10	0		DEAEHN
Cc1c(NN)ncnc1OCc1cccc(Br)c1	ZINC000147822627	186041862	/nfs/dbraw/zinc/04/18/62/186041862.db2.gz	RHZKFEZLBBKOMF-UHFFFAOYSA-N	0	3	309.167	2.412	10	0		DEAEHN
CN1CCCC[C@H]1CN1C(=O)C2(CC2)N[C@H]1c1ccsc1	ZINC000144334021	186035303	/nfs/dbraw/zinc/03/53/03/186035303.db2.gz	VJFRSMUXSIAUEI-UONOGXRCSA-N	0	3	305.447	2.195	10	0		DEAEHN
CN1CC[C@@H](N2C(=O)C3(CCCC3)N[C@H]2c2ccsc2)C1	ZINC000145216310	186036491	/nfs/dbraw/zinc/03/64/91/186036491.db2.gz	HRKOFVPIQOKVGI-ZIAGYGMSSA-N	0	3	305.447	2.195	10	0		DEAEHN
Cc1ccc([C@H]2NCC(=O)N2C[C@H](C)N2CCCCC2)s1	ZINC000145700624	186037718	/nfs/dbraw/zinc/03/77/18/186037718.db2.gz	OYPVRGSOEGRIGV-LRDDRELGSA-N	0	3	307.463	2.361	10	0		DEAEHN
CN[C@H](C[C@H]1CN(C)CCN1C)c1ccc(F)c(F)c1F	ZINC000149555007	186051181	/nfs/dbraw/zinc/05/11/81/186051181.db2.gz	LIIFYOHZVFKSHB-GXFFZTMASA-N	0	3	301.356	2.000	10	0		DEAEHN
CN[C@@H](c1cccc(OC(F)(F)F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000150093111	186054422	/nfs/dbraw/zinc/05/44/22/186054422.db2.gz	GZPINDMAPOUQIS-PWSUYJOCSA-N	0	3	323.336	2.280	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1coc(Br)c1	ZINC000268103099	539794022	/nfs/dbraw/zinc/79/40/22/539794022.db2.gz	IDWZGSKKHZCJAQ-JTQLQIEISA-N	0	3	301.184	2.208	10	0		DEAEHN
CCc1nn(C)c(Cl)c1C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000155710162	186105846	/nfs/dbraw/zinc/10/58/46/186105846.db2.gz	HQKNLFGFEORYPK-CMPLNLGQSA-N	0	3	312.845	2.094	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@](C)(O)c1ccccc1Cl)N(C)C	ZINC000155865776	186119078	/nfs/dbraw/zinc/11/90/78/186119078.db2.gz	TVTDMZZPRSZTSC-HOCLYGCPSA-N	0	3	312.841	2.394	10	0		DEAEHN
COc1ccc(CNC[C@@H](C)[S@@](C)=O)cc1OC(F)F	ZINC000159644972	186132462	/nfs/dbraw/zinc/13/24/62/186132462.db2.gz	XYTHRWYYNHRCEQ-YBYGRFCBSA-N	0	3	307.362	2.153	10	0		DEAEHN
CCOC(=O)NCCNCc1cc(Br)cs1	ZINC000163929544	186142800	/nfs/dbraw/zinc/14/28/00/186142800.db2.gz	BFUJBIVOARURSW-UHFFFAOYSA-N	0	3	307.213	2.346	10	0		DEAEHN
C[C@@H]1C[C@H](C)N(S(=O)(=O)c2ccc(CN)c(Cl)c2)C1	ZINC000164243459	186153113	/nfs/dbraw/zinc/15/31/13/186153113.db2.gz	LYHMFIUILXHAML-ZJUUUORDSA-N	0	3	302.827	2.218	10	0		DEAEHN
CCN1CCO[C@@H](CN)[C@@H]1c1ccc(C)cc1Br	ZINC000164306783	186155280	/nfs/dbraw/zinc/15/52/80/186155280.db2.gz	NJEBUPNAIIAYQO-KBPBESRZSA-N	0	3	313.239	2.478	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NC(=O)N1CCC[C@@H](N(C)C)C1	ZINC000173344478	186178704	/nfs/dbraw/zinc/17/87/04/186178704.db2.gz	HPIBMPXOJMCGPG-DOTOQJQBSA-N	0	3	319.449	2.327	10	0		DEAEHN
CSCc1cccc(CNC(=O)NC[C@@H]2CCCN2C)c1	ZINC000189964163	186256376	/nfs/dbraw/zinc/25/63/76/186256376.db2.gz	SWBHFJUEPSLKOB-HNNXBMFYSA-N	0	3	307.463	2.443	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2cnc(-c3ccco3)s2)CCO1	ZINC000194295442	186277963	/nfs/dbraw/zinc/27/79/63/186277963.db2.gz	NHRKACYOUSFGCL-LBPRGKRZSA-N	0	3	307.419	2.166	10	0		DEAEHN
CC(C)Cc1nnc(NC(=O)N2CCN3CCC[C@H]3C2)s1	ZINC000171886639	198000871	/nfs/dbraw/zinc/00/08/71/198000871.db2.gz	BNXKPRABZRNOSI-NSHDSACASA-N	0	3	309.439	2.049	10	0		DEAEHN
CC(=O)Nc1ccc(C)c(NC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000171889820	198002290	/nfs/dbraw/zinc/00/22/90/198002290.db2.gz	LVLWLQXQLCKVGF-OAHLLOKOSA-N	0	3	316.405	2.265	10	0		DEAEHN
CC(=O)c1ccccc1OCCN1C[C@H]2CCCN2C[C@@H]1C	ZINC000172081937	198036916	/nfs/dbraw/zinc/03/69/16/198036916.db2.gz	HGDGBSHEGUKFJG-GOEBONIOSA-N	0	3	302.418	2.437	10	0		DEAEHN
CCC[C@@H](NC(=O)N1CCO[C@@H](CN(C)C)C1)c1ccccc1	ZINC000172116231	198041652	/nfs/dbraw/zinc/04/16/52/198041652.db2.gz	HGKYBWDBUOKYQE-DLBZAZTESA-N	0	3	319.449	2.500	10	0		DEAEHN
COc1cccc(C(=O)N2CCC[N@@H+](C3CCCC3)CC2)c1[O-]	ZINC000172413090	198094225	/nfs/dbraw/zinc/09/42/25/198094225.db2.gz	LMOQAMFVACBRDV-UHFFFAOYSA-N	0	3	318.417	2.491	10	0		DEAEHN
COc1cccc(C(=O)N2CCC[N@H+](C3CCCC3)CC2)c1[O-]	ZINC000172413090	198094226	/nfs/dbraw/zinc/09/42/26/198094226.db2.gz	LMOQAMFVACBRDV-UHFFFAOYSA-N	0	3	318.417	2.491	10	0		DEAEHN
C[C@@H]1CSCCN1C(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000172559240	198115034	/nfs/dbraw/zinc/11/50/34/198115034.db2.gz	ZOFUZSKOKOWVDJ-ZBFHGGJFSA-N	0	3	321.490	2.306	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)CCCS(=O)(=O)c2ccccc2)CCN1C	ZINC000172846463	198157372	/nfs/dbraw/zinc/15/73/72/198157372.db2.gz	NQTFLDASUJODRU-CVEARBPZSA-N	0	3	324.490	2.265	10	0		DEAEHN
CCc1ccc([C@@H]2CCCCN2CCCC(=O)NC(N)=O)o1	ZINC000172871084	198160307	/nfs/dbraw/zinc/16/03/07/198160307.db2.gz	XCTZXZHHBGRAOK-ZDUSSCGKSA-N	0	3	307.394	2.344	10	0		DEAEHN
O=C(Nc1ccc2c(c1)CNC2)N1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000333099088	539948631	/nfs/dbraw/zinc/94/86/31/539948631.db2.gz	ANKQPHJAYXNYHK-CRAIPNDOSA-N	0	3	315.417	2.449	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCCc2ccccc2F)CCN1C	ZINC000173441468	198215270	/nfs/dbraw/zinc/21/52/70/198215270.db2.gz	NFCHJFZKIJOORC-DZGCQCFKSA-N	0	3	307.413	2.492	10	0		DEAEHN
Cc1cc2cc(C(=O)N3CCO[C@@H](CN(C)C)C3)oc2cc1C	ZINC000173521291	198223259	/nfs/dbraw/zinc/22/32/59/198223259.db2.gz	XEDKHOICLXWNJC-HNNXBMFYSA-N	0	3	316.401	2.452	10	0		DEAEHN
COCCCN(C)CCNC(=O)N[C@@H](C)c1ccccc1C	ZINC000173578984	198230320	/nfs/dbraw/zinc/23/03/20/198230320.db2.gz	ITEKLQPGFRLUML-HNNXBMFYSA-N	0	3	307.438	2.324	10	0		DEAEHN
Cc1ccccc1O[C@@H](C)CNC(=O)N1CC[C@@H](N(C)C)C1	ZINC000173916911	198267729	/nfs/dbraw/zinc/26/77/29/198267729.db2.gz	OGYCRSFAPCDYGU-LSDHHAIUSA-N	0	3	305.422	2.108	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)N2CCN(c3ccncc3)CC2)c1	ZINC000024086721	354063889	/nfs/dbraw/zinc/06/38/89/354063889.db2.gz	IYAVEWVWPGTAFP-UHFFFAOYSA-N	0	3	324.384	2.002	10	0		DEAEHN
CCOC[C@@H]1CCCN(C(=O)N[C@H](CC(C)C)CN(C)C)C1	ZINC000073203347	191291833	/nfs/dbraw/zinc/29/18/33/191291833.db2.gz	ALICMFHHAIKYAD-HZPDHXFCSA-N	0	3	313.486	2.421	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCOC[C@H]1CC(C)C	ZINC000073203327	191291975	/nfs/dbraw/zinc/29/19/75/191291975.db2.gz	RNXFTCPGLMTBHC-HZPDHXFCSA-N	0	3	313.486	2.419	10	0		DEAEHN
CCC[C@H](N)C(=O)N(Cc1ccccc1)C[C@H](O)c1ccco1	ZINC000236796512	202014401	/nfs/dbraw/zinc/01/44/01/202014401.db2.gz	JHEJZZWONBURBW-HOTGVXAUSA-N	0	3	316.401	2.469	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)N(C)CCN2CCCC2)c1	ZINC000072591172	354908395	/nfs/dbraw/zinc/90/83/95/354908395.db2.gz	IHGREPOADQLVRA-UHFFFAOYSA-N	0	3	318.421	2.229	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)C2C[C@H]3CCC[C@@H](C2)C3=O)CCN1C	ZINC000247159544	291059864	/nfs/dbraw/zinc/05/98/64/291059864.db2.gz	AJTHJEZXIQBCKZ-DRFQVBMSSA-N	0	3	306.450	2.323	10	0		DEAEHN
CC1CCN(C(=O)CN[C@]2(CO)C[C@H](C)CC(C)(C)C2)CC1	ZINC000080903319	355391288	/nfs/dbraw/zinc/39/12/88/355391288.db2.gz	CSUOSHIGYPTWOI-CRAIPNDOSA-N	0	3	310.482	2.412	10	0		DEAEHN
CN1CCC[C@H]1c1ccc(Nc2cc(Cl)nn(C)c2=O)nc1	ZINC000114215793	355761541	/nfs/dbraw/zinc/76/15/41/355761541.db2.gz	ZVEBUHDXTUSVLU-LBPRGKRZSA-N	0	3	319.796	2.339	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC(=O)NC[C@H]2CCCN2C)c1	ZINC000139416316	355876605	/nfs/dbraw/zinc/87/66/05/355876605.db2.gz	OZBYDHYZSYCXGO-QWHCGFSZSA-N	0	3	321.421	2.158	10	0		DEAEHN
Cn1c2ccccc2nc1-c1cc(N2CCNCC2)ncc1F	ZINC000168768992	355978014	/nfs/dbraw/zinc/97/80/14/355978014.db2.gz	AMNZFIMLHLBDOQ-UHFFFAOYSA-N	0	3	311.364	2.184	10	0		DEAEHN
C[C@H]1CC[C@H](C(N)=O)CN1Cc1cnn(Cc2ccccc2)c1	ZINC000179420484	356025651	/nfs/dbraw/zinc/02/56/51/356025651.db2.gz	QCOLLIXYVFGQEK-YOEHRIQHSA-N	0	3	312.417	2.017	10	0		DEAEHN
CC1(C)[C@@H]2CC[C@@](C)(C2)[C@@H]1NS(=O)(=O)C[C@@H]1CCCCN1	ZINC000080156934	192007052	/nfs/dbraw/zinc/00/70/52/192007052.db2.gz	YZDFCZKNTWKVFA-CTASWTNQSA-N	0	3	314.495	2.263	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCc1cc(Cl)cc2c1OCC2	ZINC000183686183	356178169	/nfs/dbraw/zinc/17/81/69/356178169.db2.gz	ANPUTHZQEALCJH-AWEZNQCLSA-N	0	3	323.824	2.168	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)Nc2ncn(C3CCCCC3)n2)C1	ZINC000184623554	356195026	/nfs/dbraw/zinc/19/50/26/356195026.db2.gz	JHRODVDRJRLERJ-CYBMUJFWSA-N	0	3	320.441	2.247	10	0		DEAEHN
NCc1nccc(OC(F)(F)F)c1I	ZINC000238611533	356304052	/nfs/dbraw/zinc/30/40/52/356304052.db2.gz	JSROMDOMEIRJNJ-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
NCc1cc(I)cc(OC(F)(F)F)n1	ZINC000238664621	356304997	/nfs/dbraw/zinc/30/49/97/356304997.db2.gz	BPTJUXAUZPKVDE-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
COC[C@@H]1CCN([C@@H](CN)c2cc3c(c(Cl)c2)OCO3)C1	ZINC000081049291	192219255	/nfs/dbraw/zinc/21/92/55/192219255.db2.gz	IDCPYOGHVYWEEL-MFKMUULPSA-N	0	3	312.797	2.037	10	0		DEAEHN
Cc1noc([C@@H]2CC[C@H](CNCc3cnc4ccccn34)O2)n1	ZINC000328618706	356460555	/nfs/dbraw/zinc/46/05/55/356460555.db2.gz	DYLTXZPZUBWIHU-KGLIPLIRSA-N	0	3	313.361	2.036	10	0		DEAEHN
CN[C@@H](CCN1CCn2cnnc2C1)c1ccccc1Cl	ZINC000081541504	192286854	/nfs/dbraw/zinc/28/68/54/192286854.db2.gz	XLZUQLYWFDYDFQ-AWEZNQCLSA-N	0	3	305.813	2.098	10	0		DEAEHN
CCC[C@H](N)C(=O)Nc1nc(-c2cccc(OC)c2)ns1	ZINC000236959923	202095692	/nfs/dbraw/zinc/09/56/92/202095692.db2.gz	LSEOTYAGWQMNMI-NSHDSACASA-N	0	3	306.391	2.280	10	0		DEAEHN
C/C=C\c1ccc(OCC(=O)N2CCN[C@H](C)[C@@H]2C)c(OC)c1	ZINC000578870396	356884966	/nfs/dbraw/zinc/88/49/66/356884966.db2.gz	PEAOJHGQZOMTAZ-QJTIAFMVSA-N	0	3	318.417	2.316	10	0		DEAEHN
COc1nc2sccn2c1CNC[C@@]1(O)CCC[C@@H](C)C1	ZINC000087050851	192617453	/nfs/dbraw/zinc/61/74/53/192617453.db2.gz	UYOBLNJPBDYXNJ-IAQYHMDHSA-N	0	3	309.435	2.435	10	0		DEAEHN
CNCc1cc(F)c(C)c(S(=O)(=O)N(C)[C@@H](C)C2CC2)c1	ZINC000088962212	192671419	/nfs/dbraw/zinc/67/14/19/192671419.db2.gz	PTXMYFTYMKFSQQ-NSHDSACASA-N	0	3	314.426	2.273	10	0		DEAEHN
Cc1ccc2c(c1)[C@@H](NC(=O)NCCNc1ccncc1)CC2	ZINC000592550833	357901069	/nfs/dbraw/zinc/90/10/69/357901069.db2.gz	IHNUNRNMTOGHQG-KRWDZBQOSA-N	0	3	310.401	2.211	10	0		DEAEHN
C[C@@H]1CN(C/C=C/c2ccc(F)cc2)C[C@@H]1N1CCOCC1	ZINC000180232306	199133834	/nfs/dbraw/zinc/13/38/34/199133834.db2.gz	NPFRMSZNGHEVIQ-LDRXLRCLSA-N	0	3	304.409	2.491	10	0		DEAEHN
C[C@H](N[C@@H]1CCc2ncnn2C1)c1cnn(Cc2ccccc2)c1	ZINC000180580934	199179521	/nfs/dbraw/zinc/17/95/21/199179521.db2.gz	OPILHUJNVBVQDW-WMLDXEAASA-N	0	3	322.416	2.189	10	0		DEAEHN
CC[C@H](C)Oc1cc(CNC(=O)N2CC[C@H](N(C)C)C2)ccn1	ZINC000180668257	199193222	/nfs/dbraw/zinc/19/32/22/199193222.db2.gz	ANORSKXMOMAEAU-ZFWWWQNUSA-N	0	3	320.437	2.104	10	0		DEAEHN
CCOC(=O)[C@H]1CCCCN1C(=O)CN[C@H](C)c1cccs1	ZINC000180928508	199229255	/nfs/dbraw/zinc/22/92/55/199229255.db2.gz	JWJJERDQRBLTPM-CHWSQXEVSA-N	0	3	324.446	2.343	10	0		DEAEHN
C[C@H](CCCc1ccccc1)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000180862653	199220193	/nfs/dbraw/zinc/22/01/93/199220193.db2.gz	ZIYRQXBQVRNSHE-SJLPKXTDSA-N	0	3	318.461	2.434	10	0		DEAEHN
NC1(C(=O)N2CC3(CCC3)c3c2cccc3F)CCOCC1	ZINC000261847607	283398264	/nfs/dbraw/zinc/39/82/64/283398264.db2.gz	MDRICMHXBBAAPA-UHFFFAOYSA-N	0	3	304.365	2.102	10	0		DEAEHN
Cn1ccnc1[C@@H]1OCC[C@H]1CNCc1noc2c1CCCC2	ZINC000668174609	540607971	/nfs/dbraw/zinc/60/79/71/540607971.db2.gz	RZIHFEMSALAGKL-BLLLJJGKSA-N	0	3	316.405	2.154	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N1CCC[C@H](N(C)C)C1	ZINC000187922248	200176523	/nfs/dbraw/zinc/17/65/23/200176523.db2.gz	JWLJULVQJXYUPI-AWEZNQCLSA-N	0	3	309.385	2.070	10	0		DEAEHN
C[C@@H](NC[C@@H](O)CC(F)(F)F)c1ccc2c(c1)OCCO2	ZINC000189343364	200384819	/nfs/dbraw/zinc/38/48/19/200384819.db2.gz	DSSTYQZTXPCALO-KOLCDFICSA-N	0	3	305.296	2.422	10	0		DEAEHN
COC(=O)[C@H](C1CC1)N1CCCN(Cc2ccccc2C)CC1	ZINC000611660064	361654573	/nfs/dbraw/zinc/65/45/73/361654573.db2.gz	NMLMMVRYLBADGM-SFHVURJKSA-N	0	3	316.445	2.454	10	0		DEAEHN
CC(=O)N1CC[C@@H](NCCc2nc(C)no2)c2ccccc21	ZINC000621754382	364536343	/nfs/dbraw/zinc/53/63/43/364536343.db2.gz	DFQWFVYITYFQHM-CQSZACIVSA-N	0	3	300.362	2.008	10	0		DEAEHN
O=C(C[C@H]1CNCCO1)Nc1nc2ccc(Cl)cc2s1	ZINC000091298925	193033686	/nfs/dbraw/zinc/03/36/86/193033686.db2.gz	YAJGKUIYIHHEKQ-VIFPVBQESA-N	0	3	311.794	2.267	10	0		DEAEHN
CC(C)NCc1c(N(C)CC2CC(O)C2)nc2sccn12	ZINC000091451382	193058436	/nfs/dbraw/zinc/05/84/36/193058436.db2.gz	LWUVSRXTQMSHKB-UHFFFAOYSA-N	0	3	308.451	2.101	10	0		DEAEHN
COCCNCc1cnn(-c2ccccn2)c1C(F)(F)F	ZINC000091335624	193041277	/nfs/dbraw/zinc/04/12/77/193041277.db2.gz	UFHRLTHPYYEWDP-UHFFFAOYSA-N	0	3	300.284	2.022	10	0		DEAEHN
CCS(=O)(=O)CCC[C@H](O)C1(N(C)C)CCC(C)CC1	ZINC000091648627	193085292	/nfs/dbraw/zinc/08/52/92/193085292.db2.gz	JTAVOHWATPJGPL-SLTAFYQDSA-N	0	3	305.484	2.073	10	0		DEAEHN
Nc1c2ncsc2ccc1NC[C@H]1CN2CCC[C@@H]2CO1	ZINC000091662814	193086676	/nfs/dbraw/zinc/08/66/76/193086676.db2.gz	BQDIQVVAXIUISU-MNOVXSKESA-N	0	3	304.419	2.154	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)N1CCCC[C@H]1c1nccs1	ZINC000133672418	283864073	/nfs/dbraw/zinc/86/40/73/283864073.db2.gz	SFKCUYCZRFWSEA-NEPJUHHUSA-N	0	3	311.476	2.292	10	0		DEAEHN
CC(C)CCCNC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000091845869	193116666	/nfs/dbraw/zinc/11/66/66/193116666.db2.gz	DCXUXKDPMDCDOS-KRWDZBQOSA-N	0	3	324.513	2.234	10	0		DEAEHN
C[C@@H]1CN(C2CCN(Cc3cnn(C(C)(C)C)c3)CC2)CCO1	ZINC000092091161	193156291	/nfs/dbraw/zinc/15/62/91/193156291.db2.gz	YFGIJBGRCRLAER-OAHLLOKOSA-N	0	3	320.481	2.323	10	0		DEAEHN
CCNCc1csc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)c1	ZINC000092113453	193161066	/nfs/dbraw/zinc/16/10/66/193161066.db2.gz	CXSSRQHABRSTPE-QWRGUYRKSA-N	0	3	302.465	2.134	10	0		DEAEHN
CCNCc1ccc(F)c(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)c1	ZINC000092113457	193161892	/nfs/dbraw/zinc/16/18/92/193161892.db2.gz	PLDXHFDLOIEUHN-TXEJJXNPSA-N	0	3	314.426	2.212	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2cc(Cl)cc(CN)c2F)C[C@@H]1C	ZINC000092113812	193161923	/nfs/dbraw/zinc/16/19/23/193161923.db2.gz	GFVUCGZRJHPEKB-IUCAKERBSA-N	0	3	320.817	2.214	10	0		DEAEHN
C[C@@H](N(C)S(=O)(=O)c1ccc(CN)cc1F)C(C)(C)C	ZINC000092115979	193164270	/nfs/dbraw/zinc/16/42/70/193164270.db2.gz	WXEJCIGJJOSSEN-SNVBAGLBSA-N	0	3	302.415	2.340	10	0		DEAEHN
O[C@H]1COCC[C@H]1NCc1cccc(Br)c1Cl	ZINC000631182960	368066794	/nfs/dbraw/zinc/06/67/94/368066794.db2.gz	GPQZPKKOEZKMPE-MNOVXSKESA-N	0	3	320.614	2.342	10	0		DEAEHN
COc1c(CN2CCN(CCC(C)(C)C)CC2)c(C)nn1C	ZINC000092219418	193175902	/nfs/dbraw/zinc/17/59/02/193175902.db2.gz	SGFWMMSVYBWXKL-UHFFFAOYSA-N	0	3	308.470	2.291	10	0		DEAEHN
COC[C@H](O)CN1CC[C@H](c2cccc(Br)c2)C1	ZINC000451573226	243141332	/nfs/dbraw/zinc/14/13/32/243141332.db2.gz	UFUGFHILBFHKPD-GXTWGEPZSA-N	0	3	314.223	2.246	10	0		DEAEHN
CC[C@@H](C)N[C@@H](CNC(=O)Cc1cn(C)nc1C)c1ccco1	ZINC000451676579	243295075	/nfs/dbraw/zinc/29/50/75/243295075.db2.gz	SSNMNEGJQCDPSS-DOMZBBRYSA-N	0	3	318.421	2.110	10	0		DEAEHN
CCN(CC(C)(C)O)[C@@H](C)C(=O)Nc1ccc(Cl)cc1N	ZINC000092964563	193189665	/nfs/dbraw/zinc/18/96/65/193189665.db2.gz	ASWPJEYZTBEACF-JTQLQIEISA-N	0	3	313.829	2.342	10	0		DEAEHN
CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)[C@H](N)CCSC	ZINC000262125844	203206006	/nfs/dbraw/zinc/20/60/06/203206006.db2.gz	LJQWSGZKHLTNTA-HONMWMINSA-N	0	3	314.426	2.098	10	0		DEAEHN
O=C(Nc1ccc(OCC2CCCCC2)cc1)[C@@H]1C[C@H](O)CN1	ZINC000262526591	203320509	/nfs/dbraw/zinc/32/05/09/203320509.db2.gz	OTWZMXAUQMVZPF-RDJZCZTQSA-N	0	3	318.417	2.307	10	0		DEAEHN
Cc1ccc(-c2nc(NC(=O)[C@@H]3C[C@H](O)CN3)sc2C)s1	ZINC000262549668	203326270	/nfs/dbraw/zinc/32/62/70/203326270.db2.gz	ONFVMUCZALKRQG-UWVGGRQHSA-N	0	3	323.443	2.150	10	0		DEAEHN
CN[C@H](Cc1cc(Br)ccc1OC)C(OC)OC	ZINC000093304942	193227211	/nfs/dbraw/zinc/22/72/11/193227211.db2.gz	GRSXGMYVKBQREQ-LLVKDONJSA-N	0	3	318.211	2.207	10	0		DEAEHN
NCc1c(F)cccc1Sc1nnnn1-c1ccccc1	ZINC000093395753	193243945	/nfs/dbraw/zinc/24/39/45/193243945.db2.gz	ALJHIMIOMBBWSI-UHFFFAOYSA-N	0	3	301.350	2.411	10	0		DEAEHN
CC[NH2+][C@]1(C(=O)[O-])CCC[C@@H]1CCN(C)CCC(F)(F)F	ZINC000093596069	193271524	/nfs/dbraw/zinc/27/15/24/193271524.db2.gz	ATNXNSYUBZAUKN-DGCLKSJQSA-N	0	3	310.360	2.494	10	0		DEAEHN
NC(=O)[C@@]1(N)CCC[C@@H]1CCSc1ccc(F)cc1F	ZINC000093627350	193276184	/nfs/dbraw/zinc/27/61/84/193276184.db2.gz	YFXKLOUXVGYQGL-YMTOWFKASA-N	0	3	300.374	2.430	10	0		DEAEHN
C[C@@H](NC[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1F	ZINC000093696618	193291827	/nfs/dbraw/zinc/29/18/27/193291827.db2.gz	XYYOYEPISARAOK-OLZOCXBDSA-N	0	3	314.426	2.148	10	0		DEAEHN
C[C@@]1(c2nc3cc(F)c(Br)cc3[nH]2)COC[C@H]1N	ZINC000093728892	193297871	/nfs/dbraw/zinc/29/78/71/193297871.db2.gz	GXPBDZPXMYQXRM-ZYHUDNBSSA-N	0	3	314.158	2.080	10	0		DEAEHN
CN[C@@]1(C(N)=O)CCC[C@@H](Sc2nc3ccccc3o2)C1	ZINC000093777943	193304379	/nfs/dbraw/zinc/30/43/79/193304379.db2.gz	MAYSBZNLYIKTBH-BMIGLBTASA-N	0	3	305.403	2.306	10	0		DEAEHN
Clc1cnc(Cl)nc1NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000093800357	193309533	/nfs/dbraw/zinc/30/95/33/193309533.db2.gz	NFCMSHBUAKFOGV-RKDXNWHRSA-N	0	3	303.193	2.059	10	0		DEAEHN
CCN[C@@]1(C(N)=O)CC[C@H](Sc2cc(F)ccc2F)C1	ZINC000093851294	193318187	/nfs/dbraw/zinc/31/81/87/193318187.db2.gz	SDTMABATPDVCQK-HZMBPMFUSA-N	0	3	300.374	2.443	10	0		DEAEHN
CN[C@@H](c1ccc(Cl)c(Cl)c1)[C@H]1CN(C)CCN1C	ZINC000093894637	193325655	/nfs/dbraw/zinc/32/56/55/193325655.db2.gz	ZSMHPYVTHVDKNE-KGLIPLIRSA-N	0	3	302.249	2.500	10	0		DEAEHN
CCOC(=O)c1c(NC(=O)[C@](C)(N)CC)sc2c1CCC2	ZINC000094236934	193353500	/nfs/dbraw/zinc/35/35/00/193353500.db2.gz	UIVRDZNQMCGTIN-OAHLLOKOSA-N	0	3	310.419	2.479	10	0		DEAEHN
COCCNCc1cc(Cl)c(O[C@@H](C)[C@@H](C)O)c(OC)c1	ZINC000094653298	193390793	/nfs/dbraw/zinc/39/07/93/193390793.db2.gz	AXZFTRKWMSQCKC-MNOVXSKESA-N	0	3	317.813	2.233	10	0		DEAEHN
CCS(=O)(=O)c1ccccc1NC(=O)[C@@H](CN)CC(C)C	ZINC000094697380	193391212	/nfs/dbraw/zinc/39/12/12/193391212.db2.gz	RYFUUKPQEJLGIB-GFCCVEGCSA-N	0	3	312.435	2.040	10	0		DEAEHN
CCNc1ccc(C(F)(F)F)cc1C(=O)NCCN(C)C	ZINC000094595421	193381690	/nfs/dbraw/zinc/38/16/90/193381690.db2.gz	NJXJBBSHDLKXPH-UHFFFAOYSA-N	0	3	303.328	2.429	10	0		DEAEHN
Brc1cccc(-c2cnc(N3CCNCC3)nc2)c1	ZINC000094577243	193381859	/nfs/dbraw/zinc/38/18/59/193381859.db2.gz	HJRIRUSAXQIMHN-UHFFFAOYSA-N	0	3	319.206	2.316	10	0		DEAEHN
CC1(C(=O)Nc2cc(Br)ccc2[O-])CC[NH2+]CC1	ZINC000094573600	193381935	/nfs/dbraw/zinc/38/19/35/193381935.db2.gz	XVEJZFRDLMLFHF-UHFFFAOYSA-N	0	3	313.195	2.483	10	0		DEAEHN
Brc1cccn2nc(NCCN3CCCCC3)nc12	ZINC000094604701	193383758	/nfs/dbraw/zinc/38/37/58/193383758.db2.gz	RJJYRRMDCFYERI-UHFFFAOYSA-N	0	3	324.226	2.390	10	0		DEAEHN
CCCN[C@H](C)c1cc(F)ccc1OCCS(C)(=O)=O	ZINC000094620276	193385081	/nfs/dbraw/zinc/38/50/81/193385081.db2.gz	ROOCWVQCSZFMMN-LLVKDONJSA-N	0	3	303.399	2.310	10	0		DEAEHN
N[C@H](C[S@@](=O)c1cccc(F)c1)c1ccc2c(c1)OCO2	ZINC000094625460	193385376	/nfs/dbraw/zinc/38/53/76/193385376.db2.gz	UDABKWFYAVNIHB-ASSNKEHSSA-N	0	3	307.346	2.362	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@H]1NCc1ccc(Br)c(F)c1	ZINC000282480408	217026700	/nfs/dbraw/zinc/02/67/00/217026700.db2.gz	VHRXSVSMGZTDGJ-PRHODGIISA-N	0	3	315.186	2.345	10	0		DEAEHN
CCc1nn(CC)c(C[C@H](N)c2ccnnc2)c1Br	ZINC000097281146	193703472	/nfs/dbraw/zinc/70/34/72/193703472.db2.gz	WBCOQXLSDGBGLH-JTQLQIEISA-N	0	3	324.226	2.260	10	0		DEAEHN
CC[C@@H]1CN(c2ncnc3ccc(C)cc32)CCN1C[C@H](C)O	ZINC000266369191	205297311	/nfs/dbraw/zinc/29/73/11/205297311.db2.gz	LJRBNSKVMYYSOJ-LSDHHAIUSA-N	0	3	314.433	2.220	10	0		DEAEHN
Cc1ncc(CN2CCC[C@@H](N3CCC(CO)CC3)C2)s1	ZINC000019837275	182154899	/nfs/dbraw/zinc/15/48/99/182154899.db2.gz	NZKFWSGWIAPHCC-OAHLLOKOSA-N	0	3	309.479	2.120	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2ccc(OC(F)F)cc2)C[C@@H](C)O1	ZINC000020081633	182185046	/nfs/dbraw/zinc/18/50/46/182185046.db2.gz	ZUOUGDPMBANCCL-GYSYKLTISA-N	0	3	300.349	2.397	10	0		DEAEHN
Cc1ccc(CN)cc1S(=O)(=O)NCc1ccc(F)cc1	ZINC000020189414	182195721	/nfs/dbraw/zinc/19/57/21/182195721.db2.gz	NHGQYWNDLMJNRZ-UHFFFAOYSA-N	0	3	308.378	2.071	10	0		DEAEHN
COCCN1CCC(NC(=O)NCC2CCCCCC2)CC1	ZINC000454631507	246005214	/nfs/dbraw/zinc/00/52/14/246005214.db2.gz	NTJSMUXKHRWRAU-UHFFFAOYSA-N	0	3	311.470	2.367	10	0		DEAEHN
C[C@@H](CNC(=O)N1C[C@@H](C)O[C@H](c2ccccc2)C1)N(C)C	ZINC000455430151	246580540	/nfs/dbraw/zinc/58/05/40/246580540.db2.gz	JLGWKBDMLDMQCA-LZWOXQAQSA-N	0	3	305.422	2.108	10	0		DEAEHN
CC[C@H](CNCc1c(Br)cnn1C)N1CCCC1	ZINC000486980444	248741854	/nfs/dbraw/zinc/74/18/54/248741854.db2.gz	JBTPQTUVGUUMFN-LLVKDONJSA-N	0	3	315.259	2.147	10	0		DEAEHN
CC[C@@H](Oc1ccccc1C)C(=O)NCCNc1ccncc1	ZINC000488532402	248800989	/nfs/dbraw/zinc/80/09/89/248800989.db2.gz	NILQGGOLGFQGTP-MRXNPFEDSA-N	0	3	313.401	2.198	10	0		DEAEHN
OC[C@H](NC[C@@H]1CCCO1)c1cc(Br)cs1	ZINC000041678622	183215865	/nfs/dbraw/zinc/21/58/65/183215865.db2.gz	PBOSYOJBHUIVMQ-UWVGGRQHSA-N	0	3	306.225	2.313	10	0		DEAEHN
CC(C)[N@H+](C)CCCC[N-]S(=O)(=O)c1ccccc1F	ZINC000041678837	183215942	/nfs/dbraw/zinc/21/59/42/183215942.db2.gz	DUFUPCWWLGHDGK-UHFFFAOYSA-N	0	3	302.415	2.224	10	0		DEAEHN
CC(C)[N@@H+](C)CCCC[N-]S(=O)(=O)c1ccccc1F	ZINC000041678837	183215945	/nfs/dbraw/zinc/21/59/45/183215945.db2.gz	DUFUPCWWLGHDGK-UHFFFAOYSA-N	0	3	302.415	2.224	10	0		DEAEHN
COC[C@@H](C)N(C)[C@@H](CN)c1ccc(Br)s1	ZINC000042318790	183254080	/nfs/dbraw/zinc/25/40/80/183254080.db2.gz	APLXOOUCFFFUOZ-BDAKNGLRSA-N	0	3	307.257	2.477	10	0		DEAEHN
CCCN(CC(=O)Nc1cccc(CN)c1)CC(F)(F)F	ZINC000042741026	183303984	/nfs/dbraw/zinc/30/39/84/183303984.db2.gz	SCSOKDVUABCHGJ-UHFFFAOYSA-N	0	3	303.328	2.358	10	0		DEAEHN
COc1ccc([C@H](CN)N(C)Cc2cscn2)c(OC)c1	ZINC000042863877	183315299	/nfs/dbraw/zinc/31/52/99/183315299.db2.gz	IBIUFEKUQLVUCX-AWEZNQCLSA-N	0	3	307.419	2.292	10	0		DEAEHN
NC[C@@H](c1ccc(Br)cc1)N1CCC(CO)CC1	ZINC000042952718	183321828	/nfs/dbraw/zinc/32/18/28/183321828.db2.gz	OPCOWTQIAISRNT-AWEZNQCLSA-N	0	3	313.239	2.153	10	0		DEAEHN
C[C@@H](N)[C@@H](c1cccs1)N1CCN(c2nccs2)CC1	ZINC000043102881	183338473	/nfs/dbraw/zinc/33/84/73/183338473.db2.gz	MQXYXONKZSXHLG-YPMHNXCESA-N	0	3	308.476	2.415	10	0		DEAEHN
C[C@H](N)[C@H](c1ccc(Cl)s1)N(C)CC(=O)NC1CC1	ZINC000043252661	183346991	/nfs/dbraw/zinc/34/69/91/183346991.db2.gz	DTTMHWWENHWEGM-ISVAXAHUSA-N	0	3	301.843	2.000	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1sccc1C)N(C)CC(=O)N1CCCC1	ZINC000043248499	183347361	/nfs/dbraw/zinc/34/73/61/183347361.db2.gz	HWPLOMQDTDAMGR-HIFRSBDPSA-N	0	3	309.479	2.389	10	0		DEAEHN
COCCN(CCOC)[C@@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043252907	183348438	/nfs/dbraw/zinc/34/84/38/183348438.db2.gz	ZMBAHFNRUOKGAO-ZWNOBZJWSA-N	0	3	306.859	2.385	10	0		DEAEHN
C[C@H](NC(=O)N1CCC[C@@H]1CN1CCCCC1)[C@H]1CCCO1	ZINC000105146490	194078893	/nfs/dbraw/zinc/07/88/93/194078893.db2.gz	RUZJGLVQZKBYRY-ARFHVFGLSA-N	0	3	309.454	2.214	10	0		DEAEHN
Cc1ccccc1OCCCN1CCN(C[C@@H](C)O)[C@H](C)C1	ZINC000105824585	194137997	/nfs/dbraw/zinc/13/79/97/194137997.db2.gz	AJAKBBGYLCOBEQ-IAGOWNOFSA-N	0	3	306.450	2.151	10	0		DEAEHN
COCCN1CCN(CCCOc2ccc(F)cc2)C[C@H]1C	ZINC000105832533	194139924	/nfs/dbraw/zinc/13/99/24/194139924.db2.gz	HQSLSMDSQRNGOZ-OAHLLOKOSA-N	0	3	310.413	2.247	10	0		DEAEHN
CCCCCNC(=O)[C@@H](C)N[C@@H]1CCc2nc(C(C)C)nn2C1	ZINC000105874071	194152997	/nfs/dbraw/zinc/15/29/97/194152997.db2.gz	HSMDZXWWQVRMAQ-ZIAGYGMSSA-N	0	3	321.469	2.001	10	0		DEAEHN
Cn1cnnc1CCNCc1ccc(F)c(Br)c1	ZINC000109421147	194263066	/nfs/dbraw/zinc/26/30/66/194263066.db2.gz	HGBWIBQGOCCTIG-UHFFFAOYSA-N	0	3	313.174	2.049	10	0		DEAEHN
CCC[C@H](C(N)=S)N1CCN(CCc2ccccc2)CC1	ZINC000109470428	194266463	/nfs/dbraw/zinc/26/64/63/194266463.db2.gz	NPNRVIZDFRNOFQ-MRXNPFEDSA-N	0	3	305.491	2.302	10	0		DEAEHN
Cc1ccc(C)c(CN2CCN(C(C)(C)C(N)=S)CC2)c1	ZINC000109470589	194266792	/nfs/dbraw/zinc/26/67/92/194266792.db2.gz	ROZWRJTZJKOZAK-UHFFFAOYSA-N	0	3	305.491	2.486	10	0		DEAEHN
CC[C@@H](C(N)=S)N1CCN(c2nc3ccccc3s2)CC1	ZINC000109471414	194266946	/nfs/dbraw/zinc/26/69/46/194266946.db2.gz	MCPUOAULOQSCFN-LBPRGKRZSA-N	0	3	320.487	2.483	10	0		DEAEHN
C[C@H](CO)[C@H](C)NCc1cc(Br)cc2c1OCC2	ZINC000156019701	197080881	/nfs/dbraw/zinc/08/08/81/197080881.db2.gz	OIOYUIDFALWOPL-ZJUUUORDSA-N	0	3	314.223	2.491	10	0		DEAEHN
COCC[C@H](N)C(=O)Nc1cccc(-c2csc(C)n2)c1	ZINC000052792344	183873433	/nfs/dbraw/zinc/87/34/33/183873433.db2.gz	BUNHGJJBUQQWEH-ZDUSSCGKSA-N	0	3	305.403	2.421	10	0		DEAEHN
CCNCc1c(N2CCN(C)[C@@H](CC)C2)nc2sccn12	ZINC000110730698	194354909	/nfs/dbraw/zinc/35/49/09/194354909.db2.gz	RCHCWMOPCNYQTE-LBPRGKRZSA-N	0	3	307.467	2.036	10	0		DEAEHN
CN([C@H]1CCCNC1)S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000110927855	194369838	/nfs/dbraw/zinc/36/98/38/194369838.db2.gz	LFXKBFJNFLRRJV-VIFPVBQESA-N	0	3	323.245	2.366	10	0		DEAEHN
C[NH2+][C@H](C)c1cccc(S(=O)(=O)[N-]c2ccncc2C)c1	ZINC000111043898	194385817	/nfs/dbraw/zinc/38/58/17/194385817.db2.gz	JRFHBMNAULXDQE-GFCCVEGCSA-N	0	3	305.403	2.471	10	0		DEAEHN
CCCOc1nc(Cl)nc(N(CCC)CCN(C)C)n1	ZINC000061541610	184174334	/nfs/dbraw/zinc/17/43/34/184174334.db2.gz	BUWASBOIXRCNEX-UHFFFAOYSA-N	0	3	301.822	2.092	10	0		DEAEHN
COc1ccc(CCC(=O)N2CCCN(C3CC3)CC2)cc1	ZINC000061605618	184176890	/nfs/dbraw/zinc/17/68/90/184176890.db2.gz	MDSOECPTBOKARH-UHFFFAOYSA-N	0	3	302.418	2.325	10	0		DEAEHN
CCCC(CCC)(C(N)=S)C(=O)N1CCC[C@H]1CN(C)C	ZINC000061646165	184181387	/nfs/dbraw/zinc/18/13/87/184181387.db2.gz	IEDWNPNKPLGAOF-ZDUSSCGKSA-N	0	3	313.511	2.412	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2ccccc2OC(F)F)CCCO1	ZINC000061916122	184195320	/nfs/dbraw/zinc/19/53/20/184195320.db2.gz	DLSGCMANMGAJKC-YPMHNXCESA-N	0	3	300.349	2.399	10	0		DEAEHN
C[C@H]([C@@H](N)c1ccccc1)N1CCN(CC(F)(F)F)CC1	ZINC000061941123	184197292	/nfs/dbraw/zinc/19/72/92/184197292.db2.gz	XZULCUSBCSEWFZ-TZMCWYRMSA-N	0	3	301.356	2.255	10	0		DEAEHN
COCCCN(C)[C@H](CN)c1cc(Br)cs1	ZINC000062029497	184202207	/nfs/dbraw/zinc/20/22/07/184202207.db2.gz	WJTXDVLUMZVFEG-SNVBAGLBSA-N	0	3	307.257	2.479	10	0		DEAEHN
CC(C)(C)NCc1c(N2CCC[C@H](O)C2)nc2sccn12	ZINC000062737122	184251632	/nfs/dbraw/zinc/25/16/32/184251632.db2.gz	FTAXPYTWLAHVJY-NSHDSACASA-N	0	3	308.451	2.245	10	0		DEAEHN
[NH3+][C@H]1CCCCC[C@@H]1[N-]S(=O)(=O)c1ccc(F)cc1Cl	ZINC000063213334	184278269	/nfs/dbraw/zinc/27/82/69/184278269.db2.gz	SLFPQXLHEASMNM-RYUDHWBXSA-N	0	3	320.817	2.417	10	0		DEAEHN
CCCC(CCC)(C(N)=S)C(=O)N(C)CCN1CCCC1	ZINC000063053390	184268618	/nfs/dbraw/zinc/26/86/18/184268618.db2.gz	NENWPAAVNPASDM-UHFFFAOYSA-N	0	3	313.511	2.413	10	0		DEAEHN
COc1cc(CN[C@@H](C)CC(N)=O)ccc1OCCC(C)C	ZINC000066147804	184392728	/nfs/dbraw/zinc/39/27/28/184392728.db2.gz	MBRVZCPHGDRDAZ-ZDUSSCGKSA-N	0	3	308.422	2.474	10	0		DEAEHN
CNC(=O)c1cccc(C(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000185420712	207365749	/nfs/dbraw/zinc/36/57/49/207365749.db2.gz	MYVFTSZPIRWUMK-CQSZACIVSA-N	0	3	317.433	2.041	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)[C@@H]1CCCC[C@H]1C	ZINC000247479478	285020298	/nfs/dbraw/zinc/02/02/98/285020298.db2.gz	JDHFWXZXARDCBB-BZUAXINKSA-N	0	3	311.470	2.317	10	0		DEAEHN
COCOc1ccc(OC)cc1CN[C@H]1CCCC[C@@H]1CO	ZINC000120009890	195080231	/nfs/dbraw/zinc/08/02/31/195080231.db2.gz	NZNQCEZKNRSUMP-CJNGLKHVSA-N	0	3	309.406	2.319	10	0		DEAEHN
c1nc(N2CCCC2)ncc1CN1CCC[C@@H]2COCC[C@@H]21	ZINC000538790546	285056147	/nfs/dbraw/zinc/05/61/47/285056147.db2.gz	ITIOLBNPVZJFOV-CVEARBPZSA-N	0	3	302.422	2.078	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC[C@@H](C)C(C)C)cc(CN)c1F	ZINC000159121789	197329019	/nfs/dbraw/zinc/32/90/19/197329019.db2.gz	ZGHGRQHWPBTYAW-LLVKDONJSA-N	0	3	302.415	2.163	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1cc(OC)c(Cl)cc1OC	ZINC000159095330	197326494	/nfs/dbraw/zinc/32/64/94/197326494.db2.gz	JOZCBSAHIBBLNE-JTQLQIEISA-N	0	3	316.785	2.050	10	0		DEAEHN
COc1cc2c(cc1[C@@H](CN)N1CCSCC1)O[C@H](C)C2	ZINC000159053700	197322679	/nfs/dbraw/zinc/32/26/79/197322679.db2.gz	ZNNPURILVWNACL-BXUZGUMPSA-N	0	3	308.447	2.067	10	0		DEAEHN
NC(=O)[C@@]1(NCc2ccccc2)Cc2ccc(Cl)cc2C1	ZINC000158940350	197313359	/nfs/dbraw/zinc/31/33/59/197313359.db2.gz	XKWMYWZMMBFHSJ-QGZVFWFLSA-N	0	3	300.789	2.453	10	0		DEAEHN
CCn1nc(C)c(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1Cl	ZINC000158979996	197316098	/nfs/dbraw/zinc/31/60/98/197316098.db2.gz	NHEMSGFNLIVLQZ-CMPLNLGQSA-N	0	3	312.845	2.323	10	0		DEAEHN
CN([C@@H](CN)c1ccc(Br)c(F)c1)[C@@H]1CCOC1	ZINC000158695654	197294480	/nfs/dbraw/zinc/29/44/80/197294480.db2.gz	UNFZXZANVWLZAQ-MFKMUULPSA-N	0	3	317.202	2.309	10	0		DEAEHN
COc1ccsc1[C@@H](O)c1c(Cl)cnn1CCN(C)C	ZINC000158678128	197293916	/nfs/dbraw/zinc/29/39/16/197293916.db2.gz	PSTXPDJZCLEUQJ-LBPRGKRZSA-N	0	3	315.826	2.250	10	0		DEAEHN
Cc1cc(C)c(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)cc1CN	ZINC000158736652	197298378	/nfs/dbraw/zinc/29/83/78/197298378.db2.gz	FWDWYHDEWVQFNH-KBPBESRZSA-N	0	3	308.447	2.183	10	0		DEAEHN
C[C@@H]1OCC[C@@H]1N(C)[C@@H](CN)c1ccc(Br)o1	ZINC000158628325	197289726	/nfs/dbraw/zinc/28/97/26/197289726.db2.gz	KJCNMNAPCAYISQ-GUBZILKMSA-N	0	3	303.200	2.151	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000158445361	197273442	/nfs/dbraw/zinc/27/34/42/197273442.db2.gz	OZPWEQMDPHXRSU-CABCVRRESA-N	0	3	317.433	2.183	10	0		DEAEHN
CC(C)(C)[C@@H](N)C(=O)N1CCCN(Cc2cccs2)CC1	ZINC000158280082	197259299	/nfs/dbraw/zinc/25/92/99/197259299.db2.gz	RUJCNIOEXHOSIZ-AWEZNQCLSA-N	0	3	309.479	2.156	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)Nc2cccc(C(F)F)c2)CCO1	ZINC000158150766	197248254	/nfs/dbraw/zinc/24/82/54/197248254.db2.gz	JSUPSAZFNTXTTF-CYBMUJFWSA-N	0	3	313.348	2.419	10	0		DEAEHN
O=C(CCN1CCC(n2cncn2)CC1)Nc1cccc(F)c1	ZINC000157766136	197213971	/nfs/dbraw/zinc/21/39/71/197213971.db2.gz	SDWOQOODMAJRLU-UHFFFAOYSA-N	0	3	317.368	2.083	10	0		DEAEHN
CC[C@@](C)([C@@H](O)c1c(Br)cnn1C)N1CCCC1	ZINC000157632135	197203760	/nfs/dbraw/zinc/20/37/60/197203760.db2.gz	SDQYLOMSJZSENV-STQMWFEESA-N	0	3	316.243	2.481	10	0		DEAEHN
C[C@](F)(C[C@@H]1COCCN1)[C@@H]1CCOC2(CCOCC2)C1	ZINC000157634062	197203423	/nfs/dbraw/zinc/20/34/23/197203423.db2.gz	AKGPDBADWKYGJU-KFWWJZLASA-N	0	3	301.402	2.069	10	0		DEAEHN
Cn1cc([C@H](CN)Oc2cc(F)cc(Br)c2)cn1	ZINC000157211768	197170423	/nfs/dbraw/zinc/17/04/23/197170423.db2.gz	WUZFHNGUMJPHPE-LBPRGKRZSA-N	0	3	314.158	2.401	10	0		DEAEHN
CCO[C@@H]1C[C@@](N)(C(=O)N(CC(F)(F)F)C(C)C)C1(C)C	ZINC000156952891	197152307	/nfs/dbraw/zinc/15/23/07/197152307.db2.gz	VHQOOYWREBVNMS-ZWNOBZJWSA-N	0	3	310.360	2.318	10	0		DEAEHN
C[C@@](O)(Cc1cccc(Br)c1)C[C@H]1COCCN1	ZINC000156888422	197147518	/nfs/dbraw/zinc/14/75/18/197147518.db2.gz	OHBMVMQNZXJTAL-UONOGXRCSA-N	0	3	314.223	2.121	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N1[C@H](C)CC[C@H]1C)c1nnc2n1CCCC2	ZINC000156347567	197105915	/nfs/dbraw/zinc/10/59/15/197105915.db2.gz	LOMZIGUVYAUMKE-MQYQWHSLSA-N	0	3	319.453	2.053	10	0		DEAEHN
COC(=O)C1(NC(=O)CN(C)C[C@@H]2CC=CCC2)CCCCC1	ZINC000542255406	285215484	/nfs/dbraw/zinc/21/54/84/285215484.db2.gz	YIXXXHDAXQCREK-OAHLLOKOSA-N	0	3	322.449	2.267	10	0		DEAEHN
C[C@H]1CCC[C@]2(CSC(NC[C@@H]3CCCS3(=O)=O)=N2)C1	ZINC000155416757	197053012	/nfs/dbraw/zinc/05/30/12/197053012.db2.gz	DGVPEWQYSCBBCN-SGMGOOAPSA-N	0	3	316.492	2.205	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1C	ZINC000245458708	285242155	/nfs/dbraw/zinc/24/21/55/285242155.db2.gz	CZXFOYCTTSIBAQ-QBPKDAKJSA-N	0	3	309.498	2.486	10	0		DEAEHN
Cc1nc(CN2CCN(c3ccnc4ccsc43)CC2)n[nH]1	ZINC000543208443	285274354	/nfs/dbraw/zinc/27/43/54/285274354.db2.gz	DLVLPIJCLKVRLH-UHFFFAOYSA-N	0	3	314.418	2.045	10	0		DEAEHN
CCNc1ncc(C(=O)NC[C@H]2CCCN2CC(C)C)s1	ZINC000120829015	195245394	/nfs/dbraw/zinc/24/53/94/195245394.db2.gz	QCGCZIYYCRBSTF-GFCCVEGCSA-N	0	3	310.467	2.425	10	0		DEAEHN
CC[C@H]1CN(Cc2cc(F)c(F)cc2F)CCN1C[C@@H](C)O	ZINC000120760857	195232493	/nfs/dbraw/zinc/23/24/93/195232493.db2.gz	ILNPOQPVCYDCGB-YPMHNXCESA-N	0	3	316.367	2.381	10	0		DEAEHN
Cc1ccsc1C(=O)N1CC[C@@H]2CO[C@@H](CN(C)C)[C@@H]2C1	ZINC000247984160	257113373	/nfs/dbraw/zinc/11/33/73/257113373.db2.gz	KESLFTXQOQATAH-MCIONIFRSA-N	0	3	308.447	2.095	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000121812544	195352953	/nfs/dbraw/zinc/35/29/53/195352953.db2.gz	NYLJVPKOWADFAN-HNNXBMFYSA-N	0	3	305.422	2.026	10	0		DEAEHN
Cc1ccc(F)c(NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C)c1	ZINC000121829287	195356407	/nfs/dbraw/zinc/35/64/07/195356407.db2.gz	SHFMFGMIDAHEFY-CYBMUJFWSA-N	0	3	323.412	2.165	10	0		DEAEHN
COc1ccc(CN2CCN(CCO)[C@@H](C)C2)c2ccccc12	ZINC000190248837	533560827	/nfs/dbraw/zinc/56/08/27/533560827.db2.gz	OMPAIIWJVKHKLI-HNNXBMFYSA-N	0	3	314.429	2.347	10	0		DEAEHN
COC[C@H](C)OC[C@H](O)CN1CC[C@@H](C)C[C@@H]1c1ccco1	ZINC000377082183	133317836	/nfs/dbraw/zinc/31/78/36/133317836.db2.gz	KBHRMLOXORPJOQ-QKPAOTATSA-N	0	3	311.422	2.465	10	0		DEAEHN
O=C(N[C@@H]1CCn2ccnc2C1)c1cccc(CN2CCCC2)c1	ZINC000548310887	285716312	/nfs/dbraw/zinc/71/63/12/285716312.db2.gz	ZJJSGOZDYOQYSQ-QGZVFWFLSA-N	0	3	324.428	2.224	10	0		DEAEHN
C[C@H](NCCOCC1CCC1)c1ccc(-n2cnnn2)cc1	ZINC000564695178	292105186	/nfs/dbraw/zinc/10/51/86/292105186.db2.gz	YOUYEMLGDJCXSO-ZDUSSCGKSA-N	0	3	301.394	2.130	10	0		DEAEHN
Cc1ccc(CN2CCC([C@H](O)c3nccn3C)CC2)c(C)n1	ZINC000187305899	144997913	/nfs/dbraw/zinc/99/79/13/144997913.db2.gz	QVBZEAZRSZHNFP-KRWDZBQOSA-N	0	3	314.433	2.378	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC([C@@H]3CCCO3)CC2)C1	ZINC000187619795	145001758	/nfs/dbraw/zinc/00/17/58/145001758.db2.gz	DSSZDLPLVPSTNJ-CVEARBPZSA-N	0	3	309.454	2.071	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cn2ccnc2s1	ZINC000188616847	145014544	/nfs/dbraw/zinc/01/45/44/145014544.db2.gz	RUVIWAGEEJMPAH-VXGBXAGGSA-N	0	3	304.419	2.095	10	0		DEAEHN
O=C(C[C@H](O)c1ccc(Cl)cc1)N1CCN2CCC1CC2	ZINC000188844264	145018516	/nfs/dbraw/zinc/01/85/16/145018516.db2.gz	FWTJCSRGAPEMCY-HNNXBMFYSA-N	0	3	308.809	2.070	10	0		DEAEHN
O[C@@H](CC1CCCC1)CN1CCCN(CC(F)(F)F)CC1	ZINC000190377709	145041930	/nfs/dbraw/zinc/04/19/30/145041930.db2.gz	ZRYYHJRMFFKNKS-AWEZNQCLSA-N	0	3	308.388	2.498	10	0		DEAEHN
CCCC[C@@H](C(=O)OC)N1CCC(c2nnc(CC)[nH]2)CC1	ZINC000190674264	145045311	/nfs/dbraw/zinc/04/53/11/145045311.db2.gz	YNYAMOHVCPVOTQ-ZDUSSCGKSA-N	0	3	308.426	2.278	10	0		DEAEHN
Cn1cc(CNCC2(C)OCCCO2)c(-c2cccs2)n1	ZINC000192250110	145072390	/nfs/dbraw/zinc/07/23/90/145072390.db2.gz	YKWADQDTDRPAEN-UHFFFAOYSA-N	0	3	307.419	2.391	10	0		DEAEHN
COc1cccc(CN[C@H]2CCCN(c3ncccn3)C2)c1F	ZINC000192668306	145077200	/nfs/dbraw/zinc/07/72/00/145077200.db2.gz	YEZADDVZTXICAQ-AWEZNQCLSA-N	0	3	316.380	2.383	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1ccccc1OC(F)F)[C@H]1CCCO1	ZINC000193130088	145083103	/nfs/dbraw/zinc/08/31/03/145083103.db2.gz	FWKCDHYPJGSYOS-ZYHUDNBSSA-N	0	3	314.332	2.384	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N(C)C[C@H](C)CS(C)(=O)=O)C12CCCC2	ZINC000246442980	145103131	/nfs/dbraw/zinc/10/31/31/145103131.db2.gz	DNWJQMYWVAYJKQ-RRFJBIMHSA-N	0	3	317.495	2.337	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cn(C)nc1-c1ccccc1	ZINC000246519660	145105716	/nfs/dbraw/zinc/10/57/16/145105716.db2.gz	UOQOAMLEGYOXGT-HOCLYGCPSA-N	0	3	324.428	2.396	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)CSCc1ccncc1	ZINC000246969614	145120740	/nfs/dbraw/zinc/12/07/40/145120740.db2.gz	NLQXNEHEVKVIIQ-CVEARBPZSA-N	0	3	319.474	2.400	10	0		DEAEHN
CCOc1ccccc1NC(=O)[C@H](C)N1CCN2CCC[C@H]2C1	ZINC000247109584	145126463	/nfs/dbraw/zinc/12/64/63/145126463.db2.gz	IXYVPZORBUVXKI-GJZGRUSLSA-N	0	3	317.433	2.192	10	0		DEAEHN
COC(=O)c1csc(NC(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000247288292	145132017	/nfs/dbraw/zinc/13/20/17/145132017.db2.gz	ZACUTAWNGKJSBO-PWSUYJOCSA-N	0	3	323.418	2.235	10	0		DEAEHN
CCOCCN(C)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000248699680	145164381	/nfs/dbraw/zinc/16/43/81/145164381.db2.gz	ACBSXNFOWNYYDS-WBVHZDCISA-N	0	3	319.449	2.185	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N[C@@H]1CCO[C@@H](C2CC2)C1	ZINC000248843184	145170052	/nfs/dbraw/zinc/17/00/52/145170052.db2.gz	OACWEPYFGQQUJN-BZUAXINKSA-N	0	3	311.470	2.220	10	0		DEAEHN
Cn1cc(-c2cc(CN3CC[C@]4(O)CCCC[C@H]4C3)on2)cn1	ZINC000248920722	145173805	/nfs/dbraw/zinc/17/38/05/145173805.db2.gz	DZQVKTUJGWNQMX-WMLDXEAASA-N	0	3	316.405	2.202	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1C[C@@H](CO)[C@@H](c2ccsc2)C1	ZINC000249527087	145185826	/nfs/dbraw/zinc/18/58/26/145185826.db2.gz	YUDZJEXFCDOMHA-ARFHVFGLSA-N	0	3	322.474	2.157	10	0		DEAEHN
COCOc1ccc(OC)cc1CN[C@@H]1C[C@H]2OCCC[C@@H]12	ZINC000249763665	145189808	/nfs/dbraw/zinc/18/98/08/145189808.db2.gz	ICIOWKRMVOHLQE-ZMSDIMECSA-N	0	3	307.390	2.335	10	0		DEAEHN
Cc1nc(C[C@@H]2CCCN(C[C@@H](O)Cc3ccccc3)C2)no1	ZINC000249906412	145191763	/nfs/dbraw/zinc/19/17/63/145191763.db2.gz	UXSSVIUJYFLMBV-IRXDYDNUSA-N	0	3	315.417	2.236	10	0		DEAEHN
CO[C@@H]1CN(CCC(=O)NC(=O)Nc2ccccc2)CC[C@H]1C	ZINC000251893670	145196948	/nfs/dbraw/zinc/19/69/48/145196948.db2.gz	QLHIMNIHDIBBGO-UKRRQHHQSA-N	0	3	319.405	2.082	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)C(=O)c2ccc(Cl)cc2)C1	ZINC000252656600	145199654	/nfs/dbraw/zinc/19/96/54/145199654.db2.gz	KJFXLIKBRMMPCE-ZFWWWQNUSA-N	0	3	320.820	2.465	10	0		DEAEHN
Cc1[nH]c(=O)ccc1C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000252801520	145201065	/nfs/dbraw/zinc/20/10/65/145201065.db2.gz	TZUPXXILWHAOHC-RDJZCZTQSA-N	0	3	311.385	2.271	10	0		DEAEHN
CN(Cc1ccccc1)C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C	ZINC000261539078	145206120	/nfs/dbraw/zinc/20/61/20/145206120.db2.gz	BMKGOUINTDQBQJ-RLFYNMQTSA-N	0	3	302.418	2.178	10	0		DEAEHN
Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc3c(c2F)CCNC3)n1	ZINC000261626614	145211582	/nfs/dbraw/zinc/21/15/82/145211582.db2.gz	AMNLWHHQNXATAC-LBPRGKRZSA-N	0	3	316.380	2.484	10	0		DEAEHN
N[C@@H](C(=O)NCC1(c2ccc(F)cc2)CCC1)C1CCOCC1	ZINC000261669271	145214809	/nfs/dbraw/zinc/21/48/09/145214809.db2.gz	GDQSJKFLPZPOJZ-MRXNPFEDSA-N	0	3	320.408	2.118	10	0		DEAEHN
COC(=O)c1ccc(CN2CCNC[C@@H]2c2cccnc2)cc1	ZINC000261781605	145225913	/nfs/dbraw/zinc/22/59/13/145225913.db2.gz	TZLCFSAPNQRXGD-QGZVFWFLSA-N	0	3	311.385	2.015	10	0		DEAEHN
CC(C)N(C)c1cccc(NC(=O)[C@H](N)C2CCOCC2)c1	ZINC000261798851	145227197	/nfs/dbraw/zinc/22/71/97/145227197.db2.gz	OBDRSPNQRIRIMP-MRXNPFEDSA-N	0	3	305.422	2.224	10	0		DEAEHN
NC1(C(=O)N2CCC[C@@H](c3ccccc3)CC2)CCOCC1	ZINC000261794648	145227623	/nfs/dbraw/zinc/22/76/23/145227623.db2.gz	ILZIHGFNNUATTN-MRXNPFEDSA-N	0	3	302.418	2.291	10	0		DEAEHN
c1coc(-c2cc(CN3CCNC[C@H]3c3cccnc3)no2)c1	ZINC000261819214	145230142	/nfs/dbraw/zinc/23/01/42/145230142.db2.gz	SBVTUKCMANZGPS-HNNXBMFYSA-N	0	3	310.357	2.476	10	0		DEAEHN
CCN(CC)c1ccc(N[C@@H]2CCC[C@@H]2[C@@H]2COCCN2)cn1	ZINC000261894332	145238525	/nfs/dbraw/zinc/23/85/25/145238525.db2.gz	GYMFVIRCDLZNPQ-BBWFWOEESA-N	0	3	318.465	2.497	10	0		DEAEHN
Cc1ccccc1CCNC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000261923198	145242545	/nfs/dbraw/zinc/24/25/45/145242545.db2.gz	RXUMEMPZMYVMEZ-JTDSTZFVSA-N	0	3	316.445	2.186	10	0		DEAEHN
COc1ccc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)cc1F	ZINC000261956885	145247100	/nfs/dbraw/zinc/24/71/00/145247100.db2.gz	XGLMHRZWPRDUNM-JDSLSITLSA-N	0	3	322.380	2.305	10	0		DEAEHN
N[C@H](C(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1)C1CCOCC1	ZINC000261996134	145250687	/nfs/dbraw/zinc/25/06/87/145250687.db2.gz	NCMBBVHKNJLLOF-UHTWSYAYSA-N	0	3	322.371	2.225	10	0		DEAEHN
C[C@@H]1CN(CC2CC[NH+](CCCCC(=O)[O-])CC2)C[C@H](C)O1	ZINC000262261558	145272164	/nfs/dbraw/zinc/27/21/64/145272164.db2.gz	REFKKOXEUMIGTQ-GASCZTMLSA-N	0	3	312.454	2.063	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1	ZINC000262301499	145275256	/nfs/dbraw/zinc/27/52/56/145275256.db2.gz	KUJQRWSHGHTQRT-MEDUHNTESA-N	0	3	311.376	2.177	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H]2CC[NH2+][C@H](C)C2)c(Cl)cc1F	ZINC000262763241	145304401	/nfs/dbraw/zinc/30/44/01/145304401.db2.gz	GNPORYCHMRLEEL-NXEZZACHSA-N	0	3	320.817	2.206	10	0		DEAEHN
NC[C@H](NS(=O)(=O)CC1CC1)c1ccc2ccccc2c1	ZINC000262802355	145305667	/nfs/dbraw/zinc/30/56/67/145305667.db2.gz	RESOBGAHRRAZCY-INIZCTEOSA-N	0	3	304.415	2.169	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2cnc(C(C)(C)C)s2)n1	ZINC000263173527	145332025	/nfs/dbraw/zinc/33/20/25/145332025.db2.gz	GAJAVDFZJSOCCH-SECBINFHSA-N	0	3	307.423	2.067	10	0		DEAEHN
Cc1ccccc1CNC(=O)[C@H](C)N[C@H]1CCO[C@H]1C1CC1	ZINC000332992637	145392958	/nfs/dbraw/zinc/39/29/58/145392958.db2.gz	LZGMAXZTOUKEDY-JQFCIGGWSA-N	0	3	302.418	2.157	10	0		DEAEHN
COC(=O)c1cncc(N[C@@H](C)CN(C)Cc2ccccc2)n1	ZINC000336713412	145398101	/nfs/dbraw/zinc/39/81/01/145398101.db2.gz	MSXXURIFPXOGCG-ZDUSSCGKSA-N	0	3	314.389	2.196	10	0		DEAEHN
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C1CCC(=O)CC1	ZINC000348802191	146310493	/nfs/dbraw/zinc/31/04/93/146310493.db2.gz	MBLZWIZZZRATMV-INIZCTEOSA-N	0	3	314.429	2.384	10	0		DEAEHN
COc1cccc(CN(CCN(C)C)C(=O)NC[C@H]2C[C@@H]2C)c1	ZINC000358563797	147156586	/nfs/dbraw/zinc/15/65/86/147156586.db2.gz	QXXKDQLLLYHXKK-GOEBONIOSA-N	0	3	319.449	2.424	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCOc2cccc(F)c2C1	ZINC000374813219	148291601	/nfs/dbraw/zinc/29/16/01/148291601.db2.gz	YSNGMGSQQKBBCZ-ZDUSSCGKSA-N	0	3	321.396	2.214	10	0		DEAEHN
O=C(NCc1ccccc1-n1cccn1)C12CCCN1CCC2	ZINC000375085290	148329090	/nfs/dbraw/zinc/32/90/90/148329090.db2.gz	QZTXRCXOXLAOLD-UHFFFAOYSA-N	0	3	310.401	2.117	10	0		DEAEHN
CCC(CC)[C@@H](O)CNC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000111826632	401724702	/nfs/dbraw/zinc/72/47/02/401724702.db2.gz	WUHVVOFGORXEPP-GJZGRUSLSA-N	0	3	301.475	2.059	10	0		DEAEHN
CC[C@@H]1CN(CCCCCn2cc(C)cn2)CCN1CCOC	ZINC000111228120	401702021	/nfs/dbraw/zinc/70/20/21/401702021.db2.gz	HQISMLDIYQSYIN-GOSISDBHSA-N	0	3	322.497	2.404	10	0		DEAEHN
C[C@@H]1CN(C2CCN(Cc3ccc4c(c3)CCO4)CC2)CCO1	ZINC000111236543	401702677	/nfs/dbraw/zinc/70/26/77/401702677.db2.gz	JFCGUTYHIKGPBK-OAHLLOKOSA-N	0	3	316.445	2.307	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)N1CCC[C@@H]1c1cnn(C)c1	ZINC000111511561	401717305	/nfs/dbraw/zinc/71/73/05/401717305.db2.gz	HBBZCHXAFUAJRY-HZPDHXFCSA-N	0	3	319.453	2.141	10	0		DEAEHN
CC(C)c1nccc(N2CCCC[C@@H](N3CCN(C)CC3)C2)n1	ZINC000127085564	401719905	/nfs/dbraw/zinc/71/99/05/401719905.db2.gz	BIFHZPBXCAMPKM-MRXNPFEDSA-N	0	3	317.481	2.206	10	0		DEAEHN
COc1cc(C[NH2+]C[C@@H]2CCCO2)cc(Br)c1[O-]	ZINC000008206662	401749842	/nfs/dbraw/zinc/74/98/42/401749842.db2.gz	JTDPHLIRMMKZEM-JTQLQIEISA-N	0	3	316.195	2.432	10	0		DEAEHN
C[C@@H]1C[C@H](c2cccc(F)c2)N(C[C@H](O)CN2CCCC2=O)C1	ZINC000075842862	401770212	/nfs/dbraw/zinc/77/02/12/401770212.db2.gz	KMQWBQINGQRXLK-KBRIMQKVSA-N	0	3	320.408	2.192	10	0		DEAEHN
C[C@@H]1C[C@@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000115157956	401820032	/nfs/dbraw/zinc/82/00/32/401820032.db2.gz	BAHBDUDXUAGIBO-JLSDUUJJSA-N	0	3	316.445	2.204	10	0		DEAEHN
Cc1ccc(NC(=O)N[C@H](C)[C@@H](C)CO)c(OCCN(C)C)c1	ZINC000077722777	401827257	/nfs/dbraw/zinc/82/72/57/401827257.db2.gz	NIHPOIDGJCHVIB-UONOGXRCSA-N	0	3	323.437	2.074	10	0		DEAEHN
CCN(CC)CC(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000117269508	401871125	/nfs/dbraw/zinc/87/11/25/401871125.db2.gz	OSQWCWRMFYRLEG-OAHLLOKOSA-N	0	3	319.449	2.122	10	0		DEAEHN
Cc1cccnc1[C@@H](NC(=O)NC[C@@H]1CCCN1C)C(C)C	ZINC000115810490	401837725	/nfs/dbraw/zinc/83/77/25/401837725.db2.gz	IPUVNOMWHQNGTJ-GJZGRUSLSA-N	0	3	304.438	2.481	10	0		DEAEHN
COc1ccccc1NC(=O)CN(C)CCCn1ccnc1C	ZINC000130866783	401840614	/nfs/dbraw/zinc/84/06/14/401840614.db2.gz	KPUIEUGSTNUVID-UHFFFAOYSA-N	0	3	316.405	2.161	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)CSCc1cscn1	ZINC000131110795	401844131	/nfs/dbraw/zinc/84/41/31/401844131.db2.gz	QARKUCMVERVMKB-WCQYABFASA-N	0	3	311.476	2.071	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1cccc(C[S@@](C)=O)c1	ZINC000078614823	401858361	/nfs/dbraw/zinc/85/83/61/401858361.db2.gz	IQWLWFQBHDTECD-AOMKIAJQSA-N	0	3	324.490	2.271	10	0		DEAEHN
COC(=O)c1ccc(C(=O)N[C@@H](CC(C)C)CN(C)C)s1	ZINC000078614992	401858827	/nfs/dbraw/zinc/85/88/27/401858827.db2.gz	RLQXWYPDTVABJN-NSHDSACASA-N	0	3	312.435	2.241	10	0		DEAEHN
C[C@@H]1CCc2sc(C(=O)N3CCO[C@H](CN(C)C)C3)cc2C1	ZINC000116788329	401859181	/nfs/dbraw/zinc/85/91/81/401859181.db2.gz	JIWKOLUQXDXXSD-TZMCWYRMSA-N	0	3	322.474	2.276	10	0		DEAEHN
CC(C)Cc1ccc(CC(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000116797919	401859653	/nfs/dbraw/zinc/85/96/53/401859653.db2.gz	GGYGNMQZVOCXOP-GOSISDBHSA-N	0	3	318.461	2.217	10	0		DEAEHN
C[C@@H](CCNCc1ccc(Br)cn1)[S@](C)=O	ZINC000132542056	401869117	/nfs/dbraw/zinc/86/91/17/401869117.db2.gz	KPOTUHMHVDEVHJ-XXFAHNHDSA-N	0	3	305.241	2.091	10	0		DEAEHN
CC(C)CSCCCNC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000129944010	401812439	/nfs/dbraw/zinc/81/24/39/401812439.db2.gz	YUYPETIRYTUYLE-HNNXBMFYSA-N	0	3	311.495	2.421	10	0		DEAEHN
c1csc(Cn2cccc2CN[C@H]2CCc3ncnn3C2)c1	ZINC000119122070	401927144	/nfs/dbraw/zinc/92/71/44/401927144.db2.gz	DMULFKLOKHQFQS-ZDUSSCGKSA-N	0	3	313.430	2.294	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)NCCN1CCC[C@@H](C)C1	ZINC000079531341	401875413	/nfs/dbraw/zinc/87/54/13/401875413.db2.gz	XWCHQALZOBJEGV-CQSZACIVSA-N	0	3	305.422	2.331	10	0		DEAEHN
C[C@@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)[C@@H]1CCCO1	ZINC000079619964	401877921	/nfs/dbraw/zinc/87/79/21/401877921.db2.gz	CTYAAGMOLNSYIZ-CABCVRRESA-N	0	3	311.470	2.317	10	0		DEAEHN
O=C(NCCCCNc1ccccn1)[C@H]1CCCc2[nH]ncc21	ZINC000135372635	401937606	/nfs/dbraw/zinc/93/76/06/401937606.db2.gz	MZQJYPDBRYTCNR-ZDUSSCGKSA-N	0	3	313.405	2.233	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)Cc1ccccc1Cl	ZINC000036076812	401902091	/nfs/dbraw/zinc/90/20/91/401902091.db2.gz	JSKMOCAZKYOJKC-LBPRGKRZSA-N	0	3	318.870	2.490	10	0		DEAEHN
CN(C)CCN(Cc1ccco1)C(=O)[C@@H]1CCCc2n[nH]cc21	ZINC000134497266	401904973	/nfs/dbraw/zinc/90/49/73/401904973.db2.gz	JWDKGDJLBYCBLN-CQSZACIVSA-N	0	3	316.405	2.013	10	0		DEAEHN
CCNC(=O)CN[C@@H](C)CCc1ccc(OC(F)F)cc1	ZINC000036780411	401907711	/nfs/dbraw/zinc/90/77/11/401907711.db2.gz	KUAAIIGKEDKGKG-NSHDSACASA-N	0	3	300.349	2.335	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)CC/C=C/c2ccccc2)CCO1	ZINC000119051480	401921919	/nfs/dbraw/zinc/92/19/19/401921919.db2.gz	BSSOSNQIKOOPCX-BHMZLHOFSA-N	0	3	302.418	2.269	10	0		DEAEHN
C[C@](CO)(NC[C@@H]1CCCO1)c1ccc(Br)cc1	ZINC000038114608	401922844	/nfs/dbraw/zinc/92/28/44/401922844.db2.gz	ORHDUHOOOVTKFM-UONOGXRCSA-N	0	3	314.223	2.425	10	0		DEAEHN
CN(C)C[C@H](NC(=O)CSc1nncs1)c1ccccc1	ZINC000048274664	401997358	/nfs/dbraw/zinc/99/73/58/401997358.db2.gz	OPJWCRJIKSHFRS-LBPRGKRZSA-N	0	3	322.459	2.049	10	0		DEAEHN
O=C(c1nc2c(cccc2N2CCNCC2)[nH]1)c1ccccc1	ZINC000045255332	401956252	/nfs/dbraw/zinc/95/62/52/401956252.db2.gz	FZBMMXWYKQENCZ-UHFFFAOYSA-N	0	3	306.369	2.204	10	0		DEAEHN
C[C@@H]1CC[C@H](C(N)=O)CN1Cc1ccc2c(c1)CC(C)(C)O2	ZINC000136381074	401966757	/nfs/dbraw/zinc/96/67/57/401966757.db2.gz	BGHXTLRGSHJEEH-OCCSQVGLSA-N	0	3	302.418	2.486	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1cccc2cnccc21	ZINC000047544042	401983369	/nfs/dbraw/zinc/98/33/69/401983369.db2.gz	NLPAAUPTWLGZEB-CYBMUJFWSA-N	0	3	321.446	2.243	10	0		DEAEHN
Cc1ccccc1[C@H](C)NCC(=O)NC(=O)NCc1ccco1	ZINC000120480785	401991558	/nfs/dbraw/zinc/99/15/58/401991558.db2.gz	UDFDJGLMTJGHTK-ZDUSSCGKSA-N	0	3	315.373	2.265	10	0		DEAEHN
CCOc1cccc(NC(=O)NC[C@H](O)CN2CCCCC2)c1	ZINC000048119773	401994378	/nfs/dbraw/zinc/99/43/78/401994378.db2.gz	BYJZBWANMXTVBD-HNNXBMFYSA-N	0	3	321.421	2.054	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cn(C)nc1-c1ccccc1	ZINC000089243235	401939760	/nfs/dbraw/zinc/93/97/60/401939760.db2.gz	UOQOAMLEGYOXGT-GDBMZVCRSA-N	0	3	324.428	2.396	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC[C@H]2CCN(C3CC3)C2)c(C)s1	ZINC000119443347	401950527	/nfs/dbraw/zinc/95/05/27/401950527.db2.gz	XUJVEESBQJTKPU-GFCCVEGCSA-N	0	3	314.476	2.128	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN(C[C@H](O)COC(C)(C)C)C2)n1	ZINC000151111159	402017023	/nfs/dbraw/zinc/01/70/23/402017023.db2.gz	XQUQOJNQFWHDFW-HOTGVXAUSA-N	0	3	321.465	2.300	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCc1nc(C)c(C)s1	ZINC000151161353	402020803	/nfs/dbraw/zinc/02/08/03/402020803.db2.gz	GFXIHAPHXAWQMD-AWEZNQCLSA-N	0	3	324.494	2.428	10	0		DEAEHN
Cc1cc(C)n2c(CN3CCC[C@@H](c4cc[nH]n4)C3)cnc2n1	ZINC000121227981	402021766	/nfs/dbraw/zinc/02/17/66/402021766.db2.gz	UTVZJTBVCSYLDH-CQSZACIVSA-N	0	3	310.405	2.449	10	0		DEAEHN
CC(=O)Nc1ccc(Cl)c(C(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000121252203	402023620	/nfs/dbraw/zinc/02/36/20/402023620.db2.gz	PDZDGOSGFZRYER-GFCCVEGCSA-N	0	3	309.797	2.075	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2ccn(C3CCCC3)n2)C1	ZINC000151450054	402036486	/nfs/dbraw/zinc/03/64/86/402036486.db2.gz	LFPPKLGBFLYWOI-HNNXBMFYSA-N	0	3	319.453	2.282	10	0		DEAEHN
Cc1noc(C)c1[C@H](C)CNC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000151480876	402038886	/nfs/dbraw/zinc/03/88/86/402038886.db2.gz	BLVMYGAGMYQDJM-DOMZBBRYSA-N	0	3	318.421	2.051	10	0		DEAEHN
C[C@@H](C(=O)N1CC[C@H](Oc2cccnc2)C1)N1CCCCCC1	ZINC000151524467	402041665	/nfs/dbraw/zinc/04/16/65/402041665.db2.gz	WBFGLVOAWABVOM-RDJZCZTQSA-N	0	3	317.433	2.326	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)Cc2ccccc2OC)C1	ZINC000052592783	402044156	/nfs/dbraw/zinc/04/41/56/402044156.db2.gz	AKDMHBXMMFXWEH-HNNXBMFYSA-N	0	3	305.422	2.321	10	0		DEAEHN
CCOC(=O)c1cnc2c(C)c(C)ccc2c1N1CCNCC1	ZINC000053994919	402061037	/nfs/dbraw/zinc/06/10/37/402061037.db2.gz	QMSGNWYISLIJKK-UHFFFAOYSA-N	0	3	313.401	2.438	10	0		DEAEHN
COC[C@@H](C)C(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000092515702	402005163	/nfs/dbraw/zinc/00/51/63/402005163.db2.gz	UJHGUPKWOIPJOY-OAHLLOKOSA-N	0	3	319.449	2.429	10	0		DEAEHN
Cc1cccc(CNC(=O)N[C@H](C)CN2CCC[C@H](C)C2)n1	ZINC000056788716	402090565	/nfs/dbraw/zinc/09/05/65/402090565.db2.gz	UAAFGNAMTJBWKE-DZGCQCFKSA-N	0	3	304.438	2.310	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)CCOc2ccc(F)cc2)C1	ZINC000057870218	402097242	/nfs/dbraw/zinc/09/72/42/402097242.db2.gz	ACUONRRHIJDMQB-OAHLLOKOSA-N	0	3	323.412	2.330	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)CCOc2ccc(F)cc2)C1	ZINC000057870216	402097517	/nfs/dbraw/zinc/09/75/17/402097517.db2.gz	ACUONRRHIJDMQB-HNNXBMFYSA-N	0	3	323.412	2.330	10	0		DEAEHN
COCCCN(C)CCNC(=O)c1cc2c(cc(F)cc2C)[nH]1	ZINC000152489983	402097811	/nfs/dbraw/zinc/09/78/11/402097811.db2.gz	LGFXTWCLEOZJDP-UHFFFAOYSA-N	0	3	321.396	2.314	10	0		DEAEHN
O=C(CN(C[C@@H]1CCCO1)C1CCCC1)NCC(F)(F)F	ZINC000152921527	402117084	/nfs/dbraw/zinc/11/70/84/402117084.db2.gz	AUFAZBVSXLYKBO-LBPRGKRZSA-N	0	3	308.344	2.089	10	0		DEAEHN
C[C@H](CN[C@H](C)c1ccc(F)cc1N(C)C)N1CCOCC1	ZINC000123468992	402129414	/nfs/dbraw/zinc/12/94/14/402129414.db2.gz	YNSMASNFZLCMQJ-ZIAGYGMSSA-N	0	3	309.429	2.263	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@H](C)OC[C@@H]1CCCCO1	ZINC000066338125	402130943	/nfs/dbraw/zinc/13/09/43/402130943.db2.gz	HFRLDXHXHXIIFG-XHSDSOJGSA-N	0	3	314.470	2.053	10	0		DEAEHN
Cc1nc(C)c(CN[C@@H]2CCCN(c3cccnn3)C2)s1	ZINC000123665575	402140815	/nfs/dbraw/zinc/14/08/15/402140815.db2.gz	ZKZZIPOYKQMMMF-CYBMUJFWSA-N	0	3	303.435	2.309	10	0		DEAEHN
CCC(O)(CC)CNC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000124908820	402203346	/nfs/dbraw/zinc/20/33/46/402203346.db2.gz	XPZALJFJVDFPIG-MRXNPFEDSA-N	0	3	321.465	2.010	10	0		DEAEHN
CCc1nn(C)c(Cl)c1C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000154015930	402186952	/nfs/dbraw/zinc/18/69/52/402186952.db2.gz	QLWQSCXSEYHOMN-MNOVXSKESA-N	0	3	312.845	2.191	10	0		DEAEHN
COC[C@@H](C)C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000103432971	402187847	/nfs/dbraw/zinc/18/78/47/402187847.db2.gz	NOWAVZUOCDZFJI-CYBMUJFWSA-N	0	3	310.463	2.359	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2sccc2Br)C1	ZINC000104188509	402200416	/nfs/dbraw/zinc/20/04/16/402200416.db2.gz	RDCVXHIJGOWZGR-QMMMGPOBSA-N	0	3	303.225	2.287	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC(c2nncn2C2CC2)CC1)N(C)C	ZINC000153822153	402172563	/nfs/dbraw/zinc/17/25/63/402172563.db2.gz	XYYHQICFRXCVLM-HNNXBMFYSA-N	0	3	319.453	2.049	10	0		DEAEHN
FC(F)Oc1ccc(CNC[C@@H]2CN(C3CC3)CCO2)cc1	ZINC000106380093	402213170	/nfs/dbraw/zinc/21/31/70/402213170.db2.gz	BUSUEZSAKPZAKX-OAHLLOKOSA-N	0	3	312.360	2.241	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)[C@H](Cc1ccccc1)N(C)C	ZINC000106905641	402221109	/nfs/dbraw/zinc/22/11/09/402221109.db2.gz	WIUKIYKPHOTIGD-WMZOPIPTSA-N	0	3	317.477	2.150	10	0		DEAEHN
CCCOc1cccc(CCNC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000154785654	402231993	/nfs/dbraw/zinc/23/19/93/402231993.db2.gz	UARPGLZBZGJHCI-INIZCTEOSA-N	0	3	319.449	2.363	10	0		DEAEHN
COc1cccc2c1CC[C@H]2NC(=O)N1CC[C@H](N(C)C)C1	ZINC000154794419	402232387	/nfs/dbraw/zinc/23/23/87/402232387.db2.gz	NRQRLUQWBOVESR-SWLSCSKDSA-N	0	3	303.406	2.028	10	0		DEAEHN
Cc1cc(C)n2c(CNC[C@H](c3ccco3)N(C)C)cnc2n1	ZINC000155645986	402264378	/nfs/dbraw/zinc/26/43/78/402264378.db2.gz	NDKSCEKIJUKQLO-OAHLLOKOSA-N	0	3	313.405	2.332	10	0		DEAEHN
Cc1nn(C)cc1[C@H](C)NC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000069773791	402243968	/nfs/dbraw/zinc/24/39/68/402243968.db2.gz	IDKJTERATUXEEY-GXTWGEPZSA-N	0	3	309.458	2.065	10	0		DEAEHN
CC(C)[C@H](O)CC(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000155400223	402256066	/nfs/dbraw/zinc/25/60/66/402256066.db2.gz	TXPURNLBYRCFSY-IAGOWNOFSA-N	0	3	304.434	2.347	10	0		DEAEHN
CCCNC(=O)CCCC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000104825678	402205514	/nfs/dbraw/zinc/20/55/14/402205514.db2.gz	YDSPKBQNGVFUOF-MRXNPFEDSA-N	0	3	319.449	2.102	10	0		DEAEHN
Cc1ccc(N2CCN(CCC(=O)NC(C)C)CC2)cc1C	ZINC000126157223	402267254	/nfs/dbraw/zinc/26/72/54/402267254.db2.gz	GPEIJAGPPFOIAS-UHFFFAOYSA-N	0	3	303.450	2.340	10	0		DEAEHN
CC(C)N1CCCC[C@H]1C(=O)N1CCC(c2ccnn2C)CC1	ZINC000156674300	402287129	/nfs/dbraw/zinc/28/71/29/402287129.db2.gz	WBVQSIIJVZZWLJ-KRWDZBQOSA-N	0	3	318.465	2.389	10	0		DEAEHN
COc1cc(CN2CCN(C)C[C@@H]2C(C)C)cc2c1OCCO2	ZINC000184737263	402296143	/nfs/dbraw/zinc/29/61/43/402296143.db2.gz	GKUCSQMVNKZNEP-OAHLLOKOSA-N	0	3	320.433	2.238	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1cccc2c1OCCO2	ZINC000176316000	402298790	/nfs/dbraw/zinc/29/87/90/402298790.db2.gz	XCIKFOZZBQPSHG-ZDUSSCGKSA-N	0	3	319.405	2.406	10	0		DEAEHN
CCOC[C@H]1CCN(CC(=O)N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000176337537	402300916	/nfs/dbraw/zinc/30/09/16/402300916.db2.gz	FIPLUHWCNWXFBB-STQMWFEESA-N	0	3	322.371	2.146	10	0		DEAEHN
CN(C)CCN(C)C(=O)c1cccc(-c2noc(C3CC3)n2)c1	ZINC000176388289	402304988	/nfs/dbraw/zinc/30/49/88/402304988.db2.gz	ODVAQYAMVZBSBF-UHFFFAOYSA-N	0	3	314.389	2.248	10	0		DEAEHN
Fc1cc(CN[C@H]2CCCSC2)cnc1N1CCOCC1	ZINC000184948851	402311921	/nfs/dbraw/zinc/31/19/21/402311921.db2.gz	IXNZKGXYDWOVSE-ZDUSSCGKSA-N	0	3	311.426	2.043	10	0		DEAEHN
C[C@H](c1ccccc1)[C@H](C)NC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000176464052	402312308	/nfs/dbraw/zinc/31/23/08/402312308.db2.gz	NRRZFULLJIIWEE-YQQAZPJKSA-N	0	3	319.449	2.151	10	0		DEAEHN
C[C@@H](CCn1cccn1)N[C@H]1CCCN(c2ccccc2)C1=O	ZINC000158845434	402313366	/nfs/dbraw/zinc/31/33/66/402313366.db2.gz	KIBGTIHIMPESIE-RDJZCZTQSA-N	0	3	312.417	2.447	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1cc(C)ccc1C	ZINC000176889079	402346839	/nfs/dbraw/zinc/34/68/39/402346839.db2.gz	LKAMDYHNRBTKGF-OAHLLOKOSA-N	0	3	317.433	2.185	10	0		DEAEHN
O=C(NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc2c(c1[O-])CCCC2	ZINC000185425252	402351572	/nfs/dbraw/zinc/35/15/72/402351572.db2.gz	MCHQKOLFIMWONF-ZDUSSCGKSA-N	0	3	314.429	2.485	10	0		DEAEHN
O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc2c(c1[O-])CCCC2	ZINC000185425252	402351575	/nfs/dbraw/zinc/35/15/75/402351575.db2.gz	MCHQKOLFIMWONF-ZDUSSCGKSA-N	0	3	314.429	2.485	10	0		DEAEHN
CN(C[C@H]1CCN(C)C1)C(=O)c1ccoc1Br	ZINC000234360648	402359688	/nfs/dbraw/zinc/35/96/88/402359688.db2.gz	CDCLOYMFLYQQQB-VIFPVBQESA-N	0	3	301.184	2.066	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(-c2ncon2)cc1	ZINC000177032966	402361710	/nfs/dbraw/zinc/36/17/10/402361710.db2.gz	LHMPNRNRSWQTSZ-OAHLLOKOSA-N	0	3	314.389	2.293	10	0		DEAEHN
O=C1CCCN1CCCNCc1ccc(Br)o1	ZINC000236612393	402368356	/nfs/dbraw/zinc/36/83/56/402368356.db2.gz	FWOLGROXYXFEGT-UHFFFAOYSA-N	0	3	301.184	2.144	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1C(=O)c1[nH]nc2ccccc21	ZINC000177169557	402377829	/nfs/dbraw/zinc/37/78/29/402377829.db2.gz	WTLGITIRCJRVOR-ZDUSSCGKSA-N	0	3	309.373	2.373	10	0		DEAEHN
COC(=O)c1sc(N2C[C@@H]3CCCN3C[C@@H]2C)nc1Cl	ZINC000227475120	402332348	/nfs/dbraw/zinc/33/23/48/402332348.db2.gz	BEKPCNIKTFUELD-IUCAKERBSA-N	0	3	315.826	2.256	10	0		DEAEHN
COC(=O)[C@@](C)(O)CN[C@@H](C)c1cccc(Br)c1	ZINC000228639284	402339340	/nfs/dbraw/zinc/33/93/40/402339340.db2.gz	DWUVXAKCJLTNJU-ZANVPECISA-N	0	3	316.195	2.024	10	0		DEAEHN
COc1c(C)cc(CN(C)C(=O)C[C@H]2CSCCN2)cc1C	ZINC000237127294	402396112	/nfs/dbraw/zinc/39/61/12/402396112.db2.gz	TYTVKRVYLHWBFC-HNNXBMFYSA-N	0	3	322.474	2.366	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1cccc2c1OCO2	ZINC000177384267	402396642	/nfs/dbraw/zinc/39/66/42/402396642.db2.gz	CRXTVFHNXZFSLW-AWEZNQCLSA-N	0	3	319.405	2.041	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)CCc2cccc3c2OCO3)CCN1C	ZINC000186041727	402398282	/nfs/dbraw/zinc/39/82/82/402398282.db2.gz	RNCQYEVDOUHACE-UKRRQHHQSA-N	0	3	318.417	2.289	10	0		DEAEHN
C[C@@H](c1ccccc1Cl)N1CCN(C(=O)C(C)(C)N)CC1	ZINC000237471362	402408714	/nfs/dbraw/zinc/40/87/14/402408714.db2.gz	VQCMCJRTIDZNDD-LBPRGKRZSA-N	0	3	309.841	2.283	10	0		DEAEHN
CCSCc1cc(C(=O)N(C)C[C@@H]2CCCN2CC)no1	ZINC000186220964	402412019	/nfs/dbraw/zinc/41/20/19/402412019.db2.gz	BZEMQAUZVXTIMJ-LBPRGKRZSA-N	0	3	311.451	2.484	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N[C@H](CO)c2ccccc2)C12CCOCC2	ZINC000186341219	402422821	/nfs/dbraw/zinc/42/28/21/402422821.db2.gz	JNLJITDDJNDKLH-BRWVUGGUSA-N	0	3	305.418	2.284	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)NCC1CCCCC1	ZINC000177696213	402427023	/nfs/dbraw/zinc/42/70/23/402427023.db2.gz	QPGHGUAIDSLMII-DOTOQJQBSA-N	0	3	309.498	2.488	10	0		DEAEHN
O=C(C[C@H]1CSCCN1)NCCCCOCc1ccccc1	ZINC000238086107	402437094	/nfs/dbraw/zinc/43/70/94/402437094.db2.gz	ZPGWSEAREWJKMR-INIZCTEOSA-N	0	3	322.474	2.195	10	0		DEAEHN
CC(C)(C)OC[C@H](O)CN1CC[C@]2(C1)OCc1ccccc12	ZINC000186665000	402452735	/nfs/dbraw/zinc/45/27/35/402452735.db2.gz	JHBIISMITHGVKK-CRAIPNDOSA-N	0	3	305.418	2.294	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C)C(=O)NCc1ccc(C)cc1	ZINC000245460231	402462456	/nfs/dbraw/zinc/46/24/56/402462456.db2.gz	FCGXWJSAYHAJIS-AEFFLSMTSA-N	0	3	317.477	2.416	10	0		DEAEHN
CC(C)NC(=O)CCN(C)[C@H](C)c1ccc([S@@](C)=O)cc1	ZINC000245479727	402464492	/nfs/dbraw/zinc/46/44/92/402464492.db2.gz	WOQZPMLYUNKHTM-LRTDBIEQSA-N	0	3	310.463	2.332	10	0		DEAEHN
CN(C)C1(CN(C)C(=O)NCc2ccc(Cl)cn2)CCC1	ZINC000186817245	402466348	/nfs/dbraw/zinc/46/63/48/402466348.db2.gz	OQYSZYJTKCARFT-UHFFFAOYSA-N	0	3	310.829	2.361	10	0		DEAEHN
Cc1ccc(O[C@@H](C)CNC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000245500302	402466457	/nfs/dbraw/zinc/46/64/57/402466457.db2.gz	ZVTCJZOXYAQPAT-HOTGVXAUSA-N	0	3	317.433	2.252	10	0		DEAEHN
COc1ccc([C@@H](C)N[C@H](C(=O)N2CCOCC2)C(C)C)cc1	ZINC000164968157	402471124	/nfs/dbraw/zinc/47/11/24/402471124.db2.gz	HDTFRYVWHAWTIQ-PBHICJAKSA-N	0	3	320.433	2.229	10	0		DEAEHN
CCc1nc(CCNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cs1	ZINC000245662394	402478128	/nfs/dbraw/zinc/47/81/28/402478128.db2.gz	DITBKFKNAIMNAR-JSGCOSHPSA-N	0	3	324.494	2.372	10	0		DEAEHN
Cc1ccc(CN2CCN(CC3CCOCC3)CC2)c(C)n1	ZINC000187059059	402480284	/nfs/dbraw/zinc/48/02/84/402480284.db2.gz	WZIPMGCNKDJMEW-UHFFFAOYSA-N	0	3	303.450	2.243	10	0		DEAEHN
CCOC(=O)C(C)(C)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245757133	402486699	/nfs/dbraw/zinc/48/66/99/402486699.db2.gz	YQLSAUMKCAANCG-CABCVRRESA-N	0	3	318.417	2.137	10	0		DEAEHN
COCC[C@](C)(O)CN[C@@H](C)c1ccc(OC)c(NC(C)=O)c1	ZINC000178380772	402491954	/nfs/dbraw/zinc/49/19/54/402491954.db2.gz	DMZBSGQCKHOCJB-SJCJKPOMSA-N	0	3	324.421	2.092	10	0		DEAEHN
C[C@H]1CC[C@](CO)(N(C)CC(=O)N2CCc3sccc3C2)C1	ZINC000187944470	402513620	/nfs/dbraw/zinc/51/36/20/402513620.db2.gz	XEIWJGKEVGCXLD-GUYCJALGSA-N	0	3	322.474	2.116	10	0		DEAEHN
CCC(CC)[C@@H]1C[C@H](NC(=O)N2CC[C@@H](N(C)C)C2)CCO1	ZINC000245901359	402495615	/nfs/dbraw/zinc/49/56/15/402495615.db2.gz	DQZBXTCPJBKQEW-OAGGEKHMSA-N	0	3	311.470	2.316	10	0		DEAEHN
CC(C)COC1CCN(C(=O)C2(N)Cc3ccccc3C2)CC1	ZINC000178443251	402499507	/nfs/dbraw/zinc/49/95/07/402499507.db2.gz	ONMAIWFBJNQFNK-UHFFFAOYSA-N	0	3	316.445	2.146	10	0		DEAEHN
C[C@H](C(=O)NCc1ccc(CO)c(F)c1)N1[C@H](C)CC[C@H]1C	ZINC000245998457	402502456	/nfs/dbraw/zinc/50/24/56/402502456.db2.gz	CYBIAEOMFNURLX-JHJVBQTASA-N	0	3	308.397	2.196	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)[C@@H](C)[C@@H](N)c1ccccc1	ZINC000178809723	402542886	/nfs/dbraw/zinc/54/28/86/402542886.db2.gz	QMHDGIIYCMXBAT-WMLDXEAASA-N	0	3	314.433	2.491	10	0		DEAEHN
COc1ccccc1C/C(C)=C/C(=O)N1CCN2CCC[C@@H]2C1	ZINC000170946113	402543619	/nfs/dbraw/zinc/54/36/19/402543619.db2.gz	VTJQEFBDNXKSFA-LCJXNMAOSA-N	0	3	314.429	2.491	10	0		DEAEHN
CC(C)NC(=O)CCNC1(c2ccc(F)cc2)CCOCC1	ZINC000170970968	402546214	/nfs/dbraw/zinc/54/62/14/402546214.db2.gz	IITUVNNTUBEVOQ-UHFFFAOYSA-N	0	3	308.397	2.336	10	0		DEAEHN
COC(=O)[C@H](C)[C@@H](NC[C@@H](O)COC(C)(C)C)c1ccccc1	ZINC000246894953	402548610	/nfs/dbraw/zinc/54/86/10/402548610.db2.gz	REIBRJGIBFJSBH-FVQBIDKESA-N	0	3	323.433	2.302	10	0		DEAEHN
Cc1cccc(OCCNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000247695904	402574734	/nfs/dbraw/zinc/57/47/34/402574734.db2.gz	WRQPVGRPABDGLX-HOTGVXAUSA-N	0	3	319.449	2.498	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](COC)c2ccccc2)C1	ZINC000171048372	402552302	/nfs/dbraw/zinc/55/23/02/402552302.db2.gz	BDUUTUNCBCUDDM-HOTGVXAUSA-N	0	3	305.422	2.158	10	0		DEAEHN
CCOc1ccc(NC(=O)N2CC[C@@H](N(C)C)C2)cc1OC	ZINC000171072662	402554668	/nfs/dbraw/zinc/55/46/68/402554668.db2.gz	NKXWDZLENWJBFH-CYBMUJFWSA-N	0	3	307.394	2.262	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2cc3c(cc2Cl)OCO3)C1	ZINC000171073963	402554878	/nfs/dbraw/zinc/55/48/78/402554878.db2.gz	QLMYZHSYYXVDFJ-VIFPVBQESA-N	0	3	311.769	2.237	10	0		DEAEHN
CC[S@](=O)c1ccccc1C(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000247093357	402556951	/nfs/dbraw/zinc/55/69/51/402556951.db2.gz	IFBOKQXTFLURDG-QLEMLULZSA-N	0	3	320.458	2.123	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H]2CCCO[C@@H]2C(C)C)C1	ZINC000247098665	402557049	/nfs/dbraw/zinc/55/70/49/402557049.db2.gz	QGYDLHRDLVSDKH-OWCLPIDISA-N	0	3	311.470	2.221	10	0		DEAEHN
COCCOc1cccc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000247123714	402557485	/nfs/dbraw/zinc/55/74/85/402557485.db2.gz	JDQVFEJHTQDHJE-HOCLYGCPSA-N	0	3	318.417	2.021	10	0		DEAEHN
CC(C)[C@@H]1OCCC[C@@H]1CNC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000247205283	402560114	/nfs/dbraw/zinc/56/01/14/402560114.db2.gz	XKGSCWFHLTYDOY-ZACQAIPSSA-N	0	3	321.465	2.093	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(-c2ccco2)on1	ZINC000247460135	402567705	/nfs/dbraw/zinc/56/77/05/402567705.db2.gz	QSXFJVITDHPGGU-NEPJUHHUSA-N	0	3	301.346	2.243	10	0		DEAEHN
COc1cc(CN(CC(C)(C)O)C2CC2)cc2c1OCCO2	ZINC000189944181	402567760	/nfs/dbraw/zinc/56/77/60/402567760.db2.gz	LQNFCKUAEHZBED-UHFFFAOYSA-N	0	3	307.390	2.202	10	0		DEAEHN
COC(=O)[C@H](C)CN(Cc1ncc(C)c(OC)c1C)C1CC1	ZINC000171235637	402569417	/nfs/dbraw/zinc/56/94/17/402569417.db2.gz	ZPRKTYXJPJKCAK-GFCCVEGCSA-N	0	3	306.406	2.481	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)N[C@H]1COc2ccccc21	ZINC000247508417	402570056	/nfs/dbraw/zinc/57/00/56/402570056.db2.gz	OYYHUGHORQMIBO-HIFRSBDPSA-N	0	3	303.406	2.294	10	0		DEAEHN
C[C@@H](C(=O)NCc1ccccc1Cl)N1CCN2CCC[C@@H]2C1	ZINC000178637688	402520792	/nfs/dbraw/zinc/52/07/92/402520792.db2.gz	VXBVUWNLERUPGE-DZGCQCFKSA-N	0	3	321.852	2.125	10	0		DEAEHN
C[C@@H]1c2ccccc2CCN1C[C@H]1CCCN(S(C)(=O)=O)C1	ZINC000246349268	402526567	/nfs/dbraw/zinc/52/65/67/402526567.db2.gz	OZNRKZYPHHQSLM-HUUCEWRRSA-N	0	3	322.474	2.277	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2c1	ZINC000189325823	402533877	/nfs/dbraw/zinc/53/38/77/402533877.db2.gz	IQXADASUJSNMAK-CYBMUJFWSA-N	0	3	301.390	2.343	10	0		DEAEHN
COC(=O)CC1(CC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)CCCC1	ZINC000189322032	402534225	/nfs/dbraw/zinc/53/42/25/402534225.db2.gz	JZIGBIXYTMIYRR-HUUCEWRRSA-N	0	3	324.465	2.441	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)CCCOCCc2ccccc2)C1	ZINC000170865170	402535244	/nfs/dbraw/zinc/53/52/44/402535244.db2.gz	YDRJSFAJJJCPJI-QGZVFWFLSA-N	0	3	304.434	2.188	10	0		DEAEHN
Cc1cc(CCNC(=O)NC[C@@H](C)N(C)C2CC2)cc(C)c1O	ZINC000189361914	402535413	/nfs/dbraw/zinc/53/54/13/402535413.db2.gz	OOMPEIVRBVOZPV-CQSZACIVSA-N	0	3	319.449	2.333	10	0		DEAEHN
CN1CCO[C@H](CN[C@H]2CCCOc3c(Cl)cccc32)C1	ZINC000246584318	402537461	/nfs/dbraw/zinc/53/74/61/402537461.db2.gz	YXKDMAKHPKXQCT-DOMZBBRYSA-N	0	3	310.825	2.474	10	0		DEAEHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)NCCCc1ccccn1	ZINC000179185022	402579011	/nfs/dbraw/zinc/57/90/11/402579011.db2.gz	KAGUVIIPBBFHAV-HZPDHXFCSA-N	0	3	318.465	2.434	10	0		DEAEHN
CN(Cc1cnn2ccccc12)[C@H]1CCCN(c2cccnn2)C1	ZINC000179496730	402591950	/nfs/dbraw/zinc/59/19/50/402591950.db2.gz	GAIYROZJRKUBIB-INIZCTEOSA-N	0	3	322.416	2.225	10	0		DEAEHN
CCOCCN1CCN(Cc2cnn(C(C)C)c2)C[C@@H]1CC	ZINC000179513556	402593195	/nfs/dbraw/zinc/59/31/95/402593195.db2.gz	XJSUEETVYPORLI-KRWDZBQOSA-N	0	3	308.470	2.397	10	0		DEAEHN
Cc1nc(C)n(C[C@H]2CCCN(Cc3cnn4ccccc34)C2)n1	ZINC000179530865	402593526	/nfs/dbraw/zinc/59/35/26/402593526.db2.gz	LONRWUCRQQGIPL-INIZCTEOSA-N	0	3	324.432	2.455	10	0		DEAEHN
COCCOc1cccc(CN2CCCN(C3CC3)CC2)c1	ZINC000179728831	402598869	/nfs/dbraw/zinc/59/88/69/402598869.db2.gz	JHDDMIOUARAEBJ-UHFFFAOYSA-N	0	3	304.434	2.382	10	0		DEAEHN
CN1CCC(N(Cc2ccco2)C(=O)N[C@H]2CCCOC2)CC1	ZINC000171616708	402602239	/nfs/dbraw/zinc/60/22/39/402602239.db2.gz	BSLIHNFXSDNCND-AWEZNQCLSA-N	0	3	321.421	2.064	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(Cc2cncs2)C1	ZINC000190488580	402605010	/nfs/dbraw/zinc/60/50/10/402605010.db2.gz	NLELJTMFBQHGDJ-HNNXBMFYSA-N	0	3	302.447	2.492	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cc3c(cc2C)OCO3)C1	ZINC000180088299	402606890	/nfs/dbraw/zinc/60/68/90/402606890.db2.gz	AYYHRDAEZBYMKK-GFCCVEGCSA-N	0	3	305.378	2.330	10	0		DEAEHN
CC(C)COC1CCN(C(=O)NC[C@H](C)N(C)C2CC2)CC1	ZINC000171695553	402611461	/nfs/dbraw/zinc/61/14/61/402611461.db2.gz	FTLRCXATPHBRJV-AWEZNQCLSA-N	0	3	311.470	2.316	10	0		DEAEHN
COc1ccc(OCCCN2CCC[C@H](n3cncn3)C2)cc1	ZINC000171703539	402612142	/nfs/dbraw/zinc/61/21/42/402612142.db2.gz	IZPPGZYYPRSKAD-HNNXBMFYSA-N	0	3	316.405	2.393	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000248885250	402612930	/nfs/dbraw/zinc/61/29/30/402612930.db2.gz	UJDOOYRWSJCWFL-NXHRZFHOSA-N	0	3	316.445	2.440	10	0		DEAEHN
CN(C)C[C@H]1CN(c2nc(C(F)F)nc3ccccc32)CCO1	ZINC000171727845	402615701	/nfs/dbraw/zinc/61/57/01/402615701.db2.gz	RMTRSKVYDAMZMH-NSHDSACASA-N	0	3	322.359	2.334	10	0		DEAEHN
CN(C[C@H](O)CO[C@H]1CCCc2ccccc21)CC1(CO)CC1	ZINC000248955661	402615831	/nfs/dbraw/zinc/61/58/31/402615831.db2.gz	CQQWHJLLOODART-WMZOPIPTSA-N	0	3	319.445	2.146	10	0		DEAEHN
COc1ccccc1NC(=O)C[C@@H](C)NCC1(C)OCCCO1	ZINC000190652918	402616537	/nfs/dbraw/zinc/61/65/37/402616537.db2.gz	XEGBMNSJQACNHO-CYBMUJFWSA-N	0	3	322.405	2.155	10	0		DEAEHN
O[C@H](CSC[C@H]1CCCO1)CN1CCc2ccccc2C1	ZINC000249013909	402617763	/nfs/dbraw/zinc/61/77/63/402617763.db2.gz	JVMBSFIJODCBAX-DLBZAZTESA-N	0	3	307.459	2.318	10	0		DEAEHN
Cc1cc(C)c2c(c1)[C@@H](NC[C@H]1CN(C)CCO1)CCCO2	ZINC000180493126	402617979	/nfs/dbraw/zinc/61/79/79/402617979.db2.gz	GUSRVZFLBXYCCT-RDJZCZTQSA-N	0	3	304.434	2.437	10	0		DEAEHN
C[C@@H]1OCCC[C@H]1C(=O)NCc1ccccc1OCCN(C)C	ZINC000190701219	402619442	/nfs/dbraw/zinc/61/94/42/402619442.db2.gz	GABQBQMKBZGCSG-GOEBONIOSA-N	0	3	320.433	2.058	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1C	ZINC000249112660	402620617	/nfs/dbraw/zinc/62/06/17/402620617.db2.gz	AVMKDGWCMDJIGB-GOEBONIOSA-N	0	3	317.433	2.183	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N2CC(C)(C)OC(C)(C)C2)C1	ZINC000249138736	402621773	/nfs/dbraw/zinc/62/17/73/402621773.db2.gz	XIMMHVPPPPOPTN-ZIAGYGMSSA-N	0	3	311.470	2.314	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(F)c1	ZINC000249153360	402622530	/nfs/dbraw/zinc/62/25/30/402622530.db2.gz	HSYKRWWVGPVSNM-QWHCGFSZSA-N	0	3	321.396	2.014	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NCc1cn(C(C)(C)C)nn1	ZINC000190840442	402626460	/nfs/dbraw/zinc/62/64/60/402626460.db2.gz	IMMKUJUPBQEMCJ-MRXNPFEDSA-N	0	3	315.465	2.296	10	0		DEAEHN
CN(C)C[C@H](NC(=O)N[C@@H]1CCC[C@H]1CCO)c1ccccc1	ZINC000249478194	402630827	/nfs/dbraw/zinc/63/08/27/402630827.db2.gz	AMLOAFZLZYTBKI-BBWFWOEESA-N	0	3	319.449	2.140	10	0		DEAEHN
CCOc1cc(NC(=O)N2CCN3CCC[C@H]3C2)ccc1OC	ZINC000171890359	402631985	/nfs/dbraw/zinc/63/19/85/402631985.db2.gz	SODQBIDQWZDDTM-AWEZNQCLSA-N	0	3	319.405	2.406	10	0		DEAEHN
Cc1csc(CCCCNC(=O)N2CCN3CCC[C@H]3C2)n1	ZINC000171906861	402632373	/nfs/dbraw/zinc/63/23/73/402632373.db2.gz	IUQFGNNJUYCGRQ-AWEZNQCLSA-N	0	3	322.478	2.264	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(C)CC1CCCCC1	ZINC000171908336	402633042	/nfs/dbraw/zinc/63/30/42/402633042.db2.gz	DKTVTWMBWFTRFY-INIZCTEOSA-N	0	3	311.470	2.319	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@H](C)Oc2cccc(C(C)=O)c2)C1	ZINC000249843800	402642261	/nfs/dbraw/zinc/64/22/61/402642261.db2.gz	ZJLVVOPPFXCEHV-GOEBONIOSA-N	0	3	318.417	2.257	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)c2ccc3c(c2)NC(=O)C3(C)C)C1	ZINC000293033334	289295461	/nfs/dbraw/zinc/29/54/61/289295461.db2.gz	GKCZHESJHZFNPJ-CYBMUJFWSA-N	0	3	315.417	2.083	10	0		DEAEHN
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1C[C@H](O)CCc1ccccc1	ZINC000191178690	402648763	/nfs/dbraw/zinc/64/87/63/402648763.db2.gz	HKZLVUAIWHVJBY-TVFCKZIOSA-N	0	3	317.429	2.254	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COc2cc(C)cc(C)c2)CC[C@H]1C	ZINC000251649643	402648920	/nfs/dbraw/zinc/64/89/20/402648920.db2.gz	HMEGIMIENHEYHW-SOLBZPMBSA-N	0	3	307.434	2.400	10	0		DEAEHN
Cc1ccc(OC2CCN(C[C@H](O)COCC(C)C)CC2)nc1	ZINC000181543750	402649250	/nfs/dbraw/zinc/64/92/50/402649250.db2.gz	FBFMKULDZHYLEB-INIZCTEOSA-N	0	3	322.449	2.267	10	0		DEAEHN
C[C@H](C(=O)Nc1ccc(F)c(F)c1)N1CCCN(C2CC2)CC1	ZINC000172347947	402651313	/nfs/dbraw/zinc/65/13/13/402651313.db2.gz	HLPMCZUWQILETR-GFCCVEGCSA-N	0	3	323.387	2.462	10	0		DEAEHN
FC(F)(F)Cn1ccnc1CN1CCCN(C2CC2)CC1	ZINC000172347360	402651387	/nfs/dbraw/zinc/65/13/87/402651387.db2.gz	LOOYUBAKJWFVGA-UHFFFAOYSA-N	0	3	302.344	2.116	10	0		DEAEHN
C[C@H](NC(=O)N1CCN(CC2CCOCC2)CC1)C1CCCC1	ZINC000172466733	402657668	/nfs/dbraw/zinc/65/76/68/402657668.db2.gz	JPEJGUOMANVWIA-HNNXBMFYSA-N	0	3	323.481	2.319	10	0		DEAEHN
COC(=O)CNC(=O)[C@H](C)N[C@H](C)c1ccc(C(C)(C)C)cc1	ZINC000182608884	402703621	/nfs/dbraw/zinc/70/36/21/402703621.db2.gz	DWMHUKLSNMXXBY-OLZOCXBDSA-N	0	3	320.433	2.312	10	0		DEAEHN
CCOC(=O)C[C@H](C)N(C)Cc1ccc(-n2ccnc2)nc1	ZINC000182666564	402706954	/nfs/dbraw/zinc/70/69/54/402706954.db2.gz	BWTXHYGDDJJUPN-ZDUSSCGKSA-N	0	3	302.378	2.041	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@](C)(Cc1ccccc1)[C@@H](C)O)N(C)C	ZINC000192049178	402707840	/nfs/dbraw/zinc/70/78/40/402707840.db2.gz	CVPCLDBAIPKEDZ-SUMDDJOVSA-N	0	3	320.477	2.463	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cccc(Br)c2F)C1	ZINC000192109780	402711779	/nfs/dbraw/zinc/71/17/79/402711779.db2.gz	SUQZSSZJCXFMEX-VIFPVBQESA-N	0	3	315.186	2.364	10	0		DEAEHN
Cc1ccccc1CS(=O)(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000173886114	402716810	/nfs/dbraw/zinc/71/68/10/402716810.db2.gz	VALPADTZYZLVQD-GOEBONIOSA-N	0	3	310.463	2.143	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)Nc1ccc(Cl)cc1	ZINC000172542789	402661630	/nfs/dbraw/zinc/66/16/30/402661630.db2.gz	WMQQLDRYUDJKEE-UHFFFAOYSA-N	0	3	307.825	2.449	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1N(C)C(=O)CN1CCCN(C2CC2)CC1	ZINC000172543394	402661657	/nfs/dbraw/zinc/66/16/57/402661657.db2.gz	UHRRTYZCCFNMHM-WBVHZDCISA-N	0	3	307.482	2.194	10	0		DEAEHN
CCOCCN1CCN(CCc2scnc2C)C[C@@H]1CC	ZINC000172535602	402661905	/nfs/dbraw/zinc/66/19/05/402661905.db2.gz	WXSYNYUPVUANTP-HNNXBMFYSA-N	0	3	311.495	2.427	10	0		DEAEHN
Cc1nc(C)c(CN2CCCC[C@@H]2CN2CCOCC2)s1	ZINC000172802070	402676709	/nfs/dbraw/zinc/67/67/09/402676709.db2.gz	ZDBDTICSXVHRTE-OAHLLOKOSA-N	0	3	309.479	2.447	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N[C@H]1C[C@H]1c1ccccc1	ZINC000261940045	402719862	/nfs/dbraw/zinc/71/98/62/402719862.db2.gz	UQDLGVYBTCTAEJ-ZAHIEGGZSA-N	0	3	314.429	2.191	10	0		DEAEHN
Clc1ccc(OCCN2CC[C@H](N3CCOCC3)C2)cc1	ZINC000173931976	402720195	/nfs/dbraw/zinc/72/01/95/402720195.db2.gz	AIYDJBNDIAHLOJ-HNNXBMFYSA-N	0	3	310.825	2.125	10	0		DEAEHN
Cc1cccc(C)c1NCC(=O)N1CCCN(C2CC2)CC1	ZINC000173336938	402693304	/nfs/dbraw/zinc/69/33/04/402693304.db2.gz	JYADNWOHRRVIAO-UHFFFAOYSA-N	0	3	301.434	2.412	10	0		DEAEHN
CC[C@@H](C)CC(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000191810180	402694152	/nfs/dbraw/zinc/69/41/52/402694152.db2.gz	NUHKDLXOORKMLK-OAHLLOKOSA-N	0	3	318.465	2.228	10	0		DEAEHN
CC[C@@H](O)CN1CCN(CCCc2ccccc2OC)CC1	ZINC000182512519	402696298	/nfs/dbraw/zinc/69/62/98/402696298.db2.gz	BTMOVCJVVXKMHA-QGZVFWFLSA-N	0	3	306.450	2.016	10	0		DEAEHN
CNC(=O)NC(=O)CCN1CC[C@@H](C)[C@H]1c1cccc(F)c1	ZINC000175146363	402782979	/nfs/dbraw/zinc/78/29/79/402782979.db2.gz	CMILKCKWHBIZKQ-ABAIWWIYSA-N	0	3	307.369	2.054	10	0		DEAEHN
C[C@H](NCc1ccc(OCCN(C)C)cc1)c1ccnn1C	ZINC000192689505	402744325	/nfs/dbraw/zinc/74/43/25/402744325.db2.gz	ZQHNUFFMFCINJQ-AWEZNQCLSA-N	0	3	302.422	2.211	10	0		DEAEHN
Cn1cc(N2CCC[C@H](NCC3=Cc4ccccc4OC3)C2)cn1	ZINC000174519461	402745227	/nfs/dbraw/zinc/74/52/27/402745227.db2.gz	YRRRHGXJTOJNFV-KRWDZBQOSA-N	0	3	324.428	2.455	10	0		DEAEHN
COc1c(C)cc(CN(C)CCN2CCO[C@H](C)C2)cc1C	ZINC000192730228	402746660	/nfs/dbraw/zinc/74/66/60/402746660.db2.gz	GSTKAQHCFOEGGG-MRXNPFEDSA-N	0	3	306.450	2.465	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(CCc2cc(Cl)cs2)n1	ZINC000263231574	402748149	/nfs/dbraw/zinc/74/81/49/402748149.db2.gz	NMGBJPRETYJHHD-NSHDSACASA-N	0	3	312.826	2.146	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(C2C3CC4CC(C3)CC2C4)n1	ZINC000263282472	402753638	/nfs/dbraw/zinc/75/36/38/402753638.db2.gz	UNNVUIDPXIFZRF-DUTNFGBUSA-N	0	3	302.422	2.185	10	0		DEAEHN
C[C@H](Sc1ccccc1)c1nc([C@H]2CNCCN2C)no1	ZINC000263316186	402758088	/nfs/dbraw/zinc/75/80/88/402758088.db2.gz	ZMSIYDIPCOBOJB-WCQYABFASA-N	0	3	304.419	2.499	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NC(=O)NC[C@H]1CCCN(C)C1	ZINC000174805783	402758514	/nfs/dbraw/zinc/75/85/14/402758514.db2.gz	MRBNXBIBSLTMBW-DOTOQJQBSA-N	0	3	319.449	2.233	10	0		DEAEHN
C[C@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)C1CCCC1	ZINC000174921922	402763257	/nfs/dbraw/zinc/76/32/57/402763257.db2.gz	NSTJDBOLXURPHC-GOEBONIOSA-N	0	3	311.470	2.317	10	0		DEAEHN
CN(C)CCN(C(=O)c1ccc2nnn(C)c2c1)c1ccccc1	ZINC000183400987	402763791	/nfs/dbraw/zinc/76/37/91/402763791.db2.gz	YIRQYFBNJUJKMY-UHFFFAOYSA-N	0	3	323.400	2.177	10	0		DEAEHN
COC(=O)c1ccc(NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000175000380	402770136	/nfs/dbraw/zinc/77/01/36/402770136.db2.gz	GWXVOZNAQUFPQQ-SWLSCSKDSA-N	0	3	319.405	2.420	10	0		DEAEHN
CCc1nc(Cl)c(C)c(NC[C@@H](O)CN2CCCCC2)n1	ZINC000175037717	402773789	/nfs/dbraw/zinc/77/37/89/402773789.db2.gz	CCHUZXRPJHULEQ-GFCCVEGCSA-N	0	3	312.845	2.260	10	0		DEAEHN
O=C(CN[C@H](c1ccc(Cl)cc1)C1CC1)N1CCOCC1	ZINC000183707107	402790492	/nfs/dbraw/zinc/79/04/92/402790492.db2.gz	RHXSPSWKPOJXLN-INIZCTEOSA-N	0	3	308.809	2.240	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000194368697	402793913	/nfs/dbraw/zinc/79/39/13/402793913.db2.gz	UJDOOYRWSJCWFL-NJAFHUGGSA-N	0	3	316.445	2.440	10	0		DEAEHN
C[C@@H](C(=O)N1CC[C@H](C(=O)OC(C)(C)C)C1)N1[C@H](C)CC[C@@H]1C	ZINC000175471996	402809591	/nfs/dbraw/zinc/80/95/91/402809591.db2.gz	SFHIFSFJJRUMMK-XGUBFFRZSA-N	0	3	324.465	2.438	10	0		DEAEHN
CCN(CCO)CCNC(=O)c1cc2cc(Cl)ccc2o1	ZINC000183983546	402810580	/nfs/dbraw/zinc/81/05/80/402810580.db2.gz	SGMSXJHNMPGPHB-UHFFFAOYSA-N	0	3	310.781	2.130	10	0		DEAEHN
Cc1noc2nc(C(C)C)cc(C(=O)NC[C@@H]3CCCN3C)c12	ZINC000194715190	402812219	/nfs/dbraw/zinc/81/22/19/402812219.db2.gz	BEEKUJUOEABAMV-LBPRGKRZSA-N	0	3	316.405	2.479	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000194918879	402822833	/nfs/dbraw/zinc/82/28/33/402822833.db2.gz	APVDLTCKGWPKTL-QXULXFAOSA-N	0	3	308.466	2.474	10	0		DEAEHN
CCc1cc(C)c(C(=O)NC(C)(C)CCN2CCN(C)CC2)o1	ZINC000184192567	402825491	/nfs/dbraw/zinc/82/54/91/402825491.db2.gz	ZLNCCVGGZMFLHX-UHFFFAOYSA-N	0	3	321.465	2.296	10	0		DEAEHN
COC[C@H](NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)c1ccco1	ZINC000175742613	402828428	/nfs/dbraw/zinc/82/84/28/402828428.db2.gz	AUHWZAKUUYQNSA-RDBSUJKOSA-N	0	3	309.410	2.091	10	0		DEAEHN
COC[C@H](NC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1)c1ccco1	ZINC000175742597	402828503	/nfs/dbraw/zinc/82/85/03/402828503.db2.gz	AUHWZAKUUYQNSA-MJBXVCDLSA-N	0	3	309.410	2.091	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC(Oc2ccc(C)cn2)CC1	ZINC000195210493	402837137	/nfs/dbraw/zinc/83/71/37/402837137.db2.gz	NSMRLVHJNPIEKL-MRXNPFEDSA-N	0	3	322.449	2.411	10	0		DEAEHN
CN(C(=O)[C@H]1CCCN(Cc2ccccc2)C1)c1nncs1	ZINC000184349336	402837432	/nfs/dbraw/zinc/83/74/32/402837432.db2.gz	BARXIRYZXUFGHN-AWEZNQCLSA-N	0	3	316.430	2.413	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)CCc1cscn1)c1ccccc1	ZINC000195242864	402838753	/nfs/dbraw/zinc/83/87/53/402838753.db2.gz	PHAOKQHSAKNRPA-OAHLLOKOSA-N	0	3	303.431	2.495	10	0		DEAEHN
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@@H]1C[C@@H]1C1CCCCC1	ZINC000184379844	402839634	/nfs/dbraw/zinc/83/96/34/402839634.db2.gz	GKKRTRQPGWBCHM-KBAYOESNSA-N	0	3	321.509	2.345	10	0		DEAEHN
O=C(COc1ccc(F)cc1Cl)N1CCN2CCC[C@@H]2C1	ZINC000195318055	402841499	/nfs/dbraw/zinc/84/14/99/402841499.db2.gz	PGAZYTXQDICLGI-GFCCVEGCSA-N	0	3	312.772	2.165	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCCCNc1ccccn1	ZINC000194065153	402783478	/nfs/dbraw/zinc/78/34/78/402783478.db2.gz	JXJJVLVJDYLMTQ-OAHLLOKOSA-N	0	3	321.469	2.159	10	0		DEAEHN
Cc1cccc(F)c1NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000184474848	402845919	/nfs/dbraw/zinc/84/59/19/402845919.db2.gz	NUKOYVYVACKERK-CYBMUJFWSA-N	0	3	309.385	2.102	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NC1CCSCC1)c1ccccc1	ZINC000195469935	402846802	/nfs/dbraw/zinc/84/68/02/402846802.db2.gz	BZSHNPPBBVCRIN-OAHLLOKOSA-N	0	3	307.463	2.484	10	0		DEAEHN
CC(=O)N1CC[C@@H](N[C@@H]2CCCOC2)c2ccc(F)cc2C1	ZINC000184510654	402847861	/nfs/dbraw/zinc/84/78/61/402847861.db2.gz	VKDLVBYQVINCRL-NVXWUHKLSA-N	0	3	306.381	2.388	10	0		DEAEHN
Cc1cccc(O[C@@H](C)CNC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000176048383	402850152	/nfs/dbraw/zinc/85/01/52/402850152.db2.gz	DSQSSRUKKTZDLD-JKSUJKDBSA-N	0	3	317.433	2.252	10	0		DEAEHN
CCOC(=O)CCC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000268597109	403097869	/nfs/dbraw/zinc/09/78/69/403097869.db2.gz	UEZUZDLCJRVOES-MRXNPFEDSA-N	0	3	318.417	2.063	10	0		DEAEHN
O[C@@H](CNCc1cccc(Cl)c1Cl)Cn1cccn1	ZINC000566733735	292264408	/nfs/dbraw/zinc/26/44/08/292264408.db2.gz	YCGTXMHKJPXGKL-NSHDSACASA-N	0	3	300.189	2.341	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)c1ccc2c(c1)NC(=O)C2(C)C	ZINC000293364682	403453421	/nfs/dbraw/zinc/45/34/21/403453421.db2.gz	CBNHLDKVAYZUGH-UHFFFAOYSA-N	0	3	315.417	2.083	10	0		DEAEHN
O=C(c1ccc(CN2CCCCC2)cc1)N1C[C@@H](F)C[C@H]1CO	ZINC000347432523	403708036	/nfs/dbraw/zinc/70/80/36/403708036.db2.gz	GLWAKQULOHIJDV-IRXDYDNUSA-N	0	3	320.408	2.217	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2ccc3cc[nH]c(=O)c3c2)C1	ZINC000333359421	403733816	/nfs/dbraw/zinc/73/38/16/403733816.db2.gz	GXUUMPVEHQBSFY-CYBMUJFWSA-N	0	3	300.362	2.108	10	0		DEAEHN
CN(Cc1cscn1)C[C@@H]1CCCN(C)[C@H]1c1cnn(C)c1	ZINC000352904094	404687930	/nfs/dbraw/zinc/68/79/30/404687930.db2.gz	SISSFNHCBHZVNM-XJKSGUPXSA-N	0	3	319.478	2.392	10	0		DEAEHN
Cc1cn2cc(C(=O)NC3CC(N4CCCCC4)C3)sc2n1	ZINC000357900246	404747546	/nfs/dbraw/zinc/74/75/46/404747546.db2.gz	OIQBRZWROUOAMM-UHFFFAOYSA-N	0	3	318.446	2.451	10	0		DEAEHN
CCCCN(C)CCNC(=O)N1CCCC[C@@H]1c1ccnn1C	ZINC000359677000	404801753	/nfs/dbraw/zinc/80/17/53/404801753.db2.gz	FQPGSDVWFPNIHI-MRXNPFEDSA-N	0	3	321.469	2.389	10	0		DEAEHN
Cc1ncc2c(n1)CC[C@H](NCc1ccc(-c3cc[nH]n3)o1)C2	ZINC000378218142	404897843	/nfs/dbraw/zinc/89/78/43/404897843.db2.gz	GMDZQSHGPZLBKB-ZDUSSCGKSA-N	0	3	309.373	2.415	10	0		DEAEHN
Cn1cc(CN2CCC[C@H]2Cn2cncn2)c(-c2ccccc2)n1	ZINC000378441816	404966148	/nfs/dbraw/zinc/96/61/48/404966148.db2.gz	IGKVIJMSAHADPG-KRWDZBQOSA-N	0	3	322.416	2.343	10	0		DEAEHN
Cn1c2ccc(CN3CC[C@@H](C(C)(C)C)[C@@H](O)C3)cc2oc1=O	ZINC000408012414	405089284	/nfs/dbraw/zinc/08/92/84/405089284.db2.gz	IPKINMQXXJSETI-HIFRSBDPSA-N	0	3	318.417	2.360	10	0		DEAEHN
C/C=C\C[C@@H](NC(=O)c1cccc(CN(C)C)c1)C(=O)OCC	ZINC000361570819	405135410	/nfs/dbraw/zinc/13/54/10/405135410.db2.gz	YNBRFAPSFDTTSF-GMNBZTITSA-N	0	3	318.417	2.376	10	0		DEAEHN
C/C=C/C[C@@H](NC(=O)c1cccc(CN(C)C)c1)C(=O)OCC	ZINC000361570818	405135746	/nfs/dbraw/zinc/13/57/46/405135746.db2.gz	YNBRFAPSFDTTSF-BIENSFFJSA-N	0	3	318.417	2.376	10	0		DEAEHN
CC(C(=O)N[C@@H]1C[C@H]1c1ccc2ccccc2c1)S(C)(=O)=O	ZINC000437279545	405192998	/nfs/dbraw/zinc/19/29/98/405192998.db2.gz	YKLSKCWEOBRCNG-KNXALSJPSA-N	0	3	317.410	2.245	10	0		DEAEHN
CCN1C[C@H](C)N(C(=O)c2cc3[nH]cnc3cc2F)C[C@@H]1C	ZINC000408471568	405214795	/nfs/dbraw/zinc/21/47/95/405214795.db2.gz	STFQBDMHEBCHFB-QWRGUYRKSA-N	0	3	304.369	2.257	10	0		DEAEHN
CN(CCCO)CCc1nc2sc3c(c2c(N)n1)CCCC3	ZINC000440967328	405332771	/nfs/dbraw/zinc/33/27/71/405332771.db2.gz	KZGYFUGHVYFTKG-UHFFFAOYSA-N	0	3	320.462	2.009	10	0		DEAEHN
c1ccc(-n2nnnc2CCN[C@H](c2cccnc2)C2CC2)cc1	ZINC000445767714	405356679	/nfs/dbraw/zinc/35/66/79/405356679.db2.gz	SUUBYQLKRUBPIM-SFHVURJKSA-N	0	3	320.400	2.341	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@H](c1ccccc1)C(F)F	ZINC000455598684	405432097	/nfs/dbraw/zinc/43/20/97/405432097.db2.gz	NWYHQNOAZFRUNX-CQSZACIVSA-N	0	3	320.343	2.221	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2coc3ccccc23)CC12COC2	ZINC000449363598	405525854	/nfs/dbraw/zinc/52/58/54/405525854.db2.gz	MJRIATRKQKRYEE-OAHLLOKOSA-N	0	3	315.369	2.444	10	0		DEAEHN
c1ccc(-n2nnc(CN[C@H]3CCN(C4CC4)C3)c2C2CC2)cc1	ZINC000638563694	405547885	/nfs/dbraw/zinc/54/78/85/405547885.db2.gz	BDCHHLOHEBMGLM-HNNXBMFYSA-N	0	3	323.444	2.471	10	0		DEAEHN
c1cn(Cc2ccccc2)c(CN[C@@H]2CCn3ccnc3C2)n1	ZINC000494423044	405695073	/nfs/dbraw/zinc/69/50/73/405695073.db2.gz	DHNSAURXRRRFOX-MRXNPFEDSA-N	0	3	307.401	2.233	10	0		DEAEHN
O[C@@]1(c2cnn[n-]2)CCC[N@H+](CCc2ccc3ccccc3c2)C1	ZINC000583617888	405776864	/nfs/dbraw/zinc/77/68/64/405776864.db2.gz	GLGPGDBSZDINFK-IBGZPJMESA-N	0	3	322.412	2.484	10	0		DEAEHN
O[C@@]1(c2cnn[n-]2)CCC[N@@H+](CCc2ccc3ccccc3c2)C1	ZINC000583617888	405776867	/nfs/dbraw/zinc/77/68/67/405776867.db2.gz	GLGPGDBSZDINFK-IBGZPJMESA-N	0	3	322.412	2.484	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCC(F)(F)C2)CN1C1CC1	ZINC000495063208	405808641	/nfs/dbraw/zinc/80/86/41/405808641.db2.gz	WVYBTVNWOSQGBP-IJLUTSLNSA-N	0	3	301.381	2.489	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCC(CCC(=O)OC)CC1	ZINC000531476548	405964114	/nfs/dbraw/zinc/96/41/14/405964114.db2.gz	FXZRFMQHWAIMHL-OAHLLOKOSA-N	0	3	310.438	2.053	10	0		DEAEHN
c1cc(OCCN2CCOCC2)ccc1CN1CC[C@@H]1C1CC1	ZINC000639223484	405985765	/nfs/dbraw/zinc/98/57/65/405985765.db2.gz	VPYDGKXCKSUAHF-LJQANCHMSA-N	0	3	316.445	2.382	10	0		DEAEHN
COCC1(NCc2cc(Br)c(O)c(OC)c2)CC1	ZINC000531701864	405996148	/nfs/dbraw/zinc/99/61/48/405996148.db2.gz	NLDWKRDSFSSKEV-UHFFFAOYSA-N	0	3	316.195	2.432	10	0		DEAEHN
C(c1noc(CN2CCC[C@H]2CN2CCCCC2)n1)C1CC1	ZINC000639471468	406103925	/nfs/dbraw/zinc/10/39/25/406103925.db2.gz	OWBZIYWUJYULRG-HNNXBMFYSA-N	0	3	304.438	2.472	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@@H]1CC[C@@H]2CCC[C@H]2C1	ZINC000533816339	406163367	/nfs/dbraw/zinc/16/33/67/406163367.db2.gz	SHBBHUYRWBLJMR-OFQRWUPVSA-N	0	3	302.422	2.183	10	0		DEAEHN
O=C1[C@@H](NCc2ccc3[nH]cnc3c2)CCN1c1ccccc1	ZINC000518302354	406133982	/nfs/dbraw/zinc/13/39/82/406133982.db2.gz	AEPSGCQSIPSEME-INIZCTEOSA-N	0	3	306.369	2.458	10	0		DEAEHN
O=C1[C@@H](NCc2ccc3nc[nH]c3c2)CCN1c1ccccc1	ZINC000518302354	406133986	/nfs/dbraw/zinc/13/39/86/406133986.db2.gz	AEPSGCQSIPSEME-INIZCTEOSA-N	0	3	306.369	2.458	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(C[C@@H]1CCc3ncnn31)CC2	ZINC000639562903	406146290	/nfs/dbraw/zinc/14/62/90/406146290.db2.gz	AKTKNFBOZGDQTI-KRWDZBQOSA-N	0	3	310.401	2.069	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C	ZINC000487280107	406221203	/nfs/dbraw/zinc/22/12/03/406221203.db2.gz	QULSNFIDJDJTOK-AXTRIDKLSA-N	0	3	314.227	2.086	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@@H]1CCO[C@H](C2CC2)C1	ZINC000487533373	406242580	/nfs/dbraw/zinc/24/25/80/406242580.db2.gz	DRCSWRCARUTESH-MFKMUULPSA-N	0	3	314.227	2.230	10	0		DEAEHN
CC(C)N(Cc1ccccc1)C(=O)CN1CC[C@@H](CO)[C@H]1C	ZINC000488730808	406341780	/nfs/dbraw/zinc/34/17/80/406341780.db2.gz	HYNZTFJCAXAWPC-WBVHZDCISA-N	0	3	304.434	2.126	10	0		DEAEHN
CCCN(Cc1ccc(C)cc1)C(=O)CN1CC[C@H](CO)[C@H]1C	ZINC000488800142	406350011	/nfs/dbraw/zinc/35/00/11/406350011.db2.gz	DVRFNOWQBCUPFR-SJLPKXTDSA-N	0	3	318.461	2.436	10	0		DEAEHN
c1c[nH]c(-c2noc([C@@H]3CCCN(Cc4cccnc4)C3)n2)n1	ZINC000547147353	406390202	/nfs/dbraw/zinc/39/02/02/406390202.db2.gz	XEZCFKDDEUMJOO-CYBMUJFWSA-N	0	3	310.361	2.234	10	0		DEAEHN
CC(C)CN(C(=O)[C@H](N)CN(C)Cc1ccccc1)C1CC1	ZINC000637929316	406482747	/nfs/dbraw/zinc/48/27/47/406482747.db2.gz	LESNYHMJSHZSFY-QGZVFWFLSA-N	0	3	303.450	2.093	10	0		DEAEHN
N[C@@H]1CCO[C@@H]1C(=O)N[C@H]1CCSc2ccc(Cl)cc21	ZINC000637898458	406467721	/nfs/dbraw/zinc/46/77/21/406467721.db2.gz	RIEAWLJSZNLPNT-MDZLAQPJSA-N	0	3	312.822	2.109	10	0		DEAEHN
CN(C)CCc1ccccc1NC(=O)N(C)C1CCOCC1	ZINC000526096049	406544954	/nfs/dbraw/zinc/54/49/54/406544954.db2.gz	MYIQQVNRMDTSPJ-UHFFFAOYSA-N	0	3	305.422	2.433	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)[C@@H]1C	ZINC000637971506	406503133	/nfs/dbraw/zinc/50/31/33/406503133.db2.gz	WCKAOOCEEAUYQY-INMHGKMJSA-N	0	3	303.450	2.093	10	0		DEAEHN
C[C@@H](N[C@@H](C)C(=O)N1CCc2sccc2C1)[C@@H]1CCCO1	ZINC000183153720	287045712	/nfs/dbraw/zinc/04/57/12/287045712.db2.gz	XVRXXDFCQXYRSH-DYEKYZERSA-N	0	3	308.447	2.178	10	0		DEAEHN
C[C@@H](O)[C@H](C)NCc1cc(Br)cc2c1OCC2	ZINC000129174856	196025458	/nfs/dbraw/zinc/02/54/58/196025458.db2.gz	BPFQFZKUZBTRSW-DTWKUNHWSA-N	0	3	300.196	2.243	10	0		DEAEHN
NCc1cncn1Cc1cc(Br)cc2c1OCC2	ZINC000129231652	196031409	/nfs/dbraw/zinc/03/14/09/196031409.db2.gz	PRPHOWQBFCZEPI-UHFFFAOYSA-N	0	3	308.179	2.088	10	0		DEAEHN
Cc1ccc(CN)cc1S(=O)(=O)NCCCC(F)(F)F	ZINC000130551183	196089843	/nfs/dbraw/zinc/08/98/43/196089843.db2.gz	ZUXYYKKVMWABTD-UHFFFAOYSA-N	0	3	310.341	2.075	10	0		DEAEHN
COCCCNC(=S)NCCCN(C)Cc1ccccc1	ZINC000130738642	196105233	/nfs/dbraw/zinc/10/52/33/196105233.db2.gz	JFIOOHALXITPDO-UHFFFAOYSA-N	0	3	309.479	2.009	10	0		DEAEHN
C[C@H](CN1C(=O)C2(CC2)N[C@@H]1c1ccsc1)N1CCCC1	ZINC000130756218	196107300	/nfs/dbraw/zinc/10/73/00/196107300.db2.gz	BDWBZDYJDFLQKI-OCCSQVGLSA-N	0	3	305.447	2.195	10	0		DEAEHN
CCN[C@@H](C)c1cccc(S(=O)(=O)NC[C@@H](C)OCC)c1	ZINC000131229627	196152686	/nfs/dbraw/zinc/15/26/86/196152686.db2.gz	CMAVAVVKOGXHNJ-OLZOCXBDSA-N	0	3	314.451	2.060	10	0		DEAEHN
CCN[C@H](Cc1cccc(F)c1F)[C@@H]1CCCCS1(=O)=O	ZINC000131484214	196173728	/nfs/dbraw/zinc/17/37/28/196173728.db2.gz	MNTJOEKLTMRWJB-KGLIPLIRSA-N	0	3	317.401	2.453	10	0		DEAEHN
N[C@@H]1COC[C@H]1C(=O)Nc1cc(Cl)ccc1Br	ZINC000131637121	196186438	/nfs/dbraw/zinc/18/64/38/196186438.db2.gz	JFQBHFBYNGAKCF-VXNVDRBHSA-N	0	3	319.586	2.015	10	0		DEAEHN
COCc1cc([C@@H](C)N[C@H]2CCC(=O)N(C)C2)ccc1OC	ZINC000133006756	196304160	/nfs/dbraw/zinc/30/41/60/196304160.db2.gz	BHMYRYKSUQLSKQ-DOMZBBRYSA-N	0	3	306.406	2.113	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](NC[C@H]1CCCS1(=O)=O)CCC2	ZINC000133952616	196348330	/nfs/dbraw/zinc/34/83/30/196348330.db2.gz	ARLAHZJULHCRIZ-ZBFHGGJFSA-N	0	3	309.431	2.239	10	0		DEAEHN
CN1CCC[C@H](Nc2ccc(NS(C)(=O)=O)c(Cl)c2)C1	ZINC000134267777	196374447	/nfs/dbraw/zinc/37/44/47/196374447.db2.gz	NYLMJEUYEPWWTE-NSHDSACASA-N	0	3	317.842	2.218	10	0		DEAEHN
COc1ccc(Br)cc1C[C@@]1(O)CCCN(C)C1	ZINC000134345522	196380660	/nfs/dbraw/zinc/38/06/60/196380660.db2.gz	PRDFMKWQCVJHKR-AWEZNQCLSA-N	0	3	314.223	2.457	10	0		DEAEHN
CN1CCC[C@@]2(CC(=O)NC(=O)[C@@H]2c2cccc(Cl)c2)C1	ZINC000134372815	196382552	/nfs/dbraw/zinc/38/25/52/196382552.db2.gz	OYMBNUYXJYCTJX-GOEBONIOSA-N	0	3	306.793	2.182	10	0		DEAEHN
Cc1ccc2c(CCN[C@@H]3CCCS(=O)(=O)C3)cn(C)c2c1	ZINC000188699898	225029611	/nfs/dbraw/zinc/02/96/11/225029611.db2.gz	VVRDNHIPWRKRMM-OAHLLOKOSA-N	0	3	320.458	2.196	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NC[C@H]1CCC(C)(C)O1	ZINC000189635189	225058095	/nfs/dbraw/zinc/05/80/95/225058095.db2.gz	WYZRUVCZORUJSR-CQSZACIVSA-N	0	3	320.433	2.314	10	0		DEAEHN
C[C@@H]1CCC[C@@H](C(=O)N2CCCC[C@@H](N3CCN(C)CC3)C2)C1	ZINC000246804183	287370752	/nfs/dbraw/zinc/37/07/52/287370752.db2.gz	JWWSWOHHAIITGT-KZNAEPCWSA-N	0	3	321.509	2.441	10	0		DEAEHN
C[C@@H]1CN(C(=O)NCCCN(C)Cc2ccccc2)C[C@@H](C)O1	ZINC000046889424	424822782	/nfs/dbraw/zinc/82/27/82/424822782.db2.gz	WKYWYTZQTSEGLB-HZPDHXFCSA-N	0	3	319.449	2.327	10	0		DEAEHN
Cc1nnc(NC(=O)N[C@H](CN(C)C)c2ccccc2)s1	ZINC000043408752	424811869	/nfs/dbraw/zinc/81/18/69/424811869.db2.gz	GUNVBMRIEMSWNP-GFCCVEGCSA-N	0	3	305.407	2.271	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)Nc2cc(F)ccc2C)c1	ZINC000105881634	424849703	/nfs/dbraw/zinc/84/97/03/424849703.db2.gz	ACFMPDXJSKPQBD-ZDUSSCGKSA-N	0	3	304.369	2.256	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)Nc1cc(C2(C)CCCC2)on1	ZINC000565928896	424907486	/nfs/dbraw/zinc/90/74/86/424907486.db2.gz	BHUOWXJXYXOGMR-UHFFFAOYSA-N	0	3	320.437	3.064	10	0		DEAEHN
CN(C[C@H]1CCCN1C)C(=O)c1nscc1Br	ZINC000404776535	424928625	/nfs/dbraw/zinc/92/86/25/424928625.db2.gz	AJSZYWKVDPLADO-MRVPVSSYSA-N	0	3	318.240	2.072	10	0		DEAEHN
CN(C(=O)c1cc(F)c(F)c(F)c1)[C@@H](CN)C(F)(F)F	ZINC000662977697	425770282	/nfs/dbraw/zinc/77/02/82/425770282.db2.gz	BQHRUSHMSMOIFE-QMMMGPOBSA-N	0	3	300.202	2.066	10	0		DEAEHN
Cn1nccc1[C@@H]1OCC[C@H]1CN1CCCC[C@H]1c1cn[nH]c1	ZINC000328998649	268852655	/nfs/dbraw/zinc/85/26/55/268852655.db2.gz	VCZFDEGVWYRVAI-JLJPHGGASA-N	0	3	315.421	2.448	10	0		DEAEHN
CCN1CC[C@H](NC(=O)N[C@@H]2CCO[C@H](c3cccs3)C2)C1	ZINC000334128273	269022679	/nfs/dbraw/zinc/02/26/79/269022679.db2.gz	REJMFKVSSQEWPI-RDBSUJKOSA-N	0	3	323.462	2.362	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NC(=O)[C@@H]1NCCCC1(C)C	ZINC000390759548	269097807	/nfs/dbraw/zinc/09/78/07/269097807.db2.gz	YRKHMNXDWYXKEC-HOCLYGCPSA-N	0	3	304.434	2.486	10	0		DEAEHN
O=C(N[C@H]1CCOc2ccccc21)N1CC[C@H](N2CC=CC2)C1	ZINC000173373505	274993267	/nfs/dbraw/zinc/99/32/67/274993267.db2.gz	APSPGQNMZQBAHC-HOCLYGCPSA-N	0	3	313.401	2.166	10	0		DEAEHN
CCN(CC)C(=O)[C@H](c1ccccc1)N1CCN2CCC[C@@H]2C1	ZINC000178635045	276092330	/nfs/dbraw/zinc/09/23/30/276092330.db2.gz	FYHIYKZILKTDDY-MSOLQXFVSA-N	0	3	315.461	2.376	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc(-n2cccn2)cc1	ZINC000177029160	276181640	/nfs/dbraw/zinc/18/16/40/276181640.db2.gz	ZASIQWKAIVOEGK-KRWDZBQOSA-N	0	3	312.417	2.429	10	0		DEAEHN
COC(=O)[C@H](NC[C@H](C1CC1)N(C)Cc1ccccc1)C1CC1	ZINC000358664460	277120584	/nfs/dbraw/zinc/12/05/84/277120584.db2.gz	UBOPBHUCZPSACU-QZTJIDSGSA-N	0	3	316.445	2.438	10	0		DEAEHN
C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1ncoc1[C@@H]1CCCO1	ZINC000329352285	277973769	/nfs/dbraw/zinc/97/37/69/277973769.db2.gz	DUULBILXOLMYBG-MCIONIFRSA-N	0	3	319.405	2.225	10	0		DEAEHN
C[C@@H]1OCC[C@@H]1N[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1	ZINC000090968740	278056572	/nfs/dbraw/zinc/05/65/72/278056572.db2.gz	HDHKMEPAJVGPNH-YZOIGVHSSA-N	0	3	308.809	2.379	10	0		DEAEHN
C[C@H]1CCCC[C@H]1NC(=O)NC(=O)CN1CCCC12CCC2	ZINC000444787713	278337786	/nfs/dbraw/zinc/33/77/86/278337786.db2.gz	YOFUTTBWGWBWLQ-UONOGXRCSA-N	0	3	307.438	2.409	10	0		DEAEHN
C[C@@H](NCC1(C)OCCCO1)c1ccc(-n2cncn2)cc1	ZINC000190669346	278340128	/nfs/dbraw/zinc/34/01/28/278340128.db2.gz	PKPSBZBAOOXFBJ-CYBMUJFWSA-N	0	3	302.378	2.071	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H]2CCOC3(CCCC3)C2)C1	ZINC000246717328	279321618	/nfs/dbraw/zinc/32/16/18/279321618.db2.gz	NZAYJQGOPYQXHN-GJZGRUSLSA-N	0	3	309.454	2.262	10	0		DEAEHN
C[C@H]1c2ccccc2O[C@@H]1C(=O)N(C)[C@H]1CCN(C)C[C@H]1C	ZINC000247396227	280129429	/nfs/dbraw/zinc/12/94/29/280129429.db2.gz	MHWVOEHIZFBHTH-RMRKRWHISA-N	0	3	302.418	2.350	10	0		DEAEHN
CC[C@@H]1CCCCCN1C(=O)NC1CCN(CCOC)CC1	ZINC000119745049	280235841	/nfs/dbraw/zinc/23/58/41/280235841.db2.gz	QAEXJOYERBCTEF-MRXNPFEDSA-N	0	3	311.470	2.461	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NCc1cscn1)c1ccccc1	ZINC000051749753	281471748	/nfs/dbraw/zinc/47/17/48/281471748.db2.gz	CWWRFLQNNUXCAL-AWEZNQCLSA-N	0	3	304.419	2.245	10	0		DEAEHN
C[C@H](NCCC(=O)N1CCOCC1)c1ccc(F)c(Cl)c1	ZINC000135134742	282062826	/nfs/dbraw/zinc/06/28/26/282062826.db2.gz	UUBPHMYTOGYALP-NSHDSACASA-N	0	3	314.788	2.379	10	0		DEAEHN
CN(C)CCN(C(=O)c1cccc(C(F)(F)F)n1)C1CC1	ZINC000450717662	289125294	/nfs/dbraw/zinc/12/52/94/289125294.db2.gz	QQKWAVPUYBFJRL-UHFFFAOYSA-N	0	3	301.312	2.267	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)N[C@@H]2CCCOc3cc(F)ccc32)C1	ZINC000180595534	289383178	/nfs/dbraw/zinc/38/31/78/289383178.db2.gz	RIFMXUQFWBROQZ-DZGCQCFKSA-N	0	3	321.396	2.385	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NC[C@H]2CCC(C)(C)O2)C1	ZINC000249391685	290173987	/nfs/dbraw/zinc/17/39/87/290173987.db2.gz	ADDSDCOKWQPHDD-RRFJBIMHSA-N	0	3	309.454	2.070	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2c2ncncc2Br)C1	ZINC000229959870	290240743	/nfs/dbraw/zinc/24/07/43/290240743.db2.gz	DEZMKRXJFWVXIL-JQWIXIFHSA-N	0	3	311.227	2.160	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H]2CCC[C@H]2C[NH3+])c(Cl)cc1F	ZINC000237791171	301398909	/nfs/dbraw/zinc/39/89/09/301398909.db2.gz	XPRKIYBJADTARY-JOYOIKCWSA-N	0	3	320.817	2.193	10	0		DEAEHN
Cc1cnc([C@H](C)NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)s1	ZINC000262495036	302372237	/nfs/dbraw/zinc/37/22/37/302372237.db2.gz	LGWOGNZSLRMLFV-MEQWQQMJSA-N	0	3	323.462	2.161	10	0		DEAEHN
COC(C)(C)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000398002293	337303528	/nfs/dbraw/zinc/30/35/28/337303528.db2.gz	XAAWODNGUAZXMI-HOCLYGCPSA-N	0	3	304.434	2.438	10	0		DEAEHN
C[C@H]1CN(CCCCCOc2ccccc2)CCN1CCO	ZINC000188587890	533927592	/nfs/dbraw/zinc/92/75/92/533927592.db2.gz	IPMFZFXKVAVDCF-KRWDZBQOSA-N	0	3	306.450	2.234	10	0		DEAEHN
CC(=O)c1ccc(OCCCC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170859834	518395032	/nfs/dbraw/zinc/39/50/32/518395032.db2.gz	ZPDAUOFMZDAEQZ-INIZCTEOSA-N	0	3	318.417	2.211	10	0		DEAEHN
CCCC(=O)NCC(=O)NCC(C)(C)N[C@H](C)c1ccccc1	ZINC000103971605	519871582	/nfs/dbraw/zinc/87/15/82/519871582.db2.gz	VTUAJGRAICPJMP-CQSZACIVSA-N	0	3	319.449	2.148	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@H](c2cccc(O)c2)C1)N(C)C	ZINC000158250511	520974729	/nfs/dbraw/zinc/97/47/29/520974729.db2.gz	QAVHOEVHWQFWQG-CVEARBPZSA-N	0	3	306.406	2.022	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@H](CC(C)C)N2CCCCC2=O)C1	ZINC000246219784	521647278	/nfs/dbraw/zinc/64/72/78/521647278.db2.gz	VAXPXIFJQOAYQK-HOTGVXAUSA-N	0	3	323.481	2.014	10	0		DEAEHN
COc1cc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc(OC)c1C	ZINC000246735060	522147767	/nfs/dbraw/zinc/14/77/67/522147767.db2.gz	ASTUDWJQULQKPZ-DOMZBBRYSA-N	0	3	320.433	2.471	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)N1CC[C@]2(O)CCCC[C@H]2C1	ZINC000247993777	524328765	/nfs/dbraw/zinc/32/87/65/524328765.db2.gz	JRXCZZBWMUGOBP-SOLBZPMBSA-N	0	3	323.481	2.197	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1C	ZINC000247277208	534798210	/nfs/dbraw/zinc/79/82/10/534798210.db2.gz	FSNDEOQXYLAUMP-IINYFYTJSA-N	0	3	305.422	2.389	10	0		DEAEHN
Cc1cc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)ccc1F	ZINC000249153400	525101761	/nfs/dbraw/zinc/10/17/61/525101761.db2.gz	HTPIVFWXBATWPE-JSGCOSHPSA-N	0	3	321.396	2.014	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)CSCc2ccccn2)CCN1C	ZINC000124343377	525242887	/nfs/dbraw/zinc/24/28/87/525242887.db2.gz	BREVCELNMNTIMK-HIFRSBDPSA-N	0	3	307.463	2.256	10	0		DEAEHN
Cc1ccc([C@@H](C)CNC(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000162208789	525681028	/nfs/dbraw/zinc/68/10/28/525681028.db2.gz	PUEFPJCYNURSSO-DOTOQJQBSA-N	0	3	319.449	2.071	10	0		DEAEHN
Cc1ccc(C(N)=O)cc1NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000246814838	526252878	/nfs/dbraw/zinc/25/28/78/526252878.db2.gz	MDXQTYYPBYRCCG-JSGCOSHPSA-N	0	3	318.421	2.040	10	0		DEAEHN
COc1ccc(C[C@H](C)NCc2nnc3n2CCCC3)cc1	ZINC000368186877	536528175	/nfs/dbraw/zinc/52/81/75/536528175.db2.gz	BODUINSFQNPWJX-ZDUSSCGKSA-N	0	3	300.406	2.344	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@H]1CCO[C@@H](C2CC2)C1	ZINC000248943735	529067104	/nfs/dbraw/zinc/06/71/04/529067104.db2.gz	ZAZVWRUZQGSRGM-ARFHVFGLSA-N	0	3	309.454	2.070	10	0		DEAEHN
CC(C)(C)c1nnc(CN[C@@H]2CCC[C@H]2[C@H]2COCCN2)s1	ZINC000261978204	534926926	/nfs/dbraw/zinc/92/69/26/534926926.db2.gz	RIXIQTGFXKHCCW-JHJVBQTASA-N	0	3	324.494	2.082	10	0		DEAEHN
CCCCCNC(=O)[C@@H](C)N1CCC(c2n[nH]c(CC)n2)CC1	ZINC000190662566	535064169	/nfs/dbraw/zinc/06/41/69/535064169.db2.gz	MODORKIBZFYDBL-CYBMUJFWSA-N	0	3	321.469	2.241	10	0		DEAEHN
CCCCCNC(=O)[C@@H](C)N1CCC(c2nc(CC)n[nH]2)CC1	ZINC000190662566	535064177	/nfs/dbraw/zinc/06/41/77/535064177.db2.gz	MODORKIBZFYDBL-CYBMUJFWSA-N	0	3	321.469	2.241	10	0		DEAEHN
CCCCCNC(=O)[C@@H](C)N1CCC(c2nnc(CC)[nH]2)CC1	ZINC000190662566	535064180	/nfs/dbraw/zinc/06/41/80/535064180.db2.gz	MODORKIBZFYDBL-CYBMUJFWSA-N	0	3	321.469	2.241	10	0		DEAEHN
CCN(c1ccc(NC(=O)[C@H]2C[C@H](OC)CN2)cc1)C(C)C	ZINC000187884454	535414115	/nfs/dbraw/zinc/41/41/15/535414115.db2.gz	STNNJZAWEPULCK-JKSUJKDBSA-N	0	3	305.422	2.237	10	0		DEAEHN
CCOCCN(C)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000246306209	535566597	/nfs/dbraw/zinc/56/65/97/535566597.db2.gz	DLQGOVSQCXXLIX-CVEARBPZSA-N	0	3	305.422	2.110	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(C/C=C\c2ccccc2)CC12COC2	ZINC000449361251	535567830	/nfs/dbraw/zinc/56/78/30/535567830.db2.gz	JAJOTASDOPTNGN-HWYHOQROSA-N	0	3	301.386	2.211	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(C/C=C/c2ccccc2)CC12COC2	ZINC000449361250	535568436	/nfs/dbraw/zinc/56/84/36/535568436.db2.gz	JAJOTASDOPTNGN-FSNWXROXSA-N	0	3	301.386	2.211	10	0		DEAEHN
CCOc1ccc(CCC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000195337466	535714068	/nfs/dbraw/zinc/71/40/68/535714068.db2.gz	ZJFPBOUJRQWZSD-MRXNPFEDSA-N	0	3	302.418	2.325	10	0		DEAEHN
CC[C@@H]1CCC[C@@H](NC(=O)NC[C@H]2CCCN2CCOC)C1	ZINC000247027125	535821109	/nfs/dbraw/zinc/82/11/09/535821109.db2.gz	PBXQEAMIDZBNNR-BZUAXINKSA-N	0	3	311.470	2.365	10	0		DEAEHN
CN(C)CCN1CCN(C(=O)c2ccc(C(C)(C)C)s2)CC1	ZINC000357470334	535876456	/nfs/dbraw/zinc/87/64/56/535876456.db2.gz	HAMIXEKIACNYLJ-UHFFFAOYSA-N	0	3	323.506	2.365	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)N[C@H](C)CN1CCC[C@@H](C)C1	ZINC000454651513	535882138	/nfs/dbraw/zinc/88/21/38/535882138.db2.gz	VKQKSPJHIIYJBS-CHWSQXEVSA-N	0	3	322.453	2.465	10	0		DEAEHN
CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)[C@@H]1CC1(C)C	ZINC000373533902	536452530	/nfs/dbraw/zinc/45/25/30/536452530.db2.gz	MGJVVZASXYJYHI-QFBILLFUSA-N	0	3	316.445	2.128	10	0		DEAEHN
CN(Cc1ccccc1F)C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C	ZINC000261919702	536482621	/nfs/dbraw/zinc/48/26/21/536482621.db2.gz	RKQSDTUHEQFUCK-DDUZABMNSA-N	0	3	320.408	2.317	10	0		DEAEHN
CO[C@@H]1CN(Cc2ccccc2OCC(=O)N(C)C)CC[C@@H]1C	ZINC000249225252	536732701	/nfs/dbraw/zinc/73/27/01/536732701.db2.gz	UWLRDJXDCIFIHM-WMLDXEAASA-N	0	3	320.433	2.010	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)C1	ZINC000187936580	536741628	/nfs/dbraw/zinc/74/16/28/536741628.db2.gz	IBRKKCRDEWHOIY-GXTWGEPZSA-N	0	3	323.824	2.256	10	0		DEAEHN
COc1ccc(C)cc1NC(=O)[C@@H](C)N1CCN2CCC[C@H]2C1	ZINC000246293405	536811870	/nfs/dbraw/zinc/81/18/70/536811870.db2.gz	IMVKDRDQPRAORX-CABCVRRESA-N	0	3	317.433	2.111	10	0		DEAEHN
COc1ccccc1C/C(C)=C/C(=O)N1CCN2CCC1CC2	ZINC000188607302	537005924	/nfs/dbraw/zinc/00/59/24/537005924.db2.gz	AKZYYKHFFAGGMD-CCEZHUSRSA-N	0	3	314.429	2.491	10	0		DEAEHN
CC(C)(C)OC(=O)NC[C@@H]1CC[C@]2(C1)NCCc1nc[nH]c12	ZINC000724109153	563496448	/nfs/dbraw/zinc/49/64/48/563496448.db2.gz	FNAOGCHUOUCNIP-BDJLRTHQSA-N	0	3	306.410	2.076	10	0		DEAEHN
CN(CC1(O)CCCCC1)[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000191765426	625541980	/nfs/dbraw/zinc/54/19/80/625541980.db2.gz	XKVAOXDVXFJTSI-KRWDZBQOSA-N	0	3	316.445	2.415	10	0		DEAEHN
C[C@@H](O)CCNCc1ccccc1I	ZINC000308617012	624197265	/nfs/dbraw/zinc/19/72/65/624197265.db2.gz	SAYDQSWAAIGOSJ-SECBINFHSA-N	0	3	305.159	2.152	10	0		DEAEHN
CC(C)(C)OC(=O)N(CCNC1COCCOC1)C(C)(C)C	ZINC000309904463	625225991	/nfs/dbraw/zinc/22/59/91/625225991.db2.gz	JPBUOKLJIGZWTD-UHFFFAOYSA-N	0	3	316.442	2.027	10	0		DEAEHN
CC(=O)N1CCC[C@H]1C(=O)C(C#N)c1nc2ccccc2s1	ZINC000041500973	641584906	/nfs/dbraw/zinc/58/49/06/641584906.db2.gz	USRZQIIJGHXVHS-AAEUAGOBSA-N	0	3	313.382	2.483	10	0		DEAEHN
Cc1nc(N)sc1C(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000055175117	646416518	/nfs/dbraw/zinc/41/65/18/646416518.db2.gz	RVBUUEXHMBLCLJ-LBPRGKRZSA-N	0	3	304.419	2.066	10	0		DEAEHN
CCOC(=O)N1CCN(CCN(C)Cc2ccc(F)cc2)CC1	ZINC000173173019	646762161	/nfs/dbraw/zinc/76/21/61/646762161.db2.gz	ZDKKAGMQTJOVOU-UHFFFAOYSA-N	0	3	323.412	2.032	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1ccc(NC=O)cc1)c1ccccc1	ZINC000173723446	646777559	/nfs/dbraw/zinc/77/75/59/646777559.db2.gz	CSUPDCJUZISZJG-KRWDZBQOSA-N	0	3	311.385	2.288	10	0		DEAEHN
CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccncc1	ZINC000180528718	648496001	/nfs/dbraw/zinc/49/60/01/648496001.db2.gz	QBMXBOMVEXWWTN-WCQYABFASA-N	0	3	322.409	2.464	10	0		DEAEHN
Cn1ccc(CC(=O)O[C@H]2CCCN(Cc3ccccc3)C2)n1	ZINC000183199533	649046442	/nfs/dbraw/zinc/04/64/42/649046442.db2.gz	YXJZYSHNXAZHCP-KRWDZBQOSA-N	0	3	313.401	2.170	10	0		DEAEHN
Oc1ccc(Br)c(CNC[C@H]2CCC[C@@H]2O)c1	ZINC000305133059	685276894	/nfs/dbraw/zinc/27/68/94/685276894.db2.gz	RXHXDJHXLORMIG-RNCFNFMXSA-N	0	3	300.196	2.405	10	0		DEAEHN
CC1(C)CN(c2cnc(CO)cn2)CCN1Cc1ccccc1	ZINC000382644689	685405011	/nfs/dbraw/zinc/40/50/11/685405011.db2.gz	ILEALGOKYPDUJN-UHFFFAOYSA-N	0	3	312.417	2.070	10	0		DEAEHN
Cn1ncc(CN[C@H]2CCc3cc(Br)ccc3C2)n1	ZINC000389842702	685436211	/nfs/dbraw/zinc/43/62/11/685436211.db2.gz	KNIOWPOBIVAAMY-ZDUSSCGKSA-N	0	3	321.222	2.225	10	0		DEAEHN
C[C@H](C[C@@H]1CCC(=O)N1)NCc1ccn(Cc2ccccc2)n1	ZINC000389971818	685437000	/nfs/dbraw/zinc/43/70/00/685437000.db2.gz	VRIIAVIPWPGFIR-ZBFHGGJFSA-N	0	3	312.417	2.078	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccnc(Br)c2)C1	ZINC000135385420	684235144	/nfs/dbraw/zinc/23/51/44/684235144.db2.gz	WZXBOGCWZBIQRT-LLVKDONJSA-N	0	3	312.211	2.058	10	0		DEAEHN
CCN(CC(=O)OC(C)(C)C)C1CCN(CCC(C)=O)CC1	ZINC000190355802	684403482	/nfs/dbraw/zinc/40/34/82/684403482.db2.gz	NYPVVSXLDXWHCQ-UHFFFAOYSA-N	0	3	312.454	2.094	10	0		DEAEHN
CCN(C)c1ccc(CNCc2cccnc2-n2ccnc2)cn1	ZINC000190750640	684412969	/nfs/dbraw/zinc/41/29/69/684412969.db2.gz	OLOKMMHAMBGXAX-UHFFFAOYSA-N	0	3	322.416	2.408	10	0		DEAEHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCO[C@H]2C)c1	ZINC000192196666	684444205	/nfs/dbraw/zinc/44/42/05/684444205.db2.gz	DRUQBVADSXCZOE-NILFDRSVSA-N	0	3	316.357	2.158	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2ccc([C@@H](C)O)cc2)C1	ZINC000195087440	685086805	/nfs/dbraw/zinc/08/68/05/685086805.db2.gz	QHLQSWOUEYNSJS-CZUORRHYSA-N	0	3	305.422	2.023	10	0		DEAEHN
O[C@@H]1CCCC[C@@H]1N1CCN(c2ncnc3sccc32)CC1	ZINC000270621843	685204403	/nfs/dbraw/zinc/20/44/03/685204403.db2.gz	OYNCUIKIVZZUGJ-UONOGXRCSA-N	0	3	318.446	2.117	10	0		DEAEHN
FC(F)(F)[C@@H]1CC[C@@H](CN2CCC(C3OCCO3)CC2)O1	ZINC000721464834	777053529	/nfs/dbraw/zinc/05/35/29/777053529.db2.gz	FFRRJLJGCXEQNU-RYUDHWBXSA-N	0	3	309.328	2.181	10	0		DEAEHN
FC(F)(F)[C@@H]1CC[C@H](CN2CCC[C@H](C3OCCO3)C2)O1	ZINC000721476223	777094758	/nfs/dbraw/zinc/09/47/58/777094758.db2.gz	LUEBMDCBRRFHFF-TUAOUCFPSA-N	0	3	309.328	2.181	10	0		DEAEHN
C[C@](O)(CNC[C@@H](O)c1ccsc1)C(F)(F)C(F)(F)F	ZINC000724056607	777232236	/nfs/dbraw/zinc/23/22/36/777232236.db2.gz	FPOAHKOQCXYSER-BDAKNGLRSA-N	0	3	319.295	2.320	10	0		DEAEHN
C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NCc1cnc2n1CCC2	ZINC000721859313	780395281	/nfs/dbraw/zinc/39/52/81/780395281.db2.gz	HBAIDXLJZOEFPA-TZMCWYRMSA-N	0	3	320.437	2.174	10	0		DEAEHN
CC(C)c1nnc2n1CCN(C(=O)CN1[C@H](C)CC[C@H]1C)[C@@H]2C	ZINC000439776383	781808160	/nfs/dbraw/zinc/80/81/60/781808160.db2.gz	VUKFIFOTRNULKK-MGPQQGTHSA-N	0	3	319.453	2.178	10	0		DEAEHN
CC1(C)C[C@@H](NC2CN(C(=O)OCc3ccccc3)C2)CO1	ZINC000397333841	790175789	/nfs/dbraw/zinc/17/57/89/790175789.db2.gz	SBYGZSUPXSERSG-CQSZACIVSA-N	0	3	304.390	2.165	10	0		DEAEHN
CC1(C)CCNCCN1S(=O)(=O)c1ccc(F)c(Cl)c1	ZINC000712513415	792192623	/nfs/dbraw/zinc/19/26/23/792192623.db2.gz	JLNGKHBNEACMBV-UHFFFAOYSA-N	0	3	320.817	2.242	10	0		DEAEHN
CC(C)(C)OC(=O)NC1CC(CNCc2ccc(CO)o2)C1	ZINC000715066059	792379356	/nfs/dbraw/zinc/37/93/56/792379356.db2.gz	FGRNSVHEEJOOOT-UHFFFAOYSA-N	0	3	310.394	2.165	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NCCCCC1CC1	ZINC000716418447	792957202	/nfs/dbraw/zinc/95/72/02/792957202.db2.gz	YZWWIYBMFRBWBU-KRWDZBQOSA-N	0	3	303.450	2.142	10	0		DEAEHN
Cn1ncc(Br)c1CNCC[C@@H]1CC(C)(C)CO1	ZINC000717325341	799380503	/nfs/dbraw/zinc/38/05/03/799380503.db2.gz	GASNOSCMCMECIN-SNVBAGLBSA-N	0	3	316.243	2.477	10	0		DEAEHN
COc1cc(C[NH2+]C[C@H]2C[C@H](O)C2)cc(Br)c1[O-]	ZINC000720994901	1085321485	/nfs/dbraw/zinc/32/14/85/1085321485.db2.gz	LNWKRSDXYILHMI-CZMCAQCFSA-N	0	3	316.195	2.024	10	0		DEAEHN
CN1CCC[C@H]2[C@@H]1CCN2C(=O)c1cncc(Br)c1	ZINC000720819106	1086169716	/nfs/dbraw/zinc/16/97/16/1086169716.db2.gz	YHHUWJOIPWKRBH-STQMWFEESA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@H]1CCC[C@@H](CNCCS(=O)(=O)C2CCCCC2)O1	ZINC000700003524	1086300784	/nfs/dbraw/zinc/30/07/84/1086300784.db2.gz	DAEPWWOVOVPISG-KBPBESRZSA-N	0	3	303.468	2.281	10	0		DEAEHN
CCn1cncc1CN[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C	ZINC000700736613	1086331514	/nfs/dbraw/zinc/33/15/14/1086331514.db2.gz	KNFSSKBWSUPDNB-GXTWGEPZSA-N	0	3	308.426	2.391	10	0		DEAEHN
Cc1cnn(C)c1CNCC12CC(C1)CN2C(=O)OC(C)(C)C	ZINC000701924882	1086396251	/nfs/dbraw/zinc/39/62/51/1086396251.db2.gz	PXLUQJOWBOVIRR-UHFFFAOYSA-N	0	3	320.437	2.218	10	0		DEAEHN
COC[C@H](C)OC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000704448191	1086580049	/nfs/dbraw/zinc/58/00/49/1086580049.db2.gz	BVYKLBDYINBCJF-HOCLYGCPSA-N	0	3	306.406	2.412	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@]2(NCc3c[nH]cn3)CCC[C@H]12	ZINC000711614952	1087174257	/nfs/dbraw/zinc/17/42/57/1087174257.db2.gz	LFPQGIXHSPHABV-XJKSGUPXSA-N	0	3	306.410	2.431	10	0		DEAEHN
Cn1cc(CN[C@]23CCC[C@@H]2N(C(=O)OC(C)(C)C)CC3)cn1	ZINC000711637539	1087179373	/nfs/dbraw/zinc/17/93/73/1087179373.db2.gz	ADXORLGWLCBGCV-YOEHRIQHSA-N	0	3	320.437	2.442	10	0		DEAEHN
Cn1cncc1CN[C@@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000711640750	1087184697	/nfs/dbraw/zinc/18/46/97/1087184697.db2.gz	QHTOWTHFHGBVQK-RHSMWYFYSA-N	0	3	320.437	2.442	10	0		DEAEHN
NC(=O)CC1CC(NCc2cccc(Br)c2F)C1	ZINC000718496502	1088559376	/nfs/dbraw/zinc/55/93/76/1088559376.db2.gz	GCQRTZWYEMHUAI-UHFFFAOYSA-N	0	3	315.186	2.332	10	0		DEAEHN
C[C@H]1[C@@H](NC(=O)c2cc(F)ccc2Br)CCN1C	ZINC000719384279	1089078513	/nfs/dbraw/zinc/07/85/13/1089078513.db2.gz	CPDCMGVRCSDJPF-UFBFGSQYSA-N	0	3	315.186	2.411	10	0		DEAEHN
Cc1ccc(CN[C@@H]2COCC[C@H]2O)c(C)c1Br	ZINC000719615012	1089328978	/nfs/dbraw/zinc/32/89/78/1089328978.db2.gz	VDCZJQGTJPJGOI-CHWSQXEVSA-N	0	3	314.223	2.305	10	0		DEAEHN
C[C@@H](NCc1ccc(Br)cc1[N+](=O)[O-])[C@H](C)O	ZINC000387016614	1144509502	/nfs/dbraw/zinc/50/95/02/1144509502.db2.gz	ODIWEWFNMIPZGJ-SFYZADRCSA-N	0	3	303.156	2.216	10	0		DEAEHN
CN(C)c1nnc(S[C@@H]2COc3ccccc3[C@H]2N)s1	ZINC000081769342	192322446	/nfs/dbraw/zinc/32/24/46/192322446.db2.gz	GGEMDFAHLRWWQW-GHMZBOCLSA-N	0	3	308.432	2.157	10	0		DEAEHN
CCN[C@H](CSCCS(C)(=O)=O)c1ccccc1OC	ZINC000081768744	192323158	/nfs/dbraw/zinc/32/31/58/192323158.db2.gz	IOWUFNKKDKNKTR-CYBMUJFWSA-N	0	3	317.476	2.124	10	0		DEAEHN
CCN[C@H](CSCCC(=O)OC)c1ccc2c(c1)OCO2	ZINC000081790317	192323787	/nfs/dbraw/zinc/32/37/87/192323787.db2.gz	VAFUJHUAPQXILW-GFCCVEGCSA-N	0	3	311.403	2.362	10	0		DEAEHN
CN[C@@H]1c2ccccc2CC[C@@H]1Sc1nnnn1C1CC1	ZINC000081867646	192332967	/nfs/dbraw/zinc/33/29/67/192332967.db2.gz	HBDJBVSLZCDKAA-UONOGXRCSA-N	0	3	301.419	2.376	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@H]1S(=O)(=O)c1cc(C)ccc1C	ZINC000081922258	192339255	/nfs/dbraw/zinc/33/92/55/192339255.db2.gz	RGSIAGDBFVJNAV-GDBMZVCRSA-N	0	3	311.447	2.234	10	0		DEAEHN
CN[C@H]1CCOC[C@@H]1S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000081922748	192339800	/nfs/dbraw/zinc/33/98/00/192339800.db2.gz	OJORPOJAXLUTJS-JQWIXIFHSA-N	0	3	324.229	2.144	10	0		DEAEHN
C[C@H](NCCCS(N)(=O)=O)c1ccc(-c2cccnc2)cc1	ZINC000181282338	199276285	/nfs/dbraw/zinc/27/62/85/199276285.db2.gz	RRGZDPUFWMMFKT-ZDUSSCGKSA-N	0	3	319.430	2.078	10	0		DEAEHN
Cc1ncc2c(c1-c1noc([C@H]3CCCCN3C)n1)CCNC2	ZINC000020535759	282168542	/nfs/dbraw/zinc/16/85/42/282168542.db2.gz	STDKMBGNCQERCD-CQSZACIVSA-N	0	3	313.405	2.243	10	0		DEAEHN
COc1ccc(Br)cc1CN[C@@H]1CN(C)C[C@H]1C	ZINC000358102841	536639035	/nfs/dbraw/zinc/63/90/35/536639035.db2.gz	WRPPZHVEQMKRMW-ZWNOBZJWSA-N	0	3	313.239	2.497	10	0		DEAEHN
N[C@H](c1cc(Cl)sc1Cl)[C@H]1CCS(=O)(=O)C1	ZINC000082998656	185210695	/nfs/dbraw/zinc/21/06/95/185210695.db2.gz	SGUFCVBSFXMDCE-XNCJUZBTSA-N	0	3	300.232	2.489	10	0		DEAEHN
CCCc1nnsc1C(=O)N1C[C@@H](N)Cc2ccccc21	ZINC000087456074	185225700	/nfs/dbraw/zinc/22/57/00/185225700.db2.gz	WVSWRURXRPUSQF-NSHDSACASA-N	0	3	302.403	2.021	10	0		DEAEHN
CCC[C@@H](CN)C(=O)Nc1cc(S(C)(=O)=O)ccc1Cl	ZINC000087517851	185227547	/nfs/dbraw/zinc/22/75/47/185227547.db2.gz	WKHRVGYRKGQZCP-VIFPVBQESA-N	0	3	318.826	2.057	10	0		DEAEHN
Cc1nn(C)c(C[C@H](N)c2cncs2)c1Br	ZINC000087574199	185228815	/nfs/dbraw/zinc/22/88/15/185228815.db2.gz	GZWJTMMOIQTWDN-ZETCQYMHSA-N	0	3	301.213	2.190	10	0		DEAEHN
CN[C@H](c1sccc1Br)[C@@H]1CCS(=O)(=O)C1	ZINC000087630646	185229613	/nfs/dbraw/zinc/22/96/13/185229613.db2.gz	QJQPSNIBVYANCE-APPZFPTMSA-N	0	3	324.265	2.206	10	0		DEAEHN
COc1ccccc1CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000173189422	282189059	/nfs/dbraw/zinc/18/90/59/282189059.db2.gz	KCKNTWQRPAWTBM-HIFRSBDPSA-N	0	3	305.422	2.319	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)s1)N1CCCNC(=O)C1	ZINC000087883140	185234477	/nfs/dbraw/zinc/23/44/77/185234477.db2.gz	XJHNHKNRUCPDPZ-RNCFNFMXSA-N	0	3	301.843	2.002	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCc1nccn1CC(C)C	ZINC000173999447	282192249	/nfs/dbraw/zinc/19/22/49/282192249.db2.gz	HBIDPLSRLISSGW-OAHLLOKOSA-N	0	3	323.485	2.315	10	0		DEAEHN
NC[C@H](NCC(F)(F)F)c1cc(Cl)c2c(c1)OCCO2	ZINC000087929570	185237575	/nfs/dbraw/zinc/23/75/75/185237575.db2.gz	DPGKSTRTQHDJMZ-VIFPVBQESA-N	0	3	310.703	2.263	10	0		DEAEHN
COc1cc(C)c(Br)cc1[C@H](N)CCCC(N)=O	ZINC000088078806	185238921	/nfs/dbraw/zinc/23/89/21/185238921.db2.gz	CCSQZNDKLVMBDC-LLVKDONJSA-N	0	3	315.211	2.422	10	0		DEAEHN
Cc1cc2[nH]c(CN[C@H]3COC[C@H]3n3ccnn3)cc2c(C)c1	ZINC000328919259	231386933	/nfs/dbraw/zinc/38/69/33/231386933.db2.gz	BMKSSWQAPXCPLL-DLBZAZTESA-N	0	3	311.389	2.106	10	0		DEAEHN
CN[C@H]1CCN(c2ccc(Cl)cc2Br)C1=O	ZINC000088123184	185240014	/nfs/dbraw/zinc/24/00/14/185240014.db2.gz	HQWIZDSNQOLKDF-VIFPVBQESA-N	0	3	303.587	2.427	10	0		DEAEHN
N[C@H]1CCCN(c2c3nsnc3c(Cl)cc2Cl)C1=O	ZINC000088128025	185240509	/nfs/dbraw/zinc/24/05/09/185240509.db2.gz	YESBIHYRGCJLTH-ZETCQYMHSA-N	0	3	317.201	2.452	10	0		DEAEHN
CN[C@H]1CCOC[C@H]1S(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000088312124	185245309	/nfs/dbraw/zinc/24/53/09/185245309.db2.gz	FWONNEGZAKHQRP-NWDGAFQWSA-N	0	3	324.229	2.144	10	0		DEAEHN
O=S(=O)(C[C@@H]1CCCCN1)N1CCCCc2ccccc21	ZINC000088337523	185246590	/nfs/dbraw/zinc/24/65/90/185246590.db2.gz	QJNXXDRSXKYOOT-HNNXBMFYSA-N	0	3	308.447	2.301	10	0		DEAEHN
NCc1cccc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)c1	ZINC000088419169	185249592	/nfs/dbraw/zinc/24/95/92/185249592.db2.gz	XEQVXTCTBREAHL-LLVKDONJSA-N	0	3	322.352	2.108	10	0		DEAEHN
CN[C@](C)(C[C@H](C)N1CCC[C@H](C(F)(F)F)C1)C(=O)OC	ZINC000088435245	185250216	/nfs/dbraw/zinc/25/02/16/185250216.db2.gz	KOTAFHLFJSFLOG-GMXVVIOVSA-N	0	3	310.360	2.190	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)CCCOC)c1ccccc1C	ZINC000081985836	192349199	/nfs/dbraw/zinc/34/91/99/192349199.db2.gz	IJONQJGUSSGQPJ-INIZCTEOSA-N	0	3	313.463	2.487	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N1CCCC[C@H]1C	ZINC000246837124	282214667	/nfs/dbraw/zinc/21/46/67/282214667.db2.gz	BLOGNWTZFMIPJV-ZBFHGGJFSA-N	0	3	304.438	2.057	10	0		DEAEHN
CCN[C@@H](C[S@](=O)CCCOC)c1cc(C)ccc1OC	ZINC000081998321	192351854	/nfs/dbraw/zinc/35/18/54/192351854.db2.gz	XVQWVPBZOYTMTL-BTYIYWSLSA-N	0	3	313.463	2.439	10	0		DEAEHN
N[C@H]1COC[C@H]1C(=O)Nc1ccc(Cl)cc1C(F)(F)F	ZINC000090378664	185293700	/nfs/dbraw/zinc/29/37/00/185293700.db2.gz	CINDIXODOLJRCD-APPZFPTMSA-N	0	3	308.687	2.271	10	0		DEAEHN
CN[C@H]1COC[C@@H]1c1nc(-c2ccc(Br)cc2)no1	ZINC000090423225	185295485	/nfs/dbraw/zinc/29/54/85/185295485.db2.gz	DVNRYDISQNTSBQ-QWRGUYRKSA-N	0	3	324.178	2.201	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1c1nc(Cc2ccc(F)cc2Cl)no1	ZINC000090423975	185295656	/nfs/dbraw/zinc/29/56/56/185295656.db2.gz	HZJRSJYYHBBCTP-CMPLNLGQSA-N	0	3	311.744	2.155	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)N1CCC[C@@H]1c1cccc(Cl)c1	ZINC000090435303	185296153	/nfs/dbraw/zinc/29/61/53/185296153.db2.gz	ORRWGMJJXKTEDT-RBSFLKMASA-N	0	3	308.809	2.238	10	0		DEAEHN
C[C@@]1(C(=O)Nc2c3ncsc3ccc2Cl)COC[C@H]1N	ZINC000090585552	185305126	/nfs/dbraw/zinc/30/51/26/185305126.db2.gz	FYFJPIUUMPLDIJ-NOZJJQNGSA-N	0	3	311.794	2.252	10	0		DEAEHN
CN(Cc1ccc(Cl)cc1Cl)C(=O)[C@@]1(C)COC[C@@H]1N	ZINC000090591490	185305364	/nfs/dbraw/zinc/30/53/64/185305364.db2.gz	BYHSKWLZURGGFM-JSGCOSHPSA-N	0	3	317.216	2.316	10	0		DEAEHN
C[C@@]1(C(=O)Nc2cccc(-c3nccs3)c2)COC[C@@H]1N	ZINC000090589989	185305588	/nfs/dbraw/zinc/30/55/88/185305588.db2.gz	GNVZRIPFQMFDHV-SWLSCSKDSA-N	0	3	303.387	2.112	10	0		DEAEHN
C[C@]1(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)COC[C@@H]1N	ZINC000090597728	185305743	/nfs/dbraw/zinc/30/57/43/185305743.db2.gz	GXZXBSXPKCZWQU-JQWIXIFHSA-N	0	3	306.259	2.147	10	0		DEAEHN
COC(=O)C1CCC(C(=O)N[C@H](CC(C)C)CN(C)C)CC1	ZINC000179480409	282226201	/nfs/dbraw/zinc/22/62/01/282226201.db2.gz	LDWLIFVWWBAHSQ-YMAMQOFZSA-N	0	3	312.454	2.058	10	0		DEAEHN
O=C(c1cccnc1)N1CCCSC[C@@H]1CN1CCCC1	ZINC000090700834	185310518	/nfs/dbraw/zinc/31/05/18/185310518.db2.gz	ZDGRWKGLHXAIRE-HNNXBMFYSA-N	0	3	305.447	2.125	10	0		DEAEHN
Cc1noc(C)c1[C@@H](C)NC(=O)c1c[nH]c(=NN)c(Cl)c1	ZINC000092343042	185313356	/nfs/dbraw/zinc/31/33/56/185313356.db2.gz	VKNQKEKZXKEVFH-ZCFIWIBFSA-N	0	3	309.757	2.116	10	0		DEAEHN
CN(C)C[C@H]1CCCN1c1cc2c(cc1Cl)C(=O)C(=O)N2	ZINC000092772620	185339965	/nfs/dbraw/zinc/33/99/65/185339965.db2.gz	RSVORXBEFRBSPP-SECBINFHSA-N	0	3	307.781	2.005	10	0		DEAEHN
CNCc1cc(S(=O)(=O)NCC2C(C)(C)C2(C)C)cs1	ZINC000092833151	185344993	/nfs/dbraw/zinc/34/49/93/185344993.db2.gz	GWVNOZHASRRZST-UHFFFAOYSA-N	0	3	316.492	2.428	10	0		DEAEHN
COc1nc(C)cc(=O)n1CCNCc1ccc(Cl)s1	ZINC000092841104	185345446	/nfs/dbraw/zinc/34/54/46/185345446.db2.gz	PWTJFJBNJFSGMK-UHFFFAOYSA-N	0	3	313.810	2.065	10	0		DEAEHN
COc1ccc(NC(=O)NC(=O)CN2CCCC2(C)C)cc1	ZINC000077382620	539363093	/nfs/dbraw/zinc/36/30/93/539363093.db2.gz	FMWCXPPNYARNLP-UHFFFAOYSA-N	0	3	305.378	2.218	10	0		DEAEHN
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)Cc1ccoc1	ZINC000328633988	529954987	/nfs/dbraw/zinc/95/49/87/529954987.db2.gz	SZMNXGOKWJYLGS-WMZOPIPTSA-N	0	3	313.401	2.369	10	0		DEAEHN
C[C@@H](NCC(C)(C)NS(C)(=O)=O)c1ccc2c(c1)CCC2	ZINC000109040956	185547485	/nfs/dbraw/zinc/54/74/85/185547485.db2.gz	ABLRAMIETRNSHY-GFCCVEGCSA-N	0	3	310.463	2.154	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCC(C)(C)c1ccncc1	ZINC000130236396	539494485	/nfs/dbraw/zinc/49/44/85/539494485.db2.gz	RKTYXEPOOPRFDL-MRXNPFEDSA-N	0	3	318.465	2.485	10	0		DEAEHN
Cc1cncc(CNC(=O)N[C@H](CN(C)C)c2ccccc2)c1	ZINC000153215638	539543154	/nfs/dbraw/zinc/54/31/54/539543154.db2.gz	JISWHRCMIGBKKB-QGZVFWFLSA-N	0	3	312.417	2.492	10	0		DEAEHN
COC(=O)c1cnc(-c2ccc(F)cc2)nc1[C@@H]1CCCN1	ZINC000616579917	362894436	/nfs/dbraw/zinc/89/44/36/362894436.db2.gz	SJEQBIGYUPWCGJ-ZDUSSCGKSA-N	0	3	301.321	2.494	10	0		DEAEHN
CN(C)CCSc1nc2nc(-c3ccccc3)nc(N)c2[nH]1	ZINC000616582160	362894554	/nfs/dbraw/zinc/89/45/54/362894554.db2.gz	UUDAVEHJGQSHBS-UHFFFAOYSA-N	0	3	314.418	2.256	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCN[C@@H](c2ccc(F)cc2)C1	ZINC000616656928	362904934	/nfs/dbraw/zinc/90/49/34/362904934.db2.gz	VCAWLLAISCPKDR-OAHLLOKOSA-N	0	3	323.412	2.297	10	0		DEAEHN
COc1ccc(F)c2c1CN(Cc1c(C)nn(C)c1C)[C@@H]2CN	ZINC000071683525	191006565	/nfs/dbraw/zinc/00/65/65/191006565.db2.gz	RKHDWFKYJJZQKP-OAHLLOKOSA-N	0	3	318.396	2.200	10	0		DEAEHN
COc1cc2c(c(OC)c1OC)[C@@H](CN)N(Cc1ccco1)C2	ZINC000071684621	191008203	/nfs/dbraw/zinc/00/82/03/191008203.db2.gz	OCKYULNIUKNNJT-CYBMUJFWSA-N	0	3	318.373	2.321	10	0		DEAEHN
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cc(CN)cc(F)c2F)C1	ZINC000138347544	186016316	/nfs/dbraw/zinc/01/63/16/186016316.db2.gz	IDWBTLVMYLFOHV-NXEZZACHSA-N	0	3	318.389	2.090	10	0		DEAEHN
CC[C@@H](C)CN(C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138471100	186016934	/nfs/dbraw/zinc/01/69/34/186016934.db2.gz	JGYYRCAPPMLDNF-SECBINFHSA-N	0	3	306.378	2.090	10	0		DEAEHN
CN[C@H](Cc1ccnc(N)c1)c1ccc(Br)cn1	ZINC000140201744	186026011	/nfs/dbraw/zinc/02/60/11/186026011.db2.gz	UZZKRLXANABLGY-GFCCVEGCSA-N	0	3	307.195	2.325	10	0		DEAEHN
CC[C@@]1(C)N[C@@H](c2ccsc2)N(C2CCN(C)CC2)C1=O	ZINC000141183285	186029062	/nfs/dbraw/zinc/02/90/62/186029062.db2.gz	LOMNBZVVILAQPF-GDBMZVCRSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCn1cc(S(=O)(=O)NCCCCC(C)C)cc1CN	ZINC000147932531	186042477	/nfs/dbraw/zinc/04/24/77/186042477.db2.gz	JMLQFMVZOWNJMY-UHFFFAOYSA-N	0	3	301.456	2.071	10	0		DEAEHN
O=C1N(CCN2CCCCC2)[C@H](c2cccs2)NC12CC2	ZINC000144075201	186034736	/nfs/dbraw/zinc/03/47/36/186034736.db2.gz	KRCDUHYAXUWEJX-CQSZACIVSA-N	0	3	305.447	2.197	10	0		DEAEHN
C[C@@H](CN1CCCC1)N1C(=O)C2(CC2)N[C@H]1c1ccsc1	ZINC000145809066	186038068	/nfs/dbraw/zinc/03/80/68/186038068.db2.gz	BHZZVKOXTQAGCT-GXTWGEPZSA-N	0	3	305.447	2.195	10	0		DEAEHN
CNCc1sccc1S(=O)(=O)NCCCC(F)(F)F	ZINC000149986925	186054204	/nfs/dbraw/zinc/05/42/04/186054204.db2.gz	FVFAYMUHOHHBCS-UHFFFAOYSA-N	0	3	316.370	2.088	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)c2cc(-c3ccncc3)on2)[C@@H](C)C1	ZINC000155650746	186099589	/nfs/dbraw/zinc/09/95/89/186099589.db2.gz	DQQZYWCEVRYIIM-WFASDCNBSA-N	0	3	314.389	2.195	10	0		DEAEHN
COc1ccc(Br)cc1CNC[C@@H](C)[S@](C)=O	ZINC000159653510	186133064	/nfs/dbraw/zinc/13/30/64/186133064.db2.gz	JUNMBZMVIRUHGF-VVVCHXIZSA-N	0	3	320.252	2.314	10	0		DEAEHN
COc1ccc(CNC[C@@H](C)[S@@](C)=O)cc1Br	ZINC000159715368	186137394	/nfs/dbraw/zinc/13/73/94/186137394.db2.gz	QCANMSOULHSQPM-XLFHBGCDSA-N	0	3	320.252	2.314	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)NCCN(C)[C@@H](C)CC)cc1F	ZINC000164134123	186150214	/nfs/dbraw/zinc/15/02/14/186150214.db2.gz	AVOKDSIDYBAIPG-LBPRGKRZSA-N	0	3	323.412	2.173	10	0		DEAEHN
CC[C@@H](CNC(=O)N1CC[C@H](N(C)C)C1)Oc1cccc(F)c1	ZINC000175641550	186183968	/nfs/dbraw/zinc/18/39/68/186183968.db2.gz	NAZBFIWMFWWBHT-GJZGRUSLSA-N	0	3	323.412	2.329	10	0		DEAEHN
CC(C)c1csc(CNC(=O)N2CCN3CCC[C@H]3C2)n1	ZINC000177908829	186202908	/nfs/dbraw/zinc/20/29/08/186202908.db2.gz	DRBFNAKXQUJLIN-LBPRGKRZSA-N	0	3	308.451	2.256	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)Cc2cccc(C(=O)N(C)C)c2)C1	ZINC000187991253	186240678	/nfs/dbraw/zinc/24/06/78/186240678.db2.gz	INEVCNNMIGWWKB-KDOFPFPSSA-N	0	3	304.434	2.371	10	0		DEAEHN
O=C(NCc1nc2ccccc2s1)N1CCN2CCC[C@H]2C1	ZINC000171897158	198004366	/nfs/dbraw/zinc/00/43/66/198004366.db2.gz	BUADSNAIWPVUCP-LBPRGKRZSA-N	0	3	316.430	2.286	10	0		DEAEHN
COc1ccc(Cl)cc1CNC(=O)N1CCN2CCC[C@H]2C1	ZINC000171902550	198005458	/nfs/dbraw/zinc/00/54/58/198005458.db2.gz	SEPMOXBGJKMOAA-AWEZNQCLSA-N	0	3	323.824	2.338	10	0		DEAEHN
C[C@@H](CC(C)(C)c1ccccc1)NC(=O)C1(N)CCOCC1	ZINC000261874890	295834886	/nfs/dbraw/zinc/83/48/86/295834886.db2.gz	OPLVBYSLZMWQBL-AWEZNQCLSA-N	0	3	304.434	2.367	10	0		DEAEHN
O=C1CC[C@@H](CN[C@H]2CCc3ccc(Br)cc32)N1	ZINC000302334527	539860734	/nfs/dbraw/zinc/86/07/34/539860734.db2.gz	GPMHQAJVSFPYDL-AAEUAGOBSA-N	0	3	309.207	2.305	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cc3ccccc3[nH]c2=O)CCN1C	ZINC000172995206	198174741	/nfs/dbraw/zinc/17/47/41/198174741.db2.gz	YHQUGBQSEGAYIW-TZMCWYRMSA-N	0	3	313.401	2.083	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)c(C)s1	ZINC000173245661	198200662	/nfs/dbraw/zinc/20/06/62/198200662.db2.gz	SPUVLASLFMNOOO-GXFFZTMASA-N	0	3	316.492	2.326	10	0		DEAEHN
Cc1cc(F)ccc1-n1ccc(C(=O)N2CC[C@H](N(C)C)C2)n1	ZINC000182056070	199379704	/nfs/dbraw/zinc/37/97/04/199379704.db2.gz	KIUYKVOYVFCDBR-AWEZNQCLSA-N	0	3	316.380	2.096	10	0		DEAEHN
Cc1cccc(O[C@@H](C)CNC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000173915624	198268082	/nfs/dbraw/zinc/26/80/82/198268082.db2.gz	QOYWOEYJRQWUBV-GJZGRUSLSA-N	0	3	305.422	2.108	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)Cc1ccccc1	ZINC000173829519	198257679	/nfs/dbraw/zinc/25/76/79/198257679.db2.gz	BYDXWZPKAGOZCW-JKSUJKDBSA-N	0	3	308.447	2.075	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)N[C@H]2COc3ccccc3C2)CCN1C	ZINC000174062268	198286554	/nfs/dbraw/zinc/28/65/54/198286554.db2.gz	HABPMEKSBRBRSC-BMFZPTHFSA-N	0	3	317.433	2.114	10	0		DEAEHN
COc1cc(N)c(Cl)cc1C(=O)N[C@@H]1CCN2CCC[C@H]1C2	ZINC000004214260	181085320	/nfs/dbraw/zinc/08/53/20/181085320.db2.gz	GZSKEXSLDPEFPT-IINYFYTJSA-N	0	3	323.824	2.145	10	0	investigational	DEAEHN
CCC[C@H](N)C(=O)N1CCC[C@@H]1c1ccc(OC)cc1OC	ZINC000236803941	202017761	/nfs/dbraw/zinc/01/77/61/202017761.db2.gz	ZZZWFAFWBZRVET-LSDHHAIUSA-N	0	3	306.406	2.495	10	0		DEAEHN
CCCN(C[C@@H]1CCCCO1)C(=O)NC[C@H]1CCCN1CC	ZINC000074493015	355032249	/nfs/dbraw/zinc/03/22/49/355032249.db2.gz	ATNMSHZLEDWKNC-CVEARBPZSA-N	0	3	311.470	2.461	10	0		DEAEHN
O=c1[nH]c2ccc(Cl)cc2c(=O)n1CCN1CCCCC1	ZINC000073658326	191338253	/nfs/dbraw/zinc/33/82/53/191338253.db2.gz	LMVXJRZURWEHNM-UHFFFAOYSA-N	0	3	307.781	2.241	10	0		DEAEHN
CCc1cnc(CNC(=O)N[C@@H](CC(C)C)CN(C)C)s1	ZINC000073722686	191348385	/nfs/dbraw/zinc/34/83/85/191348385.db2.gz	JXFYZEXONQJXFG-LBPRGKRZSA-N	0	3	312.483	2.481	10	0		DEAEHN
CCOc1ccccc1CN(C)C(=O)NC1CCN(C)CC1	ZINC000079854874	355332259	/nfs/dbraw/zinc/33/22/59/355332259.db2.gz	HJTCFVDGSAOJAZ-UHFFFAOYSA-N	0	3	305.422	2.321	10	0		DEAEHN
CCOC(=O)C1(O)CCN(c2ccnc3ccccc32)CC1	ZINC000080693925	355380921	/nfs/dbraw/zinc/38/09/21/355380921.db2.gz	BEADBRYEYKRURA-UHFFFAOYSA-N	0	3	300.358	2.129	10	0		DEAEHN
C[C@H](CSC(C)(C)C)N[C@@H]1CCN(C2CCOCC2)C1=O	ZINC000367413108	283113720	/nfs/dbraw/zinc/11/37/20/283113720.db2.gz	PEEJIZBAPQFKHO-TZMCWYRMSA-N	0	3	314.495	2.276	10	0		DEAEHN
Cc1c(C(=O)N[C@H]2CC[C@@H](N(C)C)C2)oc2c1C(=O)CCC2	ZINC000093988774	355690870	/nfs/dbraw/zinc/69/08/70/355690870.db2.gz	DRAONSMHVGHOJF-NWDGAFQWSA-N	0	3	304.390	2.320	10	0		DEAEHN
Cc1nn(CC(C)C)c(C)c1CC(=O)NC[C@@H]1CCCN(C)C1	ZINC000108335147	355735118	/nfs/dbraw/zinc/73/51/18/355735118.db2.gz	YHSPUXQSJWFZAP-INIZCTEOSA-N	0	3	320.481	2.156	10	0		DEAEHN
CCNc1nc(Cl)ccc1C(=O)NCCN1CCCCC1	ZINC000113933818	355760513	/nfs/dbraw/zinc/76/05/13/355760513.db2.gz	LPZVXUWJDRXCOD-UHFFFAOYSA-N	0	3	310.829	2.383	10	0		DEAEHN
COCCN1CCC(NC(=O)N[C@H](C)c2ccc(C)o2)CC1	ZINC000140231470	355883954	/nfs/dbraw/zinc/88/39/54/355883954.db2.gz	ZERPQEVPFUPYTK-CYBMUJFWSA-N	0	3	309.410	2.059	10	0		DEAEHN
CCC[C@@H](C)CN1CCN(CC(=O)NCc2ccccc2)CC1	ZINC000179659302	356030681	/nfs/dbraw/zinc/03/06/81/356030681.db2.gz	RPLODKURXQNHFC-QGZVFWFLSA-N	0	3	317.477	2.357	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1cccc(C)c1F	ZINC000179940897	356037208	/nfs/dbraw/zinc/03/72/08/356037208.db2.gz	XITAYYGHILBTDE-ZDUSSCGKSA-N	0	3	309.385	2.366	10	0		DEAEHN
Cc1cnn(CCC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c1	ZINC000180168128	356044045	/nfs/dbraw/zinc/04/40/45/356044045.db2.gz	PFXFXOWFZRSZGE-SJLPKXTDSA-N	0	3	312.417	2.143	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cccc(OC(C)C)n1	ZINC000179144536	356014797	/nfs/dbraw/zinc/01/47/97/356014797.db2.gz	QBQHHYRFRHDBFZ-AWEZNQCLSA-N	0	3	305.422	2.425	10	0		DEAEHN
COc1cc(C[NH2+][C@H](C)[C@H](C)CO)cc(Br)c1[O-]	ZINC000080204301	192012415	/nfs/dbraw/zinc/01/24/15/192012415.db2.gz	MYNPJDWAZXTQGH-RKDXNWHRSA-N	0	3	318.211	2.270	10	0		DEAEHN
COC[C@H](C)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000187087082	356212785	/nfs/dbraw/zinc/21/27/85/356212785.db2.gz	LXHHPXROKBOPSR-DOMZBBRYSA-N	0	3	309.385	2.304	10	0		DEAEHN
Cc1ccc(C[C@H](C)NS(=O)(=O)C[C@@H]2CCCCN2)s1	ZINC000080248270	192017150	/nfs/dbraw/zinc/01/71/50/192017150.db2.gz	UUWGSQBRAWVHEO-AAEUAGOBSA-N	0	3	316.492	2.049	10	0		DEAEHN
CC[C@@H]1CC(=O)[C@@H]2Oc3c4c(ccc3O)C[C@@H]3[C@H]1[C@@]42CCN3C	ZINC000209510501	356269675	/nfs/dbraw/zinc/26/96/75/356269675.db2.gz	QSKKOOHSRYUZQA-JTJXXDHKSA-N	0	3	313.397	2.266	10	0		DEAEHN
C[C@H]1CCC[C@@](N)(C(=O)Nc2cc(C(N)=O)ccc2Cl)C1	ZINC000080913802	192201240	/nfs/dbraw/zinc/20/12/40/192201240.db2.gz	SLNXIHLMQYOUNL-VFZGTOFNSA-N	0	3	309.797	2.285	10	0		DEAEHN
NCc1ccnc(C(F)(F)F)c1I	ZINC000306950586	356406126	/nfs/dbraw/zinc/40/61/26/356406126.db2.gz	ZMDVAGPHHKDCOK-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
Brc1ccccc1CN1CC[C@H]2OCCN[C@@H]2C1	ZINC000404054540	283164266	/nfs/dbraw/zinc/16/42/66/283164266.db2.gz	GHFBQEFQYVBBSP-ZIAGYGMSSA-N	0	3	311.223	2.012	10	0		DEAEHN
Brc1ccccc1CN1CC[C@H]2OCCN[C@H]2C1	ZINC000404054537	283164392	/nfs/dbraw/zinc/16/43/92/283164392.db2.gz	GHFBQEFQYVBBSP-UONOGXRCSA-N	0	3	311.223	2.012	10	0		DEAEHN
Cc1nn(C)c(Cl)c1CN(C)C[C@@H]1CCc2nccn2C1	ZINC000328655435	356466920	/nfs/dbraw/zinc/46/69/20/356466920.db2.gz	YKKOFDLJMSWSPB-LBPRGKRZSA-N	0	3	307.829	2.273	10	0		DEAEHN
CC[C@@H](NC)c1cccc(S(=O)(=O)N[C@H](C)CCOC)c1	ZINC000081717825	192316670	/nfs/dbraw/zinc/31/66/70/192316670.db2.gz	MGDGRKFUKGABNJ-IUODEOHRSA-N	0	3	314.451	2.060	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)Nc1cc(C(=O)NC2CC2)ccc1C	ZINC000236903655	202063913	/nfs/dbraw/zinc/06/39/13/202063913.db2.gz	MWFDXZLVRQWILR-ZUZCIYMTSA-N	0	3	303.406	2.199	10	0		DEAEHN
CC(C)(C)c1ccc(CN[C@@H]2CCN(S(C)(=O)=O)C2)s1	ZINC000400325231	356723660	/nfs/dbraw/zinc/72/36/60/356723660.db2.gz	ZOEPJBAVGCGCKF-LLVKDONJSA-N	0	3	316.492	2.169	10	0		DEAEHN
c1nc(-c2ccncc2)sc1CNCCN1CCCOCC1	ZINC000578370303	356805701	/nfs/dbraw/zinc/80/57/01/356805701.db2.gz	XSWFDEXGMXKYPF-UHFFFAOYSA-N	0	3	318.446	2.017	10	0		DEAEHN
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CSC2(C)C)c1	ZINC000578642548	356849991	/nfs/dbraw/zinc/84/99/91/356849991.db2.gz	PUDXGCMIIOCILF-HIFRSBDPSA-N	0	3	309.431	2.113	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N(C)C2CCC(C)CC2)nc1	ZINC000088993890	192686804	/nfs/dbraw/zinc/68/68/04/192686804.db2.gz	IGEQLZQKHWCAJO-UHFFFAOYSA-N	0	3	311.451	2.000	10	0		DEAEHN
CCCCC[C@@H](C)NS(=O)(=O)c1cc(CN)n(CC)c1	ZINC000088998327	192689359	/nfs/dbraw/zinc/68/93/59/192689359.db2.gz	GLNZVFUGTXVJFY-GFCCVEGCSA-N	0	3	301.456	2.214	10	0		DEAEHN
CN1CC[C@H](NC(=O)Cc2cccc(O)c2)[C@@H]1c1ccccc1	ZINC000179222868	199001027	/nfs/dbraw/zinc/00/10/27/199001027.db2.gz	RXOWNMHDBKNGEV-HKUYNNGSSA-N	0	3	310.397	2.496	10	0		DEAEHN
COCCCN(C)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000179264248	199007171	/nfs/dbraw/zinc/00/71/71/199007171.db2.gz	MDXAECCBIPIIEY-CVEARBPZSA-N	0	3	305.422	2.110	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1Cc1cc(C(N)=O)cs1	ZINC000180132091	199120941	/nfs/dbraw/zinc/12/09/41/199120941.db2.gz	RWNDOIKCWCAFNB-CYBMUJFWSA-N	0	3	304.419	2.017	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1Cc1cc(C(N)=O)cs1	ZINC000180132073	199121602	/nfs/dbraw/zinc/12/16/02/199121602.db2.gz	RWNDOIKCWCAFNB-ZDUSSCGKSA-N	0	3	304.419	2.017	10	0		DEAEHN
CC[C@H](C(=O)N1CCN2CCC[C@@H]2C1)c1ccc(OC)cc1	ZINC000180472218	199162846	/nfs/dbraw/zinc/16/28/46/199162846.db2.gz	QHOZPBPYUZAWDZ-WBVHZDCISA-N	0	3	302.418	2.495	10	0		DEAEHN
CCn1cc([C@H](C)NCCCNC(=O)c2cccs2)cn1	ZINC000180833673	199215609	/nfs/dbraw/zinc/21/56/09/199215609.db2.gz	PXEGJPTWLKHVHK-LBPRGKRZSA-N	0	3	306.435	2.435	10	0		DEAEHN
CN(C[C@H](O)c1cccc(Br)c1)CC1(CO)CC1	ZINC000186808252	200013891	/nfs/dbraw/zinc/01/38/91/200013891.db2.gz	IXCBRIUULOZCSH-ZDUSSCGKSA-N	0	3	314.223	2.187	10	0		DEAEHN
CCN(CCO)CCNC(=O)N[C@H](C)c1cccc(Cl)c1	ZINC000187080413	200058648	/nfs/dbraw/zinc/05/86/48/200058648.db2.gz	KCPDSFUFUZMCKT-GFCCVEGCSA-N	0	3	313.829	2.014	10	0		DEAEHN
C[C@@H]1CC[C@@](CO)(N(C)CC(=O)N(C)Cc2cccs2)C1	ZINC000187963654	200183657	/nfs/dbraw/zinc/18/36/57/200183657.db2.gz	ZPPFRSGRTHSOKX-CZUORRHYSA-N	0	3	310.463	2.189	10	0		DEAEHN
CCCCOc1ccc(NC(=O)N2CC[C@H](N(C)C)C2)cn1	ZINC000187874470	200169566	/nfs/dbraw/zinc/16/95/66/200169566.db2.gz	OHHLBONSONGNDQ-AWEZNQCLSA-N	0	3	306.410	2.428	10	0		DEAEHN
CO[C@H]1CN(Cc2ccccc2N2CCOCC2)CC[C@@H]1C	ZINC000188329349	200228711	/nfs/dbraw/zinc/22/87/11/200228711.db2.gz	CJYFHESYZPNIKO-YJBOKZPZSA-N	0	3	304.434	2.380	10	0		DEAEHN
COc1ccc(F)c(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1OC	ZINC000188451321	200249474	/nfs/dbraw/zinc/24/94/74/200249474.db2.gz	GYSDIVRZPHAUIU-VXGBXAGGSA-N	0	3	322.380	2.152	10	0		DEAEHN
COc1ccccc1/C=C/CN1CCN(CC(C)(C)O)C[C@H]1C	ZINC000188741944	200298045	/nfs/dbraw/zinc/29/80/45/200298045.db2.gz	RNOMRCGDSIQORN-MNDMWVCDSA-N	0	3	318.461	2.485	10	0		DEAEHN
O=C1[C@H](N[C@H]2CCCSC2)CCN1Cc1ccc(F)cc1	ZINC000189055808	200342011	/nfs/dbraw/zinc/34/20/11/200342011.db2.gz	YYHPNUSGVXVGTF-LSDHHAIUSA-N	0	3	308.422	2.412	10	0		DEAEHN
CO[C@H]1CCN(C[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000443613443	238115936	/nfs/dbraw/zinc/11/59/36/238115936.db2.gz	BDANGDDPAFVOJI-OLZOCXBDSA-N	0	3	303.324	2.330	10	0		DEAEHN
O=C(NCCNc1ccncc1)NC[C@@H]1CCc2ccccc2C1	ZINC000605059672	360953517	/nfs/dbraw/zinc/95/35/17/360953517.db2.gz	YWABDHBARIFMEZ-OAHLLOKOSA-N	0	3	324.428	2.020	10	0		DEAEHN
CN1CCO[C@@H](CN(Cc2ccc3c[nH]nc3c2)CC2CC2)C1	ZINC000275789517	212537452	/nfs/dbraw/zinc/53/74/52/212537452.db2.gz	SGBNXWIDGNTILW-QGZVFWFLSA-N	0	3	314.433	2.106	10	0		DEAEHN
O=C(c1cc(O)ccc1C(F)(F)F)N1CCN2CCC[C@H]2C1	ZINC000193174731	201002198	/nfs/dbraw/zinc/00/21/98/201002198.db2.gz	JSYBHISJKJEUKU-JTQLQIEISA-N	0	3	314.307	2.331	10	0		DEAEHN
c1[nH]nc2cccc(CN3CCC(c4nnc5n4CCC5)CC3)c12	ZINC000628145900	366738274	/nfs/dbraw/zinc/73/82/74/366738274.db2.gz	YMAWVWUBSCXCIN-UHFFFAOYSA-N	0	3	322.416	2.480	10	0		DEAEHN
CSCC[C@H](C)N(C)C(=O)Nc1cnn(CCN(C)C)c1	ZINC000610478449	361405089	/nfs/dbraw/zinc/40/50/89/361405089.db2.gz	YEHSPXQMIUADEM-LBPRGKRZSA-N	0	3	313.471	2.050	10	0		DEAEHN
COC(=O)C(C)(C)[C@@H](NCCn1cccn1)c1ccccc1	ZINC000611406320	361593774	/nfs/dbraw/zinc/59/37/74/361593774.db2.gz	OXPYXLNZWDYUMN-HNNXBMFYSA-N	0	3	301.390	2.413	10	0		DEAEHN
CCO[C@@H](CNC(=O)N1CC[C@H](N(C)C)C1)c1ccccc1	ZINC000195187139	201355118	/nfs/dbraw/zinc/35/51/18/201355118.db2.gz	TWEQDZHJHNMGBX-HOTGVXAUSA-N	0	3	305.422	2.110	10	0		DEAEHN
C(=C/c1ccccc1)\CN[C@H]1CCN(c2ccc3nncn3n2)C1	ZINC000623652619	365117311	/nfs/dbraw/zinc/11/73/11/365117311.db2.gz	LFACVIXKZCJXHG-RRGWEWPQSA-N	0	3	320.400	2.006	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)N[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000091135268	193001670	/nfs/dbraw/zinc/00/16/70/193001670.db2.gz	WCDISYWZMPAVQG-MXWKQRLJSA-N	0	3	310.385	2.319	10	0		DEAEHN
O[C@@H]1COCC[C@@H]1NCc1cc(Br)ccc1Cl	ZINC000623767574	365167801	/nfs/dbraw/zinc/16/78/01/365167801.db2.gz	YDJGIFXPAXLURF-NWDGAFQWSA-N	0	3	320.614	2.342	10	0		DEAEHN
Cc1ccc([O-])c(C[NH2+]C[C@@H]2CCCO[C@H]2c2cn[nH]c2)n1	ZINC000623768891	365168386	/nfs/dbraw/zinc/16/83/86/365168386.db2.gz	CQKNZCSGWXYCGZ-BLLLJJGKSA-N	0	3	302.378	2.076	10	0		DEAEHN
NC(=O)c1ccsc1NC(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2N1	ZINC000091360568	193046641	/nfs/dbraw/zinc/04/66/41/193046641.db2.gz	DWYXFQZWRYIACT-USWWRNFRSA-N	0	3	307.419	2.096	10	0		DEAEHN
CC(C)CNCc1cncc(-n2cc(Br)cn2)n1	ZINC000091422429	193054051	/nfs/dbraw/zinc/05/40/51/193054051.db2.gz	YWPRQHFTVAUZOO-UHFFFAOYSA-N	0	3	310.199	2.170	10	0		DEAEHN
CCNC(C)(C)C(=O)Nc1ccc(Br)c(C)n1	ZINC000091507117	193066826	/nfs/dbraw/zinc/06/68/26/193066826.db2.gz	HBWAYHOZMLRKKH-UHFFFAOYSA-N	0	3	300.200	2.479	10	0		DEAEHN
C[C@@H](NC[C@@H]1CN(C)CCO1)c1cccc(Br)c1	ZINC000091666882	193088566	/nfs/dbraw/zinc/08/85/66/193088566.db2.gz	YBZFUXJCOJLHOY-BXUZGUMPSA-N	0	3	313.239	2.430	10	0		DEAEHN
CN[C@H](c1cccc(OC(F)(F)F)c1)[C@H]1CN(C)CCO1	ZINC000091717594	193097102	/nfs/dbraw/zinc/09/71/02/193097102.db2.gz	GPYQVAQNJUNBKB-CHWSQXEVSA-N	0	3	304.312	2.176	10	0		DEAEHN
C[C@H](N[C@@H]1CCOC[C@@H]1O)c1ccccc1Br	ZINC000624235186	365344334	/nfs/dbraw/zinc/34/43/34/365344334.db2.gz	GECLJQDDDHKECW-BIMULSAOSA-N	0	3	300.196	2.250	10	0		DEAEHN
CC(C)Cc1nnc(NC(=O)N2C[C@H]3CCCN3C[C@@H]2C)s1	ZINC000091988578	193137712	/nfs/dbraw/zinc/13/77/12/193137712.db2.gz	FFKRTAHUSXWYKN-NWDGAFQWSA-N	0	3	323.466	2.437	10	0		DEAEHN
CC[C@H](COC)NCc1cnc2cnc(Br)cn12	ZINC000092050118	193148230	/nfs/dbraw/zinc/14/82/30/193148230.db2.gz	WKBPGMPZCUNJPT-SECBINFHSA-N	0	3	313.199	2.006	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H]1NCCCC1(C)C)c1ccc(NC(N)=O)cc1	ZINC000261940102	296097776	/nfs/dbraw/zinc/09/77/76/296097776.db2.gz	UQRYFRZENVLDJM-RISCZKNCSA-N	0	3	318.421	2.133	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](O)CN1CC2(C1)CC(F)(F)C2	ZINC000677734325	541623189	/nfs/dbraw/zinc/62/31/89/541623189.db2.gz	UJEKOVHXOGFSES-OAHLLOKOSA-N	0	3	310.388	2.210	10	0		DEAEHN
CCCN(C1CC1)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115611	193162944	/nfs/dbraw/zinc/16/29/44/193162944.db2.gz	XKTNCIYRERECOX-UHFFFAOYSA-N	0	3	300.399	2.108	10	0		DEAEHN
CN(CC1CCCCC1)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115911	193163850	/nfs/dbraw/zinc/16/38/50/193163850.db2.gz	FZEHCIVRCHEYMB-UHFFFAOYSA-N	0	3	314.426	2.485	10	0		DEAEHN
C[C@H](N(C)S(=O)(=O)c1ccc(CN)cc1F)C(C)(C)C	ZINC000092115978	193164284	/nfs/dbraw/zinc/16/42/84/193164284.db2.gz	WXEJCIGJJOSSEN-JTQLQIEISA-N	0	3	302.415	2.340	10	0		DEAEHN
c1c(CNC[C@@H]2C[C@H]2c2ccccc2)nnn1C[C@@H]1CCOC1	ZINC000631144602	368043992	/nfs/dbraw/zinc/04/39/92/368043992.db2.gz	NWKOKQDUKWNBHK-ZVZYQTTQSA-N	0	3	312.417	2.208	10	0		DEAEHN
CO[C@@H]1[C@@H](C)[C@H](NCC(=O)Nc2ccc3c(c2)OCO3)C1(C)C	ZINC000451502439	243040194	/nfs/dbraw/zinc/04/01/94/243040194.db2.gz	PNUXXAMAXMINKR-CIISACIHSA-N	0	3	320.389	2.003	10	0		DEAEHN
CCN(CC(C)(C)O)c1nc2sccn2c1CNC(C)C	ZINC000092971133	193190792	/nfs/dbraw/zinc/19/07/92/193190792.db2.gz	USJSJWQRDNLVQB-UHFFFAOYSA-N	0	3	310.467	2.491	10	0		DEAEHN
CCC[C@@](C)(N)C(=O)NC[C@H](c1ccccc1)C(C)(C)CO	ZINC000262587918	203341638	/nfs/dbraw/zinc/34/16/38/203341638.db2.gz	TXMBZXDZMRFVQL-CRAIPNDOSA-N	0	3	306.450	2.422	10	0		DEAEHN
NC(=O)[C@]1(N)CCC[C@H]1CCSc1nc2ccccc2[nH]1	ZINC000093629106	193276177	/nfs/dbraw/zinc/27/61/77/193276177.db2.gz	OIQQIDYNYNVXHO-BONVTDFDSA-N	0	3	304.419	2.028	10	0		DEAEHN
NC(=O)COC[C@@H](N)c1ccc(Br)c2ccccc21	ZINC000093658368	193285637	/nfs/dbraw/zinc/28/56/37/193285637.db2.gz	MZALHMIXEOIHNC-CYBMUJFWSA-N	0	3	323.190	2.104	10	0		DEAEHN
CN[C@H](c1ccc(Cl)c(OC)c1)[C@H]1CN2CCC[C@@H]2CO1	ZINC000094009081	193338717	/nfs/dbraw/zinc/33/87/17/193338717.db2.gz	MQQHZLQQZGIFDK-DAXOMENPSA-N	0	3	310.825	2.472	10	0		DEAEHN
CN1CCO[C@@H](CNCc2ccc(Br)c(F)c2)C1	ZINC000093938970	193330003	/nfs/dbraw/zinc/33/00/03/193330003.db2.gz	WBOWCYZSOBNIMA-NSHDSACASA-N	0	3	317.202	2.008	10	0		DEAEHN
CCN1CCO[C@@H]([C@@H](Cc2nc(C(C)(C)C)cs2)NC)C1	ZINC000094257041	193355146	/nfs/dbraw/zinc/35/51/46/193355146.db2.gz	XEABZMDLNDCGJT-CHWSQXEVSA-N	0	3	311.495	2.292	10	0		DEAEHN
CC[C@@H](N)[C@H](c1cccc(Cl)c1)N(C)CCS(C)(=O)=O	ZINC000094297253	193356738	/nfs/dbraw/zinc/35/67/38/193356738.db2.gz	RWVZWHUZVKZQCL-KGLIPLIRSA-N	0	3	318.870	2.095	10	0		DEAEHN
CN(C[C@H]1CCCOC1)c1nc(C(F)(F)F)ccc1CN	ZINC000094334311	193360077	/nfs/dbraw/zinc/36/00/77/193360077.db2.gz	FWYKXFVRIGLAOR-SNVBAGLBSA-N	0	3	303.328	2.422	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@@H](C)Oc1c(F)cc(CNC)cc1F	ZINC000094346449	193363631	/nfs/dbraw/zinc/36/36/31/193363631.db2.gz	WLGKNTHAISUGCG-VHSXEESVSA-N	0	3	300.349	2.366	10	0		DEAEHN
CCNCc1cc(F)c(OC[C@@H](O)COC(C)C)c(F)c1	ZINC000094346946	193363820	/nfs/dbraw/zinc/36/38/20/193363820.db2.gz	ZRGVDPKLVMCYRI-LBPRGKRZSA-N	0	3	303.349	2.239	10	0		DEAEHN
CC[C@H](C)NCC(=O)Nc1cc(C)c(Br)cn1	ZINC000094063553	193342442	/nfs/dbraw/zinc/34/24/42/193342442.db2.gz	IPLIYCURBKNQKP-VIFPVBQESA-N	0	3	300.200	2.479	10	0		DEAEHN
CCC(N)(CC)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000094243907	193354668	/nfs/dbraw/zinc/35/46/68/193354668.db2.gz	XMJXYGWANUIPOA-UHFFFAOYSA-N	0	3	320.361	2.139	10	0		DEAEHN
CNCc1cc(C)ccc1O[C@H]1CCC[C@@H](S(C)(=O)=O)C1	ZINC000094634525	193386180	/nfs/dbraw/zinc/38/61/80/193386180.db2.gz	VGEDMOJIUOFAKA-LSDHHAIUSA-N	0	3	311.447	2.449	10	0		DEAEHN
CC(C)(C)NCc1ccn([C@@H]2CCC[C@@H](S(C)(=O)=O)C2)n1	ZINC000094644461	193389485	/nfs/dbraw/zinc/38/94/85/193389485.db2.gz	XXFSVPSNEFSNSB-ZIAGYGMSSA-N	0	3	313.467	2.300	10	0		DEAEHN
CC[C@@H](CN)S(=O)(=O)NC12CC3C[C@@](C)(C1)C[C@](C)(C3)C2	ZINC000094544500	193378196	/nfs/dbraw/zinc/37/81/96/193378196.db2.gz	OKUFKHVFRHFLHX-KEPFICHZSA-N	0	3	314.495	2.392	10	0		DEAEHN
Brc1ccccc1-c1cnc(N2CCNCC2)nc1	ZINC000094577241	193381280	/nfs/dbraw/zinc/38/12/80/193381280.db2.gz	QZUYGDLWIVMLSH-UHFFFAOYSA-N	0	3	319.206	2.316	10	0		DEAEHN
CCN[C@H](c1cc(F)c(C)cc1F)[C@H]1CCS(=O)(=O)C1	ZINC000094707858	193392869	/nfs/dbraw/zinc/39/28/69/193392869.db2.gz	ALOKMSGXEYTSFO-HZMBPMFUSA-N	0	3	303.374	2.359	10	0		DEAEHN
O=S1(=O)CC[C@H](NCCn2ccc3c2cccc3Cl)C1	ZINC000094613130	193384426	/nfs/dbraw/zinc/38/44/26/193384426.db2.gz	CMZHZVPVFIPNDW-NSHDSACASA-N	0	3	312.822	2.071	10	0		DEAEHN
CCN1C[C@H](N[C@@H](C[C@H]2CCOC2)c2ccccc2)CC1=O	ZINC000453356501	245089328	/nfs/dbraw/zinc/08/93/28/245089328.db2.gz	LSKHBCLLHNYORB-OIISXLGYSA-N	0	3	302.418	2.365	10	0		DEAEHN
O=C(Nc1ccc(-c2cc[nH]n2)cc1)N1CCN2CCC[C@H]2C1	ZINC000265964234	205002762	/nfs/dbraw/zinc/00/27/62/205002762.db2.gz	UOGRYBVOULNGAX-HNNXBMFYSA-N	0	3	311.389	2.389	10	0		DEAEHN
CCn1ncc(Br)c1[C@@H](C[C@@H]1CCOC1)NC	ZINC000162046163	197538428	/nfs/dbraw/zinc/53/84/28/197538428.db2.gz	XXLQZEYBTRNZRI-GXSJLCMTSA-N	0	3	302.216	2.353	10	0		DEAEHN
COc1ccccc1N1CCN([C@@H](CN)c2ccco2)CC1	ZINC000019795789	182150812	/nfs/dbraw/zinc/15/08/12/182150812.db2.gz	QOPSQUZULYZSTN-HNNXBMFYSA-N	0	3	301.390	2.110	10	0		DEAEHN
Fc1ccc(Br)cc1CNC[C@H]1CCOCO1	ZINC000160125295	197388104	/nfs/dbraw/zinc/38/81/04/197388104.db2.gz	RHYZIDHQZHXPTG-LLVKDONJSA-N	0	3	304.159	2.441	10	0		DEAEHN
C[C@H](CN(C)C(=O)CC1CCN(C)CC1)C(=O)OC(C)(C)C	ZINC000458398848	248290437	/nfs/dbraw/zinc/29/04/37/248290437.db2.gz	SPKWDPFJACBYPA-CYBMUJFWSA-N	0	3	312.454	2.155	10	0		DEAEHN
COC[C@H](NCCCCS(C)(=O)=O)c1ccc(Cl)cc1	ZINC000488675301	248805060	/nfs/dbraw/zinc/80/50/60/248805060.db2.gz	NAALXHRVNWKMTN-AWEZNQCLSA-N	0	3	319.854	2.442	10	0		DEAEHN
CN(C)CCNC(=O)c1nn(-c2ccccc2)c2c1CCCC2	ZINC000041460805	183192613	/nfs/dbraw/zinc/19/26/13/183192613.db2.gz	ZHJWGKMWHNGPQG-UHFFFAOYSA-N	0	3	312.417	2.043	10	0		DEAEHN
COCCCN(CCOC)[C@H](CN)c1ccccc1Cl	ZINC000042420997	183267473	/nfs/dbraw/zinc/26/74/73/183267473.db2.gz	LDIRDCRZGIOHFZ-OAHLLOKOSA-N	0	3	300.830	2.325	10	0		DEAEHN
Cc1cc(NS(=O)(=O)[C@@H]2CCCNC2)c2ccccc2n1	ZINC000042341383	183255802	/nfs/dbraw/zinc/25/58/02/183255802.db2.gz	TYLXXVFJQYHLMV-GFCCVEGCSA-N	0	3	305.403	2.037	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccccc1Cl)N(C)CC(=O)NC1CC1	ZINC000043051476	183332655	/nfs/dbraw/zinc/33/26/55/183332655.db2.gz	JWHIXGHNOKABNN-GOEBONIOSA-N	0	3	309.841	2.329	10	0		DEAEHN
CCCN(CC(F)(F)F)S(=O)(=O)c1cccc(CN)c1	ZINC000042768570	183307008	/nfs/dbraw/zinc/30/70/08/183307008.db2.gz	OMIFEMJUJQRQRT-UHFFFAOYSA-N	0	3	310.341	2.108	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(C)s1)N1CCCC[C@@H]1C(=O)NC	ZINC000043242690	183346537	/nfs/dbraw/zinc/34/65/37/183346537.db2.gz	GJTYHUXKLARJDE-UMVBOHGHSA-N	0	3	309.479	2.435	10	0		DEAEHN
CC(=O)N1CCCN([C@@H](c2ccc(Cl)s2)[C@@H](C)N)CC1	ZINC000043254141	183347771	/nfs/dbraw/zinc/34/77/71/183347771.db2.gz	IXPAGFMYBAZTHB-QMTHXVAHSA-N	0	3	315.870	2.344	10	0		DEAEHN
NC[C@@H](Sc1nc(N)cc(N)n1)c1ccc(Cl)s1	ZINC000043258274	183347949	/nfs/dbraw/zinc/34/79/49/183347949.db2.gz	JJKDDBWNKZOZFT-ZCFIWIBFSA-N	0	3	301.828	2.148	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)s1)N1CCC[C@@H]1C(=O)NC	ZINC000043253667	183348397	/nfs/dbraw/zinc/34/83/97/183348397.db2.gz	UDTGBUHUTMPTKL-CWSCBRNRSA-N	0	3	315.870	2.390	10	0		DEAEHN
Cc1ccc([C@@H](Oc2ccc(S(C)(=O)=O)cc2)[C@H](C)N)o1	ZINC000043366992	183357156	/nfs/dbraw/zinc/35/71/56/183357156.db2.gz	UJBJXWSZZTXMIH-NHYWBVRUSA-N	0	3	309.387	2.459	10	0		DEAEHN
CN[C@@H](CN(C)CC(F)(F)F)c1ccc(OC)c(OC)c1	ZINC000043900761	183388956	/nfs/dbraw/zinc/38/89/56/183388956.db2.gz	RRPWVQLJHDZHAC-NSHDSACASA-N	0	3	306.328	2.458	10	0		DEAEHN
O=C1C[C@H](NCCc2ccsc2)C(=O)N1C1CCCCC1	ZINC000105034499	194065367	/nfs/dbraw/zinc/06/53/67/194065367.db2.gz	OQGOJIHERVWBSE-AWEZNQCLSA-N	0	3	306.431	2.340	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)Nc2cccc(C)c2C)c1	ZINC000105881610	194156178	/nfs/dbraw/zinc/15/61/78/194156178.db2.gz	ZTCYTUQIDQFTKP-OAHLLOKOSA-N	0	3	300.406	2.425	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(Cc2cccc(C(N)=O)c2)C1	ZINC000105897513	194162339	/nfs/dbraw/zinc/16/23/39/194162339.db2.gz	BHUNLIQZQINFGQ-MRXNPFEDSA-N	0	3	312.417	2.382	10	0		DEAEHN
COCCCCCN1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000105911664	194169700	/nfs/dbraw/zinc/16/97/00/194169700.db2.gz	RQPXFZBQBNIINB-SFHVURJKSA-N	0	3	306.450	2.154	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2nc3ccccc3n2C(F)F)CCO1	ZINC000105925797	194171326	/nfs/dbraw/zinc/17/13/26/194171326.db2.gz	IBYWGXLSJXFJHL-GFCCVEGCSA-N	0	3	324.375	2.194	10	0		DEAEHN
C[C@@H](c1nnc(-c2ccccc2)o1)N1CCO[C@H](CN(C)C)C1	ZINC000105926816	194171987	/nfs/dbraw/zinc/17/19/87/194171987.db2.gz	BXTDLSHCCGDIOU-DZGCQCFKSA-N	0	3	316.405	2.060	10	0		DEAEHN
CCOc1cccc(NC(=O)NC[C@@H]2CCCN2CCOC)c1	ZINC000110090843	194308576	/nfs/dbraw/zinc/30/85/76/194308576.db2.gz	QKDZYKITBJCEEI-HNNXBMFYSA-N	0	3	321.421	2.318	10	0		DEAEHN
Cc1ccsc1[C@H]1C[C@H]1C(=O)NCCNc1ccncc1	ZINC000534530110	284849020	/nfs/dbraw/zinc/84/90/20/284849020.db2.gz	MQBOXZYXJPUMBL-UONOGXRCSA-N	0	3	301.415	2.205	10	0		DEAEHN
COCCCN(C)[C@@H](CN)c1ccc(OC)c(OC)c1Cl	ZINC000110829639	194362179	/nfs/dbraw/zinc/36/21/79/194362179.db2.gz	AWLPSYDTQUBBKU-LBPRGKRZSA-N	0	3	316.829	2.325	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCO[C@H](c3ccccc3)C2)C1	ZINC000057869760	184059950	/nfs/dbraw/zinc/05/99/50/184059950.db2.gz	SXDRHRNSAINFNJ-IRXDYDNUSA-N	0	3	317.433	2.254	10	0		DEAEHN
O=C1C[C@@H](NCCc2ccccc2)C(=O)N1c1ccccc1F	ZINC000059489408	184138858	/nfs/dbraw/zinc/13/88/58/184138858.db2.gz	LQOLDDDBXLFJLJ-OAHLLOKOSA-N	0	3	312.344	2.290	10	0		DEAEHN
c1csc(-c2noc(CN3CCCN(C4CC4)CC3)n2)c1	ZINC000061041222	184161068	/nfs/dbraw/zinc/16/10/68/184161068.db2.gz	ZOJSJAGMJAHHQQ-UHFFFAOYSA-N	0	3	304.419	2.468	10	0		DEAEHN
CC(C)[NH2+]CCCS(=O)(=O)[N-]c1cc(F)c(F)c(F)c1	ZINC000061120958	184162549	/nfs/dbraw/zinc/16/25/49/184162549.db2.gz	WBHYCEGQRKGPBQ-UHFFFAOYSA-N	0	3	310.341	2.234	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(NC[C@@H]2CCCN(C)C2)n1	ZINC000061540815	184173520	/nfs/dbraw/zinc/17/35/20/184173520.db2.gz	YAVUFWXKQYSFBJ-NSHDSACASA-N	0	3	312.849	2.125	10	0		DEAEHN
C[C@@H]1CN(CCC(=O)Nc2ccc(Cl)c(N)c2)CCCO1	ZINC000061912866	184195397	/nfs/dbraw/zinc/19/53/97/184195397.db2.gz	YXYCVLXXSDXXBC-LLVKDONJSA-N	0	3	311.813	2.362	10	0		DEAEHN
CN(CCNc1c(C(N)=S)cnc2ccccc21)C1CC1	ZINC000062010439	184201150	/nfs/dbraw/zinc/20/11/50/184201150.db2.gz	XCFISDFPLOJTCY-UHFFFAOYSA-N	0	3	300.431	2.375	10	0		DEAEHN
CN(Cc1nccn1C)[C@H](CN)c1ccc(Br)cc1	ZINC000062247623	184225372	/nfs/dbraw/zinc/22/53/72/184225372.db2.gz	HTGIZIBTYJEAIM-CYBMUJFWSA-N	0	3	323.238	2.314	10	0		DEAEHN
Nc1ncc(C(=O)N2CC[C@H](N3CCCCC3)C2)cc1Cl	ZINC000062984978	184264739	/nfs/dbraw/zinc/26/47/39/184264739.db2.gz	PZDGKBXBHIAFDI-LBPRGKRZSA-N	0	3	308.813	2.018	10	0		DEAEHN
CC[NH2+][C@@H](C)c1cccc([N-]S(=O)(=O)C[C@@H]2CCCO2)c1	ZINC000063155735	184274614	/nfs/dbraw/zinc/27/46/14/184274614.db2.gz	MAGVGVCDXKTYGX-WFASDCNBSA-N	0	3	312.435	2.278	10	0		DEAEHN
C[C@@H](NC(=O)N1CCN(CC2CCCCC2)CC1)[C@H]1CCCO1	ZINC000065456646	184347148	/nfs/dbraw/zinc/34/71/48/184347148.db2.gz	WLUMEXBQPPPWBS-NVXWUHKLSA-N	0	3	323.481	2.461	10	0		DEAEHN
C[C@@H](CCO)NC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000119161437	207355793	/nfs/dbraw/zinc/35/57/93/207355793.db2.gz	MEZQKHPSTXCROM-YJBOKZPZSA-N	0	3	319.449	2.111	10	0		DEAEHN
COCCC[C@H](N)C(=O)N1CCc2sccc2[C@H]1C1CC1	ZINC000159304760	197344155	/nfs/dbraw/zinc/34/41/55/197344155.db2.gz	PQVPJUIFZQQFKN-DZGCQCFKSA-N	0	3	308.447	2.338	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC1(C)CCC(C)CC1	ZINC000111856385	285023810	/nfs/dbraw/zinc/02/38/10/285023810.db2.gz	JKUOGCIHDPGNOK-ISXOHVOVSA-N	0	3	311.470	2.365	10	0		DEAEHN
CCc1ccc([C@H](C)N[C@H](C)C(=O)NC(=O)NC2CC2)cc1	ZINC000119672910	195014457	/nfs/dbraw/zinc/01/44/57/195014457.db2.gz	RACQJEMCEBMHAU-NWDGAFQWSA-N	0	3	303.406	2.276	10	0		DEAEHN
CC1(CNC(=O)NCCNc2ccncc2)Cc2ccccc2C1	ZINC000538808339	285056813	/nfs/dbraw/zinc/05/68/13/285056813.db2.gz	NEHQWUDIFPNZDI-UHFFFAOYSA-N	0	3	324.428	2.020	10	0		DEAEHN
CCNC(=O)N1CC[C@@H](N[C@@H](C)c2ccc(C)cc2OC)C1	ZINC000540157918	285111447	/nfs/dbraw/zinc/11/14/47/285111447.db2.gz	OPACUKRYSOMCEQ-UONOGXRCSA-N	0	3	305.422	2.458	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N(C)C2CC2)cc(C)c1F	ZINC000159061092	197323858	/nfs/dbraw/zinc/32/38/58/197323858.db2.gz	SORINQGEFCOURB-UHFFFAOYSA-N	0	3	300.399	2.027	10	0		DEAEHN
Cc1cc(N2CCN(CCC3CCCC3)CC2)n2ncnc2n1	ZINC000159052493	197322388	/nfs/dbraw/zinc/32/23/88/197322388.db2.gz	DHKMQGKHFNYEDV-UHFFFAOYSA-N	0	3	314.437	2.135	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2ccc(-c3ccccc3)nn2)C1	ZINC000158952492	197314353	/nfs/dbraw/zinc/31/43/53/197314353.db2.gz	YTVZBELTLSRMKC-CQSZACIVSA-N	0	3	311.389	2.311	10	0		DEAEHN
CCN[C@H](CS(=O)(=O)c1cccc(Cl)c1)[C@@H]1CCOC1	ZINC000158837122	197305348	/nfs/dbraw/zinc/30/53/48/197305348.db2.gz	AMDSBSAHSVKGOZ-BXUZGUMPSA-N	0	3	317.838	2.128	10	0		DEAEHN
CN([C@@H](CN)c1cc(Br)ccc1F)[C@@H]1CCOC1	ZINC000158658672	197292017	/nfs/dbraw/zinc/29/20/17/197292017.db2.gz	XWHGPFXRSQOKGU-MFKMUULPSA-N	0	3	317.202	2.309	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)ccc1C	ZINC000158749502	197299064	/nfs/dbraw/zinc/29/90/64/197299064.db2.gz	OQVPGZATQRNVNC-ZIAGYGMSSA-N	0	3	308.447	2.135	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)c1ccc(C)cc1)[C@@H]1CCOC1	ZINC000158725010	197297334	/nfs/dbraw/zinc/29/73/34/197297334.db2.gz	WVIDRLKQVOXQHP-ZBFHGGJFSA-N	0	3	311.447	2.173	10	0		DEAEHN
C[C@H](NC(=O)NC[C@@](C)(O)CN(C)C)c1cccc(Cl)c1	ZINC000120252582	195128564	/nfs/dbraw/zinc/12/85/64/195128564.db2.gz	YUGICVBVFJEFON-XHDPSFHLSA-N	0	3	313.829	2.013	10	0		DEAEHN
C[C@@H]1OCC[C@H]1N(C)[C@@H](CN)c1ccccc1OC(F)F	ZINC000158609066	197288194	/nfs/dbraw/zinc/28/81/94/197288194.db2.gz	JBXSAWDCNXFPKI-UHTWSYAYSA-N	0	3	300.349	2.397	10	0		DEAEHN
NN=c1[nH]cc(C(=O)NC[C@H]2CCCCS2)cc1Cl	ZINC000158491885	197277343	/nfs/dbraw/zinc/27/73/43/197277343.db2.gz	MOYMTORRNSTLAM-SECBINFHSA-N	0	3	300.815	2.036	10	0		DEAEHN
CC(C)Oc1cncc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000158446480	197273075	/nfs/dbraw/zinc/27/30/75/197273075.db2.gz	OFERCINPTFGVCE-DZGCQCFKSA-N	0	3	305.422	2.424	10	0		DEAEHN
COc1c([C@H](CN)N(C)[C@@H](C)c2cccs2)c(C)nn1C	ZINC000158387173	197267895	/nfs/dbraw/zinc/26/78/95/197267895.db2.gz	UHPLNKWRIZYIPP-RYUDHWBXSA-N	0	3	308.451	2.491	10	0		DEAEHN
COCCNCc1ccc(-n2ccc(C(F)(F)F)n2)nc1	ZINC000158347488	197264476	/nfs/dbraw/zinc/26/44/76/197264476.db2.gz	RRDSIRUUHKCWGC-UHFFFAOYSA-N	0	3	300.284	2.022	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2ccccc2O[C@@H]2CCOC2)C1	ZINC000120300243	195138687	/nfs/dbraw/zinc/13/86/87/195138687.db2.gz	NUPYAMOTQOQFTL-UONOGXRCSA-N	0	3	319.405	2.022	10	0		DEAEHN
COC(=O)[C@@](C)(C[C@H](C)N(C)CCOC(C)C)NC(C)C	ZINC000157500212	197191717	/nfs/dbraw/zinc/19/17/17/197191717.db2.gz	UVXJJCLCFKCVPW-GOEBONIOSA-N	0	3	302.459	2.052	10	0		DEAEHN
CCc1nn(C)c(C[C@@](C)(F)C[C@H]2COCCN2)c1Cl	ZINC000157546366	197196030	/nfs/dbraw/zinc/19/60/30/197196030.db2.gz	CETXVUHYOSOKHD-HZMBPMFUSA-N	0	3	303.809	2.285	10	0		DEAEHN
COC[C@H](C)NCCOc1c(Br)cccc1OC	ZINC000157290879	197177357	/nfs/dbraw/zinc/17/73/57/197177357.db2.gz	ANCHNPZRKLEHBR-JTQLQIEISA-N	0	3	318.211	2.461	10	0		DEAEHN
CCOCCN(C)[C@@H](CN)c1ccc(OC)c(OC)c1Cl	ZINC000157117798	197162498	/nfs/dbraw/zinc/16/24/98/197162498.db2.gz	OHDFVWRNFDGLSU-LBPRGKRZSA-N	0	3	316.829	2.325	10	0		DEAEHN
CCCN(CC(F)(F)F)C(=O)[C@]1(N)C[C@H](OCC)C1(C)C	ZINC000156945830	197151680	/nfs/dbraw/zinc/15/16/80/197151680.db2.gz	LOMJMCXZOKAVRO-GXFFZTMASA-N	0	3	310.360	2.320	10	0		DEAEHN
C[C@](O)(Cc1sccc1Br)C[C@@H]1COCCN1	ZINC000156858699	197145382	/nfs/dbraw/zinc/14/53/82/197145382.db2.gz	CVLMZVIERRRRQC-BXKDBHETSA-N	0	3	320.252	2.183	10	0		DEAEHN
NCc1ccccc1NC(=O)CC[S@@](=O)c1cccs1	ZINC000155970008	197077971	/nfs/dbraw/zinc/07/79/71/197077971.db2.gz	JCHQAWFETSDYLV-FQEVSTJZSA-N	0	3	308.428	2.343	10	0		DEAEHN
CC(C)[C@@H](O)CNCc1cc(Br)cc2c1OCC2	ZINC000155950470	197076819	/nfs/dbraw/zinc/07/68/19/197076819.db2.gz	GIAWTFZNJCNMII-ZDUSSCGKSA-N	0	3	314.223	2.491	10	0		DEAEHN
NCc1cccc(NC(=O)C[S@](=O)c2ccccc2F)c1	ZINC000155942755	197075626	/nfs/dbraw/zinc/07/56/26/197075626.db2.gz	ROXLRHVTLKEINS-OAQYLSRUSA-N	0	3	306.362	2.031	10	0		DEAEHN
O=C(Nc1cccc(CN2CCCCC2)c1)[C@H]1CSC(=O)N1	ZINC000155008741	197013594	/nfs/dbraw/zinc/01/35/94/197013594.db2.gz	ABRKVHDZRFWEIS-CQSZACIVSA-N	0	3	319.430	2.436	10	0		DEAEHN
CC(=O)N1CCO[C@@H]2CCN(Cc3c(C)cccc3C)C[C@H]21	ZINC000247908775	257113944	/nfs/dbraw/zinc/11/39/44/257113944.db2.gz	CYTYGNUKFDYPQU-QZTJIDSGSA-N	0	3	302.418	2.125	10	0		DEAEHN
O=C1[C@@H]2CN(Cc3ccsc3)C[C@@H]2CN1Cc1ccncc1	ZINC000247854451	257116050	/nfs/dbraw/zinc/11/60/50/257116050.db2.gz	IUQFNLVYKQTTFS-HZPDHXFCSA-N	0	3	313.426	2.234	10	0		DEAEHN
O=C(NCc1cccs1)[C@]12CCO[C@H]1CCN(C1CCC1)C2	ZINC000247497144	257118776	/nfs/dbraw/zinc/11/87/76/257118776.db2.gz	OLVWLNWTRWSKTD-RDJZCZTQSA-N	0	3	320.458	2.398	10	0		DEAEHN
O=C(NCC1CC1)[C@@H]1C[C@@H]2OCC[C@@H]2N(Cc2ccsc2)C1	ZINC000247517577	257119491	/nfs/dbraw/zinc/11/94/91/257119491.db2.gz	WFUMTNUTUXGOLI-PMPSAXMXSA-N	0	3	320.458	2.254	10	0		DEAEHN
CN(C)C1(CNC(=O)c2ccc3c(c2)NC(=O)C3(C)C)CCC1	ZINC000295011843	224377523	/nfs/dbraw/zinc/37/75/23/224377523.db2.gz	VPEUZJMIOLILON-UHFFFAOYSA-N	0	3	315.417	2.130	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cnc([C@@H]3CCCO3)s2)C1	ZINC000121040611	195285969	/nfs/dbraw/zinc/28/59/69/195285969.db2.gz	PCHJGCCPPDKJJC-AGIUHOORSA-N	0	3	323.462	2.453	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N2CC[C@@H]3OCCC[C@H]3C2)cc1	ZINC000128296398	195953288	/nfs/dbraw/zinc/95/32/88/195953288.db2.gz	SNGGHXFCWVONKM-IRXDYDNUSA-N	0	3	302.418	2.389	10	0		DEAEHN
C[C@@H](N[C@H]1CCN(c2ncccc2Cl)C1)c1ccnn1C	ZINC000192953574	533545907	/nfs/dbraw/zinc/54/59/07/533545907.db2.gz	UGYFALPRUOBASN-NEPJUHHUSA-N	0	3	305.813	2.398	10	0		DEAEHN
C[C@@H](Cc1ccccc1)C(=O)NCCN1CCN(C)C(C)(C)C1	ZINC000357685809	133093859	/nfs/dbraw/zinc/09/38/59/133093859.db2.gz	HNEIPSVDXKNOKC-INIZCTEOSA-N	0	3	317.477	2.007	10	0		DEAEHN
COC(=O)c1cc(CNCC[C@@H]2COc3ccccc3O2)c[nH]1	ZINC000360277043	133173230	/nfs/dbraw/zinc/17/32/30/133173230.db2.gz	ZSOGBDTXHBDDCD-CYBMUJFWSA-N	0	3	316.357	2.121	10	0		DEAEHN
C[C@@H]1CCOCCN1C[C@@H](O)COc1cccc2[nH]ccc21	ZINC000362235387	133218933	/nfs/dbraw/zinc/21/89/33/133218933.db2.gz	KMMBHCKRMJESEH-ZIAGYGMSSA-N	0	3	304.390	2.018	10	0		DEAEHN
C[C@H]1CN(CC(=O)NCCc2cccc3cccnc32)C[C@@H]1C	ZINC000362445934	133230779	/nfs/dbraw/zinc/23/07/79/133230779.db2.gz	FSSGOBUUICQZMZ-GJZGRUSLSA-N	0	3	311.429	2.481	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@H]2CCCC[C@H]2O)C1	ZINC000373019546	133374614	/nfs/dbraw/zinc/37/46/14/133374614.db2.gz	HWBGUXPUVMDBTF-YLFCFFPRSA-N	0	3	323.481	2.196	10	0		DEAEHN
CN(Cc1cccc(Br)c1)[C@@]1(CO)CCOC1	ZINC000359571641	147353260	/nfs/dbraw/zinc/35/32/60/147353260.db2.gz	LOKWDRAXQIPLRW-CYBMUJFWSA-N	0	3	300.196	2.032	10	0		DEAEHN
CN1CCO[C@H](CNCc2cccn2Cc2cccs2)C1	ZINC000119089375	144660345	/nfs/dbraw/zinc/66/03/45/144660345.db2.gz	ZARXGJMQFXHUHE-OAHLLOKOSA-N	0	3	305.447	2.018	10	0		DEAEHN
O=C([C@@H]1C[C@H]1c1cc(F)ccc1F)N1CCN2CCC1CC2	ZINC000188617809	145014680	/nfs/dbraw/zinc/01/46/80/145014680.db2.gz	JIDIWHDOFOXGRI-DZGCQCFKSA-N	0	3	306.356	2.375	10	0		DEAEHN
O=C([C@H]1C[C@@H]1c1c(F)cccc1F)N1CCN2CCC1CC2	ZINC000188667499	145015670	/nfs/dbraw/zinc/01/56/70/145015670.db2.gz	OXDHRKULWMIIKV-STQMWFEESA-N	0	3	306.356	2.375	10	0		DEAEHN
NC(=O)NC(=O)CCN(CCC(F)(F)F)Cc1ccccc1	ZINC000191238342	145054767	/nfs/dbraw/zinc/05/47/67/145054767.db2.gz	LWKCVPVBBSMMOE-UHFFFAOYSA-N	0	3	317.311	2.026	10	0		DEAEHN
COc1ccc(OC)c(NC(=O)[C@H](C)N[C@@H](C)[C@@H]2CCCO2)c1	ZINC000193129064	145082892	/nfs/dbraw/zinc/08/28/92/145082892.db2.gz	CNRFZADPMDQVDP-HUBLWGQQSA-N	0	3	322.405	2.188	10	0		DEAEHN
C[C@H](NCC(=O)Nc1ccccc1OC(F)F)[C@H]1CCCO1	ZINC000193130076	145083009	/nfs/dbraw/zinc/08/30/09/145083009.db2.gz	FWKCDHYPJGSYOS-CMPLNLGQSA-N	0	3	314.332	2.384	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)Cc2cccc(C)c2)[C@@H](C)C1	ZINC000246485904	145104337	/nfs/dbraw/zinc/10/43/37/145104337.db2.gz	WZGUDSYOWCOXNL-DOTOQJQBSA-N	0	3	324.490	2.487	10	0		DEAEHN
Cc1ccc([C@H](O)CN2CCC[C@@H](Cn3ccnn3)C2)cc1	ZINC000246637987	145109135	/nfs/dbraw/zinc/10/91/35/145109135.db2.gz	JKBPTFIGXDOBOQ-NVXWUHKLSA-N	0	3	300.406	2.032	10	0		DEAEHN
C[C@H](Sc1ccccn1)C(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000246728553	145112264	/nfs/dbraw/zinc/11/22/64/145112264.db2.gz	XHRSJIPTNSYHRS-IHRRRGAJSA-N	0	3	305.447	2.257	10	0		DEAEHN
CCc1ccc([C@@H]2CCCCN2C[C@@H](O)CN2CCOCC2)o1	ZINC000246781021	145113969	/nfs/dbraw/zinc/11/39/69/145113969.db2.gz	OOQOSPVGCJNSBD-RDJZCZTQSA-N	0	3	322.449	2.062	10	0		DEAEHN
CCc1ccc(OCC(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1	ZINC000246802145	145115051	/nfs/dbraw/zinc/11/50/51/145115051.db2.gz	BVQXPIPHRBKFPW-GDBMZVCRSA-N	0	3	302.418	2.323	10	0		DEAEHN
C[C@H]1CN([C@H](CNCc2cncn2C)c2cccs2)CCO1	ZINC000247175104	145128397	/nfs/dbraw/zinc/12/83/97/145128397.db2.gz	NCNBYLRPKSEKDC-DZGCQCFKSA-N	0	3	320.462	2.033	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@H]1CCCN(C(C)C)C1=O	ZINC000247193221	145128716	/nfs/dbraw/zinc/12/87/16/145128716.db2.gz	WQSGLMIORYSFER-HOTGVXAUSA-N	0	3	304.438	2.055	10	0		DEAEHN
CCc1noc2ncc(C(=O)N3C[C@H]4CCCN4C[C@H]3C)cc12	ZINC000247253194	145130685	/nfs/dbraw/zinc/13/06/85/145130685.db2.gz	NQUWQBCEFONPHT-DGCLKSJQSA-N	0	3	314.389	2.094	10	0		DEAEHN
C[C@@H]1CC[C@H](CC(=O)N2CCCC[C@@H](N3CCN(C)CC3)C2)C1	ZINC000247309538	145133000	/nfs/dbraw/zinc/13/30/00/145133000.db2.gz	FRYQCIMYNAWYRT-FGTMMUONSA-N	0	3	321.509	2.441	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)COc2ccc(F)cc2F)C1	ZINC000247358423	145134456	/nfs/dbraw/zinc/13/44/56/145134456.db2.gz	OKHHBEKPWZNULA-SMDDNHRTSA-N	0	3	312.360	2.189	10	0		DEAEHN
Cc1ccc(OCCCN2CCN(C[C@@H](C)O)[C@@H](C)C2)cc1C	ZINC000247404745	145136221	/nfs/dbraw/zinc/13/62/21/145136221.db2.gz	YYCQFOMMNUKDAK-ZWKOTPCHSA-N	0	3	320.477	2.459	10	0		DEAEHN
CN(CCCNC(=O)N1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000247594138	145142042	/nfs/dbraw/zinc/14/20/42/145142042.db2.gz	RTXGZQUSVQXDLA-KRWDZBQOSA-N	0	3	316.449	2.003	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2cccc(OC(F)F)c2)C[C@H]1C	ZINC000247779593	145144105	/nfs/dbraw/zinc/14/41/05/145144105.db2.gz	RORGIVJUCCUBTF-OLZOCXBDSA-N	0	3	314.376	2.175	10	0		DEAEHN
CN(CCN1CCC[C@H]1C(=O)NC1CC1)Cc1ccc(F)cc1	ZINC000248548122	145158654	/nfs/dbraw/zinc/15/86/54/145158654.db2.gz	FLJNWVDLRXSLPA-KRWDZBQOSA-N	0	3	319.424	2.001	10	0		DEAEHN
CN(C[C@@H]1CCC(C)(C)O1)[C@H]1CCCN(c2cccnn2)C1	ZINC000248566911	145159311	/nfs/dbraw/zinc/15/93/11/145159311.db2.gz	JKGZCAOHTXCDDX-GJZGRUSLSA-N	0	3	304.438	2.335	10	0		DEAEHN
COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@H](C)[C@H]1CCCO1	ZINC000248607848	145160969	/nfs/dbraw/zinc/16/09/69/145160969.db2.gz	PMIBDJDWCMFSRZ-KNCOVGOOSA-N	0	3	320.433	2.418	10	0		DEAEHN
Cc1ccc(Cl)c(OC[C@H](O)CN(C)C[C@H]2CCCO2)c1	ZINC000248616308	145161497	/nfs/dbraw/zinc/16/14/97/145161497.db2.gz	ZBAPCJWVYHNCLV-ZIAGYGMSSA-N	0	3	313.825	2.499	10	0		DEAEHN
COc1ccccc1C[C@@H]1CCCN1CCN1CCO[C@H](C)C1	ZINC000249061240	145177748	/nfs/dbraw/zinc/17/77/48/145177748.db2.gz	PRRFAKLYXGESGZ-AEFFLSMTSA-N	0	3	318.461	2.423	10	0		DEAEHN
CC1(C)[C@H](NCC(=O)NCCc2ccccc2)[C@H]2CCCO[C@H]21	ZINC000252734535	145200982	/nfs/dbraw/zinc/20/09/82/145200982.db2.gz	NGYLVSSNSNACNT-KBAYOESNSA-N	0	3	316.445	2.139	10	0		DEAEHN
Cc1cnc(-c2cccc(NC(=O)C3(N)CCOCC3)c2)o1	ZINC000261686839	145216830	/nfs/dbraw/zinc/21/68/30/145216830.db2.gz	CURIZKYFEJLZHQ-UHFFFAOYSA-N	0	3	301.346	2.096	10	0		DEAEHN
N[C@@H](C(=O)NCC1CCC(C(F)(F)F)CC1)C1CCOCC1	ZINC000261716630	145219748	/nfs/dbraw/zinc/21/97/48/145219748.db2.gz	CDJVERYIHXCUBV-KGPNIALWSA-N	0	3	322.371	2.225	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N1CC(=O)Nc1ccc2c(c1F)CCNC2	ZINC000261722320	145220710	/nfs/dbraw/zinc/22/07/10/145220710.db2.gz	LQLGKCKRCANCGX-VXGBXAGGSA-N	0	3	305.397	2.283	10	0		DEAEHN
C[C@@H](c1ccc(C(C)(C)C)cc1)N(C)CC(=O)N1CCNCC1	ZINC000261737708	145222105	/nfs/dbraw/zinc/22/21/05/145222105.db2.gz	NOPMZISFPMQXFC-HNNXBMFYSA-N	0	3	317.477	2.409	10	0		DEAEHN
Cc1ccc([O-])c(CN2CC[NH2+]C[C@@H]2c2cccc(F)c2)n1	ZINC000261753337	145222462	/nfs/dbraw/zinc/22/24/62/145222462.db2.gz	QIMSWUHGXOXAMJ-MRXNPFEDSA-N	0	3	301.365	2.381	10	0		DEAEHN
CCc1nn(C)c(CC)c1CN1CCNC[C@H]1c1cccnc1	ZINC000261781695	145225660	/nfs/dbraw/zinc/22/56/60/145225660.db2.gz	UAWZPYKOCHDAIZ-SFHVURJKSA-N	0	3	313.449	2.086	10	0		DEAEHN
c1cncc([C@H]2CNCCN2Cc2ccc(N3CCCC3)nc2)c1	ZINC000261810227	145229108	/nfs/dbraw/zinc/22/91/08/145229108.db2.gz	MMIIUMTZIBIHCU-GOSISDBHSA-N	0	3	323.444	2.223	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)Nc1ccc2c(c1F)CCNC2	ZINC000261826633	145230981	/nfs/dbraw/zinc/23/09/81/145230981.db2.gz	YPGNHJGISQAJDH-OAHLLOKOSA-N	0	3	305.397	2.284	10	0		DEAEHN
CCNC(=O)c1ccc(C)c(NC(=O)[C@H]2NCCCC2(C)C)c1	ZINC000261856175	145233644	/nfs/dbraw/zinc/23/36/44/145233644.db2.gz	JXNFPJPOOYJMNJ-OAHLLOKOSA-N	0	3	317.433	2.461	10	0		DEAEHN
Cc1ccc(CN(C)C(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)cc1	ZINC000261885627	145237929	/nfs/dbraw/zinc/23/79/29/145237929.db2.gz	NCMAADOLZHEIQV-TXPKVOOTSA-N	0	3	316.445	2.486	10	0		DEAEHN
Cc1ccc(NC(=O)C2(N)CCOCC2)cc1-c1ncco1	ZINC000261910600	145240365	/nfs/dbraw/zinc/24/03/65/145240365.db2.gz	SZFOYLHWFRPEPD-UHFFFAOYSA-N	0	3	301.346	2.096	10	0		DEAEHN
CCc1ccc(O)c(NC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)c1	ZINC000261924558	145242788	/nfs/dbraw/zinc/24/27/88/145242788.db2.gz	SBTMGKJBROWVBO-WBHUJUFNSA-N	0	3	318.417	2.426	10	0		DEAEHN
NC1(C(=O)N2CCC(Cc3cccc(F)c3)CC2)CCOCC1	ZINC000261949967	145245709	/nfs/dbraw/zinc/24/57/09/145245709.db2.gz	YVEOUNZRDDTGMY-UHFFFAOYSA-N	0	3	320.408	2.115	10	0		DEAEHN
NC1(C(=O)Nc2ccc(Cc3ccncc3)cc2)CCOCC1	ZINC000261953851	145246604	/nfs/dbraw/zinc/24/66/04/145246604.db2.gz	ZLPPZCYHTXZFQF-UHFFFAOYSA-N	0	3	311.385	2.119	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)N2C[C@@H](c3ccccc3)[C@H](N)C2)c1	ZINC000262229798	145270861	/nfs/dbraw/zinc/27/08/61/145270861.db2.gz	NSKHPXCRODXWHN-ZWKOTPCHSA-N	0	3	323.396	2.212	10	0		DEAEHN
C[C@@H](C(=O)NCc1ccc(CO)c(F)c1)[C@@H](N)c1ccccc1	ZINC000262305629	145275183	/nfs/dbraw/zinc/27/51/83/145275183.db2.gz	OPMCOXCQVYIASF-SJKOYZFVSA-N	0	3	316.376	2.270	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1CNC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C	ZINC000262579211	145295110	/nfs/dbraw/zinc/29/51/10/145295110.db2.gz	YQKXFFZVOJJTRG-KAYRBKQESA-N	0	3	308.466	2.461	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(/C=C/c2ccc(Cl)cc2)n1	ZINC000263140677	145328777	/nfs/dbraw/zinc/32/87/77/145328777.db2.gz	CHKDPKPGAFFILK-WXJAXGNASA-N	0	3	304.781	2.470	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(C(C)(C)c2ccc(F)cc2)n1	ZINC000263201441	145335315	/nfs/dbraw/zinc/33/53/15/145335315.db2.gz	JDOFRNFIYBAFRM-CYBMUJFWSA-N	0	3	304.369	2.111	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2cc(-c3cccs3)on2)n1	ZINC000263205805	145335968	/nfs/dbraw/zinc/33/59/68/145335968.db2.gz	JRVIFEPZQKKKCO-JTQLQIEISA-N	0	3	317.374	2.029	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(/C=C/c2ccc3ccccc3n2)n1	ZINC000263214268	145337358	/nfs/dbraw/zinc/33/73/58/145337358.db2.gz	KPAHBLILTIRSNR-FDMDGMSGSA-N	0	3	321.384	2.364	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2C[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000263223074	145337928	/nfs/dbraw/zinc/33/79/28/145337928.db2.gz	MGHFAIICEMJNQK-UHIISALHSA-N	0	3	320.343	2.195	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@]23CCc2ccccc23)n1	ZINC000263221636	145338014	/nfs/dbraw/zinc/33/80/14/145338014.db2.gz	LXSXRUDPQYCDAJ-DAYGRLMNSA-N	0	3	310.401	2.017	10	0		DEAEHN
CC(C)[C@@H](C(=O)N1CCC[C@H](c2noc(C3CC3)n2)C1)N(C)C	ZINC000349570627	146386680	/nfs/dbraw/zinc/38/66/80/146386680.db2.gz	SWOVKRZNVOQIME-KBPBESRZSA-N	0	3	320.437	2.239	10	0		DEAEHN
C[C@H](CN(C)C)NC(=O)N1C[C@@H](C)O[C@@H](c2ccccc2)C1	ZINC000358509028	147147601	/nfs/dbraw/zinc/14/76/01/147147601.db2.gz	VTIMQGNROVCPKK-IIAWOOMASA-N	0	3	305.422	2.108	10	0		DEAEHN
C[C@@H](C(=O)NCc1ccc2cc[nH]c2n1)N1[C@H](C)CC[C@@H]1C	ZINC000359422362	147324953	/nfs/dbraw/zinc/32/49/53/147324953.db2.gz	MRKLHTLHBXQNHT-XQQFMLRXSA-N	0	3	300.406	2.440	10	0		DEAEHN
CC1=CCN(CCN[C@H](C)c2ccc3c(c2)OCC(=O)N3)CC1	ZINC000565497286	292166172	/nfs/dbraw/zinc/16/61/72/292166172.db2.gz	PHHUCYGUCGYSDW-CQSZACIVSA-N	0	3	315.417	2.320	10	0		DEAEHN
O=C1C[C@H](NCC2=CCCOC2)CN1c1ccccc1Cl	ZINC000370758118	148052761	/nfs/dbraw/zinc/05/27/61/148052761.db2.gz	RAUAJAIKBKZDHW-ZDUSSCGKSA-N	0	3	306.793	2.382	10	0		DEAEHN
NC(=O)[C@@H](Cc1ccccc1)NCc1ccccc1-n1cccn1	ZINC000371870707	148148444	/nfs/dbraw/zinc/14/84/44/148148444.db2.gz	SGHVQNUWBIDAQS-QGZVFWFLSA-N	0	3	320.396	2.059	10	0		DEAEHN
CN(C)[C@@H](CNC(=O)CN1CCCC12CCC2)c1ccccc1	ZINC000373103106	148210821	/nfs/dbraw/zinc/21/08/21/148210821.db2.gz	DJCQICWBVQZRBN-KRWDZBQOSA-N	0	3	315.461	2.424	10	0		DEAEHN
C[C@H]1CN(C(=O)C2CCN(C)CC2)C[C@H](c2ccc(F)cc2)O1	ZINC000073989775	401726884	/nfs/dbraw/zinc/72/68/84/401726884.db2.gz	DCBKIUDJFJTUIE-SUMWQHHRSA-N	0	3	320.408	2.456	10	0		DEAEHN
Fc1cc(CNC[C@H]2COCCO2)ccc1Br	ZINC000127406614	401733385	/nfs/dbraw/zinc/73/33/85/401733385.db2.gz	AEPQMPJVJHPCBA-JTQLQIEISA-N	0	3	304.159	2.093	10	0		DEAEHN
CN1C[C@H](NCc2ccc(Br)c(F)c2)CCC1=O	ZINC000127476619	401737210	/nfs/dbraw/zinc/73/72/10/401737210.db2.gz	KYRCFAXKIDORFS-SNVBAGLBSA-N	0	3	315.186	2.299	10	0		DEAEHN
CC[C@@H]1CN(CCCCCn2cc(C)cn2)CCN1C[C@@H](C)O	ZINC000111227872	401701946	/nfs/dbraw/zinc/70/19/46/401701946.db2.gz	NIMXNHQSLZNIIX-QZTJIDSGSA-N	0	3	322.497	2.139	10	0		DEAEHN
CC(C)N1CCN(c2ccc(C(=O)N[C@H]3C[C@H]3C)cc2)CC1	ZINC000072094586	401703578	/nfs/dbraw/zinc/70/35/78/401703578.db2.gz	WYPZUWOKMSEQFQ-PBHICJAKSA-N	0	3	301.434	2.355	10	0		DEAEHN
C[C@@H](CNC(=O)c1cnn2c1CCCC2)N1CCC[C@@H](C)C1	ZINC000126954271	401714365	/nfs/dbraw/zinc/71/43/65/401714365.db2.gz	BSPRMLFNLZEDRM-KGLIPLIRSA-N	0	3	304.438	2.070	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1nc(C2CC2)cs1	ZINC000111413560	401714935	/nfs/dbraw/zinc/71/49/35/401714935.db2.gz	GRLBXWKCJDJIHH-LBPRGKRZSA-N	0	3	324.450	2.253	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCCN(C2CC2)CC1)Oc1ccccc1	ZINC000073230469	401716687	/nfs/dbraw/zinc/71/66/87/401716687.db2.gz	SQXVZDKIEOVRLD-HNNXBMFYSA-N	0	3	317.433	2.334	10	0		DEAEHN
O=C(CN[C@H]1CCCC[C@H]1n1cccn1)NC(C1CC1)C1CC1	ZINC000129089682	401798739	/nfs/dbraw/zinc/79/87/39/401798739.db2.gz	UPIBLYFFJQQDPB-JKSUJKDBSA-N	0	3	316.449	2.261	10	0		DEAEHN
CN(CCN1CCCCC1)[C@H]1CCN(c2ccccc2)C1=O	ZINC000077285797	401808993	/nfs/dbraw/zinc/80/89/93/401808993.db2.gz	NFIYGONOXRLMSD-KRWDZBQOSA-N	0	3	301.434	2.210	10	0		DEAEHN
COc1ccccc1NCC(=O)NCCN1CCCC[C@H]1C	ZINC000112869223	401760257	/nfs/dbraw/zinc/76/02/57/401760257.db2.gz	HWDQPFSUTYWRCM-CQSZACIVSA-N	0	3	305.422	2.098	10	0		DEAEHN
O=C1NCCCC[C@@H]1N1CCC(OCc2ccccc2)CC1	ZINC000010988545	401772807	/nfs/dbraw/zinc/77/28/07/401772807.db2.gz	BTVYFUHDNKKEAV-KRWDZBQOSA-N	0	3	302.418	2.336	10	0		DEAEHN
COc1ccccc1CCNC(=O)CN1C[C@H](C)CC[C@H]1C	ZINC000076149381	401784924	/nfs/dbraw/zinc/78/49/24/401784924.db2.gz	NLPSCRKAWCDBGZ-HUUCEWRRSA-N	0	3	304.434	2.474	10	0		DEAEHN
CN(C)Cc1cccc(CNC(=O)[C@@H]2CCCc3n[nH]cc32)c1	ZINC000132737722	401873239	/nfs/dbraw/zinc/87/32/39/401873239.db2.gz	UUAFDCTZOBAUKV-OAHLLOKOSA-N	0	3	312.417	2.208	10	0		DEAEHN
COc1ccc2c3c1O[C@H]1C(=O)C[C@@H](C)[C@H]4[C@@H](C2)N(C)CC[C@]314	ZINC000029414775	401856439	/nfs/dbraw/zinc/85/64/39/401856439.db2.gz	XENDXLLQEKTAFL-JTJXXDHKSA-N	0	3	313.397	2.179	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)Cc2cccc3ccccc32)CCO1	ZINC000116784570	401858602	/nfs/dbraw/zinc/85/86/02/401858602.db2.gz	PVCGDRRSOVKEOZ-KRWDZBQOSA-N	0	3	312.413	2.171	10	0		DEAEHN
CCSCc1ccc(C(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000116784886	401858749	/nfs/dbraw/zinc/85/87/49/401858749.db2.gz	DCMXKHSWWJBAJL-INIZCTEOSA-N	0	3	322.474	2.342	10	0		DEAEHN
CC[C@@H](CC(=O)N1CCO[C@H](CN(C)C)C1)c1ccccc1	ZINC000116787302	401859419	/nfs/dbraw/zinc/85/94/19/401859419.db2.gz	PBBVJUOSMPTUHR-DOTOQJQBSA-N	0	3	304.434	2.359	10	0		DEAEHN
C[C@@H](C(=O)N1CCC(c2ccnn2C)CC1)N1[C@H](C)CC[C@@H]1C	ZINC000131908813	401859516	/nfs/dbraw/zinc/85/95/16/401859516.db2.gz	NANCEZGPUHNKRT-ZNMIVQPWSA-N	0	3	318.465	2.387	10	0		DEAEHN
C[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1)[C@@H]1CCCO1	ZINC000079487893	401873873	/nfs/dbraw/zinc/87/38/73/401873873.db2.gz	SGOCRGPKHOKVHK-RDJZCZTQSA-N	0	3	319.449	2.327	10	0		DEAEHN
CC(C)C[C@@H](N)C(=O)N(C)Cc1ccc(Br)o1	ZINC000037819848	401917800	/nfs/dbraw/zinc/91/78/00/401917800.db2.gz	AFJDHBCMNNBQNG-SNVBAGLBSA-N	0	3	303.200	2.374	10	0		DEAEHN
C[C@@H](NC[C@H](O)Cn1cccn1)c1cccc(Br)c1	ZINC000038012400	401920287	/nfs/dbraw/zinc/92/02/87/401920287.db2.gz	OMWDVJFAIGZDIZ-RISCZKNCSA-N	0	3	324.222	2.357	10	0		DEAEHN
COc1cc(C[NH2+]C[C@H](C)N(C)C)cc(Br)c1[O-]	ZINC000038088950	401922262	/nfs/dbraw/zinc/92/22/62/401922262.db2.gz	WVNPQZKPLNEHKN-VIFPVBQESA-N	0	3	317.227	2.203	10	0		DEAEHN
OC[C@@H](NC[C@@H]1CCCO1)c1cccc(Br)c1	ZINC000038114863	401922921	/nfs/dbraw/zinc/92/29/21/401922921.db2.gz	TUZCNJSFTMDPRD-QWHCGFSZSA-N	0	3	300.196	2.251	10	0		DEAEHN
O=C(c1ccccc1)N1CCCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000089883327	401969871	/nfs/dbraw/zinc/96/98/71/401969871.db2.gz	BCAXQNPHLMWNIC-IRXDYDNUSA-N	0	3	302.418	2.138	10	0		DEAEHN
CN(CCCN1CCN(C)CC1)C(=O)[C@@H]1C[C@H]1C1CCCCC1	ZINC000119900283	401970964	/nfs/dbraw/zinc/97/09/64/401970964.db2.gz	YJDZKTNGSVZAFI-ZWKOTPCHSA-N	0	3	321.509	2.299	10	0		DEAEHN
COc1ccc(OCCC(=O)NCCN2CCCC[C@@H]2C)cc1	ZINC000046859079	401973926	/nfs/dbraw/zinc/97/39/26/401973926.db2.gz	PGCIYTHZMPXFEO-HNNXBMFYSA-N	0	3	320.433	2.455	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@@H](C)N1CCC[C@H](Cc2nccn2C)C1	ZINC000090004009	401978688	/nfs/dbraw/zinc/97/86/88/401978688.db2.gz	ZVHDNHWBENUSQJ-ARFHVFGLSA-N	0	3	320.481	2.368	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCC1(c2ccc(F)cc2F)CC1	ZINC000090551838	401985150	/nfs/dbraw/zinc/98/51/50/401985150.db2.gz	RZSUDLDXROZLTB-ZDUSSCGKSA-N	0	3	323.387	2.390	10	0		DEAEHN
CN(CCNC(=O)N1CCCN(C2CC2)CC1)c1ccccc1	ZINC000140308627	401989022	/nfs/dbraw/zinc/98/90/22/401989022.db2.gz	YVFGSZFCLFUSIC-UHFFFAOYSA-N	0	3	316.449	2.003	10	0		DEAEHN
COc1ccc([C@@H](C)NC(=O)C[C@@H]2CSCCN2)cc1F	ZINC000091135121	401994341	/nfs/dbraw/zinc/99/43/41/401994341.db2.gz	UUFOJWBBFDJNJM-ZYHUDNBSSA-N	0	3	312.410	2.107	10	0		DEAEHN
CCO[C@@H](C)c1noc(CN2CCC(c3ccn[nH]3)CC2)n1	ZINC000120607434	401995269	/nfs/dbraw/zinc/99/52/69/401995269.db2.gz	UQZBDQDUUFHOJJ-NSHDSACASA-N	0	3	305.382	2.270	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)c1cc(-c2cccnc2)on1	ZINC000044532616	401944808	/nfs/dbraw/zinc/94/48/08/401944808.db2.gz	MCTXYNYIPKWFLW-ZDUSSCGKSA-N	0	3	314.389	2.341	10	0		DEAEHN
COc1cc(CN(CCCCO)C2CC2)cc2c1OCCO2	ZINC000093383099	402014843	/nfs/dbraw/zinc/01/48/43/402014843.db2.gz	MVUCCTHZHWFTHL-UHFFFAOYSA-N	0	3	307.390	2.203	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCC(NCC(=O)c2ccc[nH]2)CC1	ZINC000095083527	402024414	/nfs/dbraw/zinc/02/44/14/402024414.db2.gz	MKECZOOWVFFXMK-UHFFFAOYSA-N	0	3	307.394	2.187	10	0		DEAEHN
Cc1cccc([C@@H](O)CNC(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000121391665	402032938	/nfs/dbraw/zinc/03/29/38/402032938.db2.gz	UQOMLDJWXOJNPY-IRXDYDNUSA-N	0	3	321.465	2.304	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H](C)c2ccc3c(c2)OCO3)C1	ZINC000052521721	402043569	/nfs/dbraw/zinc/04/35/69/402043569.db2.gz	WHOVFRXSXIZRSD-GXTWGEPZSA-N	0	3	319.405	2.260	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@H](OC)c2ccccc2)C1	ZINC000052523341	402043747	/nfs/dbraw/zinc/04/37/47/402043747.db2.gz	UXMUHMBIUWLBOW-CVEARBPZSA-N	0	3	305.422	2.158	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2nc(C3CC3)cs2)C1	ZINC000151641363	402048064	/nfs/dbraw/zinc/04/80/64/402048064.db2.gz	FEBQYWBKXIJUIV-LBPRGKRZSA-N	0	3	308.451	2.304	10	0		DEAEHN
COc1ccc(CNC(=O)CN(C)CCC2CCOCC2)cc1	ZINC000120762019	402001211	/nfs/dbraw/zinc/00/12/11/402001211.db2.gz	XDRZRFQMWRFAJB-UHFFFAOYSA-N	0	3	320.433	2.060	10	0		DEAEHN
CC(C)N(C)CC(=O)N1C[C@@H](c2ccc(F)cc2)O[C@@H](C)C1	ZINC000152194538	402080906	/nfs/dbraw/zinc/08/09/06/402080906.db2.gz	KRGWTELGHNNQKH-BBRMVZONSA-N	0	3	308.397	2.454	10	0		DEAEHN
CCOCCN1CCC(C(=O)N2CCc3ccccc32)CC1	ZINC000152194013	402081054	/nfs/dbraw/zinc/08/10/54/402081054.db2.gz	WHZQCQLUHZKHQT-UHFFFAOYSA-N	0	3	302.418	2.324	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cc(F)cc3nccnc32)CCN1C	ZINC000122754921	402092991	/nfs/dbraw/zinc/09/29/91/402092991.db2.gz	SARKSJBCRGFBHO-AAEUAGOBSA-N	0	3	316.380	2.324	10	0		DEAEHN
CC[C@](C)(O)CN1CCN(Cc2cc(F)ccc2OC)CC1	ZINC000123044965	402107547	/nfs/dbraw/zinc/10/75/47/402107547.db2.gz	JTEGUDQKVDBQJB-KRWDZBQOSA-N	0	3	310.413	2.113	10	0		DEAEHN
CCC[C@H](C(=O)NCc1nc(-c2ccccc2)c[nH]1)N(C)C	ZINC000123054268	402108192	/nfs/dbraw/zinc/10/81/92/402108192.db2.gz	QSRBKVJNCSLTSU-OAHLLOKOSA-N	0	3	300.406	2.423	10	0		DEAEHN
CCc1ccc([C@H](CNC(=O)NC[C@H](O)C(C)C)N(C)C)cc1	ZINC000152947782	402118247	/nfs/dbraw/zinc/11/82/47/402118247.db2.gz	OMHCKGZPKJSZSG-IRXDYDNUSA-N	0	3	321.465	2.168	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)CN(C)Cc2ccccc2)CCN1C	ZINC000123265133	402118751	/nfs/dbraw/zinc/11/87/51/402118751.db2.gz	OGICMNJKIHYKKL-NVXWUHKLSA-N	0	3	303.450	2.060	10	0		DEAEHN
Cc1cc(F)cc(NC(=O)C(=O)NCCN2CCCC[C@@H]2C)c1	ZINC000153134070	402129137	/nfs/dbraw/zinc/12/91/37/402129137.db2.gz	GYKGWXDQOKKGSI-ZDUSSCGKSA-N	0	3	321.396	2.063	10	0		DEAEHN
COc1ccccc1OCC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000123710151	402142639	/nfs/dbraw/zinc/14/26/39/402142639.db2.gz	CLDDLDHZBDBSDA-UONOGXRCSA-N	0	3	306.406	2.015	10	0		DEAEHN
CCOC[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)C(C)C	ZINC000189363961	286169961	/nfs/dbraw/zinc/16/99/61/286169961.db2.gz	AFNRKVSPOYBUBP-DOMZBBRYSA-N	0	3	314.451	2.046	10	0		DEAEHN
Cc1cc(NC(=O)C(=O)NCCN2CCCC[C@H]2C)ccc1F	ZINC000103322930	402185249	/nfs/dbraw/zinc/18/52/49/402185249.db2.gz	KEBIGWYCGMPQKI-CYBMUJFWSA-N	0	3	321.396	2.063	10	0		DEAEHN
Cc1cc(C)nc(SCC(=O)N[C@H](CC(C)C)CN(C)C)n1	ZINC000068223002	402188079	/nfs/dbraw/zinc/18/80/79/402188079.db2.gz	JBPRSIVSZJPVMD-CQSZACIVSA-N	0	3	324.494	2.278	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@H](Cc2ccccc2)C2CC2)C1	ZINC000154169456	402197208	/nfs/dbraw/zinc/19/72/08/402197208.db2.gz	FXTLHNAPFXKPBN-IAGOWNOFSA-N	0	3	301.434	2.353	10	0		DEAEHN
COc1cc(OC)cc(N2CC[C@@H](CNCc3ncc[nH]3)C2)c1	ZINC000153781191	402170421	/nfs/dbraw/zinc/17/04/21/402170421.db2.gz	GZQJTTDFJKYYAY-ZDUSSCGKSA-N	0	3	316.405	2.043	10	0		DEAEHN
CC(C)NC(=O)NC[C@@H]1CCN(Cc2cc(C(C)(C)C)[nH]n2)C1	ZINC000067769452	402172502	/nfs/dbraw/zinc/17/25/02/402172502.db2.gz	MYLCKLNCBQJPMQ-ZDUSSCGKSA-N	0	3	321.469	2.237	10	0		DEAEHN
COc1ccc(CCCC(=O)NC[C@@H]2CCCN2C)c(OC)c1	ZINC000154653249	402224197	/nfs/dbraw/zinc/22/41/97/402224197.db2.gz	CPDNAQUHWGHKLH-HNNXBMFYSA-N	0	3	320.433	2.237	10	0		DEAEHN
CN(C)[C@H]1CCCN(C(=O)NCCCc2cccc(F)c2)C1	ZINC000069467286	402225272	/nfs/dbraw/zinc/22/52/72/402225272.db2.gz	YYPMNKSZDLRIDB-INIZCTEOSA-N	0	3	307.413	2.494	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)c1ccc(-c2ncon2)cc1	ZINC000107219990	402227982	/nfs/dbraw/zinc/22/79/82/402227982.db2.gz	ZATBJVSLCIXVAF-ZDUSSCGKSA-N	0	3	314.389	2.341	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)[C@H]1CSC(=O)N1)c1ccccc1	ZINC000154798890	402233143	/nfs/dbraw/zinc/23/31/43/402233143.db2.gz	CDJZGUBSQZRGRT-KGLIPLIRSA-N	0	3	321.446	2.011	10	0		DEAEHN
COC(=O)[C@@H](NC[C@H]1CCCN1CC(C)C)c1cccnc1	ZINC000155212793	402248903	/nfs/dbraw/zinc/24/89/03/402248903.db2.gz	MVTKXDWLLGSVDW-CVEARBPZSA-N	0	3	305.422	2.006	10	0		DEAEHN
C[C@@H](NC(=O)NC[C@H]1CCCN(C)C1)c1ccc2c(c1)OCO2	ZINC000108546618	402256262	/nfs/dbraw/zinc/25/62/62/402256262.db2.gz	GKNIFHNDRVIMNI-CHWSQXEVSA-N	0	3	319.405	2.117	10	0		DEAEHN
CC(C)COC1CCN(C(=O)NC[C@H]2CCCN(C)C2)CC1	ZINC000108588580	402258143	/nfs/dbraw/zinc/25/81/43/402258143.db2.gz	ODYKIQVEQHNWHU-OAHLLOKOSA-N	0	3	311.470	2.175	10	0		DEAEHN
c1cc(-c2cc(N3CCNCC3)nc(-c3ccncc3)n2)ccn1	ZINC000070451637	402260558	/nfs/dbraw/zinc/26/05/58/402260558.db2.gz	GLKJOFMOGNYUGB-UHFFFAOYSA-N	0	3	318.384	2.010	10	0		DEAEHN
CC(C)CCOCCN(C)[C@@H]1CCCN(c2cccnn2)C1	ZINC000105909620	402210898	/nfs/dbraw/zinc/21/08/98/402210898.db2.gz	DHRFSMDNHBXNTO-MRXNPFEDSA-N	0	3	306.454	2.440	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2ncc(-c3ccccc3)o2)CCO1	ZINC000105925215	402211669	/nfs/dbraw/zinc/21/16/69/402211669.db2.gz	HWXDZYAZIWQJIS-OAHLLOKOSA-N	0	3	301.390	2.104	10	0		DEAEHN
CC(C)c1ncc(Cl)c(C(=O)N(C)C[C@@H]2CCN(C)C2)n1	ZINC000071189341	402270787	/nfs/dbraw/zinc/27/07/87/402270787.db2.gz	CZOHWABHEGQMBX-LLVKDONJSA-N	0	3	310.829	2.277	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1occc1Br	ZINC000176078286	402276326	/nfs/dbraw/zinc/27/63/26/402276326.db2.gz	UPAFMXZCBVHGNO-NXEZZACHSA-N	0	3	313.195	2.351	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@H]1CCCN1c1nccs1	ZINC000156685659	402286729	/nfs/dbraw/zinc/28/67/29/402286729.db2.gz	WGXHWOAFBQFIMN-ZIAGYGMSSA-N	0	3	324.494	2.204	10	0		DEAEHN
CC1(C)CCCC[C@@H]1NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000156909971	402289433	/nfs/dbraw/zinc/28/94/33/402289433.db2.gz	MXYOYGBEEOMEIE-GJZGRUSLSA-N	0	3	311.470	2.101	10	0		DEAEHN
COc1cc(CN2CCN(C)C[C@H]2C(C)C)cc2c1OCCO2	ZINC000184737247	402295893	/nfs/dbraw/zinc/29/58/93/402295893.db2.gz	GKUCSQMVNKZNEP-HNNXBMFYSA-N	0	3	320.433	2.238	10	0		DEAEHN
CC(C)C[C@@H](C)C(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000184827509	402302610	/nfs/dbraw/zinc/30/26/10/402302610.db2.gz	XFBFIFSOMGOCAC-SJORKVTESA-N	0	3	309.498	2.297	10	0		DEAEHN
O=C(NCCc1cc(F)ccc1F)N1CC[C@H](N2CC=CC2)C1	ZINC000176458403	402311095	/nfs/dbraw/zinc/31/10/95/402311095.db2.gz	GLVPETAKSWCFEK-HNNXBMFYSA-N	0	3	321.371	2.163	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)NC[C@H]2CCCN(C)C2)s1	ZINC000176563520	402320272	/nfs/dbraw/zinc/32/02/72/402320272.db2.gz	NTUPJFJIRBSFCL-VXGBXAGGSA-N	0	3	311.451	2.231	10	0		DEAEHN
COC(=O)c1coc(C(=O)N(CCN(C)C)C2CCCC2)c1	ZINC000185122903	402326383	/nfs/dbraw/zinc/32/63/83/402326383.db2.gz	ABFBKJARHCLGPF-UHFFFAOYSA-N	0	3	308.378	2.013	10	0		DEAEHN
COCC(=O)N1CCN(c2c(C)cnc3c(C)cccc32)CC1	ZINC000185275768	402340342	/nfs/dbraw/zinc/34/03/42/402340342.db2.gz	ANBLOGWOFNEDNA-UHFFFAOYSA-N	0	3	313.401	2.147	10	0		DEAEHN
CCN(CCCNCc1cnn(C)c1C)C(=O)OC(C)(C)C	ZINC000229808335	402345587	/nfs/dbraw/zinc/34/55/87/402345587.db2.gz	XEGQVTUPBVVPLA-UHFFFAOYSA-N	0	3	310.442	2.465	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)N(C)C[C@H]2CCCN2CC)cc1	ZINC000176895138	402347695	/nfs/dbraw/zinc/34/76/95/402347695.db2.gz	VDUTYJBSWUMDGB-MRXNPFEDSA-N	0	3	317.433	2.130	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1ccccc1C(=O)OC	ZINC000177024377	402360519	/nfs/dbraw/zinc/36/05/19/402360519.db2.gz	YOJBQMSUUFQCGL-CYBMUJFWSA-N	0	3	319.405	2.421	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000177031944	402361599	/nfs/dbraw/zinc/36/15/99/402361599.db2.gz	KMYZLTLGPWSVGI-KRWDZBQOSA-N	0	3	314.429	2.301	10	0		DEAEHN
CCc1cccc(OCCN2C[C@@H](C)[C@H](N3CCOCC3)C2)c1	ZINC000177223757	402383524	/nfs/dbraw/zinc/38/35/24/402383524.db2.gz	PRAOYZKDVNPJOH-VQIMIIECSA-N	0	3	318.461	2.280	10	0		DEAEHN
CC(C)(C)c1cccc(OCCCN2C[C@H](O)C[C@@H]2CO)c1	ZINC000185137513	402327042	/nfs/dbraw/zinc/32/70/42/402327042.db2.gz	USEFCQRGBFDKJW-HZPDHXFCSA-N	0	3	307.434	2.181	10	0		DEAEHN
CN(C)Cc1ccccc1CNC(=O)[C@@H]1CCCc2n[nH]cc21	ZINC000177274327	402386661	/nfs/dbraw/zinc/38/66/61/402386661.db2.gz	AUAKBADRYHHHTM-OAHLLOKOSA-N	0	3	312.417	2.208	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(-c2nc[nH]n2)cc1	ZINC000186005007	402396551	/nfs/dbraw/zinc/39/65/51/402396551.db2.gz	GWLKXUNNWPXBFD-OAHLLOKOSA-N	0	3	313.405	2.028	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NC[C@H](OC)c1ccccc1	ZINC000177422595	402400835	/nfs/dbraw/zinc/40/08/35/402400835.db2.gz	ZPKYARBVLAAQPS-SJORKVTESA-N	0	3	319.449	2.500	10	0		DEAEHN
CCC[C@@H](C(=O)NCCc1nc2ccc(F)cc2n1C)N(C)C	ZINC000162075247	402408562	/nfs/dbraw/zinc/40/85/62/402408562.db2.gz	PWBWVUQVPIWDCN-AWEZNQCLSA-N	0	3	320.412	2.101	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC(Cn2cccn2)CC1	ZINC000177503043	402409920	/nfs/dbraw/zinc/40/99/20/402409920.db2.gz	LATFYUVJIVKXGN-UHFFFAOYSA-N	0	3	308.426	2.120	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H](C)Oc1ccccc1OC)N(C)C	ZINC000162332835	402416813	/nfs/dbraw/zinc/41/68/13/402416813.db2.gz	KCLCTFDTRKUUKZ-KBPBESRZSA-N	0	3	308.422	2.309	10	0		DEAEHN
COCCC1(CNC(=O)N2CCCN(C3CC3)CC2)CCC1	ZINC000177628772	402421893	/nfs/dbraw/zinc/42/18/93/402421893.db2.gz	FFDOPJGMAJFYQF-UHFFFAOYSA-N	0	3	309.454	2.073	10	0		DEAEHN
CCOC(=O)c1nn(C)cc1CNC[C@H]1C[C@H]1c1ccccc1	ZINC000186349171	402423886	/nfs/dbraw/zinc/42/38/86/402423886.db2.gz	BQSWDSNCSYKYCW-ZBFHGGJFSA-N	0	3	313.401	2.490	10	0		DEAEHN
Cc1cc(OCC(=O)N2CC[C@H](N(C)C)C2)cc(C)c1Cl	ZINC000162593640	402425739	/nfs/dbraw/zinc/42/57/39/402425739.db2.gz	SETPHJJGIWPFJE-ZDUSSCGKSA-N	0	3	310.825	2.498	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)Nc1ccnn1C(C)C	ZINC000177696427	402427826	/nfs/dbraw/zinc/42/78/26/402427826.db2.gz	MLFVPGKLZLREHC-LSDHHAIUSA-N	0	3	321.469	2.207	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)Nc1ccc(C(C)=O)cc1	ZINC000177710063	402429163	/nfs/dbraw/zinc/42/91/63/402429163.db2.gz	TVGPMQMJKHVRKZ-QGZVFWFLSA-N	0	3	317.433	2.244	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2)N(C)C	ZINC000161534787	402391073	/nfs/dbraw/zinc/39/10/73/402391073.db2.gz	BTVMRCFKRZZOKF-JSGCOSHPSA-N	0	3	306.406	2.365	10	0		DEAEHN
C[C@H](C(=O)N[C@H]1CCC[C@@H](C)[C@@H]1C)N1CCCN(C2CC2)CC1	ZINC000246107068	402510541	/nfs/dbraw/zinc/51/05/41/402510541.db2.gz	DGELBGVHSYFXOK-HPFXQQBRSA-N	0	3	321.509	2.486	10	0		DEAEHN
COC[C@H](C)CN[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000187795602	402511300	/nfs/dbraw/zinc/51/13/00/402511300.db2.gz	WOMGQSOTRNWMNF-WBVHZDCISA-N	0	3	304.434	2.092	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@H]2CCCN2Cc2ccccc2)C1	ZINC000245238144	402453067	/nfs/dbraw/zinc/45/30/67/402453067.db2.gz	YGBZVBILLZITTB-ZWKOTPCHSA-N	0	3	315.461	2.252	10	0		DEAEHN
COc1cccc([C@H]2C[C@@H]2C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c1	ZINC000245455061	402462087	/nfs/dbraw/zinc/46/20/87/402462087.db2.gz	SJFRDAOLIFJCEO-ATLSCFEFSA-N	0	3	314.429	2.494	10	0		DEAEHN
CC[C@H](C(=O)Nc1ccc(OC)cc1)N1CCN2CCC[C@H]2C1	ZINC000245466949	402463088	/nfs/dbraw/zinc/46/30/88/402463088.db2.gz	JREROTMUKGNMJC-DOTOQJQBSA-N	0	3	317.433	2.192	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)CSCC(F)(F)F	ZINC000245603878	402473697	/nfs/dbraw/zinc/47/36/97/402473697.db2.gz	XHLXYIOBSJRJQP-QWRGUYRKSA-N	0	3	310.385	2.367	10	0		DEAEHN
CC[C@@H]1CN(CC2=Cc3ccccc3OC2)CCN1C[C@H](C)O	ZINC000245701554	402480885	/nfs/dbraw/zinc/48/08/85/402480885.db2.gz	DFJYOXLCMQDABV-MAUKXSAKSA-N	0	3	316.445	2.239	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@@H](C)C(=O)N1CCC(C)CC1	ZINC000178333400	402485571	/nfs/dbraw/zinc/48/55/71/402485571.db2.gz	GFDAEFRMWICRJD-DOTOQJQBSA-N	0	3	318.465	2.303	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@@H](C)c1ccncc1OC	ZINC000187163742	402485983	/nfs/dbraw/zinc/48/59/83/402485983.db2.gz	ONCRASLXUBMDLI-KBPBESRZSA-N	0	3	320.437	2.277	10	0		DEAEHN
COCc1nc2n(n1)CCC[C@H]2N[C@H](C)C1CCSCC1	ZINC000187306204	402493034	/nfs/dbraw/zinc/49/30/34/402493034.db2.gz	QMESQFSFTPIYCX-DGCLKSJQSA-N	0	3	310.467	2.381	10	0		DEAEHN
COCc1nc2n(n1)CCC[C@@H]2N[C@@H](C)C1CCSCC1	ZINC000187306219	402493044	/nfs/dbraw/zinc/49/30/44/402493044.db2.gz	QMESQFSFTPIYCX-AAEUAGOBSA-N	0	3	310.467	2.381	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)Cc2ccccc2)[C@@H](C)C1	ZINC000246041744	402505201	/nfs/dbraw/zinc/50/52/01/402505201.db2.gz	BFUKFUDAVWVSLD-GOEBONIOSA-N	0	3	310.463	2.179	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000246056572	402506193	/nfs/dbraw/zinc/50/61/93/402506193.db2.gz	CXOAJCRHIUUIBQ-KGLIPLIRSA-N	0	3	312.410	2.073	10	0		DEAEHN
COC[C@@H](C)CN[C@H](CCSC)c1nnc2ccccn21	ZINC000187629189	402506413	/nfs/dbraw/zinc/50/64/13/402506413.db2.gz	JPKCBJMXZWJZRZ-QWHCGFSZSA-N	0	3	308.451	2.396	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccncc1Br	ZINC000246084917	402508630	/nfs/dbraw/zinc/50/86/30/402508630.db2.gz	UIUDJGLLJKKMGX-QWRGUYRKSA-N	0	3	324.222	2.153	10	0		DEAEHN
Fc1ccc(-c2noc(CN3CCN4CCC[C@@H]4C3)n2)cc1F	ZINC000178530873	402508836	/nfs/dbraw/zinc/50/88/36/402508836.db2.gz	MBCDFHOIEYTQQI-GFCCVEGCSA-N	0	3	320.343	2.295	10	0		DEAEHN
COc1c(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)c(C)nn1C	ZINC000246091310	402509080	/nfs/dbraw/zinc/50/90/80/402509080.db2.gz	IPBXHHZBYLBSBH-YOEHRIQHSA-N	0	3	318.465	2.186	10	0		DEAEHN
C[C@H](CNC(=O)OC(C)(C)C)N(C)C[C@@H](O)COC(C)(C)C	ZINC000246849836	402547329	/nfs/dbraw/zinc/54/73/29/402547329.db2.gz	PBPSRHOFWXCKJH-CHWSQXEVSA-N	0	3	318.458	2.007	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)CC1CCCC1	ZINC000246999575	402552971	/nfs/dbraw/zinc/55/29/71/402552971.db2.gz	KPCWIJLDGLLXOH-CABCVRRESA-N	0	3	300.468	2.065	10	0		DEAEHN
CN(C)C1(CN(C)C(=O)N[C@H]2COc3ccccc32)CCC1	ZINC000189752071	402556860	/nfs/dbraw/zinc/55/68/60/402556860.db2.gz	JDYYWDMKJFMTIB-AWEZNQCLSA-N	0	3	303.406	2.246	10	0		DEAEHN
COc1ccc(OC)c(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000247227154	402560970	/nfs/dbraw/zinc/56/09/70/402560970.db2.gz	MNLQKGUHHIFNOB-OLZOCXBDSA-N	0	3	304.390	2.013	10	0		DEAEHN
Cc1cc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)n(C)n1	ZINC000179011742	402564411	/nfs/dbraw/zinc/56/44/11/402564411.db2.gz	GBCLOIWTHJKUTN-GDBMZVCRSA-N	0	3	313.405	2.295	10	0		DEAEHN
COc1ccccc1/C(C)=C/C(=O)N1CCN2CCC[C@@H]2C1	ZINC000171192545	402565062	/nfs/dbraw/zinc/56/50/62/402565062.db2.gz	PAESVMQMIJHZSI-OKFGHLOFSA-N	0	3	300.402	2.405	10	0		DEAEHN
CCOc1ncc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1Cl	ZINC000247411569	402566104	/nfs/dbraw/zinc/56/61/04/402566104.db2.gz	QDRPFFRPPULLGQ-YPMHNXCESA-N	0	3	323.824	2.442	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(-n2cccn2)cc1	ZINC000247499524	402569272	/nfs/dbraw/zinc/56/92/72/402569272.db2.gz	UXUUWTXLKPGNII-PBHICJAKSA-N	0	3	310.401	2.181	10	0		DEAEHN
C[C@@H](C(=O)N1CCO[C@@H](c2nccs2)C1)N1[C@H](C)CC[C@@H]1C	ZINC000247493917	402569627	/nfs/dbraw/zinc/56/96/27/402569627.db2.gz	MGIFJCTVNMEKDW-RFQIPJPRSA-N	0	3	323.462	2.304	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@@H]2Oc3ccccc3O[C@@H]2C)C1	ZINC000247505756	402570095	/nfs/dbraw/zinc/57/00/95/402570095.db2.gz	XXSYIQKVISYEIP-VWPFQQQWSA-N	0	3	318.417	2.060	10	0		DEAEHN
CN(C[C@@H](O)COc1ccc(C(C)(C)C)cc1)CC1(CO)CC1	ZINC000190041430	402572647	/nfs/dbraw/zinc/57/26/47/402572647.db2.gz	PKGYLGLQKHIMMQ-MRXNPFEDSA-N	0	3	321.461	2.428	10	0		DEAEHN
CC(C)(C)c1nc(CC(=O)N2CCN3CCC[C@H]3C2)cs1	ZINC000171268684	402573193	/nfs/dbraw/zinc/57/31/93/402573193.db2.gz	BRHNOALDEUMYJM-ZDUSSCGKSA-N	0	3	307.463	2.290	10	0		DEAEHN
Cc1ccccc1OCCNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000246196415	402518090	/nfs/dbraw/zinc/51/80/90/402518090.db2.gz	MTNAXBYKSPAJII-JKSUJKDBSA-N	0	3	319.449	2.498	10	0		DEAEHN
Cc1ccc(NC(=O)[C@H](C)N2CCN3CCC[C@@H]3C2)cc1F	ZINC000178620237	402518521	/nfs/dbraw/zinc/51/85/21/402518521.db2.gz	ADERNTFZOXHYQI-DZGCQCFKSA-N	0	3	305.397	2.241	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)[C@H](C)N1CCN2CCC[C@@H]2C1	ZINC000178628076	402519602	/nfs/dbraw/zinc/51/96/02/402519602.db2.gz	QSLRBYXBYYLVJM-FUHWJXTLSA-N	0	3	315.461	2.204	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](N[C@@H](C(=O)N(C)C)c2ccccc2)C1	ZINC000246264517	402521954	/nfs/dbraw/zinc/52/19/54/402521954.db2.gz	RJFAEWQZLQIZMM-DJIMGWMZSA-N	0	3	303.450	2.134	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1cc(OC)c(OC)cc1OC)N(C)C	ZINC000178655906	402522381	/nfs/dbraw/zinc/52/23/81/402522381.db2.gz	KJHGOMQFUVTHIW-ZDUSSCGKSA-N	0	3	324.421	2.059	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCC2(c3ccc(F)cc3)CC2)C1	ZINC000170831128	402530357	/nfs/dbraw/zinc/53/03/57/402530357.db2.gz	YXNYYXRDEKMGJP-OAHLLOKOSA-N	0	3	305.397	2.203	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000170833401	402530695	/nfs/dbraw/zinc/53/06/95/402530695.db2.gz	BONXARGSDADHKJ-QGZVFWFLSA-N	0	3	316.449	2.001	10	0		DEAEHN
CCc1cccc(S(=O)(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000246447966	402531171	/nfs/dbraw/zinc/53/11/71/402531171.db2.gz	ILAQVSZTONKYFI-CJNGLKHVSA-N	0	3	310.463	2.256	10	0		DEAEHN
Cc1csc(CCCCNC(=O)N2CC[C@H](N(C)C)C2)n1	ZINC000170836882	402531705	/nfs/dbraw/zinc/53/17/05/402531705.db2.gz	JVKPFQFMRSDVEE-ZDUSSCGKSA-N	0	3	310.467	2.120	10	0		DEAEHN
COCCn1cc(C(=O)N2CC[C@H](N(C)C)C2)c2ccccc21	ZINC000170855253	402533087	/nfs/dbraw/zinc/53/30/87/402533087.db2.gz	QYERWXKZCDEHHP-AWEZNQCLSA-N	0	3	315.417	2.064	10	0		DEAEHN
C[C@@H](C(=O)NCc1ccc(CO)c(F)c1)N1[C@H](C)CC[C@@H]1C	ZINC000170855500	402533366	/nfs/dbraw/zinc/53/33/66/402533366.db2.gz	CYBIAEOMFNURLX-XQQFMLRXSA-N	0	3	308.397	2.196	10	0		DEAEHN
Cc1cnn(CCC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c1	ZINC000248062440	402581389	/nfs/dbraw/zinc/58/13/89/402581389.db2.gz	PFXFXOWFZRSZGE-WMZOPIPTSA-N	0	3	312.417	2.143	10	0		DEAEHN
CC[C@@H]1CN(Cc2cccc(COC)c2)CCN1C[C@@H](C)O	ZINC000179212751	402581636	/nfs/dbraw/zinc/58/16/36/402581636.db2.gz	SBBYKQPMIFSNBE-CRAIPNDOSA-N	0	3	306.450	2.110	10	0		DEAEHN
COC(=O)c1cc(C)ccc1NC(=O)N1CCN2CCC[C@H]2C1	ZINC000179215226	402581696	/nfs/dbraw/zinc/58/16/96/402581696.db2.gz	RVRZPBGCANRVDJ-ZDUSSCGKSA-N	0	3	317.389	2.094	10	0		DEAEHN
CC(C)Cn1ncc(C(=O)N2CCN3CCC[C@@H]3C2)c1C1CC1	ZINC000179332097	402585227	/nfs/dbraw/zinc/58/52/27/402585227.db2.gz	KOQFPYSSLQHAKC-OAHLLOKOSA-N	0	3	316.449	2.337	10	0		DEAEHN
CC[C@H](C)c1ccc(S(=O)(=O)N[C@H]2CNCC[C@H]2C)cc1	ZINC000249360084	402626910	/nfs/dbraw/zinc/62/69/10/402626910.db2.gz	AFOPAZWEKMJYQP-ZENOOKHLSA-N	0	3	310.463	2.476	10	0		DEAEHN
c1nc(N2CCCCC2)cc(N2CCCN(C3CC3)CC2)n1	ZINC000171831493	402626968	/nfs/dbraw/zinc/62/69/68/402626968.db2.gz	LCINXVPPDYXRIU-UHFFFAOYSA-N	0	3	301.438	2.141	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)C2(c3ccccc3)CCOCC2)C1	ZINC000171554037	402594126	/nfs/dbraw/zinc/59/41/26/402594126.db2.gz	UMWMAEOELGZHDI-KRWDZBQOSA-N	0	3	316.445	2.335	10	0		DEAEHN
CN(C)CCN(Cc1cccc(F)c1)C(=O)N[C@@H]1CCCOC1	ZINC000171613302	402601281	/nfs/dbraw/zinc/60/12/81/402601281.db2.gz	BVCREKNDFWFDES-MRXNPFEDSA-N	0	3	323.412	2.078	10	0		DEAEHN
CCCCOCC(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190632294	402614759	/nfs/dbraw/zinc/61/47/59/402614759.db2.gz	WDKGULIXRKUACJ-QGZVFWFLSA-N	0	3	319.449	2.179	10	0		DEAEHN
C[C@H](CC(=O)Nc1cccc(F)c1)NCC1(C)OCCCO1	ZINC000190650788	402616087	/nfs/dbraw/zinc/61/60/87/402616087.db2.gz	XEMCSFNJEVMHBM-GFCCVEGCSA-N	0	3	310.369	2.286	10	0		DEAEHN
CCC(CC)n1nc(C)cc1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000180472383	402617473	/nfs/dbraw/zinc/61/74/73/402617473.db2.gz	ZTQAOJHLDUYRCD-OAHLLOKOSA-N	0	3	304.438	2.473	10	0		DEAEHN
CCc1ccccc1S(=O)(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000249466931	402630244	/nfs/dbraw/zinc/63/02/44/402630244.db2.gz	QRBJFOOLPJEWEM-HIFRSBDPSA-N	0	3	308.447	2.106	10	0		DEAEHN
Cc1csc2nc(CN(C)[C@]3(CO)CC[C@@H](C)C3)cc(=O)n12	ZINC000249555824	402634854	/nfs/dbraw/zinc/63/48/54/402634854.db2.gz	JRMJLTSUFSGYTE-BDJLRTHQSA-N	0	3	321.446	2.047	10	0		DEAEHN
CC(C)N1CCC[C@H](N2C[C@@H](c3ccsc3)[C@H](CO)C2)C1=O	ZINC000249551255	402634422	/nfs/dbraw/zinc/63/44/22/402634422.db2.gz	HZRVZDXQGQIIRA-JYJNAYRXSA-N	0	3	322.474	2.155	10	0		DEAEHN
COC(=O)[C@@H](C)CN(C)C[C@H](O)COc1ccccc1C(C)C	ZINC000249711172	402639124	/nfs/dbraw/zinc/63/91/24/402639124.db2.gz	DWKFBRUARHGLHU-GJZGRUSLSA-N	0	3	323.433	2.291	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(Br)nc1	ZINC000252589794	402658887	/nfs/dbraw/zinc/65/88/87/402658887.db2.gz	CELSSEOHXBFGIR-JQWIXIFHSA-N	0	3	324.222	2.153	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc1C	ZINC000173883208	402716848	/nfs/dbraw/zinc/71/68/48/402716848.db2.gz	ARTBBOCNLZBALN-HOCLYGCPSA-N	0	3	310.463	2.310	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@H](C)[C@@H]1CCCO1	ZINC000252733963	402660505	/nfs/dbraw/zinc/66/05/05/402660505.db2.gz	XPVSIBIWWVCYEY-INMHGKMJSA-N	0	3	319.449	2.374	10	0		DEAEHN
CCOC(=O)[C@@H](c1ccccc1)N1CCCN(C2CC2)CC1	ZINC000172540674	402661824	/nfs/dbraw/zinc/66/18/24/402661824.db2.gz	HJUOPRVBQMRFMG-QGZVFWFLSA-N	0	3	302.418	2.461	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1nc2cccnc2s1	ZINC000253355363	402662561	/nfs/dbraw/zinc/66/25/61/402662561.db2.gz	AQXOCBKOCQDECB-RYUDHWBXSA-N	0	3	316.430	2.390	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)N2CCCC[C@@H]2c2cn[nH]c2)C1	ZINC000182335063	402681667	/nfs/dbraw/zinc/68/16/67/402681667.db2.gz	MRBVBYLVGCDDQC-GDBMZVCRSA-N	0	3	319.453	2.378	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1N[C@@H]1CCCN(c2ccccc2F)C1=O	ZINC000191691952	402686566	/nfs/dbraw/zinc/68/65/66/402686566.db2.gz	DZHKDXXZUXURLW-VHDGCEQUSA-N	0	3	306.381	2.336	10	0		DEAEHN
CN(C[C@@H]1CCCN(C)C1)C(=O)c1snnc1C(C)(C)C	ZINC000191956507	402700964	/nfs/dbraw/zinc/70/09/64/402700964.db2.gz	VJBMQUCAIXKUGB-LLVKDONJSA-N	0	3	310.467	2.249	10	0		DEAEHN
C[C@@H](NCc1ccc(S(=O)(=O)C(F)F)cc1)[C@H]1CCCO1	ZINC000183125214	402741417	/nfs/dbraw/zinc/74/14/17/402741417.db2.gz	WSTRGUIDVPONDK-ZWNOBZJWSA-N	0	3	319.373	2.340	10	0		DEAEHN
COc1ccc(NC(=O)[C@H](C)N[C@H](C)[C@H]2CCCO2)c(OC)c1	ZINC000183134358	402741916	/nfs/dbraw/zinc/74/19/16/402741916.db2.gz	LTOUPDPTJYLVFW-TYNCELHUSA-N	0	3	322.405	2.188	10	0		DEAEHN
Cc1cccnc1C(F)(F)C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000192708365	402745518	/nfs/dbraw/zinc/74/55/18/402745518.db2.gz	BAAJXEIQSKBSHH-QWHCGFSZSA-N	0	3	311.376	2.327	10	0		DEAEHN
C[C@@H](Cc1nc([C@H]2CNCCN2C)no1)c1cccc(F)c1	ZINC000263174522	402746528	/nfs/dbraw/zinc/74/65/28/402746528.db2.gz	GBQZGMCXKSRGAW-SMDDNHRTSA-N	0	3	304.369	2.131	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cc(C)oc1C	ZINC000183250768	402750318	/nfs/dbraw/zinc/75/03/18/402750318.db2.gz	GJEXGOOFYCHSHW-ZIAGYGMSSA-N	0	3	312.435	2.144	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(C2C3CC4CC(C3)CC2C4)n1	ZINC000263282470	402753922	/nfs/dbraw/zinc/75/39/22/402753922.db2.gz	UNNVUIDPXIFZRF-BPHCLYMKSA-N	0	3	302.422	2.185	10	0		DEAEHN
CCc1cnc(CCNC(=O)NC[C@H](C)N(C)C2CC2)s1	ZINC000174734444	402754630	/nfs/dbraw/zinc/75/46/30/402754630.db2.gz	IVUUYJVEZSWHQW-NSHDSACASA-N	0	3	310.467	2.030	10	0		DEAEHN
C[C@H](COCc1ccccc1)NC(=O)NC[C@H]1CCCN(C)C1	ZINC000174805791	402758699	/nfs/dbraw/zinc/75/86/99/402758699.db2.gz	MRBNXBIBSLTMBW-NVXWUHKLSA-N	0	3	319.449	2.233	10	0		DEAEHN
O=C(NCCCc1cccc(F)c1)N1CC[C@H](N2CC=CC2)C1	ZINC000174818905	402758906	/nfs/dbraw/zinc/75/89/06/402758906.db2.gz	INHQGYAZKNPCBW-KRWDZBQOSA-N	0	3	317.408	2.414	10	0		DEAEHN
C[C@@H](NC(=O)N(CCN(C)C)C[C@H]1CCCO1)C1CCCC1	ZINC000174921939	402762975	/nfs/dbraw/zinc/76/29/75/402762975.db2.gz	NSTJDBOLXURPHC-GDBMZVCRSA-N	0	3	311.470	2.317	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(OC)ccc1OC	ZINC000175032717	402773256	/nfs/dbraw/zinc/77/32/56/402773256.db2.gz	HZVYPYZVDJMFKQ-ZIAGYGMSSA-N	0	3	318.417	2.403	10	0		DEAEHN
CCOc1ccc2cc(C(=O)N3CCN4CCC[C@@H]4C3)[nH]c2c1	ZINC000195335031	402841973	/nfs/dbraw/zinc/84/19/73/402841973.db2.gz	USULPPQIERSTQA-CQSZACIVSA-N	0	3	313.401	2.487	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cccc(C(=O)OC)c2)C1	ZINC000194310866	402791535	/nfs/dbraw/zinc/79/15/35/402791535.db2.gz	NQWUEUCAYAYVSQ-CQSZACIVSA-N	0	3	305.378	2.079	10	0		DEAEHN
CC[C@@H]1CN(CCC(=O)NC(C)C)CCN1Cc1ccccc1	ZINC000183747972	402793883	/nfs/dbraw/zinc/79/38/83/402793883.db2.gz	MWZLLGKVSOJDIQ-GOSISDBHSA-N	0	3	317.477	2.498	10	0		DEAEHN
CCN1CCC[C@H](N[C@@H](C)c2cnc3cc(C)nn3c2C)C1	ZINC000194378968	402794676	/nfs/dbraw/zinc/79/46/76/402794676.db2.gz	PULRBHDLZPJKTQ-ZFWWWQNUSA-N	0	3	301.438	2.481	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)N1c2ccccc2C[C@@H]1C	ZINC000175341386	402798374	/nfs/dbraw/zinc/79/83/74/402798374.db2.gz	VYGNXUJXTFPUJP-DOTOQJQBSA-N	0	3	315.461	2.380	10	0		DEAEHN
CC[C@@H](Oc1ccccc1F)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000175455493	402807700	/nfs/dbraw/zinc/80/77/00/402807700.db2.gz	LKIPEYXRITYHDH-UKRRQHHQSA-N	0	3	306.381	2.290	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Cc2ccc(-n3cccn3)cc2)C1	ZINC000194660622	402808822	/nfs/dbraw/zinc/80/88/22/402808822.db2.gz	CSDOGRUKLHZPPL-MRXNPFEDSA-N	0	3	312.417	2.015	10	0		DEAEHN
COCc1ccccc1CNC(=O)N1CCCN(C2CC2)CC1	ZINC000194659804	402808837	/nfs/dbraw/zinc/80/88/37/402808837.db2.gz	RNUWWVZOLKXJCM-UHFFFAOYSA-N	0	3	317.433	2.213	10	0		DEAEHN
C[C@H]1CN(CCOc2cccc(Cl)c2)C[C@@H]1N1CCOCC1	ZINC000175587620	402819505	/nfs/dbraw/zinc/81/95/05/402819505.db2.gz	MCXNOXXKJRFKSP-YOEHRIQHSA-N	0	3	324.852	2.371	10	0		DEAEHN
C[C@H](O)C[C@@H]1CCCN1Cc1ccc2c(c1)sc(=O)n2C	ZINC000195024947	402827661	/nfs/dbraw/zinc/82/76/61/402827661.db2.gz	IQUUBMDWZPDYML-AAEUAGOBSA-N	0	3	306.431	2.335	10	0		DEAEHN
CN(CCOCC1CC1)Cc1ccc2c(c1)sc(=O)n2C	ZINC000195037951	402827965	/nfs/dbraw/zinc/82/79/65/402827965.db2.gz	AUVDHPWNKGMTDK-UHFFFAOYSA-N	0	3	306.431	2.458	10	0		DEAEHN
CN(C)C[C@H](NC(=O)CCc1cscn1)c1ccccc1	ZINC000195242852	402838767	/nfs/dbraw/zinc/83/87/67/402838767.db2.gz	PHAOKQHSAKNRPA-HNNXBMFYSA-N	0	3	303.431	2.495	10	0		DEAEHN
COCCCN(C)CCNC(=O)Nc1cccc([C@H](C)OC)c1	ZINC000175957171	402844813	/nfs/dbraw/zinc/84/48/13/402844813.db2.gz	JVNMZAVDVXKTLE-AWEZNQCLSA-N	0	3	323.437	2.484	10	0		DEAEHN
Cc1nc(C[C@@H]2CCCN(C[C@H](O)c3ccccc3)C2)no1	ZINC000195518028	402849541	/nfs/dbraw/zinc/84/95/41/402849541.db2.gz	LBBZJJGHHZJKPL-HOCLYGCPSA-N	0	3	301.390	2.366	10	0		DEAEHN
CO[C@H]1C[C@@H](CN(C)Cc2cc(-c3ccccc3)on2)N(C)C1	ZINC000286036970	403435721	/nfs/dbraw/zinc/43/57/21/403435721.db2.gz	IDKBRRDPQUCPHZ-IRXDYDNUSA-N	0	3	315.417	2.493	10	0		DEAEHN
CCn1cc(CCN2C[C@@H](O)C[C@H]2c2cccc(OC)c2)cn1	ZINC000286213580	403474478	/nfs/dbraw/zinc/47/44/78/403474478.db2.gz	QPWPLLSIJUXERO-WMZOPIPTSA-N	0	3	315.417	2.262	10	0		DEAEHN
CCn1cc(CCN2C[C@H](O)C[C@@H]2c2cccc(F)c2)cn1	ZINC000286380632	403513196	/nfs/dbraw/zinc/51/31/96/403513196.db2.gz	ZBZCBGAZMGWCCM-IAGOWNOFSA-N	0	3	303.381	2.393	10	0		DEAEHN
c1nc2nc(-c3ccccc3)cc(N3CCN4CCC3CC4)n2n1	ZINC000302757806	403721879	/nfs/dbraw/zinc/72/18/79/403721879.db2.gz	JBCWLELTVRCDPF-UHFFFAOYSA-N	0	3	320.400	2.076	10	0		DEAEHN
c1cn(C[C@H]2CCCN(Cc3ccc(-c4cc[nH]n4)o3)C2)nn1	ZINC000369476120	404109333	/nfs/dbraw/zinc/10/93/33/404109333.db2.gz	IKBFFCQMWHMNQW-ZDUSSCGKSA-N	0	3	312.377	2.173	10	0		DEAEHN
CO[C@@H]1COC[C@H]1n1cc(CN[C@@H]2C[C@@H](C)CC(C)(C)C2)nn1	ZINC000329544929	404371664	/nfs/dbraw/zinc/37/16/64/404371664.db2.gz	ZCJLXCQDRRSIEJ-RRCSTGOVSA-N	0	3	322.453	2.169	10	0		DEAEHN
c1cc(CN[C@@H]2CCO[C@@]3(CCOC3)C2)c2c(c1)OCCCO2	ZINC000356293992	404428967	/nfs/dbraw/zinc/42/89/67/404428967.db2.gz	XZXZNKNXAMCRER-QAPCUYQASA-N	0	3	319.401	2.276	10	0		DEAEHN
CN(C)c1nccc(CNCCc2ccc3ccccc3n2)n1	ZINC000361026758	404883910	/nfs/dbraw/zinc/88/39/10/404883910.db2.gz	JSHPTDOREKRRAN-UHFFFAOYSA-N	0	3	307.401	2.423	10	0		DEAEHN
Nc1ccc(C(=O)N[C@@H]2[C@H]3CN(Cc4ccccc4)C[C@H]32)cc1	ZINC000378573062	405003426	/nfs/dbraw/zinc/00/34/26/405003426.db2.gz	YNYXPLIKTFVCMO-PIIMJCKOSA-N	0	3	307.397	2.129	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)c2ncccc2N)CCN1Cc1ccccc1	ZINC000379661926	405028677	/nfs/dbraw/zinc/02/86/77/405028677.db2.gz	GTWMMXJMZUKTCP-ZBFHGGJFSA-N	0	3	324.428	2.447	10	0		DEAEHN
CCN1CC[C@H](NC(=O)c2ccc(F)cc2Br)C1	ZINC000389991147	405043356	/nfs/dbraw/zinc/04/33/56/405043356.db2.gz	NIVQXKYBGKTIFC-JTQLQIEISA-N	0	3	315.186	2.412	10	0		DEAEHN
CC(C)C(=O)N[C@@H]1CCCN(C(=O)[C@H](C)N2[C@H](C)CC[C@H]2C)C1	ZINC000407978998	405082682	/nfs/dbraw/zinc/08/26/82/405082682.db2.gz	MTDQUMQSFXNXNU-LVQVYYBASA-N	0	3	323.481	2.011	10	0		DEAEHN
CCS(=O)(=O)C[C@H](C)N[C@@H]1CCOC2(CCCCC2)C1	ZINC000408102874	405112742	/nfs/dbraw/zinc/11/27/42/405112742.db2.gz	DOHOZMIXKYMFNI-UONOGXRCSA-N	0	3	303.468	2.281	10	0		DEAEHN
Cc1cccc2c1ncc(C)c2N[C@@H]1CCCS(=O)(=O)C1	ZINC000408239172	405149008	/nfs/dbraw/zinc/14/90/08/405149008.db2.gz	VXLXCHLUCHITDU-CYBMUJFWSA-N	0	3	304.415	2.263	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)CCCN1CCC[C@@H](O)[C@H]1C	ZINC000568408738	292339115	/nfs/dbraw/zinc/33/91/15/292339115.db2.gz	XDNHUVUJQZXIJR-CXAGYDPISA-N	0	3	318.417	2.453	10	0		DEAEHN
CC[C@H](C(=O)N1CCCC[C@@H]1c1nnc2n1CCCC2)N(C)C	ZINC000408472464	405216043	/nfs/dbraw/zinc/21/60/43/405216043.db2.gz	VJCXIVHJJCIYNO-ZIAGYGMSSA-N	0	3	319.453	2.008	10	0		DEAEHN
Cc1ccc(-c2ocnc2C(=O)NCCNc2ccncc2)cc1	ZINC000439037552	405263349	/nfs/dbraw/zinc/26/33/49/405263349.db2.gz	FVJGWFCDTOUJMQ-UHFFFAOYSA-N	0	3	322.368	2.309	10	0		DEAEHN
COC[C@@H](NC(=O)NCC1(N(C)C)CCC1)c1ccc(F)cc1	ZINC000445863104	405359666	/nfs/dbraw/zinc/35/96/66/405359666.db2.gz	KPUGGAJQJWJWLK-OAHLLOKOSA-N	0	3	323.412	2.297	10	0		DEAEHN
c1ccc(CN2CCCO[C@H](CN3CC[C@]34CCOC4)C2)cc1	ZINC000421016992	405430607	/nfs/dbraw/zinc/43/06/07/405430607.db2.gz	JPVFPBBLGWESEE-RBUKOAKNSA-N	0	3	316.445	2.142	10	0		DEAEHN
CC(C)N1CC[C@H](N(C)C(=O)NCc2ccc3cc[nH]c3n2)C1	ZINC000458777617	405585657	/nfs/dbraw/zinc/58/56/57/405585657.db2.gz	AONMZHGSFPQRIN-HNNXBMFYSA-N	0	3	315.421	2.187	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N[C@@H]2C[C@H]([NH+](C)C)C2(C)C)cc1[O-]	ZINC000636090499	405731315	/nfs/dbraw/zinc/73/13/15/405731315.db2.gz	GOABVOMIKMLJHF-CABCVRRESA-N	0	3	304.390	2.053	10	0		DEAEHN
CN1CCC(CC(=O)N2CC[C@@](C)(C(=O)OC(C)(C)C)C2)CC1	ZINC000457241059	405765031	/nfs/dbraw/zinc/76/50/31/405765031.db2.gz	SAEYUGXTFNBWRF-GOSISDBHSA-N	0	3	324.465	2.299	10	0		DEAEHN
CCN1CCC(N(C)C(=O)c2cc(C)cc(C(=O)OC)c2)CC1	ZINC000457519046	405879011	/nfs/dbraw/zinc/87/90/11/405879011.db2.gz	KFHGDQUATPERKC-UHFFFAOYSA-N	0	3	318.417	2.338	10	0		DEAEHN
Cc1nc2scc(C3CC3)n2c1CNC[C@@H]1CN(C)CCO1	ZINC000459422025	405896827	/nfs/dbraw/zinc/89/68/27/405896827.db2.gz	FLDVRJQRTVZNIE-CYBMUJFWSA-N	0	3	320.462	2.002	10	0		DEAEHN
C[C@@H]1C[C@@H]1c1ccc(CNC(=O)NCCNc2ccncc2)o1	ZINC000560752820	405867191	/nfs/dbraw/zinc/86/71/91/405867191.db2.gz	PVLSWUAFRSYZSL-DOMZBBRYSA-N	0	3	314.389	2.131	10	0		DEAEHN
CC(C)(C)OC(=O)[C@]1(C)CCN(C[C@@H](O)CC(F)(F)F)C1	ZINC000459565790	405959310	/nfs/dbraw/zinc/95/93/10/405959310.db2.gz	SJGWGFRKKWIRQW-GXFFZTMASA-N	0	3	311.344	2.353	10	0		DEAEHN
c1nncn1CC1CCN(Cc2ccc3nccnc3c2)CC1	ZINC000639292254	406026178	/nfs/dbraw/zinc/02/61/78/406026178.db2.gz	CAUQZEYAJDFKLT-UHFFFAOYSA-N	0	3	308.389	2.134	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N[C@@H]2CCCN(C(C)C)C2)c1	ZINC000457729214	405974649	/nfs/dbraw/zinc/97/46/49/405974649.db2.gz	HLNWFKNIWHUFEO-MRXNPFEDSA-N	0	3	318.417	2.384	10	0		DEAEHN
COc1ccc(OC)c(CNC[C@H](CO)Cc2ccco2)c1	ZINC000532675237	406092956	/nfs/dbraw/zinc/09/29/56/406092956.db2.gz	CFTYVMCJLJFIPQ-CYBMUJFWSA-N	0	3	305.374	2.238	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@H](COC)Cc1ccccc1	ZINC000471696711	406110026	/nfs/dbraw/zinc/11/00/26/406110026.db2.gz	JJLYFOCVPICICW-DLBZAZTESA-N	0	3	304.434	2.235	10	0		DEAEHN
CC(=O)N1CCN(Cc2cc[nH]c(=O)c2)CC12CCCCC2	ZINC000639556598	406145935	/nfs/dbraw/zinc/14/59/35/406145935.db2.gz	OZYHCBYURSLQRG-UHFFFAOYSA-N	0	3	303.406	2.154	10	0		DEAEHN
O=C(CN1C[C@@H]2CCCC[C@H]2C1)NC[C@H]1Cc2ccccc2O1	ZINC000476589713	406150849	/nfs/dbraw/zinc/15/08/49/406150849.db2.gz	WDLNTTAHXNHHGI-YESZJQIVSA-N	0	3	314.429	2.228	10	0		DEAEHN
C[C@H]1C[C@H](CCNCc2c(Br)cnn2C)CCO1	ZINC000487567794	406247763	/nfs/dbraw/zinc/24/77/63/406247763.db2.gz	BFZBDXKKLWYRFI-WDEREUQCSA-N	0	3	316.243	2.477	10	0		DEAEHN
CC=CC[C@@H]1NC(=O)N([C@H]2CCN(Cc3ccccc3)C2)C1=O	ZINC000521528085	406351599	/nfs/dbraw/zinc/35/15/99/406351599.db2.gz	ULVGYIGQEBKHGI-SUSYHVFKSA-N	0	3	313.401	2.148	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCc1nc(C)c2ccccc2n1	ZINC000522545821	406407016	/nfs/dbraw/zinc/40/70/16/406407016.db2.gz	JYRBVFQRUDFWOE-INIZCTEOSA-N	0	3	312.417	2.429	10	0		DEAEHN
C[C@H]1CCCN(C(=O)[C@@H](N)CN(C)Cc2ccccc2)CC1	ZINC000637957178	406495237	/nfs/dbraw/zinc/49/52/37/406495237.db2.gz	DKPDPDWLZIXCNE-RDJZCZTQSA-N	0	3	303.450	2.094	10	0		DEAEHN
C[C@@H]1CCC[C@@H](C)N1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637871475	406455380	/nfs/dbraw/zinc/45/53/80/406455380.db2.gz	QSBZWMGNDPZTEA-INMHGKMJSA-N	0	3	303.450	2.235	10	0		DEAEHN
CC(C)CC[C@@H](C)NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637873532	406456744	/nfs/dbraw/zinc/45/67/44/406456744.db2.gz	PCMHLDDPPSNJNF-NVXWUHKLSA-N	0	3	305.466	2.387	10	0		DEAEHN
C[C@H](NC(=O)[C@H](N)CN(C)Cc1ccccc1)c1cccs1	ZINC000637885237	406461886	/nfs/dbraw/zinc/46/18/86/406461886.db2.gz	JKNUQQNQYBRZGP-DZGCQCFKSA-N	0	3	317.458	2.385	10	0		DEAEHN
CC(C)CC1(CNC(=O)[C@H](N)CN(C)Cc2ccccc2)CC1	ZINC000638044858	406541019	/nfs/dbraw/zinc/54/10/19/406541019.db2.gz	NKPCLYJVJLALIO-QGZVFWFLSA-N	0	3	317.477	2.388	10	0		DEAEHN
CC[C@@H]1CC[C@H](C)N1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638313477	406693626	/nfs/dbraw/zinc/69/36/26/406693626.db2.gz	XAMDBVYSNYQFMP-USXIJHARSA-N	0	3	303.450	2.235	10	0		DEAEHN
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CSC2(C)C)cc1	ZINC000572596135	406699826	/nfs/dbraw/zinc/69/98/26/406699826.db2.gz	JTOJBRFROKKOMF-ZFWWWQNUSA-N	0	3	309.431	2.113	10	0		DEAEHN
COc1cccc(C(=O)N[C@@H](CC(C)C)CN(C)C)c1OC	ZINC000128898748	196001598	/nfs/dbraw/zinc/00/15/98/196001598.db2.gz	REXPNHWSSLMSRX-ZDUSSCGKSA-N	0	3	308.422	2.410	10	0		DEAEHN
CNc1nc(N(C)Cc2ccsc2)nc(N2CCCC2)n1	ZINC000129077860	196017457	/nfs/dbraw/zinc/01/74/57/196017457.db2.gz	OXPKIQMWMFFQHY-UHFFFAOYSA-N	0	3	304.423	2.211	10	0		DEAEHN
c1ccc2nc(CN3CC[C@H](CN4CCOCC4)C3)ccc2c1	ZINC000129607638	196061820	/nfs/dbraw/zinc/06/18/20/196061820.db2.gz	UBJJEXDKKGQFCV-MRXNPFEDSA-N	0	3	311.429	2.389	10	0		DEAEHN
C[C@@H](NC(=O)C(C)(C)N1CCNCC1)c1ccccc1Cl	ZINC000129697285	196068270	/nfs/dbraw/zinc/06/82/70/196068270.db2.gz	JNYLHBYZXBIBKI-GFCCVEGCSA-N	0	3	309.841	2.201	10	0		DEAEHN
CCC[C@H](NC(=O)C(C)(C)N1CCNCC1)c1cccs1	ZINC000129708348	196069305	/nfs/dbraw/zinc/06/93/05/196069305.db2.gz	SGAWYGMMOJZPLT-ZDUSSCGKSA-N	0	3	309.479	2.389	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)[C@H](N)c1cccs1)c1ccccc1	ZINC000130564826	196091415	/nfs/dbraw/zinc/09/14/15/196091415.db2.gz	UJEZUSXTBUCONO-UKRRQHHQSA-N	0	3	303.431	2.167	10	0		DEAEHN
CCN[C@@H](Cc1ncnn1CC)c1ccc(Br)cn1	ZINC000130886535	196120241	/nfs/dbraw/zinc/12/02/41/196120241.db2.gz	IENSVWCFYGWASW-LBPRGKRZSA-N	0	3	324.226	2.349	10	0		DEAEHN
CCCN(CCC)S(=O)(=O)Nc1cccc2c1CCNC2	ZINC000131031384	196133958	/nfs/dbraw/zinc/13/39/58/196133958.db2.gz	AERPNXDVSDXLAC-UHFFFAOYSA-N	0	3	311.451	2.111	10	0		DEAEHN
CCc1nn(CCCS(C)(=O)=O)c(CC)c1[C@@H](CC)NC	ZINC000131093747	196139593	/nfs/dbraw/zinc/13/95/93/196139593.db2.gz	KHKIDQZOQCGAKV-GFCCVEGCSA-N	0	3	315.483	2.113	10	0		DEAEHN
CSCC[C@H](C)NS(=O)(=O)c1cccc([C@@H](C)N)c1	ZINC000131233861	196152469	/nfs/dbraw/zinc/15/24/69/196152469.db2.gz	NDKKMWSMANDMEF-WDEREUQCSA-N	0	3	302.465	2.126	10	0		DEAEHN
COc1ccc2c(N)c(C(=O)NC[C@@H](C)N(C)C)sc2c1	ZINC000131248112	196152847	/nfs/dbraw/zinc/15/28/47/196152847.db2.gz	KMIRWHKBJZOZCX-SECBINFHSA-N	0	3	307.419	2.172	10	0		DEAEHN
CC[C@](O)(c1c(Br)cnn1CCN(C)C)C(C)C	ZINC000131450532	196169522	/nfs/dbraw/zinc/16/95/22/196169522.db2.gz	KOAAICCEAHYALD-CYBMUJFWSA-N	0	3	318.259	2.461	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2CC[C@H](C)[C@@H](C)C2)cs1	ZINC000131780160	196198422	/nfs/dbraw/zinc/19/84/22/196198422.db2.gz	WHQWTPZNNNRSCH-QWRGUYRKSA-N	0	3	302.465	2.134	10	0		DEAEHN
CNc1ncc(Br)c(NC[C@@H]2CCCN(C)C2)n1	ZINC000131952684	196213269	/nfs/dbraw/zinc/21/32/69/196213269.db2.gz	GHGFHWZIOBCDGJ-VIFPVBQESA-N	0	3	314.231	2.035	10	0		DEAEHN
NC1(C(=O)NCCc2ccc(Cl)cc2Cl)CCOCC1	ZINC000132066909	196222964	/nfs/dbraw/zinc/22/29/64/196222964.db2.gz	HHQQHSYXLNDUMN-UHFFFAOYSA-N	0	3	317.216	2.160	10	0		DEAEHN
C[C@@H]1CC[C@@](O)(c2c(Br)cnn2CCN(C)C)C1	ZINC000132360454	196249001	/nfs/dbraw/zinc/24/90/01/196249001.db2.gz	ZKBOTSOLAFIEMT-MFKMUULPSA-N	0	3	316.243	2.215	10	0		DEAEHN
CN(C[C@H]1CCCN1C)C(=O)c1sc2cccnc2c1N	ZINC000132317567	196245077	/nfs/dbraw/zinc/24/50/77/196245077.db2.gz	VGOAVNXQOHVGNT-SNVBAGLBSA-N	0	3	304.419	2.045	10	0		DEAEHN
C[C@H]1CNC[C@H](COCc2cc(F)cc(Br)c2)O1	ZINC000132629643	196271943	/nfs/dbraw/zinc/27/19/43/196271943.db2.gz	VXSWGZZTVHCZNO-TVQRCGJNSA-N	0	3	318.186	2.482	10	0		DEAEHN
CC(C)(C)OCCOc1ncc(Br)cc1CN	ZINC000133084115	196309775	/nfs/dbraw/zinc/30/97/75/196309775.db2.gz	MJHRPJBOKIOXGJ-UHFFFAOYSA-N	0	3	303.200	2.497	10	0		DEAEHN
COC(=O)c1sccc1NC(=O)Cc1ccccc1CN	ZINC000133298811	196328340	/nfs/dbraw/zinc/32/83/40/196328340.db2.gz	QOBBWQLSZKGRLG-UHFFFAOYSA-N	0	3	304.371	2.175	10	0		DEAEHN
CC(C)(CCc1ccccc1)NS(=O)(=O)[C@H]1CCCNC1	ZINC000133760515	196334763	/nfs/dbraw/zinc/33/47/63/196334763.db2.gz	ZJWHVKPNRSOKAB-HNNXBMFYSA-N	0	3	310.463	2.069	10	0		DEAEHN
NCc1ccc(Cl)c(S(=O)(=O)NCCC2CCC2)c1	ZINC000133959114	196349724	/nfs/dbraw/zinc/34/97/24/196349724.db2.gz	WCVZSQPMUGUUFI-UHFFFAOYSA-N	0	3	302.827	2.267	10	0		DEAEHN
COc1cc([C@@H](O)[C@H]([NH3+])C(C)C)cc(Br)c1[O-]	ZINC000134815948	196421318	/nfs/dbraw/zinc/42/13/18/196421318.db2.gz	YZOGWEWYEWMYGJ-GHMZBOCLSA-N	0	3	304.184	2.180	10	0		DEAEHN
CCCn1cc(S(=O)(=O)N2[C@@H](C)CC[C@@H]2CC)cc1CN	ZINC000136754137	196551189	/nfs/dbraw/zinc/55/11/89/196551189.db2.gz	IAWLQTGSCMMYQV-STQMWFEESA-N	0	3	313.467	2.308	10	0		DEAEHN
Cc1ccc(C(=O)NC[C@H](O)CN2CCCCC2)c(Cl)c1	ZINC000191859673	225117810	/nfs/dbraw/zinc/11/78/10/225117810.db2.gz	RYAPNFJFTGBKAC-ZDUSSCGKSA-N	0	3	310.825	2.225	10	0		DEAEHN
CCn1cncc1CNC1CCN(c2cc(C)nc(C)n2)CC1	ZINC000417970104	229165865	/nfs/dbraw/zinc/16/58/65/229165865.db2.gz	QHQSJESPGDDNAR-UHFFFAOYSA-N	0	3	314.437	2.068	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccc(N3CCC(C)=N3)cc2)C1	ZINC000194659432	424878051	/nfs/dbraw/zinc/87/80/51/424878051.db2.gz	VTDLPYNKAQMTFY-MRXNPFEDSA-N	0	3	314.433	2.487	10	0		DEAEHN
C[C@@H](CNC(=O)c1nscc1Br)N(C)C1CC1	ZINC000404875339	424929662	/nfs/dbraw/zinc/92/96/62/424929662.db2.gz	WHILBNYMFVRTSO-ZETCQYMHSA-N	0	3	318.240	2.118	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)c2nscc2Br)CCN1C	ZINC000404941996	424930923	/nfs/dbraw/zinc/93/09/23/424930923.db2.gz	MILOHDNXHOXTQR-HTQZYQBOSA-N	0	3	318.240	2.118	10	0		DEAEHN
CC[C@H](C)n1nc(NC(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1C	ZINC000408113242	424933414	/nfs/dbraw/zinc/93/34/14/424933414.db2.gz	UKMHVDGNEANNAF-NWANDNLSSA-N	0	3	319.453	2.863	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC2(C1)CN(Cc1ccccc1)C[C@@H]2N	ZINC000409434031	424934571	/nfs/dbraw/zinc/93/45/71/424934571.db2.gz	VDGCJDWEKTVRMG-HNNXBMFYSA-N	0	3	317.433	2.067	10	0		DEAEHN
c1ncn(-c2ccc(CNC[C@H]3COC4(CCCC4)O3)cc2)n1	ZINC000360059863	269047878	/nfs/dbraw/zinc/04/78/78/269047878.db2.gz	QSHAHSCJWGQPNJ-INIZCTEOSA-N	0	3	314.389	2.043	10	0		DEAEHN
CC(=O)c1cccc(CNC(=O)CCN(C)c2ccncc2)c1	ZINC000515498715	269351272	/nfs/dbraw/zinc/35/12/72/269351272.db2.gz	JAOYSTCXZOYTGM-UHFFFAOYSA-N	0	3	311.385	2.427	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)N1CCN(c2ccccc2)CC1	ZINC000262556696	275814879	/nfs/dbraw/zinc/81/48/79/275814879.db2.gz	UHSNTIAJXIUCCC-MRXNPFEDSA-N	0	3	301.434	2.113	10	0		DEAEHN
CC1(C)C[C@@H](NC(=O)C2(N)CCOCC2)c2ccc(F)cc2O1	ZINC000261673282	275856782	/nfs/dbraw/zinc/85/67/82/275856782.db2.gz	CBZPVKVDUXLMRA-CYBMUJFWSA-N	0	3	322.380	2.052	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc2c(s1)CCOC2	ZINC000176992385	276181633	/nfs/dbraw/zinc/18/16/33/276181633.db2.gz	VINIAASVDMIWKK-ZDUSSCGKSA-N	0	3	308.447	2.377	10	0		DEAEHN
CCN1CCCN(C(=O)N[C@H]2CCCC[C@H]2n2cccn2)CC1	ZINC000408379529	276367136	/nfs/dbraw/zinc/36/71/36/276367136.db2.gz	LPQAFSYUQQHDNG-JKSUJKDBSA-N	0	3	319.453	2.104	10	0		DEAEHN
CN1CCO[C@@H](CN[C@@H]2CCCOc3cc4c(cc32)CCC4)C1	ZINC000180501500	277119820	/nfs/dbraw/zinc/11/98/20/277119820.db2.gz	VBIXOPLPPBTYAT-FUHWJXTLSA-N	0	3	316.445	2.309	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC[C@H]1c1cnn(C)c1	ZINC000170896334	277435482	/nfs/dbraw/zinc/43/54/82/277435482.db2.gz	ZVTROSOTPRFTIW-HOTGVXAUSA-N	0	3	321.469	2.243	10	0		DEAEHN
CS[C@@H]1CCC[C@H](NC(=O)N2CC[C@@H](N3CC=CC3)C2)C1	ZINC000245591612	278144575	/nfs/dbraw/zinc/14/45/75/278144575.db2.gz	BCOJUQCAVQUJSD-RRFJBIMHSA-N	0	3	309.479	2.316	10	0		DEAEHN
Cc1c(CN[C@@H](CNC(=O)OC(C)(C)C)C2CC2)cnn1C	ZINC000162867518	280226857	/nfs/dbraw/zinc/22/68/57/280226857.db2.gz	AANCFGZDSANDSV-AWEZNQCLSA-N	0	3	308.426	2.121	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cnn(C(C)C)c1C	ZINC000180333911	281194069	/nfs/dbraw/zinc/19/40/69/281194069.db2.gz	YJFPZJOXXUBTQD-LSDHHAIUSA-N	0	3	304.438	2.471	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000246532657	281196646	/nfs/dbraw/zinc/19/66/46/281196646.db2.gz	IXMPLQNRYLZPJO-ALILYOIUSA-N	0	3	318.461	2.467	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cn(C)nc1C(C)(C)C	ZINC000092472524	288305081	/nfs/dbraw/zinc/30/50/81/288305081.db2.gz	BFKMRVNXJPJNGD-CHWSQXEVSA-N	0	3	304.438	2.026	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN([C@H](C)C(=O)NCC(C)C)C2)n1	ZINC000249891750	281246958	/nfs/dbraw/zinc/24/69/58/281246958.db2.gz	QPNNKEXYTSZWRO-HZPDHXFCSA-N	0	3	318.465	2.285	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCCOc1ccccc1	ZINC000079200551	281587777	/nfs/dbraw/zinc/58/77/77/281587777.db2.gz	OEINJZUAPNRGKF-OAHLLOKOSA-N	0	3	307.438	2.341	10	0		DEAEHN
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000122668439	289081473	/nfs/dbraw/zinc/08/14/73/289081473.db2.gz	BOHJAVLQDGOKHA-WBOJAVRRSA-N	0	3	302.418	2.492	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@H](c2ccccc2)[C@H]2CCCO2)C1	ZINC000245998683	289313258	/nfs/dbraw/zinc/31/32/58/289313258.db2.gz	DNVDNHDWFPVRNK-BRWVUGGUSA-N	0	3	317.433	2.252	10	0		DEAEHN
Cc1cccc(CN(CCN(C)C)C(=O)Nc2nncs2)c1	ZINC000171446107	325721371	/nfs/dbraw/zinc/72/13/71/325721371.db2.gz	WUVCZJHPOVJUTP-UHFFFAOYSA-N	0	3	319.434	2.442	10	0		DEAEHN
O=C(CCNCc1ccc(-c2cc[nH]n2)o1)Nc1ccccn1	ZINC000576572399	326303238	/nfs/dbraw/zinc/30/32/38/326303238.db2.gz	CMNNEKKJEPXRJS-UHFFFAOYSA-N	0	3	311.345	2.183	10	0		DEAEHN
COC[C@@H](C)CN1CCN(c2ncnc3ccsc32)CC1	ZINC000187265940	332964837	/nfs/dbraw/zinc/96/48/37/332964837.db2.gz	JZOWOSZIQJSIQM-LBPRGKRZSA-N	0	3	306.435	2.096	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cccc(OC(C)C)n1	ZINC000179144522	333147042	/nfs/dbraw/zinc/14/70/42/333147042.db2.gz	QBQHHYRFRHDBFZ-CQSZACIVSA-N	0	3	305.422	2.425	10	0		DEAEHN
COC(C)(C)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000398002295	337303542	/nfs/dbraw/zinc/30/35/42/337303542.db2.gz	XAAWODNGUAZXMI-ZBFHGGJFSA-N	0	3	304.434	2.438	10	0		DEAEHN
c1cc(CN2CCCC[C@H]2CN2CCOCC2)nc2c1CCC2	ZINC000584396363	337317384	/nfs/dbraw/zinc/31/73/84/337317384.db2.gz	ZATPXKFRUYDJNI-SFHVURJKSA-N	0	3	315.461	2.257	10	0		DEAEHN
C[C@H]1CCCN(c2cc(NC[C@H]3CCCN(C)C3)ncn2)C1	ZINC000302004848	534178019	/nfs/dbraw/zinc/17/80/19/534178019.db2.gz	ZNSPPTLSUMRVSV-LSDHHAIUSA-N	0	3	303.454	2.467	10	0		DEAEHN
CC(=O)c1cccc(OCC(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000158864428	518451533	/nfs/dbraw/zinc/45/15/33/518451533.db2.gz	YBUSDHHVQCZTEV-DYVFJYSZSA-N	0	3	318.417	2.113	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCN([C@@H](C)c2cccnc2)CC1)N(C)C	ZINC000162156419	520581031	/nfs/dbraw/zinc/58/10/31/520581031.db2.gz	UCITVWDUHGQWDL-RDJZCZTQSA-N	0	3	318.465	2.017	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000249799300	521646059	/nfs/dbraw/zinc/64/60/59/521646059.db2.gz	YLDYNTCSGPOCDP-HIFRSBDPSA-N	0	3	305.422	2.107	10	0		DEAEHN
CC[C@@H](C(=O)N(C)Cc1cnn(-c2ccccc2)c1)N(C)C	ZINC000124602785	521804541	/nfs/dbraw/zinc/80/45/41/521804541.db2.gz	WLXNKXKBSGSZNB-INIZCTEOSA-N	0	3	300.406	2.171	10	0		DEAEHN
COCCOc1ccccc1C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000158856326	524058615	/nfs/dbraw/zinc/05/86/15/524058615.db2.gz	ZUUKDZLHFIZVEF-HOCLYGCPSA-N	0	3	320.433	2.170	10	0		DEAEHN
Cc1ccc(C)c(OC[C@H](O)CN2[C@H](C)CC(O)C[C@H]2C)c1	ZINC000248841833	524182227	/nfs/dbraw/zinc/18/22/27/524182227.db2.gz	QBACXPRUQIYJII-BFYDXBDKSA-N	0	3	307.434	2.277	10	0		DEAEHN
Cc1cc(C)nc(SCC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)n1	ZINC000127486539	524594379	/nfs/dbraw/zinc/59/43/79/524594379.db2.gz	KUPMYDKCWFFASV-ZIAGYGMSSA-N	0	3	322.478	2.127	10	0		DEAEHN
COc1ccccc1NCC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000127556872	524634031	/nfs/dbraw/zinc/63/40/31/524634031.db2.gz	IYFWGXPYUGFDKU-ZIAGYGMSSA-N	0	3	305.422	2.048	10	0		DEAEHN
Cc1ccc(OC[C@H](O)CN2[C@H](C)CC(O)C[C@H]2C)c(C)c1	ZINC000248841282	525438000	/nfs/dbraw/zinc/43/80/00/525438000.db2.gz	PTGMPQZQWSWRGE-BFYDXBDKSA-N	0	3	307.434	2.277	10	0		DEAEHN
Cc1ccc([C@@H](C)NC(=O)Nc2ccn(CCN(C)C)n2)o1	ZINC000156216820	525709369	/nfs/dbraw/zinc/70/93/69/525709369.db2.gz	NXWLRXGQUPSFHT-GFCCVEGCSA-N	0	3	305.382	2.229	10	0		DEAEHN
CC(C)=CCC[C@@H](C)CCN1CC[C@H](NS(C)(=O)=O)C1	ZINC000192624748	527409592	/nfs/dbraw/zinc/40/95/92/527409592.db2.gz	JTTMHOXHQCGRHH-CABCVRRESA-N	0	3	302.484	2.383	10	0		DEAEHN
CCN1CCC[C@@H](CN(C)Cc2cc[nH]n2)[C@@H]1c1cnn(C)c1	ZINC000328655199	529045943	/nfs/dbraw/zinc/04/59/43/529045943.db2.gz	YDBPWGUREDDMAS-WMLDXEAASA-N	0	3	316.453	2.048	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)N1CCc2ccc(F)cc21	ZINC000261964701	535042610	/nfs/dbraw/zinc/04/26/10/535042610.db2.gz	YEVDXIJEDYLJIU-JCKWVBRZSA-N	0	3	318.392	2.247	10	0		DEAEHN
CC(C)[C@@H]1C[C@@H](NCc2cccc(N3CCOCC3)n2)CCO1	ZINC000359101409	535269759	/nfs/dbraw/zinc/26/97/59/535269759.db2.gz	IDNGALDXFPBPNC-RDJZCZTQSA-N	0	3	319.449	2.211	10	0		DEAEHN
CC(C)[C@]1(CO)CCN(Cc2cccc(C(=O)N(C)C)c2)C1	ZINC000377657199	535310731	/nfs/dbraw/zinc/31/07/31/535310731.db2.gz	UFSYZAACVIFNJG-GOSISDBHSA-N	0	3	304.434	2.229	10	0		DEAEHN
CCCc1noc(CCCC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)n1	ZINC000247539672	535555760	/nfs/dbraw/zinc/55/57/60/535555760.db2.gz	XXHGZJUEKZMGFN-UONOGXRCSA-N	0	3	322.453	2.286	10	0		DEAEHN
CCC[C@H](C(=O)N1C[C@@H](CO)[C@@H](c2ccsc2)C1)N(C)C	ZINC000249527749	535581088	/nfs/dbraw/zinc/58/10/88/535581088.db2.gz	ZEQBVCSXCAYLPD-RRFJBIMHSA-N	0	3	310.463	2.013	10	0		DEAEHN
CCN1CCN(CCCNc2nc(CC(C)C)ns2)CC1	ZINC000185176875	535698976	/nfs/dbraw/zinc/69/89/76/535698976.db2.gz	GKXCBLDRJBEUQE-UHFFFAOYSA-N	0	3	311.499	2.176	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)Nc1cccc(-c2nnc(C)n2C)c1	ZINC000262509868	535850425	/nfs/dbraw/zinc/85/04/25/535850425.db2.gz	AYOQKCBTAKKJHP-IINYFYTJSA-N	0	3	301.394	2.102	10	0		DEAEHN
CCc1ccccc1OCC(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000247091932	535966173	/nfs/dbraw/zinc/96/61/73/535966173.db2.gz	JNIGVYVSAMWDNV-ZBFHGGJFSA-N	0	3	304.434	2.473	10	0		DEAEHN
CNC(=O)c1ccc(CN(C)C[C@@H](O)CC2CCCC2)cc1	ZINC000191267624	536421156	/nfs/dbraw/zinc/42/11/56/536421156.db2.gz	XYCAMJNWNVQOLU-KRWDZBQOSA-N	0	3	304.434	2.419	10	0		DEAEHN
CNC(=O)c1ccc(CN2CC[C@H](C)[C@H](n3ccnc3)C2)cc1	ZINC000247794812	536424187	/nfs/dbraw/zinc/42/41/87/536424187.db2.gz	ZLXQTFDDLIQUDF-WMLDXEAASA-N	0	3	312.417	2.326	10	0		DEAEHN
C[C@@H](Cn1ncc2ccccc2c1=O)NCc1ccc(F)nc1	ZINC000189172445	625466071	/nfs/dbraw/zinc/46/60/71/625466071.db2.gz	LSUHFWVYEYTXMO-LBPRGKRZSA-N	0	3	312.348	2.109	10	0		DEAEHN
Cc1cc(NCc2cc(Cl)c3c(c2)OCCO3)nc(N)n1	ZINC000075668203	623014107	/nfs/dbraw/zinc/01/41/07/623014107.db2.gz	KYFZPYWINNYMDZ-UHFFFAOYSA-N	0	3	306.753	2.404	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)/C=C\c1ccccc1	ZINC000255774304	625719127	/nfs/dbraw/zinc/71/91/27/625719127.db2.gz	OSVVPTLARKRONN-PYPCHCLXSA-N	0	3	306.431	2.156	10	0		DEAEHN
CC[S@@](=O)CCN[C@@H](C)c1ccc(NC(C)=O)cc1OC	ZINC000747870021	638486395	/nfs/dbraw/zinc/48/63/95/638486395.db2.gz	BVTOXTLOIXYUCE-WIUDPPPLSA-N	0	3	312.435	2.073	10	0		DEAEHN
COC(=O)/C(C)=C\CN(CCO)[C@@H]1CCCc2ccccc21	ZINC000748815599	638595415	/nfs/dbraw/zinc/59/54/15/638595415.db2.gz	CBHRQVOVPIZUPP-OOXMNIKJSA-N	0	3	303.402	2.478	10	0		DEAEHN
COc1cc(C[NH2+][C@@H](C)[C@H](C)O)cc(Br)c1[O-]	ZINC000342244804	639500611	/nfs/dbraw/zinc/50/06/11/639500611.db2.gz	YOMMXKSKSHHBHJ-YUMQZZPRSA-N	0	3	304.184	2.022	10	0		DEAEHN
Cc1nonc1COC(=O)c1cccc(CN2CCCC2)c1	ZINC000805884967	643713163	/nfs/dbraw/zinc/71/31/63/643713163.db2.gz	YCHDUGFUSLOCBS-UHFFFAOYSA-N	0	3	301.346	2.331	10	0		DEAEHN
Cc1cc2ncn(CN3CC[C@H](N4CCOCC4)C3)c2cc1C	ZINC000172959322	646756766	/nfs/dbraw/zinc/75/67/66/646756766.db2.gz	SQWLUQNFZDUUIF-INIZCTEOSA-N	0	3	314.433	2.017	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)NNc2ccncc2)cc1	ZINC000180439909	648490291	/nfs/dbraw/zinc/49/02/91/648490291.db2.gz	GDIQULSTKLBXIO-IAQYHMDHSA-N	0	3	310.357	2.433	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccccc2NC(=O)OC)C1	ZINC000112905167	651606851	/nfs/dbraw/zinc/60/68/51/651606851.db2.gz	UKQKWZRKOIGIAH-LBPRGKRZSA-N	0	3	305.378	2.079	10	0		DEAEHN
Cn1cc([C@@H]2CCN(Cn3cnc4cc(F)c(F)cc43)C2)cn1	ZINC000116257467	684064537	/nfs/dbraw/zinc/06/45/37/684064537.db2.gz	LBUJIUZRGGVVSE-LLVKDONJSA-N	0	3	317.343	2.495	10	0		DEAEHN
COc1ccc([C@@H](NC[C@@H]2CCCS2(=O)=O)C2CC2)cc1	ZINC000126844597	684157874	/nfs/dbraw/zinc/15/78/74/684157874.db2.gz	JOCDWQPGYIVUEW-HOTGVXAUSA-N	0	3	309.431	2.313	10	0		DEAEHN
Cc1cn(C)nc1CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C	ZINC000723501997	777113765	/nfs/dbraw/zinc/11/37/65/777113765.db2.gz	XTDNIIJSTWCLPX-KBPBESRZSA-N	0	3	322.453	2.464	10	0		DEAEHN
CC[C@]1(O)CCCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724060307	777233743	/nfs/dbraw/zinc/23/37/43/777233743.db2.gz	UMAXAHWFCWJCMQ-ZJUUUORDSA-N	0	3	305.287	2.172	10	0		DEAEHN
CC1(C)C[NH2+]C[C@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000721889555	781574692	/nfs/dbraw/zinc/57/46/92/781574692.db2.gz	PTYQIDFJPWTTSA-LLVKDONJSA-N	0	3	323.245	2.270	10	0		DEAEHN
CN1C[C@H](CCNCc2ccc(Br)o2)CC1=O	ZINC000723551985	787344329	/nfs/dbraw/zinc/34/43/29/787344329.db2.gz	KDZAJOHNLQXUSI-SECBINFHSA-N	0	3	301.184	2.000	10	0		DEAEHN
C[C@H](NC[C@@H]1CC[C@H](NC(=O)OC(C)(C)C)C1)c1cn(C)nn1	ZINC000715852687	792528160	/nfs/dbraw/zinc/52/81/60/792528160.db2.gz	HKZMYNBVXKRPCY-XQQFMLRXSA-N	0	3	323.441	2.159	10	0		DEAEHN
Cc1cc(CN[C@@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)[nH]n1	ZINC000716447387	792958661	/nfs/dbraw/zinc/95/86/61/792958661.db2.gz	PFARSKMRETYQCC-BXUZGUMPSA-N	0	3	308.426	2.453	10	0		DEAEHN
Cc1c(CN[C@@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)cnn1C	ZINC000401717216	801844503	/nfs/dbraw/zinc/84/45/03/801844503.db2.gz	YTOAYCSSIFFGPI-IUODEOHRSA-N	0	3	322.453	2.464	10	0		DEAEHN
COc1cc(OC)c(OC)cc1CNCCc1ccccn1	ZINC000060815669	1078878181	/nfs/dbraw/zinc/87/81/81/1078878181.db2.gz	XQJJFVXHADJUTG-UHFFFAOYSA-N	0	3	302.374	2.440	10	0		DEAEHN
C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CCNCc1nccn1C	ZINC000721045374	1085634328	/nfs/dbraw/zinc/63/43/28/1085634328.db2.gz	LUMCFCSCNAGFQW-ZIAGYGMSSA-N	0	3	322.453	2.403	10	0		DEAEHN
Cn1nccc1CN[C@@]12CCC[C@@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000711638405	1087179359	/nfs/dbraw/zinc/17/93/59/1087179359.db2.gz	GCCWELJBAYPNNS-WMLDXEAASA-N	0	3	320.437	2.442	10	0		DEAEHN
O=C(NCc1cnc(Cl)s1)c1cc2c(s1)CCNC2	ZINC000718191308	1088409919	/nfs/dbraw/zinc/40/99/19/1088409919.db2.gz	RJLLNKPHQBTJLH-UHFFFAOYSA-N	0	3	313.835	2.434	10	0		DEAEHN
C[C@@H]1[C@@H](NC(=O)c2cc(Br)ccc2F)CCN1C	ZINC000719388440	1089071272	/nfs/dbraw/zinc/07/12/72/1089071272.db2.gz	QGTQGMDXEAHDMH-PELKAZGASA-N	0	3	315.186	2.411	10	0		DEAEHN
C[C@@H]1[C@H](NC(=O)c2ccc(Br)cc2F)CCN1C	ZINC000719388971	1089079991	/nfs/dbraw/zinc/07/99/91/1089079991.db2.gz	UGDMUQIIMDNJAE-PRHODGIISA-N	0	3	315.186	2.411	10	0		DEAEHN
CN(C)c1nnc(S[C@H]2COc3ccccc3[C@H]2N)s1	ZINC000081769343	192322562	/nfs/dbraw/zinc/32/25/62/192322562.db2.gz	GGEMDFAHLRWWQW-WDEREUQCSA-N	0	3	308.432	2.157	10	0		DEAEHN
CN[C@H](c1ccc(OC)cc1)[C@H](C)SCCS(C)(=O)=O	ZINC000081768866	192322615	/nfs/dbraw/zinc/32/26/15/192322615.db2.gz	ISOBQUCXLVFOPQ-FZMZJTMJSA-N	0	3	317.476	2.122	10	0		DEAEHN
CN[C@@H](c1ccc(OC)cc1)[C@H](C)SCCS(C)(=O)=O	ZINC000081768868	192323103	/nfs/dbraw/zinc/32/31/03/192323103.db2.gz	ISOBQUCXLVFOPQ-SMDDNHRTSA-N	0	3	317.476	2.122	10	0		DEAEHN
CC(C)N(CC(=O)NCCN1CCc2ccccc21)C1CC1	ZINC000076674850	185030513	/nfs/dbraw/zinc/03/05/13/185030513.db2.gz	GEVMAVGRQSJDJS-UHFFFAOYSA-N	0	3	301.434	2.038	10	0		DEAEHN
CC(=O)Nc1cccc([C@@H](C)NC(=O)NC[C@@H]2CCCN2C)c1	ZINC000139524880	282101164	/nfs/dbraw/zinc/10/11/64/282101164.db2.gz	QTRVJFCATYNEFG-WBMJQRKESA-N	0	3	318.421	2.099	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)[C@@H]1Cc2cc(F)ccc2O1	ZINC000076958660	185061103	/nfs/dbraw/zinc/06/11/03/185061103.db2.gz	XVJUPEMZKFCHLG-LRDDRELGSA-N	0	3	306.381	2.120	10	0		DEAEHN
CCN[C@@H](CSCC(=O)OC)c1ccc2c(c1)OCCO2	ZINC000081793181	192324854	/nfs/dbraw/zinc/32/48/54/192324854.db2.gz	FNSIZOQULLXGGS-LBPRGKRZSA-N	0	3	311.403	2.015	10	0		DEAEHN
CN[C@@H](CSc1ncccn1)c1ccc2c(c1)OCCO2	ZINC000081871682	192332494	/nfs/dbraw/zinc/33/24/94/192332494.db2.gz	CVHNLXMYZRZAKD-LBPRGKRZSA-N	0	3	303.387	2.301	10	0		DEAEHN
CCCN[C@H]1CCOC[C@@H]1S(=O)(=O)c1ccc(C)cc1C	ZINC000081922487	192338409	/nfs/dbraw/zinc/33/84/09/192338409.db2.gz	PCHSXTHLQDRATE-HOCLYGCPSA-N	0	3	311.447	2.234	10	0		DEAEHN
CCCN[C@@H]1c2ccc(OC)cc2CC[C@@H]1S(=O)(=O)CC	ZINC000081925722	192340253	/nfs/dbraw/zinc/34/02/53/192340253.db2.gz	RVXFIXGUCKNMJD-JKSUJKDBSA-N	0	3	311.447	2.485	10	0		DEAEHN
CC[C@@H](N)[C@@H](C)S(=O)(=O)c1ccccc1Br	ZINC000081931512	192341292	/nfs/dbraw/zinc/34/12/92/192341292.db2.gz	HYTQGPJMFATWTD-PSASIEDQSA-N	0	3	306.225	2.349	10	0		DEAEHN
CCCNCCS(=O)(=O)c1ccccc1Br	ZINC000081932095	192341724	/nfs/dbraw/zinc/34/17/24/192341724.db2.gz	XDPMAHJUNXTCTI-UHFFFAOYSA-N	0	3	306.225	2.222	10	0		DEAEHN
O=C(NC[C@H](O)CN1CCCCC1)[C@H](c1ccccc1)C1CC1	ZINC000158694853	295676679	/nfs/dbraw/zinc/67/66/79/295676679.db2.gz	YPIIPBNFALCRKT-ZWKOTPCHSA-N	0	3	316.445	2.143	10	0		DEAEHN
O=c1[nH]ccnc1N1CCC[C@@H](NCc2cccc3[nH]ccc32)C1	ZINC000328632209	231269309	/nfs/dbraw/zinc/26/93/09/231269309.db2.gz	LDQFLVPQELQYKF-CQSZACIVSA-N	0	3	323.400	2.422	10	0		DEAEHN
CCC[C@H](C[NH3+])[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000087403818	185223718	/nfs/dbraw/zinc/22/37/18/185223718.db2.gz	FGRVNNFFIAHVCO-SECBINFHSA-N	0	3	311.234	2.399	10	0		DEAEHN
Cc1nn(C)c(C[C@@H](N)c2cncs2)c1Br	ZINC000087574200	185228764	/nfs/dbraw/zinc/22/87/64/185228764.db2.gz	GZWJTMMOIQTWDN-SSDOTTSWSA-N	0	3	301.213	2.190	10	0		DEAEHN
Cc1nn(C)c(C[C@@H](N)c2cscn2)c1Br	ZINC000087594525	185228910	/nfs/dbraw/zinc/22/89/10/185228910.db2.gz	JBSDTBBBTPNREP-SSDOTTSWSA-N	0	3	301.213	2.190	10	0		DEAEHN
CN(C)C[C@@H](O)CNc1c2nsnc2c(Cl)cc1Cl	ZINC000088119937	185240121	/nfs/dbraw/zinc/24/01/21/185240121.db2.gz	FTFMWKOXRHIXFV-LURJTMIESA-N	0	3	321.233	2.333	10	0		DEAEHN
O=C(CN1CCCN(Cc2ccccc2)CC1)Nc1ccncc1	ZINC000088386788	185247875	/nfs/dbraw/zinc/24/78/75/185247875.db2.gz	GHQQBFCZKBUVAA-UHFFFAOYSA-N	0	3	324.428	2.228	10	0		DEAEHN
COC(=O)[C@@](C)(N)CCCCN1CCC(C(F)(F)F)CC1	ZINC000088435491	185250383	/nfs/dbraw/zinc/25/03/83/185250383.db2.gz	OCBZHGJEMLGKEE-ZDUSSCGKSA-N	0	3	310.360	2.321	10	0		DEAEHN
CC[NH2+][C@@](C)(CCCN1CCC(C(F)(F)F)CC1)C(=O)[O-]	ZINC000088435551	185250398	/nfs/dbraw/zinc/25/03/98/185250398.db2.gz	IFBCZOMFDSNKIN-ZDUSSCGKSA-N	0	3	310.360	2.494	10	0		DEAEHN
CCOC(=O)[C@@](C)(CCN1CCC[C@H](C(F)(F)F)C1)NC	ZINC000088435330	185250448	/nfs/dbraw/zinc/25/04/48/185250448.db2.gz	FUHMZKPFXFOCFL-WCQYABFASA-N	0	3	310.360	2.192	10	0		DEAEHN
CCC(CC)[N-]S(=O)(=O)c1ccc(C[NH2+]CC(C)C)o1	ZINC000088541916	185255745	/nfs/dbraw/zinc/25/57/45/185255745.db2.gz	FQVCORDTVCIZSW-UHFFFAOYSA-N	0	3	302.440	2.492	10	0		DEAEHN
C[C@H]1CCCN1S(=O)(=O)c1ccc(CNC(C)(C)C)o1	ZINC000088543313	185256521	/nfs/dbraw/zinc/25/65/21/185256521.db2.gz	LBDNYABHWKXODO-NSHDSACASA-N	0	3	300.424	2.341	10	0		DEAEHN
CCCN[C@H]1CCOC[C@H]1S(=O)(=O)Cc1ccccc1C	ZINC000081984812	192348814	/nfs/dbraw/zinc/34/88/14/192348814.db2.gz	ADBNXIQZGXONDS-JKSUJKDBSA-N	0	3	311.447	2.067	10	0		DEAEHN
CCCN[C@@H](c1ccccc1COC)[C@H]1CCS(=O)(=O)C1	ZINC000088556546	185258022	/nfs/dbraw/zinc/25/80/22/185258022.db2.gz	STBYYLSAGZKCHY-GOEBONIOSA-N	0	3	311.447	2.308	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)NCCCc1ccccn1	ZINC000179221319	282218915	/nfs/dbraw/zinc/21/89/15/282218915.db2.gz	ZWENDHLRSXWDRK-INIZCTEOSA-N	0	3	304.438	2.188	10	0		DEAEHN
COCCC[S@@](=O)C[C@@H](N)c1cccc(C(F)(F)F)c1	ZINC000081999309	192353101	/nfs/dbraw/zinc/35/31/01/192353101.db2.gz	LJXJNCSWBQJGLT-ODXCJYRJSA-N	0	3	309.353	2.490	10	0		DEAEHN
N[C@@H](C[S@](=O)c1ccc(F)cc1)c1ccc2c(c1)OCO2	ZINC000082003190	192353618	/nfs/dbraw/zinc/35/36/18/192353618.db2.gz	PSBLMGVTILAOBQ-YEJXKQKISA-N	0	3	307.346	2.362	10	0		DEAEHN
CN(Cc1ccc(Br)cc1)[C@H](CN)c1cncn1C	ZINC000090167499	185284789	/nfs/dbraw/zinc/28/47/89/185284789.db2.gz	ZYFJHXMEUOZLSH-CYBMUJFWSA-N	0	3	323.238	2.314	10	0		DEAEHN
Cc1nc(-c2cccc(NC(=O)[C@@H]3COC[C@@H]3N)c2)cs1	ZINC000090380490	185293787	/nfs/dbraw/zinc/29/37/87/185293787.db2.gz	IUUZJELFJBDGMK-OLZOCXBDSA-N	0	3	303.387	2.031	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1cc(Cl)cc2cccnc21	ZINC000090432810	185295840	/nfs/dbraw/zinc/29/58/40/185295840.db2.gz	ZWHYTUHNMOOISZ-WCQYABFASA-N	0	3	305.765	2.061	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)N(Cc1ccc(Cl)cc1)C1CC1	ZINC000090434943	185296124	/nfs/dbraw/zinc/29/61/24/185296124.db2.gz	BCLISUWPEZZWAG-HUUCEWRRSA-N	0	3	308.809	2.065	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000090434112	185296211	/nfs/dbraw/zinc/29/62/11/185296211.db2.gz	HPAWBYLTZFVHFI-GWCFXTLKSA-N	0	3	305.765	2.061	10	0		DEAEHN
C[C@]1(C(=O)N[C@@H](c2cccs2)C2CCCC2)COC[C@@H]1N	ZINC000090585240	185305106	/nfs/dbraw/zinc/30/51/06/185305106.db2.gz	NPPMFEQGUXPYET-LZWOXQAQSA-N	0	3	308.447	2.459	10	0		DEAEHN
C[C@@]1(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)COC[C@H]1N	ZINC000090597735	185305795	/nfs/dbraw/zinc/30/57/95/185305795.db2.gz	GXZXBSXPKCZWQU-ZYHUDNBSSA-N	0	3	306.259	2.147	10	0		DEAEHN
CCC[C@H](C(=O)NCCc1nnc(-c2ccccc2)o1)N(C)C	ZINC000179501343	282227550	/nfs/dbraw/zinc/22/75/50/282227550.db2.gz	MKXHUYWKPUPPGL-CQSZACIVSA-N	0	3	316.405	2.126	10	0		DEAEHN
CN(C)C[C@@H]1CSCCCN1C(=O)NCc1cccs1	ZINC000090700238	185310396	/nfs/dbraw/zinc/31/03/96/185310396.db2.gz	WYJCUFJUIOMLPJ-GFCCVEGCSA-N	0	3	313.492	2.327	10	0		DEAEHN
Cc1cccc(CC(=O)N2CCCSC[C@@H]2CN(C)C)c1	ZINC000090699966	185310432	/nfs/dbraw/zinc/31/04/32/185310432.db2.gz	JHUZJNUMXVOFMG-INIZCTEOSA-N	0	3	306.475	2.433	10	0		DEAEHN
CN(C)C[C@H]1CSCCCN1C(=O)NCc1ccccc1	ZINC000090700235	185310545	/nfs/dbraw/zinc/31/05/45/185310545.db2.gz	SLHQMPFMMFMMAS-HNNXBMFYSA-N	0	3	307.463	2.265	10	0		DEAEHN
CCCS(=O)(=O)N1CCCSC[C@H]1CN1CCCCC1	ZINC000090701809	185310632	/nfs/dbraw/zinc/31/06/32/185310632.db2.gz	HKFOZFAXEDVOTF-CQSZACIVSA-N	0	3	320.524	2.020	10	0		DEAEHN
CC1(C)CCc2ccccc2[C@@H]1[NH2+]CCCOC(=O)N=C(N)[O-]	ZINC000183223801	282240446	/nfs/dbraw/zinc/24/04/46/282240446.db2.gz	CDSZFCGXWRVXSJ-AWEZNQCLSA-N	0	3	319.405	2.485	10	0		DEAEHN
CC1(C)CCc2ccccc2[C@@H]1[NH2+]CCCOC([O-])=NC(N)=O	ZINC000183223801	282240449	/nfs/dbraw/zinc/24/04/49/282240449.db2.gz	CDSZFCGXWRVXSJ-AWEZNQCLSA-N	0	3	319.405	2.485	10	0		DEAEHN
CCOc1c(OC)cc(CNCC2(CCO)CC2)cc1OC	ZINC000186177056	282268815	/nfs/dbraw/zinc/26/88/15/282268815.db2.gz	QDJNYYDTWMELEX-UHFFFAOYSA-N	0	3	309.406	2.355	10	0		DEAEHN
CN(CCNC(=O)NC[C@H]1CCC(C)(C)O1)Cc1ccccc1	ZINC000186387385	282274389	/nfs/dbraw/zinc/27/43/89/282274389.db2.gz	CEIBHUNGCJBJFA-MRXNPFEDSA-N	0	3	319.449	2.375	10	0		DEAEHN
CN(C)c1ccc(NC(=O)NC[C@H]2N(C)CCCC2(C)C)cn1	ZINC000448013380	529784427	/nfs/dbraw/zinc/78/44/27/529784427.db2.gz	MCPIGPPAYWOTBO-CQSZACIVSA-N	0	3	319.453	2.390	10	0		DEAEHN
Cc1nn(C)c2sc(C(=O)N[C@H]3CN(C(C)C)C[C@@H]3C)cc12	ZINC000155615889	282292287	/nfs/dbraw/zinc/29/22/87/282292287.db2.gz	WXIMRUVCQVZQLD-GWCFXTLKSA-N	0	3	320.462	2.402	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1ccc(N(C)C)nc1)c1ccccc1	ZINC000032273399	190658188	/nfs/dbraw/zinc/65/81/88/190658188.db2.gz	ORRJFXUNUHRDDJ-MRXNPFEDSA-N	0	3	312.417	2.180	10	0		DEAEHN
CCOc1ccc(C[C@@H]2[C@H](O)C3CCN2CC3)cc1OCC	ZINC000169966637	197762593	/nfs/dbraw/zinc/76/25/93/197762593.db2.gz	SPIGMAGALOTEOL-CRAIPNDOSA-N	0	3	305.418	2.482	10	0		DEAEHN
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1ncc(F)cn1	ZINC000328637373	529955041	/nfs/dbraw/zinc/95/50/41/529955041.db2.gz	VXRAPEJMDASBQU-ZFWWWQNUSA-N	0	3	301.369	2.140	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)[C@H]1CCCCN1Cc1ccccc1	ZINC000245469491	282390642	/nfs/dbraw/zinc/39/06/42/282390642.db2.gz	VEHLDXMZZLXKQQ-ZWKOTPCHSA-N	0	3	315.461	2.252	10	0		DEAEHN
CCc1nc(CNC(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)cs1	ZINC000125405100	539472747	/nfs/dbraw/zinc/47/27/47/539472747.db2.gz	CXPMJHAFKAEJBS-QWRGUYRKSA-N	0	3	308.451	2.130	10	0		DEAEHN
CCc1cnc(CCNC(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)s1	ZINC000126316115	539477286	/nfs/dbraw/zinc/47/72/86/539477286.db2.gz	FJXXEGHZVGPUGF-NWDGAFQWSA-N	0	3	322.478	2.172	10	0		DEAEHN
CS[C@H]1CN(C(=O)Nc2ccc(C)nc2)C[C@@H]1N1CCCC1	ZINC000615932975	362735422	/nfs/dbraw/zinc/73/54/22/362735422.db2.gz	XKDHRBJJEYVZDH-GJZGRUSLSA-N	0	3	320.462	2.434	10	0		DEAEHN
CN[C@@H]1Cc2ccccc2N(S(=O)(=O)c2ccccc2)C1	ZINC000616671758	362907732	/nfs/dbraw/zinc/90/77/32/362907732.db2.gz	CCLFVZSZMJQDEB-CQSZACIVSA-N	0	3	302.399	2.026	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC[C@H](n2ccnc2)CC1	ZINC000616627010	362900672	/nfs/dbraw/zinc/90/06/72/362900672.db2.gz	ATLYWKDHZVUDTP-AWEZNQCLSA-N	0	3	308.426	2.435	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2Cc1nc(-c2ccoc2)no1	ZINC000177341425	539630307	/nfs/dbraw/zinc/63/03/07/539630307.db2.gz	DFIFHOGFYLGOIW-KGLIPLIRSA-N	0	3	302.378	2.388	10	0		DEAEHN
O=C1CCCN1C[C@H](O)CNC1(c2ccc(Cl)cc2)CCC1	ZINC000178839714	539637449	/nfs/dbraw/zinc/63/74/49/539637449.db2.gz	HFZWDVZPCYTSQA-OAHLLOKOSA-N	0	3	322.836	2.292	10	0		DEAEHN
Cc1ccc(CN(C(=O)CN[C@H](C)[C@@H]2CCCO2)C2CC2)o1	ZINC000183124826	539659263	/nfs/dbraw/zinc/65/92/63/539659263.db2.gz	QTIRVYKXURMFFM-CJNGLKHVSA-N	0	3	306.406	2.236	10	0		DEAEHN
NC[C@@H](NC[C@H]1CCCO1)c1cc(Br)cs1	ZINC000083774353	192383186	/nfs/dbraw/zinc/38/31/86/192383186.db2.gz	NBSGKZQJYLGWFH-NXEZZACHSA-N	0	3	305.241	2.279	10	0		DEAEHN
CN[C@@H](C[S@](=O)CCOC)c1cccc(C(F)(F)F)c1	ZINC000084035323	192396454	/nfs/dbraw/zinc/39/64/54/192396454.db2.gz	XKZWKIMUXBNGGO-YUNKPMOVSA-N	0	3	309.353	2.361	10	0		DEAEHN
Cc1nn(C)c(CNCC2CCC(O)CC2)c1Br	ZINC000227767755	539731364	/nfs/dbraw/zinc/73/13/64/539731364.db2.gz	ALBYPXXJXOMMGH-UHFFFAOYSA-N	0	3	316.243	2.132	10	0		DEAEHN
CC[C@@H](C)N(CC)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138462729	186017341	/nfs/dbraw/zinc/01/73/41/186017341.db2.gz	LRYMNUMOQSTGID-SNVBAGLBSA-N	0	3	320.405	2.493	10	0		DEAEHN
CCNCc1cc(F)c(F)c(S(=O)(=O)N2CC[C@H](C)C2)c1	ZINC000138653595	186018102	/nfs/dbraw/zinc/01/81/02/186018102.db2.gz	BTWHXVXJAOKFJS-JTQLQIEISA-N	0	3	318.389	2.105	10	0		DEAEHN
CC(C)[C@H]1CCCN1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000139159996	186020013	/nfs/dbraw/zinc/02/00/13/186020013.db2.gz	CPKXCVKTJXXITF-GFCCVEGCSA-N	0	3	318.389	2.233	10	0		DEAEHN
CC[C@H]1CC[C@@H](C)N1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000139278131	186020831	/nfs/dbraw/zinc/02/08/31/186020831.db2.gz	LQEOBSLNRPHZJV-KOLCDFICSA-N	0	3	318.389	2.375	10	0		DEAEHN
CC(C)[C@H]1N[C@H](c2ccsc2)N(C2CCN(C)CC2)C1=O	ZINC000141241671	186029211	/nfs/dbraw/zinc/02/92/11/186029211.db2.gz	JBSTYQJZXGEZHH-CABCVRRESA-N	0	3	307.463	2.297	10	0		DEAEHN
CCC[C@H]1N[C@H](c2cccs2)N(C2CCN(C)CC2)C1=O	ZINC000141176885	186029242	/nfs/dbraw/zinc/02/92/42/186029242.db2.gz	RVLGCZMRKVNYLT-HIFRSBDPSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCc1ccc([C@H](C)NC[C@@H](O)COC[C@H]2CCCO2)cc1	ZINC000248498434	539774065	/nfs/dbraw/zinc/77/40/65/539774065.db2.gz	NWQCUBJYSTZQGE-BMGDILEWSA-N	0	3	307.434	2.456	10	0		DEAEHN
CC(C)(C)NCc1cc(S(=O)(=O)NCC(F)F)ccc1F	ZINC000148184799	186043991	/nfs/dbraw/zinc/04/39/91/186043991.db2.gz	ZPMMJIWKCKGEQD-UHFFFAOYSA-N	0	3	324.368	2.257	10	0		DEAEHN
CC[C@@H]1N[C@H](c2ccsc2)N(CCN2CCCCC2)C1=O	ZINC000144077378	186034954	/nfs/dbraw/zinc/03/49/54/186034954.db2.gz	COSRYUYNSMLUNG-GJZGRUSLSA-N	0	3	307.463	2.443	10	0		DEAEHN
CCc1nn(C)c2c1nc([S-])n2CC1([NH+](C)C)CCCC1	ZINC000147268382	186038987	/nfs/dbraw/zinc/03/89/87/186038987.db2.gz	OLNOLUZFVHKKDQ-UHFFFAOYSA-N	0	3	307.467	2.495	10	0		DEAEHN
CN(c1cccc(CN)c1)S(=O)(=O)CCc1ccccc1	ZINC000149280324	186049024	/nfs/dbraw/zinc/04/90/24/186049024.db2.gz	DBDQLSLFSOGTOE-UHFFFAOYSA-N	0	3	304.415	2.154	10	0		DEAEHN
C[C@@H](N)c1cc(Br)ccc1OCc1nncn1C	ZINC000150046911	186054213	/nfs/dbraw/zinc/05/42/13/186054213.db2.gz	CTGWSTJHBWRZKH-MRVPVSSYSA-N	0	3	311.183	2.176	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@H]2CC[C@H](C)O2)c(OCCN(C)C)c1	ZINC000155825637	186115784	/nfs/dbraw/zinc/11/57/84/186115784.db2.gz	ZVKJEYNVKNBILQ-ZFWWWQNUSA-N	0	3	306.406	2.441	10	0		DEAEHN
CC(C(=O)N[C@H](C)Cc1ccc(Br)cc1)=C1CNC1	ZINC000164001744	186145171	/nfs/dbraw/zinc/14/51/71/186145171.db2.gz	RYBRNGUNIBOPQC-SNVBAGLBSA-N	0	3	323.234	2.416	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)NC2CC(C)C2)ccc1CC	ZINC000164005136	186145287	/nfs/dbraw/zinc/14/52/87/186145287.db2.gz	FGMWTPKNKZPAMU-UHFFFAOYSA-N	0	3	310.463	2.435	10	0		DEAEHN
Cc1ccc(Br)c(NC(=O)C2(N)CCOCC2)c1	ZINC000163998083	186145307	/nfs/dbraw/zinc/14/53/07/186145307.db2.gz	JWBZFFIZTFKILX-UHFFFAOYSA-N	0	3	313.195	2.204	10	0		DEAEHN
CNCc1ccc(Cl)c(S(=O)(=O)NC2CC(C)C2)c1	ZINC000163994861	186145531	/nfs/dbraw/zinc/14/55/31/186145531.db2.gz	CBCCVCLRCLNKSL-UHFFFAOYSA-N	0	3	302.827	2.136	10	0		DEAEHN
CCOc1cccnc1C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000164108180	186149358	/nfs/dbraw/zinc/14/93/58/186149358.db2.gz	DOHPOZZNTVFXNK-UONOGXRCSA-N	0	3	303.406	2.037	10	0		DEAEHN
CSc1cc2c(cc1CNC[C@@H](C)[S@@](C)=O)OCCO2	ZINC000159651580	186132831	/nfs/dbraw/zinc/13/28/31/186132831.db2.gz	QNRHMCURVQSFLG-SBKAZYGRSA-N	0	3	315.460	2.036	10	0		DEAEHN
CC1(C)CN(CC[C@H](N)c2ccccc2Cl)C[C@@H](CO)O1	ZINC000163948259	186143470	/nfs/dbraw/zinc/14/34/70/186143470.db2.gz	CDTUVIFBTLYBCL-WFASDCNBSA-N	0	3	312.841	2.202	10	0		DEAEHN
Cc1cc(C(=O)N2CC[C@@H](N3CCCC3)C2)nn1-c1ccccc1	ZINC000171440275	186160706	/nfs/dbraw/zinc/16/07/06/186160706.db2.gz	DWNOFVRTFLWBRY-QGZVFWFLSA-N	0	3	324.428	2.491	10	0		DEAEHN
CCSCc1cc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)no1	ZINC000186041329	186234289	/nfs/dbraw/zinc/23/42/89/186234289.db2.gz	MBADHQUAKGPNEK-NEPJUHHUSA-N	0	3	311.451	2.482	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)C1=Cc2ccccc2OC1	ZINC000191880797	186269200	/nfs/dbraw/zinc/26/92/00/186269200.db2.gz	ZOUJZVZITWIWSV-CYBMUJFWSA-N	0	3	324.446	2.070	10	0		DEAEHN
C[C@H](NC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C)c1cccs1	ZINC000253246958	186300283	/nfs/dbraw/zinc/30/02/83/186300283.db2.gz	SKPWHUMYBVSHHZ-LRQBHLAOSA-N	0	3	308.447	2.458	10	0		DEAEHN
CC(C)(CNC(=O)N1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000171901313	198004462	/nfs/dbraw/zinc/00/44/62/198004462.db2.gz	YXKXKUFWDKJJDE-INIZCTEOSA-N	0	3	301.434	2.454	10	0		DEAEHN
O=C(c1cccc(-n2ccnc2)c1)N1CCCN(C2CC2)CC1	ZINC000172114084	198041398	/nfs/dbraw/zinc/04/13/98/198041398.db2.gz	RQOONNJJMGKNPW-UHFFFAOYSA-N	0	3	310.401	2.183	10	0		DEAEHN
O=C(NCCc1cc2ccccc2o1)N1CCN2CCC[C@H]2C1	ZINC000172495803	198106433	/nfs/dbraw/zinc/10/64/33/198106433.db2.gz	LYJXXMNRLGEIDX-HNNXBMFYSA-N	0	3	313.401	2.465	10	0		DEAEHN
CCN(C(=O)c1ccc(Br)cn1)[C@@H]1CCN(C)C1	ZINC000617556780	363184503	/nfs/dbraw/zinc/18/45/03/363184503.db2.gz	XKSHAARBYFVDGC-LLVKDONJSA-N	0	3	312.211	2.010	10	0		DEAEHN
C[C@H]1[C@H](NC(=O)c2ncccc2N)CCN1Cc1ccccc1	ZINC000309734765	539878163	/nfs/dbraw/zinc/87/81/63/539878163.db2.gz	QHNOROUYLYVCNP-XJKSGUPXSA-N	0	3	310.401	2.057	10	0		DEAEHN
COCCCOc1cccc(C(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000173574520	198229002	/nfs/dbraw/zinc/22/90/02/198229002.db2.gz	WUJDZHCTBAEMTR-INIZCTEOSA-N	0	3	318.417	2.022	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCCN(C)c2ccccc2)CCN1C	ZINC000173598759	198232057	/nfs/dbraw/zinc/23/20/57/198232057.db2.gz	STADQYKOLOOYPE-RDJZCZTQSA-N	0	3	318.465	2.247	10	0		DEAEHN
Cc1cnn(CCN[C@@H]2CCCN(c3ccc(C)cc3)C2=O)c1	ZINC000174086593	198290240	/nfs/dbraw/zinc/29/02/40/198290240.db2.gz	RRLJYSUYGWUEAQ-QGZVFWFLSA-N	0	3	312.417	2.285	10	0		DEAEHN
CCOc1ccccc1CNC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000174250891	198310671	/nfs/dbraw/zinc/31/06/71/198310671.db2.gz	UIHVOVOXVZAWGU-INIZCTEOSA-N	0	3	315.417	2.241	10	0		DEAEHN
C[C@H]1CCN(CC(=O)NC(C)(C)C)CCN1Cc1ccccc1	ZINC000174434402	198335090	/nfs/dbraw/zinc/33/50/90/198335090.db2.gz	UVDNUZOKGBTHBO-INIZCTEOSA-N	0	3	317.477	2.498	10	0		DEAEHN
CCc1nc(CCNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cs1	ZINC000174602168	198357624	/nfs/dbraw/zinc/35/76/24/198357624.db2.gz	DITBKFKNAIMNAR-TZMCWYRMSA-N	0	3	324.494	2.372	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)Nc2cnn(CC(F)F)c2)CCN1C	ZINC000174852991	198393283	/nfs/dbraw/zinc/39/32/83/198393283.db2.gz	PRPYEKHBUHNYQT-JQWIXIFHSA-N	0	3	315.368	2.095	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1cnn(-c2ccc(Cl)cc2)c1	ZINC000175847922	198516486	/nfs/dbraw/zinc/51/64/86/198516486.db2.gz	UTJAUVFUVZVTJX-MRXNPFEDSA-N	0	3	323.824	2.403	10	0		DEAEHN
c1nc(CNC[C@@H]2CN(Cc3ccccc3)CCCO2)co1	ZINC000277018804	213243765	/nfs/dbraw/zinc/24/37/65/213243765.db2.gz	MLCXHSRCDRUNCB-QGZVFWFLSA-N	0	3	301.390	2.055	10	0		DEAEHN
O=C(NC1CC1)c1ccnc(N2CCN[C@@H](c3ccccc3)C2)c1	ZINC000065255942	354680890	/nfs/dbraw/zinc/68/08/90/354680890.db2.gz	LAGUHNXZUTVANQ-QGZVFWFLSA-N	0	3	322.412	2.125	10	0		DEAEHN
CCC[C@@H](N)C(=O)Nc1nc(-c2cccc(OC)c2)ns1	ZINC000236816951	202022971	/nfs/dbraw/zinc/02/29/71/202022971.db2.gz	LSEOTYAGWQMNMI-LLVKDONJSA-N	0	3	306.391	2.280	10	0		DEAEHN
CC[C@@H]1CN(C(=O)N[C@@H](CC(C)C)CN(C)C)CCS1	ZINC000073722559	191348304	/nfs/dbraw/zinc/34/83/04/191348304.db2.gz	AMOOEQZTKPHACV-UONOGXRCSA-N	0	3	301.500	2.500	10	0		DEAEHN
CO[C@H](CNC(=O)N[C@H](CC(C)C)CN(C)C)C(C)(C)C	ZINC000073722904	191348822	/nfs/dbraw/zinc/34/88/22/191348822.db2.gz	RZMFYWZTTFQTSF-ZIAGYGMSSA-N	0	3	301.475	2.323	10	0		DEAEHN
CCc1ccc(S(=O)(=O)NC2CCN(C(C)C)CC2)s1	ZINC000074914372	191385940	/nfs/dbraw/zinc/38/59/40/191385940.db2.gz	KFWREXWAZAWMHR-UHFFFAOYSA-N	0	3	316.492	2.462	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)Nc1ccc([S@](C)=O)cc1	ZINC000080127883	355347927	/nfs/dbraw/zinc/34/79/27/355347927.db2.gz	XAUMTIOJEMULBY-WHEQGISXSA-N	0	3	323.462	2.420	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)NCc1cccc(C)n1	ZINC000113406582	355758281	/nfs/dbraw/zinc/75/82/81/355758281.db2.gz	UAAANKLCHOGEPZ-MRXNPFEDSA-N	0	3	304.438	2.454	10	0		DEAEHN
Cc1cccc(CNC(=O)NC[C@@H](C)N2CCC[C@H](C)C2)n1	ZINC000123977674	355807246	/nfs/dbraw/zinc/80/72/46/355807246.db2.gz	WXBNGGKUEUFGFS-DZGCQCFKSA-N	0	3	304.438	2.310	10	0		DEAEHN
CCS(=O)(=O)C[C@@H](C)N[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000183050847	356157667	/nfs/dbraw/zinc/15/76/67/356157667.db2.gz	RLABPUUJUNVLGV-KGLIPLIRSA-N	0	3	321.446	2.346	10	0		DEAEHN
C[C@H](N[C@H]1CCCS(=O)(=O)C1)c1cccc(-n2ccnc2)c1	ZINC000183050724	356158093	/nfs/dbraw/zinc/15/80/93/356158093.db2.gz	POLNXLOWXCIYEM-ZFWWWQNUSA-N	0	3	319.430	2.100	10	0		DEAEHN
C[C@H](CN[C@@H]1CCCS(=O)(=O)C1)c1ccc(F)cc1F	ZINC000183051575	356158120	/nfs/dbraw/zinc/15/81/20/356158120.db2.gz	ZIYMKMLFKBAZDY-ZYHUDNBSSA-N	0	3	303.374	2.235	10	0		DEAEHN
CCS(=O)(=O)C[C@H](C)NCCc1ccc(OC)cc1Cl	ZINC000183123216	356160930	/nfs/dbraw/zinc/16/09/30/356160930.db2.gz	WFSLVHNSVVADQR-NSHDSACASA-N	0	3	319.854	2.304	10	0		DEAEHN
CCCN[C@H](C)c1csc(N(CCOC)CCOC)n1	ZINC000080829457	192194050	/nfs/dbraw/zinc/19/40/50/192194050.db2.gz	WRBOAKYLXUJOHR-GFCCVEGCSA-N	0	3	301.456	2.303	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1c(C)cccc1OC	ZINC000195031628	356248469	/nfs/dbraw/zinc/24/84/69/356248469.db2.gz	DYVXDOZLNPHKTL-AWEZNQCLSA-N	0	3	321.421	2.236	10	0		DEAEHN
CN1CC[C@H](NC(=O)[C@H]2CCn3ccnc3C2)[C@@H]1c1ccccc1	ZINC000247914432	356320894	/nfs/dbraw/zinc/32/08/94/356320894.db2.gz	AUVAELWREBMFRB-BQFCYCMXSA-N	0	3	324.428	2.007	10	0		DEAEHN
CCc1cccc(S(=O)(=O)N2CCC(N3CCCC3)CC2)c1	ZINC000081038115	192216871	/nfs/dbraw/zinc/21/68/71/192216871.db2.gz	PTXFSRAEAVDKNI-UHFFFAOYSA-N	0	3	322.474	2.498	10	0		DEAEHN
N[C@H](CC[NH3+])c1cc(Br)c([O-])c(Br)c1	ZINC000306737554	356405532	/nfs/dbraw/zinc/40/55/32/356405532.db2.gz	RKRHDQSNBPIZPB-MRVPVSSYSA-N	0	3	324.016	2.266	10	0		DEAEHN
OCCN1CCC[C@H](NCc2sccc2Br)C1	ZINC000384413508	356683266	/nfs/dbraw/zinc/68/32/66/356683266.db2.gz	XDTKOCCBYKFUCK-JTQLQIEISA-N	0	3	319.268	2.057	10	0		DEAEHN
COc1cc(CN2CC[C@H](CO)[C@H]2C)ccc1OC(F)F	ZINC000386351331	356696411	/nfs/dbraw/zinc/69/64/11/356696411.db2.gz	YIYSAUXIRPHTPL-ZYHUDNBSSA-N	0	3	301.333	2.499	10	0		DEAEHN
C=Cn1cc(CNC[C@@H](CO)Cc2ccc(F)c(F)c2)cn1	ZINC000578143811	356769672	/nfs/dbraw/zinc/76/96/72/356769672.db2.gz	UHSYPOOLHJSPSQ-ZDUSSCGKSA-N	0	3	307.344	2.203	10	0		DEAEHN
c1[nH]c(-c2ccccc2)nc1CNCCN1C[C@H]2CC[C@@H](C1)O2	ZINC000581113253	357132539	/nfs/dbraw/zinc/13/25/39/357132539.db2.gz	PWLNZIWCGINSBN-CALCHBBNSA-N	0	3	312.417	2.030	10	0		DEAEHN
c1nc(-c2ccccc2)[nH]c1CNCCN1C[C@H]2CC[C@@H](C1)O2	ZINC000581113253	357132543	/nfs/dbraw/zinc/13/25/43/357132543.db2.gz	PWLNZIWCGINSBN-CALCHBBNSA-N	0	3	312.417	2.030	10	0		DEAEHN
CC[C@H]1CCCCN1S(=O)(=O)c1ccsc1CNC	ZINC000088942620	192663573	/nfs/dbraw/zinc/66/35/73/192663573.db2.gz	OMPIDSBQAXREES-NSHDSACASA-N	0	3	302.465	2.421	10	0		DEAEHN
Cc1ccccc1NCCC(=O)Nc1cnn(CCN(C)C)c1	ZINC000588857943	357429985	/nfs/dbraw/zinc/42/99/85/357429985.db2.gz	ZJXHDVKFBWFSGZ-UHFFFAOYSA-N	0	3	315.421	2.194	10	0		DEAEHN
CC(C)[C@H](O)CC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000178898476	198948841	/nfs/dbraw/zinc/94/88/41/198948841.db2.gz	JUOLJRXGHZBEST-GOSISDBHSA-N	0	3	318.461	2.217	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H](C)c1ccc(-n2cncn2)cc1)N(C)C	ZINC000179334223	199017184	/nfs/dbraw/zinc/01/71/84/199017184.db2.gz	DSWZTXKXPVMMSM-CZUORRHYSA-N	0	3	315.421	2.175	10	0		DEAEHN
Cc1cc(C(=O)N(CCN(C)C)Cc2ccccn2)c(C)[nH]1	ZINC000593216971	358035127	/nfs/dbraw/zinc/03/51/27/358035127.db2.gz	FXUKGAURDMJVCH-UHFFFAOYSA-N	0	3	300.406	2.231	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C)c1F	ZINC000180471862	199162972	/nfs/dbraw/zinc/16/29/72/199162972.db2.gz	SNVURODVSJVNML-ZDUSSCGKSA-N	0	3	323.412	2.165	10	0		DEAEHN
COc1cc([C@H](C)NC[C@H]2CN(C)CCO2)ccc1SC	ZINC000180498454	199167244	/nfs/dbraw/zinc/16/72/44/199167244.db2.gz	CRCSMUQUTKBLJY-JSGCOSHPSA-N	0	3	310.463	2.398	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCc2ccc(Cl)cn2)CCN1C	ZINC000180846205	199218018	/nfs/dbraw/zinc/21/80/18/199218018.db2.gz	FNEBQBNNJMNIBH-RISCZKNCSA-N	0	3	310.829	2.359	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCc2ccc(Cl)cn2)CCN1C	ZINC000180846185	199218413	/nfs/dbraw/zinc/21/84/13/199218413.db2.gz	FNEBQBNNJMNIBH-SMDDNHRTSA-N	0	3	310.829	2.359	10	0		DEAEHN
CCCn1cc(S(=O)(=O)N2CC[C@H](C)C[C@@H]2C)cc1CN	ZINC000089023259	192703855	/nfs/dbraw/zinc/70/38/55/192703855.db2.gz	SJTWAIMEJKLAOV-STQMWFEESA-N	0	3	313.467	2.166	10	0		DEAEHN
CN(C[C@@H](O)c1ccccc1C(F)(F)F)CC1(CO)CC1	ZINC000186764992	200006027	/nfs/dbraw/zinc/00/60/27/200006027.db2.gz	OHKZLBCMHRSYGO-CYBMUJFWSA-N	0	3	303.324	2.443	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCc2cc(Cl)cc3c2OCC3)C1	ZINC000186846258	200020829	/nfs/dbraw/zinc/02/08/29/200020829.db2.gz	BMZGNENWUGTKKH-CQSZACIVSA-N	0	3	323.824	2.120	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2cc(F)ccc2OC)C1	ZINC000187068454	200055446	/nfs/dbraw/zinc/05/54/46/200055446.db2.gz	KLHLLKGNHVFUSF-CQSZACIVSA-N	0	3	309.385	2.118	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NCc2cccc(CN(C)C)c2)CC[C@H]1C	ZINC000187325348	200095602	/nfs/dbraw/zinc/09/56/02/200095602.db2.gz	LBIWLTLMERWLGD-RHSMWYFYSA-N	0	3	319.449	2.315	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)CC(=O)N(C)Cc2ccccc2F)C1	ZINC000187944567	200180558	/nfs/dbraw/zinc/18/05/58/200180558.db2.gz	ZHLOKLIWMJAHFJ-KDOFPFPSSA-N	0	3	322.424	2.267	10	0		DEAEHN
O=C1[C@H](N[C@@H]2CCCSC2)CCN1Cc1ccc(F)cc1	ZINC000189055767	200342161	/nfs/dbraw/zinc/34/21/61/200342161.db2.gz	YYHPNUSGVXVGTF-HUUCEWRRSA-N	0	3	308.422	2.412	10	0		DEAEHN
CC[C@H](OC1CCCC1)C(=O)Nc1cnn(CCN(C)C)c1	ZINC000603086833	360693964	/nfs/dbraw/zinc/69/39/64/360693964.db2.gz	KTWBIEUCOBILLK-HNNXBMFYSA-N	0	3	308.426	2.121	10	0		DEAEHN
Cc1cc(C(F)(F)F)ccc1CN1CC[C@H](NC(N)=O)C1	ZINC000443663789	238120077	/nfs/dbraw/zinc/12/00/77/238120077.db2.gz	YXXPCMGZISUGHP-LBPRGKRZSA-N	0	3	301.312	2.256	10	0		DEAEHN
CCN(CC(=O)NC12CC3CC(CC(C3)C1)C2)CC(C)(C)O	ZINC000603940274	360875082	/nfs/dbraw/zinc/87/50/82/360875082.db2.gz	CDNVNMNSDZZYAV-UHFFFAOYSA-N	0	3	308.466	2.164	10	0		DEAEHN
O=C(CN1CCCC12CCC2)NC[C@@H]1Cc2ccccc2O1	ZINC000444790933	238310275	/nfs/dbraw/zinc/31/02/75/238310275.db2.gz	LPKFAJGIYGLCKI-HNNXBMFYSA-N	0	3	300.402	2.125	10	0		DEAEHN
Cn1ccc(CN2CCC[C@@H](CC(=O)OC(C)(C)C)C2)cc1=O	ZINC000610763317	361463060	/nfs/dbraw/zinc/46/30/60/361463060.db2.gz	SYVXTGQXJYUPAJ-AWEZNQCLSA-N	0	3	320.433	2.329	10	0		DEAEHN
O=C(NCCCCO)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000194340169	201205792	/nfs/dbraw/zinc/20/57/92/201205792.db2.gz	OEBZOJOYOKXREK-QGZVFWFLSA-N	0	3	319.449	2.113	10	0		DEAEHN
CC1(C)[C@H](NCc2cccc(S(C)(=O)=O)c2)[C@H]2CCCO[C@H]21	ZINC000449177919	240157277	/nfs/dbraw/zinc/15/72/77/240157277.db2.gz	WPJPELVLYWGYLF-BZUAXINKSA-N	0	3	323.458	2.383	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2ccc(OC)c(C)c2)CC12COC2	ZINC000449356940	240396269	/nfs/dbraw/zinc/39/62/69/240396269.db2.gz	CWSAHKDOZWXBLL-HNNXBMFYSA-N	0	3	319.401	2.015	10	0		DEAEHN
O[C@H]1COCC[C@H]1NCc1ccc(Br)cc1Cl	ZINC000623765770	365167061	/nfs/dbraw/zinc/16/70/61/365167061.db2.gz	WYTMDCHBWHYCGV-NEPJUHHUSA-N	0	3	320.614	2.342	10	0		DEAEHN
C[S@](=O)CCN[C@H]1CCc2c1cccc2Br	ZINC000091341906	193043010	/nfs/dbraw/zinc/04/30/10/193043010.db2.gz	UUBRPKCUEHAMGI-BLLLJJGKSA-N	0	3	302.237	2.405	10	0		DEAEHN
CCNc1ccc(Cl)c(C(=O)N2CCC[C@@H](N(C)C)C2)n1	ZINC000091432080	193054784	/nfs/dbraw/zinc/05/47/84/193054784.db2.gz	IALSIQVWEBBCRQ-LLVKDONJSA-N	0	3	310.829	2.333	10	0		DEAEHN
COc1ccc(Br)c(CNCC2CC(O)C2)c1	ZINC000091524388	193068683	/nfs/dbraw/zinc/06/86/83/193068683.db2.gz	CWLDEDCAMAKYGL-UHFFFAOYSA-N	0	3	300.196	2.318	10	0		DEAEHN
Cc1csc([C@H]2CCCN([C@@H](C)CN3CCOCC3)C2)n1	ZINC000091552664	193072285	/nfs/dbraw/zinc/07/22/85/193072285.db2.gz	OJQJBFMXZLLYAW-GJZGRUSLSA-N	0	3	309.479	2.352	10	0		DEAEHN
c1ccc2c(c1)CN(c1ccnc(N3CCN4CCC3CC4)n1)C2	ZINC000624150115	365308548	/nfs/dbraw/zinc/30/85/48/365308548.db2.gz	QTABSZMQTOZJIM-UHFFFAOYSA-N	0	3	321.428	2.281	10	0		DEAEHN
Cc1cc([C@H](N)[C@@H]2CCS(=O)(=O)C2)ccc1Br	ZINC000091474283	193061015	/nfs/dbraw/zinc/06/10/15/193061015.db2.gz	GHIDKBRZSYKJKC-PWSUYJOCSA-N	0	3	318.236	2.192	10	0		DEAEHN
CN[C@H](c1ccc(F)c(F)c1F)[C@@H]1CN2CCC[C@@H]2CO1	ZINC000091721333	193097206	/nfs/dbraw/zinc/09/72/06/193097206.db2.gz	IGAXDHLQPVNMDD-MURWCNHISA-N	0	3	300.324	2.228	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@H]1O)c1cc(Br)ccc1F	ZINC000624236566	365345151	/nfs/dbraw/zinc/34/51/51/365345151.db2.gz	FREHELGYWAWVKX-AQUOVQTQSA-N	0	3	318.186	2.389	10	0		DEAEHN
CC(C)O[C@@H](C(=O)NCCNc1ccncc1)c1ccccc1	ZINC000449813709	241115872	/nfs/dbraw/zinc/11/58/72/241115872.db2.gz	INUDMTLGZCHASZ-QGZVFWFLSA-N	0	3	313.401	2.198	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)ccc1C	ZINC000092113768	193161383	/nfs/dbraw/zinc/16/13/83/193161383.db2.gz	SKVCEGWETSCYBZ-KBPBESRZSA-N	0	3	310.463	2.381	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)ccc1F	ZINC000092113604	193161644	/nfs/dbraw/zinc/16/16/44/193161644.db2.gz	DTLVLHIJBMYBGX-RYUDHWBXSA-N	0	3	314.426	2.212	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N(C)[C@H](C)CC)c(F)c1	ZINC000092115627	193163316	/nfs/dbraw/zinc/16/33/16/193163316.db2.gz	LTHAZABOZVQBKM-LLVKDONJSA-N	0	3	302.415	2.354	10	0		DEAEHN
CCN(CC)S(=O)(=O)c1ccc(CNC(C)C)cc1F	ZINC000092115468	193163355	/nfs/dbraw/zinc/16/33/55/193163355.db2.gz	FXMQTOMNQXZABQ-UHFFFAOYSA-N	0	3	302.415	2.354	10	0		DEAEHN
CC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@@H]2CC2(C)C)c(F)c1	ZINC000092116020	193164552	/nfs/dbraw/zinc/16/45/52/193164552.db2.gz	SVIBOAOGQUORMH-CYBMUJFWSA-N	0	3	300.399	2.012	10	0		DEAEHN
CC(C)N(CC1CC1)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115969	193164682	/nfs/dbraw/zinc/16/46/82/193164682.db2.gz	GASTVWQFKBHNLE-UHFFFAOYSA-N	0	3	300.399	2.094	10	0		DEAEHN
O[C@@H]1CCOC[C@H]1N[C@H]1CCc2sc(Br)cc21	ZINC000631750784	368369722	/nfs/dbraw/zinc/36/97/22/368369722.db2.gz	MIQBJLUPXBUZBP-IVZWLZJFSA-N	0	3	318.236	2.237	10	0		DEAEHN
COC[C@H](O)CN(C)Cc1cc(C)c(Br)s1	ZINC000092256178	193182086	/nfs/dbraw/zinc/18/20/86/193182086.db2.gz	OMYSVBGYJYOOOJ-SECBINFHSA-N	0	3	308.241	2.258	10	0		DEAEHN
CCN(CC(C)(C)O)[C@@H](C)C(=O)Nc1ccc(Cl)c(N)c1	ZINC000092965214	193189859	/nfs/dbraw/zinc/18/98/59/193189859.db2.gz	KSUPWOXQTSNFBM-JTQLQIEISA-N	0	3	313.829	2.342	10	0		DEAEHN
Cc1cccc(Oc2ccc(NC(=O)[C@@H]3C[C@H](O)CN3)cc2)c1	ZINC000262557974	203330541	/nfs/dbraw/zinc/33/05/41/203330541.db2.gz	VLQIKYFWUYPBNL-YOEHRIQHSA-N	0	3	312.369	2.449	10	0		DEAEHN
CCCN[C@H](Cc1c(Cl)c(C)nn1CC)C(OC)OC	ZINC000093305612	193227413	/nfs/dbraw/zinc/22/74/13/193227413.db2.gz	LJVXHTREFLNUOP-LLVKDONJSA-N	0	3	303.834	2.394	10	0		DEAEHN
NC(=O)[C@]1(N)CCC[C@H]1CCSc1ccc(F)cc1F	ZINC000093627351	193276254	/nfs/dbraw/zinc/27/62/54/193276254.db2.gz	YFXKLOUXVGYQGL-XPTSAGLGSA-N	0	3	300.374	2.430	10	0		DEAEHN
CC[C@@H](CO)N1CCN(C/C=C/c2ccccc2OC)CC1	ZINC000093740095	193298762	/nfs/dbraw/zinc/29/87/62/193298762.db2.gz	CFLXQNUAEGALFY-JKNJVXJCSA-N	0	3	304.434	2.097	10	0		DEAEHN
CC[C@@H](CO)N1CCN(Cc2ccc(F)c(Cl)c2)CC1	ZINC000093739903	193298875	/nfs/dbraw/zinc/29/88/75/193298875.db2.gz	QFBXJIAYRUTKNU-ZDUSSCGKSA-N	0	3	300.805	2.368	10	0		DEAEHN
CCOC(=O)[C@]1(N)CC[C@H](N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000093831898	193314638	/nfs/dbraw/zinc/31/46/38/193314638.db2.gz	DEPLTBTXVPMNKF-GVXVVHGQSA-N	0	3	308.344	2.074	10	0		DEAEHN
CCOC(=O)[C@]1(N)CC[C@@H](N2CCC(C(F)(F)F)CC2)C1	ZINC000093831934	193315308	/nfs/dbraw/zinc/31/53/08/193315308.db2.gz	FATSYPAJORRTNC-YPMHNXCESA-N	0	3	308.344	2.074	10	0		DEAEHN
COc1ccccc1S[C@H]1CC[C@@](NC2CC2)(C(N)=O)C1	ZINC000093851856	193318619	/nfs/dbraw/zinc/31/86/19/193318619.db2.gz	IFOUAXFZJRBZAN-LRDDRELGSA-N	0	3	306.431	2.316	10	0		DEAEHN
CN[C@@H](c1ccccc1C(F)(F)F)[C@H]1CN(C)CCN1C	ZINC000093894705	193325496	/nfs/dbraw/zinc/32/54/96/193325496.db2.gz	QACYFNSDJBGOEE-KGLIPLIRSA-N	0	3	301.356	2.212	10	0		DEAEHN
CCNC(=O)[C@@H](C)Oc1c(F)cc(CNC(C)C)cc1F	ZINC000094347339	193363354	/nfs/dbraw/zinc/36/33/54/193363354.db2.gz	LBJVTIVVPGBITR-SNVBAGLBSA-N	0	3	300.349	2.366	10	0		DEAEHN
CCN(CC)C(=O)[C@@H](C)Oc1c(F)cc(CNC)cc1F	ZINC000094346354	193363553	/nfs/dbraw/zinc/36/35/53/193363553.db2.gz	FJOJUHPSMMESMM-SNVBAGLBSA-N	0	3	300.349	2.320	10	0		DEAEHN
Nc1cc(Br)ccc1CN[C@@H]1CCN(C2CC2)C1	ZINC000094047798	193341648	/nfs/dbraw/zinc/34/16/48/193341648.db2.gz	ADXBPJZDXMPGDG-GFCCVEGCSA-N	0	3	310.239	2.358	10	0		DEAEHN
CN[C@@H]1COC[C@H]1c1nc(-c2ncc(Cl)cc2Cl)no1	ZINC000094199325	193348699	/nfs/dbraw/zinc/34/86/99/193348699.db2.gz	LVJLRYQEIPGZKS-VXNVDRBHSA-N	0	3	315.160	2.140	10	0		DEAEHN
CCS(=O)(=O)CCC[C@@H](N)c1ccc(C(F)(F)F)cn1	ZINC000097218211	193693818	/nfs/dbraw/zinc/69/38/18/193693818.db2.gz	NJNUWSHDTNSTFL-SNVBAGLBSA-N	0	3	310.341	2.315	10	0		DEAEHN
CC(C)N(CCN(C)C)C(=O)c1ncsc1Br	ZINC000288515089	220191403	/nfs/dbraw/zinc/19/14/03/220191403.db2.gz	CGDTZNQHTKBXPQ-UHFFFAOYSA-N	0	3	320.256	2.318	10	0		DEAEHN
C[C@@H]1CN([C@H](CN)c2ccccc2OC(F)F)C[C@@H](C)O1	ZINC000019803237	182151712	/nfs/dbraw/zinc/15/17/12/182151712.db2.gz	YTYCUDHPYYWDSF-NQBHXWOUSA-N	0	3	300.349	2.397	10	0		DEAEHN
NC[C@@H](c1ccc(Br)cc1)N1CCSCC1	ZINC000020257084	182200835	/nfs/dbraw/zinc/20/08/35/182200835.db2.gz	UXLABRDIVJMMIM-LBPRGKRZSA-N	0	3	301.253	2.498	10	0		DEAEHN
CCCC[C@H](NCCNS(C)(=O)=O)c1ccc(F)cc1	ZINC000021013794	182260553	/nfs/dbraw/zinc/26/05/53/182260553.db2.gz	BFVXFIZORLNKJH-AWEZNQCLSA-N	0	3	302.415	2.196	10	0		DEAEHN
C[C@@H]1CN([C@H](CN)c2ccc(Br)o2)C[C@H](C)O1	ZINC000022215195	182313597	/nfs/dbraw/zinc/31/35/97/182313597.db2.gz	RQKWILGPCSQRSX-KXUCPTDWSA-N	0	3	303.200	2.151	10	0		DEAEHN
C[C@@H](CNCc1ccc(Br)cc1F)[S@@](C)=O	ZINC000159809090	197366712	/nfs/dbraw/zinc/36/67/12/197366712.db2.gz	CJSAOKZXCOLHHC-PWJLMRLQSA-N	0	3	308.216	2.445	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N(C)[C@@H]2CCN(C(C)C)C2)c1	ZINC000457841040	248040613	/nfs/dbraw/zinc/04/06/13/248040613.db2.gz	HFISIQWIAOCERW-MRXNPFEDSA-N	0	3	318.417	2.336	10	0		DEAEHN
COC[C@H](NC(=O)NC(C)(C)CN(C)C)c1ccc(F)cc1	ZINC000458466934	248325255	/nfs/dbraw/zinc/32/52/55/248325255.db2.gz	MRRNOFNUPKBBCX-AWEZNQCLSA-N	0	3	311.401	2.153	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cc(Br)cn2C)C1	ZINC000040503697	183084650	/nfs/dbraw/zinc/08/46/50/183084650.db2.gz	QHVVIPIUUAWPQT-NSHDSACASA-N	0	3	314.227	2.002	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2ccc3nc(SC)sc3c2)C1	ZINC000040632873	183111359	/nfs/dbraw/zinc/11/13/59/183111359.db2.gz	DMRXGIXEPTWSJK-KOLCDFICSA-N	0	3	323.443	2.334	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2c3ncsc3ccc2Cl)C1	ZINC000040632735	183111822	/nfs/dbraw/zinc/11/18/22/183111822.db2.gz	JEDIJPLIOFRBRF-APPZFPTMSA-N	0	3	311.794	2.265	10	0		DEAEHN
CCN1CCN(CCNc2ccc(Br)cc2)CC1	ZINC000041563171	183203055	/nfs/dbraw/zinc/20/30/55/183203055.db2.gz	XADLJVJVJGGGIO-UHFFFAOYSA-N	0	3	312.255	2.499	10	0		DEAEHN
COC(=O)Cc1c(C)nc2ccc(F)cc2c1NCCN(C)C	ZINC000041473519	183192936	/nfs/dbraw/zinc/19/29/36/183192936.db2.gz	HFTKCOKTWGUJJC-UHFFFAOYSA-N	0	3	319.380	2.371	10	0		DEAEHN
CC(C)(C)NC(=O)COc1c(Br)cccc1CN	ZINC000042411357	183265515	/nfs/dbraw/zinc/26/55/15/183265515.db2.gz	JOFLMNBQOXGGRC-UHFFFAOYSA-N	0	3	315.211	2.201	10	0		DEAEHN
CNCc1cccc(Br)c1OCc1nccn1C	ZINC000042411585	183265799	/nfs/dbraw/zinc/26/57/99/183265799.db2.gz	FGIIBMWHVBMPKA-UHFFFAOYSA-N	0	3	310.195	2.481	10	0		DEAEHN
CC(C)N(CCCO)[C@@H](C)C(=O)Nc1ccc(Cl)c(N)c1	ZINC000042482945	183275562	/nfs/dbraw/zinc/27/55/62/183275562.db2.gz	LEBPKTKAJNXWSY-NSHDSACASA-N	0	3	313.829	2.342	10	0		DEAEHN
CCN(CCOC)[C@H](CN)c1ccccc1Br	ZINC000042492641	183276379	/nfs/dbraw/zinc/27/63/79/183276379.db2.gz	CIWHYFNGVBATME-CYBMUJFWSA-N	0	3	301.228	2.417	10	0		DEAEHN
COC[C@H](O)CN(C)c1cccc(Cl)c1CNC(C)C	ZINC000042511615	183278407	/nfs/dbraw/zinc/27/84/07/183278407.db2.gz	IMMQKLBESXQFPX-GFCCVEGCSA-N	0	3	300.830	2.282	10	0		DEAEHN
CCN(CC(F)(F)F)[C@@H](C)C(=O)Nc1ccccc1CN	ZINC000042739559	183303856	/nfs/dbraw/zinc/30/38/56/183303856.db2.gz	GVCKYLMWCSFESA-JTQLQIEISA-N	0	3	303.328	2.357	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)cc1)N(C)CC(=O)NC1CC1	ZINC000042945175	183320087	/nfs/dbraw/zinc/32/00/87/183320087.db2.gz	WPAXAGKPHJSHCY-GDBMZVCRSA-N	0	3	309.841	2.329	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccc(Cl)s1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043252785	183348307	/nfs/dbraw/zinc/34/83/07/183348307.db2.gz	JIQRBIHCLCHNPY-BREBYQMCSA-N	0	3	315.870	2.342	10	0		DEAEHN
NC[C@@H](c1ccc(Br)s1)N1CCC(CO)CC1	ZINC000043259490	183349174	/nfs/dbraw/zinc/34/91/74/183349174.db2.gz	ZQOPPFBXSZPRBO-JTQLQIEISA-N	0	3	319.268	2.215	10	0		DEAEHN
N[C@@H](c1ccc(Br)cc1F)[C@@H]1CCS(=O)(=O)C1	ZINC000043299833	183351507	/nfs/dbraw/zinc/35/15/07/183351507.db2.gz	XABPTPWGEBQVHZ-RDDDGLTNSA-N	0	3	322.199	2.023	10	0		DEAEHN
N[C@H](c1cc(Br)ccc1F)[C@@H]1CCS(=O)(=O)C1	ZINC000043299754	183351617	/nfs/dbraw/zinc/35/16/17/183351617.db2.gz	XLFFUEWUIFDXEZ-HQJQHLMTSA-N	0	3	322.199	2.023	10	0		DEAEHN
COCCN(CCOC)[C@H](CN)c1ccc(Cl)c(F)c1	ZINC000043390389	183358327	/nfs/dbraw/zinc/35/83/27/183358327.db2.gz	DYBQGKNKJZUDQM-CQSZACIVSA-N	0	3	304.793	2.074	10	0		DEAEHN
CCN[C@H](C)c1cccc(S(=O)(=O)N[C@@H](C)COCC)c1	ZINC000044728259	183436018	/nfs/dbraw/zinc/43/60/18/183436018.db2.gz	VGLFSSWRPSVPPX-QWHCGFSZSA-N	0	3	314.451	2.060	10	0		DEAEHN
N[C@@H]1C[C@H]1NC(=O)c1cc(C(F)(F)F)ccc1Br	ZINC000159797986	197365030	/nfs/dbraw/zinc/36/50/30/197365030.db2.gz	QXVOUSCJPBAULR-RKDXNWHRSA-N	0	3	323.112	2.297	10	0		DEAEHN
CCCN[C@H](CN(CCOC)C(CC)CC)C(=O)OCC	ZINC000045426726	183507064	/nfs/dbraw/zinc/50/70/64/183507064.db2.gz	FTJAJIYLJOAHOT-OAHLLOKOSA-N	0	3	302.459	2.055	10	0		DEAEHN
CC(C)[NH2+]CCCS(=O)(=O)[N-]c1cccc2ncccc12	ZINC000105235800	194087817	/nfs/dbraw/zinc/08/78/17/194087817.db2.gz	QUMJPLLCSBXGMA-UHFFFAOYSA-N	0	3	307.419	2.365	10	0		DEAEHN
CC[C@H]1CN(CCCOc2ccccc2)CCN1C[C@@H](C)O	ZINC000105825905	194138322	/nfs/dbraw/zinc/13/83/22/194138322.db2.gz	OQNBXYLOEBMZOT-SJORKVTESA-N	0	3	306.450	2.233	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)Nc2ccc(F)c(F)c2)c1	ZINC000105881476	194155751	/nfs/dbraw/zinc/15/57/51/194155751.db2.gz	BTMWEFNVDUYESJ-LLVKDONJSA-N	0	3	308.332	2.087	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc(OC)c(F)c2)CCN1C[C@@H](C)O	ZINC000106104136	194186232	/nfs/dbraw/zinc/18/62/32/194186232.db2.gz	AOZAPRVCUUATBY-UKRRQHHQSA-N	0	3	310.413	2.111	10	0		DEAEHN
CCOCCN1CCN(Cc2cn3ccccc3n2)C[C@@H]1CC	ZINC000106117146	194188158	/nfs/dbraw/zinc/18/81/58/194188158.db2.gz	NVHMPOKSIUJLMS-KRWDZBQOSA-N	0	3	316.449	2.267	10	0		DEAEHN
CO[C@H]1C[C@@H](CN(C)C(=O)c2cc3ccc(C)cc3[nH]2)N(C)C1	ZINC000285266596	218358714	/nfs/dbraw/zinc/35/87/14/218358714.db2.gz	PMOXRIIETGEYIC-GJZGRUSLSA-N	0	3	315.417	2.267	10	0		DEAEHN
CCNC(=O)NC(=O)CN[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000050273691	183781310	/nfs/dbraw/zinc/78/13/10/183781310.db2.gz	SIBHZTAMTSDNMR-AWEZNQCLSA-N	0	3	309.797	2.226	10	0		DEAEHN
C[C@H](N)c1cccc(S(=O)(=O)N2Cc3ccccc3C2)c1	ZINC000050912705	183807522	/nfs/dbraw/zinc/80/75/22/183807522.db2.gz	HMQNHJSFHDABHQ-LBPRGKRZSA-N	0	3	302.399	2.411	10	0		DEAEHN
CCOCCN1CCN(Cc2ncc(C)c(OC)c2C)C[C@@H]1C	ZINC000110031110	194304182	/nfs/dbraw/zinc/30/41/82/194304182.db2.gz	AZDQDFDQSZKMIL-HNNXBMFYSA-N	0	3	321.465	2.250	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)s1)N1CCNC(=O)C1(C)C	ZINC000110653436	194347351	/nfs/dbraw/zinc/34/73/51/194347351.db2.gz	VOGLDRVZSSVPFY-SKDRFNHKSA-N	0	3	315.870	2.390	10	0		DEAEHN
COCCCN(C)[C@H](CN)c1ccc(OC)c(OC)c1Cl	ZINC000110829642	194362625	/nfs/dbraw/zinc/36/26/25/194362625.db2.gz	AWLPSYDTQUBBKU-GFCCVEGCSA-N	0	3	316.829	2.325	10	0		DEAEHN
CSC(C)(C)CNS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000157463967	197189500	/nfs/dbraw/zinc/18/95/00/197189500.db2.gz	DGVNXVQURAXHNI-UHFFFAOYSA-N	0	3	320.480	2.198	10	0		DEAEHN
CSC(C)(C)C[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000157463967	197189501	/nfs/dbraw/zinc/18/95/01/197189501.db2.gz	DGVNXVQURAXHNI-UHFFFAOYSA-N	0	3	320.480	2.198	10	0		DEAEHN
CNC(=O)C[C@@H](C)NCc1ccc(Br)c(F)c1	ZINC000269023772	207173545	/nfs/dbraw/zinc/17/35/45/207173545.db2.gz	QFZMRZDOWMZYRN-MRVPVSSYSA-N	0	3	303.175	2.202	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(N[C@H](C)CN2CCCC2)n1	ZINC000061539164	184172918	/nfs/dbraw/zinc/17/29/18/184172918.db2.gz	XVFXWHWAJSDKTM-LLVKDONJSA-N	0	3	312.849	2.267	10	0		DEAEHN
CCCOc1nc(Cl)nc(N(C)C2CCN(CC)CC2)n1	ZINC000061540293	184173399	/nfs/dbraw/zinc/17/33/99/184173399.db2.gz	KUODZUCJZPFYDO-UHFFFAOYSA-N	0	3	313.833	2.234	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)C1(C(N)=S)CCCCCC1	ZINC000061646157	184180974	/nfs/dbraw/zinc/18/09/74/184180974.db2.gz	YCMHPXJJOWSYIC-CYBMUJFWSA-N	0	3	311.495	2.166	10	0		DEAEHN
COCC[C@@H](N)C(=O)Nc1cc(Br)ccc1Cl	ZINC000061692423	184183580	/nfs/dbraw/zinc/18/35/80/184183580.db2.gz	DKHYUJQRNMBCTQ-SECBINFHSA-N	0	3	321.602	2.405	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1ccc(Br)cn1	ZINC000061874616	184191758	/nfs/dbraw/zinc/19/17/58/184191758.db2.gz	YRUWHSAVBWGEGF-LLVKDONJSA-N	0	3	312.211	2.010	10	0		DEAEHN
CCN[C@H](C)c1cccc(S(=O)(=O)N(C)CCCOC)c1	ZINC000062037793	184203147	/nfs/dbraw/zinc/20/31/47/184203147.db2.gz	XRRYCISDYIRWHC-CYBMUJFWSA-N	0	3	314.451	2.014	10	0		DEAEHN
COCCN1C(=O)C[C@H](N)[C@@H]1c1c(Cl)cccc1Cl	ZINC000062210264	184220689	/nfs/dbraw/zinc/22/06/89/184220689.db2.gz	FCMGBGIVIDXCLS-GXFFZTMASA-N	0	3	303.189	2.241	10	0		DEAEHN
CC(C)N[C@H](CCOc1ccccc1C(F)(F)F)C(N)=O	ZINC000062546972	184242095	/nfs/dbraw/zinc/24/20/95/184242095.db2.gz	AKXWIXGAEYFWTQ-LLVKDONJSA-N	0	3	304.312	2.326	10	0		DEAEHN
CN(Cc1nccn1C)c1nc2c(s1)[C@@H](N)CC(C)(C)C2	ZINC000062327856	184230870	/nfs/dbraw/zinc/23/08/70/184230870.db2.gz	UFFGMAAFKKNXRB-JTQLQIEISA-N	0	3	305.451	2.485	10	0		DEAEHN
CCN[C@H](C)c1ccc(F)cc1O[C@H]1CCS(=O)(=O)C1	ZINC000062746697	184251776	/nfs/dbraw/zinc/25/17/76/184251776.db2.gz	DUDKALOEFQQUFK-PWSUYJOCSA-N	0	3	301.383	2.062	10	0		DEAEHN
CCCNCc1cccc(OC)c1OCCCS(C)(=O)=O	ZINC000063014386	184266664	/nfs/dbraw/zinc/26/66/64/184266664.db2.gz	JMNQXJCUIROOMP-UHFFFAOYSA-N	0	3	315.435	2.008	10	0		DEAEHN
CNc1nc(CN(C)CCN2CCCC2)nc2sccc21	ZINC000063053387	184268657	/nfs/dbraw/zinc/26/86/57/184268657.db2.gz	PZCWABGQZYZACN-UHFFFAOYSA-N	0	3	305.451	2.261	10	0		DEAEHN
CC[C@@H](C)NCC(=O)Nc1cccc(C(=O)N(CC)CC)c1	ZINC000066068122	184386549	/nfs/dbraw/zinc/38/65/49/184386549.db2.gz	CFESLRXYCJDFOT-CYBMUJFWSA-N	0	3	305.422	2.495	10	0		DEAEHN
CNCC(=O)Nc1ccc(C(=O)N[C@@H](C)c2ccccc2)cc1	ZINC000066225876	184397887	/nfs/dbraw/zinc/39/78/87/184397887.db2.gz	HSMAJHVCTRIOQT-ZDUSSCGKSA-N	0	3	311.385	2.336	10	0		DEAEHN
CCNCC(=O)Nc1ccc(C(=O)NCc2ccccc2)cc1	ZINC000066225778	184398019	/nfs/dbraw/zinc/39/80/19/184398019.db2.gz	VLRGBCMWCNHJKJ-UHFFFAOYSA-N	0	3	311.385	2.165	10	0		DEAEHN
Cc1cc(C)c2c(c1)[C@H](NC[C@H]1CN(C)CCO1)CCCO2	ZINC000180493112	291836769	/nfs/dbraw/zinc/83/67/69/291836769.db2.gz	GUSRVZFLBXYCCT-DOTOQJQBSA-N	0	3	304.434	2.437	10	0		DEAEHN
CCC[C@H](C(=O)NCCCc1ccc(OC)c(OC)c1)N(C)C	ZINC000120108282	195098008	/nfs/dbraw/zinc/09/80/08/195098008.db2.gz	IAJVCBMDYUTQKT-OAHLLOKOSA-N	0	3	322.449	2.483	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCC[C@@H](C)[C@@H]2C)cc(CN)c1F	ZINC000159104610	197327485	/nfs/dbraw/zinc/32/74/85/197327485.db2.gz	KYCBQTNBQYECIF-PWSUYJOCSA-N	0	3	314.426	2.402	10	0		DEAEHN
CN(C1CC1)S(=O)(=O)c1ccc(F)c(CNC(C)(C)C)c1	ZINC000159061540	197324080	/nfs/dbraw/zinc/32/40/80/197324080.db2.gz	CYYAGWNLWLVTGF-UHFFFAOYSA-N	0	3	314.426	2.497	10	0		DEAEHN
CCN(C)S(=O)(=O)c1cc(C)c(F)c(CNC(C)C)c1	ZINC000159060167	197323828	/nfs/dbraw/zinc/32/38/28/197323828.db2.gz	AGXHFPSZFHUVDI-UHFFFAOYSA-N	0	3	302.415	2.273	10	0		DEAEHN
CCCNCc1cc(S(=O)(=O)N(C)CC)cc(C)c1F	ZINC000159059845	197324019	/nfs/dbraw/zinc/32/40/19/197324019.db2.gz	GUFSIUJKIGXBKI-UHFFFAOYSA-N	0	3	302.415	2.274	10	0		DEAEHN
CN[C@H](Cc1ccc(OC)c(Br)c1)c1cn[nH]n1	ZINC000158875999	197308051	/nfs/dbraw/zinc/30/80/51/197308051.db2.gz	RAVXMYOJXZFHJN-SNVBAGLBSA-N	0	3	311.183	2.079	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)c1ccccc1C)[C@H]1CCOC1	ZINC000158829370	197304831	/nfs/dbraw/zinc/30/48/31/197304831.db2.gz	WCKVQINBLONLTJ-GJZGRUSLSA-N	0	3	311.447	2.173	10	0		DEAEHN
CCN[C@H](c1c(Br)cnn1CCOC)C1CC1	ZINC000158769505	197300267	/nfs/dbraw/zinc/30/02/67/197300267.db2.gz	OGOBYJRHBUYYJC-NSHDSACASA-N	0	3	302.216	2.353	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)c1ccc(N(C)C)cc1F	ZINC000158023251	197236340	/nfs/dbraw/zinc/23/63/40/197236340.db2.gz	JHWWBVUGURLQCP-CYBMUJFWSA-N	0	3	307.413	2.496	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)C2(C(N)=S)CCCCCC2)CCN1C	ZINC000157998945	197233818	/nfs/dbraw/zinc/23/38/18/197233818.db2.gz	RANYRRVJPMRLML-OLZOCXBDSA-N	0	3	311.495	2.212	10	0		DEAEHN
CCOCCN(C)[C@H](CN)c1ccccc1Br	ZINC000157696403	197209088	/nfs/dbraw/zinc/20/90/88/197209088.db2.gz	YRKRMLYGEOHODB-CYBMUJFWSA-N	0	3	301.228	2.417	10	0		DEAEHN
CCn1ncc(Br)c1[C@H](O)[C@@](C)(CC)N(C)C	ZINC000157612156	197201730	/nfs/dbraw/zinc/20/17/30/197201730.db2.gz	UAYRGPLNNQTYCB-NWDGAFQWSA-N	0	3	304.232	2.429	10	0		DEAEHN
CC[C@H]1CN([C@@H](CN)c2ccc3c(c2)OCCO3)CCS1	ZINC000157406254	197185325	/nfs/dbraw/zinc/18/53/25/197185325.db2.gz	SWEHBSMPAZLSRR-KBPBESRZSA-N	0	3	308.447	2.285	10	0		DEAEHN
COC[C@@H](C)NCCOc1c(Br)cccc1OC	ZINC000157291040	197177487	/nfs/dbraw/zinc/17/74/87/197177487.db2.gz	ANCHNPZRKLEHBR-SNVBAGLBSA-N	0	3	318.211	2.461	10	0		DEAEHN
C/C(=C\c1c(Br)c(C)nn1C)C[C@@H]1COCCN1	ZINC000157354125	197181752	/nfs/dbraw/zinc/18/17/52/197181752.db2.gz	HOUPPYNUBBMIEG-MXMFLMJRSA-N	0	3	314.227	2.273	10	0		DEAEHN
CC(C)OCCN(C)CCOc1ccc(CC(N)=S)cc1	ZINC000157254385	197173866	/nfs/dbraw/zinc/17/38/66/197173866.db2.gz	IHWXZVSQPYYWGJ-UHFFFAOYSA-N	0	3	310.463	2.251	10	0		DEAEHN
C[C@@](O)(Cc1cc(Br)cs1)C[C@@H]1COCCN1	ZINC000156923413	197150401	/nfs/dbraw/zinc/15/04/01/197150401.db2.gz	IHLYWHBCVRYCPL-PWSUYJOCSA-N	0	3	320.252	2.183	10	0		DEAEHN
CN[C@H](C)c1cccc(S(=O)(=O)NCC(C)(C)SC)c1	ZINC000156875196	197146454	/nfs/dbraw/zinc/14/64/54/197146454.db2.gz	FKNZISUPTBFIIS-LLVKDONJSA-N	0	3	316.492	2.387	10	0		DEAEHN
C[C@](O)(Cc1ccc(Br)s1)C[C@@H]1COCCN1	ZINC000156804654	197141870	/nfs/dbraw/zinc/14/18/70/197141870.db2.gz	NSPDCQQVNNTSJZ-BXKDBHETSA-N	0	3	320.252	2.183	10	0		DEAEHN
COC(=O)Nc1cccc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000155299848	197041968	/nfs/dbraw/zinc/04/19/68/197041968.db2.gz	YKZBUHVVHQPNEV-DOMZBBRYSA-N	0	3	319.405	2.323	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@H]1CC(=O)Nc2ccccc21	ZINC000245423579	285238288	/nfs/dbraw/zinc/23/82/88/285238288.db2.gz	BNCKJMCNLNUZSI-HIFRSBDPSA-N	0	3	315.417	2.055	10	0		DEAEHN
CC[C@H]1CN(Cc2cccc3[nH]ccc32)CCN1C[C@@H](C)O	ZINC000120764654	195232602	/nfs/dbraw/zinc/23/26/02/195232602.db2.gz	HEUIZFTUTMCJIY-ZBFHGGJFSA-N	0	3	301.434	2.445	10	0		DEAEHN
Cc1ccc(CN2CC[C@@H]3C[C@@H](C(=O)N(C)C)O[C@H]3C2)cc1	ZINC000248006314	257111327	/nfs/dbraw/zinc/11/13/27/257111327.db2.gz	OPYWWESFLLSLCI-IKGGRYGDSA-N	0	3	302.418	2.063	10	0		DEAEHN
c1cc(CN2C[C@H]3COC[C@@]3(COCC3CCOCC3)C2)co1	ZINC000247829404	257117411	/nfs/dbraw/zinc/11/74/11/257117411.db2.gz	HCRYIIHPTJJLHT-ROUUACIJSA-N	0	3	321.417	2.171	10	0		DEAEHN
COC[C@H](C)CNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245663995	285336792	/nfs/dbraw/zinc/33/67/92/285336792.db2.gz	QKNPTPMAFPIPAA-KBMXLJTQSA-N	0	3	305.422	2.014	10	0		DEAEHN
O=C(CNCC1(O)CCC1)Nc1c(Cl)cccc1Cl	ZINC000127433908	195877027	/nfs/dbraw/zinc/87/70/27/195877027.db2.gz	YIYCOZXRICHHPI-UHFFFAOYSA-N	0	3	303.189	2.437	10	0		DEAEHN
NC1(C(=O)Nc2ccc(Br)cc2F)CCOCC1	ZINC000127703116	195902606	/nfs/dbraw/zinc/90/26/06/195902606.db2.gz	PEDVPUVYIWRUFU-UHFFFAOYSA-N	0	3	317.158	2.035	10	0		DEAEHN
COc1ccc(C(=O)NC[C@@H]2CCCN2C)c(OCC2CC2)c1	ZINC000188315719	533327561	/nfs/dbraw/zinc/32/75/61/533327561.db2.gz	ATBHSYCSOGMINA-AWEZNQCLSA-N	0	3	318.417	2.308	10	0		DEAEHN
CC1=CCN(CCNCc2cn(C)nc2-c2cccnc2)CC1	ZINC000358135349	133123610	/nfs/dbraw/zinc/12/36/10/133123610.db2.gz	JVOFPCPXBSYAPX-UHFFFAOYSA-N	0	3	311.433	2.224	10	0		DEAEHN
Cc1nn(C)c(C)c1CNCC[C@H]1COc2ccccc2O1	ZINC000360273117	133172594	/nfs/dbraw/zinc/17/25/94/133172594.db2.gz	FUTRQTJBDVNFQN-AWEZNQCLSA-N	0	3	301.390	2.357	10	0		DEAEHN
C[C@H]1CCOCCN1C[C@@H](O)COCc1ccccc1Cl	ZINC000362231998	133218486	/nfs/dbraw/zinc/21/84/86/133218486.db2.gz	ANUOXYPMOYFCGU-DZGCQCFKSA-N	0	3	313.825	2.328	10	0		DEAEHN
Cc1cccc(C)c1CCNC(=O)NCCNc1ccncc1	ZINC000362806454	133252277	/nfs/dbraw/zinc/25/22/77/133252277.db2.gz	DIZDIRAUCLOEKW-UHFFFAOYSA-N	0	3	312.417	2.074	10	0		DEAEHN
COc1cccc(N2CCC[C@H](NCc3[nH]ncc3C)C2=O)c1	ZINC000368091621	133260074	/nfs/dbraw/zinc/26/00/74/133260074.db2.gz	HBLWDYAEQRMVKV-HNNXBMFYSA-N	0	3	314.389	2.012	10	0		DEAEHN
NC[C@H](c1cccnc1)N1CCN(c2ccc(F)cc2)CC1	ZINC000019795952	134639056	/nfs/dbraw/zinc/63/90/56/134639056.db2.gz	VMNVODCRDWMYCU-QGZVFWFLSA-N	0	3	300.381	2.043	10	0		DEAEHN
CCc1ccc([C@H](C)NCC(=O)NC(=O)NCC(C)C)cc1	ZINC000120420003	144672150	/nfs/dbraw/zinc/67/21/50/144672150.db2.gz	XYYKJPZDFGHHRV-ZDUSSCGKSA-N	0	3	305.422	2.381	10	0		DEAEHN
O=C(CN[C@@H]1CCCC[C@H]1n1cccn1)NCc1cccs1	ZINC000128357263	144741155	/nfs/dbraw/zinc/74/11/55/144741155.db2.gz	FLVIBDCMXXELSA-HUUCEWRRSA-N	0	3	318.446	2.334	10	0		DEAEHN
C[C@@H]1CCC[C@H]1CC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000187660513	145001947	/nfs/dbraw/zinc/00/19/47/145001947.db2.gz	XHHNQBFTAHLQLT-SQNIBIBYSA-N	0	3	321.509	2.441	10	0		DEAEHN
O=C([C@H]1CCCO[C@@H]1c1ccccc1)N1CCN2CCC1CC2	ZINC000188624145	145014539	/nfs/dbraw/zinc/01/45/39/145014539.db2.gz	QTXAOLDTFAJWMG-ZWKOTPCHSA-N	0	3	314.429	2.461	10	0		DEAEHN
O=C([C@H]1C[C@@H]1c1ccc(F)c(F)c1)N1CCN2CCC1CC2	ZINC000188642060	145014924	/nfs/dbraw/zinc/01/49/24/145014924.db2.gz	QOABVIUMFLNYJS-KGLIPLIRSA-N	0	3	306.356	2.375	10	0		DEAEHN
Cn1cc(C(=O)N2CCN3CCC2CC3)c(-c2cccs2)n1	ZINC000188836378	145018632	/nfs/dbraw/zinc/01/86/32/145018632.db2.gz	VMWJQMBASZXGKT-UHFFFAOYSA-N	0	3	316.430	2.069	10	0		DEAEHN
CN(C)CCNC(=O)C1(c2ccccc2Br)CC1	ZINC000189606331	145030630	/nfs/dbraw/zinc/03/06/30/145030630.db2.gz	IIQTUFPHHWTEJJ-UHFFFAOYSA-N	0	3	311.223	2.159	10	0		DEAEHN
Cc1oncc1CN(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000189658574	145031960	/nfs/dbraw/zinc/03/19/60/145031960.db2.gz	OGPIJAPQJQQDBR-GOSISDBHSA-N	0	3	315.417	2.052	10	0		DEAEHN
c1ccc(CSCCN2CC[C@H](N3CCOCC3)C2)cc1	ZINC000192603153	145075629	/nfs/dbraw/zinc/07/56/29/145075629.db2.gz	UKXJMHHJHIVSFD-KRWDZBQOSA-N	0	3	306.475	2.326	10	0		DEAEHN
COCCCOCCN(C)Cc1ccc2c(c1)sc(=O)n2C	ZINC000192703226	145077752	/nfs/dbraw/zinc/07/77/52/145077752.db2.gz	YFWSUIKYHBSMJJ-UHFFFAOYSA-N	0	3	324.446	2.085	10	0		DEAEHN
CCOC(=O)CCN(C(=O)C1CCN(C2CC2)CC1)C(C)(C)C	ZINC000192812852	145079707	/nfs/dbraw/zinc/07/97/07/145079707.db2.gz	LCUWCKPGWPBBHD-UHFFFAOYSA-N	0	3	324.465	2.441	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(CC[C@H]3CCOC3=O)C2)c1	ZINC000246304434	145098247	/nfs/dbraw/zinc/09/82/47/145098247.db2.gz	BINZGKSOTUOFOR-UONOGXRCSA-N	0	3	319.401	2.446	10	0		DEAEHN
C[C@@H]1CN(C[C@@H](O)c2ccccc2Cl)C[C@H]1N1CCOCC1	ZINC000246325116	145098731	/nfs/dbraw/zinc/09/87/31/145098731.db2.gz	DIGOKKVIXAKSTA-KBRIMQKVSA-N	0	3	324.852	2.026	10	0		DEAEHN
COCc1csc(NC(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)n1	ZINC000246404617	145101685	/nfs/dbraw/zinc/10/16/85/145101685.db2.gz	LPPDFRBEGVSJDY-ZYHUDNBSSA-N	0	3	312.439	2.140	10	0		DEAEHN
C[C@H]1CN(CCOc2ccccc2Cl)C[C@H]1N1CCOCC1	ZINC000246406406	145102093	/nfs/dbraw/zinc/10/20/93/145102093.db2.gz	JSSNYZPTBKKBDB-GOEBONIOSA-N	0	3	324.852	2.371	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(-c3ccco3)on2)C1	ZINC000246538728	145105943	/nfs/dbraw/zinc/10/59/43/145105943.db2.gz	GIZROBYYAVGQCC-JSGCOSHPSA-N	0	3	315.373	2.491	10	0		DEAEHN
COc1cc(F)c(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1OC	ZINC000246672463	145109794	/nfs/dbraw/zinc/10/97/94/145109794.db2.gz	YNQNUWGYTYBKEJ-NEPJUHHUSA-N	0	3	322.380	2.152	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC[C@@H](n3cc(C)cn3)C2)C1	ZINC000247487917	145139055	/nfs/dbraw/zinc/13/90/55/145139055.db2.gz	LBIMDHKDFNDUFF-HZPDHXFCSA-N	0	3	319.453	2.022	10	0		DEAEHN
CN1CC[C@H](NC(=O)CC[C@H]2CCOC2)[C@H]1c1ccccc1	ZINC000247974353	145146647	/nfs/dbraw/zinc/14/66/47/145146647.db2.gz	GDVJKJBAPXNWAN-QILLFSRXSA-N	0	3	302.418	2.365	10	0		DEAEHN
O=S1(=O)CC[C@H](N[C@H]2CCO[C@@H](C3CC3)C2)c2ccccc21	ZINC000248546997	145157876	/nfs/dbraw/zinc/15/78/76/145157876.db2.gz	GAOOTMWSRJDSKK-CWRNSKLLSA-N	0	3	321.442	2.452	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccn(C)n1	ZINC000248816568	145168688	/nfs/dbraw/zinc/16/86/88/145168688.db2.gz	KZGARPMJNMYXNY-UKRRQHHQSA-N	0	3	313.405	2.062	10	0		DEAEHN
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1CCCCn1ccnc1C	ZINC000248849487	145169931	/nfs/dbraw/zinc/16/99/31/145169931.db2.gz	PTNYFNCCCGWDBZ-XHSDSOJGSA-N	0	3	305.422	2.245	10	0		DEAEHN
Cc1nc(CC(C)C)oc1C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000248876584	145171606	/nfs/dbraw/zinc/17/16/06/145171606.db2.gz	CVMFDUUSOUVZTA-TZMCWYRMSA-N	0	3	305.422	2.490	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2ccc(OCC3CC3)cc2)C[C@H]1C	ZINC000248912730	145173671	/nfs/dbraw/zinc/17/36/71/145173671.db2.gz	YPYOGQMKOYNXBH-CVEARBPZSA-N	0	3	318.461	2.362	10	0		DEAEHN
CCOCCN1CCN(C[C@@H](O)C2CCCCC2)C[C@H]1CC	ZINC000248988400	145174854	/nfs/dbraw/zinc/17/48/54/145174854.db2.gz	XOEHZBBZFAVTOS-QZTJIDSGSA-N	0	3	312.498	2.360	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN(CC(=O)N[C@H](C)C(C)C)C2)n1	ZINC000249884063	145191059	/nfs/dbraw/zinc/19/10/59/145191059.db2.gz	OKPHYCQVBYOKCX-CVEARBPZSA-N	0	3	318.465	2.285	10	0		DEAEHN
CN1CC[C@H](NC(=O)Cc2cncs2)[C@H]1c1ccccc1	ZINC000249969528	145191807	/nfs/dbraw/zinc/19/18/07/145191807.db2.gz	XKYNDNWKDVUKKU-GOEBONIOSA-N	0	3	301.415	2.247	10	0		DEAEHN
CN1CC[C@H](NC(=O)NO[C@H]2CCCCO2)[C@H]1c1ccccc1	ZINC000251890549	145196914	/nfs/dbraw/zinc/19/69/14/145196914.db2.gz	WXWKPQNWPFCZEB-HRCADAONSA-N	0	3	319.405	2.189	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2C2CC2)C1	ZINC000252006367	145198316	/nfs/dbraw/zinc/19/83/16/145198316.db2.gz	XQBLJXAOHSUBRC-JQHSSLGASA-N	0	3	313.445	2.408	10	0		DEAEHN
Cc1cccc(CS(=O)(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000252466272	145199337	/nfs/dbraw/zinc/19/93/37/145199337.db2.gz	WCMLPSAXYRMIRG-GDBMZVCRSA-N	0	3	310.463	2.143	10	0		DEAEHN
CN(Cc1cccc(F)c1)C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000261613266	145210492	/nfs/dbraw/zinc/21/04/92/145210492.db2.gz	BGFZMOGVKSKMJW-RVKKMQEKSA-N	0	3	320.408	2.317	10	0		DEAEHN
COc1cc(NC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)ccc1F	ZINC000261632096	145212349	/nfs/dbraw/zinc/21/23/49/145212349.db2.gz	DDJHQDNEQXSTFF-PZSREKOKSA-N	0	3	322.380	2.305	10	0		DEAEHN
CC(C)OCc1cccc(NC(=O)[C@H](N)C2CCOCC2)c1	ZINC000261647134	145213014	/nfs/dbraw/zinc/21/30/14/145213014.db2.gz	DWIMFYOWFZXZQT-MRXNPFEDSA-N	0	3	306.406	2.304	10	0		DEAEHN
COc1ccc(CN2CCNC[C@H]2c2cccnc2)c(OC)c1	ZINC000261732775	145221233	/nfs/dbraw/zinc/22/12/33/145221233.db2.gz	OKMCVRSRHFMMEB-KRWDZBQOSA-N	0	3	313.401	2.245	10	0		DEAEHN
C[C@@H](NC(=O)C1(N)CCOCC1)c1c(F)cccc1Cl	ZINC000261750668	145222632	/nfs/dbraw/zinc/22/26/32/145222632.db2.gz	FCOFOSWETNZTLK-SECBINFHSA-N	0	3	300.761	2.164	10	0		DEAEHN
Cn1c(CN2CCNC[C@@H]2c2cccnc2)nc2ccccc21	ZINC000261746017	145223006	/nfs/dbraw/zinc/22/30/06/145223006.db2.gz	NAPIJKGPAKBDRC-QGZVFWFLSA-N	0	3	307.401	2.115	10	0		DEAEHN
C[C@@H](NC(=O)C1(N)CCOCC1)c1ccc(F)c(Cl)c1	ZINC000261775129	145225019	/nfs/dbraw/zinc/22/50/19/145225019.db2.gz	GZODAFNVFXTCEF-SECBINFHSA-N	0	3	300.761	2.164	10	0		DEAEHN
CCc1ccc(CNC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)s1	ZINC000262419558	145282623	/nfs/dbraw/zinc/28/26/23/145282623.db2.gz	DWCDAQWKNKMCQB-GRDNDAEWSA-N	0	3	322.474	2.459	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)Nc1ccc(F)cc1F	ZINC000262498271	145288005	/nfs/dbraw/zinc/28/80/05/145288005.db2.gz	LSHAECINLLVCCZ-CKUKBARFSA-N	0	3	310.344	2.436	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H]2CC[NH2+][C@@H](C)C2)c(Cl)cc1F	ZINC000262763243	145304319	/nfs/dbraw/zinc/30/43/19/145304319.db2.gz	GNPORYCHMRLEEL-VHSXEESVSA-N	0	3	320.817	2.206	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2ccccc2OCC2CC2)n1	ZINC000263228093	145338732	/nfs/dbraw/zinc/33/87/32/145338732.db2.gz	NBMZIGOXAVTXRJ-CQSZACIVSA-N	0	3	314.389	2.102	10	0		DEAEHN
Cc1cn2c(n1)[C@@H](CNC(=O)[C@@H](C)N1CCCCCC1)CCC2	ZINC000332679256	145386502	/nfs/dbraw/zinc/38/65/02/145386502.db2.gz	GGHDTVJJYCDFTD-HZPDHXFCSA-N	0	3	318.465	2.450	10	0		DEAEHN
CCC1CCC(NC(=O)NC[C@H](C)CN2CCN(C)CC2)CC1	ZINC000073782006	401721970	/nfs/dbraw/zinc/72/19/70/401721970.db2.gz	LPTNZAPDMZODBE-GTPINHCMSA-N	0	3	324.513	2.138	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N([C@H](C)C1CC1)C1CC1	ZINC000074167318	401731624	/nfs/dbraw/zinc/73/16/24/401731624.db2.gz	MGKIAVDARJONTE-CJNGLKHVSA-N	0	3	309.454	2.070	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)NCc3ccccn3)cc2)CC1	ZINC000074165837	401731817	/nfs/dbraw/zinc/73/18/17/401731817.db2.gz	XPRPYOBULWCFRJ-UHFFFAOYSA-N	0	3	324.428	2.154	10	0		DEAEHN
Cc1cc(Br)ccc1NC(=O)C1(N)CCOCC1	ZINC000127701184	401746273	/nfs/dbraw/zinc/74/62/73/401746273.db2.gz	HFFQVONWNSACEC-UHFFFAOYSA-N	0	3	313.195	2.204	10	0		DEAEHN
c1cc(CN2CCCC[C@@H]2CN2CCOCC2)cc2c1OCC2	ZINC000111301807	401710190	/nfs/dbraw/zinc/71/01/90/401710190.db2.gz	CXDCMPBQWZFHJB-GOSISDBHSA-N	0	3	316.445	2.308	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)N[C@@H]1COc2ccccc21	ZINC000111481522	401716778	/nfs/dbraw/zinc/71/67/78/401716778.db2.gz	OYYHUGHORQMIBO-UKRRQHHQSA-N	0	3	303.406	2.294	10	0		DEAEHN
Cc1ccc([C@@H](CNC(=O)N(C)C[C@H]2CCCO2)N(C)C)cc1	ZINC000077007217	401802678	/nfs/dbraw/zinc/80/26/78/401802678.db2.gz	CVHHUGVHLIOKLV-IAGOWNOFSA-N	0	3	319.449	2.418	10	0		DEAEHN
CC(C)N1CCO[C@H](CN2CCN(CCC(C)(C)C)CC2)C1	ZINC000112697833	401754335	/nfs/dbraw/zinc/75/43/35/401754335.db2.gz	WPHJUIWPDKJROY-QGZVFWFLSA-N	0	3	311.514	2.149	10	0		DEAEHN
COc1ccc2nc(C(=O)NC[C@@H](C)N(C)C3CC3)ccc2c1	ZINC000075577846	401763026	/nfs/dbraw/zinc/76/30/26/401763026.db2.gz	RRTRQSVZGSQZNT-GFCCVEGCSA-N	0	3	313.401	2.456	10	0		DEAEHN
CCOc1cc(CNCCOCCO)cc(Cl)c1OCC	ZINC000010435724	401770296	/nfs/dbraw/zinc/77/02/96/401770296.db2.gz	KPBAWBFZRWFOAF-UHFFFAOYSA-N	0	3	317.813	2.236	10	0		DEAEHN
COc1ccc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c(OC)c1	ZINC000113232269	401771434	/nfs/dbraw/zinc/77/14/34/401771434.db2.gz	QPWWEFGHPZOSPZ-QWHCGFSZSA-N	0	3	304.390	2.013	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N[C@H](CO)CC(C)(C)C	ZINC000128435298	401776411	/nfs/dbraw/zinc/77/64/11/401776411.db2.gz	IQMIJVCEZBNOGK-KBPBESRZSA-N	0	3	301.475	2.059	10	0		DEAEHN
CC(C)(C)c1n[nH]cc1CN1CCC[C@H](Cn2cncn2)C1	ZINC000128497722	401779665	/nfs/dbraw/zinc/77/96/65/401779665.db2.gz	VBEQPNIJCNAGPZ-ZDUSSCGKSA-N	0	3	302.426	2.211	10	0		DEAEHN
Cc1cc(N2C[C@H]3OCCN(C)[C@@H]3C2)c2cc(F)ccc2n1	ZINC000130258819	401824974	/nfs/dbraw/zinc/82/49/74/401824974.db2.gz	OGCUVRDVLSXOSR-IAGOWNOFSA-N	0	3	301.365	2.202	10	0		DEAEHN
CCc1ccc([C@H](CNC(=O)N[C@@H](C)[C@@H](C)CO)N(C)C)cc1	ZINC000077753991	401828859	/nfs/dbraw/zinc/82/88/59/401828859.db2.gz	USJOHNIXSLDGIL-ZQIUZPCESA-N	0	3	321.465	2.168	10	0		DEAEHN
CCc1cc(NC(=O)N[C@H](CN(C)C)c2ccccc2)n(C)n1	ZINC000116507985	401853844	/nfs/dbraw/zinc/85/38/44/401853844.db2.gz	GCOZXFQMUGJMPI-OAHLLOKOSA-N	0	3	315.421	2.407	10	0		DEAEHN
COc1ccc2c3c1O[C@H]1C(=O)C[C@H](C)[C@H]4[C@@H](C2)N(C)CC[C@]314	ZINC000029463970	401856410	/nfs/dbraw/zinc/85/64/10/401856410.db2.gz	XENDXLLQEKTAFL-PMNSSUKJSA-N	0	3	313.397	2.179	10	0		DEAEHN
Cc1ccccc1[C@@H](C)CC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000116785125	401858384	/nfs/dbraw/zinc/85/83/84/401858384.db2.gz	KTKCLUZYBVIHNY-JKSUJKDBSA-N	0	3	304.434	2.278	10	0		DEAEHN
CC(C)COc1cccc(C(=O)N2CCO[C@@H](CN(C)C)C2)c1	ZINC000116798302	401859737	/nfs/dbraw/zinc/85/97/37/401859737.db2.gz	NMFJSVLLKSAMHR-KRWDZBQOSA-N	0	3	320.433	2.124	10	0		DEAEHN
C[C@@H](C(=O)N(CCN(C)C)Cc1ccccn1)C1CCOCC1	ZINC000132263654	401864419	/nfs/dbraw/zinc/86/44/19/401864419.db2.gz	OWFFWASYCOIDDA-OAHLLOKOSA-N	0	3	319.449	2.035	10	0		DEAEHN
CCCNC(=O)CCN[C@H](C)c1ccc(OC)c(NC(C)=O)c1	ZINC000129960969	401813138	/nfs/dbraw/zinc/81/31/38/401813138.db2.gz	MMQWMZOVMQCBMH-GFCCVEGCSA-N	0	3	321.421	2.221	10	0		DEAEHN
CCN(CCNC(=O)N1CCO[C@H](c2ccc(C)o2)C1)C1CC1	ZINC000119199503	401932555	/nfs/dbraw/zinc/93/25/55/401932555.db2.gz	CJXQFIMOVYLVRT-INIZCTEOSA-N	0	3	321.421	2.155	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCC1(c2cccc(F)c2)CC1	ZINC000119732706	401965088	/nfs/dbraw/zinc/96/50/88/401965088.db2.gz	ZJALQQZQKUWJRU-HNNXBMFYSA-N	0	3	305.397	2.251	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2ccc(C)c(OC)c2)C1	ZINC000119830852	401968150	/nfs/dbraw/zinc/96/81/50/401968150.db2.gz	HZGAKRARHNVWFH-INIZCTEOSA-N	0	3	319.449	2.330	10	0		DEAEHN
CCOc1ccc(NC(=O)CCN2CCN(C3CC3)CC2)cc1	ZINC000136766362	401973779	/nfs/dbraw/zinc/97/37/79/401973779.db2.gz	ROKZMEXIBADMNE-UHFFFAOYSA-N	0	3	317.433	2.194	10	0		DEAEHN
COc1ccccc1OCCC(=O)NCCN1CCCC[C@H]1C	ZINC000046859312	401974211	/nfs/dbraw/zinc/97/42/11/401974211.db2.gz	IVHCZIFBTJTJHJ-OAHLLOKOSA-N	0	3	320.433	2.455	10	0		DEAEHN
CC(C)c1noc(CCC(=O)NCCN2CCCC[C@@H]2C)n1	ZINC000046860527	401974268	/nfs/dbraw/zinc/97/42/68/401974268.db2.gz	FMBUPUJZPXBMOQ-ZDUSSCGKSA-N	0	3	308.426	2.116	10	0		DEAEHN
CCCN(CCC)C(=O)CN1CCC[C@@H](Cc2nccn2C)C1	ZINC000090004137	401978878	/nfs/dbraw/zinc/97/88/78/401978878.db2.gz	IERSOGABEUNHDC-INIZCTEOSA-N	0	3	320.481	2.323	10	0		DEAEHN
COc1ccc(COCCCC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000120218255	401982324	/nfs/dbraw/zinc/98/23/24/401982324.db2.gz	WYQZXGMJCLNFOY-INIZCTEOSA-N	0	3	320.433	2.155	10	0		DEAEHN
CCc1cccc(NC(=O)NC[C@H](O)CN2CCCCC2)c1	ZINC000043333198	401938351	/nfs/dbraw/zinc/93/83/51/401938351.db2.gz	ZRQUVOMUBQFZEL-INIZCTEOSA-N	0	3	305.422	2.217	10	0		DEAEHN
CCCN(CCNCc1cnn(C)c1C)C(=O)OC(C)(C)C	ZINC000119339167	401942664	/nfs/dbraw/zinc/94/26/64/401942664.db2.gz	LPKPIZKAXFBLEN-UHFFFAOYSA-N	0	3	310.442	2.465	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cccnc1Br	ZINC000135561756	401945487	/nfs/dbraw/zinc/94/54/87/401945487.db2.gz	XFTKYJIGORPUIJ-GHMZBOCLSA-N	0	3	324.222	2.153	10	0		DEAEHN
CN1CCN(C(=O)CC2CCN(Cc3cccs3)CC2)CC1	ZINC000093142382	402012144	/nfs/dbraw/zinc/01/21/44/402012144.db2.gz	BUICGMUXPLBTBP-UHFFFAOYSA-N	0	3	321.490	2.124	10	0		DEAEHN
C[C@@H](C(=O)N1CCCCC1)N1CC[C@H](CNc2ccccn2)C1	ZINC000151105399	402016248	/nfs/dbraw/zinc/01/62/48/402016248.db2.gz	YHUOMRNCSORCFK-JKSUJKDBSA-N	0	3	316.449	2.216	10	0		DEAEHN
CCOC[C@@H](NC(=O)N[C@H](CC(C)C)CN(C)C)C(C)C	ZINC000190125231	286138547	/nfs/dbraw/zinc/13/85/47/286138547.db2.gz	ZNXRTEODROWGAC-HUUCEWRRSA-N	0	3	301.475	2.323	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)NCCN2CCCC[C@@H]2C)ccc1F	ZINC000053809760	402060112	/nfs/dbraw/zinc/06/01/12/402060112.db2.gz	ZSHWEWUBGPYFBE-LBPRGKRZSA-N	0	3	321.396	2.388	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2ccc(OC(C)C)nc2)C1	ZINC000052527185	402043624	/nfs/dbraw/zinc/04/36/24/402043624.db2.gz	ZJEYIZJMOQOLGK-OAHLLOKOSA-N	0	3	320.437	2.152	10	0		DEAEHN
CC1(C)Cc2cccc(CN3CC[C@@H](N4CCOCC4)C3)c2O1	ZINC000121001338	402010179	/nfs/dbraw/zinc/01/01/79/402010179.db2.gz	HTOQETJFNONAKD-QGZVFWFLSA-N	0	3	316.445	2.307	10	0		DEAEHN
Cc1[nH]nc2ncc(C(=O)N[C@H](CN(C)C)c3ccccc3)cc12	ZINC000122723461	402092173	/nfs/dbraw/zinc/09/21/73/402092173.db2.gz	YZUWWBMFPYXKRK-MRXNPFEDSA-N	0	3	323.400	2.299	10	0		DEAEHN
C[C@H](N[C@H]1CCC(=O)N(C)C1)c1cnn(Cc2ccccc2)c1	ZINC000152465051	402097022	/nfs/dbraw/zinc/09/70/22/402097022.db2.gz	LGZFTFVWHVRBKL-YOEHRIQHSA-N	0	3	312.417	2.203	10	0		DEAEHN
COc1ccc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1OC	ZINC000122928236	402102161	/nfs/dbraw/zinc/10/21/61/402102161.db2.gz	AOVNYYSVDKUDQA-OCCSQVGLSA-N	0	3	306.406	2.259	10	0		DEAEHN
COC(=O)CCC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000062228457	402109879	/nfs/dbraw/zinc/10/98/79/402109879.db2.gz	CCTSOQJDOQPNCQ-INIZCTEOSA-N	0	3	318.417	2.111	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cc3ccccc3oc2=O)CCN1C	ZINC000123177928	402114318	/nfs/dbraw/zinc/11/43/18/402114318.db2.gz	MVAKSTQFQXNIJE-GXTWGEPZSA-N	0	3	314.385	2.348	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)CN(C)Cc2ccccc2)CCN1C	ZINC000123265658	402118665	/nfs/dbraw/zinc/11/86/65/402118665.db2.gz	OGICMNJKIHYKKL-WBVHZDCISA-N	0	3	303.450	2.060	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccccc2OCCOC)C1	ZINC000066338638	402131304	/nfs/dbraw/zinc/13/13/04/402131304.db2.gz	ASRALZKNTTXPRD-CQSZACIVSA-N	0	3	321.421	2.318	10	0		DEAEHN
O=S(=O)(NCc1ccc2c(c1)CNC2)c1ccccc1Cl	ZINC000097829577	402133357	/nfs/dbraw/zinc/13/33/57/402133357.db2.gz	WEDKIJWCKAUXRY-UHFFFAOYSA-N	0	3	322.817	2.422	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC[C@H](c2nncn2C2CC2)C1)N(C)C	ZINC000153482769	402148157	/nfs/dbraw/zinc/14/81/57/402148157.db2.gz	LERCNROIMOJKPA-DZGCQCFKSA-N	0	3	319.453	2.049	10	0		DEAEHN
C[C@@H](C(=O)N(C)CC(=O)NC1CC1)N(C)CCC1CCCCC1	ZINC000101565726	402149091	/nfs/dbraw/zinc/14/90/91/402149091.db2.gz	FVRFCSOZZAVAQN-AWEZNQCLSA-N	0	3	323.481	2.014	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](CCCO)c2ccccc2)C1	ZINC000153970149	402184345	/nfs/dbraw/zinc/18/43/45/402184345.db2.gz	SVQJRWOSNZHONT-IRXDYDNUSA-N	0	3	319.449	2.284	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cccc(-c3nc[nH]n3)c2)CCN1C	ZINC000154016868	402187807	/nfs/dbraw/zinc/18/78/07/402187807.db2.gz	DWRGAVAFALARLN-WFASDCNBSA-N	0	3	313.405	2.026	10	0		DEAEHN
Cc1ccn2ncc(C(=O)Nc3cccc(CN(C)C)c3)c2n1	ZINC000068669158	402203857	/nfs/dbraw/zinc/20/38/57/402203857.db2.gz	MDBLAJCYNNCDLD-UHFFFAOYSA-N	0	3	309.373	2.352	10	0		DEAEHN
CN(C(=O)C[C@@H]1CCOc2ccccc21)[C@@H]1CCCN(C)C1	ZINC000153747458	402168375	/nfs/dbraw/zinc/16/83/75/402168375.db2.gz	PNKOMVWPOYMXCU-LSDHHAIUSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@@](C)(c2ccccc2)C1)N(C)C	ZINC000154567138	402218619	/nfs/dbraw/zinc/21/86/19/402218619.db2.gz	VJABEEXVDGZRCS-SJLPKXTDSA-N	0	3	304.434	2.491	10	0		DEAEHN
CC[C@H](C(=O)NC[C@]1(C)CCCN1Cc1ccccc1)N(C)C	ZINC000154841965	402235621	/nfs/dbraw/zinc/23/56/21/402235621.db2.gz	KRGZTAWFVDPKHH-MJGOQNOKSA-N	0	3	317.477	2.498	10	0		DEAEHN
CC[C@@H]1CN(C(=O)[C@@H]2CCCCN2CC)CCN1CC(F)F	ZINC000125692128	402245415	/nfs/dbraw/zinc/24/54/15/402245415.db2.gz	HXDZGIODXWYFRV-KGLIPLIRSA-N	0	3	317.424	2.049	10	0		DEAEHN
CN(C)C[C@H]1CN(CCCOc2cccc(Cl)c2)CCO1	ZINC000155374328	402254520	/nfs/dbraw/zinc/25/45/20/402254520.db2.gz	QXUGFKNSDBSKLT-INIZCTEOSA-N	0	3	312.841	2.371	10	0		DEAEHN
COCCOc1cccc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000155372411	402254587	/nfs/dbraw/zinc/25/45/87/402254587.db2.gz	DETZVSIYMGCELB-PBHICJAKSA-N	0	3	320.433	2.170	10	0		DEAEHN
COc1ccccc1CC1CCN(C(=O)CNC2CC2)CC1	ZINC000154368663	402208929	/nfs/dbraw/zinc/20/89/29/402208929.db2.gz	ZDBZMLYRXUDNRS-UHFFFAOYSA-N	0	3	302.418	2.228	10	0		DEAEHN
CCCC[C@H](C(=O)OC)N1CCC(Cc2nccn2C)CC1	ZINC000105918312	402211222	/nfs/dbraw/zinc/21/12/22/402211222.db2.gz	AQBZMNNTFFNHMQ-OAHLLOKOSA-N	0	3	307.438	2.406	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@](C)(O)c1cccc(Cl)c1)N(C)C	ZINC000185076638	402322928	/nfs/dbraw/zinc/32/29/28/402322928.db2.gz	SFSSFRQIMCKLDQ-GDBMZVCRSA-N	0	3	312.841	2.394	10	0		DEAEHN
CN(C)[C@H](CNC(=O)CN1CCCC1(C)C)c1ccccc1	ZINC000184580748	402278995	/nfs/dbraw/zinc/27/89/95/402278995.db2.gz	GERXJYDOUAHZCZ-MRXNPFEDSA-N	0	3	303.450	2.280	10	0		DEAEHN
CC(=O)[C@@H]1C[C@H](C(=O)NC[C@H]2CCCN2CC(C)C)C1(C)C	ZINC000156698103	402287025	/nfs/dbraw/zinc/28/70/25/402287025.db2.gz	LOMPNORCQIXFSR-OWCLPIDISA-N	0	3	308.466	2.474	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1ccc(C)c(C(N)=O)c1	ZINC000176339944	402301201	/nfs/dbraw/zinc/30/12/01/402301201.db2.gz	QLPGPBKHFFICOE-CQSZACIVSA-N	0	3	318.421	2.042	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1nc(COC)cs1	ZINC000176382136	402304229	/nfs/dbraw/zinc/30/42/29/402304229.db2.gz	GYBZYZXLRAWTHA-GFCCVEGCSA-N	0	3	312.439	2.238	10	0		DEAEHN
CCOc1cccnc1C(=O)NCCN1CCCC[C@H]1CC	ZINC000176386946	402304892	/nfs/dbraw/zinc/30/48/92/402304892.db2.gz	FSAOVYJHVTZKRH-CQSZACIVSA-N	0	3	305.422	2.475	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1cccc(F)c1C	ZINC000176892146	402346908	/nfs/dbraw/zinc/34/69/08/402346908.db2.gz	BPJZGYYRGZHUON-ZDUSSCGKSA-N	0	3	321.396	2.015	10	0		DEAEHN
CN(C)S(=O)(=O)CCN[C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000230992901	402354008	/nfs/dbraw/zinc/35/40/08/402354008.db2.gz	WNLUESQGJRCTRN-CQSZACIVSA-N	0	3	316.854	2.272	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc(NC(C)=O)ccc1F	ZINC000176980592	402356598	/nfs/dbraw/zinc/35/65/98/402356598.db2.gz	SFWULOFQZCNGKP-CQSZACIVSA-N	0	3	321.396	2.340	10	0		DEAEHN
O=C(CNC[C@H]1CCCO1)NCc1ccc(Cl)cc1Cl	ZINC000232741563	402358052	/nfs/dbraw/zinc/35/80/52/402358052.db2.gz	RILZQSLTMDJECJ-GFCCVEGCSA-N	0	3	317.216	2.378	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(OC)cc1OC	ZINC000177035527	402362266	/nfs/dbraw/zinc/36/22/66/402362266.db2.gz	HEXFDVMFJIDGEA-CYBMUJFWSA-N	0	3	306.406	2.260	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc2c(c1)OCCO2	ZINC000177035799	402362323	/nfs/dbraw/zinc/36/23/23/402362323.db2.gz	SCDNSZDOWQSMCK-AWEZNQCLSA-N	0	3	304.390	2.014	10	0		DEAEHN
CCC[C@H](N)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1	ZINC000236913486	402388199	/nfs/dbraw/zinc/38/81/99/402388199.db2.gz	AFFXPNUJFXILTI-RRFJBIMHSA-N	0	3	309.841	2.329	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCOc1ccc(C)cc1	ZINC000177295626	402388833	/nfs/dbraw/zinc/38/88/33/402388833.db2.gz	ZOGRAHNNSUBWTR-INIZCTEOSA-N	0	3	319.449	2.500	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1C(=O)[C@H](C)N1CCCCCC1	ZINC000177222560	402382775	/nfs/dbraw/zinc/38/27/75/402382775.db2.gz	LTOSSVRDPHXDHS-RDJZCZTQSA-N	0	3	318.465	2.447	10	0		DEAEHN
CCC[C@@H](C(=O)NCCCN(C)c1ccccc1F)N(C)C	ZINC000161701495	402396426	/nfs/dbraw/zinc/39/64/26/402396426.db2.gz	KMEKRSIQCIVXBB-INIZCTEOSA-N	0	3	309.429	2.499	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCCOC1CCCC1	ZINC000177450627	402403718	/nfs/dbraw/zinc/40/37/18/402403718.db2.gz	NFHDERUGNCNRKV-OAHLLOKOSA-N	0	3	311.470	2.461	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H](C)c1nc2ccccc2n1C)N(C)C	ZINC000162209213	402413054	/nfs/dbraw/zinc/41/30/54/402413054.db2.gz	JUNHWPTWAUKUFK-DOMZBBRYSA-N	0	3	302.422	2.481	10	0		DEAEHN
COc1cccc2c1CC[C@H]2NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000177625576	402421881	/nfs/dbraw/zinc/42/18/81/402421881.db2.gz	PPERMVUMPGLNKC-CZUORRHYSA-N	0	3	315.417	2.172	10	0		DEAEHN
CC(C)c1cc(C(=O)N2CCC(Cc3nccn3C)CC2)n[nH]1	ZINC000162524978	402423185	/nfs/dbraw/zinc/42/31/85/402423185.db2.gz	FALYOMTZVQQKIV-UHFFFAOYSA-N	0	3	315.421	2.362	10	0		DEAEHN
C[C@H](NCC1(O)CCOCC1)c1ccccc1OC(F)F	ZINC000162609008	402425993	/nfs/dbraw/zinc/42/59/93/402425993.db2.gz	QTRXTQZUIRNBFJ-NSHDSACASA-N	0	3	301.333	2.480	10	0		DEAEHN
CC[C@@H](NC(=O)N1CC[C@@H](N2CCCC2)C1)c1nccs1	ZINC000162645693	402427312	/nfs/dbraw/zinc/42/73/12/402427312.db2.gz	HAUIKQZQJRHSJO-CHWSQXEVSA-N	0	3	308.451	2.474	10	0		DEAEHN
CCc1nc(NC(=O)CN(C)C[C@@H]2CCCN2CC)sc1C	ZINC000177712460	402429663	/nfs/dbraw/zinc/42/96/63/402429663.db2.gz	HSEUWKYTXMZLSC-ZDUSSCGKSA-N	0	3	324.494	2.369	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccc(N(CC)CC)nc1)N(C)C	ZINC000161612507	402393770	/nfs/dbraw/zinc/39/37/70/402393770.db2.gz	YFCPRPFVNDOXNE-HNNXBMFYSA-N	0	3	306.454	2.274	10	0		DEAEHN
C[C@H](c1ccccc1)[C@@](C)(O)C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000245427370	402459544	/nfs/dbraw/zinc/45/95/44/402459544.db2.gz	VZTMZTUKOFYDFL-FXRXJOCMSA-N	0	3	316.445	2.236	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C(=O)NC1CC1)c1ccccc1	ZINC000245476171	402464623	/nfs/dbraw/zinc/46/46/23/402464623.db2.gz	SNTGAHDAZWJOFJ-QZTJIDSGSA-N	0	3	315.461	2.422	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@H](COC)c1ccc(C)o1	ZINC000245479776	402464641	/nfs/dbraw/zinc/46/46/41/402464641.db2.gz	WRDMLURIMFZYBV-HUUCEWRRSA-N	0	3	323.437	2.401	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C)C(=O)NCCc1cccs1	ZINC000245474648	402464966	/nfs/dbraw/zinc/46/49/66/402464966.db2.gz	RDGHAHJIZHTKDA-HUUCEWRRSA-N	0	3	323.506	2.211	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cccnc1Br	ZINC000246140415	402512533	/nfs/dbraw/zinc/51/25/33/402512533.db2.gz	XFTKYJIGORPUIJ-QWRGUYRKSA-N	0	3	324.222	2.153	10	0		DEAEHN
COc1ccc([C@H](C)N[C@@H](C(=O)N2CCOCC2)C(C)C)cc1	ZINC000164968028	402471521	/nfs/dbraw/zinc/47/15/21/402471521.db2.gz	HDTFRYVWHAWTIQ-WMLDXEAASA-N	0	3	320.433	2.229	10	0		DEAEHN
CC[C@H](COC)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245615586	402474585	/nfs/dbraw/zinc/47/45/85/402474585.db2.gz	CTRVCRWVZHMKIO-PMPSAXMXSA-N	0	3	305.422	2.156	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ncccc1C(F)(F)F	ZINC000245628211	402475337	/nfs/dbraw/zinc/47/53/37/402475337.db2.gz	UIMRMDIAFKPLPS-QWRGUYRKSA-N	0	3	313.323	2.409	10	0		DEAEHN
COC[C@H](C)CNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245663991	402477606	/nfs/dbraw/zinc/47/76/06/402477606.db2.gz	QKNPTPMAFPIPAA-BMFZPTHFSA-N	0	3	305.422	2.014	10	0		DEAEHN
COC(=O)c1ccc(CN2CCC[C@H]2Cn2ccnc2C)o1	ZINC000178299788	402481731	/nfs/dbraw/zinc/48/17/31/402481731.db2.gz	MWCXPHLEPCZOJT-ZDUSSCGKSA-N	0	3	303.362	2.236	10	0		DEAEHN
C[C@@H]1CN(C[C@@H]2CCCN(S(C)(=O)=O)C2)[C@H]1c1ccccc1	ZINC000246154896	402513248	/nfs/dbraw/zinc/51/32/48/402513248.db2.gz	DHVZQEXMQKEUKB-HLLBOEOZSA-N	0	3	322.474	2.351	10	0		DEAEHN
COc1cc(CN2CC[C@@H]3OCCC[C@H]3C2)cc2c1OCCO2	ZINC000245771274	402486966	/nfs/dbraw/zinc/48/69/66/402486966.db2.gz	RUFLZGPBMMQVPR-GJZGRUSLSA-N	0	3	319.401	2.467	10	0		DEAEHN
CCN(C)[C@@H](C(=O)N1CCN2CCCC[C@H]2C1)c1ccccc1	ZINC000245869457	402492659	/nfs/dbraw/zinc/49/26/59/402492659.db2.gz	VQTAGBCKMBXNFC-ZWKOTPCHSA-N	0	3	315.461	2.376	10	0		DEAEHN
Cc1ccc(CN2CCC([C@@H](O)c3nccn3C)CC2)c(C)n1	ZINC000187305919	402493022	/nfs/dbraw/zinc/49/30/22/402493022.db2.gz	QVBZEAZRSZHNFP-QGZVFWFLSA-N	0	3	314.433	2.378	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)C1	ZINC000245998689	402502632	/nfs/dbraw/zinc/50/26/32/402502632.db2.gz	DNVDNHDWFPVRNK-ZACQAIPSSA-N	0	3	317.433	2.252	10	0		DEAEHN
COc1ccc(C[C@H](C)NCc2cc(C(N)=O)co2)cc1OC	ZINC000187707424	402509027	/nfs/dbraw/zinc/50/90/27/402509027.db2.gz	AXNXDXPZGRDXNU-NSHDSACASA-N	0	3	318.373	2.117	10	0		DEAEHN
CC(C)[C@@H]1CN(C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)CCS1	ZINC000246805621	402545831	/nfs/dbraw/zinc/54/58/31/402545831.db2.gz	DDTAEIJBEMPIPY-KFWWJZLASA-N	0	3	313.511	2.498	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1C[C@@H](C)CCC[C@H]1C	ZINC000246922067	402549450	/nfs/dbraw/zinc/54/94/50/402549450.db2.gz	JEMACGWFAWGGII-ARFHVFGLSA-N	0	3	311.470	2.317	10	0		DEAEHN
CCOC(=O)CCCN1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000171037707	402551388	/nfs/dbraw/zinc/55/13/88/402551388.db2.gz	SDPUJASKBREXRQ-HNNXBMFYSA-N	0	3	305.422	2.467	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@@H]1CCCN1C[C@@H](O)COC(C)(C)C	ZINC000247175246	402558722	/nfs/dbraw/zinc/55/87/22/402558722.db2.gz	NDGPHZIXXMIEOG-CABCVRRESA-N	0	3	309.454	2.350	10	0		DEAEHN
COC(=O)CCNC(=O)CN[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000171127944	402559914	/nfs/dbraw/zinc/55/99/14/402559914.db2.gz	YDAWNBMDSRTUON-INIZCTEOSA-N	0	3	324.808	2.060	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(-c2cccs2)n[nH]1	ZINC000247221699	402560824	/nfs/dbraw/zinc/56/08/24/402560824.db2.gz	MJEJCBBFRSLERQ-NEPJUHHUSA-N	0	3	316.430	2.447	10	0		DEAEHN
O[C@]1(CNCc2ccc(-c3ccncc3)cc2F)CCOC1	ZINC000179019972	402565074	/nfs/dbraw/zinc/56/50/74/402565074.db2.gz	CSVRMVAFQHTRHQ-KRWDZBQOSA-N	0	3	302.349	2.129	10	0		DEAEHN
O=C(N[C@H]1CCc2cc(F)ccc21)N1CCN2CCC[C@H]2C1	ZINC000247374908	402565575	/nfs/dbraw/zinc/56/55/75/402565575.db2.gz	FPNLBTLPWYMIEN-HOCLYGCPSA-N	0	3	303.381	2.303	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)N[C@H](C)CN1CCCCC1	ZINC000189955855	402568348	/nfs/dbraw/zinc/56/83/48/402568348.db2.gz	OLTCHFJNTVHJSS-ZIAGYGMSSA-N	0	3	320.437	2.325	10	0		DEAEHN
C[C@H](N[C@@H]1CCNC1=O)c1ccc(OCC(F)(F)F)cc1	ZINC000179065231	402569912	/nfs/dbraw/zinc/56/99/12/402569912.db2.gz	KEDOGCWISNZZHU-JOYOIKCWSA-N	0	3	302.296	2.167	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1cn2ccnc2s1)c1ccccc1	ZINC000188184092	402517053	/nfs/dbraw/zinc/51/70/53/402517053.db2.gz	MEMYYGDCXCPNKP-CYBMUJFWSA-N	0	3	314.414	2.429	10	0		DEAEHN
C[C@H](C(=O)NCc1ccccc1Cl)N1CCN2CCC[C@@H]2C1	ZINC000178637700	402520777	/nfs/dbraw/zinc/52/07/77/402520777.db2.gz	VXBVUWNLERUPGE-UKRRQHHQSA-N	0	3	321.852	2.125	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@@H](c2cccc(F)c2)C1)N(C)C	ZINC000178656528	402522308	/nfs/dbraw/zinc/52/23/08/402522308.db2.gz	GKNTWTZXFFDZPK-JKSUJKDBSA-N	0	3	308.397	2.456	10	0		DEAEHN
C[C@@H](C(=O)N[C@H]1CCC[C@@H](C)[C@H]1C)N1CCN2CCC[C@@H]2C1	ZINC000246304124	402523870	/nfs/dbraw/zinc/52/38/70/402523870.db2.gz	JHNPJXZDOVEZBP-UUAJXVIYSA-N	0	3	307.482	2.096	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC[C@H](n2ccnc2CC)C1)N(C)C	ZINC000179110077	402573673	/nfs/dbraw/zinc/57/36/73/402573673.db2.gz	JLGBSVQBZVVQAP-LSDHHAIUSA-N	0	3	306.454	2.339	10	0		DEAEHN
C[C@H](OCCCNC(=O)N1CC[C@H](N(C)C)C1)c1ccccc1	ZINC000170826970	402529815	/nfs/dbraw/zinc/52/98/15/402529815.db2.gz	DLXLAZCPOOLRNG-RDJZCZTQSA-N	0	3	319.449	2.500	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCCc2ccc(Cl)s2)C1	ZINC000170831628	402530250	/nfs/dbraw/zinc/53/02/50/402530250.db2.gz	ULPLRTDTIYYHJM-SNVBAGLBSA-N	0	3	301.843	2.290	10	0		DEAEHN
C[C@@H](CNC(=O)N1CC[C@@H](N(C)C)C1)COCc1ccccc1	ZINC000170833606	402531065	/nfs/dbraw/zinc/53/10/65/402531065.db2.gz	ZGQQYXQXNOWXIC-DOTOQJQBSA-N	0	3	319.449	2.185	10	0		DEAEHN
CC(C)Oc1ccccc1CNC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170832914	402531073	/nfs/dbraw/zinc/53/10/73/402531073.db2.gz	AQCKTQUMRAYKPV-OAHLLOKOSA-N	0	3	305.422	2.319	10	0		DEAEHN
C[C@@H](CNC(=O)N1CC[C@H](N(C)C)C1)COCc1ccccc1	ZINC000170833600	402531138	/nfs/dbraw/zinc/53/11/38/402531138.db2.gz	ZGQQYXQXNOWXIC-RDJZCZTQSA-N	0	3	319.449	2.185	10	0		DEAEHN
Cc1c(C(=O)N2CC[C@H](N(C)C)C2)cnn1-c1ccccc1F	ZINC000170856263	402533093	/nfs/dbraw/zinc/53/30/93/402533093.db2.gz	QTOCVKLTMIIAFN-ZDUSSCGKSA-N	0	3	316.380	2.096	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2nn(-c3ccccc3)c3c2CCC3)C1	ZINC000170856906	402533614	/nfs/dbraw/zinc/53/36/14/402533614.db2.gz	BPTQBQDKXBAZSL-HNNXBMFYSA-N	0	3	324.428	2.137	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1ccc2nccn2c1)c1ccccc1	ZINC000170861653	402534257	/nfs/dbraw/zinc/53/42/57/402534257.db2.gz	DNMQEZGXKOARKT-INIZCTEOSA-N	0	3	308.385	2.367	10	0		DEAEHN
CCc1ccc(C(=O)CCC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170861339	402534416	/nfs/dbraw/zinc/53/44/16/402534416.db2.gz	BKXSPKFILTZNOH-MRXNPFEDSA-N	0	3	302.418	2.374	10	0		DEAEHN
CCOc1ccc(C(=O)CCC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170862334	402534434	/nfs/dbraw/zinc/53/44/34/402534434.db2.gz	HHVAPYUPTXIHDX-HNNXBMFYSA-N	0	3	318.417	2.211	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cccn2Cc2cccs2)C1	ZINC000170864635	402535248	/nfs/dbraw/zinc/53/52/48/402535248.db2.gz	SAWYUOSCORYTSE-CYBMUJFWSA-N	0	3	303.431	2.374	10	0		DEAEHN
CC(=O)c1cccc(OCCCC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000170864217	402535296	/nfs/dbraw/zinc/53/52/96/402535296.db2.gz	XEFQJIRRZPCBKA-MRXNPFEDSA-N	0	3	318.417	2.211	10	0		DEAEHN
Cc1oc(-c2cccs2)nc1CC(=O)N1CC[C@H](N(C)C)C1	ZINC000170867885	402535889	/nfs/dbraw/zinc/53/58/89/402535889.db2.gz	WUBQPGABRVKJMM-LBPRGKRZSA-N	0	3	319.430	2.417	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N(C)CCC2CCOCC2)C1	ZINC000246542240	402536069	/nfs/dbraw/zinc/53/60/69/402536069.db2.gz	LWPTYRSUHDAUMH-GDBMZVCRSA-N	0	3	311.470	2.173	10	0		DEAEHN
COc1ccc(OCCCN2CCC[C@@H]2C(=O)N(C)C)cc1	ZINC000247948180	402578719	/nfs/dbraw/zinc/57/87/19/402578719.db2.gz	BKZNSZGLMZNDCD-MRXNPFEDSA-N	0	3	306.406	2.017	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1sc(COC)nc1C	ZINC000247980001	402579613	/nfs/dbraw/zinc/57/96/13/402579613.db2.gz	HHELGXQBCDHFKM-OLZOCXBDSA-N	0	3	323.462	2.297	10	0		DEAEHN
CC(C)[C@](C)(O)CNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179471948	402591621	/nfs/dbraw/zinc/59/16/21/402591621.db2.gz	SYCWEBSCRHZHSK-JFIYKMOQSA-N	0	3	319.449	2.138	10	0		DEAEHN
Cn1cc(CN2CCCN(Cc3ccc4c[nH]nc4c3)CC2)cn1	ZINC000179523557	402594026	/nfs/dbraw/zinc/59/40/26/402594026.db2.gz	VDVIXMGPEMZEHS-UHFFFAOYSA-N	0	3	324.432	2.004	10	0		DEAEHN
CC[C@H](NCC(=O)N1CCC[C@@H](C(F)(F)F)C1)[C@@H]1CCCO1	ZINC000248579295	402596746	/nfs/dbraw/zinc/59/67/46/402596746.db2.gz	ICHISXGYVYVYRF-AGIUHOORSA-N	0	3	322.371	2.335	10	0		DEAEHN
O=C(c1cc(F)c(F)c(F)c1F)N1CCN2CCC[C@@H]2C1	ZINC000171585814	402598027	/nfs/dbraw/zinc/59/80/27/402598027.db2.gz	ZSDKKXWNNVACBD-MRVPVSSYSA-N	0	3	302.271	2.163	10	0		DEAEHN
CN(C)CCN(Cc1ccccc1F)C(=O)N[C@@H]1CCCOC1	ZINC000171614446	402601311	/nfs/dbraw/zinc/60/13/11/402601311.db2.gz	WAGQGDSDOHHSEM-OAHLLOKOSA-N	0	3	323.412	2.078	10	0		DEAEHN
CCc1ccccc1NC(=O)[C@H](C)N1CCN2CCC[C@@H]2C1	ZINC000171640443	402604909	/nfs/dbraw/zinc/60/49/09/402604909.db2.gz	CJQYGLCHHPZPTL-GOEBONIOSA-N	0	3	301.434	2.356	10	0		DEAEHN
COC(=O)c1cccc(OCCN2[C@H](C)C[C@@H](O)C[C@@H]2C)c1	ZINC000248737153	402605959	/nfs/dbraw/zinc/60/59/59/402605959.db2.gz	CINZZVXKHOLYQV-AGGWBTHJSA-N	0	3	307.390	2.086	10	0		DEAEHN
CN1CC[C@H](NC(=O)[C@@H]2CCCc3n[nH]cc32)[C@@H]1c1ccccc1	ZINC000180182339	402609838	/nfs/dbraw/zinc/60/98/38/402609838.db2.gz	MVDGVHWKKSTESJ-JLSDUUJJSA-N	0	3	324.428	2.391	10	0		DEAEHN
CCOCCCC(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190602256	402612370	/nfs/dbraw/zinc/61/23/70/402612370.db2.gz	ZEWQZGQAEYRBRQ-KRWDZBQOSA-N	0	3	319.449	2.179	10	0		DEAEHN
CSC[C@@H](C)C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190604599	402613190	/nfs/dbraw/zinc/61/31/90/402613190.db2.gz	XLOYVIYGNNMHQE-ZBFHGGJFSA-N	0	3	321.490	2.361	10	0		DEAEHN
CCOC(=O)CSc1cncc(N[C@@H]2CCCN(CC)C2)n1	ZINC000180422295	402616290	/nfs/dbraw/zinc/61/62/90/402616290.db2.gz	MENIABHJDSUQJF-GFCCVEGCSA-N	0	3	324.450	2.028	10	0		DEAEHN
C[C@@H]1CCC[C@H](NC(=O)NC[C@@H](O)CN2CCCCC2)CC1	ZINC000249026435	402618029	/nfs/dbraw/zinc/61/80/29/402618029.db2.gz	ANJIPJOSQHDHJO-OWCLPIDISA-N	0	3	311.470	2.101	10	0		DEAEHN
C[C@H]1CSCCN(CC(=O)N2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000249020707	402618103	/nfs/dbraw/zinc/61/81/03/402618103.db2.gz	KSYOQGNPICJQFY-VXGBXAGGSA-N	0	3	324.412	2.472	10	0		DEAEHN
Brc1ccc(CNCCCCN2CCOCC2)o1	ZINC000190774841	402622149	/nfs/dbraw/zinc/62/21/49/402622149.db2.gz	IINWWFMENDROTB-UHFFFAOYSA-N	0	3	317.227	2.244	10	0		DEAEHN
Cc1ccc(F)cc1NC(=O)C(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000249200367	402622941	/nfs/dbraw/zinc/62/29/41/402622941.db2.gz	QTYGVKLJQHGGJI-JSGCOSHPSA-N	0	3	321.396	2.014	10	0		DEAEHN
COCCN1CCCN([C@@H](C)CCc2ccccc2)CC1=O	ZINC000190799149	402623702	/nfs/dbraw/zinc/62/37/02/402623702.db2.gz	VSVCFHDHWRKZIH-INIZCTEOSA-N	0	3	304.434	2.188	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC[C@@H]2c2c(C)n[nH]c2C)C1	ZINC000181073605	402634575	/nfs/dbraw/zinc/63/45/75/402634575.db2.gz	TVXANLIUNJKRRC-HUUCEWRRSA-N	0	3	319.453	2.357	10	0		DEAEHN
CCOC(=O)[C@H](Cc1ccccc1)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000249852886	402642475	/nfs/dbraw/zinc/64/24/75/402642475.db2.gz	PSGIMLDIQOZFRR-BPQIPLTHSA-N	0	3	318.461	2.479	10	0		DEAEHN
COc1ccc(C[C@@H](C)CN2CCN(CCO)[C@H](C)C2)cc1F	ZINC000249880136	402642965	/nfs/dbraw/zinc/64/29/65/402642965.db2.gz	HMSYMDINFHLHNB-HUUCEWRRSA-N	0	3	324.440	2.011	10	0		DEAEHN
COc1ccc(F)c(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1OC	ZINC000191160245	402647109	/nfs/dbraw/zinc/64/71/09/402647109.db2.gz	GBKCAAFWAFWNJV-VXGBXAGGSA-N	0	3	324.396	2.398	10	0		DEAEHN
COc1cc(F)ccc1N1CCN(CC2CCOCC2)CC1	ZINC000172306448	402648857	/nfs/dbraw/zinc/64/88/57/402648857.db2.gz	IPGNMNUPYVANOO-UHFFFAOYSA-N	0	3	308.397	2.383	10	0		DEAEHN
O=C1Nc2ccccc2CC[C@H]1N1C[C@H]2CCC[C@@H](C1)C2O	ZINC000192028962	402706842	/nfs/dbraw/zinc/70/68/42/402706842.db2.gz	MQGMHTYZAKLHLI-NUCGDHGJSA-N	0	3	300.402	2.033	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)Cc1cccc(C)c1	ZINC000173830314	402714448	/nfs/dbraw/zinc/71/44/48/402714448.db2.gz	VGNJBEXCDAMWCV-DLBZAZTESA-N	0	3	322.474	2.383	10	0		DEAEHN
O=C(c1cccc(Oc2cnccn2)c1)N1CCN2CCC[C@H]2C1	ZINC000172570867	402663330	/nfs/dbraw/zinc/66/33/30/402663330.db2.gz	MGBJPQBPPWVCKJ-HNNXBMFYSA-N	0	3	324.384	2.189	10	0		DEAEHN
CC(C)n1ncc2cc(CNCC3(C)OCCCO3)cnc21	ZINC000192248868	402719450	/nfs/dbraw/zinc/71/94/50/402719450.db2.gz	FCSBKDGFHHVFHA-UHFFFAOYSA-N	0	3	304.394	2.255	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)c2cnc(-c3ccncc3)s2)C1	ZINC000172894684	402679388	/nfs/dbraw/zinc/67/93/88/402679388.db2.gz	MZNSZGKMGYPNHS-CYBMUJFWSA-N	0	3	316.430	2.371	10	0		DEAEHN
CC(=O)N1CCCN(Cc2ccc(-n3ccnc3)cc2C)CC1	ZINC000191859669	402695865	/nfs/dbraw/zinc/69/58/65/402695865.db2.gz	OGXRHUNPFVGZTA-UHFFFAOYSA-N	0	3	312.417	2.235	10	0		DEAEHN
CCc1nnc(CN[C@H]2CCC[C@@H]2CNC(=O)OC(C)(C)C)[nH]1	ZINC000191916307	402698611	/nfs/dbraw/zinc/69/86/11/402698611.db2.gz	MXECWJSHIWHUSC-NEPJUHHUSA-N	0	3	323.441	2.150	10	0		DEAEHN
CCc1nnc(C[NH2+][C@H]2CCC[C@@H]2CNC(=O)OC(C)(C)C)[n-]1	ZINC000191916307	402698612	/nfs/dbraw/zinc/69/86/12/402698612.db2.gz	MXECWJSHIWHUSC-NEPJUHHUSA-N	0	3	323.441	2.150	10	0		DEAEHN
Cc1ccc([C@H](CNC(=O)[C@@H]2CCOC[C@@H]2C)N(C)C)cc1	ZINC000192455960	402730307	/nfs/dbraw/zinc/73/03/07/402730307.db2.gz	PMUROGIIBRWQBQ-UAGQMJEPSA-N	0	3	304.434	2.387	10	0		DEAEHN
C[C@H](N[C@H]1CCN(Cc2ccccn2)C[C@@H]1C)c1nccn1C	ZINC000182982565	402731133	/nfs/dbraw/zinc/73/11/33/402731133.db2.gz	UQEYEYZFTTVHQV-ZOBUZTSGSA-N	0	3	313.449	2.376	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2cnn(CC3CC3)c2)CCN1C	ZINC000174452750	402741986	/nfs/dbraw/zinc/74/19/86/402741986.db2.gz	ZEQGSBPFACNRPU-DOMZBBRYSA-N	0	3	305.426	2.240	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(F)(F)c1ncccc1C	ZINC000192672851	402743595	/nfs/dbraw/zinc/74/35/95/402743595.db2.gz	AHARBCFCDIAATK-CYBMUJFWSA-N	0	3	311.376	2.425	10	0		DEAEHN
CC[C@H]1CN(c2ccccc2)CCN1CCN1CCO[C@H](C)C1	ZINC000192798962	402750332	/nfs/dbraw/zinc/75/03/32/402750332.db2.gz	HFAQZXLSBFGSKK-MSOLQXFVSA-N	0	3	317.477	2.308	10	0		DEAEHN
CC(C)Oc1ccccc1Cc1nc([C@H]2CNCCN2C)no1	ZINC000263276858	402753405	/nfs/dbraw/zinc/75/34/05/402753405.db2.gz	SYOKBKLZNGUGHF-CQSZACIVSA-N	0	3	316.405	2.024	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2ccc(C(F)(F)F)cc2)n1	ZINC000263302752	402756306	/nfs/dbraw/zinc/75/63/06/402756306.db2.gz	XGUCCMQHXVNWGX-NSHDSACASA-N	0	3	312.295	2.332	10	0		DEAEHN
Cc1nc(C)c(CCNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)s1	ZINC000174804611	402757832	/nfs/dbraw/zinc/75/78/32/402757832.db2.gz	VWLFWBRBHMTZPZ-BXUZGUMPSA-N	0	3	324.494	2.427	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@@H]2c2c(F)cccc2F)n1	ZINC000263314719	402758025	/nfs/dbraw/zinc/75/80/25/402758025.db2.gz	ZIAFMXAONAANBI-OPQQBVKSSA-N	0	3	320.343	2.195	10	0		DEAEHN
C[C@H](OC1CCCCCC1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263318515	402758595	/nfs/dbraw/zinc/75/85/95/402758595.db2.gz	ZVWCKBLWZSXJOO-JSGCOSHPSA-N	0	3	308.426	2.446	10	0		DEAEHN
C[C@@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)C1CCCC1	ZINC000174921903	402763082	/nfs/dbraw/zinc/76/30/82/402763082.db2.gz	NSTJDBOLXURPHC-ZBFHGGJFSA-N	0	3	311.470	2.317	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)CSCc1cccnc1	ZINC000174978180	402768652	/nfs/dbraw/zinc/76/86/52/402768652.db2.gz	KGTBFJVLBYUHRG-HZPDHXFCSA-N	0	3	319.474	2.400	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cnc2ccccc2n1	ZINC000174985484	402769070	/nfs/dbraw/zinc/76/90/70/402769070.db2.gz	AKVKWUYAVHLWGQ-ZIAGYGMSSA-N	0	3	310.401	2.329	10	0		DEAEHN
C[C@H](NCC(=O)NC(C)(C)C)c1cccc(-n2cccn2)c1	ZINC000183575063	402778052	/nfs/dbraw/zinc/77/80/52/402778052.db2.gz	PXNVUTJKVDJJSA-ZDUSSCGKSA-N	0	3	300.406	2.438	10	0		DEAEHN
Cc1cc(C(=O)N2CCN3CCC[C@H]3C2)nn1-c1ccccc1	ZINC000195333625	402842029	/nfs/dbraw/zinc/84/20/29/402842029.db2.gz	OOKNCUIJGIXRFT-INIZCTEOSA-N	0	3	310.401	2.101	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)N1C[C@H](N(C)C)Cc2ccccc21	ZINC000194325628	402792517	/nfs/dbraw/zinc/79/25/17/402792517.db2.gz	ROZFCUWSINBCMK-BMFZPTHFSA-N	0	3	302.418	2.179	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCC[C@H](n2cc(C)cn2)C1	ZINC000175377452	402801278	/nfs/dbraw/zinc/80/12/78/402801278.db2.gz	RUWRASANEUATMV-HOTGVXAUSA-N	0	3	319.453	2.022	10	0		DEAEHN
O[C@@H](COc1ccc(Cl)cc1)CN1CCCN(C2CC2)CC1	ZINC000195339265	402843016	/nfs/dbraw/zinc/84/30/16/402843016.db2.gz	ZMIHXEDCNSMWHN-MRXNPFEDSA-N	0	3	324.852	2.250	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccc(N2CCCCCC2)nc1	ZINC000194705069	402811767	/nfs/dbraw/zinc/81/17/67/402811767.db2.gz	NDKPWOYCBQZZMB-INIZCTEOSA-N	0	3	316.449	2.286	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)NCc2cccnc2N(C)C)cc1	ZINC000195134145	402833412	/nfs/dbraw/zinc/83/34/12/402833412.db2.gz	XFYRXFCZWGRFED-UHFFFAOYSA-N	0	3	312.417	2.139	10	0		DEAEHN
CNC(=O)[C@@H](NCCOc1ccc(C(F)(F)F)cc1)C(C)C	ZINC000183635284	402784442	/nfs/dbraw/zinc/78/44/42/402784442.db2.gz	DHIPMMHJYANKQZ-ZDUSSCGKSA-N	0	3	318.339	2.444	10	0		DEAEHN
CCCC[C@H](CCC)NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000175988673	402846350	/nfs/dbraw/zinc/84/63/50/402846350.db2.gz	YVGBOFGHORFNBC-HOTGVXAUSA-N	0	3	313.486	2.491	10	0		DEAEHN
Cn1c(CN2CCC(c3ccn[nH]3)CC2)nc2ccccc2c1=O	ZINC000195515593	402849015	/nfs/dbraw/zinc/84/90/15/402849015.db2.gz	GLFWLIZNOZGMHK-UHFFFAOYSA-N	0	3	323.400	2.036	10	0		DEAEHN
CC(=O)c1ccc(CC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1	ZINC000265947325	402964420	/nfs/dbraw/zinc/96/44/20/402964420.db2.gz	KBUNWJKECHIQAZ-CXAGYDPISA-N	0	3	302.418	2.373	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCc2cn3ccsc3n2)CCN1C	ZINC000266637213	402980230	/nfs/dbraw/zinc/98/02/30/402980230.db2.gz	BCUGGPVKFSIDJC-YPMHNXCESA-N	0	3	321.450	2.020	10	0		DEAEHN
Cn1ccnc1[C@H]1OCCC[C@@H]1NCc1cccc2nccn21	ZINC000275550508	403104518	/nfs/dbraw/zinc/10/45/18/403104518.db2.gz	NHPPNECEJMWCAG-HOCLYGCPSA-N	0	3	311.389	2.078	10	0		DEAEHN
Cn1cc([C@H]2OCCC[C@@H]2NCc2cccc3c2OCO3)cn1	ZINC000275606939	403109197	/nfs/dbraw/zinc/10/91/97/403109197.db2.gz	QSPVXBNFMACFKO-GOEBONIOSA-N	0	3	315.373	2.159	10	0		DEAEHN
Cc1n[nH]c(C)c1CN1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000275887424	403130950	/nfs/dbraw/zinc/13/09/50/403130950.db2.gz	ZFTPDWYAJWAGLH-KRWDZBQOSA-N	0	3	313.449	2.375	10	0		DEAEHN
C[C@@H](NC1CC(OCc2ccccc2)C1)C(=O)N1CCCC1	ZINC000343502160	403615666	/nfs/dbraw/zinc/61/56/66/403615666.db2.gz	JZVOXCADTIDSDQ-ODIFPOPNSA-N	0	3	302.418	2.335	10	0		DEAEHN
CN1CC[C@H](NC(=O)N[C@@]2(C)CCCOC2)[C@@H]1c1ccccc1	ZINC000332799473	403618811	/nfs/dbraw/zinc/61/88/11/403618811.db2.gz	PVWHXZUELBQWES-BQFCYCMXSA-N	0	3	317.433	2.300	10	0		DEAEHN
CC1(C)Cc2ccc(C(=O)N3CCN4CCC[C@@H]4C3)c(O)c2O1	ZINC000333034016	403650744	/nfs/dbraw/zinc/65/07/44/403650744.db2.gz	ICLXSYMQXBQVRI-CYBMUJFWSA-N	0	3	316.401	2.026	10	0		DEAEHN
c1ccc(-c2nc3c(c(N4CCN5CCC4CC5)n2)CCC3)nc1	ZINC000302750117	403721490	/nfs/dbraw/zinc/72/14/90/403721490.db2.gz	GSDHZNMTNUSBOK-UHFFFAOYSA-N	0	3	321.428	2.312	10	0		DEAEHN
O=S(=O)(C1CCN(CCc2ccccc2)CC1)N1CCCC1	ZINC000369744421	404215206	/nfs/dbraw/zinc/21/52/06/404215206.db2.gz	FSEMECCIYCDQCL-UHFFFAOYSA-N	0	3	322.474	2.119	10	0		DEAEHN
c1nc(-c2ccncc2)sc1CNCCNc1cnccn1	ZINC000349857951	404230889	/nfs/dbraw/zinc/23/08/89/404230889.db2.gz	WBFBNNVZWFGURR-UHFFFAOYSA-N	0	3	312.402	2.197	10	0		DEAEHN
Cc1nc([C@H]2CCCN2C(=O)[C@H](C)N2CCCCCC2)no1	ZINC000329416611	404330961	/nfs/dbraw/zinc/33/09/61/404330961.db2.gz	ZGRDBTCWEVIDKQ-GXTWGEPZSA-N	0	3	306.410	2.306	10	0		DEAEHN
CN(C)CCOc1cc(C(=O)N2CCCC23CCC3)ccn1	ZINC000365617708	404700851	/nfs/dbraw/zinc/70/08/51/404700851.db2.gz	CNAALHNYVHYSTH-UHFFFAOYSA-N	0	3	303.406	2.181	10	0		DEAEHN
CN1CCC[C@H](N2CCN(C(=O)[C@H]3CCCCC3(C)C)CC2)C1	ZINC000366059253	404749451	/nfs/dbraw/zinc/74/94/51/404749451.db2.gz	WLQLFTYSUNOTRZ-DLBZAZTESA-N	0	3	321.509	2.441	10	0		DEAEHN
CC(C)[C@@H](O)C(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1	ZINC000375841347	404758256	/nfs/dbraw/zinc/75/82/56/404758256.db2.gz	RSDLYCPZJAWQOU-BPLDGKMQSA-N	0	3	310.463	2.264	10	0		DEAEHN
OCC[C@H]1CSCCN1CCCc1ccc2c(c1)CCO2	ZINC000360967564	404864064	/nfs/dbraw/zinc/86/40/64/404864064.db2.gz	AVELLFBOHUXMIE-INIZCTEOSA-N	0	3	307.459	2.354	10	0		DEAEHN
C[C@@H](C[S@](C)=O)NCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000361270246	405001131	/nfs/dbraw/zinc/00/11/31/405001131.db2.gz	DKYKNLUIOMORJR-QKVFXAPYSA-N	0	3	311.447	2.499	10	0		DEAEHN
O=C(CCc1cncc2ccccc21)NCCNc1ccncc1	ZINC000361375514	405045170	/nfs/dbraw/zinc/04/51/70/405045170.db2.gz	JINFZVSTFIHLET-UHFFFAOYSA-N	0	3	320.396	2.213	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCC[C@@H](Cc2nccn2C)C1	ZINC000361543070	405123236	/nfs/dbraw/zinc/12/32/36/405123236.db2.gz	KBECMPNFRHWDCT-HOTGVXAUSA-N	0	3	318.465	2.076	10	0		DEAEHN
CCOC(=O)CC(C)(C)CCN1CCO[C@]2(CCCOC2)C1	ZINC000367866206	405178052	/nfs/dbraw/zinc/17/80/52/405178052.db2.gz	SIVGCWUEKKETHK-QGZVFWFLSA-N	0	3	313.438	2.237	10	0		DEAEHN
CC(=O)N1CC[C@H](CN(C)Cc2ccc(-c3ccccn3)nc2)C1	ZINC000425415015	405286955	/nfs/dbraw/zinc/28/69/55/405286955.db2.gz	DVIVKHKFTQEZKE-QGZVFWFLSA-N	0	3	324.428	2.444	10	0		DEAEHN
C[C@H](CN1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O)CS(C)(=O)=O	ZINC000368269121	405233724	/nfs/dbraw/zinc/23/37/24/405233724.db2.gz	FDWBLXGISSKIAZ-FPCVCCKLSA-N	0	3	317.495	2.073	10	0		DEAEHN
COCCn1cc(CNC[C@H]2Oc3ccccc3[C@H]2C)cn1	ZINC000368283469	405234359	/nfs/dbraw/zinc/23/43/59/405234359.db2.gz	BJBVSIVRPOVEKU-CXAGYDPISA-N	0	3	301.390	2.184	10	0		DEAEHN
COc1ccc2c(c1)CN(C(=O)CC1CCN(C)CC1)CCO2	ZINC000456152736	405519895	/nfs/dbraw/zinc/51/98/95/405519895.db2.gz	IGFXLWYAIMHRJZ-UHFFFAOYSA-N	0	3	318.417	2.148	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2cccc3cc[nH]c32)CC12COC2	ZINC000449363187	405525561	/nfs/dbraw/zinc/52/55/61/405525561.db2.gz	LOZLOMUEONOSFH-OAHLLOKOSA-N	0	3	314.385	2.179	10	0		DEAEHN
CC(=O)N1CCC(CNCc2nc3ccccc3nc2C)CC1	ZINC000638529063	405528058	/nfs/dbraw/zinc/52/80/58/405528058.db2.gz	YGJVOHMAZRNIGC-UHFFFAOYSA-N	0	3	312.417	2.286	10	0		DEAEHN
Cc1nc(CN[C@@H]2CN(C)C[C@@H]2C)sc1Br	ZINC000449404365	405548709	/nfs/dbraw/zinc/54/87/09/405548709.db2.gz	ZHSOQNLHTXUTJU-IONNQARKSA-N	0	3	304.257	2.254	10	0		DEAEHN
CC[C@](C)(NC(=O)[C@@H](N)CN(C)Cc1ccccc1)C1CC1	ZINC000638858134	405721041	/nfs/dbraw/zinc/72/10/41/405721041.db2.gz	LQRUNFSHGNDQCV-WMZOPIPTSA-N	0	3	303.450	2.141	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CC[C@](C)(C(=O)OC(C)(C)C)C1	ZINC000457277205	405775714	/nfs/dbraw/zinc/77/57/14/405775714.db2.gz	YEDQILPVGMUXCK-KSSFIOAISA-N	0	3	324.465	2.441	10	0		DEAEHN
C(N[C@@H]1CCCC[C@@H]1[C@@H]1CCOC1)c1nnc2n1CCCC2	ZINC000530439933	405802656	/nfs/dbraw/zinc/80/26/56/405802656.db2.gz	RSZFEGZXCXNGAN-RBSFLKMASA-N	0	3	304.438	2.299	10	0		DEAEHN
CC(=O)N1CCN(C[C@@H]2CCN(c3ccccc3)C2)C(C)(C)C1	ZINC000638927387	405763558	/nfs/dbraw/zinc/76/35/58/405763558.db2.gz	UEGSSMRKNYOPCG-QGZVFWFLSA-N	0	3	315.461	2.456	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)NC[C@@H](CC(C)C)N(C)C)c1	ZINC000457552289	405894732	/nfs/dbraw/zinc/89/47/32/405894732.db2.gz	HDBUXAUAZLAJNI-MRXNPFEDSA-N	0	3	320.433	2.488	10	0		DEAEHN
COCCOC[C@H](O)CN1CC[C@H](C)C[C@H]1c1ccc(C)o1	ZINC000450460031	405908958	/nfs/dbraw/zinc/90/89/58/405908958.db2.gz	ZAUPXVYFJKJQTN-IMJJTQAJSA-N	0	3	311.422	2.385	10	0		DEAEHN
OCCC1(NCc2cnc(N3CCCC3)nc2)CCCCC1	ZINC000531191338	405923260	/nfs/dbraw/zinc/92/32/60/405923260.db2.gz	DJHYHOPWCYFCDT-UHFFFAOYSA-N	0	3	304.438	2.252	10	0		DEAEHN
c1ccc(CN2CCO[C@H]3CN(CCC[C@H]4CCO4)C[C@H]32)cc1	ZINC000639305604	406033233	/nfs/dbraw/zinc/03/32/33/406033233.db2.gz	ACIBTWDHDBHSFW-OTWHNJEPSA-N	0	3	316.445	2.141	10	0		DEAEHN
C[C@@H](O)CCN1CCN(c2cccc(Br)c2)CC1	ZINC000450927177	405988088	/nfs/dbraw/zinc/98/80/88/405988088.db2.gz	BFVLBUYVGFLJBE-GFCCVEGCSA-N	0	3	313.239	2.342	10	0		DEAEHN
Cc1nn(C)cc1CC(=O)N1C[C@@H]2CCCN2Cc2ccccc21	ZINC000460021350	406074097	/nfs/dbraw/zinc/07/40/97/406074097.db2.gz	JRQBYTBXGZKGND-KRWDZBQOSA-N	0	3	324.428	2.282	10	0		DEAEHN
c1nc2n(n1)[C@@H](CN1CCC(N3CCc4ccccc43)CC1)CC2	ZINC000639626598	406176472	/nfs/dbraw/zinc/17/64/72/406176472.db2.gz	UJEALFPMJYLVBX-QGZVFWFLSA-N	0	3	323.444	2.293	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@@H]1CCC[C@H]2OCC[C@@H]21	ZINC000487322186	406223904	/nfs/dbraw/zinc/22/39/04/406223904.db2.gz	PWVCPHWMUZFHCY-IRUJWGPZSA-N	0	3	314.227	2.230	10	0		DEAEHN
Cc1ccc([C@H](C)NC(=O)CN2CC[C@H](CO)[C@H]2C)cc1C	ZINC000488732265	406342272	/nfs/dbraw/zinc/34/22/72/406342272.db2.gz	MMKDVOFCYDKEKD-ZMSDIMECSA-N	0	3	304.434	2.183	10	0		DEAEHN
C[C@H](N[C@@H]1CCC(=O)N(C)C1)c1cncc(Br)c1	ZINC000569121952	292392274	/nfs/dbraw/zinc/39/22/74/292392274.db2.gz	OLFPHGBGPUSXNG-JOYOIKCWSA-N	0	3	312.211	2.116	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N[C@@H]1C[C@H]1c1ccccc1	ZINC000637911162	406473813	/nfs/dbraw/zinc/47/38/13/406473813.db2.gz	YFWLJJQCMMNAQM-GBESFXJTSA-N	0	3	323.440	2.118	10	0		DEAEHN
CN1CCN(c2ccncc2NC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)CC1	ZINC000525315242	406485221	/nfs/dbraw/zinc/48/52/21/406485221.db2.gz	PPHJPTFJARVPKF-HALDLXJZSA-N	0	3	314.433	2.208	10	0		DEAEHN
CC(=O)N1CCCN(C[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000637881142	406460178	/nfs/dbraw/zinc/46/01/78/406460178.db2.gz	HMNDJHKNKDPYFG-QGZVFWFLSA-N	0	3	301.434	2.067	10	0		DEAEHN
C[C@@H](N(C)C(=O)[C@H](N)CN(C)Cc1ccccc1)C1(C)CC1	ZINC000638042279	406539754	/nfs/dbraw/zinc/53/97/54/406539754.db2.gz	QFBXULHXCZBLAX-GDBMZVCRSA-N	0	3	303.450	2.093	10	0		DEAEHN
CCc1cnc(CNC[C@@H]2CCC3(CCOCC3)[C@H]2O)s1	ZINC000548992070	406571049	/nfs/dbraw/zinc/57/10/49/406571049.db2.gz	UKLSCIPZZYNPLK-WFASDCNBSA-N	0	3	310.463	2.363	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N[C@@H]1CCc2ccccc21	ZINC000638416969	406760496	/nfs/dbraw/zinc/76/04/96/406760496.db2.gz	WANZJLRXNPNICM-RTBURBONSA-N	0	3	323.440	2.249	10	0		DEAEHN
OCCN1CCC[C@@H](NCc2ccsc2C(F)(F)F)C1	ZINC000527655607	406706079	/nfs/dbraw/zinc/70/60/79/406706079.db2.gz	KKXPVPGTYQYQFI-LLVKDONJSA-N	0	3	308.369	2.313	10	0		DEAEHN
O=C(NCCNc1ccncc1)NC[C@@H]1CCCC(F)(F)C1	ZINC000554605556	406816937	/nfs/dbraw/zinc/81/69/37/406816937.db2.gz	UCHPDUNNKWKWHR-GFCCVEGCSA-N	0	3	312.364	2.040	10	0		DEAEHN
CSc1nc(Cl)cc(NC[C@@H]2CN3CCC[C@@H]3CO2)n1	ZINC000129524276	196055255	/nfs/dbraw/zinc/05/52/55/196055255.db2.gz	WDHUYEOJSCDXCH-NXEZZACHSA-N	0	3	314.842	2.127	10	0		DEAEHN
COc1ccccc1[C@H](O)CN[C@@H]1CCCc2c1cnn2C	ZINC000130602620	196094335	/nfs/dbraw/zinc/09/43/35/196094335.db2.gz	YZYREVJJBJGWAO-GDBMZVCRSA-N	0	3	301.390	2.129	10	0		DEAEHN
O=S1(=O)CCC[C@@H](NC2=NCC3(CCCCC3)CS2)C1	ZINC000131154101	196144316	/nfs/dbraw/zinc/14/43/16/196144316.db2.gz	UJYZNDUMEDOAQL-GFCCVEGCSA-N	0	3	316.492	2.207	10	0		DEAEHN
Cc1nn(C)c(C[C@H](N)c2ncccc2F)c1Br	ZINC000131315869	196160362	/nfs/dbraw/zinc/16/03/62/196160362.db2.gz	RCYIBPQWLQLPGV-VIFPVBQESA-N	0	3	313.174	2.268	10	0		DEAEHN
CCOC(=O)[C@@H](NCCN(C)C)c1cccc(C(F)F)c1	ZINC000131965266	196214152	/nfs/dbraw/zinc/21/41/52/196214152.db2.gz	KOMSMRXRRCHOQK-ZDUSSCGKSA-N	0	3	300.349	2.380	10	0		DEAEHN
O=C(N[C@H]1CCC[C@@H](OCC(F)(F)F)C1)[C@@H]1CCCCN1	ZINC000132327059	196246637	/nfs/dbraw/zinc/24/66/37/196246637.db2.gz	CCWZKWOKQFNBOC-TUAOUCFPSA-N	0	3	308.344	2.135	10	0		DEAEHN
NC1(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)CCOCC1	ZINC000132237063	196238006	/nfs/dbraw/zinc/23/80/06/196238006.db2.gz	AAVBCNDGVAQYSV-UHFFFAOYSA-N	0	3	320.723	2.388	10	0		DEAEHN
CC[C@@](O)(c1c(Br)cnn1CCN(C)C)C1CC1	ZINC000132461235	196257621	/nfs/dbraw/zinc/25/76/21/196257621.db2.gz	CSJAKTXBLOYMPE-ZDUSSCGKSA-N	0	3	316.243	2.215	10	0		DEAEHN
CC[C@](O)(c1c(Br)cnn1CCN(C)C)C1CC1	ZINC000132461406	196257922	/nfs/dbraw/zinc/25/79/22/196257922.db2.gz	CSJAKTXBLOYMPE-CYBMUJFWSA-N	0	3	316.243	2.215	10	0		DEAEHN
Cc1cccc2c(NC[C@@H](O)CN3CCCCC3)ncnc12	ZINC000132617980	196271124	/nfs/dbraw/zinc/27/11/24/196271124.db2.gz	JSHVJGUYODLBKI-CQSZACIVSA-N	0	3	300.406	2.197	10	0		DEAEHN
Cc1ccc([C@H](CN)N[C@H](C)CCO)c(Br)c1	ZINC000132684672	196276290	/nfs/dbraw/zinc/27/62/90/196276290.db2.gz	QLAOUAJDTVLABQ-MFKMUULPSA-N	0	3	301.228	2.118	10	0		DEAEHN
CCN[C@@H](C[C@H]1CCCN(S(C)(=O)=O)C1)c1occc1C	ZINC000133190539	196319520	/nfs/dbraw/zinc/31/95/20/196319520.db2.gz	GANNZJBDVUVLLB-KGLIPLIRSA-N	0	3	314.451	2.300	10	0		DEAEHN
CCN[C@H](c1c(Br)cnn1C)[C@H]1CO[C@@H](C)C1	ZINC000133932009	196347269	/nfs/dbraw/zinc/34/72/69/196347269.db2.gz	IQJCTRKFAFZZEW-NGZCFLSTSA-N	0	3	302.216	2.258	10	0		DEAEHN
COc1ccc(C(C)(C)C(=O)N2CC[C@H](N(C)C)C2)cc1OC	ZINC000134265828	196375162	/nfs/dbraw/zinc/37/51/62/196375162.db2.gz	WDVCGGISIUBHDJ-AWEZNQCLSA-N	0	3	320.433	2.144	10	0		DEAEHN
Cc1cccc(S(=O)(=O)N[C@@](C)(CN)c2ccccc2)c1	ZINC000134474296	196395170	/nfs/dbraw/zinc/39/51/70/196395170.db2.gz	AZJQMTGMOQENND-INIZCTEOSA-N	0	3	304.415	2.147	10	0		DEAEHN
c1ccc(OC2CCC2)c(CN[C@H](C2CC2)[C@@H]2CNCCO2)c1	ZINC000422915784	230274830	/nfs/dbraw/zinc/27/48/30/230274830.db2.gz	YZNPRTDMNJKRAX-RBUKOAKNSA-N	0	3	316.445	2.475	10	0		DEAEHN
Cc1nnc(NC[C@@H]2CCCN(C)[C@H]2c2cccs2)nc1C	ZINC000359574188	424830893	/nfs/dbraw/zinc/83/08/93/424830893.db2.gz	HHUULAZFYUSIDE-DZGCQCFKSA-N	0	3	317.462	3.045	10	0		DEAEHN
Cc1c(Cl)cccc1NC(=O)Cn1cc(C(C)(C)N)nn1	ZINC000070118872	424841884	/nfs/dbraw/zinc/84/18/84/424841884.db2.gz	STXFZRIMRKDRPH-UHFFFAOYSA-N	0	3	307.785	2.072	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)Nc2ccc(C)cc2C)c1	ZINC000105881398	424849492	/nfs/dbraw/zinc/84/94/92/424849492.db2.gz	HUKVTTQPZKIBLQ-OAHLLOKOSA-N	0	3	300.406	2.425	10	0		DEAEHN
Brc1ccsc1CN1CC[C@H]2OCCN[C@H]2C1	ZINC000404248877	424925956	/nfs/dbraw/zinc/92/59/56/424925956.db2.gz	IAAQEXKYBAOGIW-WDEREUQCSA-N	0	3	317.252	2.073	10	0		DEAEHN
CC(C)n1ncnc1CN[C@H](C)CN(C)Cc1ccccc1	ZINC000309806256	424894341	/nfs/dbraw/zinc/89/43/41/424894341.db2.gz	LHHUNRFDXDKGOH-OAHLLOKOSA-N	0	3	301.438	2.469	10	0		DEAEHN
OCC1CC(NCc2cc(Br)cc3c2OCC3)C1	ZINC000657811159	425403968	/nfs/dbraw/zinc/40/39/68/425403968.db2.gz	RYGCEXLHSSMFAF-UHFFFAOYSA-N	0	3	312.207	2.245	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)N[C@@H](C)CSC)cc2)CC1	ZINC000173830283	267484591	/nfs/dbraw/zinc/48/45/91/267484591.db2.gz	XVSSYLSRJMABQX-AWEZNQCLSA-N	0	3	321.490	2.310	10	0		DEAEHN
CN(C(=O)Cc1c(F)cccc1Cl)[C@H](CN)C(F)(F)F	ZINC000662975068	425768581	/nfs/dbraw/zinc/76/85/81/425768581.db2.gz	FHUJTDSWUAJUPP-SNVBAGLBSA-N	0	3	312.694	2.370	10	0		DEAEHN
CN(C(=O)COc1cccc(Cl)c1)[C@@H](CN)C(F)(F)F	ZINC000662979134	425770686	/nfs/dbraw/zinc/77/06/86/425770686.db2.gz	SUUVZHXAOLMNPS-JTQLQIEISA-N	0	3	310.703	2.067	10	0		DEAEHN
C[C@@H]1CCCCN1C(=O)CN[C@@H]1CCCC[C@@H]1n1cccn1	ZINC000333185615	268899556	/nfs/dbraw/zinc/89/95/56/268899556.db2.gz	SVNWERHKXMBRKT-OAGGEKHMSA-N	0	3	304.438	2.357	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)N1CCN(c2ccccc2)CC1	ZINC000262556695	275816382	/nfs/dbraw/zinc/81/63/82/275816382.db2.gz	UHSNTIAJXIUCCC-INIZCTEOSA-N	0	3	301.434	2.113	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCOC[C@@H]2c2ccc(C)o2)C1	ZINC000117037468	276166397	/nfs/dbraw/zinc/16/63/97/276166397.db2.gz	ULNSNXMAGZRBLF-HUUCEWRRSA-N	0	3	321.421	2.155	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H]2CCOc3ccc(F)cc32)C1	ZINC000069411283	276166823	/nfs/dbraw/zinc/16/68/23/276166823.db2.gz	ZLNAGHSJMKSKKR-UKRRQHHQSA-N	0	3	321.396	2.433	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H]2CCOc3ccc(F)cc32)C1	ZINC000245827635	276177684	/nfs/dbraw/zinc/17/76/84/276177684.db2.gz	ZLNAGHSJMKSKKR-ZFWWWQNUSA-N	0	3	321.396	2.433	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C)C(=O)N1CCc2ccccc21	ZINC000245459078	276377751	/nfs/dbraw/zinc/37/77/51/276377751.db2.gz	DHGHHFCWSXZXQO-WBVHZDCISA-N	0	3	315.461	2.380	10	0		DEAEHN
CN1CCO[C@@H](CN[C@H]2CC3(CCC3)Oc3ccccc32)C1	ZINC000246395511	277119717	/nfs/dbraw/zinc/11/97/17/277119717.db2.gz	LGKLUTUVDXKYLE-HOCLYGCPSA-N	0	3	302.418	2.353	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)[C@H]2COc3ccccc32)C1	ZINC000247022191	277155685	/nfs/dbraw/zinc/15/56/85/277155685.db2.gz	ZMXVQQKWPKHRFG-CWRNSKLLSA-N	0	3	300.402	2.105	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc3c2OCCO3)C1	ZINC000247329761	277156032	/nfs/dbraw/zinc/15/60/32/277156032.db2.gz	UTSFBQZFJFVWIV-DZGCQCFKSA-N	0	3	316.401	2.014	10	0		DEAEHN
CC(C)CC(=O)N1CCC(CN2CCC[C@](F)(CO)C2)CC1	ZINC000367865511	277342518	/nfs/dbraw/zinc/34/25/18/277342518.db2.gz	PEANIRFXHJACHF-QGZVFWFLSA-N	0	3	314.445	2.068	10	0		DEAEHN
CO[C@H]1CN(Cc2ccccc2OCC(=O)N(C)C)CC[C@H]1C	ZINC000188328831	277343765	/nfs/dbraw/zinc/34/37/65/277343765.db2.gz	UWLRDJXDCIFIHM-PBHICJAKSA-N	0	3	320.433	2.010	10	0		DEAEHN
CCN(C)[C@H](C(=O)N1CCCN(C2CC2)CC1)c1ccccc1	ZINC000171480662	279044112	/nfs/dbraw/zinc/04/41/12/279044112.db2.gz	YVPUQXLFSCWYRA-SFHVURJKSA-N	0	3	315.461	2.376	10	0		DEAEHN
CC(C)C[C@H](C)C(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000184827527	279082885	/nfs/dbraw/zinc/08/28/85/279082885.db2.gz	XFBFIFSOMGOCAC-IRXDYDNUSA-N	0	3	309.498	2.297	10	0		DEAEHN
C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000471902390	279097843	/nfs/dbraw/zinc/09/78/43/279097843.db2.gz	YUHDLSACIYXIJP-JFGNBEQYSA-N	0	3	305.344	2.205	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H]1[C@H]2CCO[C@H]2C12CCC2	ZINC000245736604	279298608	/nfs/dbraw/zinc/29/86/08/279298608.db2.gz	BJTDSTRBCOBGOC-KLHDSHLOSA-N	0	3	321.465	2.070	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)N1CC[C@H]2OCCC[C@@H]2C1	ZINC000151269344	279301737	/nfs/dbraw/zinc/30/17/37/279301737.db2.gz	NSDSHQXQJSRTBK-BZUAXINKSA-N	0	3	309.454	2.071	10	0		DEAEHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)c1cnn2c1CCCC2	ZINC000127215020	279310916	/nfs/dbraw/zinc/31/09/16/279310916.db2.gz	WDFWUQYXGCIREB-UONOGXRCSA-N	0	3	304.438	2.070	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cn(C)nc1C(C)(C)C	ZINC000127533962	279326998	/nfs/dbraw/zinc/32/69/98/279326998.db2.gz	HGWSJZPWAURYCO-ZDUSSCGKSA-N	0	3	306.454	2.274	10	0		DEAEHN
C[C@H](N)CC(=O)/N=c1/sccn1Cc1ccccc1Cl	ZINC000261881372	279394346	/nfs/dbraw/zinc/39/43/46/279394346.db2.gz	RWPAZRLSYGBBJK-KDSBZSBUSA-N	0	3	309.822	2.416	10	0		DEAEHN
C[C@H]1NCCN(C(=O)C2=Cc3cc(Cl)ccc3OC2)[C@H]1C	ZINC000262899368	280049701	/nfs/dbraw/zinc/04/97/01/280049701.db2.gz	XMVBMYSYJZEQLN-MNOVXSKESA-N	0	3	306.793	2.325	10	0		DEAEHN
Cc1c(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)[nH]c2c1C(=O)CCC2	ZINC000268430699	280219660	/nfs/dbraw/zinc/21/96/60/280219660.db2.gz	YCXLESJEGWOVPU-FZMZJTMJSA-N	0	3	317.433	2.301	10	0		DEAEHN
CC[C@H](C)N[C@@H](CNC(=O)N[C@H](C)[C@H](C)OC)c1ccco1	ZINC000461007603	280749940	/nfs/dbraw/zinc/74/99/40/280749940.db2.gz	LAJDOYQGRZFXJE-CRWXNKLISA-N	0	3	311.426	2.431	10	0		DEAEHN
C[C@H](CNC(=O)NC1CCN(C)CC1)c1ccc(F)cc1F	ZINC000073485288	281541774	/nfs/dbraw/zinc/54/17/74/281541774.db2.gz	FJTAJUODBHEVKC-LLVKDONJSA-N	0	3	311.376	2.462	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)COc1ccc(F)cc1F	ZINC000077730556	281577567	/nfs/dbraw/zinc/57/75/67/281577567.db2.gz	XYBFIXKBQLLTKL-CYBMUJFWSA-N	0	3	314.376	2.436	10	0		DEAEHN
CC1CCN(CCNC(=O)Nc2ccc([S@@](C)=O)cc2)CC1	ZINC000080127553	281595853	/nfs/dbraw/zinc/59/58/53/281595853.db2.gz	OAUMZMJBQVGLLI-QFIPXVFZSA-N	0	3	323.462	2.277	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)NC[C@H](C)SC)cc2)CC1	ZINC000129476407	281912905	/nfs/dbraw/zinc/91/29/05/281912905.db2.gz	DHIPMZQFBAGNNU-AWEZNQCLSA-N	0	3	321.490	2.310	10	0		DEAEHN
C[C@H](C1CC1)N(C(=O)CN1CC[C@@]2(O)CCCC[C@@H]2C1)C1CC1	ZINC000248202579	289398124	/nfs/dbraw/zinc/39/81/24/289398124.db2.gz	ZEYFPVKPJRHOQZ-OGWOLHLISA-N	0	3	320.477	2.403	10	0		DEAEHN
COC[C@H](C)OC[C@H](O)CN1CC[C@H](C)C[C@H]1c1ccco1	ZINC000377082182	293043623	/nfs/dbraw/zinc/04/36/23/293043623.db2.gz	KBHRMLOXORPJOQ-JONQDZQNSA-N	0	3	311.422	2.465	10	0		DEAEHN
NC(=O)NC(=O)CN[C@H](c1ccc(Cl)cc1)C1CCCC1	ZINC000182556550	295075670	/nfs/dbraw/zinc/07/56/70/295075670.db2.gz	OCEDNTZAOBVTOV-AWEZNQCLSA-N	0	3	309.797	2.356	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)N(C)C2CCN(C)CC2)c1	ZINC000106725417	295317527	/nfs/dbraw/zinc/31/75/27/295317527.db2.gz	KQMBJMKRIXUMID-IRXDYDNUSA-N	0	3	302.418	2.351	10	0		DEAEHN
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CSC2(C)C)cc1	ZINC000572596133	325954167	/nfs/dbraw/zinc/95/41/67/325954167.db2.gz	JTOJBRFROKKOMF-HIFRSBDPSA-N	0	3	309.431	2.113	10	0		DEAEHN
CC[C@H](C)n1ncc(C(=O)N[C@H]2CN(C3CC3)C[C@@H]2C)c1C	ZINC000574690353	326178144	/nfs/dbraw/zinc/17/81/44/326178144.db2.gz	BSYGLMVMPYTGNM-MKBNYLNASA-N	0	3	304.438	2.375	10	0		DEAEHN
c1cc(-c2noc(CN3CCN(C4CCCC4)CC3)n2)co1	ZINC000584248275	331953237	/nfs/dbraw/zinc/95/32/37/331953237.db2.gz	JHMHVOUVOHFGOT-UHFFFAOYSA-N	0	3	302.378	2.390	10	0		DEAEHN
CC[C@@H](N[C@@H](C)C1CCS(=O)(=O)CC1)c1nccs1	ZINC000187228159	332963657	/nfs/dbraw/zinc/96/36/57/332963657.db2.gz	LJORHNJYCVMYRD-CMPLNLGQSA-N	0	3	302.465	2.397	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1c[nH]c(=O)c2ccccc12	ZINC000188222643	333039362	/nfs/dbraw/zinc/03/93/62/333039362.db2.gz	ZZXRYSDGSMKKMF-CYBMUJFWSA-N	0	3	313.401	2.084	10	0		DEAEHN
COC[C@@H](C)CN1CCN(c2ncnc3sccc32)CC1	ZINC000189621475	333164640	/nfs/dbraw/zinc/16/46/40/333164640.db2.gz	DGKIQPDOYVKHLV-LBPRGKRZSA-N	0	3	306.435	2.096	10	0		DEAEHN
Cc1noc(CCN[C@H](C)c2ccc(Br)cn2)n1	ZINC000582898089	337212396	/nfs/dbraw/zinc/21/23/96/337212396.db2.gz	ZHRJQCRBBREGPS-MRVPVSSYSA-N	0	3	311.183	2.429	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000247448482	519719927	/nfs/dbraw/zinc/71/99/27/519719927.db2.gz	SMUVGUJAYHRBCO-MEDUHNTESA-N	0	3	321.396	2.243	10	0		DEAEHN
CCCN(C[C@@H]1CCCCO1)C(=O)N[C@@H]1CCCN(CC)C1	ZINC000106541552	521675794	/nfs/dbraw/zinc/67/57/94/521675794.db2.gz	DQCAGTNJVCIEPF-CVEARBPZSA-N	0	3	311.470	2.461	10	0		DEAEHN
CC[N@@H+]1CC[C@H](N(C)C(=O)c2cc(OC)ccc2[O-])[C@@H](C)C1	ZINC000247417481	521718926	/nfs/dbraw/zinc/71/89/26/521718926.db2.gz	NRGIMLIIYAMLJE-WFASDCNBSA-N	0	3	306.406	2.203	10	0		DEAEHN
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(OC)ccc2[O-])[C@@H](C)C1	ZINC000247417481	521718927	/nfs/dbraw/zinc/71/89/27/521718927.db2.gz	NRGIMLIIYAMLJE-WFASDCNBSA-N	0	3	306.406	2.203	10	0		DEAEHN
COC(=O)COc1c(C)cc(CN(C)C[C@@H]2CCCO2)cc1C	ZINC000128124409	523214733	/nfs/dbraw/zinc/21/47/33/523214733.db2.gz	OJXOZASBXOEGKC-INIZCTEOSA-N	0	3	321.417	2.466	10	0		DEAEHN
COCCCNC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000157434467	523339174	/nfs/dbraw/zinc/33/91/74/523339174.db2.gz	NJPDNEKANDNMFD-GOSISDBHSA-N	0	3	319.449	2.377	10	0		DEAEHN
C/C(=C\c1cccc(C(F)(F)F)c1)CN[C@H](CO)[C@@H](C)O	ZINC000419797516	527527488	/nfs/dbraw/zinc/52/74/88/527527488.db2.gz	UBJLJKXVBIRIJX-ONNUJCNVSA-N	0	3	303.324	2.440	10	0		DEAEHN
CCO[C@H](C)c1noc(CN2C[C@@H]3CCCCN3C[C@@H]2C)n1	ZINC000328681227	528020487	/nfs/dbraw/zinc/02/04/87/528020487.db2.gz	VBEUZEMJAHQDII-MJBXVCDLSA-N	0	3	308.426	2.226	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@H]2CCCc3c(O)cccc32)C1	ZINC000190308591	529091327	/nfs/dbraw/zinc/09/13/27/529091327.db2.gz	WDFJXZZMEPHUPL-XJKSGUPXSA-N	0	3	302.418	2.413	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@@]1(N)C(=O)N1CCc2ccccc21	ZINC000262392367	535042025	/nfs/dbraw/zinc/04/20/25/535042025.db2.gz	BKNFUKHTKYLXRP-JCKWVBRZSA-N	0	3	300.402	2.108	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)CCC(=O)c2ccccc2)C1	ZINC000247369906	535256615	/nfs/dbraw/zinc/25/66/15/535256615.db2.gz	PBJGEKYDPFBUJU-GDBMZVCRSA-N	0	3	302.418	2.494	10	0		DEAEHN
CCCN(CC)CCNC(=O)C(=O)N1CCC2(C1)CCCCC2	ZINC000360160157	535297785	/nfs/dbraw/zinc/29/77/85/535297785.db2.gz	CHXXZAHOOGSXTN-UHFFFAOYSA-N	0	3	323.481	2.017	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)N1CCC(Nc2nccs2)CC1	ZINC000190432848	535493159	/nfs/dbraw/zinc/49/31/59/535493159.db2.gz	MWBCOLDOKJDCRZ-AWEZNQCLSA-N	0	3	322.478	2.420	10	0		DEAEHN
CCCc1nc(CN2CCNC[C@@H]2c2ccccc2OC)no1	ZINC000261668724	535524846	/nfs/dbraw/zinc/52/48/46/535524846.db2.gz	HMIVCPYAMOEKFM-CQSZACIVSA-N	0	3	316.405	2.177	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CCCc1nc(C2CC2)no1	ZINC000176983895	535584729	/nfs/dbraw/zinc/58/47/29/535584729.db2.gz	BLDIWXUMWTTWRF-AWEZNQCLSA-N	0	3	320.437	2.212	10	0		DEAEHN
CCOC(=O)[C@H](CC)N1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000247216864	535647839	/nfs/dbraw/zinc/64/78/39/535647839.db2.gz	COXWBQQWQVGDEL-GJZGRUSLSA-N	0	3	305.422	2.466	10	0		DEAEHN
CCN(C(=O)CN1CCNC[C@@H]1c1cccnc1)c1ccccc1	ZINC000261620102	535663811	/nfs/dbraw/zinc/66/38/11/535663811.db2.gz	CXMOTUXHUWVKQU-GOSISDBHSA-N	0	3	324.428	2.081	10	0		DEAEHN
CCN1CCN([C@H](C)CNC(=O)[C@H](C)Cc2ccccc2)CC1	ZINC000358457977	535740079	/nfs/dbraw/zinc/74/00/79/535740079.db2.gz	SPXIYCMIQSJZAU-IAGOWNOFSA-N	0	3	317.477	2.007	10	0		DEAEHN
CN(C)CCOc1ccccc1-c1nc(C2(N)CCC2)no1	ZINC000261929396	535912843	/nfs/dbraw/zinc/91/28/43/535912843.db2.gz	LHRROYDDNWIGLD-UHFFFAOYSA-N	0	3	302.378	2.015	10	0		DEAEHN
CC[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)NCc1ccc([O-])c(F)c1	ZINC000246565435	536167301	/nfs/dbraw/zinc/16/73/01/536167301.db2.gz	ZFLRWQZYWCGJGV-KBPBESRZSA-N	0	3	321.396	2.300	10	0		DEAEHN
CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCc1ccc([O-])c(F)c1	ZINC000246565435	536167304	/nfs/dbraw/zinc/16/73/04/536167304.db2.gz	ZFLRWQZYWCGJGV-KBPBESRZSA-N	0	3	321.396	2.300	10	0		DEAEHN
C[NH2+][C@@H](C)C[N-]S(=O)(=O)c1oc2ccc(Cl)cc2c1C	ZINC000261763365	536344241	/nfs/dbraw/zinc/34/42/41/536344241.db2.gz	ONJQIOHCMZLQSB-QMMMGPOBSA-N	0	3	316.810	2.281	10	0		DEAEHN
CN(CCN1CCN2CCCC[C@H]2C1)Cc1ccc(F)cc1	ZINC000248561516	536371959	/nfs/dbraw/zinc/37/19/59/536371959.db2.gz	NCIQWLBXZPSLRB-SFHVURJKSA-N	0	3	305.441	2.428	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cnc3ccccc3n2)C1	ZINC000246749785	536472312	/nfs/dbraw/zinc/47/23/12/536472312.db2.gz	POWJSSSQUHPFFL-SUMWQHHRSA-N	0	3	310.401	2.186	10	0		DEAEHN
CN(Cc1ccccc1F)C(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C	ZINC000261919705	536482799	/nfs/dbraw/zinc/48/27/99/536482799.db2.gz	RKQSDTUHEQFUCK-DHSIGJKJSA-N	0	3	320.408	2.317	10	0		DEAEHN
CO[C@@H]1CN(Cc2cn(C)nc2-c2ccncc2)CC[C@@H]1C	ZINC000249163900	536733566	/nfs/dbraw/zinc/73/35/66/536733566.db2.gz	JULMTBPRWBIKRV-XJKSGUPXSA-N	0	3	300.406	2.339	10	0		DEAEHN
COc1ccccc1OCCN(C)C[C@H](O)COC(C)(C)C	ZINC000052452023	625179468	/nfs/dbraw/zinc/17/94/68/625179468.db2.gz	WXJMWIVTFUXBBA-AWEZNQCLSA-N	0	3	311.422	2.182	10	0		DEAEHN
c1cn(-c2cc(CNCc3ccc4c[nH]nc4c3)ccn2)cn1	ZINC000236578292	625189688	/nfs/dbraw/zinc/18/96/88/625189688.db2.gz	BEWKMYYPTNRFTO-UHFFFAOYSA-N	0	3	304.357	2.433	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2c(C)c3ccccc3oc2=O)C1	ZINC000177199397	625880198	/nfs/dbraw/zinc/88/01/98/625880198.db2.gz	VJYXJEJLPSIHCN-CYBMUJFWSA-N	0	3	314.385	2.316	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N[C@@H]1CCCc2nc(C)ncc21	ZINC000734823792	633429823	/nfs/dbraw/zinc/42/98/23/633429823.db2.gz	DXKMBCFIZVINAR-CVEARBPZSA-N	0	3	302.422	2.153	10	0		DEAEHN
c1nc2c(c(NC[C@@H]3CN4CCC[C@H]4CO3)n1)CCCCC2	ZINC000317077675	635109341	/nfs/dbraw/zinc/10/93/41/635109341.db2.gz	NTIZLTADHOOWGH-UONOGXRCSA-N	0	3	302.422	2.021	10	0		DEAEHN
COC(=O)/C(C)=C/CN(CCO)[C@@H]1CCCc2ccccc21	ZINC000748815598	638593743	/nfs/dbraw/zinc/59/37/43/638593743.db2.gz	CBHRQVOVPIZUPP-IDKBZEPQSA-N	0	3	303.402	2.478	10	0		DEAEHN
CCOC(=O)[C@H](CC1CC1)NC(=O)[C@H](C)N1CCCCCC1	ZINC000752385050	639178525	/nfs/dbraw/zinc/17/85/25/639178525.db2.gz	DWKZCBYOIFOBEW-ZFWWWQNUSA-N	0	3	310.438	2.099	10	0		DEAEHN
O=C(CN1CCC2(CCCC2)C1)N1CCO[C@H]2CCCC[C@H]21	ZINC000174276896	646802681	/nfs/dbraw/zinc/80/26/81/646802681.db2.gz	BNAUSICILHDISS-CVEARBPZSA-N	0	3	306.450	2.423	10	0		DEAEHN
Cc1cc(C)cc([C@H](O)CN2CCC(NC(=O)C3CC3)CC2)c1	ZINC000174730247	646997167	/nfs/dbraw/zinc/99/71/67/646997167.db2.gz	UTTDGEBHLQCGDJ-GOSISDBHSA-N	0	3	316.445	2.327	10	0		DEAEHN
CC(C)[C@H](CN(C)C)NC(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000733164297	647893768	/nfs/dbraw/zinc/89/37/68/647893768.db2.gz	ONMCNHYVHGFTCO-INIZCTEOSA-N	0	3	302.418	2.060	10	0		DEAEHN
CCC1(CNCc2nc(Br)c[nH]2)CCOCC1	ZINC000383869621	685409348	/nfs/dbraw/zinc/40/93/48/685409348.db2.gz	HOIKNUPALSYWBK-UHFFFAOYSA-N	0	3	302.216	2.469	10	0		DEAEHN
Cc1cc(C)n(CCCNCc2nc(Br)c[nH]2)n1	ZINC000385778706	685414947	/nfs/dbraw/zinc/41/49/47/685414947.db2.gz	WVONIAXXICXKHJ-UHFFFAOYSA-N	0	3	312.215	2.165	10	0		DEAEHN
CC(=O)N1C[C@@H](NCc2cccnc2)CC[C@@H]1C(F)(F)F	ZINC000886038217	691989607	/nfs/dbraw/zinc/98/96/07/691989607.db2.gz	SITLTIFDKCFRQS-QWHCGFSZSA-N	0	3	301.312	2.113	10	0		DEAEHN
CC(C)[C@H](CNCc1cncnc1)ONC(=O)OC(C)(C)C	ZINC000398770243	790291245	/nfs/dbraw/zinc/29/12/45/790291245.db2.gz	CBYRQXKKOYQASO-ZDUSSCGKSA-N	0	3	310.398	2.047	10	0		DEAEHN
CN(C)[C@@H]1Cc2ccccc2N(C(=O)/C=C\c2ccncn2)C1	ZINC000588438843	777195064	/nfs/dbraw/zinc/19/50/64/777195064.db2.gz	BEFPAPNJJMYZSP-XITLMJRVSA-N	0	3	308.385	2.009	10	0		DEAEHN
CC[C@@H](NCc1nc(Br)c[nH]1)[C@@H]1CCCOC1	ZINC000724011146	777220579	/nfs/dbraw/zinc/22/05/79/777220579.db2.gz	CYGJJKQEOHRUGN-NXEZZACHSA-N	0	3	302.216	2.467	10	0		DEAEHN
C[C@@](O)(CN1CCC[C@](C)(O)CC1)C(F)(F)C(F)(F)F	ZINC000724041750	777228918	/nfs/dbraw/zinc/22/89/18/777228918.db2.gz	OVVRXXACHZSVGY-VHSXEESVSA-N	0	3	305.287	2.172	10	0		DEAEHN
Cc1cnc(CNC[C@H](O)COCc2ccccc2)c(C)c1	ZINC000724095421	777239675	/nfs/dbraw/zinc/23/96/75/777239675.db2.gz	KKQHQJJSTVNOOQ-KRWDZBQOSA-N	0	3	300.402	2.366	10	0		DEAEHN
CC1(C)C[NH2+]C[C@@H]1[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000721893056	781582897	/nfs/dbraw/zinc/58/28/97/781582897.db2.gz	WLLWKOPYYMLJON-JTQLQIEISA-N	0	3	323.245	2.270	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=S)NC2CCN(C)CC2)c1	ZINC000745181413	784691101	/nfs/dbraw/zinc/69/11/01/784691101.db2.gz	MCXRRJRLOMCWJB-UHFFFAOYSA-N	0	3	320.462	2.050	10	0		DEAEHN
Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)N(C)CC1CC(O)C1	ZINC000190201295	786181899	/nfs/dbraw/zinc/18/18/99/786181899.db2.gz	RGOVKSRPAKZHJT-QVOMUQBLSA-N	0	3	304.434	2.263	10	0		DEAEHN
CC1CCN(CCNCc2cn(C)nc2Br)CC1	ZINC000712462124	792188978	/nfs/dbraw/zinc/18/89/78/792188978.db2.gz	KLWAFZFTHNMUQO-UHFFFAOYSA-N	0	3	315.259	2.004	10	0		DEAEHN
CO[C@H]1C[C@H](CNCc2c(Br)c(C)nn2C)C1	ZINC000714584435	792320276	/nfs/dbraw/zinc/32/02/76/792320276.db2.gz	LQXKRFYJIFAGGN-MGCOHNPYSA-N	0	3	302.216	2.006	10	0		DEAEHN
C[C@H](NCC1CC(NC(=O)OC(C)(C)C)C1)c1cnccn1	ZINC000715068768	792379972	/nfs/dbraw/zinc/37/99/72/792379972.db2.gz	ZBYXGZKYLWSHBF-HIFPTAJRSA-N	0	3	306.410	2.431	10	0		DEAEHN
CO[C@H]1CCC[C@@H](NCc2cn(C)nc2Br)C1	ZINC000720645729	1085803389	/nfs/dbraw/zinc/80/33/89/1085803389.db2.gz	LZIFYTOSECNBSV-MNOVXSKESA-N	0	3	302.216	2.230	10	0		DEAEHN
CN1CCC[C@H]2[C@H]1CCN2C(=O)c1ccnc(Br)c1	ZINC000720828898	1086183611	/nfs/dbraw/zinc/18/36/11/1086183611.db2.gz	JVDSXZVCWUCPPP-NEPJUHHUSA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@H]1O[C@@H](C)[C@H](C)[C@H]1NCc1cc(Br)nn1C	ZINC000701042644	1086347956	/nfs/dbraw/zinc/34/79/56/1086347956.db2.gz	MATCLLXXDYMABT-APOZVJGGSA-N	0	3	302.216	2.084	10	0		DEAEHN
COC1(OC)CC[C@@H]1N[C@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000710957197	1086691713	/nfs/dbraw/zinc/69/17/13/1086691713.db2.gz	CRMNFEOCFQDTLN-WOPDTQHZSA-N	0	3	302.415	2.029	10	0		DEAEHN
NC(=O)CC1CC(NCc2ccc(CSC(F)F)o2)C1	ZINC000718502912	1088569098	/nfs/dbraw/zinc/56/90/98/1088569098.db2.gz	OPWBRFLAJAGEFD-UHFFFAOYSA-N	0	3	304.362	2.479	10	0		DEAEHN
C(N[C@@H]1CCCN2CCSC[C@H]12)c1nc2c(s1)CCC2	ZINC000719530664	1089286677	/nfs/dbraw/zinc/28/66/77/1089286677.db2.gz	NVCJRGXDFOQQNP-DGCLKSJQSA-N	0	3	309.504	2.301	10	0		DEAEHN
C(N[C@H]1CCCN2CCSC[C@@H]12)c1nc2c(s1)CCC2	ZINC000719530663	1089287151	/nfs/dbraw/zinc/28/71/51/1089287151.db2.gz	NVCJRGXDFOQQNP-AAEUAGOBSA-N	0	3	309.504	2.301	10	0		DEAEHN
Cc1nc(CN[C@@H]2CCN(C)[C@@H]2C)sc1Br	ZINC000719602900	1089325122	/nfs/dbraw/zinc/32/51/22/1089325122.db2.gz	QFTYSZQTZZOKSN-RKDXNWHRSA-N	0	3	304.257	2.396	10	0		DEAEHN
CCN[C@H]1CCOC[C@@H]1S(=O)(=O)c1ccc(C(C)C)cc1	ZINC000081919962	192339245	/nfs/dbraw/zinc/33/92/45/192339245.db2.gz	ORKXAXYGJMLHSC-HOTGVXAUSA-N	0	3	311.447	2.351	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)CCc2ccccc2Cl)CCO1	ZINC000116794778	282136889	/nfs/dbraw/zinc/13/68/89/282136889.db2.gz	GBNSZRXBYJSMSO-AWEZNQCLSA-N	0	3	310.825	2.062	10	0		DEAEHN
CCN[C@@H]1c2ccccc2CCC[C@@H]1S(=O)(=O)CCOC	ZINC000081944010	192344373	/nfs/dbraw/zinc/34/43/73/192344373.db2.gz	FGZSHDCRALHLBK-JKSUJKDBSA-N	0	3	311.447	2.103	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@H]3C2)cc1	ZINC000128296152	282146760	/nfs/dbraw/zinc/14/67/60/282146760.db2.gz	SNGGHXFCWVONKM-DLBZAZTESA-N	0	3	302.418	2.389	10	0		DEAEHN
CN(C)Cc1ccccc1CNC(=O)c1cnccc1N(C)C	ZINC000183570766	282150278	/nfs/dbraw/zinc/15/02/78/282150278.db2.gz	NJPLUFZEVJOVDP-UHFFFAOYSA-N	0	3	312.417	2.139	10	0		DEAEHN
O=C(CN(C[C@@H]1CCCO1)C1CCCC1)NCc1ccco1	ZINC000152920052	282157630	/nfs/dbraw/zinc/15/76/30/282157630.db2.gz	DHNHSRXVAGIBNC-INIZCTEOSA-N	0	3	306.406	2.319	10	0		DEAEHN
COc1cc(Br)c(C(=O)[C@@H]2CCCN2)cc1OC	ZINC000082724504	185197097	/nfs/dbraw/zinc/19/70/97/185197097.db2.gz	CEZQMIDIXFIEMN-JTQLQIEISA-N	0	3	314.179	2.401	10	0		DEAEHN
Cc1cc(CN(C)C[C@@H]2CCCN(C)[C@H]2c2cnn(C)c2)no1	ZINC000328628265	231261256	/nfs/dbraw/zinc/26/12/56/231261256.db2.gz	HCJOCCAXJCRUQU-WMLDXEAASA-N	0	3	317.437	2.231	10	0		DEAEHN
CC(C)(C)c1nnsc1C(=O)NCc1ccccc1CN	ZINC000087455600	185225608	/nfs/dbraw/zinc/22/56/08/185225608.db2.gz	FEJDESHWXSFFNY-UHFFFAOYSA-N	0	3	304.419	2.224	10	0		DEAEHN
CC(C)(N)CS(=O)(=O)Cc1sccc1Br	ZINC000088072522	185238852	/nfs/dbraw/zinc/23/88/52/185238852.db2.gz	UWSYJRXZABCNPQ-UHFFFAOYSA-N	0	3	312.254	2.163	10	0		DEAEHN
CN[C@@H]1CCN(c2c(F)cc(Br)cc2F)C1=O	ZINC000088171601	185240975	/nfs/dbraw/zinc/24/09/75/185240975.db2.gz	HJGSOTXJFZIOOP-SECBINFHSA-N	0	3	305.122	2.052	10	0		DEAEHN
CCN[C@H]1CCN(c2c(F)cc(Br)cc2F)C1=O	ZINC000088171599	185241041	/nfs/dbraw/zinc/24/10/41/185241041.db2.gz	NQYKQIGWQJMQNH-JTQLQIEISA-N	0	3	319.149	2.442	10	0		DEAEHN
CN[C@H]1CCN(c2c3nsnc3c(Cl)cc2Cl)C1=O	ZINC000088120662	185240041	/nfs/dbraw/zinc/24/00/41/185240041.db2.gz	YHYQWJQQHLRPTK-ZETCQYMHSA-N	0	3	317.201	2.323	10	0		DEAEHN
CCO[C@@H](CN)CS(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000088315628	185245174	/nfs/dbraw/zinc/24/51/74/185245174.db2.gz	GWXIXRYNBVBWGR-QMMMGPOBSA-N	0	3	312.218	2.131	10	0		DEAEHN
CN[C@H]1CCCN(c2cc(OC)ccc2Br)C1=O	ZINC000088330710	185246076	/nfs/dbraw/zinc/24/60/76/185246076.db2.gz	ADVWEUCDHFBERY-NSHDSACASA-N	0	3	313.195	2.173	10	0		DEAEHN
CC[C@H](CN)S(=O)(=O)Nc1cccc(O[C@@H](C)CC)c1	ZINC000088473798	185252163	/nfs/dbraw/zinc/25/21/63/185252163.db2.gz	NMJPYDVJVFBFSN-SMDDNHRTSA-N	0	3	300.424	2.343	10	0		DEAEHN
CS(=O)(=O)c1ccc(N2CCNCC23CCCCC3)cc1	ZINC000088396716	185248596	/nfs/dbraw/zinc/24/85/96/185248596.db2.gz	FJTSVBXDFPYZNN-UHFFFAOYSA-N	0	3	308.447	2.203	10	0		DEAEHN
CN[C@@](C)(CCCN1CCC(C(F)(F)F)CC1)C(=O)OC	ZINC000088435522	185250246	/nfs/dbraw/zinc/25/02/46/185250246.db2.gz	YUSIWYZKKUNAEN-ZDUSSCGKSA-N	0	3	310.360	2.192	10	0		DEAEHN
CCOC(=O)[C@@](C)(CCN1CCC(C(F)(F)F)CC1)NC	ZINC000088435577	185250282	/nfs/dbraw/zinc/25/02/82/185250282.db2.gz	PWBQPYGVZHPVSN-CYBMUJFWSA-N	0	3	310.360	2.192	10	0		DEAEHN
CC[C@H](C(=O)NCCc1cn(C)c2cc(C)ccc12)N(C)C	ZINC000188413370	529607336	/nfs/dbraw/zinc/60/73/36/529607336.db2.gz	GXERNXXSHCDJBO-MRXNPFEDSA-N	0	3	301.434	2.486	10	0		DEAEHN
C[N-]S(=O)(=O)c1ccc(C[NH2+][C@H]2CCCCC[C@H]2C)o1	ZINC000088541009	185255762	/nfs/dbraw/zinc/25/57/62/185255762.db2.gz	DOTPCDUUJKIKJJ-YPMHNXCESA-N	0	3	300.424	2.246	10	0		DEAEHN
C[C@@H]1CCC[C@@H](NCc2ccc(S(=O)(=O)N(C)C)o2)C1	ZINC000088540069	185255839	/nfs/dbraw/zinc/25/58/39/185255839.db2.gz	JILGEHQJDXPLLD-VXGBXAGGSA-N	0	3	300.424	2.198	10	0		DEAEHN
CC[C@@H]1CC[C@@H](NCc2ccc(S(=O)(=O)N(C)C)o2)[C@@H]1C	ZINC000088540957	185255945	/nfs/dbraw/zinc/25/59/45/185255945.db2.gz	PECFKYFFOMDOGX-YRGRVCCFSA-N	0	3	314.451	2.444	10	0		DEAEHN
CC(C)(C)NCc1ccc(S(=O)(=O)N2CCCCC2)o1	ZINC000088543363	185256262	/nfs/dbraw/zinc/25/62/62/185256262.db2.gz	LHNWQAVDDOXMTP-UHFFFAOYSA-N	0	3	300.424	2.342	10	0		DEAEHN
C[C@H]1CCN(S(=O)(=O)c2ccc(CNC(C)(C)C)o2)C1	ZINC000088544035	185256659	/nfs/dbraw/zinc/25/66/59/185256659.db2.gz	MAXNOVTYICIYES-NSHDSACASA-N	0	3	300.424	2.198	10	0		DEAEHN
CCOC(=O)[C@H]1CNCCN1[C@@H](C)c1ccc(SC)cc1	ZINC000088657995	185261666	/nfs/dbraw/zinc/26/16/66/185261666.db2.gz	OKMGSGSPFZUQDI-SWLSCSKDSA-N	0	3	308.447	2.306	10	0		DEAEHN
CCC[C@@H](C(=O)NCCc1nc2c(s1)CCCC2)N(C)C	ZINC000179158727	282216604	/nfs/dbraw/zinc/21/66/04/282216604.db2.gz	JFTPTCHJBYCUER-ZDUSSCGKSA-N	0	3	309.479	2.411	10	0		DEAEHN
CN[C@H](c1ccc(C)cc1)[C@H](C)S(=O)(=O)C1CCOCC1	ZINC000081990339	192351106	/nfs/dbraw/zinc/35/11/06/192351106.db2.gz	TUIIUCCPSKZASV-BBRMVZONSA-N	0	3	311.447	2.238	10	0		DEAEHN
CN[C@H](C[S@](=O)c1ccccc1)c1ccc2c(c1)OCO2	ZINC000082000993	192353150	/nfs/dbraw/zinc/35/31/50/192353150.db2.gz	UDXAHIFXYZRDNW-SPLOXXLWSA-N	0	3	303.383	2.484	10	0		DEAEHN
CCN(C1CNC1)S(=O)(=O)c1cc(Cl)sc1Cl	ZINC000090291339	185289647	/nfs/dbraw/zinc/28/96/47/185289647.db2.gz	CVSGBGHXGVEKGF-UHFFFAOYSA-N	0	3	315.247	2.037	10	0		DEAEHN
N[C@H](C[S@](=O)c1ccc(F)cc1)c1ccc2c(c1)OCO2	ZINC000082003193	192353650	/nfs/dbraw/zinc/35/36/50/192353650.db2.gz	PSBLMGVTILAOBQ-LRTDBIEQSA-N	0	3	307.346	2.362	10	0		DEAEHN
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)[C@]1(C)COC[C@@H]1N	ZINC000090590491	185305540	/nfs/dbraw/zinc/30/55/40/185305540.db2.gz	RGRYJIDMDZOHIN-GXTWGEPZSA-N	0	3	317.216	2.316	10	0		DEAEHN
C[C@]1(c2nc(-c3cccc(Br)c3)no2)COC[C@@H]1N	ZINC000090573270	185304412	/nfs/dbraw/zinc/30/44/12/185304412.db2.gz	ASBOYPHYQXASTQ-GWCFXTLKSA-N	0	3	324.178	2.114	10	0		DEAEHN
CC[NH2+]Cc1ccc(S(=O)(=O)[N-]c2ccnc(C)c2)cc1	ZINC000092365083	185313912	/nfs/dbraw/zinc/31/39/12/185313912.db2.gz	CRPWECLFODPTRQ-UHFFFAOYSA-N	0	3	305.403	2.300	10	0		DEAEHN
Cc1c(F)cc(CN)cc1S(=O)(=O)NC1C(C)(C)C1(C)C	ZINC000092833261	185344827	/nfs/dbraw/zinc/34/48/27/185344827.db2.gz	ROYPZQWSJJQZOH-UHFFFAOYSA-N	0	3	314.426	2.306	10	0		DEAEHN
COCCCN(C)CCNC(=O)c1c(C)oc2ccccc21	ZINC000185670481	282264431	/nfs/dbraw/zinc/26/44/31/282264431.db2.gz	KGOPIOXTQIHTOF-UHFFFAOYSA-N	0	3	304.390	2.439	10	0		DEAEHN
COC(=O)CNC(=O)[C@@H](C)N[C@@H](C)c1ccc(CC(C)C)cc1	ZINC000181406364	199291601	/nfs/dbraw/zinc/29/16/01/199291601.db2.gz	BPABCLFDQSBSEG-UONOGXRCSA-N	0	3	320.433	2.213	10	0		DEAEHN
CC(C)N(CCN(C)C)C(=O)c1coc(Br)c1	ZINC000151967245	539533404	/nfs/dbraw/zinc/53/34/04/539533404.db2.gz	DKWORKYVCNNFOH-UHFFFAOYSA-N	0	3	303.200	2.454	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NC[C@]1(C)CCCO1)c1ccccc1	ZINC000153838983	539546922	/nfs/dbraw/zinc/54/69/22/539546922.db2.gz	SOUYNRJZKXFAOH-RDJZCZTQSA-N	0	3	305.422	2.158	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1cnc(C2CC2)nc1	ZINC000176344941	539626955	/nfs/dbraw/zinc/62/69/55/539626955.db2.gz	DYNODZJIEBYSQR-AWEZNQCLSA-N	0	3	303.410	2.302	10	0		DEAEHN
OCC[C@@]1(CN[C@@H]2CCCOc3cc(F)ccc32)CCOC1	ZINC000182122646	539654820	/nfs/dbraw/zinc/65/48/20/539654820.db2.gz	KTSGUZIPCCLMJK-WBVHZDCISA-N	0	3	309.381	2.418	10	0		DEAEHN
CCCN[C@@](CO)(CN(C)CC(F)(F)F)c1ccccc1	ZINC000070513652	190903485	/nfs/dbraw/zinc/90/34/85/190903485.db2.gz	RTMPOJRUQMRTMU-CQSZACIVSA-N	0	3	304.356	2.368	10	0		DEAEHN
CNC(=O)[C@H](NCc1ccc(-n2nc(C)cc2C)cc1)C(C)C	ZINC000183653221	539663526	/nfs/dbraw/zinc/66/35/26/539663526.db2.gz	YHJPFLVREHCCPU-QGZVFWFLSA-N	0	3	314.433	2.349	10	0		DEAEHN
CCOc1ccccc1[C@H](C[S@@](=O)C1CCOCC1)NC	ZINC000084055009	192397247	/nfs/dbraw/zinc/39/72/47/192397247.db2.gz	KDCGNEXOMKOBJV-BTYIYWSLSA-N	0	3	311.447	2.274	10	0		DEAEHN
CN1C[C@H](NCc2cc(Br)ccc2F)CCC1=O	ZINC000084059743	192397666	/nfs/dbraw/zinc/39/76/66/192397666.db2.gz	FGHJKZBGCNTZNJ-LLVKDONJSA-N	0	3	315.186	2.299	10	0		DEAEHN
N[C@H](C[S@](=O)c1ccccc1F)c1ccc2c(c1)OCO2	ZINC000084001289	192394929	/nfs/dbraw/zinc/39/49/29/192394929.db2.gz	BRLNHKWOLWZPJZ-XUSGNXJCSA-N	0	3	307.346	2.362	10	0		DEAEHN
COc1cccc2c1CN(Cc1ccc3c(c1)OCO3)[C@@H]2CN	ZINC000071683156	191006965	/nfs/dbraw/zinc/00/69/65/191006965.db2.gz	MVXYVOJOTXUCMC-OAHLLOKOSA-N	0	3	312.369	2.440	10	0		DEAEHN
Cn1ccnc1CN1Cc2ccc(C(F)(F)F)cc2[C@@H]1CN	ZINC000071684068	191008925	/nfs/dbraw/zinc/00/89/25/191008925.db2.gz	WJZAVCDGMSAPKL-ZDUSSCGKSA-N	0	3	310.323	2.455	10	0		DEAEHN
CC(C)CN(C1CC1)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138807625	186018907	/nfs/dbraw/zinc/01/89/07/186018907.db2.gz	LJYQCEHLDQVXKH-UHFFFAOYSA-N	0	3	318.389	2.233	10	0		DEAEHN
CS(=O)(=O)c1cccc2[nH]c(-c3cccc(CN)c3)nc21	ZINC000138155956	186014230	/nfs/dbraw/zinc/01/42/30/186014230.db2.gz	NKPGNZXJIYMMSN-UHFFFAOYSA-N	0	3	301.371	2.092	10	0		DEAEHN
C[C@@H]1CCN(S(=O)(=O)c2cc(CN)cc(F)c2F)C[C@@H]1C	ZINC000139334218	186021922	/nfs/dbraw/zinc/02/19/22/186021922.db2.gz	FLAPVCMRNNHYGL-ZJUUUORDSA-N	0	3	318.389	2.090	10	0		DEAEHN
Cc1c(F)cc(C[NH2+]C(C)C)cc1S(=O)(=O)[N-]CC(F)F	ZINC000148185045	186043739	/nfs/dbraw/zinc/04/37/39/186043739.db2.gz	GFYCZPNOPAHUDM-UHFFFAOYSA-N	0	3	324.368	2.176	10	0		DEAEHN
Cc1c(CNC(C)C)cccc1S(=O)(=O)NCC(F)F	ZINC000148191261	186044063	/nfs/dbraw/zinc/04/40/63/186044063.db2.gz	YEVCKTDUBQQRIV-UHFFFAOYSA-N	0	3	306.378	2.036	10	0		DEAEHN
CC(C)[C@@H](CN(C)C)N1C(=O)C2(CC2)N[C@@H]1c1ccsc1	ZINC000145035481	186036751	/nfs/dbraw/zinc/03/67/51/186036751.db2.gz	FGMZJLZRFHTVOP-KGLIPLIRSA-N	0	3	307.463	2.297	10	0		DEAEHN
C[C@@H]1Cc2ccccc2N1C(=O)CN1CCCN(C2CC2)CC1	ZINC000145758846	186038066	/nfs/dbraw/zinc/03/80/66/186038066.db2.gz	RVCBMGPBYFICHP-OAHLLOKOSA-N	0	3	313.445	2.134	10	0		DEAEHN
Cc1ccc(OC[C@@H](O)CN2CCCN(C3CC3)CC2)c(C)c1	ZINC000145738512	186038108	/nfs/dbraw/zinc/03/81/08/186038108.db2.gz	LUSXVXIENSNWDS-SFHVURJKSA-N	0	3	318.461	2.213	10	0		DEAEHN
C[N-]S(=O)(=O)c1ccc(C[NH2+][C@@H]2CCCC(C)(C)C2)o1	ZINC000149311428	186049303	/nfs/dbraw/zinc/04/93/03/186049303.db2.gz	IPEONYVEFKGNKW-LLVKDONJSA-N	0	3	300.424	2.246	10	0		DEAEHN
CCN[C@H](c1ccc2cccnc2c1)[C@@H]1CCS(=O)(=O)C1	ZINC000150124085	186055162	/nfs/dbraw/zinc/05/51/62/186055162.db2.gz	LTWLFHXRGGNUNS-GDBMZVCRSA-N	0	3	304.415	2.320	10	0		DEAEHN
CCNc1nc(Cl)nc(N2CC[C@H](N3CCCCC3)C2)n1	ZINC000149956416	186053488	/nfs/dbraw/zinc/05/34/88/186053488.db2.gz	NXGRRTLICGCQFM-NSHDSACASA-N	0	3	310.833	2.021	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1cccc(N(C)C)n1	ZINC000152669644	186095700	/nfs/dbraw/zinc/09/57/00/186095700.db2.gz	QQUKWUWBFRGLIZ-CYBMUJFWSA-N	0	3	305.426	2.096	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)ccc1F	ZINC000155719017	186106503	/nfs/dbraw/zinc/10/65/03/186106503.db2.gz	PTCVXUHACYXVSP-ZBEGNZNMSA-N	0	3	321.396	2.243	10	0		DEAEHN
Cc1ccc(NC(=O)[C@H]2CC[C@H](C)O2)c(OCCN(C)C)c1	ZINC000155825757	186115972	/nfs/dbraw/zinc/11/59/72/186115972.db2.gz	ZVKJEYNVKNBILQ-DZGCQCFKSA-N	0	3	306.406	2.441	10	0		DEAEHN
CC(C(=O)Nc1ccc(OCC(F)(F)F)cc1)=C1CNC1	ZINC000163976815	186144138	/nfs/dbraw/zinc/14/41/38/186144138.db2.gz	PKJGRJRDHANGNW-UHFFFAOYSA-N	0	3	300.280	2.486	10	0		DEAEHN
COCCN(C)[C@H](CN)c1ccc(C)cc1Br	ZINC000164068913	186147710	/nfs/dbraw/zinc/14/77/10/186147710.db2.gz	LXPQKQNTGXWCPR-CYBMUJFWSA-N	0	3	301.228	2.336	10	0		DEAEHN
CCOc1cccnc1C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000164108291	186149037	/nfs/dbraw/zinc/14/90/37/186149037.db2.gz	DOHPOZZNTVFXNK-ZIAGYGMSSA-N	0	3	303.406	2.037	10	0		DEAEHN
O=C(Nc1cccc(C(F)(F)F)c1)OC[C@@H]1CNCCO1	ZINC000164132850	186149918	/nfs/dbraw/zinc/14/99/18/186149918.db2.gz	JGUOWBYQYQMUHQ-NSHDSACASA-N	0	3	304.268	2.242	10	0		DEAEHN
COCCN(C)CCNc1ncc(Cl)cc1Br	ZINC000159591091	186129714	/nfs/dbraw/zinc/12/97/14/186129714.db2.gz	QRVPMINHVOLEOK-UHFFFAOYSA-N	0	3	322.634	2.488	10	0		DEAEHN
CN1CCN(Nc2ncc(Cl)cc2Br)CC1	ZINC000159622315	186131174	/nfs/dbraw/zinc/13/11/74/186131174.db2.gz	VEORDOUYBYMMPF-UHFFFAOYSA-N	0	3	305.607	2.072	10	0		DEAEHN
CN1C(=O)CC[C@@H](NCc2c[nH]c3cc(Cl)ccc23)C1=O	ZINC000163890754	186141399	/nfs/dbraw/zinc/14/13/99/186141399.db2.gz	BSEGBKFFWQLSFE-GFCCVEGCSA-N	0	3	305.765	2.058	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2cnc(-c3ccco3)s2)CCO1	ZINC000194295428	186277916	/nfs/dbraw/zinc/27/79/16/186277916.db2.gz	NHRKACYOUSFGCL-GFCCVEGCSA-N	0	3	307.419	2.166	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CCc2ccc(F)cc21	ZINC000171908471	198006364	/nfs/dbraw/zinc/00/63/64/198006364.db2.gz	BVEAILVXJRXDGB-HNNXBMFYSA-N	0	3	321.396	2.009	10	0		DEAEHN
Cc1ccccc1NC(=O)CCN1CCC(C(=O)N(C)C)CC1	ZINC000072556854	191194059	/nfs/dbraw/zinc/19/40/59/191194059.db2.gz	DBXLGMGQCSZMEQ-UHFFFAOYSA-N	0	3	317.433	2.124	10	0		DEAEHN
Cc1nc(C)c(CN2CCCN(c3cccnn3)CC2)s1	ZINC000172789938	198150195	/nfs/dbraw/zinc/15/01/95/198150195.db2.gz	HDDDIMBPXTXFMR-UHFFFAOYSA-N	0	3	303.435	2.262	10	0		DEAEHN
CCN(CCNC(=O)c1cnc(-c2ccncc2)s1)C1CC1	ZINC000172899613	198165824	/nfs/dbraw/zinc/16/58/24/198165824.db2.gz	CIIPZXBHCGPQAR-UHFFFAOYSA-N	0	3	316.430	2.419	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)Nc2nc3c(s2)COCC3)CCN1C	ZINC000173241782	198199694	/nfs/dbraw/zinc/19/96/94/198199694.db2.gz	AIFWJLKJJIQWKO-WDEREUQCSA-N	0	3	324.450	2.162	10	0		DEAEHN
O=C(Nc1ccc2c(c1F)CCNC2)N1CC2(C1)CCCOC2	ZINC000333259672	539953340	/nfs/dbraw/zinc/95/33/40/539953340.db2.gz	DRFVGZCTLABEGP-UHFFFAOYSA-N	0	3	319.380	2.116	10	0		DEAEHN
COc1ccccc1CCNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000173425756	198213839	/nfs/dbraw/zinc/21/38/39/198213839.db2.gz	RWSHTTBZGBBIDG-GOEBONIOSA-N	0	3	319.449	2.362	10	0		DEAEHN
CC[C@@H](O)CN1CCN(Cc2ccc(OC(C)C)cc2)CC1	ZINC000174094130	198291562	/nfs/dbraw/zinc/29/15/62/198291562.db2.gz	SMBOQFOPVUIABR-QGZVFWFLSA-N	0	3	306.450	2.362	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)Nc2ccc3c(c2)OCCO3)CCN1C	ZINC000174112993	198293342	/nfs/dbraw/zinc/29/33/42/198293342.db2.gz	RNWFDOSZCIKUOW-GXTWGEPZSA-N	0	3	319.405	2.404	10	0		DEAEHN
CC(C(=O)N1CC[C@@H](C)[C@@H]1c1cccc(F)c1)S(C)(=O)=O	ZINC000174439389	198335124	/nfs/dbraw/zinc/33/51/24/198335124.db2.gz	ITNBQYGJNZRPES-JTNHKYCSSA-N	0	3	313.394	2.168	10	0		DEAEHN
C=C/C(C)=C\CC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000617703865	363227398	/nfs/dbraw/zinc/22/73/98/363227398.db2.gz	QEIXTKWTQGMQLL-XTQXNGTCSA-N	0	3	314.429	2.392	10	0		DEAEHN
C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NC2CCN(C)CC2)c1	ZINC000054147900	354454776	/nfs/dbraw/zinc/45/47/76/354454776.db2.gz	LZECXEYYWQUAEM-BLLLJJGKSA-N	0	3	315.417	2.105	10	0		DEAEHN
CCCN(C[C@H]1CCCCO1)C(=O)NC[C@@H]1CCCN1CC	ZINC000074493011	355032559	/nfs/dbraw/zinc/03/25/59/355032559.db2.gz	ATNMSHZLEDWKNC-JKSUJKDBSA-N	0	3	311.470	2.461	10	0		DEAEHN
C[C@@H](N[C@@H]1CCC(F)(F)C1)c1ccc(S(N)(=O)=O)cc1	ZINC000380307160	540122303	/nfs/dbraw/zinc/12/23/03/540122303.db2.gz	JGVGZAXCGDBZLU-MWLCHTKSSA-N	0	3	304.362	2.172	10	0		DEAEHN
CCN1CCO[C@H](CNCc2ccc(Br)s2)C1	ZINC000113266921	355758424	/nfs/dbraw/zinc/75/84/24/355758424.db2.gz	ONGXDSYUVRSQCS-SNVBAGLBSA-N	0	3	319.268	2.321	10	0		DEAEHN
CCN1CCO[C@@H](CNCc2ccc(OC(F)F)cc2)C1	ZINC000134437472	355859978	/nfs/dbraw/zinc/85/99/78/355859978.db2.gz	KYTVWUARUBHPBG-AWEZNQCLSA-N	0	3	300.349	2.098	10	0		DEAEHN
Cc1csc(=O)n1CCN[C@H](C)c1ccc2c(c1)OCO2	ZINC000182282107	356119312	/nfs/dbraw/zinc/11/93/12/356119312.db2.gz	PCHSCTUPEXFLLT-LLVKDONJSA-N	0	3	306.387	2.298	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)NCC2(C)CCCCCC2)CCO1	ZINC000181715215	356091990	/nfs/dbraw/zinc/09/19/90/356091990.db2.gz	UOMQQNPNWYYFPZ-HNNXBMFYSA-N	0	3	311.470	2.319	10	0		DEAEHN
CCS(=O)(=O)C[C@H](C)NCCc1c[nH]c2cccc(C)c12	ZINC000182808104	356146521	/nfs/dbraw/zinc/14/65/21/356146521.db2.gz	DLPUEVJUURXUJH-ZDUSSCGKSA-N	0	3	308.447	2.432	10	0		DEAEHN
COc1ccc([C@H](C)N[C@H](C)C[S@@](C)=O)cc1NC(C)=O	ZINC000184307427	356189255	/nfs/dbraw/zinc/18/92/55/356189255.db2.gz	HHCZEVZYXNGXKS-NNUHMIRASA-N	0	3	312.435	2.071	10	0		DEAEHN
COc1ccc([C@H](C)N[C@H](C)C[S@](C)=O)cc1NC(C)=O	ZINC000184307387	356189526	/nfs/dbraw/zinc/18/95/26/356189526.db2.gz	HHCZEVZYXNGXKS-NNOLRYQLSA-N	0	3	312.435	2.071	10	0		DEAEHN
COCCN(C[C@H](C(N)=S)c1ccccc1)[C@@H](C)COC	ZINC000080797447	192192095	/nfs/dbraw/zinc/19/20/95/192192095.db2.gz	CJXNSVUDDPCHLQ-ZFWWWQNUSA-N	0	3	310.463	2.040	10	0		DEAEHN
CC(C)(C)N1CCN(C[C@H](C(N)=S)c2ccccc2)CC1	ZINC000080797098	192192466	/nfs/dbraw/zinc/19/24/66/192192466.db2.gz	ZDVQLJVXWQHHGK-HNNXBMFYSA-N	0	3	305.491	2.472	10	0		DEAEHN
NCc1cc(I)cnc1OC(F)(F)F	ZINC000238664796	356305412	/nfs/dbraw/zinc/30/54/12/356305412.db2.gz	MJLDGXCIFPJCQJ-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
C[C@H](C(=O)OC(C)(C)C)N(C)C(=O)[C@@H](C)N1CCCCCC1	ZINC000081450498	192269019	/nfs/dbraw/zinc/26/90/19/192269019.db2.gz	RNWOBPCDMMGDSM-ZIAGYGMSSA-N	0	3	312.454	2.440	10	0		DEAEHN
CC(C)N1CC[C@@H](CNc2nnc(Br)s2)C1	ZINC000081664504	192309638	/nfs/dbraw/zinc/30/96/38/192309638.db2.gz	GNZJOJOYZIVZRM-QMMMGPOBSA-N	0	3	305.245	2.443	10	0		DEAEHN
CC[C@H](C)[C@H]([NH3+])C(=O)NCc1ccc([O-])c(Br)c1	ZINC000236887014	202053735	/nfs/dbraw/zinc/05/37/35/202053735.db2.gz	PJFZMQXTAYHRIQ-UFBFGSQYSA-N	0	3	315.211	2.144	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)NCc1cccnc1OC1CCCC1	ZINC000236987368	202110795	/nfs/dbraw/zinc/11/07/95/202110795.db2.gz	MCPYSAUWZNZUIN-IUODEOHRSA-N	0	3	305.422	2.393	10	0		DEAEHN
Brc1csc(CN2CC[C@@H]3OCCN[C@H]3C2)c1	ZINC000404186544	356732419	/nfs/dbraw/zinc/73/24/19/356732419.db2.gz	FAMIMYLZSCWIFY-RYUDHWBXSA-N	0	3	317.252	2.073	10	0		DEAEHN
c1cn([C@H]2CCCN(CCN3CCCc4ccccc43)C2)nn1	ZINC000578621058	356846218	/nfs/dbraw/zinc/84/62/18/356846218.db2.gz	HYMNXHSQPIZHJI-KRWDZBQOSA-N	0	3	311.433	2.368	10	0		DEAEHN
CCCNCc1ccc(S(=O)(=O)N(C)C(CC)CC)nc1	ZINC000088963998	192672906	/nfs/dbraw/zinc/67/29/06/192672906.db2.gz	CIHRYKPNPUUXAG-UHFFFAOYSA-N	0	3	313.467	2.390	10	0		DEAEHN
c1cnc(N2CCC[C@H](NCc3n[nH]c4ccccc34)C2)nc1	ZINC000589641632	357485920	/nfs/dbraw/zinc/48/59/20/357485920.db2.gz	UXHJSILWHUXXKX-ZDUSSCGKSA-N	0	3	308.389	2.112	10	0		DEAEHN
c1cnc(N2CCC[C@H](NCc3[nH]nc4ccccc43)C2)nc1	ZINC000589641632	357485925	/nfs/dbraw/zinc/48/59/25/357485925.db2.gz	UXHJSILWHUXXKX-ZDUSSCGKSA-N	0	3	308.389	2.112	10	0		DEAEHN
CSC[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179169318	198992668	/nfs/dbraw/zinc/99/26/68/198992668.db2.gz	AVJREGNFIHESFG-NWANDNLSSA-N	0	3	307.463	2.483	10	0		DEAEHN
CN(C)C[C@H]1CN(CCOc2ccc(F)cc2Cl)CCO1	ZINC000179609551	199063549	/nfs/dbraw/zinc/06/35/49/199063549.db2.gz	LZLLBTNFUYXOLL-ZDUSSCGKSA-N	0	3	316.804	2.120	10	0		DEAEHN
Cc1noc(C)c1CC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000180111355	199118806	/nfs/dbraw/zinc/11/88/06/199118806.db2.gz	URMFXSZWTSTRJL-FUHWJXTLSA-N	0	3	313.401	2.396	10	0		DEAEHN
CC1CCN(CCNC(=O)[C@H]2CCO[C@@H]2c2cccnc2)CC1	ZINC000276651798	213024158	/nfs/dbraw/zinc/02/41/58/213024158.db2.gz	ZAPZSOJSTZFNTM-DLBZAZTESA-N	0	3	317.433	2.007	10	0		DEAEHN
COc1ccc(C(=O)Nc2cnn(CCN(C)C)c2)c(Cl)c1	ZINC000594488096	358281675	/nfs/dbraw/zinc/28/16/75/358281675.db2.gz	PFRRGUMWZMPNFY-UHFFFAOYSA-N	0	3	322.796	2.359	10	0		DEAEHN
C[C@@H](CNC(=O)N(C)[C@@H](C)c1cnn(C)c1)N1CCC[C@@H](C)C1	ZINC000180645438	199189353	/nfs/dbraw/zinc/18/93/53/199189353.db2.gz	QKDIZYGRUNDJLW-ILXRZTDVSA-N	0	3	321.469	2.243	10	0		DEAEHN
COCc1cccc(CC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000188226177	200212266	/nfs/dbraw/zinc/21/22/66/200212266.db2.gz	NRRDTXAQYSLPEC-PBHICJAKSA-N	0	3	304.434	2.317	10	0		DEAEHN
COc1ccccc1/C=C/CN1CCN(CC(C)(C)O)C[C@@H]1C	ZINC000188741965	200298279	/nfs/dbraw/zinc/29/82/79/200298279.db2.gz	RNOMRCGDSIQORN-DYLHUKMJSA-N	0	3	318.461	2.485	10	0		DEAEHN
COC[C@H](N[C@H]1CCN(Cc2ccc(F)cc2)C1=O)C(C)C	ZINC000189049619	200341611	/nfs/dbraw/zinc/34/16/11/200341611.db2.gz	BOCQSVCFEHJZCS-HOTGVXAUSA-N	0	3	308.397	2.187	10	0		DEAEHN
CNC[C@H](C)C(=O)/N=c1/sccn1Cc1ccccc1F	ZINC000237096502	283573401	/nfs/dbraw/zinc/57/34/01/283573401.db2.gz	QLCIIHUUGGOLHA-IRPICPOESA-N	0	3	307.394	2.020	10	0		DEAEHN
C[C@H](NC(=O)C(=O)c1ccc2c(c1)CCC2)C1CCN(C)CC1	ZINC000603333945	360795524	/nfs/dbraw/zinc/79/55/24/360795524.db2.gz	FDPJRUFQWQFBEG-ZDUSSCGKSA-N	0	3	314.429	2.205	10	0		DEAEHN
O=C([C@@H]1CCCO[C@H]1c1ccccc1)N1CCN2CCC[C@@H]2C1	ZINC000195336073	296023372	/nfs/dbraw/zinc/02/33/72/296023372.db2.gz	QWXBTVVGJWCLCP-KURKYZTESA-N	0	3	314.429	2.461	10	0		DEAEHN
COc1cccc(C[C@H](C)NC(=O)N[C@@H]2CCN(C3CC3)C2)c1	ZINC000604199805	360890321	/nfs/dbraw/zinc/89/03/21/360890321.db2.gz	QFGJRHCBSYUFRA-DZGCQCFKSA-N	0	3	317.433	2.162	10	0		DEAEHN
Cc1nnc(CN2CCN([C@H](C)CCc3ccccc3)CC2)[nH]1	ZINC000605422496	360968115	/nfs/dbraw/zinc/96/81/15/360968115.db2.gz	FPAPACAWHDAJGN-OAHLLOKOSA-N	0	3	313.449	2.252	10	0		DEAEHN
Cc1cc(N(C)C[C@H]2CCS(=O)(=O)C2)c2ccccc2n1	ZINC000607148457	361071974	/nfs/dbraw/zinc/07/19/74/361071974.db2.gz	SMIJUFNUVWFQLQ-CYBMUJFWSA-N	0	3	304.415	2.414	10	0		DEAEHN
CC[C@H](O)CN1CCN(CCSCc2ccccc2)CC1	ZINC000192604830	200909082	/nfs/dbraw/zinc/90/90/82/200909082.db2.gz	XKSVCAYUIQRKGD-KRWDZBQOSA-N	0	3	308.491	2.308	10	0		DEAEHN
CCc1ccc(S(=O)(=O)N[C@H]2CNCC[C@@H]2C)cc1CC	ZINC000193407084	201048256	/nfs/dbraw/zinc/04/82/56/201048256.db2.gz	FADNSVRRSKQYMP-LRDDRELGSA-N	0	3	310.463	2.088	10	0		DEAEHN
O=C(N[C@@H]1C[C@H]1c1ccc(F)cc1)N1CCN2CCC[C@@H]2C1	ZINC000195234239	201363407	/nfs/dbraw/zinc/36/34/07/201363407.db2.gz	HRYNLYPDHCVWDQ-OWCLPIDISA-N	0	3	303.381	2.171	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC(c2cc(Cl)cnc2N)=C[C@H](N)C1	ZINC000675078455	541286226	/nfs/dbraw/zinc/28/62/26/541286226.db2.gz	PWTRSXZLBKZNAN-NSHDSACASA-N	0	3	324.812	2.279	10	0		DEAEHN
C[C@H](C(=O)Nc1nc2ccccc2s1)N1CC[C@@H](N(C)C)C1	ZINC000623014931	364855812	/nfs/dbraw/zinc/85/58/12/364855812.db2.gz	AGLQTYVRXWXCHA-VXGBXAGGSA-N	0	3	318.446	2.259	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2ccc(C)cc2C)CC12COC2	ZINC000449357466	240391489	/nfs/dbraw/zinc/39/14/89/240391489.db2.gz	DKSKODXDUISFDS-MRXNPFEDSA-N	0	3	303.402	2.315	10	0		DEAEHN
Cc1cc(CNC[C@H]2CN(C)CCN2Cc2ccccc2)ccn1	ZINC000623574663	365086172	/nfs/dbraw/zinc/08/61/72/365086172.db2.gz	TVLSCQMEANGYFL-FQEVSTJZSA-N	0	3	324.472	2.296	10	0		DEAEHN
c1csc(CNC[C@@H]2CN(Cc3ccncc3)CCO2)c1	ZINC000623780518	365172388	/nfs/dbraw/zinc/17/23/88/365172388.db2.gz	NPNIWQVBYMFQIL-OAHLLOKOSA-N	0	3	303.431	2.134	10	0		DEAEHN
COc1ccc(Cl)c(NC(=O)C[C@H]2CSCCN2)c1	ZINC000091290575	193031751	/nfs/dbraw/zinc/03/17/51/193031751.db2.gz	HNAHZCVNGMXWAJ-VIFPVBQESA-N	0	3	300.811	2.382	10	0		DEAEHN
C[C@@H](NC[C@H]1CSCCS1)c1ccc2[nH]c(=O)[nH]c2c1	ZINC000091368927	193048069	/nfs/dbraw/zinc/04/80/69/193048069.db2.gz	GTLHJSBPSZVHNC-KOLCDFICSA-N	0	3	309.460	2.355	10	0		DEAEHN
CN(Cc1csc(Br)c1)c1cncc(CN)n1	ZINC000091420652	193054034	/nfs/dbraw/zinc/05/40/34/193054034.db2.gz	QOENMEYNGAJECF-UHFFFAOYSA-N	0	3	313.224	2.396	10	0		DEAEHN
C[C@@H](NC[C@H]1CN(C)CCO1)c1ccc(Br)s1	ZINC000091667434	193088368	/nfs/dbraw/zinc/08/83/68/193088368.db2.gz	FZBXFOIFCQQZPV-ZJUUUORDSA-N	0	3	319.268	2.492	10	0		DEAEHN
C[C@H]1CC[C@@H]([N-]S(=O)(=O)c2cccc(Cl)c2Cl)C[NH2+]1	ZINC000624407146	365413650	/nfs/dbraw/zinc/41/36/50/365413650.db2.gz	UMMXBSQABVRHKL-DTWKUNHWSA-N	0	3	323.245	2.412	10	0		DEAEHN
C[C@@H]1CN(C2CCN(Cc3cccc4c3OCO4)CC2)CCO1	ZINC000092079148	193154567	/nfs/dbraw/zinc/15/45/67/193154567.db2.gz	XTLAUFSNLZJYLS-CQSZACIVSA-N	0	3	318.417	2.100	10	0		DEAEHN
COC[C@H](N)Cc1cn(-c2ccc(Cl)c(Cl)c2)nn1	ZINC000630587768	367741821	/nfs/dbraw/zinc/74/18/21/367741821.db2.gz	ZCQVUNJIIMLWLV-MRVPVSSYSA-N	0	3	301.177	2.090	10	0		DEAEHN
C[C@H]1CN(S(=O)(=O)c2cc(Cl)cc(CN)c2F)C[C@H]1C	ZINC000092113811	193161173	/nfs/dbraw/zinc/16/11/73/193161173.db2.gz	GFVUCGZRJHPEKB-DTORHVGOSA-N	0	3	320.817	2.214	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCCC[C@H]2C)c(F)c1	ZINC000092115475	193163078	/nfs/dbraw/zinc/16/30/78/193163078.db2.gz	QVRMKHHPLHSTGU-GFCCVEGCSA-N	0	3	314.426	2.498	10	0		DEAEHN
CC[C@@H](C)N(CC)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115642	193163542	/nfs/dbraw/zinc/16/35/42/193163542.db2.gz	SGEGBNVPIPJVHI-LLVKDONJSA-N	0	3	302.415	2.354	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCCCCC2)c(F)c1	ZINC000092115497	193163565	/nfs/dbraw/zinc/16/35/65/193163565.db2.gz	NGYCYMHDNOTAEK-UHFFFAOYSA-N	0	3	314.426	2.500	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCC[C@H]2C(C)C)c(F)c1	ZINC000092116283	193164011	/nfs/dbraw/zinc/16/40/11/193164011.db2.gz	HOOYWMIOMUKLKE-AWEZNQCLSA-N	0	3	314.426	2.354	10	0		DEAEHN
CCC(C)(C)N(C)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092116210	193164259	/nfs/dbraw/zinc/16/42/59/193164259.db2.gz	IEUKVXDXXGARMP-UHFFFAOYSA-N	0	3	302.415	2.354	10	0		DEAEHN
Cc1occc1CN(C)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115877	193164666	/nfs/dbraw/zinc/16/46/66/193164666.db2.gz	FYHOSKUJLNLRNM-UHFFFAOYSA-N	0	3	312.366	2.007	10	0		DEAEHN
C[C@@H]1CCCN(S(=O)(=O)c2ccc(CN)cc2F)[C@@H]1C	ZINC000092116051	193164713	/nfs/dbraw/zinc/16/47/13/193164713.db2.gz	NENAIOFYQZCHBW-GHMZBOCLSA-N	0	3	300.399	2.094	10	0		DEAEHN
O=C(N[C@@H]1CCOc2ccccc21)N1CC[C@@H](N2CC=CC2)C1	ZINC000173373522	284083688	/nfs/dbraw/zinc/08/36/88/284083688.db2.gz	APSPGQNMZQBAHC-GDBMZVCRSA-N	0	3	313.401	2.166	10	0		DEAEHN
CCC[C@](C)([NH3+])C(=O)NCc1ccc([O-])c(Br)c1	ZINC000262169242	203218016	/nfs/dbraw/zinc/21/80/16/203218016.db2.gz	WWWTYJOCENWOLZ-ZDUSSCGKSA-N	0	3	315.211	2.288	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N(CC)C[C@H](C)CC)nc1	ZINC000093265771	193222621	/nfs/dbraw/zinc/22/26/21/193222621.db2.gz	QIVREHWQRLXKFK-CYBMUJFWSA-N	0	3	313.467	2.248	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1CCC(=O)NC1CCCC1	ZINC000249772179	284166699	/nfs/dbraw/zinc/16/66/99/284166699.db2.gz	TXEFUCWUQRGZCC-IMJJTQAJSA-N	0	3	322.449	2.241	10	0		DEAEHN
CCOC(=O)[C@]1(N)CCC[C@@H]1CCN(C)CCC(F)(F)F	ZINC000093596060	193270711	/nfs/dbraw/zinc/27/07/11/193270711.db2.gz	VMZJFWRMDLBBBD-YPMHNXCESA-N	0	3	310.360	2.321	10	0		DEAEHN
N[C@@H](Cc1c[nH]cn1)c1nc2cc(F)c(Br)cc2[nH]1	ZINC000093728652	193297351	/nfs/dbraw/zinc/29/73/51/193297351.db2.gz	SUZQVXCMIIMEJJ-VIFPVBQESA-N	0	3	324.157	2.430	10	0		DEAEHN
N[C@@H](Cc1c[nH]cn1)c1nc2cc(Br)c(F)cc2[nH]1	ZINC000093728652	193297352	/nfs/dbraw/zinc/29/73/52/193297352.db2.gz	SUZQVXCMIIMEJJ-VIFPVBQESA-N	0	3	324.157	2.430	10	0		DEAEHN
CCC(CC)NC(=O)[C@H](C)Oc1c(F)cc(CN)cc1F	ZINC000094345937	193363644	/nfs/dbraw/zinc/36/36/44/193363644.db2.gz	YXQRTZRZWYRZJT-VIFPVBQESA-N	0	3	300.349	2.496	10	0		DEAEHN
CN[C@H](c1ccc(F)c(Br)c1)[C@H]1COCCO1	ZINC000094096379	193345120	/nfs/dbraw/zinc/34/51/20/193345120.db2.gz	NPZDHTVEPPURPK-VXGBXAGGSA-N	0	3	304.159	2.264	10	0		DEAEHN
CN[C@@H](c1cc(Br)ccc1F)[C@H]1COCCO1	ZINC000094108715	193345904	/nfs/dbraw/zinc/34/59/04/193345904.db2.gz	WSOKDRLTDBBFHU-NEPJUHHUSA-N	0	3	304.159	2.264	10	0		DEAEHN
CCN[C@H](Cc1cccc(F)c1F)C(C)(C)S(C)(=O)=O	ZINC000094713185	193393116	/nfs/dbraw/zinc/39/31/16/193393116.db2.gz	JFYNGZCJBUXFCH-GFCCVEGCSA-N	0	3	305.390	2.309	10	0		DEAEHN
NC(=S)c1cc(F)ccc1CN1CCN2CCCC[C@@H]2C1	ZINC000094439538	193369633	/nfs/dbraw/zinc/36/96/33/193369633.db2.gz	ZTLQVNOYKMSOEQ-CQSZACIVSA-N	0	3	307.438	2.130	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccc(-n2cccn2)cc1)N(C)C	ZINC000161572463	197504586	/nfs/dbraw/zinc/50/45/86/197504586.db2.gz	PCQXONIBPNOYJW-INIZCTEOSA-N	0	3	300.406	2.219	10	0		DEAEHN
COC(C)(C)CNCC(=O)Nc1ccc(Br)cc1	ZINC000160257790	197395663	/nfs/dbraw/zinc/39/56/63/197395663.db2.gz	MQFURWKRTDNZSW-UHFFFAOYSA-N	0	3	315.211	2.402	10	0		DEAEHN
Cn1cc([C@@H](CN)Oc2cc(F)ccc2Br)cn1	ZINC000160178908	197391517	/nfs/dbraw/zinc/39/15/17/197391517.db2.gz	VDWRMHKVNXTJGB-GFCCVEGCSA-N	0	3	314.158	2.401	10	0		DEAEHN
CO[C@]1(C[NH2+]Cc2ccc([O-])c(Br)c2)CCOC1	ZINC000160104517	197386235	/nfs/dbraw/zinc/38/62/35/197386235.db2.gz	JLBXCCIODOKNOV-ZDUSSCGKSA-N	0	3	316.195	2.050	10	0		DEAEHN
Nc1cc(NC(=O)CCCN2CCC(O)CC2)ccc1Cl	ZINC000020555315	182231886	/nfs/dbraw/zinc/23/18/86/182231886.db2.gz	NJIFAIIXOLSKQL-UHFFFAOYSA-N	0	3	311.813	2.098	10	0		DEAEHN
COc1cc(Br)cc(CNCCN(C)C)c1OC	ZINC000020968307	182256486	/nfs/dbraw/zinc/25/64/86/182256486.db2.gz	GFCFYGVFWNYRTR-UHFFFAOYSA-N	0	3	317.227	2.118	10	0		DEAEHN
CC(C)[C@@H]1OCC[C@H]1CN[C@@H](C(=O)N(C)C)c1ccccc1	ZINC000267441036	206068929	/nfs/dbraw/zinc/06/89/29/206068929.db2.gz	PDSWPAJXBIVFLT-BBWFWOEESA-N	0	3	304.434	2.467	10	0		DEAEHN
CCn1nc(NC(=O)N2CCN3CCC[C@@H]3C2)cc1C1CC1	ZINC000267427683	206059629	/nfs/dbraw/zinc/05/96/29/206059629.db2.gz	BJPBCXNIQUZEDZ-CYBMUJFWSA-N	0	3	303.410	2.092	10	0		DEAEHN
CC1(OCC(=O)N2CCC[C@@H]2c2ccccc2Cl)CNC1	ZINC000098060912	193780061	/nfs/dbraw/zinc/78/00/61/193780061.db2.gz	NNAGKZNYFZMMPC-CQSZACIVSA-N	0	3	308.809	2.382	10	0		DEAEHN
COc1cccc([C@@H]2C[C@H]2NC(=O)CC2CCN(C)CC2)c1	ZINC000456544270	247266111	/nfs/dbraw/zinc/26/61/11/247266111.db2.gz	ZDXXNXCYZQESTD-DLBZAZTESA-N	0	3	302.418	2.399	10	0		DEAEHN
Cc1ccc([C@@H](C)CNC(=O)N2C[C@@H]3CCN(C)[C@@H]3C2)cc1	ZINC000458432854	248307226	/nfs/dbraw/zinc/30/72/26/248307226.db2.gz	XCYJPLROXDKOBZ-BHYGNILZSA-N	0	3	301.434	2.444	10	0		DEAEHN
COc1ccc([C@H](C(=O)NCCN(C)C)C(C)C)cc1OC	ZINC000040651909	183114069	/nfs/dbraw/zinc/11/40/69/183114069.db2.gz	FAVJZTSCMCOIRO-MRXNPFEDSA-N	0	3	308.422	2.121	10	0		DEAEHN
CCN(CC)[C@@H](CNC(=O)NCCOC)c1ccc(OC)cc1	ZINC000040654255	183114182	/nfs/dbraw/zinc/11/41/82/183114182.db2.gz	BQLKLNXHDXLUEB-INIZCTEOSA-N	0	3	323.437	2.024	10	0		DEAEHN
Cc1cc(N(CCO)CCO)c2ccc(C(F)(F)F)cc2n1	ZINC000040570952	183103751	/nfs/dbraw/zinc/10/37/51/183103751.db2.gz	YHEMNGCSZZHFRE-UHFFFAOYSA-N	0	3	314.307	2.353	10	0		DEAEHN
O=C(COc1cccc(Cl)c1Cl)N1CCCNCC1	ZINC000041516856	183196752	/nfs/dbraw/zinc/19/67/52/183196752.db2.gz	QBPCIILJDYKTEN-UHFFFAOYSA-N	0	3	303.189	2.194	10	0		DEAEHN
CCNC(=O)[C@H](C)Oc1c(Br)cccc1CNC	ZINC000042411506	183265388	/nfs/dbraw/zinc/26/53/88/183265388.db2.gz	NWGLQBKWBWFQNT-VIFPVBQESA-N	0	3	315.211	2.072	10	0		DEAEHN
CCNCc1cccc(Br)c1O[C@@H]1CCOC1=O	ZINC000042411759	183266008	/nfs/dbraw/zinc/26/60/08/183266008.db2.gz	DZGBIDDDMUBQNU-LLVKDONJSA-N	0	3	314.179	2.253	10	0		DEAEHN
CC(C)N(CCCO)[C@H](C)C(=O)Nc1ccc(Cl)c(N)c1	ZINC000042482947	183275413	/nfs/dbraw/zinc/27/54/13/183275413.db2.gz	LEBPKTKAJNXWSY-LLVKDONJSA-N	0	3	313.829	2.342	10	0		DEAEHN
C[C@@H](CNC(=O)c1cc(Br)cn1C)N1CCCC1	ZINC000042506246	183277713	/nfs/dbraw/zinc/27/77/13/183277713.db2.gz	WUJJBPGOLRBUEV-JTQLQIEISA-N	0	3	314.227	2.002	10	0		DEAEHN
COCCN([C@H](C)COC)[C@@H](CN)c1ccccc1Cl	ZINC000042603169	183290657	/nfs/dbraw/zinc/29/06/57/183290657.db2.gz	YSNSIMYCUQRUFG-DOMZBBRYSA-N	0	3	300.830	2.323	10	0		DEAEHN
CNCc1cc2c(cc1OCc1ncc(Cl)n1C)OCO2	ZINC000042874377	183315915	/nfs/dbraw/zinc/31/59/15/183315915.db2.gz	IIOYNACEHGOFDY-UHFFFAOYSA-N	0	3	309.753	2.101	10	0		DEAEHN
NC[C@H](c1ccc(Br)cc1)N1CCC[C@H](CO)C1	ZINC000042953780	183321863	/nfs/dbraw/zinc/32/18/63/183321863.db2.gz	HZJMHROQHYBUFP-SMDDNHRTSA-N	0	3	313.239	2.153	10	0		DEAEHN
NC[C@@H](c1ccc(Br)cc1)N1CCCC[C@@H]1CO	ZINC000042954131	183322185	/nfs/dbraw/zinc/32/21/85/183322185.db2.gz	DQYIPGPJPYFZMO-KGLIPLIRSA-N	0	3	313.239	2.296	10	0		DEAEHN
COc1ccc2ccccc2c1[C@@H](N)[C@@H]1CCS(=O)(=O)C1	ZINC000043300090	183352303	/nfs/dbraw/zinc/35/23/03/183352303.db2.gz	KBYFAIVAUSEYKZ-WBMJQRKESA-N	0	3	305.399	2.283	10	0		DEAEHN
CN[C@@H](c1cccc(C(F)(F)F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000043300564	183352391	/nfs/dbraw/zinc/35/23/91/183352391.db2.gz	DQYYQVDHDFCBBO-JQWIXIFHSA-N	0	3	307.337	2.401	10	0		DEAEHN
CC[C@@H](N)[C@@H](Oc1cccc(S(C)(=O)=O)c1)C(F)(F)F	ZINC000043385226	183358415	/nfs/dbraw/zinc/35/84/15/183358415.db2.gz	DAHNVFGACRWVEC-GHMZBOCLSA-N	0	3	311.325	2.137	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCc2nc(C(C)(C)C)cs2)C1	ZINC000105296583	194093802	/nfs/dbraw/zinc/09/38/02/194093802.db2.gz	MYEGUDGSUOZNTI-NSHDSACASA-N	0	3	310.467	2.286	10	0		DEAEHN
Clc1ncccc1CN[C@@H]1CCCN(c2cccnn2)C1	ZINC000105802440	194131779	/nfs/dbraw/zinc/13/17/79/194131779.db2.gz	VBCYKPGDCSGWCF-CYBMUJFWSA-N	0	3	303.797	2.284	10	0		DEAEHN
COCCN1CCN(Cc2ccc(-n3ccnc3)cc2)C[C@H]1C	ZINC000106108896	194187827	/nfs/dbraw/zinc/18/78/27/194187827.db2.gz	GRUDXUVGYUVTCX-MRXNPFEDSA-N	0	3	314.433	2.025	10	0		DEAEHN
O=S(=O)(c1ccc(CNC2CC2)cc1)N1C[C@H]2CC[C@@H]1C2	ZINC000049717227	183755521	/nfs/dbraw/zinc/75/55/21/183755521.db2.gz	PFKCHDYUHHROSC-DZGCQCFKSA-N	0	3	306.431	2.112	10	0		DEAEHN
CNc1ccc(Cl)c(C(=O)NC[C@H](C)N2CCCCC2)n1	ZINC000050788125	183803546	/nfs/dbraw/zinc/80/35/46/183803546.db2.gz	RNSINWMYQYYMAS-NSHDSACASA-N	0	3	310.829	2.381	10	0		DEAEHN
CCN(Cc1ccc(F)c(F)c1)C(=O)[C@@H](N)CCCOC	ZINC000159342153	197346630	/nfs/dbraw/zinc/34/66/30/197346630.db2.gz	ZGPKCXIQAYYPDW-AWEZNQCLSA-N	0	3	300.349	2.067	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)s1)N1CCNC(=O)[C@@H]1C	ZINC000110655168	194347416	/nfs/dbraw/zinc/34/74/16/194347416.db2.gz	UVHKUFTZCGEXFG-SBMIAAHKSA-N	0	3	301.843	2.000	10	0		DEAEHN
C[C@H]1CN(CCNc2ccc(Br)cc2)CCN1C	ZINC000110755592	194357184	/nfs/dbraw/zinc/35/71/84/194357184.db2.gz	YTGGJTZUGZBCKA-LBPRGKRZSA-N	0	3	312.255	2.497	10	0		DEAEHN
CN([C@@H]1CCCNC1)S(=O)(=O)c1ccc(C(F)(F)F)cc1	ZINC000110928286	194370371	/nfs/dbraw/zinc/37/03/71/194370371.db2.gz	CQYLBLMHSGUUCD-LLVKDONJSA-N	0	3	322.352	2.078	10	0		DEAEHN
CCCN([C@@H]1CCCNC1)S(=O)(=O)c1cc(C)ccc1F	ZINC000110942518	194371742	/nfs/dbraw/zinc/37/17/42/194371742.db2.gz	IRKVFCQAUBPGEC-CYBMUJFWSA-N	0	3	314.426	2.287	10	0		DEAEHN
CCCN[C@@](C)(CCN(CC)CCOCC)C(=O)OCC	ZINC000111121698	194391788	/nfs/dbraw/zinc/39/17/88/194391788.db2.gz	ZSJHMDVWDLQXGI-INIZCTEOSA-N	0	3	302.459	2.056	10	0		DEAEHN
CCOCCN(CC)CC[C@@](C)(NC(C)C)C(=O)OCC	ZINC000111122176	194393609	/nfs/dbraw/zinc/39/36/09/194393609.db2.gz	POJKAHUTLNMQIN-MRXNPFEDSA-N	0	3	302.459	2.055	10	0		DEAEHN
CN(C)CCN(C)c1ccc(C(N)=S)c(C(F)(F)F)c1	ZINC000111138975	194394701	/nfs/dbraw/zinc/39/47/01/194394701.db2.gz	RHEMFXRJAVKKEJ-UHFFFAOYSA-N	0	3	305.369	2.337	10	0		DEAEHN
CCN1CCC[C@@H](Nc2cncc(-n3nc(C)cc3C)n2)C1	ZINC000112075876	194430522	/nfs/dbraw/zinc/43/05/22/194430522.db2.gz	TXNLJNZSAULFRB-CQSZACIVSA-N	0	3	300.410	2.175	10	0		DEAEHN
CC(=O)N1CCC(NC(=O)CN2CCC[C@@H]2CC(C)(C)C)CC1	ZINC000057863633	184058336	/nfs/dbraw/zinc/05/83/36/184058336.db2.gz	FKGFUJBHICEHAV-MRXNPFEDSA-N	0	3	323.481	2.014	10	0		DEAEHN
Cc1cccc(NC(=O)CN2CCCN(C3CC3)CC2)c1C	ZINC000061040946	184160589	/nfs/dbraw/zinc/16/05/89/184160589.db2.gz	FLLKBDBNVHDTNC-UHFFFAOYSA-N	0	3	301.434	2.412	10	0		DEAEHN
CC[C@H](Oc1ccc(Br)cc1[C@H](C)N)C(N)=O	ZINC000061676070	184181747	/nfs/dbraw/zinc/18/17/47/184181747.db2.gz	QQELFQFMCWRCSC-XVKPBYJWSA-N	0	3	301.184	2.112	10	0		DEAEHN
CN[C@@H]1CCN(c2cc(Br)ccc2Cl)C1=O	ZINC000061691687	184182797	/nfs/dbraw/zinc/18/27/97/184182797.db2.gz	MISLSECCKGPAGK-SECBINFHSA-N	0	3	303.587	2.427	10	0		DEAEHN
C[C@@H](CC(N)=O)C[C@H](N)c1cc2c(cc1Cl)OCCCO2	ZINC000061830312	184188700	/nfs/dbraw/zinc/18/87/00/184188700.db2.gz	LXGLRGVYGQQIFM-SKDRFNHKSA-N	0	3	312.797	2.403	10	0		DEAEHN
NCc1ccccc1CNC(=O)c1ccc(Br)o1	ZINC000061841075	184189186	/nfs/dbraw/zinc/18/91/86/184189186.db2.gz	BJIKFDGYTPLSOD-UHFFFAOYSA-N	0	3	309.163	2.431	10	0		DEAEHN
COCCNCc1ccc(O[C@H](C)C(=O)OC)c(Cl)c1	ZINC000062730581	184251200	/nfs/dbraw/zinc/25/12/00/184251200.db2.gz	CHUSUDJPOODJAI-SNVBAGLBSA-N	0	3	301.770	2.016	10	0		DEAEHN
CCN[C@H](CCSc1ccc(C(F)(F)F)cn1)C(N)=O	ZINC000062599038	184244702	/nfs/dbraw/zinc/24/47/02/184244702.db2.gz	ACKKDKFGUWLZHM-SECBINFHSA-N	0	3	307.341	2.046	10	0		DEAEHN
CC(C)N[C@H](CCSc1ccc(C(F)(F)F)cn1)C(N)=O	ZINC000062599067	184245084	/nfs/dbraw/zinc/24/50/84/184245084.db2.gz	DORWLXDRGQRELP-SNVBAGLBSA-N	0	3	321.368	2.435	10	0		DEAEHN
CCN(CC)c1ccc(NS(=O)(=O)[C@H]2CCCNC2)cc1	ZINC000062996937	184265102	/nfs/dbraw/zinc/26/51/02/184265102.db2.gz	MDACIYQEWJWTAC-HNNXBMFYSA-N	0	3	311.451	2.027	10	0		DEAEHN
COCCN(C(=O)c1nc(C(C)C)oc1C)C1CCN(C)CC1	ZINC000065293522	184323784	/nfs/dbraw/zinc/32/37/84/184323784.db2.gz	NKICGMSIWNVMTL-UHFFFAOYSA-N	0	3	323.437	2.289	10	0		DEAEHN
CCCCNCC(=O)Nc1ccc(CCC(=O)N(C)C)cc1	ZINC000066213974	184397191	/nfs/dbraw/zinc/39/71/91/184397191.db2.gz	MWDAVYWHZINVET-UHFFFAOYSA-N	0	3	305.422	2.036	10	0		DEAEHN
CCN[C@H](c1cccc2cccnc21)[C@H]1CCS(=O)(=O)C1	ZINC000069501222	184520659	/nfs/dbraw/zinc/52/06/59/184520659.db2.gz	RSWVYHVAPTUKJE-BBRMVZONSA-N	0	3	304.415	2.320	10	0		DEAEHN
CC(=O)N1CCC(CN[C@H](C)c2cn3ccccc3n2)CC1	ZINC000556235872	291815886	/nfs/dbraw/zinc/81/58/86/291815886.db2.gz	HMVAGPNPBXRXEO-CYBMUJFWSA-N	0	3	300.406	2.243	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CC[C@H](C)C[C@H]1C	ZINC000247535463	285025278	/nfs/dbraw/zinc/02/52/78/285025278.db2.gz	XXTIGUDCYZBRHA-ZJIFWQFVSA-N	0	3	311.470	2.221	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCC[C@H]2C(C)C)cc(CN)c1F	ZINC000159123885	197329679	/nfs/dbraw/zinc/32/96/79/197329679.db2.gz	HPNUPNHDQWYDHJ-AWEZNQCLSA-N	0	3	314.426	2.402	10	0		DEAEHN
CC[C@@H]1CCC[NH2+][C@H]1C[N-]S(=O)(=O)c1ccc(F)cc1F	ZINC000158998901	197318143	/nfs/dbraw/zinc/31/81/43/197318143.db2.gz	YNIPKEIWVQGVNJ-MFKMUULPSA-N	0	3	318.389	2.021	10	0		DEAEHN
CN(C)CCc1noc(-c2cc(C(F)(F)F)ccc2N)n1	ZINC000158683726	197294298	/nfs/dbraw/zinc/29/42/98/197294298.db2.gz	RVQPVYYEYURYFT-UHFFFAOYSA-N	0	3	300.284	2.442	10	0		DEAEHN
CCNCc1sccc1S(=O)(=O)N1C[C@@H]2CCC[C@H]2C1	ZINC000158754935	197299365	/nfs/dbraw/zinc/29/93/65/197299365.db2.gz	OHWKDIIEHBNOHG-RYUDHWBXSA-N	0	3	314.476	2.278	10	0		DEAEHN
COc1cnn(CCN(C)C)c1[C@H](O)c1sccc1Cl	ZINC000158760963	197298681	/nfs/dbraw/zinc/29/86/81/197298681.db2.gz	NNXZEMTUQVIDJW-LBPRGKRZSA-N	0	3	315.826	2.250	10	0		DEAEHN
CCN[C@H](CS(=O)(=O)c1ccc(C)cc1C)[C@H]1CCOC1	ZINC000158737259	197298129	/nfs/dbraw/zinc/29/81/29/197298129.db2.gz	IBFZFGFDTIWIEZ-LSDHHAIUSA-N	0	3	311.447	2.092	10	0		DEAEHN
CCN[C@@H](CC)c1c(Br)cnn1CCN(C)C	ZINC000158736435	197298239	/nfs/dbraw/zinc/29/82/39/197298239.db2.gz	YLXLYEGJHAZRPT-NSHDSACASA-N	0	3	303.248	2.268	10	0		DEAEHN
N[C@H](CS(=O)(=O)c1cc(Cl)ccc1Cl)[C@@H]1CCOC1	ZINC000158740898	197297970	/nfs/dbraw/zinc/29/79/70/197297970.db2.gz	UWWHAPMHUOJHQG-LDYMZIIASA-N	0	3	324.229	2.131	10	0		DEAEHN
CCN[C@H](CS(=O)(=O)c1cc(C)ccc1C)[C@H]1CCOC1	ZINC000158734414	197296892	/nfs/dbraw/zinc/29/68/92/197296892.db2.gz	BCPRLACFAZLSEP-LSDHHAIUSA-N	0	3	311.447	2.092	10	0		DEAEHN
CC1CC(=O)N(c2ccc(C(F)(F)F)cc2CN)C(=O)C1	ZINC000158345542	197264120	/nfs/dbraw/zinc/26/41/20/197264120.db2.gz	PEUGYTSUEITBBB-UHFFFAOYSA-N	0	3	300.280	2.454	10	0		DEAEHN
CC(C)OCCN(C)[C@H](CN)c1ccc(Br)o1	ZINC000157828416	197218758	/nfs/dbraw/zinc/21/87/58/197218758.db2.gz	FEFYQILNXINCII-SNVBAGLBSA-N	0	3	305.216	2.399	10	0		DEAEHN
CCn1ccnc(Oc2ccc(Br)cc2CN)c1=O	ZINC000157525735	197194469	/nfs/dbraw/zinc/19/44/69/197194469.db2.gz	PZNPMVJKJNRGTN-UHFFFAOYSA-N	0	3	324.178	2.277	10	0		DEAEHN
CN(CC(=O)NCc1ccc(Cl)cc1)[C@@H]1CCCC[C@@H]1O	ZINC000157332660	197179888	/nfs/dbraw/zinc/17/98/88/197179888.db2.gz	DJKICWPQRNQZIS-CABCVRRESA-N	0	3	310.825	2.192	10	0		DEAEHN
Cc1c(CNC2CC2)cccc1S(=O)(=O)N(C)CC(F)F	ZINC000157161052	197166869	/nfs/dbraw/zinc/16/68/69/197166869.db2.gz	VNPWDSFCVFTGDM-UHFFFAOYSA-N	0	3	318.389	2.133	10	0		DEAEHN
Cn1cc([C@@H](CN)Oc2cc(F)cc(Br)c2)cn1	ZINC000157211642	197170029	/nfs/dbraw/zinc/17/00/29/197170029.db2.gz	WUZFHNGUMJPHPE-GFCCVEGCSA-N	0	3	314.158	2.401	10	0		DEAEHN
C[C@@H]1CCC[C@@]2(CSC(NC[C@@H]3CCCS3(=O)=O)=N2)C1	ZINC000155416865	197052964	/nfs/dbraw/zinc/05/29/64/197052964.db2.gz	DGVPEWQYSCBBCN-DYEKYZERSA-N	0	3	316.492	2.205	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)C(=O)Nc2ccccc2Cl)CCN1C	ZINC000120622060	195204132	/nfs/dbraw/zinc/20/41/32/195204132.db2.gz	KTHPQZRUKXNRRM-NEPJUHHUSA-N	0	3	323.824	2.220	10	0		DEAEHN
COc1ccc([O-])c(C(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)c1	ZINC000120810432	195242048	/nfs/dbraw/zinc/24/20/48/195242048.db2.gz	DQOGIFCWPVTWIQ-CYBMUJFWSA-N	0	3	306.406	2.251	10	0		DEAEHN
COc1ccc([O-])c(C(=O)NC[C@H]2CCC[N@H+]2CC(C)C)c1	ZINC000120810432	195242051	/nfs/dbraw/zinc/24/20/51/195242051.db2.gz	DQOGIFCWPVTWIQ-CYBMUJFWSA-N	0	3	306.406	2.251	10	0		DEAEHN
CC(C)NC(=O)[C@]12CCO[C@H]1CCN(Cc1ccsc1)C2	ZINC000247968952	257112678	/nfs/dbraw/zinc/11/26/78/257112678.db2.gz	CMQNJCLLWACTCS-HOCLYGCPSA-N	0	3	308.447	2.254	10	0		DEAEHN
c1cc(CN2C[C@H]3COC[C@@]3(COCc3ccncc3)C2)co1	ZINC000247903013	257115120	/nfs/dbraw/zinc/11/51/20/257115120.db2.gz	WKGCQJPNKHJEDQ-ROUUACIJSA-N	0	3	314.385	2.340	10	0		DEAEHN
CO[C@@H]1CCN(C2CCC2)[C@H]2CN(Cc3ccncc3)C[C@H]21	ZINC000247811271	257118123	/nfs/dbraw/zinc/11/81/23/257118123.db2.gz	CQSHAZBSLGEMQT-FGTMMUONSA-N	0	3	301.434	2.155	10	0		DEAEHN
CC(C)CCn1cc(C(=O)N[C@H](CC(C)C)CN(C)C)nn1	ZINC000151343677	196667712	/nfs/dbraw/zinc/66/77/12/196667712.db2.gz	NKYHKHMKJWHFBU-CQSZACIVSA-N	0	3	309.458	2.030	10	0		DEAEHN
Fc1cnc(N2CCO[C@H]3CN(CC4CCCCC4)C[C@@H]32)nc1	ZINC000503718774	257208231	/nfs/dbraw/zinc/20/82/31/257208231.db2.gz	VYNYFEXQXHBWHW-HOTGVXAUSA-N	0	3	320.412	2.085	10	0		DEAEHN
Cc1cc(N2CC[C@H](N[C@H]3CC[C@@H]3C3CCC3)C2=O)n(C)n1	ZINC000560941452	291949555	/nfs/dbraw/zinc/94/95/55/291949555.db2.gz	BBENSZJCDAGMEL-ILXRZTDVSA-N	0	3	302.422	2.002	10	0		DEAEHN
CCN1CCN(C(=O)[C@@H](C)N[C@@H](C)c2ccccc2C)CC1	ZINC000120952130	195270871	/nfs/dbraw/zinc/27/08/71/195270871.db2.gz	JPWZULNMERBOMO-JKSUJKDBSA-N	0	3	303.450	2.198	10	0		DEAEHN
CC[C@@H]1CN(Cc2c[nH]nc2C(C)(C)C)CCN1CCOC	ZINC000120955173	195271107	/nfs/dbraw/zinc/27/11/07/195271107.db2.gz	ZBQDQYFQNWCPME-OAHLLOKOSA-N	0	3	308.470	2.250	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)CSCc1ccncc1	ZINC000120955401	195271378	/nfs/dbraw/zinc/27/13/78/195271378.db2.gz	JNZYAZHJSAMFNY-OAHLLOKOSA-N	0	3	309.479	2.407	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C)cc1F	ZINC000121825723	195355177	/nfs/dbraw/zinc/35/51/77/195355177.db2.gz	ZBMCOPOVVFEYDK-AWEZNQCLSA-N	0	3	323.412	2.165	10	0		DEAEHN
Cc1ccc(F)c(NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000121829132	195356440	/nfs/dbraw/zinc/35/64/40/195356440.db2.gz	SHFMFGMIDAHEFY-ZDUSSCGKSA-N	0	3	323.412	2.165	10	0		DEAEHN
CC(C)[C@H]1N[C@@H](c2cccs2)N(CCN2CCCC2)C1=O	ZINC000123420200	195579914	/nfs/dbraw/zinc/57/99/14/195579914.db2.gz	AWQVWGGXMPVURU-HUUCEWRRSA-N	0	3	307.463	2.299	10	0		DEAEHN
CCC(CC)CNS(=O)(=O)c1ccc(CNC2CC2)cn1	ZINC000125680935	195775661	/nfs/dbraw/zinc/77/56/61/195775661.db2.gz	OLAOWORVVYMRPD-UHFFFAOYSA-N	0	3	311.451	2.048	10	0		DEAEHN
C=Cn1cc(CN[C@H]2CCN(c3ncccc3Cl)C2)cn1	ZINC000194365159	132537932	/nfs/dbraw/zinc/53/79/32/132537932.db2.gz	BFXNRSDTLLMGMO-ZDUSSCGKSA-N	0	3	303.797	2.401	10	0		DEAEHN
COC(=O)C1C(=O)Nc2cc(Cl)c(Br)cc21	ZINC000725255742	542770588	/nfs/dbraw/zinc/77/05/88/542770588.db2.gz	LBFWUADNLXYTKC-MRVPVSSYSA-N	0	3	304.527	2.311	10	0		DEAEHN
COCCOc1cccc(CNCCN2CC=C(C)CC2)c1	ZINC000358146490	133124294	/nfs/dbraw/zinc/12/42/94/133124294.db2.gz	XDTKNTNEKJDUHN-UHFFFAOYSA-N	0	3	304.434	2.453	10	0		DEAEHN
CC1CCN(CCN2CCO[C@@H](COc3ccccc3)C2)CC1	ZINC000361989961	133203778	/nfs/dbraw/zinc/20/37/78/133203778.db2.gz	ZGLWUPGVNCCUIQ-LJQANCHMSA-N	0	3	318.461	2.498	10	0		DEAEHN
Cc1nccn1CCCCN1C[C@@]2(CCOC2)OC(C)(C)C1	ZINC000368445453	133273280	/nfs/dbraw/zinc/27/32/80/133273280.db2.gz	GVHKFUJHDBYTCN-QGZVFWFLSA-N	0	3	307.438	2.242	10	0		DEAEHN
CC(C)c1noc(CCC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)n1	ZINC000124120850	144706798	/nfs/dbraw/zinc/70/67/98/144706798.db2.gz	PWAPHBOYEHDIJE-QWHCGFSZSA-N	0	3	308.426	2.067	10	0		DEAEHN
Cc1csc([C@@H](C)CNC(=O)N2CCCN(C3CC3)CC2)n1	ZINC000186798156	144989265	/nfs/dbraw/zinc/98/92/65/144989265.db2.gz	LETVCAXQSVGVFS-LBPRGKRZSA-N	0	3	322.478	2.435	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1n[nH]c2c1CCCCC2	ZINC000188021197	145005740	/nfs/dbraw/zinc/00/57/40/145005740.db2.gz	WYXHUJKNIURHGR-ZDUSSCGKSA-N	0	3	304.438	2.235	10	0		DEAEHN
Cn1ccnc(NC[C@@]2(C)CCCN2Cc2ccccc2)c1=O	ZINC000189223054	145024110	/nfs/dbraw/zinc/02/41/10/145024110.db2.gz	UHEXEXJTSHFKRU-GOSISDBHSA-N	0	3	312.417	2.247	10	0		DEAEHN
C[C@H]1CN(Cc2cccc(-c3cccnc3)c2)CCN1CCO	ZINC000190243616	145040078	/nfs/dbraw/zinc/04/00/78/145040078.db2.gz	RTJRNYQEWIGJRI-INIZCTEOSA-N	0	3	311.429	2.247	10	0		DEAEHN
C[C@@H]1CC[C@H](CN2CCCN(Cc3noc(C4CC4)n3)CC2)O1	ZINC000190525257	145043942	/nfs/dbraw/zinc/04/39/42/145043942.db2.gz	TXHVSGALOYFZHP-UKRRQHHQSA-N	0	3	320.437	2.022	10	0		DEAEHN
O=C1NCCCC[C@H]1N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000192608055	145076732	/nfs/dbraw/zinc/07/67/32/145076732.db2.gz	LQINHBINHYFZIT-QGZVFWFLSA-N	0	3	319.424	2.002	10	0		DEAEHN
CCOc1ccc(NC(=O)N2CCN3CCC[C@H]3C2)cc1OC	ZINC000193724722	145089669	/nfs/dbraw/zinc/08/96/69/145089669.db2.gz	RNKZIOOHHRMZHW-AWEZNQCLSA-N	0	3	319.405	2.406	10	0		DEAEHN
C[C@H](NC(=O)N1CCN2CCC[C@H]2C1)[C@@H]1COc2ccccc21	ZINC000246221172	145095546	/nfs/dbraw/zinc/09/55/46/145095546.db2.gz	FKXDQOUAINWTTM-DZKIICNBSA-N	0	3	315.417	2.041	10	0		DEAEHN
C[C@H](C(=O)N(C)C)N1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1	ZINC000246273717	145096488	/nfs/dbraw/zinc/09/64/88/145096488.db2.gz	ALOJQFPOTUIABC-UHOFOFEASA-N	0	3	308.397	2.190	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CC[C@@H]2OCCC[C@H]2C1	ZINC000246416211	145102165	/nfs/dbraw/zinc/10/21/65/145102165.db2.gz	AGKHKUVDLRWLGU-XHSDSOJGSA-N	0	3	311.470	2.173	10	0		DEAEHN
Cc1cc(CN2CCN(C[C@H](C)O)[C@@H](C)C2)c2ccccc2n1	ZINC000246587854	145107247	/nfs/dbraw/zinc/10/72/47/145107247.db2.gz	BPFWJYSJJZAXTK-HOTGVXAUSA-N	0	3	313.445	2.430	10	0		DEAEHN
CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1cccc(OC)c1[O-]	ZINC000246596726	145108302	/nfs/dbraw/zinc/10/83/02/145108302.db2.gz	PZFHDFORRJFSSI-OLZOCXBDSA-N	0	3	304.390	2.100	10	0		DEAEHN
CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cccc(OC)c1[O-]	ZINC000246596726	145108303	/nfs/dbraw/zinc/10/83/03/145108303.db2.gz	PZFHDFORRJFSSI-OLZOCXBDSA-N	0	3	304.390	2.100	10	0		DEAEHN
CC(C)N(CC(=O)N1CCO[C@H]2CCCC[C@H]21)C1CCOCC1	ZINC000246881036	145117921	/nfs/dbraw/zinc/11/79/21/145117921.db2.gz	FXLNCGSRWBMUKN-SJORKVTESA-N	0	3	324.465	2.046	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1CCCS(=O)(=O)c1ccccc1	ZINC000246979129	145121462	/nfs/dbraw/zinc/12/14/62/145121462.db2.gz	DWMNQZNFMOWDNA-CVEARBPZSA-N	0	3	322.474	2.019	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)CSCc1ccccn1	ZINC000246981991	145121637	/nfs/dbraw/zinc/12/16/37/145121637.db2.gz	OLNWBQPRWQKNRO-CVEARBPZSA-N	0	3	319.474	2.400	10	0		DEAEHN
CSc1ccc(O[C@@H](C)C(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000247056607	145125147	/nfs/dbraw/zinc/12/51/47/145125147.db2.gz	RCVHAWMMMMHXKC-KBPBESRZSA-N	0	3	320.458	2.482	10	0		DEAEHN
CC[C@H]1CN(CCCOc2ccc(F)cc2)CCN1C[C@H](C)O	ZINC000247080748	145126075	/nfs/dbraw/zinc/12/60/75/145126075.db2.gz	HBDTVUCCYVGAOI-RDJZCZTQSA-N	0	3	324.440	2.372	10	0		DEAEHN
CC(C)Oc1cncc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1	ZINC000247141833	145127785	/nfs/dbraw/zinc/12/77/85/145127785.db2.gz	WEEGYBLPZHYTPB-ZFWWWQNUSA-N	0	3	303.406	2.178	10	0		DEAEHN
C[C@@H](NC(=O)N1CCN2CCC[C@H]2C1)c1nc2ccccc2[nH]1	ZINC000247185137	145128240	/nfs/dbraw/zinc/12/82/40/145128240.db2.gz	NUHJSSIDTDMWHH-OLZOCXBDSA-N	0	3	313.405	2.114	10	0		DEAEHN
C[C@H](C(=O)Nc1ccccc1Cl)N1CCN2CCC[C@H]2C1	ZINC000247386579	145135398	/nfs/dbraw/zinc/13/53/98/145135398.db2.gz	WOLGXHRZCUUYCE-OLZOCXBDSA-N	0	3	307.825	2.447	10	0		DEAEHN
CCOc1ccc(OCC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000247550764	145141131	/nfs/dbraw/zinc/14/11/31/145141131.db2.gz	YTQOCHDSQPPNFH-GJZGRUSLSA-N	0	3	320.433	2.405	10	0		DEAEHN
O=C([C@H]1CCCN(C/C=C/c2ccccc2)C1)N1CCOCC1	ZINC000247800879	145144041	/nfs/dbraw/zinc/14/40/41/145144041.db2.gz	FWDYCFFNQYNLTC-PYJQOMOHSA-N	0	3	314.429	2.271	10	0		DEAEHN
O=C1O[C@H](CN2CCN3CCCC[C@H]3C2)CN1c1ccccc1	ZINC000248369484	145151940	/nfs/dbraw/zinc/15/19/40/145151940.db2.gz	WIBMHZSSINHHDO-DLBZAZTESA-N	0	3	315.417	2.182	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1nncs1	ZINC000248396348	145152485	/nfs/dbraw/zinc/15/24/85/145152485.db2.gz	PVQVQAYBXBLLPS-DGCLKSJQSA-N	0	3	317.418	2.180	10	0		DEAEHN
Cc1cn(-c2ccccc2)nc1C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000248590296	145160093	/nfs/dbraw/zinc/16/00/93/145160093.db2.gz	YCQFKYQMPXVFHS-NVXWUHKLSA-N	0	3	324.428	2.489	10	0		DEAEHN
Cc1c(-c2cc(CN3CC[C@H]4OCCC[C@H]4C3)on2)cnn1C	ZINC000248612594	145161441	/nfs/dbraw/zinc/16/14/41/145161441.db2.gz	IREBYDRLPLDQAV-SUMWQHHRSA-N	0	3	316.405	2.384	10	0		DEAEHN
Cc1csc([C@H](C)CNC(=O)N2CCN3CCC[C@H]3C2)n1	ZINC000248637018	145162893	/nfs/dbraw/zinc/16/28/93/145162893.db2.gz	QNZJRGLHJUZICK-YPMHNXCESA-N	0	3	308.451	2.045	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ncccc1Br	ZINC000248779078	145167424	/nfs/dbraw/zinc/16/74/24/145167424.db2.gz	UVLPXNXZUVDRTA-MNOVXSKESA-N	0	3	324.222	2.153	10	0		DEAEHN
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1CCCCn1ccnc1C	ZINC000248849478	145170223	/nfs/dbraw/zinc/17/02/23/145170223.db2.gz	PTNYFNCCCGWDBZ-OAGGEKHMSA-N	0	3	305.422	2.245	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(C[C@@H](O)CC(F)(F)F)C1	ZINC000248867184	145170923	/nfs/dbraw/zinc/17/09/23/145170923.db2.gz	BCIAMICAYRAERD-RYUDHWBXSA-N	0	3	305.344	2.396	10	0		DEAEHN
C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1cn2ccnc2s1	ZINC000248990632	145175202	/nfs/dbraw/zinc/17/52/02/145175202.db2.gz	XAOAJFBTGGHHQC-XQQFMLRXSA-N	0	3	320.462	2.492	10	0		DEAEHN
CCCN(C)c1ccc(C(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000249843007	145190619	/nfs/dbraw/zinc/19/06/19/145190619.db2.gz	ZAXJFDLRLHFOHP-KRWDZBQOSA-N	0	3	301.434	2.453	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@@H](C)N1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000249862871	145190675	/nfs/dbraw/zinc/19/06/75/145190675.db2.gz	GSFDMQXPJKZFEL-IMJJTQAJSA-N	0	3	318.465	2.427	10	0		DEAEHN
Cc1nccn1C[C@@H](C)CNC(=O)NCCN1CCCC[C@H]1C	ZINC000249838926	145190913	/nfs/dbraw/zinc/19/09/13/145190913.db2.gz	UMFBKHNMZYDPEX-LSDHHAIUSA-N	0	3	321.469	2.001	10	0		DEAEHN
CCc1csc([C@@H]2CCCN(C[C@@H](O)Cn3cccn3)C2)n1	ZINC000249862384	145191041	/nfs/dbraw/zinc/19/10/41/145191041.db2.gz	GQBLHPZODRFTRL-UKRRQHHQSA-N	0	3	320.462	2.143	10	0		DEAEHN
NC1(C(=O)Nc2ccc(Oc3ccccn3)cc2)CCOCC1	ZINC000261651756	145213870	/nfs/dbraw/zinc/21/38/70/145213870.db2.gz	AOGRQXRSJPKCDM-UHFFFAOYSA-N	0	3	313.357	2.320	10	0		DEAEHN
c1cncc([C@@H]2CNCCN2CCc2ccc3c(c2)CCO3)c1	ZINC000261699214	145218331	/nfs/dbraw/zinc/21/83/31/145218331.db2.gz	JOIZDZUAWDRKHH-SFHVURJKSA-N	0	3	309.413	2.206	10	0		DEAEHN
NC1(C(=O)N2CCC[C@H](c3ccccc3)CC2)CCOCC1	ZINC000261794646	145227222	/nfs/dbraw/zinc/22/72/22/145227222.db2.gz	ILZIHGFNNUATTN-INIZCTEOSA-N	0	3	302.418	2.291	10	0		DEAEHN
C[C@H](NC(=O)C1(N)CCOCC1)c1ccccc1C(F)(F)F	ZINC000261925548	145242372	/nfs/dbraw/zinc/24/23/72/145242372.db2.gz	VRBIITVXEFCFAJ-JTQLQIEISA-N	0	3	316.323	2.391	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)NCCc1ccccc1F	ZINC000261958522	145247039	/nfs/dbraw/zinc/24/70/39/145247039.db2.gz	XKAUKDGLVBPWKU-DDUZABMNSA-N	0	3	320.408	2.017	10	0		DEAEHN
CCc1ccc([C@H]2CNCCN2CC(=O)NC(C)(C)C)cc1	ZINC000262201773	145269591	/nfs/dbraw/zinc/26/95/91/145269591.db2.gz	KMVNMRIFUDMGAT-MRXNPFEDSA-N	0	3	303.450	2.110	10	0		DEAEHN
CCN(CC)CC(=O)Nc1cc(CN)cc(C(F)(F)F)c1	ZINC000262956763	145313873	/nfs/dbraw/zinc/31/38/73/145313873.db2.gz	JPAMZOCMOZBZMR-UHFFFAOYSA-N	0	3	303.328	2.444	10	0		DEAEHN
C[C@H]1C[NH2+]CC[C@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1Cl	ZINC000262763316	145304013	/nfs/dbraw/zinc/30/40/13/145304013.db2.gz	JZOPUZFAYOMDRZ-GZMMTYOYSA-N	0	3	323.245	2.270	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(Cc2ccc3c(c2)CCCC3)n1	ZINC000263125142	145327688	/nfs/dbraw/zinc/32/76/88/145327688.db2.gz	BFEVHRGFYSPIBV-MRXNPFEDSA-N	0	3	312.417	2.115	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(CCSc2ccc(F)cc2)n1	ZINC000263193504	145335045	/nfs/dbraw/zinc/33/50/45/145335045.db2.gz	IDQMAEYHMLCOGY-CYBMUJFWSA-N	0	3	322.409	2.120	10	0		DEAEHN
COc1cccc([C@@H](C)Cc2nc([C@H]3CNCCN3C)no2)c1	ZINC000263199774	145335765	/nfs/dbraw/zinc/33/57/65/145335765.db2.gz	IWEWKGHTSQDFMG-SWLSCSKDSA-N	0	3	316.405	2.001	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@@H]2c2ccc(F)c(F)c2)n1	ZINC000263223072	145338049	/nfs/dbraw/zinc/33/80/49/145338049.db2.gz	MGHFAIICEMJNQK-JTNHKYCSSA-N	0	3	320.343	2.195	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N1CC(=O)NCc1ccnc(OC(F)F)c1	ZINC000356985307	147016059	/nfs/dbraw/zinc/01/60/59/147016059.db2.gz	NVYJEJUMYFUGSF-GHMZBOCLSA-N	0	3	313.348	2.172	10	0		DEAEHN
CCCN(C)CC(=O)N[C@H](c1ccn(C)n1)c1ccc(F)cc1	ZINC000358904538	147228288	/nfs/dbraw/zinc/22/82/88/147228288.db2.gz	JOYAMYCUYCAMAM-KRWDZBQOSA-N	0	3	318.396	2.107	10	0		DEAEHN
COc1ccc(Cl)cc1CNC(=O)N[C@H]1CCN(C2CC2)C1	ZINC000359343445	147311339	/nfs/dbraw/zinc/31/13/39/147311339.db2.gz	NACVFTWVZYCODX-ZDUSSCGKSA-N	0	3	323.824	2.385	10	0		DEAEHN
C/C(=C\C(C)(C)C)C(=O)N1CCN([C@H]2CCCN(C)C2)CC1	ZINC000375378314	148365367	/nfs/dbraw/zinc/36/53/67/148365367.db2.gz	IXVSXSRVMAZCLM-MDJJKAFGSA-N	0	3	307.482	2.217	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccncc1Br	ZINC000246084913	297100483	/nfs/dbraw/zinc/10/04/83/297100483.db2.gz	UIUDJGLLJKKMGX-MNOVXSKESA-N	0	3	324.222	2.153	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)c1cnn2c1CCCC2	ZINC000127452153	401736107	/nfs/dbraw/zinc/73/61/07/401736107.db2.gz	HSRKCYJQRJKSDO-CQSZACIVSA-N	0	3	304.438	2.214	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H](C)c1ccc(-n2ccnn2)cc1)N(C)C	ZINC000126546324	401699298	/nfs/dbraw/zinc/69/92/98/401699298.db2.gz	IGQUVRAVARLAIC-CJNGLKHVSA-N	0	3	315.421	2.175	10	0		DEAEHN
CCc1cccc(OCCN2CCC(C(=O)N(C)C)CC2)c1	ZINC000072822539	401712968	/nfs/dbraw/zinc/71/29/68/401712968.db2.gz	PJTGGTWAJLFHOL-UHFFFAOYSA-N	0	3	304.434	2.428	10	0		DEAEHN
C[C@H](CNC(=O)N[C@@H](C)[C@@H]1CCCO1)N(C)Cc1ccccc1	ZINC000111451662	401716114	/nfs/dbraw/zinc/71/61/14/401716114.db2.gz	QRXDGBIOTJZBQD-VYDXJSESSA-N	0	3	319.449	2.374	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cc(Cl)nc(N2CCCC2)c1	ZINC000112724803	401756473	/nfs/dbraw/zinc/75/64/73/401756473.db2.gz	GYEDISQHQUIWRS-ZDUSSCGKSA-N	0	3	322.840	2.159	10	0		DEAEHN
Cc1ccc(NC(=O)N(C)CCCN2CCN(C)CC2)s1	ZINC000075416316	401759254	/nfs/dbraw/zinc/75/92/54/401759254.db2.gz	MQZPKEYGMPXPON-UHFFFAOYSA-N	0	3	310.467	2.158	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)CCC(=O)c1cccs1	ZINC000113226602	401770775	/nfs/dbraw/zinc/77/07/75/401770775.db2.gz	IQXBFBZVYKXFFZ-QWHCGFSZSA-N	0	3	306.431	2.406	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccn(-c2ccccc2)n1	ZINC000113226030	401770934	/nfs/dbraw/zinc/77/09/34/401770934.db2.gz	WGTOFCVPUZOBEK-GOEBONIOSA-N	0	3	310.401	2.181	10	0		DEAEHN
CCc1ccc(OCC(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1	ZINC000113229450	401771711	/nfs/dbraw/zinc/77/17/11/401771711.db2.gz	BVQXPIPHRBKFPW-HOCLYGCPSA-N	0	3	302.418	2.323	10	0		DEAEHN
c1ncn(C[C@@H]2CCCN(CC3=Cc4ccccc4OC3)C2)n1	ZINC000128599312	401784370	/nfs/dbraw/zinc/78/43/70/401784370.db2.gz	FRAMHNNXTZKCIM-OAHLLOKOSA-N	0	3	310.401	2.466	10	0		DEAEHN
C[C@@H](C(=O)N1CC[C@@H](c2cnn(C)c2)C1)N1CCCCCC1	ZINC000116116538	401842441	/nfs/dbraw/zinc/84/24/41/401842441.db2.gz	UWCHPLJAAYBREW-LSDHHAIUSA-N	0	3	304.438	2.001	10	0		DEAEHN
COc1ccc(Nc2nc(C(=O)NCCN(C)C)cs2)cc1	ZINC000027905023	401848219	/nfs/dbraw/zinc/84/82/19/401848219.db2.gz	DOXVUEPMKUTGEU-UHFFFAOYSA-N	0	3	320.418	2.187	10	0		DEAEHN
COc1ccc(OC)c(CN2CC[C@@H](c3cnn(C)c3)C2)c1	ZINC000116312960	401849013	/nfs/dbraw/zinc/84/90/13/401849013.db2.gz	LFBOLBKUCDWNRO-CYBMUJFWSA-N	0	3	301.390	2.427	10	0		DEAEHN
O=C(Cc1cnc2ccccc2c1)N1CC[C@H](N2CCCC2)C1	ZINC000131425027	401850563	/nfs/dbraw/zinc/85/05/63/401850563.db2.gz	NORYCDOIFXLCQV-KRWDZBQOSA-N	0	3	309.413	2.474	10	0		DEAEHN
C[C@@H](NC[C@@H]1CN(C)CCO1)c1ccc(Br)cc1	ZINC000078469442	401852003	/nfs/dbraw/zinc/85/20/03/401852003.db2.gz	ORTZTRPHUBFWBC-BXUZGUMPSA-N	0	3	313.239	2.430	10	0		DEAEHN
C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)N1CC[C@H](c2cnn(C)c2)C1	ZINC000116408033	401852151	/nfs/dbraw/zinc/85/21/51/401852151.db2.gz	WSUAWUBTVJEETG-FPCVCCKLSA-N	0	3	318.465	2.387	10	0		DEAEHN
CCOC(=O)CCCCN1CCC[C@H](c2nncn2CC)C1	ZINC000132715875	401872250	/nfs/dbraw/zinc/87/22/50/401872250.db2.gz	QRISGYDFLDWNNQ-AWEZNQCLSA-N	0	3	308.426	2.211	10	0		DEAEHN
CC(C)Cc1ccc(CC(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000116797922	401859639	/nfs/dbraw/zinc/85/96/39/401859639.db2.gz	GGYGNMQZVOCXOP-SFHVURJKSA-N	0	3	318.461	2.217	10	0		DEAEHN
CC[C@@H](NC(=O)c1ccccc1OCCN(C)C)[C@@H]1CCCO1	ZINC000132342152	401865609	/nfs/dbraw/zinc/86/56/09/401865609.db2.gz	PSCXSALZZHKKQW-WBVHZDCISA-N	0	3	320.433	2.314	10	0		DEAEHN
COc1cc(Br)c(CNCC[C@@H](C)O)cc1OC	ZINC000078781905	401865797	/nfs/dbraw/zinc/86/57/97/401865797.db2.gz	DPKRRKFCLCEXTH-SECBINFHSA-N	0	3	318.211	2.327	10	0		DEAEHN
Cc1ccccc1[C@@H](C)NC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000117023038	401867232	/nfs/dbraw/zinc/86/72/32/401867232.db2.gz	YOKCKVILYVFJHW-CABCVRRESA-N	0	3	305.422	2.028	10	0		DEAEHN
CCCC[C@@H]1CCC[C@@H]1NC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000117044931	401867554	/nfs/dbraw/zinc/86/75/54/401867554.db2.gz	BUHFJIVSUCRZKQ-OAGGEKHMSA-N	0	3	311.470	2.317	10	0		DEAEHN
CCN(C(C)=O)c1nc(CN[C@H]2CCCN(CC)C2)cs1	ZINC000040502727	401925780	/nfs/dbraw/zinc/92/57/80/401925780.db2.gz	RNMTTXXWHSHEMV-ZDUSSCGKSA-N	0	3	310.467	2.090	10	0		DEAEHN
Cc1ccc(NC(=O)NC[C@@H](O)CN2CCCCC2)c(C)c1	ZINC000043142066	401937323	/nfs/dbraw/zinc/93/73/23/401937323.db2.gz	RSIQRYBOXREHGP-OAHLLOKOSA-N	0	3	305.422	2.272	10	0		DEAEHN
COCCN(C)CCCNC(=O)C[C@H]1CCOc2ccccc21	ZINC000117755467	401883421	/nfs/dbraw/zinc/88/34/21/401883421.db2.gz	UEUBFGPKAUUNBB-OAHLLOKOSA-N	0	3	320.433	2.027	10	0		DEAEHN
Cc1ccc(F)c(OCC(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000133408083	401884828	/nfs/dbraw/zinc/88/48/28/401884828.db2.gz	IIWRKIKAEQXADF-UONOGXRCSA-N	0	3	306.381	2.208	10	0		DEAEHN
COCCN(Cc1ccccc1C)C[C@@H](O)COCC(C)C	ZINC000036099872	401902714	/nfs/dbraw/zinc/90/27/14/401902714.db2.gz	SNLYQTHCCMNWFX-GOSISDBHSA-N	0	3	309.450	2.477	10	0		DEAEHN
C[C@H](O)C1CCN(C(=O)[C@H]2CCCN2Cc2ccccc2)CC1	ZINC000118729368	401905735	/nfs/dbraw/zinc/90/57/35/401905735.db2.gz	QYJSIMBSNCHAJX-MAUKXSAKSA-N	0	3	316.445	2.270	10	0		DEAEHN
CCC(C)(C)NC(=O)CN1CC[C@@H]2[C@H](CCCN2C2CC2)C1	ZINC000134879633	401918296	/nfs/dbraw/zinc/91/82/96/401918296.db2.gz	ZOTXLGHWNPFLES-GDBMZVCRSA-N	0	3	307.482	2.240	10	0		DEAEHN
Cc1noc(CCN[C@H](C)c2ccc(N3CCCC3=O)cc2)n1	ZINC000089517867	401950662	/nfs/dbraw/zinc/95/06/62/401950662.db2.gz	UUKLPSROWHYPTC-GFCCVEGCSA-N	0	3	314.389	2.398	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@@H](C)N[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000119488584	401953588	/nfs/dbraw/zinc/95/35/88/401953588.db2.gz	SEVUWSVEUUVOKI-MELADBBJSA-N	0	3	315.421	2.221	10	0		DEAEHN
CCCS(=O)(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000119689689	401963568	/nfs/dbraw/zinc/96/35/68/401963568.db2.gz	SOUATCTVNHWWDU-INIZCTEOSA-N	0	3	310.463	2.371	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)NC[C@@H]1CCCN(C)C1	ZINC000119828717	401968002	/nfs/dbraw/zinc/96/80/02/401968002.db2.gz	YXAZLJSWPKQOMP-ZDUSSCGKSA-N	0	3	310.467	2.059	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2cc3ccccc3[nH]2)C1	ZINC000136522601	401968752	/nfs/dbraw/zinc/96/87/52/401968752.db2.gz	FDHCXVXNRRSHGV-MRXNPFEDSA-N	0	3	314.433	2.494	10	0		DEAEHN
CC(=O)c1ccccc1OCC(=O)NC1CCN(C2CC2)CC1	ZINC000120089844	401977680	/nfs/dbraw/zinc/97/76/80/401977680.db2.gz	QAYVSZQCFGMOJN-UHFFFAOYSA-N	0	3	316.401	2.011	10	0		DEAEHN
CCNC(=O)N1CC[C@H](N[C@H](C)c2ccc(F)c(OC)c2)C1	ZINC000090410228	401982136	/nfs/dbraw/zinc/98/21/36/401982136.db2.gz	LXPNATOZXSBEBN-YPMHNXCESA-N	0	3	309.385	2.289	10	0		DEAEHN
CC[C@H]1CCCCCN1C(=O)NC[C@H]1CCCN1CCOC	ZINC000120341473	401987381	/nfs/dbraw/zinc/98/73/81/401987381.db2.gz	UNHUTEUTJGFMFZ-JKSUJKDBSA-N	0	3	311.470	2.461	10	0		DEAEHN
COCCN1CCC[C@@H]1CN[C@H](C)c1nc2ccccc2n1C	ZINC000091318961	401996246	/nfs/dbraw/zinc/99/62/46/401996246.db2.gz	MVIZEKFTCVPOCF-HUUCEWRRSA-N	0	3	316.449	2.335	10	0		DEAEHN
COC(=O)[C@@H](C)CN(CCn1cccn1)Cc1ccccc1	ZINC000121107666	402015840	/nfs/dbraw/zinc/01/58/40/402015840.db2.gz	BXIFJGWDPADKOB-HNNXBMFYSA-N	0	3	301.390	2.194	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@H](C)NCCCN1CCOCC1	ZINC000151172446	402021561	/nfs/dbraw/zinc/02/15/61/402021561.db2.gz	RNMNFYGMTPRPPJ-AWEZNQCLSA-N	0	3	308.470	2.319	10	0		DEAEHN
COc1cccc(C(=O)N(CCN(C)C)Cc2ccco2)c1O	ZINC000121253850	402023560	/nfs/dbraw/zinc/02/35/60/402023560.db2.gz	VBXAHSKGSMRUKH-UHFFFAOYSA-N	0	3	318.373	2.198	10	0		DEAEHN
CCN1CCN(C[C@@H](C)CNC(=O)NC(C)(CC)CC)CC1	ZINC000121254588	402023611	/nfs/dbraw/zinc/02/36/11/402023611.db2.gz	FLZZHKXCTJLDLW-HNNXBMFYSA-N	0	3	312.502	2.138	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](C)[C@@H]2COc3ccccc32)C1	ZINC000121262721	402024404	/nfs/dbraw/zinc/02/44/04/402024404.db2.gz	UUPUXMASRZCRDK-DZKIICNBSA-N	0	3	317.433	2.335	10	0		DEAEHN
C[C@@H](NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cnccn1	ZINC000095089254	402025129	/nfs/dbraw/zinc/02/51/29/402025129.db2.gz	QPFLGWDLIKXQCY-OLZOCXBDSA-N	0	3	306.410	2.384	10	0		DEAEHN
C[C@@H]1CCCCN1CC(=O)NCCN1CCc2ccccc21	ZINC000051228063	402032635	/nfs/dbraw/zinc/03/26/35/402032635.db2.gz	FDELSGKDXAXILJ-OAHLLOKOSA-N	0	3	301.434	2.040	10	0		DEAEHN
Cc1cccc([C@H](O)CNC(=O)N[C@H](CC(C)C)CN(C)C)c1	ZINC000121391850	402032796	/nfs/dbraw/zinc/03/27/96/402032796.db2.gz	UQOMLDJWXOJNPY-IAGOWNOFSA-N	0	3	321.465	2.304	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@@H](Oc2cccnc2)C1)N1CCCCCC1	ZINC000151524678	402041310	/nfs/dbraw/zinc/04/13/10/402041310.db2.gz	WBFGLVOAWABVOM-NVXWUHKLSA-N	0	3	317.433	2.326	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)Cc2ccc(OC)cc2)C1	ZINC000052593507	402044363	/nfs/dbraw/zinc/04/43/63/402044363.db2.gz	SOLPSVMFDZHHDT-OAHLLOKOSA-N	0	3	305.422	2.321	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)CCOc2ccccc2F)C1	ZINC000052593442	402044403	/nfs/dbraw/zinc/04/44/03/402044403.db2.gz	XFUGSGOEEWJEDU-AWEZNQCLSA-N	0	3	323.412	2.330	10	0		DEAEHN
C[C@@H](C(=O)N[C@H](Cc1ccccc1)CN(C)C)C1CCOCC1	ZINC000121586269	402045209	/nfs/dbraw/zinc/04/52/09/402045209.db2.gz	MCTQQRDTMOEXNW-CRAIPNDOSA-N	0	3	318.461	2.338	10	0		DEAEHN
Cc1[nH]ncc1CN1CCCC[C@H]1c1nnc2n1CCCC2	ZINC000092812332	402009908	/nfs/dbraw/zinc/00/99/08/402009908.db2.gz	LRMVYOWJBFJMKI-AWEZNQCLSA-N	0	3	300.410	2.373	10	0		DEAEHN
NC(=O)[C@H]1CCCN(Cc2cccc(OCC(F)(F)F)c2)C1	ZINC000122300551	402071255	/nfs/dbraw/zinc/07/12/55/402071255.db2.gz	ZOMWTFWJMSQLKA-LBPRGKRZSA-N	0	3	316.323	2.325	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCc2ccc(C)c(OC)c2)C1	ZINC000054780767	402072185	/nfs/dbraw/zinc/07/21/85/402072185.db2.gz	FMGAYPOSJAJDLR-OAHLLOKOSA-N	0	3	305.422	2.287	10	0		DEAEHN
CC(C)C(=O)N1CCC[C@H]1C(=O)Nc1cccc(CN(C)C)c1	ZINC000055308287	402079386	/nfs/dbraw/zinc/07/93/86/402079386.db2.gz	FPEIGUVDZONKNA-INIZCTEOSA-N	0	3	317.433	2.334	10	0		DEAEHN
COCc1ccc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)o1	ZINC000097007510	402100073	/nfs/dbraw/zinc/10/00/73/402100073.db2.gz	NLNNHGMBPAYACR-OAHLLOKOSA-N	0	3	316.401	2.329	10	0		DEAEHN
COCc1ccc(C(=O)N[C@H](CN(C)C)c2ccccc2)o1	ZINC000096990238	402100272	/nfs/dbraw/zinc/10/02/72/402100272.db2.gz	OHMHDDAGRVPHBK-OAHLLOKOSA-N	0	3	302.374	2.459	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)CCc2nc(C(C)(C)C)no2)CCN1C	ZINC000123055120	402108085	/nfs/dbraw/zinc/10/80/85/402108085.db2.gz	WZSUUUKQBFLWDD-CHWSQXEVSA-N	0	3	322.453	2.241	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)Cc1c(Cl)cccc1OC	ZINC000152869788	402113679	/nfs/dbraw/zinc/11/36/79/402113679.db2.gz	OXYGQPPPNRVWMD-GFCCVEGCSA-N	0	3	310.825	2.492	10	0		DEAEHN
CC(=O)Nc1cccc([C@@H](C)NC[C@@H](C)N2CCOCC2)c1	ZINC000123252467	402117991	/nfs/dbraw/zinc/11/79/91/402117991.db2.gz	YQPZYEUZNPMDMO-ZIAGYGMSSA-N	0	3	305.422	2.016	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)C[C@H]2OC(=O)c3ccccc32)CCN1C	ZINC000123400881	402125831	/nfs/dbraw/zinc/12/58/31/402125831.db2.gz	AMUATTFVQMBYFE-XJKCOSOUSA-N	0	3	316.401	2.229	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccccc1NCCOC)N(C)C	ZINC000153092488	402126624	/nfs/dbraw/zinc/12/66/24/402126624.db2.gz	FMURXLIHLUOHLP-INIZCTEOSA-N	0	3	307.438	2.091	10	0		DEAEHN
CN1CCO[C@H]2CN(c3ccnc4ccc(Cl)cc43)C[C@@H]21	ZINC000153140781	402128965	/nfs/dbraw/zinc/12/89/65/402128965.db2.gz	BUFOYLRWCHLRBA-HOTGVXAUSA-N	0	3	303.793	2.407	10	0		DEAEHN
COc1cccc(Cl)c1CC(=O)N1CCC[C@H](N(C)C)C1	ZINC000153135658	402129020	/nfs/dbraw/zinc/12/90/20/402129020.db2.gz	NQVPOVLCUQUORB-LBPRGKRZSA-N	0	3	310.825	2.444	10	0		DEAEHN
CC[C@H](C(=O)N1CCO[C@H](CN(C)C)C1)c1ccc(F)cc1	ZINC000123594300	402136883	/nfs/dbraw/zinc/13/68/83/402136883.db2.gz	LHVRFEALVYHFOY-CVEARBPZSA-N	0	3	308.397	2.108	10	0		DEAEHN
CC[C@@](C)(O)CN1CCCN(C(=O)CCc2ccccc2)CC1	ZINC000123641774	402139490	/nfs/dbraw/zinc/13/94/90/402139490.db2.gz	ZDBJDCLTBMPLQC-LJQANCHMSA-N	0	3	318.461	2.315	10	0		DEAEHN
CCCC(=O)N[C@H]1CCCN(CCCOCC(F)(F)F)C1	ZINC000101563228	402148697	/nfs/dbraw/zinc/14/86/97/402148697.db2.gz	SVVTUDVFGXSBRP-LBPRGKRZSA-N	0	3	310.360	2.336	10	0		DEAEHN
COc1ccc(NC(=O)NCCN2CCCC[C@H]2C)c(C)n1	ZINC000124000747	402158323	/nfs/dbraw/zinc/15/83/23/402158323.db2.gz	TUUKULASRDJNRY-GFCCVEGCSA-N	0	3	306.410	2.395	10	0		DEAEHN
Cc1nc(C[C@H]2CCCN(CCC(=O)OC(C)(C)C)C2)no1	ZINC000103230583	402182036	/nfs/dbraw/zinc/18/20/36/402182036.db2.gz	OSTGKFBAVHMGRP-CYBMUJFWSA-N	0	3	309.410	2.364	10	0		DEAEHN
CCCCOC(=O)CCN1CCC[C@@H](Cc2noc(C)n2)C1	ZINC000103230648	402182044	/nfs/dbraw/zinc/18/20/44/402182044.db2.gz	NUOCSXGPHCDNFO-AWEZNQCLSA-N	0	3	309.410	2.366	10	0		DEAEHN
COc1ccccc1C1CC(N[C@@H]2CCCS(=O)(=O)C2)C1	ZINC000069140601	402214105	/nfs/dbraw/zinc/21/41/05/402214105.db2.gz	AMZAHVIFPFBUIP-ROKHWSDSSA-N	0	3	309.431	2.108	10	0		DEAEHN
Cc1noc(C)c1CCNC(=O)NCCN1CCCC[C@@H]1C	ZINC000107077074	402225591	/nfs/dbraw/zinc/22/55/91/402225591.db2.gz	YZAKYESJSFPSOP-LBPRGKRZSA-N	0	3	308.426	2.008	10	0		DEAEHN
CCOc1ccc(CN2CCN(C[C@@H](C)O)[C@H](CC)C2)cc1	ZINC000155082966	402244519	/nfs/dbraw/zinc/24/45/19/402244519.db2.gz	MMZAVUVIBXSHLP-NVXWUHKLSA-N	0	3	306.450	2.362	10	0		DEAEHN
CN(C)C[C@@H]1CN(CCCOc2cccc(Cl)c2)CCO1	ZINC000155374224	402254482	/nfs/dbraw/zinc/25/44/82/402254482.db2.gz	QXUGFKNSDBSKLT-MRXNPFEDSA-N	0	3	312.841	2.371	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@H](C)C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000155704442	402265402	/nfs/dbraw/zinc/26/54/02/402265402.db2.gz	UUNBJHLDKNLTNT-DCGLDWPTSA-N	0	3	320.481	2.060	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2noc3c2CCCCC3)CCN1C	ZINC000154338691	402207203	/nfs/dbraw/zinc/20/72/03/402207203.db2.gz	JNIIXAPDBIPJRO-QWHCGFSZSA-N	0	3	305.422	2.498	10	0		DEAEHN
COc1c(C)cnc(CN2CCC[C@H](Cn3cncn3)C2)c1C	ZINC000105919359	402211201	/nfs/dbraw/zinc/21/12/01/402211201.db2.gz	ZPARUPRMFJALEQ-HNNXBMFYSA-N	0	3	315.421	2.211	10	0		DEAEHN
C[C@H](C(=O)N1CCCO1)N1CCC(Cc2ccccc2)CC1	ZINC000155878589	402269688	/nfs/dbraw/zinc/26/96/88/402269688.db2.gz	UHMBPQMGNXQVDG-OAHLLOKOSA-N	0	3	302.418	2.494	10	0		DEAEHN
CCOc1cccnc1C(=O)NC[C@@H](C)N1CCC[C@H](C)C1	ZINC000176070637	402275634	/nfs/dbraw/zinc/27/56/34/402275634.db2.gz	MWGFPUMCLNQNQY-UONOGXRCSA-N	0	3	305.422	2.331	10	0		DEAEHN
CCOc1cccnc1C(=O)N[C@H](C)CN1CCC[C@H](C)C1	ZINC000176163303	402285811	/nfs/dbraw/zinc/28/58/11/402285811.db2.gz	XBAYJTXAWQXISI-UONOGXRCSA-N	0	3	305.422	2.331	10	0		DEAEHN
CCc1cnc(CN(C)C(=O)N[C@@H]2CCCN(CC)C2)s1	ZINC000176257505	402294565	/nfs/dbraw/zinc/29/45/65/402294565.db2.gz	LLLNCIJQRGEMJI-GFCCVEGCSA-N	0	3	310.467	2.331	10	0		DEAEHN
COc1ccc([C@H](C)CC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000176282054	402296873	/nfs/dbraw/zinc/29/68/73/402296873.db2.gz	BRGQQHPIHYECBT-GDBMZVCRSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H](COC)c1ccccc1	ZINC000176311012	402298849	/nfs/dbraw/zinc/29/88/49/402298849.db2.gz	KOQKWWQUYONUTH-SJORKVTESA-N	0	3	319.449	2.500	10	0		DEAEHN
CC(C)c1ccc(NC(=O)CN[C@@H]2CCCC[C@H]2C(N)=O)cc1	ZINC000184810063	402301424	/nfs/dbraw/zinc/30/14/24/402301424.db2.gz	OJMRKVOYOTUNGR-HZPDHXFCSA-N	0	3	317.433	2.382	10	0		DEAEHN
CC(C)[C@](C)(O)C[NH+]1CCC(C(=O)Nc2ccccc2[O-])CC1	ZINC000184937092	402310650	/nfs/dbraw/zinc/31/06/50/402310650.db2.gz	GNZJNFNWMWVIOG-GOSISDBHSA-N	0	3	320.433	2.450	10	0		DEAEHN
COc1ccc(/C(C)=C/C(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000176520110	402316636	/nfs/dbraw/zinc/31/66/36/402316636.db2.gz	QIVAQLHMUDFZMZ-WCRPCQDQSA-N	0	3	300.402	2.405	10	0		DEAEHN
CC[C@@H](O)[C@H]1CCCCN1Cc1cc(-c2cnn(C)c2)no1	ZINC000185008060	402316841	/nfs/dbraw/zinc/31/68/41/402316841.db2.gz	LUOJZFPDHTXDSF-HZPDHXFCSA-N	0	3	304.394	2.201	10	0		DEAEHN
CN(Cc1cc(-c2cnn(C)c2)no1)C1CCC(CO)CC1	ZINC000185039633	402318877	/nfs/dbraw/zinc/31/88/77/402318877.db2.gz	CFZFZYXCKQSQPX-UHFFFAOYSA-N	0	3	304.394	2.058	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000185058404	402321120	/nfs/dbraw/zinc/32/11/20/402321120.db2.gz	IQUVYCSBKZIUSO-HNNXBMFYSA-N	0	3	303.406	2.246	10	0		DEAEHN
COC(C)(C)C(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1	ZINC000185335052	402344545	/nfs/dbraw/zinc/34/45/45/402344545.db2.gz	KIDWYQHFBOBSJS-MRXNPFEDSA-N	0	3	304.434	2.438	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)COc1cccc(C(C)=O)c1	ZINC000176985305	402356811	/nfs/dbraw/zinc/35/68/11/402356811.db2.gz	VXISDMIRHIWUMP-MRXNPFEDSA-N	0	3	318.417	2.211	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@@H]1Cc2cc(F)ccc2O1	ZINC000177015039	402359299	/nfs/dbraw/zinc/35/92/99/402359299.db2.gz	PPYAEDQETQAKKR-ZBFHGGJFSA-N	0	3	306.381	2.072	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1ccoc1Br	ZINC000234262966	402359495	/nfs/dbraw/zinc/35/94/95/402359495.db2.gz	ZYTGOVKSMQUYDZ-SECBINFHSA-N	0	3	301.184	2.208	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cccc(C[S@](C)=O)c2)C1	ZINC000177058415	402365483	/nfs/dbraw/zinc/36/54/83/402365483.db2.gz	LLHGWVFQQQMTKL-DHZVRSILSA-N	0	3	322.474	2.024	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@@H]1COc2ccccc21	ZINC000177449217	402403160	/nfs/dbraw/zinc/40/31/60/402403160.db2.gz	UWMJKCOMSHVYDL-DZGCQCFKSA-N	0	3	303.406	2.246	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@@H](c2ccccc2F)C1)N(C)C	ZINC000161969078	402405183	/nfs/dbraw/zinc/40/51/83/402405183.db2.gz	BUNOYVOIFNNCTH-JKSUJKDBSA-N	0	3	308.397	2.456	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@@H](C)CCc1cccn1C	ZINC000177550240	402415076	/nfs/dbraw/zinc/41/50/76/402415076.db2.gz	ZPNJXJWMGQMHFH-RDJZCZTQSA-N	0	3	320.481	2.472	10	0		DEAEHN
C[C@@H](C(=O)NCc1cccc(CN(C)C)c1)C1CCOCC1	ZINC000162403336	402419003	/nfs/dbraw/zinc/41/90/03/402419003.db2.gz	SOSLAHQBFLROSM-CQSZACIVSA-N	0	3	304.434	2.427	10	0		DEAEHN
COC(CN1CCC[C@@H](c2nc(-c3ccccc3)n[nH]2)C1)OC	ZINC000162493341	402422003	/nfs/dbraw/zinc/42/20/03/402422003.db2.gz	BDOPENGCHQUZBT-CQSZACIVSA-N	0	3	316.405	2.270	10	0		DEAEHN
C[NH+](C)C[C@H]1CCN(C(=O)c2ccc3c(c2[O-])CCCC3)C1	ZINC000186360176	402425142	/nfs/dbraw/zinc/42/51/42/402425142.db2.gz	SOTLGLBILOSTEZ-CYBMUJFWSA-N	0	3	302.418	2.295	10	0		DEAEHN
CC(C)c1cccc(NC(=O)C(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000177680482	402426284	/nfs/dbraw/zinc/42/62/84/402426284.db2.gz	JYCIADFEQMCUCJ-MRXNPFEDSA-N	0	3	315.417	2.055	10	0		DEAEHN
O=C(C[C@H]1CSCCN1)N(C[C@H]1CCCO1)C1CCCC1	ZINC000238079053	402436898	/nfs/dbraw/zinc/43/68/98/402436898.db2.gz	FETUMKVSKGLOKZ-DZGCQCFKSA-N	0	3	312.479	2.032	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2nc(C)c(C)s2)C1	ZINC000177853898	402441232	/nfs/dbraw/zinc/44/12/32/402441232.db2.gz	IPYXUCMUOPYRFD-CYBMUJFWSA-N	0	3	310.467	2.086	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)[C@H](O)c2cc(Cl)cc(Cl)c2)C1	ZINC000163126949	402442415	/nfs/dbraw/zinc/44/24/15/402442415.db2.gz	BOYVIRLOTCBGOW-QWHCGFSZSA-N	0	3	317.216	2.189	10	0		DEAEHN
COCCN(C)CCCNC(=O)c1cc(C)c(F)cc1Cl	ZINC000163307740	402447031	/nfs/dbraw/zinc/44/70/31/402447031.db2.gz	FRNLZSUHSYOXPT-UHFFFAOYSA-N	0	3	316.804	2.486	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@H]1CCN(c2ccccc2)C1)N(C)C	ZINC000161555073	402391692	/nfs/dbraw/zinc/39/16/92/402391692.db2.gz	AWQWOXSQSITVOH-NVXWUHKLSA-N	0	3	303.450	2.359	10	0		DEAEHN
Cc1cccc(C)c1OCCN1C[C@H](N2CCOCC2)[C@@H](C)C1	ZINC000246116895	402511243	/nfs/dbraw/zinc/51/12/43/402511243.db2.gz	KSZVYKQGEMDTEO-ROUUACIJSA-N	0	3	318.461	2.335	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N1CC[C@@H](N2CCCC2)C1)c1ccccc1	ZINC000245397684	402455166	/nfs/dbraw/zinc/45/51/66/402455166.db2.gz	PZBJNHGLJCOYKL-XYJFISCASA-N	0	3	315.461	2.422	10	0		DEAEHN
O=C(COc1ccc2c(c1)CCCC2)N1CCN2CCC[C@H]2C1	ZINC000178113512	402461579	/nfs/dbraw/zinc/46/15/79/402461579.db2.gz	WMOZBEBTCAZEMO-KRWDZBQOSA-N	0	3	314.429	2.251	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN([C@H]3CCN(C(C)C)C3=O)C2)n1	ZINC000245459258	402462387	/nfs/dbraw/zinc/46/23/87/402462387.db2.gz	DJTYJQNZLRTCEI-HOTGVXAUSA-N	0	3	316.449	2.133	10	0		DEAEHN
CCOc1cc(CN2C[C@@H](C(N)=O)CC[C@H]2C)ccc1OC	ZINC000245513631	402467016	/nfs/dbraw/zinc/46/70/16/402467016.db2.gz	DFDMFRLEZGGIQR-OCCSQVGLSA-N	0	3	306.406	2.180	10	0		DEAEHN
O=C1NCC[C@@H]1N1CCC(c2c[nH]c3cc(F)ccc32)CC1	ZINC000178201805	402470585	/nfs/dbraw/zinc/47/05/85/402470585.db2.gz	BVNVEBPUAZPXAF-INIZCTEOSA-N	0	3	301.365	2.375	10	0		DEAEHN
O=C(NC[C@@H]1C[C@H]1c1ccccc1)N1CC[C@@H](N2CC=CC2)C1	ZINC000245671144	402477991	/nfs/dbraw/zinc/47/79/91/402477991.db2.gz	FIRCHDVXPPSKCU-KSZLIROESA-N	0	3	311.429	2.446	10	0		DEAEHN
CN1CC[C@H](NC(=O)NC[C@H]2CCCOC2)[C@H]1c1ccccc1	ZINC000245680225	402478665	/nfs/dbraw/zinc/47/86/65/402478665.db2.gz	VCGXVHBHVCZELA-HYVNUMGLSA-N	0	3	317.433	2.158	10	0		DEAEHN
COc1ccc(O)cc1C(=O)N1CCCN(C2CCCC2)CC1	ZINC000187170200	402486299	/nfs/dbraw/zinc/48/62/99/402486299.db2.gz	IXSXPXFCGXPLHC-UHFFFAOYSA-N	0	3	318.417	2.491	10	0		DEAEHN
CCOC(=O)c1csc(N2CC[C@H]3[C@H](CCCN3C)C2)n1	ZINC000166892844	402488048	/nfs/dbraw/zinc/48/80/48/402488048.db2.gz	XCMXCMAOELQPQH-YPMHNXCESA-N	0	3	309.435	2.240	10	0		DEAEHN
CO[C@H]1CN(C(=O)NCC(C)(C)N2CCCCC2)CC[C@H]1C	ZINC000187246651	402490161	/nfs/dbraw/zinc/49/01/61/402490161.db2.gz	ANGPQBABECVYFA-CABCVRRESA-N	0	3	311.470	2.317	10	0		DEAEHN
CCCC(=O)N[C@@H]1CCCN([C@@H]2Cc3ccccc3[C@H]2O)C1	ZINC000245859421	402491717	/nfs/dbraw/zinc/49/17/17/402491717.db2.gz	OKJIMKRQQZYDPO-QGPMSJSTSA-N	0	3	302.418	2.025	10	0		DEAEHN
COC(=O)C[C@H]1CCCN1CCN(C)Cc1ccc(F)cc1	ZINC000187304914	402493340	/nfs/dbraw/zinc/49/33/40/402493340.db2.gz	DLZWPNFOZAWKIW-MRXNPFEDSA-N	0	3	308.397	2.285	10	0		DEAEHN
COc1cccc(CNC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1	ZINC000245931973	402499093	/nfs/dbraw/zinc/49/90/93/402499093.db2.gz	PNMCEYRCGLCBKW-RDJZCZTQSA-N	0	3	317.433	2.321	10	0		DEAEHN
C/C(=C\C(=O)NC[C@H](O)CN1CCCCC1)c1cccc(F)c1	ZINC000178517857	402506764	/nfs/dbraw/zinc/50/67/64/402506764.db2.gz	LXTCBYFGIYXUAP-SHRNQRGKSA-N	0	3	320.408	2.192	10	0		DEAEHN
COC(=O)[C@H](N[C@@H]1CN(C(C)C)C[C@@H]1C)c1ccccc1F	ZINC000246166608	402514323	/nfs/dbraw/zinc/51/43/23/402514323.db2.gz	FBPHUIJPTLRWSV-APHBMKBZSA-N	0	3	308.397	2.358	10	0		DEAEHN
CN(C)C[C@@H]1CN(CCCCCOc2ccccc2)CCO1	ZINC000189510420	402542245	/nfs/dbraw/zinc/54/22/45/402542245.db2.gz	QCOAZPGMGAWZHN-GOSISDBHSA-N	0	3	306.450	2.498	10	0		DEAEHN
CC(C)c1ccc([C@H](N)CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)cc1	ZINC000178876091	402548925	/nfs/dbraw/zinc/54/89/25/402548925.db2.gz	PUBBHQKNUISAFF-VQHPVUNQSA-N	0	3	302.418	2.494	10	0		DEAEHN
CC(C)c1ccc([C@@H](N)CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)cc1	ZINC000178876100	402549176	/nfs/dbraw/zinc/54/91/76/402549176.db2.gz	PUBBHQKNUISAFF-NCOADZHNSA-N	0	3	302.418	2.494	10	0		DEAEHN
CCOC(=O)Nc1ccc(NC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000171076874	402555120	/nfs/dbraw/zinc/55/51/20/402555120.db2.gz	NZDKSYGKLKVCDQ-CQSZACIVSA-N	0	3	320.393	2.423	10	0		DEAEHN
COCCOc1ccc(NC(=O)N2CC[C@H](N(C)C)C2)c(C)c1	ZINC000171078863	402555194	/nfs/dbraw/zinc/55/51/94/402555194.db2.gz	IOJILQONDFMRNP-AWEZNQCLSA-N	0	3	321.421	2.188	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2nnc(-c3ccsc3)s2)C1	ZINC000171080659	402555980	/nfs/dbraw/zinc/55/59/80/402555980.db2.gz	KRXJBXTXBXFZTC-SNVBAGLBSA-N	0	3	323.447	2.434	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(C[C@@H](O)COCC(C)C)C1	ZINC000247243145	402561625	/nfs/dbraw/zinc/56/16/25/402561625.db2.gz	SMZJJSCAKJAMIB-HZPDHXFCSA-N	0	3	309.454	2.116	10	0		DEAEHN
C[C@H](NCC(=O)N(C)CC1CC1)c1cccc(-n2ccnc2)c1	ZINC000189911278	402566582	/nfs/dbraw/zinc/56/65/82/402566582.db2.gz	ZWXITNHJQKWHRM-AWEZNQCLSA-N	0	3	312.417	2.391	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)[C@H]1CCCC[C@H]1C	ZINC000247479482	402568933	/nfs/dbraw/zinc/56/89/33/402568933.db2.gz	JDHFWXZXARDCBB-OAGGEKHMSA-N	0	3	311.470	2.317	10	0		DEAEHN
C[C@@H](N[C@@H]1CCNC1=O)c1ccc(OCC(F)(F)F)cc1	ZINC000179065241	402569825	/nfs/dbraw/zinc/56/98/25/402569825.db2.gz	KEDOGCWISNZZHU-BXKDBHETSA-N	0	3	302.296	2.167	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@H]2Oc3ccccc3O[C@@H]2C)C1	ZINC000247505762	402570246	/nfs/dbraw/zinc/57/02/46/402570246.db2.gz	XXSYIQKVISYEIP-WVZRYYJFSA-N	0	3	318.417	2.060	10	0		DEAEHN
Cc1noc2ncc(C(=O)N(C)[C@H]3CCN(C)[C@@H](C)C3)cc12	ZINC000247535787	402571283	/nfs/dbraw/zinc/57/12/83/402571283.db2.gz	XQXIHTPORWWLPT-GWCFXTLKSA-N	0	3	302.378	2.086	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NC(=O)C1(N)Cc2ccccc2C1	ZINC000178607645	402517116	/nfs/dbraw/zinc/51/71/16/402517116.db2.gz	SXDZVNUHASRODD-HNNXBMFYSA-N	0	3	324.424	2.204	10	0		DEAEHN
C[C@@H](C(=O)Nc1cccc2ncccc21)N1CCN2CCC[C@@H]2C1	ZINC000178625130	402518939	/nfs/dbraw/zinc/51/89/39/402518939.db2.gz	UWZOKVBHIUXRFI-LSDHHAIUSA-N	0	3	324.428	2.342	10	0		DEAEHN
C[C@@H]1CN(C(=O)CN2CCC[C@]3(CC=CCC3)C2)C[C@@H](C)O1	ZINC000246403516	402529455	/nfs/dbraw/zinc/52/94/55/402529455.db2.gz	QYYTWTDYFOYGKQ-JFIYKMOQSA-N	0	3	306.450	2.445	10	0		DEAEHN
C[C@@H]1C[C@@H]1NC(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	ZINC000170823110	402529983	/nfs/dbraw/zinc/52/99/83/402529983.db2.gz	XFANSWLDYDGKMG-CJNGLKHVSA-N	0	3	315.417	2.136	10	0		DEAEHN
Cc1c(C(=O)N2CC[C@@H](N(C)C)C2)cnn1-c1ccccc1F	ZINC000170856265	402532994	/nfs/dbraw/zinc/53/29/94/402532994.db2.gz	QTOCVKLTMIIAFN-CYBMUJFWSA-N	0	3	316.380	2.096	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(-n3cc[nH]c3=S)cc2)C1	ZINC000170865631	402534923	/nfs/dbraw/zinc/53/49/23/402534923.db2.gz	GILNHYSWTGMLHN-CQSZACIVSA-N	0	3	316.430	2.311	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cc(F)cc(Br)c2)C1	ZINC000170865959	402535068	/nfs/dbraw/zinc/53/50/68/402535068.db2.gz	DYHRTKUVRQHEEA-LBPRGKRZSA-N	0	3	315.186	2.364	10	0		DEAEHN
Cc1ccc(-c2nc(CC(=O)N3CC[C@@H](N(C)C)C3)cs2)o1	ZINC000170866885	402535914	/nfs/dbraw/zinc/53/59/14/402535914.db2.gz	HWFJEIVCJRUCPA-CYBMUJFWSA-N	0	3	319.430	2.417	10	0		DEAEHN
CN1CCN(C(=O)[C@H]2CCCc3[nH]ncc32)[C@@H](c2ccccc2)C1	ZINC000246653187	402539732	/nfs/dbraw/zinc/53/97/32/402539732.db2.gz	VPZVMNLJLSFUGT-MAUKXSAKSA-N	0	3	324.428	2.345	10	0		DEAEHN
Cc1noc(C)c1[C@@H](C)CC(=O)N1CCCN(C2CC2)CC1	ZINC000179193910	402579731	/nfs/dbraw/zinc/57/97/31/402579731.db2.gz	DLJPNTWLPPEXBF-LBPRGKRZSA-N	0	3	305.422	2.482	10	0		DEAEHN
O=C(c1cc(C2CCCCC2)n[nH]1)N1CCN2CCC[C@H]2C1	ZINC000179343151	402585692	/nfs/dbraw/zinc/58/56/92/402585692.db2.gz	MRXGIAULJGYFHY-AWEZNQCLSA-N	0	3	302.422	2.378	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(CCn2c(C)csc2=O)C1	ZINC000171613568	402601342	/nfs/dbraw/zinc/60/13/42/402601342.db2.gz	WZZJNPNODZYXAM-CQSZACIVSA-N	0	3	320.462	2.314	10	0		DEAEHN
C[C@H](C(=O)Nc1ccccc1Cl)N1CCN2CCC[C@@H]2C1	ZINC000171639461	402604384	/nfs/dbraw/zinc/60/43/84/402604384.db2.gz	WOLGXHRZCUUYCE-CHWSQXEVSA-N	0	3	307.825	2.447	10	0		DEAEHN
FC(F)Oc1cccc(CNC[C@@H]2CN(C3CC3)CCO2)c1	ZINC000171646145	402605787	/nfs/dbraw/zinc/60/57/87/402605787.db2.gz	XRNLYGVKPYVETB-OAHLLOKOSA-N	0	3	312.360	2.241	10	0		DEAEHN
c1cn2c(cccc2CN2CCCC[C@@H]2CN2CCOCC2)n1	ZINC000180027469	402605754	/nfs/dbraw/zinc/60/57/54/402605754.db2.gz	TYJLFNNLFGSMPF-MRXNPFEDSA-N	0	3	314.433	2.021	10	0		DEAEHN
COc1c(C)cc(CN2C[C@@H](C)[C@H](N3CCOCC3)C2)cc1C	ZINC000180228234	402610199	/nfs/dbraw/zinc/61/01/99/402610199.db2.gz	ZJXIYKOOPIHHDE-SJLPKXTDSA-N	0	3	318.461	2.465	10	0		DEAEHN
CC[C@H](C)OCC(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190620864	402614223	/nfs/dbraw/zinc/61/42/23/402614223.db2.gz	DRBKPWKLSLFEEB-DOTOQJQBSA-N	0	3	319.449	2.177	10	0		DEAEHN
C[C@@H](NC[C@H](O)CN1CCCC1=O)c1cc2ccccc2o1	ZINC000180442665	402616764	/nfs/dbraw/zinc/61/67/64/402616764.db2.gz	BIBQOXROYDEVGC-OCCSQVGLSA-N	0	3	302.374	2.067	10	0		DEAEHN
CN1CCO[C@@H](CN[C@@H]2CCCOc3c(Cl)cccc32)C1	ZINC000180492388	402618166	/nfs/dbraw/zinc/61/81/66/402618166.db2.gz	YXKDMAKHPKXQCT-SWLSCSKDSA-N	0	3	310.825	2.474	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)NCCN1CCCC[C@H]1C	ZINC000249281923	402625246	/nfs/dbraw/zinc/62/52/46/402625246.db2.gz	NUGAGYZWHXFKDV-ZIAGYGMSSA-N	0	3	320.437	2.325	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)[C@H](Cc2ccccc2)N(C)C)C1	ZINC000247877051	402577596	/nfs/dbraw/zinc/57/75/96/402577596.db2.gz	YUCFDCOSKSMKLR-AEFFLSMTSA-N	0	3	317.477	2.007	10	0		DEAEHN
Cc1ccc(OCCCNC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000171906300	402632486	/nfs/dbraw/zinc/63/24/86/402632486.db2.gz	WHPMQQMHMJPPIU-MRXNPFEDSA-N	0	3	317.433	2.254	10	0		DEAEHN
CC(C)C(=O)N1CCC(NC(=O)[C@@H](C)N2[C@H](C)CC[C@@H]2C)CC1	ZINC000249897103	402643060	/nfs/dbraw/zinc/64/30/60/402643060.db2.gz	RXWXCNNJTIAULX-QLFBSQMISA-N	0	3	323.481	2.011	10	0		DEAEHN
C[C@@H]1CC(O)C[C@@H](C)N1C[C@H](O)COc1ccccc1Cl	ZINC000191172423	402648168	/nfs/dbraw/zinc/64/81/68/402648168.db2.gz	PGOWTFVMUSSSET-BZPMIXESSA-N	0	3	313.825	2.313	10	0		DEAEHN
CCOc1ccc(OC[C@H](O)CN2CC[C@@H](C)[C@H](OC)C2)cc1	ZINC000251679344	402648893	/nfs/dbraw/zinc/64/88/93/402648893.db2.gz	IWNRRURPFYVKFZ-IIDMSEBBSA-N	0	3	323.433	2.182	10	0		DEAEHN
C[C@@H](C(=O)NC1CCC(C)CC1)N1CCCN(C2CC2)CC1	ZINC000172345811	402651660	/nfs/dbraw/zinc/65/16/60/402651660.db2.gz	LNASCMMEUNCEDM-PCKAHOCUSA-N	0	3	307.482	2.240	10	0		DEAEHN
Oc1cccc(N2CCN(C[C@@H](O)C3CCCCC3)CC2)c1	ZINC000191270964	402656234	/nfs/dbraw/zinc/65/62/34/402656234.db2.gz	DYCFNPFEJCXOHP-GOSISDBHSA-N	0	3	304.434	2.455	10	0		DEAEHN
C[C@@H](NC(=O)N1CCN(CC2CCOCC2)CC1)C1CCCC1	ZINC000172466737	402657632	/nfs/dbraw/zinc/65/76/32/402657632.db2.gz	JPEJGUOMANVWIA-OAHLLOKOSA-N	0	3	323.481	2.319	10	0		DEAEHN
COCCN1CCC(N[C@@H](C)c2nc(C(C)(C)C)no2)CC1	ZINC000173639875	402705893	/nfs/dbraw/zinc/70/58/93/402705893.db2.gz	ZOXJRYSRWNRKPW-LBPRGKRZSA-N	0	3	310.442	2.129	10	0		DEAEHN
CN(C)CCN1CCC(NC(=O)NC2CCC(C)(C)CC2)CC1	ZINC000173743571	402710650	/nfs/dbraw/zinc/71/06/50/402710650.db2.gz	FZLNMIJFIPXNMF-UHFFFAOYSA-N	0	3	324.513	2.280	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)Cc1ccccc1C	ZINC000173831247	402714666	/nfs/dbraw/zinc/71/46/66/402714666.db2.gz	ZOOGMQUBXBNMFJ-IAGOWNOFSA-N	0	3	322.474	2.383	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(C)cc1	ZINC000173830517	402714694	/nfs/dbraw/zinc/71/46/94/402714694.db2.gz	VPTUCRHYBXSBKM-HUUCEWRRSA-N	0	3	308.447	2.242	10	0		DEAEHN
C[C@H](CN[C@H]1CCCOc2cc(F)ccc21)N1CCOCC1	ZINC000181929854	402661320	/nfs/dbraw/zinc/66/13/20/402661320.db2.gz	HHRSXRMVUMYOTK-CJNGLKHVSA-N	0	3	308.397	2.350	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccc([S@](C)=O)cc1	ZINC000253550080	402668786	/nfs/dbraw/zinc/66/87/86/402668786.db2.gz	YNBUQIWYNUDOIW-GTQRCTGISA-N	0	3	320.458	2.123	10	0		DEAEHN
C[C@@H]1C[C@H](NCC2(C)OCCCO2)CN1Cc1ccccc1	ZINC000192248581	402719280	/nfs/dbraw/zinc/71/92/80/402719280.db2.gz	WHJMHXQRLZMGNJ-WBVHZDCISA-N	0	3	304.434	2.392	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)NCCc2ccsc2)C1	ZINC000182349986	402683094	/nfs/dbraw/zinc/68/30/94/402683094.db2.gz	FHUUSOOKMDZRLZ-HUUCEWRRSA-N	0	3	307.463	2.416	10	0		DEAEHN
Cc1ccccc1[C@H](C)NCC(=O)NCC(=O)OC(C)(C)C	ZINC000182389543	402685278	/nfs/dbraw/zinc/68/52/78/402685278.db2.gz	IPOQTFURJAUYHM-ZDUSSCGKSA-N	0	3	306.406	2.104	10	0		DEAEHN
Cc1csc([C@@H]2CCCN(C(=O)NC3CCN(C)CC3)C2)n1	ZINC000173389859	402695708	/nfs/dbraw/zinc/69/57/08/402695708.db2.gz	AFMBUQWXFQDPIT-CYBMUJFWSA-N	0	3	322.478	2.435	10	0		DEAEHN
Fc1ccc(SCCN2CC[C@@H](N3CCOCC3)C2)cc1	ZINC000173938483	402720800	/nfs/dbraw/zinc/72/08/00/402720800.db2.gz	IWKMJUZSTMHXAU-OAHLLOKOSA-N	0	3	310.438	2.324	10	0		DEAEHN
CC(C)[C@@H](C(=O)N1CCO[C@@H](CN(C)C)C1)c1ccccc1	ZINC000173522209	402701449	/nfs/dbraw/zinc/70/14/49/402701449.db2.gz	YLJWCLAGVLEHFV-DLBZAZTESA-N	0	3	304.434	2.215	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)N1CCc2ccccc21	ZINC000262392323	402725535	/nfs/dbraw/zinc/72/55/35/402725535.db2.gz	BKNFUKHTKYLXRP-DDUZABMNSA-N	0	3	300.402	2.108	10	0		DEAEHN
COc1ccc(NC(=O)[C@H](C)N[C@H](C)[C@@H]2CCCO2)c(OC)c1	ZINC000183134323	402742010	/nfs/dbraw/zinc/74/20/10/402742010.db2.gz	LTOUPDPTJYLVFW-XUJVJEKNSA-N	0	3	322.405	2.188	10	0		DEAEHN
Cc1ccccc1C(C)(C)c1nc([C@H]2CNCCN2C)no1	ZINC000263135182	402745020	/nfs/dbraw/zinc/74/50/20/402745020.db2.gz	BZPDGUKMUJDZIN-CQSZACIVSA-N	0	3	300.406	2.280	10	0		DEAEHN
CN(C)C(=O)CC(=O)Nc1cccc(CN2CCCCC2)c1	ZINC000174608158	402748334	/nfs/dbraw/zinc/74/83/34/402748334.db2.gz	LHFOBIRKLQEVRG-UHFFFAOYSA-N	0	3	303.406	2.089	10	0		DEAEHN
Cc1c(Cl)cccc1OCc1nc([C@@H]2CNCCN2C)no1	ZINC000263277623	402753150	/nfs/dbraw/zinc/75/31/50/402753150.db2.gz	TVTXLJDRXMFXML-LBPRGKRZSA-N	0	3	322.796	2.187	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)[C@@H]1CCCCN1Cc1ccccc1	ZINC000174832278	402759460	/nfs/dbraw/zinc/75/94/60/402759460.db2.gz	VEHLDXMZZLXKQQ-ROUUACIJSA-N	0	3	315.461	2.252	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cccc(N(C)C(C)=O)c2)C1	ZINC000174949057	402765614	/nfs/dbraw/zinc/76/56/14/402765614.db2.gz	SKKGZFDQBMCPML-OAHLLOKOSA-N	0	3	318.421	2.275	10	0		DEAEHN
CN(C)CCN(Cc1ccccn1)C(=O)NCC1(C)CCC1	ZINC000175000491	402770234	/nfs/dbraw/zinc/77/02/34/402770234.db2.gz	LKGOVVNZDNUPRK-UHFFFAOYSA-N	0	3	304.438	2.345	10	0		DEAEHN
CCc1nc2n(n1)C[C@H](NCc1ccc(C)c(OC)c1)CC2	ZINC000194298446	402791121	/nfs/dbraw/zinc/79/11/21/402791121.db2.gz	OAPDLAOHTCZZPV-CQSZACIVSA-N	0	3	300.406	2.262	10	0		DEAEHN
C[C@H](CNC(=O)[C@H]1CCOC[C@H]1C)N(C)Cc1ccccc1	ZINC000194334883	402792644	/nfs/dbraw/zinc/79/26/44/402792644.db2.gz	NNNQZNNCKYBYAK-INMHGKMJSA-N	0	3	304.434	2.296	10	0		DEAEHN
COC[C@H](NC(=O)NCCN1CCCC[C@H]1C)c1ccco1	ZINC000175278181	402793199	/nfs/dbraw/zinc/79/31/99/402793199.db2.gz	DKFCWCHDWDFUAN-KGLIPLIRSA-N	0	3	309.410	2.141	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)NCc1cccc(Cl)c1	ZINC000175357353	402799556	/nfs/dbraw/zinc/79/95/56/402799556.db2.gz	FCXHLCMVOCOSMM-INIZCTEOSA-N	0	3	323.868	2.372	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](COC)c2ccc(C)o2)C1	ZINC000175361561	402800270	/nfs/dbraw/zinc/80/02/70/402800270.db2.gz	GRMUDMKGIXDGEZ-KBPBESRZSA-N	0	3	309.410	2.059	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)S(=O)(=O)c1ccc(C)c(C)c1	ZINC000175398194	402803335	/nfs/dbraw/zinc/80/33/35/402803335.db2.gz	UXOITHIRKPWOQK-HNNXBMFYSA-N	0	3	310.463	2.408	10	0		DEAEHN
Cc1cnn([C@@H]2CCCN(C(=O)C3CCN(C4CC4)CC3)C2)c1	ZINC000194580673	402803697	/nfs/dbraw/zinc/80/36/97/402803697.db2.gz	JEROVTMFZWEPSX-QGZVFWFLSA-N	0	3	316.449	2.229	10	0		DEAEHN
Cc1cnn([C@H]2CCCN(C(=O)C3CCN(C4CC4)CC3)C2)c1	ZINC000194580687	402803888	/nfs/dbraw/zinc/80/38/88/402803888.db2.gz	JEROVTMFZWEPSX-KRWDZBQOSA-N	0	3	316.449	2.229	10	0		DEAEHN
CN1CCN([C@H]2CCCCN(C(=O)CCC3CCC3)C2)CC1	ZINC000175407127	402804221	/nfs/dbraw/zinc/80/42/21/402804221.db2.gz	LHAGNSSOWBTZBC-KRWDZBQOSA-N	0	3	307.482	2.195	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)NCCN1CCC(C)CC1	ZINC000175473594	402809656	/nfs/dbraw/zinc/80/96/56/402809656.db2.gz	VMWFBHYQOXNJHJ-UHFFFAOYSA-N	0	3	321.469	2.070	10	0		DEAEHN
C[C@H](NC(=O)CN1CCCN(C2CC2)CC1)c1cccs1	ZINC000195341075	402843024	/nfs/dbraw/zinc/84/30/24/402843024.db2.gz	CCDZOQKJLMHSAH-ZDUSSCGKSA-N	0	3	307.463	2.095	10	0		DEAEHN
CC1=NN(c2ccc(C(=O)NC[C@@H]3CCCN3C)cc2)CC1	ZINC000194700028	402811259	/nfs/dbraw/zinc/81/12/59/402811259.db2.gz	OUYSRULKKGRVEP-INIZCTEOSA-N	0	3	300.406	2.097	10	0		DEAEHN
COC(=O)c1coc(C(=O)Nc2cccc(CN(C)C)c2)c1	ZINC000184006982	402811559	/nfs/dbraw/zinc/81/15/59/402811559.db2.gz	AGMCONVOBADMDI-UHFFFAOYSA-N	0	3	302.330	2.380	10	0		DEAEHN
Cc1cc([N-]C(=O)[C@H](C)N2CCC(C[NH+]3CCCC3)CC2)on1	ZINC000194733147	402813095	/nfs/dbraw/zinc/81/30/95/402813095.db2.gz	JDAKTQPHAKQHTC-AWEZNQCLSA-N	0	3	320.437	2.118	10	0		DEAEHN
COC(=O)C[C@H]1CCCN1Cc1ccc2c(c1)sc(=O)n2C	ZINC000195031461	402828224	/nfs/dbraw/zinc/82/82/24/402828224.db2.gz	CUBMUXICCZFZOI-GFCCVEGCSA-N	0	3	320.414	2.128	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2ccc(F)cc2C)C1	ZINC000175944777	402844028	/nfs/dbraw/zinc/84/40/28/402844028.db2.gz	VQFXQJKPESXEFH-MRXNPFEDSA-N	0	3	307.413	2.460	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)CCCOc1ccc(F)cc1F	ZINC000195316907	402841535	/nfs/dbraw/zinc/84/15/35/402841535.db2.gz	CJEOGPAKOCHPDN-ZDUSSCGKSA-N	0	3	312.360	2.334	10	0		DEAEHN
COCCCN(C)CCNC(=O)Nc1cccc([C@@H](C)OC)c1	ZINC000175957183	402844938	/nfs/dbraw/zinc/84/49/38/402844938.db2.gz	JVNMZAVDVXKTLE-CQSZACIVSA-N	0	3	323.437	2.484	10	0		DEAEHN
Cn1nccc1C1CCN(C[C@@H](O)c2ccc(F)cc2)CC1	ZINC000195501927	402847620	/nfs/dbraw/zinc/84/76/20/402847620.db2.gz	GWBCFELSNKBONL-QGZVFWFLSA-N	0	3	303.381	2.472	10	0		DEAEHN
CC(=O)c1ccc(CC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000265947328	402964355	/nfs/dbraw/zinc/96/43/55/402964355.db2.gz	KBUNWJKECHIQAZ-GUYCJALGSA-N	0	3	302.418	2.373	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCc2cn3ccsc3n2)CCN1C	ZINC000266637206	402980205	/nfs/dbraw/zinc/98/02/05/402980205.db2.gz	BCUGGPVKFSIDJC-DGCLKSJQSA-N	0	3	321.450	2.020	10	0		DEAEHN
CCN(CCOCCO)Cc1ccc(Br)c(F)c1	ZINC000282195526	403131019	/nfs/dbraw/zinc/13/10/19/403131019.db2.gz	WUHXXTBCOWQQAG-UHFFFAOYSA-N	0	3	320.202	2.419	10	0		DEAEHN
Cc1nc2cccc(C(=O)N(C)[C@H]3CCN(C)[C@@H](C)C3)c2[nH]1	ZINC000283824723	403226494	/nfs/dbraw/zinc/22/64/94/403226494.db2.gz	FMVHJQXYOAHWLN-AAEUAGOBSA-N	0	3	300.406	2.426	10	0		DEAEHN
C/C(=C\c1ccccc1)CN1CCC[C@H](CS(N)(=O)=O)C1	ZINC000271179213	403274243	/nfs/dbraw/zinc/27/42/43/403274243.db2.gz	LKQVYULHEWPTTQ-DKGMDFAASA-N	0	3	308.447	2.090	10	0		DEAEHN
CCN1CC[C@@H]2OCCN(Cc3ncc(Cl)s3)[C@H]2C1	ZINC000339391773	403380215	/nfs/dbraw/zinc/38/02/15/403380215.db2.gz	IHHNZGXTTMKYOS-QWRGUYRKSA-N	0	3	301.843	2.092	10	0		DEAEHN
c1c(CNCCCN2CCc3ccccc32)nc2ncccn12	ZINC000298455163	403386173	/nfs/dbraw/zinc/38/61/73/403386173.db2.gz	OCWAMDOYCHSDMF-UHFFFAOYSA-N	0	3	307.401	2.272	10	0		DEAEHN
Cn1cc(CN[C@H]2CCO[C@@H]2c2nccn2-c2ccccc2)cn1	ZINC000343383203	403562395	/nfs/dbraw/zinc/56/23/95/403562395.db2.gz	HICKCAPHAGIPNA-IRXDYDNUSA-N	0	3	323.400	2.226	10	0		DEAEHN
C[C@@H]1OCC[C@]1(C)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000332880133	403630459	/nfs/dbraw/zinc/63/04/59/403630459.db2.gz	VFTQUMIORGKXPW-SCNOPHJPSA-N	0	3	317.433	2.299	10	0		DEAEHN
C/C(=C\c1ccc(F)cc1)C(=O)NC[C@@H]1CN2CCC[C@H]2CO1	ZINC000363360313	404155356	/nfs/dbraw/zinc/15/53/56/404155356.db2.gz	GEUSPMWENQKBSN-DKTLHIEFSA-N	0	3	318.392	2.208	10	0		DEAEHN
CN(C(=O)c1cc2ccccc2[nH]c1=O)[C@H]1CN2CCC1CC2	ZINC000329442964	404338941	/nfs/dbraw/zinc/33/89/41/404338941.db2.gz	KMYVYXAKENRXPU-INIZCTEOSA-N	0	3	311.385	2.107	10	0		DEAEHN
CC(C)[C@@H](C(=O)N1CCC[C@@H](c2nnc[n-]2)C1)[NH+]1CCCCC1	ZINC000364090271	404316762	/nfs/dbraw/zinc/31/67/62/404316762.db2.gz	QXGRTPPQLAWZIW-CABCVRRESA-N	0	3	319.453	2.021	10	0		DEAEHN
Cc1nn(C)c2cc(NC(=O)N3CCN4CCC[C@@H]4C3)ccc12	ZINC000291891431	404568466	/nfs/dbraw/zinc/56/84/66/404568466.db2.gz	WJUIVGPUPDHOPO-CQSZACIVSA-N	0	3	313.405	2.194	10	0		DEAEHN
CC(C)N1CCCN(C(=O)Nc2cn(C)nc2C2CC2)CC1	ZINC000291989403	404615124	/nfs/dbraw/zinc/61/51/24/404615124.db2.gz	GOXKSIZVVDGWTN-UHFFFAOYSA-N	0	3	305.426	2.246	10	0		DEAEHN
Cc1nccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)n1	ZINC000374034370	404673932	/nfs/dbraw/zinc/67/39/32/404673932.db2.gz	HDPIFWWHCTVEKW-OAHLLOKOSA-N	0	3	310.401	2.270	10	0		DEAEHN
Cc1scc(C(=O)N2CCN([C@H]3CCCN(C)C3)CC2)c1C	ZINC000367372077	405028797	/nfs/dbraw/zinc/02/87/97/405028797.db2.gz	PJZIRDGBKHSSKR-HNNXBMFYSA-N	0	3	321.490	2.217	10	0		DEAEHN
Cc1cc(C(=O)NC2CCN(C[C@@H](O)C(C)C)CC2)c(C)o1	ZINC000367382836	405033115	/nfs/dbraw/zinc/03/31/15/405033115.db2.gz	ZSDWBIFZSNUAAX-MRXNPFEDSA-N	0	3	308.422	2.108	10	0		DEAEHN
C/C=C\CNC[C@@H](O)COc1cccc(Br)c1	ZINC000385061324	405033987	/nfs/dbraw/zinc/03/39/87/405033987.db2.gz	UUUWVNDJSZSAHF-ZZKXABKFSA-N	0	3	300.196	2.355	10	0		DEAEHN
C/C=C/CNC[C@@H](O)COc1cccc(Br)c1	ZINC000385061323	405034251	/nfs/dbraw/zinc/03/42/51/405034251.db2.gz	UUUWVNDJSZSAHF-QAVQXKDTSA-N	0	3	300.196	2.355	10	0		DEAEHN
C[C@@H]1CCOCCN1C(=O)NC[C@H](c1ccccc1)N(C)C	ZINC000378496469	404982441	/nfs/dbraw/zinc/98/24/41/404982441.db2.gz	KATPIPGZXMTNAP-GDBMZVCRSA-N	0	3	305.422	2.110	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN1CCC(CCc2ccc(O)cc2)CC1	ZINC000568355531	292332977	/nfs/dbraw/zinc/33/29/77/292332977.db2.gz	FAAJKYVDHFVPDB-SFHVURJKSA-N	0	3	305.418	2.377	10	0		DEAEHN
C[C@@H]1CCOCCN1C[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000367460164	405056495	/nfs/dbraw/zinc/05/64/95/405056495.db2.gz	YYGYOZSLWUJJDX-IEBWSBKVSA-N	0	3	318.461	2.388	10	0		DEAEHN
COCCCN(C)CCNC(=O)C[C@H]1CCOc2ccccc21	ZINC000152437937	292334217	/nfs/dbraw/zinc/33/42/17/292334217.db2.gz	LWGHWKUKHUZVTP-OAHLLOKOSA-N	0	3	320.433	2.027	10	0		DEAEHN
C[C@H]1CC(CCN2CCC[C@H]2CS(N)(=O)=O)C[C@H](C)C1	ZINC000408245657	405151489	/nfs/dbraw/zinc/15/14/89/405151489.db2.gz	HURSBFPHAIJYDK-NFAWXSAZSA-N	0	3	302.484	2.202	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N[C@H]2C[C@@H](N(C)C)C2(C)C)c1C	ZINC000636087321	405728308	/nfs/dbraw/zinc/72/83/08/405728308.db2.gz	OUQKKFDCRJPTBA-QWHCGFSZSA-N	0	3	305.422	2.293	10	0		DEAEHN
CN1C(=O)C[C@@H](NCc2ccc3c[nH]nc3c2)[C@@H]1c1cccnc1	ZINC000583616566	405775224	/nfs/dbraw/zinc/77/52/24/405775224.db2.gz	LAQOMLOGEGPGKB-AEFFLSMTSA-N	0	3	321.384	2.020	10	0		DEAEHN
CCc1ccc2nccc(N3CCN(CC(=O)OC)CC3)c2c1	ZINC000450243911	405797746	/nfs/dbraw/zinc/79/77/46/405797746.db2.gz	OOZUVCBFFPVTQX-UHFFFAOYSA-N	0	3	313.401	2.092	10	0		DEAEHN
CCn1nncc1CN1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000459334098	405858854	/nfs/dbraw/zinc/85/88/54/405858854.db2.gz	DFCCCLWNTCAFCV-INIZCTEOSA-N	0	3	313.449	2.394	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)c1	ZINC000457590301	405910074	/nfs/dbraw/zinc/91/00/74/405910074.db2.gz	FFRVYNLOPLTGMR-CZUORRHYSA-N	0	3	318.417	2.194	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)N[C@@H]3CN(C4CC4)C[C@@H]3C)cc2)c1	ZINC000531567232	405980183	/nfs/dbraw/zinc/98/01/83/405980183.db2.gz	GPVLITRMSGIJIK-KBXCAEBGSA-N	0	3	324.428	2.393	10	0		DEAEHN
CC(=O)C(C)(C)CCC(=O)Nc1cnn(C2CCN(C)CC2)c1	ZINC000634093756	406001942	/nfs/dbraw/zinc/00/19/42/406001942.db2.gz	QPDGXYPIPFEZEY-UHFFFAOYSA-N	0	3	320.437	2.484	10	0		DEAEHN
Cc1cc(C[C@H](C)NC(=O)N2CCCN(C(C)(C)C)CC2)[nH]n1	ZINC000531771044	406005585	/nfs/dbraw/zinc/00/55/85/406005585.db2.gz	YJNBEFNIJIIAPJ-ZDUSSCGKSA-N	0	3	321.469	2.165	10	0		DEAEHN
CC1(C)CN(C[C@@H](O)Cc2ccccc2C(F)(F)F)C[C@H]1O	ZINC000562617999	406045525	/nfs/dbraw/zinc/04/55/25/406045525.db2.gz	ZDHOZNHVDSFHAP-GXTWGEPZSA-N	0	3	317.351	2.312	10	0		DEAEHN
c1nc2n(n1)[C@@H](CN1CCC[C@@]3(C1)OCc1ccccc13)CC2	ZINC000639593873	406160097	/nfs/dbraw/zinc/16/00/97/406160097.db2.gz	WVJJUTRSYLLYHS-QAPCUYQASA-N	0	3	310.401	2.287	10	0		DEAEHN
CC1(C)CN(C[C@H](O)COC[C@H]2CCCO2)Cc2ccccc21	ZINC000534668167	406192141	/nfs/dbraw/zinc/19/21/41/406192141.db2.gz	MLTDSDIZVCZMCX-DLBZAZTESA-N	0	3	319.445	2.336	10	0		DEAEHN
CN1CCC[C@@H]1CNC(=O)c1ccc(F)cc1OC(F)F	ZINC000487623706	406251971	/nfs/dbraw/zinc/25/19/71/406251971.db2.gz	SASNLWAHOPEFOJ-SNVBAGLBSA-N	0	3	302.296	2.251	10	0		DEAEHN
C[C@@]1(F)CNCCN(Cc2nc3cc(Cl)ccc3c(=O)[nH]2)C1	ZINC000569003103	292383507	/nfs/dbraw/zinc/38/35/07/292383507.db2.gz	QGYYCAJAMASQDQ-OAHLLOKOSA-N	0	3	324.787	2.122	10	0		DEAEHN
C[C@H](c1ccc(F)cc1)N(C)C(=O)CN1CC[C@H](CO)[C@H]1C	ZINC000488808745	406350407	/nfs/dbraw/zinc/35/04/07/406350407.db2.gz	ROLSYBNTZPGCBF-UMVBOHGHSA-N	0	3	308.397	2.048	10	0		DEAEHN
CS[C@@H]1CCC[C@@H](NC(=O)N2CC[C@@H](N3CC=CC3)C2)C1	ZINC000245591604	286693316	/nfs/dbraw/zinc/69/33/16/286693316.db2.gz	BCOJUQCAVQUJSD-RBSFLKMASA-N	0	3	309.479	2.316	10	0		DEAEHN
C(N[C@@H]1CCC[C@H]([C@H]2CCOC2)C1)c1nnc2n1CCCC2	ZINC000547397040	406406404	/nfs/dbraw/zinc/40/64/04/406406404.db2.gz	CLANFBNGDVIXST-SOUVJXGZSA-N	0	3	304.438	2.299	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N[C@H]1C[C@H]1c1ccccc1	ZINC000637911159	406473830	/nfs/dbraw/zinc/47/38/30/406473830.db2.gz	YFWLJJQCMMNAQM-FHWLQOOXSA-N	0	3	323.440	2.118	10	0		DEAEHN
COC[C@]1(C(=O)NCCc2ccc(Cl)s2)CCCCN1	ZINC000637935362	406485295	/nfs/dbraw/zinc/48/52/95/406485295.db2.gz	GWLUXSHTSBIISO-AWEZNQCLSA-N	0	3	316.854	2.219	10	0		DEAEHN
COc1ccc(NC(=O)[C@@H](N)CN(C)Cc2ccccc2)cc1	ZINC000637868712	406454916	/nfs/dbraw/zinc/45/49/16/406454916.db2.gz	ITOWFDPXXUDKLE-KRWDZBQOSA-N	0	3	313.401	2.093	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)N1C[C@@H](C)N(C)C[C@H]1C)CC2	ZINC000526010069	406532581	/nfs/dbraw/zinc/53/25/81/406532581.db2.gz	NFFYGVBIAGLKDH-MGPQQGTHSA-N	0	3	318.465	2.189	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N1C[C@@H](C)N(C)C[C@H]1C)C2	ZINC000526010069	406532583	/nfs/dbraw/zinc/53/25/83/406532583.db2.gz	NFFYGVBIAGLKDH-MGPQQGTHSA-N	0	3	318.465	2.189	10	0		DEAEHN
c1[nH]nc2cc(CNCc3ccnc(N4CCOCC4)c3)ccc12	ZINC000551005287	406609366	/nfs/dbraw/zinc/60/93/66/406609366.db2.gz	GRSGHLWIMHMBDB-UHFFFAOYSA-N	0	3	323.400	2.084	10	0		DEAEHN
c1nc(CN2CCC[C@H]([C@H]3CCOC3)C2)cc2c1OCCO2	ZINC000638182205	406611526	/nfs/dbraw/zinc/61/15/26/406611526.db2.gz	RFENCKGYHPQVIF-KBPBESRZSA-N	0	3	304.390	2.101	10	0		DEAEHN
C[C@@H](CNC(=O)NCCOCC1CCC1)N1CCC[C@@H](C)C1	ZINC000572452904	406670560	/nfs/dbraw/zinc/67/05/60/406670560.db2.gz	FUZFGYAGPKVLBT-CABCVRRESA-N	0	3	311.470	2.223	10	0		DEAEHN
c1csc([C@H](CNCc2ccns2)N2CCOCC2)c1	ZINC000638292743	406677484	/nfs/dbraw/zinc/67/74/84/406677484.db2.gz	ILONFXMTXCNMNX-ZDUSSCGKSA-N	0	3	309.460	2.368	10	0		DEAEHN
NC[C@H](NC(=O)c1csc(C(F)(F)F)c1)C(F)(F)F	ZINC000638396255	406747829	/nfs/dbraw/zinc/74/78/29/406747829.db2.gz	AKJMWJSEKRVOGG-YFKPBYRVSA-N	0	3	306.231	2.386	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000246532676	287219074	/nfs/dbraw/zinc/21/90/74/287219074.db2.gz	IXMPLQNRYLZPJO-PFUJJPPESA-N	0	3	318.461	2.467	10	0		DEAEHN
COc1ccc(Oc2ncc(CN)cn2)c(Br)c1	ZINC000129609006	196061765	/nfs/dbraw/zinc/06/17/65/196061765.db2.gz	SNZRCBWGEDYSDQ-UHFFFAOYSA-N	0	3	310.151	2.499	10	0		DEAEHN
CCS(=O)(=O)CCC[C@@H](NC)c1ccc(OC)cc1F	ZINC000131013045	196131553	/nfs/dbraw/zinc/13/15/53/196131553.db2.gz	KMMIDEMVCLXUFD-CQSZACIVSA-N	0	3	303.399	2.310	10	0		DEAEHN
Brc1ccccc1Cc1ncc2c(n1)CCNC2	ZINC000131092363	196139810	/nfs/dbraw/zinc/13/98/10/196139810.db2.gz	QTNCMULCAGKRIG-UHFFFAOYSA-N	0	3	304.191	2.476	10	0		DEAEHN
C[C@H](CN1CCOCC1)NC1=NCC2(CCCCC2)CS1	ZINC000131121112	196141919	/nfs/dbraw/zinc/14/19/19/196141919.db2.gz	UAIGGJDLUWTKIS-CQSZACIVSA-N	0	3	311.495	2.350	10	0		DEAEHN
CNCc1ccc(C)c(S(=O)(=O)NCCCC(F)(F)F)c1	ZINC000131215497	196150515	/nfs/dbraw/zinc/15/05/15/196150515.db2.gz	GWQJZRQWRGWPLP-UHFFFAOYSA-N	0	3	324.368	2.335	10	0		DEAEHN
CCO[C@H](C)CNS(=O)(=O)c1cccc([C@@H](CC)NC)c1	ZINC000131228213	196151286	/nfs/dbraw/zinc/15/12/86/196151286.db2.gz	BKWUTQTWKNTELO-IUODEOHRSA-N	0	3	314.451	2.060	10	0		DEAEHN
CCN[C@@H](CCCS(C)(=O)=O)c1ccc(OC)cc1OC	ZINC000131233653	196152305	/nfs/dbraw/zinc/15/23/05/196152305.db2.gz	VALKDHWNXMPWTH-AWEZNQCLSA-N	0	3	315.435	2.179	10	0		DEAEHN
Cc1cccc(NC(=O)[C@]2(C)COC[C@H]2N)c1Br	ZINC000131436477	196168733	/nfs/dbraw/zinc/16/87/33/196168733.db2.gz	NTVYSTSVBMNVSR-ZWNOBZJWSA-N	0	3	313.195	2.060	10	0		DEAEHN
Cc1cccc(NC(=O)[C@@]2(C)COC[C@H]2N)c1Br	ZINC000131436709	196169395	/nfs/dbraw/zinc/16/93/95/196169395.db2.gz	NTVYSTSVBMNVSR-MFKMUULPSA-N	0	3	313.195	2.060	10	0		DEAEHN
CCCN[C@@H](Cc1cccc(F)c1F)[C@@H](C)S(C)(=O)=O	ZINC000131485613	196173743	/nfs/dbraw/zinc/17/37/43/196173743.db2.gz	JOQGTAAHTHTIHB-MFKMUULPSA-N	0	3	305.390	2.309	10	0		DEAEHN
Cc1cc(Br)c(N2CC[C@@H](N)C2=O)cc1Cl	ZINC000131883452	196207131	/nfs/dbraw/zinc/20/71/31/196207131.db2.gz	LBECRPVAFKQMEN-SECBINFHSA-N	0	3	303.587	2.475	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)NC[C@H]2CCCN2CC(C)C)cc1	ZINC000132564942	196266917	/nfs/dbraw/zinc/26/69/17/196266917.db2.gz	GYLAIRMUGCDXPF-MRXNPFEDSA-N	0	3	317.433	2.170	10	0		DEAEHN
Cc1ccc([C@@H](CN)N[C@H](C)CCO)c(Br)c1	ZINC000132684461	196275756	/nfs/dbraw/zinc/27/57/56/196275756.db2.gz	QLAOUAJDTVLABQ-ZWNOBZJWSA-N	0	3	301.228	2.118	10	0		DEAEHN
C[C@@H](NCCn1c(=O)cccc1C(F)(F)F)[C@H]1CCCO1	ZINC000132827375	196287688	/nfs/dbraw/zinc/28/76/88/196287688.db2.gz	WDGGJKOBRVVWGR-GHMZBOCLSA-N	0	3	304.312	2.024	10	0		DEAEHN
COC(=O)c1ccc(Cl)cc1N[C@@H](C)C[C@H]1COCCN1	ZINC000133568941	196331247	/nfs/dbraw/zinc/33/12/47/196331247.db2.gz	QGEOEQBCVIYAOL-JQWIXIFHSA-N	0	3	312.797	2.306	10	0		DEAEHN
CC(=O)NC1CCN([C@H](c2ccc(Cl)s2)[C@@H](C)N)CC1	ZINC000133741383	196333326	/nfs/dbraw/zinc/33/33/26/196333326.db2.gz	GRCLYWMNXIZZMV-OTYXRUKQSA-N	0	3	315.870	2.390	10	0		DEAEHN
C(c1nn2c(nnc2C2CCCC2)s1)[C@H]1CSCCN1	ZINC000133980403	196350960	/nfs/dbraw/zinc/35/09/60/196350960.db2.gz	QJEXIZUBXBKWFQ-JTQLQIEISA-N	0	3	309.464	2.091	10	0		DEAEHN
COCCN(C)CCCNC(=O)c1c[nH]c2cc(F)ccc12	ZINC000192890757	225145880	/nfs/dbraw/zinc/14/58/80/225145880.db2.gz	IJMYWUXGKOUBCF-UHFFFAOYSA-N	0	3	307.369	2.005	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCCC[C@@H](c2cc(N)n[nH]2)C1	ZINC000616631188	422516694	/nfs/dbraw/zinc/51/66/94/422516694.db2.gz	YEJZVTWFVLNTJD-GFCCVEGCSA-N	0	3	323.441	2.086	10	0		DEAEHN
CC(C)(N)c1cn(Cc2csc(Br)c2)nn1	ZINC000069679957	424842134	/nfs/dbraw/zinc/84/21/34/424842134.db2.gz	NKUHWDKCSBAQJF-UHFFFAOYSA-N	0	3	301.213	2.344	10	0		DEAEHN
CCCc1cc(NCCN2CCCC[C@@H]2C)n2ncnc2n1	ZINC000194269950	424874581	/nfs/dbraw/zinc/87/45/81/424874581.db2.gz	HDSKGJFJBGRNMW-ZDUSSCGKSA-N	0	3	302.426	2.363	10	0		DEAEHN
CCC1CCC(NC(=O)NC[C@@H](O)CN2CCCCC2)CC1	ZINC000194452184	424875947	/nfs/dbraw/zinc/87/59/47/424875947.db2.gz	ZLOUTBUOZYXXQV-UYSNPLJNSA-N	0	3	311.470	2.101	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)CCCOc2ccc(OC)cc2)C1	ZINC000194630200	424878032	/nfs/dbraw/zinc/87/80/32/424878032.db2.gz	PNIYFGDIBBHIJT-OAHLLOKOSA-N	0	3	320.433	2.455	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)CCc2nnc(C3CCCC3)o2)C1	ZINC000155674987	424862227	/nfs/dbraw/zinc/86/22/27/424862227.db2.gz	YFSZVXFDZKZHPG-CQSZACIVSA-N	0	3	320.437	2.260	10	0		DEAEHN
CCc1ccc([C@@H](C)N[C@@H](C)C(=O)N2CCN(CC)CC2)cc1	ZINC000192661987	424864523	/nfs/dbraw/zinc/86/45/23/424864523.db2.gz	DHFOZTCVDDHQHJ-CVEARBPZSA-N	0	3	317.477	2.452	10	0		DEAEHN
CN(Cc1ccc(Br)cn1)[C@H]1CN2CCC1CC2	ZINC000385747452	424911925	/nfs/dbraw/zinc/91/19/25/424911925.db2.gz	RATZREKJFGVDBZ-AWEZNQCLSA-N	0	3	310.239	2.370	10	0		DEAEHN
O[C@]1(CCNCc2cc(F)cc(Br)c2)CCOC1	ZINC000404147983	424925219	/nfs/dbraw/zinc/92/52/19/424925219.db2.gz	NAKLKTXQHWLGTF-CYBMUJFWSA-N	0	3	318.186	2.219	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc(C)c(OC)c2)CCN1C[C@H](C)O	ZINC000248998756	424886764	/nfs/dbraw/zinc/88/67/64/424886764.db2.gz	PUPBXGWBNMQRMM-DOTOQJQBSA-N	0	3	306.450	2.281	10	0		DEAEHN
CN1CC[C@@H](CNc2ccnc(C3CC3)n2)[C@@H]1c1cccnc1	ZINC000328640950	424901868	/nfs/dbraw/zinc/90/18/68/424901868.db2.gz	XRHXYKOUFWAQSO-RDJZCZTQSA-N	0	3	309.417	2.854	10	0		DEAEHN
CC(C)NC(=O)CCN(CCc1ccccc1)[C@H]1CCOC1	ZINC000084134024	267382543	/nfs/dbraw/zinc/38/25/43/267382543.db2.gz	ADWRIKNOLCRDQE-KRWDZBQOSA-N	0	3	304.434	2.235	10	0		DEAEHN
COc1ccc(CNC2CC(CO)C2)c(Br)c1	ZINC000657810532	425403739	/nfs/dbraw/zinc/40/37/39/425403739.db2.gz	GANLIQWYRMLASQ-UHFFFAOYSA-N	0	3	300.196	2.318	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CC[C@H](Cc2ccncc2)C1	ZINC000363718805	269073669	/nfs/dbraw/zinc/07/36/69/269073669.db2.gz	NSOAAYXZBHRIRZ-IAGOWNOFSA-N	0	3	316.449	2.140	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)c2coc(Br)c2)CCN1C	ZINC000393539872	269100013	/nfs/dbraw/zinc/10/00/13/269100013.db2.gz	XJYQPCSLSRDAMQ-WCBMZHEXSA-N	0	3	301.184	2.255	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1nc2cccnc2s1	ZINC000193972262	276182375	/nfs/dbraw/zinc/18/23/75/276182375.db2.gz	LKOFNHNLFRLFQP-NSHDSACASA-N	0	3	304.419	2.248	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1cc(C(N)=O)ccc1C	ZINC000176330072	276376799	/nfs/dbraw/zinc/37/67/99/276376799.db2.gz	LQTUPCBYZAUAEW-AWEZNQCLSA-N	0	3	318.421	2.042	10	0		DEAEHN
CCc1nc2c(s1)[C@@H](N[C@H]1CCc3ncnn3C1)CCC2	ZINC000180608098	276691919	/nfs/dbraw/zinc/69/19/19/276691919.db2.gz	MLNNSEOPBJTGBV-QWRGUYRKSA-N	0	3	303.435	2.279	10	0		DEAEHN
CN1CCC(NC(=O)Nc2ncc(C(F)(F)F)s2)CC1	ZINC000276514059	277029977	/nfs/dbraw/zinc/02/99/77/277029977.db2.gz	JSGGOTNDIVIQMJ-UHFFFAOYSA-N	0	3	308.329	2.378	10	0		DEAEHN
CS(=O)(=O)N(CCN1CCCC12CCC2)Cc1ccccc1	ZINC000373102995	278108416	/nfs/dbraw/zinc/10/84/16/278108416.db2.gz	CQKLCABQTIHDBL-UHFFFAOYSA-N	0	3	322.474	2.467	10	0		DEAEHN
CC(=O)[C@](C)(O)CN1CCC[C@@H](CCC(=O)OC(C)(C)C)C1	ZINC000412059681	278238666	/nfs/dbraw/zinc/23/86/66/278238666.db2.gz	CWHAVBUSRAWIFF-WMLDXEAASA-N	0	3	313.438	2.160	10	0		DEAEHN
CC[C@@H](NC(=O)N1CCCN(C2CC2)CC1)c1ccncc1	ZINC000074470123	280172041	/nfs/dbraw/zinc/17/20/41/280172041.db2.gz	YLUOQSBIFJUHER-MRXNPFEDSA-N	0	3	302.422	2.412	10	0		DEAEHN
CC[C@@H]1CCCCCN1C(=O)NC1CCN(CCN(C)C)CC1	ZINC000119198604	280235698	/nfs/dbraw/zinc/23/56/98/280235698.db2.gz	VCLUFRJTKDKSID-QGZVFWFLSA-N	0	3	324.513	2.377	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cccc(C)c1	ZINC000173827342	288313020	/nfs/dbraw/zinc/31/30/20/288313020.db2.gz	SDFIIZGZZWAKPF-LSDHHAIUSA-N	0	3	308.447	2.242	10	0		DEAEHN
CN(C)CCNC(=O)NCc1csc(-c2ccccc2)n1	ZINC000133689422	282022543	/nfs/dbraw/zinc/02/25/43/282022543.db2.gz	MSQUCRNWRQDIGR-UHFFFAOYSA-N	0	3	304.419	2.171	10	0		DEAEHN
COc1ccccc1[C@H]1CNCCN1Cc1c(C)noc1C	ZINC000261734600	295412931	/nfs/dbraw/zinc/41/29/31/295412931.db2.gz	MGYFXGYXIOLUSG-MRXNPFEDSA-N	0	3	301.390	2.447	10	0		DEAEHN
C[C@H]1COCC[C@H]1C(=O)N(CCN(C)C)Cc1ccccc1	ZINC000193885162	300353318	/nfs/dbraw/zinc/35/33/18/300353318.db2.gz	ACYWAIRJYCDECL-DOTOQJQBSA-N	0	3	304.434	2.249	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)NCc2ccc(CO)c(F)c2)c1	ZINC000172617647	325732469	/nfs/dbraw/zinc/73/24/69/325732469.db2.gz	LUFPIZILGMAETP-UHFFFAOYSA-N	0	3	316.376	2.310	10	0		DEAEHN
C[C@@H](CNC(=O)NCCOCC1CCC1)N1CCCC[C@@H]1C	ZINC000575037636	326211766	/nfs/dbraw/zinc/21/17/66/326211766.db2.gz	RHTKMBAEHSUQEO-GJZGRUSLSA-N	0	3	311.470	2.365	10	0		DEAEHN
O=C(NC[C@@H]1CCCCN1C1CC1)NC1(CCO)CCCCC1	ZINC000576651502	326309397	/nfs/dbraw/zinc/30/93/97/326309397.db2.gz	MSRPNYSSSINQDY-INIZCTEOSA-N	0	3	323.481	2.388	10	0		DEAEHN
COC[C@H](C)CN[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O	ZINC000188198241	333039206	/nfs/dbraw/zinc/03/92/06/333039206.db2.gz	PTEKHCRIKQWLJE-QMTHXVAHSA-N	0	3	314.788	2.457	10	0		DEAEHN
COC[C@@H](C)C[NH+]1CCC(C(=O)Nc2ccccc2[O-])CC1	ZINC000189588758	333150095	/nfs/dbraw/zinc/15/00/95/333150095.db2.gz	VUAQFSMWYIFODU-ZDUSSCGKSA-N	0	3	306.406	2.325	10	0		DEAEHN
C[C@@H]1CC(NCc2c(Br)cnn2C)C[C@@H](C)O1	ZINC000584565227	337361946	/nfs/dbraw/zinc/36/19/46/337361946.db2.gz	FTCCFMNNFKPCRX-RKDXNWHRSA-N	0	3	302.216	2.228	10	0		DEAEHN
Cc1cc(CCNC(=O)N2CCN3CCC[C@H]3C2)cc(C)c1O	ZINC000190929184	534156984	/nfs/dbraw/zinc/15/69/84/534156984.db2.gz	QWZOAURWUZYWMM-INIZCTEOSA-N	0	3	317.433	2.041	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@H](C)c2c(C)noc2C)C1	ZINC000246922123	521620623	/nfs/dbraw/zinc/62/06/23/521620623.db2.gz	YLOJNTHEJZYRDS-SMDDNHRTSA-N	0	3	308.426	2.178	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCCCNc2ccccn2)C1	ZINC000105174572	521644271	/nfs/dbraw/zinc/64/42/71/521644271.db2.gz	YLJFUQVOUXISRR-HNNXBMFYSA-N	0	3	319.453	2.057	10	0		DEAEHN
COc1cc(C)ccc1CNC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000155830693	522258089	/nfs/dbraw/zinc/25/80/89/522258089.db2.gz	DCYCGTXAFDBMJA-MRXNPFEDSA-N	0	3	315.417	2.159	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN([C@@H](C)C(=O)N(CC)CC)C1	ZINC000105897332	522596180	/nfs/dbraw/zinc/59/61/80/522596180.db2.gz	HCIABRFJAJXSDY-LSDHHAIUSA-N	0	3	306.454	2.339	10	0		DEAEHN
C[C@@H](C(=O)N(CCN(C)C)Cc1ccco1)c1cccnc1	ZINC000156472128	524090688	/nfs/dbraw/zinc/09/06/88/524090688.db2.gz	GODSPUYQYYZKNL-CQSZACIVSA-N	0	3	301.390	2.369	10	0		DEAEHN
COc1ccc(OC)c(CC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000124169511	524812127	/nfs/dbraw/zinc/81/21/27/524812127.db2.gz	RJGPYWXXSBUABG-HIFRSBDPSA-N	0	3	320.433	2.187	10	0		DEAEHN
CC(=O)c1ccc(CC(=O)N(C)[C@H]2CCN(C3CC3)C2)cc1	ZINC000347006150	534839826	/nfs/dbraw/zinc/83/98/26/534839826.db2.gz	MPYNJTFWEIEOQR-KRWDZBQOSA-N	0	3	300.402	2.127	10	0		DEAEHN
C[C@]1(CNC(=O)Cc2cc[nH]n2)CCCN1Cc1ccccc1	ZINC000154827547	525251728	/nfs/dbraw/zinc/25/17/28/525251728.db2.gz	APBPUJRYNNHSQT-GOSISDBHSA-N	0	3	312.417	2.123	10	0		DEAEHN
Cc1ccnc(C2CCN(C(=O)[C@@H](C(C)C)N(C)C)CC2)n1	ZINC000363819180	525641609	/nfs/dbraw/zinc/64/16/09/525641609.db2.gz	HGBZOIBDRWOTBM-OAHLLOKOSA-N	0	3	304.438	2.077	10	0		DEAEHN
CC(=O)c1cccc(CN2CCCC[C@@H]2[C@@H]2CNC(=O)C2)c1	ZINC000450640204	534888111	/nfs/dbraw/zinc/88/81/11/534888111.db2.gz	GAOJLZBKTNOLAV-DLBZAZTESA-N	0	3	300.402	2.380	10	0		DEAEHN
Cc1cnn([C@@H]2CCCN(C[C@H](O)COc3ccccc3)C2)c1	ZINC000105900910	526265989	/nfs/dbraw/zinc/26/59/89/526265989.db2.gz	DRCNGAILOVAOHO-SJORKVTESA-N	0	3	315.417	2.268	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@H](C)NC[C@H](C)CS(C)(=O)=O	ZINC000157619085	527589083	/nfs/dbraw/zinc/58/90/83/527589083.db2.gz	FRJZWPDWQZBYJH-RYUDHWBXSA-N	0	3	315.483	2.278	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)CSCc2cccnc2)C1	ZINC000247012958	535255941	/nfs/dbraw/zinc/25/59/41/535255941.db2.gz	HFDMWZRCNBKVIN-UKRRQHHQSA-N	0	3	307.463	2.160	10	0		DEAEHN
CC1CCC(OC2CCN(C(=O)C3(N)CCOCC3)CC2)CC1	ZINC000261662740	535266993	/nfs/dbraw/zinc/26/69/93/535266993.db2.gz	BGRKZIWJFISFTM-UHFFFAOYSA-N	0	3	324.465	2.081	10	0		DEAEHN
CCN(C(=O)CN1CCNC[C@H]1c1cccnc1)c1ccccc1	ZINC000261620103	535663685	/nfs/dbraw/zinc/66/36/85/535663685.db2.gz	CXMOTUXHUWVKQU-SFHVURJKSA-N	0	3	324.428	2.081	10	0		DEAEHN
CCN(CC)[C@H](C(=O)N1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000246370073	535665374	/nfs/dbraw/zinc/66/53/74/535665374.db2.gz	GMBARYSWMSLSII-ROUUACIJSA-N	0	3	315.461	2.376	10	0		DEAEHN
CCN(CC)c1ncc(CNCC[C@@H](O)C(F)(F)F)s1	ZINC000349315174	535692698	/nfs/dbraw/zinc/69/26/98/535692698.db2.gz	KUIJJAJRHIFVLZ-SNVBAGLBSA-N	0	3	311.373	2.392	10	0		DEAEHN
CCc1cccc(NC(=O)CN2CCNC[C@H]2c2cccnc2)c1	ZINC000261778659	535898243	/nfs/dbraw/zinc/89/82/43/535898243.db2.gz	PJHCEHAGOWNWTP-SFHVURJKSA-N	0	3	324.428	2.229	10	0		DEAEHN
COC(=O)C[C@@H]1CCCN1CCN(C)Cc1ccc(F)cc1	ZINC000248544177	536317160	/nfs/dbraw/zinc/31/71/60/536317160.db2.gz	DLZWPNFOZAWKIW-INIZCTEOSA-N	0	3	308.397	2.285	10	0		DEAEHN
C[NH2+][C@H](C)C[N-]S(=O)(=O)c1oc2ccc(Cl)cc2c1C	ZINC000261763361	536403847	/nfs/dbraw/zinc/40/38/47/536403847.db2.gz	ONJQIOHCMZLQSB-MRVPVSSYSA-N	0	3	316.810	2.281	10	0		DEAEHN
CN1CCN([C@]2(C)CCCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000685952327	568422162	/nfs/dbraw/zinc/42/21/62/568422162.db2.gz	GDIRCOGGYIWCCT-QGZVFWFLSA-N	0	3	311.470	2.414	10	0		DEAEHN
CN1CC[C@H](NC(=O)C[C@@H]2CCCOC2)[C@@H]1c1ccccc1	ZINC000193694848	625657939	/nfs/dbraw/zinc/65/79/39/625657939.db2.gz	LAJXNPDEQRCPGU-ZVZYQTTQSA-N	0	3	302.418	2.365	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NS(=O)(=O)/C=C\c2ccccc2)C1	ZINC000255558240	625087143	/nfs/dbraw/zinc/08/71/43/625087143.db2.gz	RLXDRJFAKYKGCQ-NRXPATIISA-N	0	3	308.447	2.305	10	0		DEAEHN
COCC[C@H](N)C(=O)Nc1ccc(-c2csc(C)n2)cc1	ZINC000052809740	625106423	/nfs/dbraw/zinc/10/64/23/625106423.db2.gz	KENVILQHLPIFJU-ZDUSSCGKSA-N	0	3	305.403	2.421	10	0		DEAEHN
C[C@@H]1CN(C(=O)c2cccc(CN3CCCC3)c2)CCN1C	ZINC000742196098	637340077	/nfs/dbraw/zinc/34/00/77/637340077.db2.gz	LSQFFWUQJZCYCT-OAHLLOKOSA-N	0	3	301.434	2.059	10	0		DEAEHN
COC(=O)/C(C)=C\CNC1(c2ccc(OC)cc2)CCOCC1	ZINC000748817957	638595291	/nfs/dbraw/zinc/59/52/91/638595291.db2.gz	PZTBAQVFEUYBGD-ZSOIEALJSA-N	0	3	319.401	2.410	10	0		DEAEHN
c1cn(-c2cc(CNCc3cnn4ccccc34)ccn2)cn1	ZINC000729680187	640824593	/nfs/dbraw/zinc/82/45/93/640824593.db2.gz	YRIVKWFLTMMLCR-UHFFFAOYSA-N	0	3	304.357	2.205	10	0		DEAEHN
CC[C@@H](C)C(=O)Nc1cccc(CNCCC(=O)N(C)OC)c1	ZINC000806626922	645854717	/nfs/dbraw/zinc/85/47/17/645854717.db2.gz	JAXRWBOUOPBNQZ-CYBMUJFWSA-N	0	3	321.421	2.171	10	0		DEAEHN
C/C=C\CN1C[C@H]2CC[C@@H](C1)C(=O)N2Cc1c(C)noc1C	ZINC000229983404	646710445	/nfs/dbraw/zinc/71/04/45/646710445.db2.gz	IKJKMMJGRONVKG-ZYOQUQOHSA-N	0	3	303.406	2.290	10	0		DEAEHN
CN(Cc1ccccc1)C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C	ZINC000261539077	648375782	/nfs/dbraw/zinc/37/57/82/648375782.db2.gz	BMKGOUINTDQBQJ-IIDMSEBBSA-N	0	3	302.418	2.178	10	0		DEAEHN
C#CCCCCCOC(=O)C1CC[C@H](C(F)(F)F)NC1=O	ZINC000185335984	649499284	/nfs/dbraw/zinc/49/92/84/649499284.db2.gz	YHLXXEGQTOHREW-WDEREUQCSA-N	0	3	305.296	2.180	10	0		DEAEHN
CC(C)c1ccnc(N2CCN(CC3(O)CCCCC3)CC2)n1	ZINC000185855280	649649206	/nfs/dbraw/zinc/64/92/06/649649206.db2.gz	HUAQOPRFVLRQNX-UHFFFAOYSA-N	0	3	318.465	2.417	10	0		DEAEHN
Cn1ccnc1[C@@H]1OCCC[C@H]1CNCc1c(Cl)cnn1C	ZINC000858008653	652236385	/nfs/dbraw/zinc/23/63/85/652236385.db2.gz	UCDUPYMBYJIKOR-SMDDNHRTSA-N	0	3	323.828	2.065	10	0		DEAEHN
COCCN1[C@H](C)CN(Cc2ncc(C)c(OC)c2C)C[C@@H]1C	ZINC000129805627	684182496	/nfs/dbraw/zinc/18/24/96/684182496.db2.gz	MLQFYQXTQISMDA-GASCZTMLSA-N	0	3	321.465	2.248	10	0		DEAEHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCO[C@H]2C)cc1	ZINC000192198694	684444040	/nfs/dbraw/zinc/44/40/40/684444040.db2.gz	AAGCBZHNUFUDSM-NILFDRSVSA-N	0	3	316.357	2.158	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@H]1CCCN(Cc2ccccc2)C1	ZINC000248393547	685157309	/nfs/dbraw/zinc/15/73/09/685157309.db2.gz	XBEWPYBZFQOSDB-XHSDSOJGSA-N	0	3	317.385	2.003	10	0		DEAEHN
CC[C@@H](NCc1c(Br)cnn1C)[C@H]1CCCOC1	ZINC000724007669	777219964	/nfs/dbraw/zinc/21/99/64/777219964.db2.gz	KAMASRYQHHXXRP-CMPLNLGQSA-N	0	3	316.243	2.477	10	0		DEAEHN
NC(=O)c1csc(CNC[C@H]2CC[C@@H](C(F)(F)F)O2)c1	ZINC000722402699	778707674	/nfs/dbraw/zinc/70/76/74/778707674.db2.gz	JLUBCPZLUNYECA-SCZZXKLOSA-N	0	3	308.325	2.047	10	0		DEAEHN
CCO[C@H]1C[C@@](CO)(NCc2cnc3cc(C)ccn23)C1(C)C	ZINC000186578257	784405537	/nfs/dbraw/zinc/40/55/37/784405537.db2.gz	ZWZZDDGIUXYMAA-YJBOKZPZSA-N	0	3	317.433	2.298	10	0		DEAEHN
O=S(=O)(c1ccc(Cl)s1)N1CCNCCC12CCC2	ZINC000713204285	792216208	/nfs/dbraw/zinc/21/62/08/792216208.db2.gz	LYNXQYYUXBTRTE-UHFFFAOYSA-N	0	3	320.867	2.308	10	0		DEAEHN
Cc1cc(C)c(S(=O)(=O)N2CCNCCC23CCC3)s1	ZINC000713210396	792216499	/nfs/dbraw/zinc/21/64/99/792216499.db2.gz	DKLGGWFVSHZQAU-UHFFFAOYSA-N	0	3	314.476	2.272	10	0		DEAEHN
COc1ccc([C@@H](C)N[C@H]2C[C@H](S(C)(=O)=O)C2)cc1F	ZINC000714252247	792305686	/nfs/dbraw/zinc/30/56/86/792305686.db2.gz	ZPEMFJXONRROHV-YUSALJHKSA-N	0	3	301.383	2.061	10	0		DEAEHN
[NH3+]C1CC(C[N-]S(=O)(=O)c2cc(Cl)ccc2Cl)C1	ZINC000715110991	792383245	/nfs/dbraw/zinc/38/32/45/792383245.db2.gz	XSRGWYAXCGRKFA-UHFFFAOYSA-N	0	3	309.218	2.009	10	0		DEAEHN
COC[C@H](NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)C1CC1	ZINC000245679179	797955335	/nfs/dbraw/zinc/95/53/35/797955335.db2.gz	USIURASNTJSNGP-IXDOHACOSA-N	0	3	317.433	2.156	10	0		DEAEHN
C[C@H](C(=O)NCCC1=CCCCC1)N1C[C@H]2CCC[C@@H](C1)C2O	ZINC000172048316	799457449	/nfs/dbraw/zinc/45/74/49/799457449.db2.gz	SJJSCLBUCYIYLV-NAZJXLNTSA-N	0	3	320.477	2.474	10	0		DEAEHN
CCc1nc(CN[C@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)n[nH]1	ZINC000401796583	801852403	/nfs/dbraw/zinc/85/24/03/801852403.db2.gz	JVJYDGNNVVUKHK-RYUDHWBXSA-N	0	3	323.441	2.102	10	0		DEAEHN
Cn1cnc(CNCCC2(CNC(=O)OC(C)(C)C)CC2)c1	ZINC000404653897	802027247	/nfs/dbraw/zinc/02/72/47/802027247.db2.gz	SJDNDGPSOWENQG-UHFFFAOYSA-N	0	3	308.426	2.205	10	0		DEAEHN
c1ncn(CCNCc2ccccc2OCc2ccccn2)n1	ZINC000065934309	1079817859	/nfs/dbraw/zinc/81/78/59/1079817859.db2.gz	FJBYVARYVMDNRF-UHFFFAOYSA-N	0	3	309.373	2.042	10	0		DEAEHN
Cc1ccc(NC(=O)Cn2nnc3ccccc32)c(CN(C)C)c1	ZINC000072840002	1080165818	/nfs/dbraw/zinc/16/58/18/1080165818.db2.gz	FVKBFBKANFZCMZ-UHFFFAOYSA-N	0	3	323.400	2.440	10	0		DEAEHN
C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1NCc1cc(Br)nn1C	ZINC000701042649	1086347634	/nfs/dbraw/zinc/34/76/34/1086347634.db2.gz	MATCLLXXDYMABT-JXVAYASWSA-N	0	3	302.216	2.084	10	0		DEAEHN
COC1(CN[C@H]2CON(C(=O)OC(C)(C)C)C2)CCCC1	ZINC000703396916	1086498439	/nfs/dbraw/zinc/49/84/39/1086498439.db2.gz	JVTNDBZZYVPAJE-GFCCVEGCSA-N	0	3	300.399	2.086	10	0		DEAEHN
Cc1nc(CNCC2(N(C)C)CC2)sc1Br	ZINC000719318753	1088936843	/nfs/dbraw/zinc/93/68/43/1088936843.db2.gz	XPURUKDISLHAJW-UHFFFAOYSA-N	0	3	304.257	2.398	10	0		DEAEHN
CN[C@@H](c1ccc(OC)cc1)[C@@H](C)SCCS(C)(=O)=O	ZINC000081768869	192322277	/nfs/dbraw/zinc/32/22/77/192322277.db2.gz	ISOBQUCXLVFOPQ-BXUZGUMPSA-N	0	3	317.476	2.122	10	0		DEAEHN
CN[C@H](CSCCS(C)(=O)=O)c1ccc(C)cc1C	ZINC000081768414	192322304	/nfs/dbraw/zinc/32/23/04/192322304.db2.gz	VYOSLYHYQQVBMC-CQSZACIVSA-N	0	3	301.477	2.342	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N[C@H](C)CN2CCCCC2)cc1	ZINC000278390462	214136651	/nfs/dbraw/zinc/13/66/51/214136651.db2.gz	AHNLWYLDQKKSOL-CQSZACIVSA-N	0	3	317.433	2.274	10	0		DEAEHN
N[C@H](CSc1nncs1)c1ccc2c(c1)OCCCO2	ZINC000081869378	192332936	/nfs/dbraw/zinc/33/29/36/192332936.db2.gz	OVROMWBSXWMUCK-SNVBAGLBSA-N	0	3	309.416	2.492	10	0		DEAEHN
CCCN[C@H]1CCOC[C@H]1S(=O)(=O)c1ccccc1Cl	ZINC000081920552	192338440	/nfs/dbraw/zinc/33/84/40/192338440.db2.gz	DVSQGTKQZVIJDW-GXTWGEPZSA-N	0	3	317.838	2.271	10	0		DEAEHN
CCN[C@H]1CCOC[C@H]1S(=O)(=O)c1ccc(C(C)C)cc1	ZINC000081919964	192339049	/nfs/dbraw/zinc/33/90/49/192339049.db2.gz	ORKXAXYGJMLHSC-JKSUJKDBSA-N	0	3	311.447	2.351	10	0		DEAEHN
CCCN[C@@H]1c2ccc(OC)cc2CC[C@H]1S(=O)(=O)CC	ZINC000081925728	192340183	/nfs/dbraw/zinc/34/01/83/192340183.db2.gz	RVXFIXGUCKNMJD-HZPDHXFCSA-N	0	3	311.447	2.485	10	0		DEAEHN
CN[C@@H]1CCOC[C@@H]1S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000081922747	192340230	/nfs/dbraw/zinc/34/02/30/192340230.db2.gz	OJORPOJAXLUTJS-PWSUYJOCSA-N	0	3	324.229	2.144	10	0		DEAEHN
CN[C@@H]1CCC[C@@H]1S(=O)(=O)c1ccccc1Br	ZINC000081931550	192340802	/nfs/dbraw/zinc/34/08/02/192340802.db2.gz	FDYRBQVYDURPOR-PWSUYJOCSA-N	0	3	318.236	2.363	10	0		DEAEHN
COCCc1ccc(-c2csc(N3CCNCC3)n2)cc1	ZINC000078899743	185125357	/nfs/dbraw/zinc/12/53/57/185125357.db2.gz	STNKJVGIXMFMFV-UHFFFAOYSA-N	0	3	303.431	2.409	10	0		DEAEHN
CCC[C@H](CS(=O)(=O)c1ccc2c(c1)OCCCO2)NC	ZINC000081936283	192343163	/nfs/dbraw/zinc/34/31/63/192343163.db2.gz	LDVSYOIJHCIYBU-GFCCVEGCSA-N	0	3	313.419	2.010	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@@H](CC(C)C)CN(C)C)cc1	ZINC000078934562	185131321	/nfs/dbraw/zinc/13/13/21/185131321.db2.gz	VEJCEBHKPRHFGN-HNNXBMFYSA-N	0	3	305.422	2.026	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NC[C@@H](c1ccco1)N(C)C	ZINC000079192857	185161373	/nfs/dbraw/zinc/16/13/73/185161373.db2.gz	JDYJITTWPUNIRP-GJZGRUSLSA-N	0	3	324.469	2.158	10	0		DEAEHN
CC(C)[C@H](C[NH3+])[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000087404509	185223951	/nfs/dbraw/zinc/22/39/51/185223951.db2.gz	FQNCPECYKHQABD-JTQLQIEISA-N	0	3	311.234	2.255	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@@H](C)C1CCCCC1	ZINC000173176482	282188422	/nfs/dbraw/zinc/18/84/22/282188422.db2.gz	PFIOVPABRRQVOW-HOCLYGCPSA-N	0	3	311.470	2.365	10	0		DEAEHN
NC1CN(CC(=O)Nc2c(Cl)cc(Cl)cc2Cl)C1	ZINC000087589973	185229139	/nfs/dbraw/zinc/22/91/39/185229139.db2.gz	AZFMECOGQCISPI-UHFFFAOYSA-N	0	3	308.596	2.228	10	0		DEAEHN
Cc1nc(CN(C)C(=O)[C@@H]2CNCc3ccccc32)cs1	ZINC000087618903	185229324	/nfs/dbraw/zinc/22/93/24/185229324.db2.gz	IRSWRXKVHBTSNZ-OAHLLOKOSA-N	0	3	301.415	2.297	10	0		DEAEHN
CN[C@@H](Cc1ccc(OC)c(Br)c1)c1nc[nH]n1	ZINC000087879295	185234571	/nfs/dbraw/zinc/23/45/71/185234571.db2.gz	UQSNZSQJSKYRFD-JTQLQIEISA-N	0	3	311.183	2.079	10	0		DEAEHN
CN[C@@H](Cc1ccc(OC)c(Br)c1)c1nnc[nH]1	ZINC000087879295	185234572	/nfs/dbraw/zinc/23/45/72/185234572.db2.gz	UQSNZSQJSKYRFD-JTQLQIEISA-N	0	3	311.183	2.079	10	0		DEAEHN
COc1ccc([C@H](CN)NCC(F)(F)F)cc1OC(F)F	ZINC000087929441	185237629	/nfs/dbraw/zinc/23/76/29/185237629.db2.gz	HKKQLYMOJCGUKZ-QMMMGPOBSA-N	0	3	314.254	2.448	10	0		DEAEHN
CC[C@@H](N)CS(=O)(=O)Cc1sccc1Br	ZINC000088075220	185238915	/nfs/dbraw/zinc/23/89/15/185238915.db2.gz	SZVUSAYLNFHGGG-SSDOTTSWSA-N	0	3	312.254	2.163	10	0		DEAEHN
CN[C@@H]1CCCN(c2ccc(Br)c(F)c2)C1=O	ZINC000088085377	185239211	/nfs/dbraw/zinc/23/92/11/185239211.db2.gz	KOQXHSKXTPWCJP-LLVKDONJSA-N	0	3	301.159	2.303	10	0		DEAEHN
COc1ccc(CS(=O)(=O)c2ccccc2C)cc1CN	ZINC000087833059	185232850	/nfs/dbraw/zinc/23/28/50/185232850.db2.gz	ORNJBAZMAMHYOA-UHFFFAOYSA-N	0	3	305.399	2.436	10	0		DEAEHN
CC(C)CNCc1c(Cl)cccc1N1CCCNC(=O)C1	ZINC000087885127	185234380	/nfs/dbraw/zinc/23/43/80/185234380.db2.gz	DRNNWERMTCQJNT-UHFFFAOYSA-N	0	3	309.841	2.412	10	0		DEAEHN
CCC(CC)[C@H](C)NCc1ccc(S(=O)(=O)N(C)C)o1	ZINC000088540791	185255894	/nfs/dbraw/zinc/25/58/94/185255894.db2.gz	NJOYODWQBJXCMN-NSHDSACASA-N	0	3	302.440	2.444	10	0		DEAEHN
CC[C@H]1CCC[C@H]([NH2+]Cc2ccc(S(=O)(=O)[N-]C)o2)C1	ZINC000088540922	185255906	/nfs/dbraw/zinc/25/59/06/185255906.db2.gz	PCAUOBYMZWBHIR-RYUDHWBXSA-N	0	3	300.424	2.246	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@@H](C)[C@H](C)CC)o1	ZINC000088542910	185256442	/nfs/dbraw/zinc/25/64/42/185256442.db2.gz	RBHICWPDJULRCL-NEPJUHHUSA-N	0	3	302.440	2.492	10	0		DEAEHN
Cc1ccc2c(N)c(C(=O)NC[C@@H]3CCN(C)C3)sc2c1	ZINC000088640954	185260862	/nfs/dbraw/zinc/26/08/62/185260862.db2.gz	PEDWINNVADDQMR-NSHDSACASA-N	0	3	303.431	2.473	10	0		DEAEHN
CCc1ccc(CNC[C@@H]2C[C@H](F)CN2c2cccnn2)o1	ZINC000328625864	529652723	/nfs/dbraw/zinc/65/27/23/529652723.db2.gz	DOOJCFIUCRGRLN-STQMWFEESA-N	0	3	304.369	2.339	10	0		DEAEHN
CC(C)(C)[C@H]1CC[C@@H](N)[C@H](S(=O)(=O)C2CCOCC2)C1	ZINC000081989755	192351066	/nfs/dbraw/zinc/35/10/66/192351066.db2.gz	DVGSZUNWQQVWMD-IACUBPJLSA-N	0	3	303.468	2.122	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@]2(C)COC[C@@H]2N)cc1Br	ZINC000090604360	185306201	/nfs/dbraw/zinc/30/62/01/185306201.db2.gz	TZDPEWYBLHCDHA-AAEUAGOBSA-N	0	3	313.195	2.060	10	0		DEAEHN
CCC[C@@H](C(=O)NCCc1nnc(-c2ccccc2)o1)N(C)C	ZINC000179501330	282227660	/nfs/dbraw/zinc/22/76/60/282227660.db2.gz	MKXHUYWKPUPPGL-AWEZNQCLSA-N	0	3	316.405	2.126	10	0		DEAEHN
O=C(c1cccnc1)N1CCCSC[C@H]1CN1CCCC1	ZINC000090700835	185310696	/nfs/dbraw/zinc/31/06/96/185310696.db2.gz	ZDGRWKGLHXAIRE-OAHLLOKOSA-N	0	3	305.447	2.125	10	0		DEAEHN
CN[C@@H]1c2cc(OC)ccc2CC[C@H]1Sc1nncn1C	ZINC000092389750	185315495	/nfs/dbraw/zinc/31/54/95/185315495.db2.gz	ODKFEHRHCSHKLK-ZIAGYGMSSA-N	0	3	304.419	2.191	10	0		DEAEHN
CCN[C@@H]1c2cc(OC)ccc2C[C@@H]1Sc1nncn1C	ZINC000092860531	185347120	/nfs/dbraw/zinc/34/71/20/185347120.db2.gz	YRZXHKKBFXQRQU-UONOGXRCSA-N	0	3	304.419	2.191	10	0		DEAEHN
COC(=O)CNC(=O)[C@H](C)N[C@@H](C)c1ccc(CC(C)C)cc1	ZINC000181406319	199292188	/nfs/dbraw/zinc/29/21/88/199292188.db2.gz	BPABCLFDQSBSEG-KBPBESRZSA-N	0	3	320.433	2.213	10	0		DEAEHN
CN1CC[C@@H](CNC(=O)c2ccncc2F)[C@@H]1c1cccnc1	ZINC000328634888	529793656	/nfs/dbraw/zinc/79/36/56/529793656.db2.gz	ULAQFWLEBSCZBT-BBRMVZONSA-N	0	3	314.364	2.039	10	0		DEAEHN
CCC(O)(CC)CNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179476427	282313047	/nfs/dbraw/zinc/31/30/47/282313047.db2.gz	PKAUSUYETFFABR-JKSUJKDBSA-N	0	3	319.449	2.282	10	0		DEAEHN
CCNC(=O)CCN1CC[C@@H](c2cc(OC)cc(OC)c2)C1	ZINC000083249874	192368672	/nfs/dbraw/zinc/36/86/72/192368672.db2.gz	WIPQVWKQLCJKFO-CYBMUJFWSA-N	0	3	306.406	2.019	10	0		DEAEHN
CN1CCN(CCC(C)(C)Nc2ccnc(C3CC3)n2)CC1	ZINC000302279115	530072184	/nfs/dbraw/zinc/07/21/84/530072184.db2.gz	UNUBLWYRUCSFER-UHFFFAOYSA-N	0	3	303.454	2.182	10	0		DEAEHN
CC(C)Oc1ccc(NC(=O)COC2(C)CNC2)cc1Cl	ZINC000098060843	539436012	/nfs/dbraw/zinc/43/60/12/539436012.db2.gz	RSGRWJFRNNEWTE-UHFFFAOYSA-N	0	3	312.797	2.444	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)Nc2cnc(C3CC3)nc2)[C@@H](C)C1	ZINC000122598943	539462115	/nfs/dbraw/zinc/46/21/15/539462115.db2.gz	XJBXRMBMWQGPCQ-FZMZJTMJSA-N	0	3	303.410	2.204	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)NCCN2CCCCCC2)cc1	ZINC000279637279	215023649	/nfs/dbraw/zinc/02/36/49/215023649.db2.gz	ZUXMCXDWECFDFX-UHFFFAOYSA-N	0	3	317.433	2.275	10	0		DEAEHN
CCOC(=O)c1cccc([C@H](N)CNC(=O)OC(C)(C)C)c1	ZINC000083428781	192371620	/nfs/dbraw/zinc/37/16/20/192371620.db2.gz	HLXXYJZQIKKWQI-CYBMUJFWSA-N	0	3	308.378	2.388	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CC[C@H](c2ccc(CO)cc2)C1	ZINC000616612056	362897523	/nfs/dbraw/zinc/89/75/23/362897523.db2.gz	LJNGSARUNODOIH-INIZCTEOSA-N	0	3	320.433	2.493	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)Nc2cnn(CC3CC3)c2)C1	ZINC000176487648	539627418	/nfs/dbraw/zinc/62/74/18/539627418.db2.gz	ZNCXPJNEUHEROA-DOMZBBRYSA-N	0	3	305.426	2.143	10	0		DEAEHN
COc1ccc(OC)c([C@@H](C)NC[C@@H](C)CS(C)(=O)=O)c1	ZINC000176954676	539628819	/nfs/dbraw/zinc/62/88/19/539628819.db2.gz	JOXUSZXQEKICCJ-VXGBXAGGSA-N	0	3	315.435	2.035	10	0		DEAEHN
C[C@@H]1CN(C(=O)c2c(F)cccc2Br)[C@H](C)CN1	ZINC000129902642	185920826	/nfs/dbraw/zinc/92/08/26/185920826.db2.gz	ZBZSNCMENBDMML-RKDXNWHRSA-N	0	3	315.186	2.411	10	0		DEAEHN
CN(C(=O)c1c[nH]nc1-c1ccc(F)cc1)[C@H]1CCCN(C)C1	ZINC000080482585	192160648	/nfs/dbraw/zinc/16/06/48/192160648.db2.gz	QADWTPBYIIKBDK-AWEZNQCLSA-N	0	3	316.380	2.382	10	0		DEAEHN
Cc1ccc(CN(C(=O)CN[C@@H](C)[C@H]2CCCO2)C2CC2)o1	ZINC000183124839	539659361	/nfs/dbraw/zinc/65/93/61/539659361.db2.gz	QTIRVYKXURMFFM-XJKSGUPXSA-N	0	3	306.406	2.236	10	0		DEAEHN
Cc1cc(N2CCC[C@@H](NCc3ccc(C)cc3)C2=O)n(C)n1	ZINC000080526302	192165161	/nfs/dbraw/zinc/16/51/61/192165161.db2.gz	RNTUXNVNZKQUKN-MRXNPFEDSA-N	0	3	312.417	2.322	10	0		DEAEHN
O=C1[C@H](N[C@H]2CCCOC2)CCCN1Cc1ccc(F)cc1F	ZINC000191647652	539703088	/nfs/dbraw/zinc/70/30/88/539703088.db2.gz	OXQFOWKLQRIYQN-GOEBONIOSA-N	0	3	324.371	2.224	10	0		DEAEHN
CSCC[C@H](N)c1nnc2ccc(Br)cn21	ZINC000083739812	192380195	/nfs/dbraw/zinc/38/01/95/192380195.db2.gz	IRXLURJCLIOZLH-QMMMGPOBSA-N	0	3	301.213	2.245	10	0		DEAEHN
CN[C@@H](c1cc(Br)sc1C)[C@@H]1COCCO1	ZINC000084006519	192395045	/nfs/dbraw/zinc/39/50/45/192395045.db2.gz	MGYPHJPEAQOCON-ONGXEEELSA-N	0	3	306.225	2.495	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)[C@@H]2CCCO[C@H]2c2ccccc2)C1	ZINC000245994639	539759943	/nfs/dbraw/zinc/75/99/43/539759943.db2.gz	BGCLSFRVMVZIDJ-ZACQAIPSSA-N	0	3	302.418	2.317	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N2CCC(C)CC2)c1	ZINC000138243824	186014776	/nfs/dbraw/zinc/01/47/76/186014776.db2.gz	KKQOEXBSDWCIRF-UHFFFAOYSA-N	0	3	318.389	2.105	10	0		DEAEHN
Cn1c2cccc(S(C)(=O)=O)c2nc1[C@H]1CCCCCN1	ZINC000138232689	186014993	/nfs/dbraw/zinc/01/49/93/186014993.db2.gz	CEEBXFASGUHWQU-LLVKDONJSA-N	0	3	307.419	2.182	10	0		DEAEHN
CCCNCc1cc(F)c(F)c(S(=O)(=O)N(CC)CC)c1	ZINC000138254253	186015907	/nfs/dbraw/zinc/01/59/07/186015907.db2.gz	RUJLASDCEAXYMO-UHFFFAOYSA-N	0	3	320.405	2.495	10	0		DEAEHN
CCS(=O)(=O)CCCOc1cc(OC)ccc1[C@H](C)NC	ZINC000138494386	186017006	/nfs/dbraw/zinc/01/70/06/186017006.db2.gz	HXYMNJRTNDGPSW-LBPRGKRZSA-N	0	3	315.435	2.179	10	0		DEAEHN
CCCCCN(C)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138465300	186017055	/nfs/dbraw/zinc/01/70/55/186017055.db2.gz	JTOGAGZDFMNFJE-UHFFFAOYSA-N	0	3	320.405	2.495	10	0		DEAEHN
CC[C@H](C)N(CC)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138462835	186017137	/nfs/dbraw/zinc/01/71/37/186017137.db2.gz	LRYMNUMOQSTGID-JTQLQIEISA-N	0	3	320.405	2.493	10	0		DEAEHN
CN[C@@H](Cc1cnccc1N)c1ccc(Br)cn1	ZINC000140217165	186026130	/nfs/dbraw/zinc/02/61/30/186026130.db2.gz	SUPYVDDLSGOBDD-ZDUSSCGKSA-N	0	3	307.195	2.325	10	0		DEAEHN
CCN1CCC[C@@H]1CN1C(=O)C2(CC2)N[C@H]1c1ccsc1	ZINC000140284734	186026362	/nfs/dbraw/zinc/02/63/62/186026362.db2.gz	QZFYXDDRBLXALQ-ZIAGYGMSSA-N	0	3	305.447	2.195	10	0		DEAEHN
CC[C@]1(C)N[C@H](c2ccsc2)N(C2CCN(C)CC2)C1=O	ZINC000141183851	186029006	/nfs/dbraw/zinc/02/90/06/186029006.db2.gz	LOMNBZVVILAQPF-HOCLYGCPSA-N	0	3	307.463	2.441	10	0		DEAEHN
CC(C)[C@H]1N[C@@H](c2cccs2)N(C2CCN(C)CC2)C1=O	ZINC000141216044	186029470	/nfs/dbraw/zinc/02/94/70/186029470.db2.gz	MVJSHPJQUVDKGF-HUUCEWRRSA-N	0	3	307.463	2.297	10	0		DEAEHN
C[C@@H]1CCN[C@H](C(=O)N2CCC(Oc3ccccc3)CC2)C1	ZINC000262581414	282674804	/nfs/dbraw/zinc/67/48/04/282674804.db2.gz	ZAPMDDUYNLREHT-PBHICJAKSA-N	0	3	302.418	2.445	10	0		DEAEHN
CCCN[C@@H](C)c1ccc(SCCS(C)(=O)=O)cn1	ZINC000149447712	186050087	/nfs/dbraw/zinc/05/00/87/186050087.db2.gz	GEDVQZYGWKUVCD-NSHDSACASA-N	0	3	302.465	2.279	10	0		DEAEHN
CCNc1nc(Cl)nc(N2CC[C@@H](N3CCCCC3)C2)n1	ZINC000149956636	186053520	/nfs/dbraw/zinc/05/35/20/186053520.db2.gz	NXGRRTLICGCQFM-LLVKDONJSA-N	0	3	310.833	2.021	10	0		DEAEHN
CNc1cc(N2CC[C@@H](N3CCCCC3)C2)nc(SC)n1	ZINC000149963557	186053575	/nfs/dbraw/zinc/05/35/75/186053575.db2.gz	IXJPWNPXQDFTFH-GFCCVEGCSA-N	0	3	307.467	2.305	10	0		DEAEHN
N[C@@H](c1cccc(OC(F)(F)F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000150018808	186054011	/nfs/dbraw/zinc/05/40/11/186054011.db2.gz	KMGXRNVLMFTQNZ-ONGXEEELSA-N	0	3	309.309	2.020	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1coc(Br)c1	ZINC000268103101	539794198	/nfs/dbraw/zinc/79/41/98/539794198.db2.gz	IDWZGSKKHZCJAQ-SNVBAGLBSA-N	0	3	301.184	2.208	10	0		DEAEHN
COC(=O)c1ccc(CNC(=O)[C@H](C)N2[C@H](C)CC[C@H]2C)cc1	ZINC000171235787	197902700	/nfs/dbraw/zinc/90/27/00/197902700.db2.gz	WKFIOSVJKAYODN-MCIONIFRSA-N	0	3	318.417	2.351	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1ccc(C)cc1Br	ZINC000159546588	186126167	/nfs/dbraw/zinc/12/61/67/186126167.db2.gz	UREQXALMIIEENV-LLVKDONJSA-N	0	3	315.211	2.450	10	0		DEAEHN
C[C@@H]1CC[C@@](CO)(N(C)Cc2cc(-c3cnn(C)c3)no2)C1	ZINC000187992524	186240382	/nfs/dbraw/zinc/24/03/82/186240382.db2.gz	NUQJRBKEVQHXIF-MLGOLLRUSA-N	0	3	304.394	2.058	10	0		DEAEHN
OC[C@H](NCCCn1ccnc1)c1cccc(Br)c1	ZINC000183898388	186228730	/nfs/dbraw/zinc/22/87/30/186228730.db2.gz	LNETXNBNMULSFY-AWEZNQCLSA-N	0	3	324.222	2.359	10	0		DEAEHN
CN(Cc1ccc(Br)c(F)c1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000626038035	366017631	/nfs/dbraw/zinc/01/76/31/366017631.db2.gz	PDVCSNWEKLBCPX-AOOOYVTPSA-N	0	3	315.186	2.284	10	0		DEAEHN
CC(=O)c1cccc(OCC(=O)NC[C@@H]2CCN2C(C)(C)C)c1	ZINC000617021381	363002046	/nfs/dbraw/zinc/00/20/46/363002046.db2.gz	WRJHRCLIZBLKCE-HNNXBMFYSA-N	0	3	318.417	2.257	10	0		DEAEHN
CCn1ncc2ccc(NC(=O)N3CCN4CCC[C@@H]4C3)cc21	ZINC000171892141	198002857	/nfs/dbraw/zinc/00/28/57/198002857.db2.gz	XMLJIDSHCXGSBY-OAHLLOKOSA-N	0	3	313.405	2.368	10	0		DEAEHN
COc1ccc(CCCNC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000171903737	198005124	/nfs/dbraw/zinc/00/51/24/198005124.db2.gz	ZHPPLVUDNDPVOZ-INIZCTEOSA-N	0	3	317.433	2.117	10	0		DEAEHN
CC1CCC(N2CCN(C(=O)Nc3nncs3)CC2)CC1	ZINC000172053261	198031650	/nfs/dbraw/zinc/03/16/50/198031650.db2.gz	OICBDLISLBKCFC-UHFFFAOYSA-N	0	3	309.439	2.266	10	0		DEAEHN
CCC[C@@H](NC(=O)N1CCO[C@H](CN(C)C)C1)c1ccccc1	ZINC000172116223	198041858	/nfs/dbraw/zinc/04/18/58/198041858.db2.gz	HGKYBWDBUOKYQE-IAGOWNOFSA-N	0	3	319.449	2.500	10	0		DEAEHN
CCn1cc(C(=O)N2CCO[C@H](CN(C)C)C2)c2ccccc21	ZINC000172308285	198077268	/nfs/dbraw/zinc/07/72/68/198077268.db2.gz	LEHILEGIANPRCN-CQSZACIVSA-N	0	3	315.417	2.064	10	0		DEAEHN
C[C@@H](NCC(=O)NC12CC3CC(CC(C3)C1)C2)[C@@H]1CCCO1	ZINC000332896683	539943084	/nfs/dbraw/zinc/94/30/84/539943084.db2.gz	KZYPUVDDJSVGGQ-LIFKJRKOSA-N	0	3	306.450	2.229	10	0		DEAEHN
CC[C@H](O)CN1CCN(CCc2c(F)cccc2Cl)CC1	ZINC000173455398	198217072	/nfs/dbraw/zinc/21/70/72/198217072.db2.gz	ZERSACXEARNLBE-ZDUSSCGKSA-N	0	3	314.832	2.410	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1c[nH]nc1-c1ccccc1	ZINC000173584326	198229940	/nfs/dbraw/zinc/22/99/40/198229940.db2.gz	YMPOOPJRCSOFFJ-DZGCQCFKSA-N	0	3	310.401	2.385	10	0		DEAEHN
COC[C@H](C)C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000173706760	198243281	/nfs/dbraw/zinc/24/32/81/198243281.db2.gz	KLZRBAPXVUGWEI-DOTOQJQBSA-N	0	3	304.434	2.392	10	0		DEAEHN
COc1cccc(N2CC[C@H](CNCc3ccc(CO)o3)C2)c1	ZINC000174336583	198320973	/nfs/dbraw/zinc/32/09/73/198320973.db2.gz	KSMHEVKPWBQBOD-CQSZACIVSA-N	0	3	316.401	2.397	10	0		DEAEHN
Fc1ccc2c(c1)OCCC[C@@H]2N[C@@H]1CCc2ncnn2C1	ZINC000182131637	283000505	/nfs/dbraw/zinc/00/05/05/283000505.db2.gz	VTLSJDZYSYFNEG-OCCSQVGLSA-N	0	3	302.353	2.236	10	0		DEAEHN
C[C@H](NC(=O)[C@@H]1NCCCC1(C)C)c1ccc(NC(N)=O)cc1	ZINC000261940099	299216871	/nfs/dbraw/zinc/21/68/71/299216871.db2.gz	UQRYFRZENVLDJM-FZMZJTMJSA-N	0	3	318.421	2.133	10	0		DEAEHN
C[C@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC2CCN(C)CC2)c1	ZINC000054147898	354454843	/nfs/dbraw/zinc/45/48/43/354454843.db2.gz	LZECXEYYWQUAEM-LRDDRELGSA-N	0	3	315.417	2.105	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCN(C[C@H](N)c2ccccc2)CC1	ZINC000059732130	354606429	/nfs/dbraw/zinc/60/64/29/354606429.db2.gz	KMDNYUVRSIBFGI-HNNXBMFYSA-N	0	3	305.422	2.239	10	0		DEAEHN
CN[C@H](C)C(=O)N1C[C@H](C)N(Cc2ccccc2)[C@H](C)[C@@H]1C	ZINC000404312536	540144695	/nfs/dbraw/zinc/14/46/95/540144695.db2.gz	MCWKTBQRNVSWPL-JJXSEGSLSA-N	0	3	303.450	2.104	10	0		DEAEHN
NC[C@H](NC(=O)c1csc(Br)c1)C(F)(F)F	ZINC000401750539	540142611	/nfs/dbraw/zinc/14/26/11/540142611.db2.gz	NJXXLTULYQTECU-YFKPBYRVSA-N	0	3	317.130	2.130	10	0		DEAEHN
C[C@@H](CNC(=O)N[C@@H](C)c1ccc2c(c1)OCO2)N(C)C1CC1	ZINC000105100113	355719599	/nfs/dbraw/zinc/71/95/99/355719599.db2.gz	XBPZVQBMDBKGLK-RYUDHWBXSA-N	0	3	319.405	2.258	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC(=O)NC[C@@H]2CCCN2C)c1	ZINC000139416063	355876324	/nfs/dbraw/zinc/87/63/24/355876324.db2.gz	OZBYDHYZSYCXGO-STQMWFEESA-N	0	3	321.421	2.158	10	0		DEAEHN
CCN1CCO[C@H](CNCc2ccccc2OC(F)F)C1	ZINC000134440743	355859998	/nfs/dbraw/zinc/85/99/98/355859998.db2.gz	ZTXYDSSRDSAHQZ-CYBMUJFWSA-N	0	3	300.349	2.098	10	0		DEAEHN
O=C(CNC1CC1)NCc1ccc(Oc2ccc(F)cc2)nc1	ZINC000154624630	355943131	/nfs/dbraw/zinc/94/31/31/355943131.db2.gz	GTHYJILOOSLPAU-UHFFFAOYSA-N	0	3	315.348	2.381	10	0		DEAEHN
CC1CCN(CCCc2noc([C@H](N)C3CCOCC3)n2)CC1	ZINC000328630557	356463534	/nfs/dbraw/zinc/46/35/34/356463534.db2.gz	JNGSQNBFRMLBAL-MRXNPFEDSA-N	0	3	322.453	2.161	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@@H]1CN(C)Cc2ccccc21	ZINC000536036059	540241312	/nfs/dbraw/zinc/24/13/12/540241312.db2.gz	PZANPNWSEXRRQF-IAGOWNOFSA-N	0	3	301.434	2.164	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)NCCCc1cc(OC)ccc1OC	ZINC000236969529	202101482	/nfs/dbraw/zinc/10/14/82/202101482.db2.gz	QQPDBVQJBZEMCF-MLGOLLRUSA-N	0	3	308.422	2.126	10	0		DEAEHN
OCCN1CCC[C@H](NCc2ccc(Br)s2)C1	ZINC000384294571	356682742	/nfs/dbraw/zinc/68/27/42/356682742.db2.gz	FDJVTEMXLRYKPP-JTQLQIEISA-N	0	3	319.268	2.057	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cs1	ZINC000088919393	192657504	/nfs/dbraw/zinc/65/75/04/192657504.db2.gz	AUSBCGIZPBKGFU-QWRGUYRKSA-N	0	3	302.465	2.134	10	0		DEAEHN
CCCNCc1cc(S(=O)(=O)N(CC)C2CC2)c(C)o1	ZINC000088940918	192663128	/nfs/dbraw/zinc/66/31/28/192663128.db2.gz	VMTUSOQTWOGFKK-UHFFFAOYSA-N	0	3	300.424	2.261	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2CCCC[C@@H]2CC)cn1C	ZINC000088942439	192663624	/nfs/dbraw/zinc/66/36/24/192663624.db2.gz	VJVAWYHIAIUYTQ-ZDUSSCGKSA-N	0	3	313.467	2.088	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)c2ncsc2Br)CCN1C	ZINC000581962733	357276106	/nfs/dbraw/zinc/27/61/06/357276106.db2.gz	ACKCSGCTKLFMGE-SFYZADRCSA-N	0	3	318.240	2.118	10	0		DEAEHN
CN(C)C[C@H]1CCCCN1C(=O)CN(C)c1ccc(Cl)cn1	ZINC000591202429	357689758	/nfs/dbraw/zinc/68/97/58/357689758.db2.gz	PEKOYRSYUNUROE-CQSZACIVSA-N	0	3	324.856	2.114	10	0		DEAEHN
Cn1cc(C(=O)N2CCN3CCC[C@H]3C2)c(-c2cccs2)n1	ZINC000179332051	199016938	/nfs/dbraw/zinc/01/69/38/199016938.db2.gz	PVQODXKQEPFTSV-LBPRGKRZSA-N	0	3	316.430	2.069	10	0		DEAEHN
COCCN1CCN(Cc2cnc(-c3ccccc3)[nH]2)C[C@H]1C	ZINC000179509832	199047764	/nfs/dbraw/zinc/04/77/64/199047764.db2.gz	IQJZUVSFXZMCHA-OAHLLOKOSA-N	0	3	314.433	2.229	10	0		DEAEHN
CC(C)C1CCN(C(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)CC1	ZINC000262426534	535378327	/nfs/dbraw/zinc/37/83/27/535378327.db2.gz	FLRMLCSDVCHXIC-HDMKZQKVSA-N	0	3	308.466	2.414	10	0		DEAEHN
C[C@H]1CCCC[C@@H]1N(C)S(=O)(=O)c1cc(CN)cs1	ZINC000089006512	192693855	/nfs/dbraw/zinc/69/38/55/192693855.db2.gz	RQNASFYXYOJAMZ-JQWIXIFHSA-N	0	3	302.465	2.406	10	0		DEAEHN
CC[C@H](C)N1CCN(CC(=O)Nc2ccccc2OC)CC1	ZINC000181136482	199255627	/nfs/dbraw/zinc/25/56/27/199255627.db2.gz	AWRYZJDUFDYTTD-AWEZNQCLSA-N	0	3	305.422	2.050	10	0		DEAEHN
C[C@H]1CN(CCC(=O)N2CCc3ccccc3C2)CCS1	ZINC000189003301	200334483	/nfs/dbraw/zinc/33/44/83/200334483.db2.gz	AGXULHLEAIFONS-AWEZNQCLSA-N	0	3	304.459	2.399	10	0		DEAEHN
C[C@H](NC[C@@H](O)CC(F)(F)F)c1ccc2c(c1)OCCO2	ZINC000189343339	200384773	/nfs/dbraw/zinc/38/47/73/200384773.db2.gz	DSSTYQZTXPCALO-ONGXEEELSA-N	0	3	305.296	2.422	10	0		DEAEHN
CCN1CC[C@@H](CNC(=O)C[C@H](C)C(=O)c2ccccc2)C1	ZINC000602103553	360266442	/nfs/dbraw/zinc/26/64/42/360266442.db2.gz	FYVBTJGNTCLADZ-GJZGRUSLSA-N	0	3	302.418	2.354	10	0		DEAEHN
c1ccc2c(c1)[nH]c1c2C[C@H](NCc2nnc3ccccn32)C1	ZINC000442849791	238085764	/nfs/dbraw/zinc/08/57/64/238085764.db2.gz	URQNZPFTRPXUPZ-LBPRGKRZSA-N	0	3	303.369	2.468	10	0		DEAEHN
CCc1ccc([C@@H]2CNCCN2C(=O)CN(CC)CC)cc1	ZINC000262055387	288553371	/nfs/dbraw/zinc/55/33/71/288553371.db2.gz	VHXPMVPRLMDLCG-KRWDZBQOSA-N	0	3	303.450	2.064	10	0		DEAEHN
Cc1cnn(CCN2CCC[C@@H](c3nnc4ccccn43)C2)c1	ZINC000606435586	361006722	/nfs/dbraw/zinc/00/67/22/361006722.db2.gz	TYPASOMHZTYERR-OAHLLOKOSA-N	0	3	310.405	2.114	10	0		DEAEHN
CCCCOC[C@H](O)CN[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000193358444	201036926	/nfs/dbraw/zinc/03/69/26/201036926.db2.gz	DNMSSPMNJXRDKV-RHSMWYFYSA-N	0	3	318.421	2.096	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)Cc2ccc(OC)c(O)c2)C1	ZINC000194169317	201190057	/nfs/dbraw/zinc/19/00/57/201190057.db2.gz	IUIKPXRGGPGTMO-CQSZACIVSA-N	0	3	321.421	2.027	10	0		DEAEHN
COC(=O)CCCN[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000611405698	361593876	/nfs/dbraw/zinc/59/38/76/361593876.db2.gz	IDTAMELGFFCEMM-OAHLLOKOSA-N	0	3	307.390	2.470	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCCCCC(=O)OC(C)(C)C	ZINC000611354206	361585091	/nfs/dbraw/zinc/58/50/91/361585091.db2.gz	WWEQIHAUXHQDBS-AWEZNQCLSA-N	0	3	312.454	2.489	10	0		DEAEHN
Cc1cccnc1C(F)(F)C(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000194607169	201262122	/nfs/dbraw/zinc/26/21/22/201262122.db2.gz	PIXJLJGPJXVFCF-QWHCGFSZSA-N	0	3	309.360	2.177	10	0		DEAEHN
CCC1(NC(=O)C(=O)Nc2cccc(CN(C)C)c2)CCC1	ZINC000194658181	201270417	/nfs/dbraw/zinc/27/04/17/201270417.db2.gz	RZKRNEQIDBPYFQ-UHFFFAOYSA-N	0	3	303.406	2.136	10	0		DEAEHN
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1CC[C@@H](N2CC=CC2)C1	ZINC000195211250	201360351	/nfs/dbraw/zinc/36/03/51/201360351.db2.gz	HIDIXRCPBFNVPN-IXDOHACOSA-N	0	3	315.392	2.337	10	0		DEAEHN
Cn1c(Cl)ncc1C1=C[C@H](N)CN(C(=O)OC(C)(C)C)C1	ZINC000675077532	541286331	/nfs/dbraw/zinc/28/63/31/541286331.db2.gz	GABHKQSIJUBDGL-JTQLQIEISA-N	0	3	312.801	2.035	10	0		DEAEHN
CC(=O)N1CC[C@H](NCCc2nc(C)no2)c2ccccc21	ZINC000621754381	364536821	/nfs/dbraw/zinc/53/68/21/364536821.db2.gz	DFQWFVYITYFQHM-AWEZNQCLSA-N	0	3	300.362	2.008	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@H]2C[C@H](O)C23CCC3)c2ccccc21	ZINC000621764258	364539378	/nfs/dbraw/zinc/53/93/78/364539378.db2.gz	BWYZLMOSMUGUPW-XIRDDKMYSA-N	0	3	300.402	2.377	10	0		DEAEHN
c1cc(CNC[C@@H]2Cc3ccccc3CO2)n(-c2ccccn2)n1	ZINC000623603144	365097244	/nfs/dbraw/zinc/09/72/44/365097244.db2.gz	OERBIZKTONTIEB-SFHVURJKSA-N	0	3	320.396	2.498	10	0		DEAEHN
Cc1ccc(CNC[C@H]2COCCN2C)c(Br)c1	ZINC000623711321	365140278	/nfs/dbraw/zinc/14/02/78/365140278.db2.gz	APKXOBGVXPZIJQ-ZDUSSCGKSA-N	0	3	313.239	2.178	10	0		DEAEHN
CCCNCc1cnn([C@@]2(C)CCS(=O)(=O)C2)c1C(C)C	ZINC000091337288	193043357	/nfs/dbraw/zinc/04/33/57/193043357.db2.gz	ZPXAGJKAGFQESD-HNNXBMFYSA-N	0	3	313.467	2.040	10	0		DEAEHN
CO[C@H](CN[C@@H](C)c1ccc(S(N)(=O)=O)cc1)C(C)(C)C	ZINC000091350124	193044294	/nfs/dbraw/zinc/04/42/94/193044294.db2.gz	OGBJXBGYILJCKG-SMDDNHRTSA-N	0	3	314.451	2.046	10	0		DEAEHN
Cc1csc(C2CCN([C@@H](C)CN3CCOCC3)CC2)n1	ZINC000091552710	193072853	/nfs/dbraw/zinc/07/28/53/193072853.db2.gz	HRVSDOFKSFEGSP-AWEZNQCLSA-N	0	3	309.479	2.352	10	0		DEAEHN
c1ccc2c(c1)CSC[C@@H]2NC[C@H]1CN2CCC[C@@H]2CO1	ZINC000091666431	193088630	/nfs/dbraw/zinc/08/86/30/193088630.db2.gz	DYRBFUGLUFQZKP-VYDXJSESSA-N	0	3	304.459	2.427	10	0		DEAEHN
NCc1cccc2c1N(S(=O)(=O)c1ccsc1)CCC2	ZINC000624389995	365406365	/nfs/dbraw/zinc/40/63/65/365406365.db2.gz	RNIFXWPSPJNEDC-UHFFFAOYSA-N	0	3	308.428	2.348	10	0		DEAEHN
CC[C@@H]1[NH2+]CC[C@H]1[N-]S(=O)(=O)c1cc(C)c(Cl)s1	ZINC000624393628	365407733	/nfs/dbraw/zinc/40/77/33/365407733.db2.gz	FCGPVZIKJRULDV-DTWKUNHWSA-N	0	3	308.856	2.129	10	0		DEAEHN
CSCCCNCc1cnc2cnc(Br)cn12	ZINC000092050079	193148630	/nfs/dbraw/zinc/14/86/30/193148630.db2.gz	HJSJYSKILPGKIS-UHFFFAOYSA-N	0	3	315.240	2.335	10	0		DEAEHN
CCC(=O)CCCN(C)C[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000450782959	242214263	/nfs/dbraw/zinc/21/42/63/242214263.db2.gz	ZTKXIMPQEMIIND-IBGZPJMESA-N	0	3	318.461	2.315	10	0		DEAEHN
CNCc1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)c1	ZINC000092113519	193161052	/nfs/dbraw/zinc/16/10/52/193161052.db2.gz	XIRHDGPGQNHHOD-PHIMTYICSA-N	0	3	316.854	2.336	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)cn1C(C)C	ZINC000092113919	193161776	/nfs/dbraw/zinc/16/17/76/193161776.db2.gz	KWXAATXKECGGAJ-BETUJISGSA-N	0	3	313.467	2.065	10	0		DEAEHN
CCCC1CCN(S(=O)(=O)c2ccc(CN)cc2F)CC1	ZINC000092116059	193164202	/nfs/dbraw/zinc/16/42/02/193164202.db2.gz	KERKSYJCLQDMCE-UHFFFAOYSA-N	0	3	314.426	2.485	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCC[C@H](C)CC2)c(F)c1	ZINC000092116173	193164368	/nfs/dbraw/zinc/16/43/68/193164368.db2.gz	GAUJSIHINBAERF-LBPRGKRZSA-N	0	3	314.426	2.356	10	0		DEAEHN
CC1(C)CCCN(S(=O)(=O)c2ccc(CN)cc2F)CC1	ZINC000092116263	193164376	/nfs/dbraw/zinc/16/43/76/193164376.db2.gz	ZMBPKAIUUOYFHC-UHFFFAOYSA-N	0	3	314.426	2.485	10	0		DEAEHN
c1ccc(COC2CC(NC3CN(c4ccncn4)C3)C2)cc1	ZINC000631747513	368366505	/nfs/dbraw/zinc/36/65/05/368366505.db2.gz	JTBPZIYEIDQJEO-UHFFFAOYSA-N	0	3	310.401	2.003	10	0		DEAEHN
CO[C@@H]1[C@@H](C)[C@@H](NCC(=O)Nc2ccc3c(c2)OCO3)C1(C)C	ZINC000451502438	243041211	/nfs/dbraw/zinc/04/12/11/243041211.db2.gz	PNUXXAMAXMINKR-AMKSKSKJSA-N	0	3	320.389	2.003	10	0		DEAEHN
CCC[C@](C)(N)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	ZINC000262112100	203203081	/nfs/dbraw/zinc/20/30/81/203203081.db2.gz	HOVZJFRDJVKPTH-HNNXBMFYSA-N	0	3	321.812	2.436	10	0		DEAEHN
CCN(CC)CCN1C(=[NH2+])NC[C@@H]1c1ccc([O-])c(Cl)c1	ZINC000093382288	193240773	/nfs/dbraw/zinc/24/07/73/193240773.db2.gz	OKCRJGBTVZGROO-CYBMUJFWSA-N	0	3	310.829	2.059	10	0		DEAEHN
CN[C@H](Cc1cc(Br)ccc1F)C(OC)OC	ZINC000093304944	193227259	/nfs/dbraw/zinc/22/72/59/193227259.db2.gz	UVXFYBJCLOVTDD-LLVKDONJSA-N	0	3	306.175	2.338	10	0		DEAEHN
CC(C)(CNC[C@H]1Cc2cc(Cl)ccc2O1)S(C)(=O)=O	ZINC000093519898	193263158	/nfs/dbraw/zinc/26/31/58/193263158.db2.gz	ICAZRESFSXMGOI-GFCCVEGCSA-N	0	3	317.838	2.056	10	0		DEAEHN
C[C@@H](NC[C@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1F	ZINC000093696620	193291905	/nfs/dbraw/zinc/29/19/05/193291905.db2.gz	XYYOYEPISARAOK-CHWSQXEVSA-N	0	3	314.426	2.148	10	0		DEAEHN
CCOC(=O)[C@]1(NC)CCC[C@H](N(C)CCC(F)(F)F)C1	ZINC000093756575	193302162	/nfs/dbraw/zinc/30/21/62/193302162.db2.gz	RCSDVJSNLJLJBI-AAEUAGOBSA-N	0	3	310.360	2.335	10	0		DEAEHN
CC(C)N[C@]1(C(N)=O)CC[C@@H](N(CC(F)(F)F)C(C)C)C1	ZINC000093826240	193313711	/nfs/dbraw/zinc/31/37/11/193313711.db2.gz	RVVDAKLZZZFQGD-DGCLKSJQSA-N	0	3	309.376	2.034	10	0		DEAEHN
Nc1ccc(N2CCN(c3ccc(Cl)cc3)CC2)nc1N	ZINC000094259996	193355336	/nfs/dbraw/zinc/35/53/36/193355336.db2.gz	MGLRUQUUSNOUJV-UHFFFAOYSA-N	0	3	303.797	2.226	10	0		DEAEHN
CCCCNC(=O)[C@@H](C)Oc1c(F)cc(CNC)cc1F	ZINC000094346634	193363423	/nfs/dbraw/zinc/36/34/23/193363423.db2.gz	WPALHNCVSNDCCR-SNVBAGLBSA-N	0	3	300.349	2.368	10	0		DEAEHN
CCNCc1cc(F)c(OCC(=O)NC(C)(C)C)c(F)c1	ZINC000094346941	193363455	/nfs/dbraw/zinc/36/34/55/193363455.db2.gz	NNFSVXDESUCXJJ-UHFFFAOYSA-N	0	3	300.349	2.368	10	0		DEAEHN
CC(C)CNCc1cn([C@@H]2CCO[C@]3(CCSC3)C2)nn1	ZINC000094419118	193368646	/nfs/dbraw/zinc/36/86/46/193368646.db2.gz	AKJCFJCJPAVLMJ-HUUCEWRRSA-N	0	3	310.467	2.251	10	0		DEAEHN
Nc1ccc(C(F)(F)F)cc1C(=O)NCCN1CCCC1	ZINC000094596078	193382265	/nfs/dbraw/zinc/38/22/65/193382265.db2.gz	VVTYMHBXNMXDFY-UHFFFAOYSA-N	0	3	301.312	2.113	10	0		DEAEHN
CN[C@@H](C)c1cc(F)ccc1OCC(=O)NCC(F)(F)F	ZINC000094619499	193385334	/nfs/dbraw/zinc/38/53/34/193385334.db2.gz	NKIOZLNNLHWBOE-QMMMGPOBSA-N	0	3	308.275	2.163	10	0		DEAEHN
CCC1(CC)CCN(S(=O)(=O)Cc2ccccc2CN)C1	ZINC000094801007	193398967	/nfs/dbraw/zinc/39/89/67/193398967.db2.gz	JNCNKAMSLDZWMY-UHFFFAOYSA-N	0	3	310.463	2.487	10	0		DEAEHN
CCN1C[C@H](N[C@H](C[C@H]2CCOC2)c2ccccc2)CC1=O	ZINC000453356498	245091166	/nfs/dbraw/zinc/09/11/66/245091166.db2.gz	LSKHBCLLHNYORB-DJIMGWMZSA-N	0	3	302.418	2.365	10	0		DEAEHN
COC(=O)[C@H](N[C@H]1CN(C(C)C)C[C@H]1C)c1ccccc1F	ZINC000246166622	284289253	/nfs/dbraw/zinc/28/92/53/284289253.db2.gz	FBPHUIJPTLRWSV-UHOFOFEASA-N	0	3	308.397	2.358	10	0		DEAEHN
CCN(c1ccccc1)S(=O)(=O)c1cc(CN)ccc1F	ZINC000020188969	182195718	/nfs/dbraw/zinc/19/57/18/182195718.db2.gz	IITRUYVKXSVZHV-UHFFFAOYSA-N	0	3	308.378	2.500	10	0		DEAEHN
Fc1ccc(Br)cc1CNC[C@@H]1CCOCO1	ZINC000160125160	197387697	/nfs/dbraw/zinc/38/76/97/197387697.db2.gz	RHYZIDHQZHXPTG-NSHDSACASA-N	0	3	304.159	2.441	10	0		DEAEHN
O=C(CN1CCNCC1)Nc1c(Cl)cccc1C(F)(F)F	ZINC000020521246	182226388	/nfs/dbraw/zinc/22/63/88/182226388.db2.gz	LPUUUOPUAUOOGI-UHFFFAOYSA-N	0	3	321.730	2.203	10	0		DEAEHN
CCOC(=O)N[C@H](CN)c1ccc(OC)c(OC(F)F)c1	ZINC000020551457	182229983	/nfs/dbraw/zinc/22/99/83/182229983.db2.gz	YGETVNGMIWIZEN-SECBINFHSA-N	0	3	304.293	2.043	10	0		DEAEHN
O=C1C(CNCCc2ccccc2)=CC2=CC=C[C@H]3CCN1[C@H]23	ZINC000039287458	183016355	/nfs/dbraw/zinc/01/63/55/183016355.db2.gz	KLIANTXYBOVEAE-LPHOPBHVSA-N	0	3	306.409	2.472	10	0		DEAEHN
CCOc1cc(/C=C\C(=O)N2CCN3CCC[C@H]3C2)ccc1O	ZINC000492405849	249057815	/nfs/dbraw/zinc/05/78/15/249057815.db2.gz	LEFQQOKKIRKCQL-LYASGUKUSA-N	0	3	316.401	2.111	10	0		DEAEHN
CCCOc1ccc(NC(=O)[C@@H]2C[C@H](OC)CN2)cc1Cl	ZINC000040634362	183112588	/nfs/dbraw/zinc/11/25/88/183112588.db2.gz	ZHYLAWNVIVMZSW-AAEUAGOBSA-N	0	3	312.797	2.444	10	0		DEAEHN
CCC[C@@H](N)C(=O)Nc1sc2c(c1C(=O)OCC)CCC2	ZINC000040853274	183141880	/nfs/dbraw/zinc/14/18/80/183141880.db2.gz	AMWWMKFXIAZZJP-SNVBAGLBSA-N	0	3	310.419	2.479	10	0		DEAEHN
CCC[C@](C)(N)C(=O)Nc1sc2c(c1C(=O)OC)CCC2	ZINC000040858921	183143398	/nfs/dbraw/zinc/14/33/98/183143398.db2.gz	FWNXOGIGSVIFIP-HNNXBMFYSA-N	0	3	310.419	2.479	10	0		DEAEHN
CN(c1c2c(nc3ccccc31)CCC2)[C@H]1CCS(=O)(=O)C1	ZINC000041477761	183193801	/nfs/dbraw/zinc/19/38/01/183193801.db2.gz	QJULYIINBQYKMO-LBPRGKRZSA-N	0	3	316.426	2.347	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)NCCN2CCCC[C@@H]2C)cc1F	ZINC000041664119	183213543	/nfs/dbraw/zinc/21/35/43/183213543.db2.gz	NSEGPYZPVTYMCI-ZDUSSCGKSA-N	0	3	321.396	2.063	10	0		DEAEHN
CCCNCc1cccc(Br)c1O[C@H](C)C(N)=O	ZINC000042411782	183266343	/nfs/dbraw/zinc/26/63/43/183266343.db2.gz	RCAVAVMOZQEPBQ-SECBINFHSA-N	0	3	315.211	2.201	10	0		DEAEHN
COCCN(C)[C@H](CN)c1cc(Br)ccc1F	ZINC000042458658	183272983	/nfs/dbraw/zinc/27/29/83/183272983.db2.gz	HNXMVLCLYNLPCA-GFCCVEGCSA-N	0	3	305.191	2.166	10	0		DEAEHN
COCCN([C@H](C)COC)[C@@H](CN)c1ccc(Cl)s1	ZINC000042602960	183290617	/nfs/dbraw/zinc/29/06/17/183290617.db2.gz	FAAVDJSSTLZFOF-MNOVXSKESA-N	0	3	306.859	2.385	10	0		DEAEHN
CCN(CC(F)(F)F)[C@H](C)C(=O)Nc1cccc(CN)c1	ZINC000042739530	183303565	/nfs/dbraw/zinc/30/35/65/183303565.db2.gz	FNALKVNBXAFYDE-SNVBAGLBSA-N	0	3	303.328	2.357	10	0		DEAEHN
C[C@H](N)[C@H](c1ccccc1Cl)N(C)CC(=O)N1CCCC1	ZINC000043052104	183332578	/nfs/dbraw/zinc/33/25/78/183332578.db2.gz	DPXIIRZEMCRZRG-BLLLJJGKSA-N	0	3	309.841	2.283	10	0		DEAEHN
CCN(CC(=O)NC(C)C)[C@H](CN)c1ccc(Cl)s1	ZINC000043253641	183348472	/nfs/dbraw/zinc/34/84/72/183348472.db2.gz	NJQNCUQVEBDDMY-SNVBAGLBSA-N	0	3	303.859	2.248	10	0		DEAEHN
COCCN(C)[C@H](c1cc(Br)cs1)[C@@H](C)N	ZINC000043286632	183350509	/nfs/dbraw/zinc/35/05/09/183350509.db2.gz	DTGNXDUSRJEZTE-KCJUWKMLSA-N	0	3	307.257	2.477	10	0		DEAEHN
NC[C@@H](Sc1nc[nH]n1)c1cc(Br)cs1	ZINC000043290305	183351232	/nfs/dbraw/zinc/35/12/32/183351232.db2.gz	UUCQELIUVZEODN-SSDOTTSWSA-N	0	3	305.226	2.421	10	0		DEAEHN
CCCN(CCO)[C@H](CN)c1ccccc1Br	ZINC000043092677	183335801	/nfs/dbraw/zinc/33/58/01/183335801.db2.gz	PTGWFVMJPCKFJL-CYBMUJFWSA-N	0	3	301.228	2.153	10	0		DEAEHN
CN[C@@](C)(CCSc1ccc(Br)cc1)C(N)=O	ZINC000045551377	183515091	/nfs/dbraw/zinc/51/50/91/183515091.db2.gz	QZMBSSZPBKMLOX-LBPRGKRZSA-N	0	3	317.252	2.395	10	0		DEAEHN
CC[C@@H]1CN(CCOc2cc(C)ccc2C)CCN1C[C@@H](C)O	ZINC000105825098	194137479	/nfs/dbraw/zinc/13/74/79/194137479.db2.gz	BANJITCMRSCZSM-QZTJIDSGSA-N	0	3	320.477	2.459	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)c2ccc(F)cc2)C[C@H]1CC	ZINC000105838107	194144022	/nfs/dbraw/zinc/14/40/22/194144022.db2.gz	YOFBYSYFHKYVJW-MSOLQXFVSA-N	0	3	324.440	2.292	10	0		DEAEHN
CN(CCCCCO)C[C@H](c1cccs1)N1CCOCC1	ZINC000105918123	194168775	/nfs/dbraw/zinc/16/87/75/194168775.db2.gz	MRJGYDXCDRYPSV-OAHLLOKOSA-N	0	3	312.479	2.216	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N1CCC[C@H](N(C)C)C1)c1ccccc1	ZINC000109808561	194287589	/nfs/dbraw/zinc/28/75/89/194287589.db2.gz	DPTSQMFSZHHHBW-ZOBUZTSGSA-N	0	3	303.450	2.278	10	0		DEAEHN
COc1ccc(CNC(=S)N2CCC[C@@H]2CN(C)C)cc1	ZINC000109670871	194278788	/nfs/dbraw/zinc/27/87/88/194278788.db2.gz	ZMJNPGBJOSYQNN-CQSZACIVSA-N	0	3	307.463	2.096	10	0		DEAEHN
CCOCCN(CC)[C@@H](CN)c1cc2c(c(Cl)c1)OCO2	ZINC000111117268	194391820	/nfs/dbraw/zinc/39/18/20/194391820.db2.gz	LYBDZKBRTTXPIX-ZDUSSCGKSA-N	0	3	314.813	2.427	10	0		DEAEHN
CC(C)OCCCNC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000057202830	184029470	/nfs/dbraw/zinc/02/94/70/184029470.db2.gz	BYVUJAKNBATDQI-KRWDZBQOSA-N	0	3	321.465	2.274	10	0		DEAEHN
[NH3+]Cc1cccc(S(=O)(=O)[N-]c2cc(F)cc(F)c2F)c1	ZINC000061118191	184162466	/nfs/dbraw/zinc/16/24/66/184162466.db2.gz	NXNXVDIDGIPTIV-UHFFFAOYSA-N	0	3	316.304	2.363	10	0		DEAEHN
CCNC(C)(C)C(=O)Nc1cc(Cl)ccc1C(=O)N(C)C	ZINC000061290090	184167510	/nfs/dbraw/zinc/16/75/10/184167510.db2.gz	JINKHTCEJVLFLE-UHFFFAOYSA-N	0	3	311.813	2.368	10	0		DEAEHN
CC(C)CN(CCN(C)C)c1nc(Cl)nc(OC(C)C)n1	ZINC000061540454	184173422	/nfs/dbraw/zinc/17/34/22/184173422.db2.gz	SENXRITZQFFHMZ-UHFFFAOYSA-N	0	3	315.849	2.336	10	0		DEAEHN
C[C@@H]1CN(CCC(=O)Nc2ccc(N)cc2Cl)CCCO1	ZINC000061912798	184195196	/nfs/dbraw/zinc/19/51/96/184195196.db2.gz	UCFKQPKOUDKKDL-LLVKDONJSA-N	0	3	311.813	2.362	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccco1)N1CCN(CC(F)(F)F)CC1	ZINC000061940812	184197353	/nfs/dbraw/zinc/19/73/53/184197353.db2.gz	XIHDFPNLJCJDIR-YPMHNXCESA-N	0	3	305.344	2.238	10	0		DEAEHN
CCN[C@@H](C)c1cnc(N2CCN(CC(F)(F)F)CC2)s1	ZINC000061948524	184197757	/nfs/dbraw/zinc/19/77/57/184197757.db2.gz	HDZRMYRTHJGMSM-JTQLQIEISA-N	0	3	322.400	2.498	10	0		DEAEHN
C[C@H](c1cccc(Cl)c1)N(C)CC(=O)N1CCCNCC1	ZINC000062014484	184201120	/nfs/dbraw/zinc/20/11/20/184201120.db2.gz	NLGJTYCCKDIKST-CYBMUJFWSA-N	0	3	309.841	2.155	10	0		DEAEHN
CCN[C@H](C)c1ccc(F)cc1O[C@@H]1CCS(=O)(=O)C1	ZINC000062746695	184251833	/nfs/dbraw/zinc/25/18/33/184251833.db2.gz	DUDKALOEFQQUFK-ZYHUDNBSSA-N	0	3	301.383	2.062	10	0		DEAEHN
[NH3+][C@@H]1CCCCC[C@@H]1[N-]S(=O)(=O)c1ccc(F)cc1Cl	ZINC000063213337	184278369	/nfs/dbraw/zinc/27/83/69/184278369.db2.gz	SLFPQXLHEASMNM-NEPJUHHUSA-N	0	3	320.817	2.417	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cc(N)c(Cl)c(Cl)c2)C1	ZINC000062964320	184262772	/nfs/dbraw/zinc/26/27/72/184262772.db2.gz	GZIQRKLLAWSWEI-VIFPVBQESA-N	0	3	302.205	2.352	10	0		DEAEHN
CC1(C)C[C@@H](N)c2ccc(OCCCS(C)(=O)=O)cc2O1	ZINC000063014435	184266676	/nfs/dbraw/zinc/26/66/76/184266676.db2.gz	SMGPFPVKTOFGKS-CYBMUJFWSA-N	0	3	313.419	2.061	10	0		DEAEHN
CS(=O)(=O)CCC[C@H](N)c1ccccc1Br	ZINC000063017154	184267117	/nfs/dbraw/zinc/26/71/17/184267117.db2.gz	BBYKTERAPCOELO-NSHDSACASA-N	0	3	306.225	2.274	10	0		DEAEHN
CS(=O)(=O)c1ccc(S[C@@H](CN)c2ccccn2)cc1	ZINC000063131262	184272236	/nfs/dbraw/zinc/27/22/36/184272236.db2.gz	PEWVJXVOXQNXHW-AWEZNQCLSA-N	0	3	308.428	2.277	10	0		DEAEHN
COCCC[C@@H](N)C(=O)N1CCc2sccc2[C@@H]1C1CC1	ZINC000159304641	197344205	/nfs/dbraw/zinc/34/42/05/197344205.db2.gz	PQVPJUIFZQQFKN-HIFRSBDPSA-N	0	3	308.447	2.338	10	0		DEAEHN
CC(C)N(CC(=O)NCCN1CCc2ccccc21)C1CCC1	ZINC000119756420	195030071	/nfs/dbraw/zinc/03/00/71/195030071.db2.gz	XNRFPGNZIJUZDB-UHFFFAOYSA-N	0	3	315.461	2.428	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2)N(C)C	ZINC000119810960	195041617	/nfs/dbraw/zinc/04/16/17/195041617.db2.gz	NSCJWOXPAURUMH-XHDPSFHLSA-N	0	3	303.406	2.089	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2C[C@H](C)CC[C@@H]2C)cc(CN)c1F	ZINC000159123442	197328960	/nfs/dbraw/zinc/32/89/60/197328960.db2.gz	MLXWINIGYZIPDA-PWSUYJOCSA-N	0	3	314.426	2.402	10	0		DEAEHN
CCCC[C@H](C)NS(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159105257	197327657	/nfs/dbraw/zinc/32/76/57/197327657.db2.gz	ANAYQCJARQQSQU-NSHDSACASA-N	0	3	302.415	2.450	10	0		DEAEHN
N[C@H](c1ccc2c3c(cccc31)CC2)[C@H]1CCS(=O)(=O)C1	ZINC000158780556	197301172	/nfs/dbraw/zinc/30/11/72/197301172.db2.gz	BJABGPNOWXBLKX-GUYCJALGSA-N	0	3	301.411	2.373	10	0		DEAEHN
CCc1ccc(S(=O)(=O)N2C[C@@H]3CCC[C@@H]3C2)cc1CN	ZINC000158756746	197299409	/nfs/dbraw/zinc/29/94/09/197299409.db2.gz	CJYZZWULWDMROO-OKILXGFUSA-N	0	3	308.447	2.128	10	0		DEAEHN
CCC(C)(C)C1CCC(O)([C@]2(CN)CCS(=O)(=O)C2)CC1	ZINC000157666024	197205382	/nfs/dbraw/zinc/20/53/82/197205382.db2.gz	QAOXOOAKSQYMAC-SIWZUTFBSA-N	0	3	317.495	2.108	10	0		DEAEHN
CCOC(=O)[C@](C)(CCN(C)CCOC(C)C)NC(C)C	ZINC000157508957	197192730	/nfs/dbraw/zinc/19/27/30/197192730.db2.gz	LYXJRPVEWRAZIJ-INIZCTEOSA-N	0	3	302.459	2.053	10	0		DEAEHN
CCc1nn(C)c(C[C@](C)(F)C[C@H]2COCCN2)c1Cl	ZINC000157546214	197196674	/nfs/dbraw/zinc/19/66/74/197196674.db2.gz	CETXVUHYOSOKHD-IINYFYTJSA-N	0	3	303.809	2.285	10	0		DEAEHN
CCCNc1cc(N2CCN3CCC[C@@H]3C2)nc(SC)n1	ZINC000157408000	197185672	/nfs/dbraw/zinc/18/56/72/197185672.db2.gz	KDWOWFFWFCEIFU-GFCCVEGCSA-N	0	3	307.467	2.305	10	0		DEAEHN
CCCNCc1ccc(F)c(S(=O)(=O)N(C)CC(F)F)c1	ZINC000157160401	197166786	/nfs/dbraw/zinc/16/67/86/197166786.db2.gz	LVMORIWBTYOLMD-UHFFFAOYSA-N	0	3	324.368	2.211	10	0		DEAEHN
CCN(C)CCNC(=O)c1sc2cc(C)nc(C)c2c1N	ZINC000157020416	197156155	/nfs/dbraw/zinc/15/61/55/197156155.db2.gz	URGJTZMHVSKVSI-UHFFFAOYSA-N	0	3	306.435	2.177	10	0		DEAEHN
C[C@](O)(Cc1ccccc1Br)C[C@H]1COCCN1	ZINC000156803220	197142354	/nfs/dbraw/zinc/14/23/54/197142354.db2.gz	MOLLLXGQRMEHAS-JSGCOSHPSA-N	0	3	314.223	2.121	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2ccc(F)c(Cl)c2)C[C@@H]1C	ZINC000120598392	195198471	/nfs/dbraw/zinc/19/84/71/195198471.db2.gz	FVAMBEZDMZNQCX-NWDGAFQWSA-N	0	3	300.805	2.366	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000120755555	195230890	/nfs/dbraw/zinc/23/08/90/195230890.db2.gz	LQBXBTSGKVXHRK-HUUCEWRRSA-N	0	3	317.433	2.183	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc(OC)c(OC)c2)CCN1CCOC	ZINC000120953625	195270984	/nfs/dbraw/zinc/27/09/84/195270984.db2.gz	FHWNVCSSGSQTFT-INIZCTEOSA-N	0	3	322.449	2.246	10	0		DEAEHN
CC[C@H]1CN(Cc2ccccc2NC(C)=O)CCN1CCOC	ZINC000120968313	195273249	/nfs/dbraw/zinc/27/32/49/195273249.db2.gz	LQVUIAGWNRAXDL-KRWDZBQOSA-N	0	3	319.449	2.188	10	0		DEAEHN
COc1ccccc1CN1CCCN(Cc2cnn(C)c2)CC1	ZINC000121589381	195311302	/nfs/dbraw/zinc/31/13/02/195311302.db2.gz	PBMGDGQVIMAYJX-UHFFFAOYSA-N	0	3	314.433	2.137	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C)cc1F	ZINC000121825918	195355300	/nfs/dbraw/zinc/35/53/00/195355300.db2.gz	ZBMCOPOVVFEYDK-CQSZACIVSA-N	0	3	323.412	2.165	10	0		DEAEHN
CCc1ccccc1NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000121869259	195365694	/nfs/dbraw/zinc/36/56/94/195365694.db2.gz	OBYCFXIGFQSXHS-OAHLLOKOSA-N	0	3	319.449	2.280	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N(C)CCc2nccs2)C1	ZINC000123243394	195560195	/nfs/dbraw/zinc/56/01/95/195560195.db2.gz	CBNXIDIDQPWHPC-OLZOCXBDSA-N	0	3	310.467	2.056	10	0		DEAEHN
COCC[C@@H](Cc1cccc(F)c1)NCc1cc(C(N)=O)co1	ZINC000187706565	533281424	/nfs/dbraw/zinc/28/14/24/533281424.db2.gz	WZQVGARSFVBYSE-HNNXBMFYSA-N	0	3	320.364	2.255	10	0		DEAEHN
COc1ccc(C[C@H](C)NC[C@H]2CCCCS2(=O)=O)cc1	ZINC000545242413	285406886	/nfs/dbraw/zinc/40/68/86/285406886.db2.gz	JUIDDHJFOZQHAJ-XJKSGUPXSA-N	0	3	311.447	2.183	10	0		DEAEHN
C1CCC(N2CCCN(c3nc(C4CCOCC4)no3)CC2)C1	ZINC000562719667	292005746	/nfs/dbraw/zinc/00/57/46/292005746.db2.gz	ZHQKTFZUOWZEGD-UHFFFAOYSA-N	0	3	320.437	2.418	10	0		DEAEHN
CC(C)[C@@H](NC(=O)OC(C)(C)C)[C@]1(C)NCCc2nc[nH]c21	ZINC000725242527	542770056	/nfs/dbraw/zinc/77/00/56/542770056.db2.gz	CCJUOAKBVXDUBX-WBMJQRKESA-N	0	3	308.426	2.320	10	0		DEAEHN
CN(C[C@@H]1CCCN(C)C1)C(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000360073582	133160302	/nfs/dbraw/zinc/16/03/02/133160302.db2.gz	GINXWFKKIADVPZ-CQSZACIVSA-N	0	3	314.429	2.158	10	0		DEAEHN
Cc1cc(C)c(CNC(=O)c2ccccc2CN(C)C)c(=O)[nH]1	ZINC000362485282	133232758	/nfs/dbraw/zinc/23/27/58/133232758.db2.gz	GSBDTGLRSSLROL-UHFFFAOYSA-N	0	3	313.401	2.396	10	0		DEAEHN
COc1ccc2c(c1)[C@](O)(CNCc1n[nH]cc1C)CCC2	ZINC000368082581	133259443	/nfs/dbraw/zinc/25/94/43/133259443.db2.gz	WZHWKSJRJABZOS-QGZVFWFLSA-N	0	3	301.390	2.040	10	0		DEAEHN
Cc1ccccc1-n1cc(CN2CCC[C@@H](c3nc[nH]n3)C2)nn1	ZINC000377623714	133337892	/nfs/dbraw/zinc/33/78/92/133337892.db2.gz	KEBQUVRPSKQAIK-CQSZACIVSA-N	0	3	323.404	2.073	10	0		DEAEHN
COc1ccccc1CCNC(=O)CN1CCCC12CCC2	ZINC000373095940	133377443	/nfs/dbraw/zinc/37/74/43/133377443.db2.gz	VSCGOXFOQVOPIQ-UHFFFAOYSA-N	0	3	302.418	2.372	10	0		DEAEHN
c1nc2n(n1)C[C@H](N[C@H]1CSCCc3ccccc31)CC2	ZINC000180604509	285584316	/nfs/dbraw/zinc/58/43/16/285584316.db2.gz	FFODRLSVRDRCNM-HIFRSBDPSA-N	0	3	300.431	2.213	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N1CC[C@@H](N2CCCC2)C1	ZINC000187887994	145004445	/nfs/dbraw/zinc/00/44/45/145004445.db2.gz	KIOYYWPZXDAEKG-OAHLLOKOSA-N	0	3	321.396	2.214	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N(C)[C@@H](CO)CC(C)C	ZINC000188407340	145011750	/nfs/dbraw/zinc/01/17/50/145011750.db2.gz	MEEPDLZHKCQGPY-HUUCEWRRSA-N	0	3	301.475	2.011	10	0		DEAEHN
Cn1cc(C(=O)N2CCN3CCC2CC3)c(-c2ccccc2)n1	ZINC000188855896	145018605	/nfs/dbraw/zinc/01/86/05/145018605.db2.gz	XMEAHWUFOLXPKC-UHFFFAOYSA-N	0	3	310.401	2.007	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)c1[nH]nnc1-c1ccccc1	ZINC000189107852	145022629	/nfs/dbraw/zinc/02/26/29/145022629.db2.gz	VQFNEDWRVWMRNW-CYBMUJFWSA-N	0	3	313.405	2.076	10	0		DEAEHN
O[C@@H](CN1CCN(Cc2cccnc2)CC1)C1CCCCC1	ZINC000190985044	145051215	/nfs/dbraw/zinc/05/12/15/145051215.db2.gz	FDJGOUNDTIMXAB-SFHVURJKSA-N	0	3	303.450	2.140	10	0		DEAEHN
CSC1(C(=O)N2CC[C@@H](CN(C)Cc3cccnc3)C2)CC1	ZINC000191055226	145052223	/nfs/dbraw/zinc/05/22/23/145052223.db2.gz	LEQJYNRFJSSOGK-HNNXBMFYSA-N	0	3	319.474	2.258	10	0		DEAEHN
CCC[C@@H]1CN(C[C@H](O)C2CCCCC2)CCN1CCOC	ZINC000191028802	145052574	/nfs/dbraw/zinc/05/25/74/145052574.db2.gz	KHWBFZCBKJGSNT-MSOLQXFVSA-N	0	3	312.498	2.360	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)CC2CCCC2)C[C@@H]1CC	ZINC000191335880	145056915	/nfs/dbraw/zinc/05/69/15/145056915.db2.gz	GBSGSMQRSVKYNS-ZWKOTPCHSA-N	0	3	312.498	2.360	10	0		DEAEHN
Cc1ccc(S(=O)(=O)C[C@H](C)N[C@H]2CCOC[C@@H]2C)cc1	ZINC000191834223	145065578	/nfs/dbraw/zinc/06/55/78/145065578.db2.gz	QQPCNQPARFYVHI-DZKIICNBSA-N	0	3	311.447	2.172	10	0		DEAEHN
Cn1ccnc1C[C@H]1CCCN(C[C@@H]2CC3(CCC3)C(=O)O2)C1	ZINC000192136512	145071765	/nfs/dbraw/zinc/07/17/65/145071765.db2.gz	OLJWULHSMVFJMQ-CABCVRRESA-N	0	3	317.433	2.160	10	0		DEAEHN
C[C@H]1CN(CCN2CCC(Nc3ccccc3F)CC2)CCO1	ZINC000192770764	145079067	/nfs/dbraw/zinc/07/90/67/145079067.db2.gz	BHHSCVVQFNQXMR-HNNXBMFYSA-N	0	3	321.440	2.423	10	0		DEAEHN
CCn1cnnc1C1CCN(CCO[C@@H]2CCCCO2)CC1	ZINC000193051296	145081404	/nfs/dbraw/zinc/08/14/04/145081404.db2.gz	JBGBJTAPKOEWRA-OAHLLOKOSA-N	0	3	308.426	2.021	10	0		DEAEHN
CCn1nc(C)c(NC(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1C	ZINC000246525450	145105688	/nfs/dbraw/zinc/10/56/88/145105688.db2.gz	UZEKEXHKELNSGJ-BXUZGUMPSA-N	0	3	307.442	2.370	10	0		DEAEHN
CN(C)c1cccc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1	ZINC000246538061	145106472	/nfs/dbraw/zinc/10/64/72/145106472.db2.gz	SEUZRMWVPHCPRA-DOTOQJQBSA-N	0	3	301.434	2.309	10	0		DEAEHN
O[C@@H](COc1ccccc1Cl)CN1CCN2CCCC[C@H]2C1	ZINC000246545964	145106547	/nfs/dbraw/zinc/10/65/47/145106547.db2.gz	KDZSNJVMUTXLBD-LSDHHAIUSA-N	0	3	324.852	2.250	10	0		DEAEHN
COc1cccc(OC)c1C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000246584640	145107897	/nfs/dbraw/zinc/10/78/97/145107897.db2.gz	YJKKFHUXBKBKDA-QWHCGFSZSA-N	0	3	306.406	2.162	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)COc1ccc(F)cc1F	ZINC000247085872	145126359	/nfs/dbraw/zinc/12/63/59/145126359.db2.gz	HZNWHOACKRLUGN-YPMHNXCESA-N	0	3	310.344	2.039	10	0		DEAEHN
CC(C)N(C(=O)[C@@H](C)N1CCC[C@@H](Cn2cncn2)C1)C(C)C	ZINC000247090994	145126565	/nfs/dbraw/zinc/12/65/65/145126565.db2.gz	HOYLVLUKJFJZBJ-HZPDHXFCSA-N	0	3	321.469	2.024	10	0		DEAEHN
C[C@H](c1ccc(F)cc1)N(C)C(=O)CN1CCN2CCC[C@H]2C1	ZINC000247101548	145126576	/nfs/dbraw/zinc/12/65/76/145126576.db2.gz	IFBLTKNAWBICKX-PBHICJAKSA-N	0	3	319.424	2.125	10	0		DEAEHN
Cc1ccc(O[C@H](C)C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1	ZINC000247249040	145130863	/nfs/dbraw/zinc/13/08/63/145130863.db2.gz	NLJUVLKUAFRQHZ-OAGGEKHMSA-N	0	3	302.418	2.457	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(C[C@@H](O)COCC(C)C)C1	ZINC000247243158	145131090	/nfs/dbraw/zinc/13/10/90/145131090.db2.gz	SMZJJSCAKJAMIB-JKSUJKDBSA-N	0	3	309.454	2.116	10	0		DEAEHN
CC(=O)Nc1ccc(CN2CCS[C@H]3COCC[C@H]32)cc1	ZINC000247303299	145132131	/nfs/dbraw/zinc/13/21/31/145132131.db2.gz	ZTVZDINJEXGOBA-CVEARBPZSA-N	0	3	306.431	2.351	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCc1ccccn1	ZINC000248392297	145152552	/nfs/dbraw/zinc/15/25/52/145152552.db2.gz	KEFWERQRCYYIJA-MAUKXSAKSA-N	0	3	324.428	2.401	10	0		DEAEHN
CC[C@@H]1C[C@@H](C(=O)N[C@H](Cc2ccccc2)CN(C)C)CCO1	ZINC000248567649	145159490	/nfs/dbraw/zinc/15/94/90/145159490.db2.gz	NQMLFSCCIGCSNR-RCCFBDPRSA-N	0	3	318.461	2.481	10	0		DEAEHN
Cc1ccccc1CN(C)C(=O)[C@H](C)N[C@H](C)[C@H]1CCCO1	ZINC000248599341	145160817	/nfs/dbraw/zinc/16/08/17/145160817.db2.gz	NKBGSOIUYTWVAQ-HLLBOEOZSA-N	0	3	304.434	2.499	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@H]2CCO[C@H]2C)c2ccc(F)cc2C1	ZINC000248689149	145163805	/nfs/dbraw/zinc/16/38/05/145163805.db2.gz	AEVRSZWYXBKLKU-GOPGUHFVSA-N	0	3	306.381	2.386	10	0		DEAEHN
Cc1cc2c(cc1C)[C@@H](C(=O)N1CCN3CCC[C@H]3C1)CO2	ZINC000248679315	145163867	/nfs/dbraw/zinc/16/38/67/145163867.db2.gz	DYPUKQQRGKEOEE-HOCLYGCPSA-N	0	3	300.402	2.086	10	0		DEAEHN
CCN1CC[C@@H](N(C)C(=O)C(=O)c2ccccc2OC)[C@@H](C)C1	ZINC000248740102	145166232	/nfs/dbraw/zinc/16/62/32/145166232.db2.gz	QILLFFVIINWFDK-DZGCQCFKSA-N	0	3	318.417	2.067	10	0		DEAEHN
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1CCCCCn1cccn1	ZINC000248785028	145167839	/nfs/dbraw/zinc/16/78/39/145167839.db2.gz	COADSKAHJIZVCP-XHSDSOJGSA-N	0	3	305.422	2.327	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C)N(C)C	ZINC000248795178	145168123	/nfs/dbraw/zinc/16/81/23/145168123.db2.gz	JCWCFFMQAVWUII-BPQIPLTHSA-N	0	3	317.477	2.353	10	0		DEAEHN
CCN(C)c1ccc(CN2CCC[C@@H](Cn3cncn3)C2)cn1	ZINC000248842467	145170238	/nfs/dbraw/zinc/17/02/38/145170238.db2.gz	LYPOJXYZRPDLQT-MRXNPFEDSA-N	0	3	314.437	2.041	10	0		DEAEHN
NC(=O)[C@H](Cc1ccc(Cl)cc1)N1CC[C@H]2OCCC[C@H]2C1	ZINC000248879056	145171721	/nfs/dbraw/zinc/17/17/21/145171721.db2.gz	NPDOBMPNFGCWJD-CWRNSKLLSA-N	0	3	322.836	2.237	10	0		DEAEHN
OC[C@@H]1CN(C[C@@H](O)CC(F)(F)F)C[C@@H]1c1ccsc1	ZINC000249291235	145182349	/nfs/dbraw/zinc/18/23/49/145182349.db2.gz	MLBHCSRYNGZJRI-SDDRHHMPSA-N	0	3	309.353	2.069	10	0		DEAEHN
C[C@@H]1COCC[C@H]1N[C@H]1CCN(c2ccc(Cl)cc2)C1=O	ZINC000249387086	145183311	/nfs/dbraw/zinc/18/33/11/145183311.db2.gz	XBQAUXDYFFCJHB-DFBGVHRSSA-N	0	3	308.809	2.460	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)N(C)[C@@H](CO)CC(C)C	ZINC000253191060	145201372	/nfs/dbraw/zinc/20/13/72/145201372.db2.gz	UFUHOSMDJHJDAW-JKSUJKDBSA-N	0	3	313.486	2.299	10	0		DEAEHN
CC[C@@H]1CN(C/C=C\c2ccccc2OC)CCN1C[C@@H](C)O	ZINC000255030229	145203044	/nfs/dbraw/zinc/20/30/44/145203044.db2.gz	BBAASKIBXDFEQK-OWUNDVQQSA-N	0	3	318.461	2.485	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)NCCc1ccc(F)cc1	ZINC000261649031	145213411	/nfs/dbraw/zinc/21/34/11/145213411.db2.gz	FNNXFSCOIRRICK-RKVPGOIHSA-N	0	3	320.408	2.017	10	0		DEAEHN
CCc1ccccc1CNC(=O)[C@]1(N)[C@H]2CCCO[C@H]2C1(C)C	ZINC000261845438	145233122	/nfs/dbraw/zinc/23/31/22/145233122.db2.gz	IYZVNUXTWQSIEZ-FRQCXROJSA-N	0	3	316.445	2.398	10	0		DEAEHN
O=C(CCN1CCNC[C@H]1c1cccnc1)Nc1ccccc1	ZINC000262233947	145270871	/nfs/dbraw/zinc/27/08/71/145270871.db2.gz	OEVJHBPVIYKPRO-KRWDZBQOSA-N	0	3	310.401	2.057	10	0		DEAEHN
C[C@H](NC(=O)[C@H]1NCCCC1(C)C)c1ccc2c(c1)OCO2	ZINC000262550207	145292032	/nfs/dbraw/zinc/29/20/32/145292032.db2.gz	SGPHYRYDJDPCEB-XHDPSFHLSA-N	0	3	304.390	2.371	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H]1NCCCC1(C)C)c1ccc2c(c1)OCO2	ZINC000262550204	145292082	/nfs/dbraw/zinc/29/20/82/145292082.db2.gz	SGPHYRYDJDPCEB-ABAIWWIYSA-N	0	3	304.390	2.371	10	0		DEAEHN
Cc1ccc(CNC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)cc1	ZINC000262553500	145292250	/nfs/dbraw/zinc/29/22/50/145292250.db2.gz	SWEWQFFAPASAJS-IIDMSEBBSA-N	0	3	302.418	2.144	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@H]2CCC[C@H](C(F)(F)F)C2)n1	ZINC000263169304	145331841	/nfs/dbraw/zinc/33/18/41/145331841.db2.gz	FOIVYOOQUYHTKR-GARJFASQSA-N	0	3	318.343	2.482	10	0		DEAEHN
Cc1ccccc1[C@H](C)Cc1nc([C@H]2CNCCN2C)no1	ZINC000263201418	145335513	/nfs/dbraw/zinc/33/55/13/145335513.db2.gz	JCISNKGATXQNAQ-UKRRQHHQSA-N	0	3	300.406	2.300	10	0		DEAEHN
CCOc1cc(-c2nc([C@@H]3CNCCN3C)no2)ccc1C	ZINC000263229779	145338528	/nfs/dbraw/zinc/33/85/28/145338528.db2.gz	NFETXVIYYQWKDP-ZDUSSCGKSA-N	0	3	302.378	2.020	10	0		DEAEHN
C[C@H](Cc1ccccc1F)c1nc([C@@H]2CNCCN2C)no1	ZINC000263227213	145338773	/nfs/dbraw/zinc/33/87/73/145338773.db2.gz	MZLSMISFBVSHJN-RISCZKNCSA-N	0	3	304.369	2.131	10	0		DEAEHN
O[C@H](CCNCc1ccc(Br)cn1)C(F)(F)F	ZINC000349300403	146366652	/nfs/dbraw/zinc/36/66/52/146366652.db2.gz	SSLCUQUTCWRTDH-SECBINFHSA-N	0	3	313.117	2.247	10	0		DEAEHN
Cc1cc(NC(=O)c2cccc(O)c2)n(C2CCN(C)CC2)n1	ZINC000357315614	147085906	/nfs/dbraw/zinc/08/59/06/147085906.db2.gz	USLAPFUAKJMAMA-UHFFFAOYSA-N	0	3	314.389	2.416	10	0		DEAEHN
CCn1cc([C@H](C)NC[C@@H]2CCC3(CCOCC3)[C@@H]2O)cn1	ZINC000374789992	148290064	/nfs/dbraw/zinc/29/00/64/148290064.db2.gz	ASMWFMOAJPSUHE-OFQRWUPVSA-N	0	3	307.438	2.121	10	0		DEAEHN
CCOCCN(CC)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248123645	286078298	/nfs/dbraw/zinc/07/82/98/286078298.db2.gz	UXMFISPHGFOXOS-SJORKVTESA-N	0	3	319.449	2.500	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)NCc1ccc(C)cc1C	ZINC000111832614	401725226	/nfs/dbraw/zinc/72/52/26/401725226.db2.gz	CVOWXNZVVCEFBX-KRWDZBQOSA-N	0	3	319.449	2.213	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1c2ccccc2C[C@@H]1C	ZINC000111865941	401726543	/nfs/dbraw/zinc/72/65/43/401726543.db2.gz	XYQCVSQGDYWPOY-HOCLYGCPSA-N	0	3	317.433	2.258	10	0		DEAEHN
COCCOc1cccc(C(=O)N[C@H](CC(C)C)CN(C)C)c1	ZINC000072016976	401701017	/nfs/dbraw/zinc/70/10/17/401701017.db2.gz	FRQMLVBPBAMBSA-MRXNPFEDSA-N	0	3	322.449	2.418	10	0		DEAEHN
Cc1cccc(CNC(=O)CN2CCC(c3ccn[nH]3)CC2)c1	ZINC000111212542	401701269	/nfs/dbraw/zinc/70/12/69/401701269.db2.gz	VAAHPCYJLJFHJC-UHFFFAOYSA-N	0	3	312.417	2.214	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cc(Br)c[nH]2)CCN1C	ZINC000127726241	401747552	/nfs/dbraw/zinc/74/75/52/401747552.db2.gz	WKEAFYSXPQGGTE-KOLCDFICSA-N	0	3	314.227	2.332	10	0		DEAEHN
Cc1ncc(CNCC[C@H](C)[S@](C)=O)n1-c1ccccc1	ZINC000129317919	401802490	/nfs/dbraw/zinc/80/24/90/401802490.db2.gz	GMESAEGRBBTVBC-YEJXKQKISA-N	0	3	305.447	2.427	10	0		DEAEHN
COCCN(C)CCCNC(=O)N1CCC[C@]2(CC=CCC2)C1	ZINC000114589011	401803770	/nfs/dbraw/zinc/80/37/70/401803770.db2.gz	QZKAXPNHPMXXPP-GOSISDBHSA-N	0	3	323.481	2.487	10	0		DEAEHN
C[C@H](N[C@H]1CCC(=O)N(C)C1=O)c1cc2c(s1)CCCC2	ZINC000129521548	401805114	/nfs/dbraw/zinc/80/51/14/401805114.db2.gz	QQOLLIHLEPCOTJ-JQWIXIFHSA-N	0	3	306.431	2.425	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2coc(-c3cccs3)n2)CCO1	ZINC000075133139	401750882	/nfs/dbraw/zinc/75/08/82/401750882.db2.gz	ZNGVLPAJVWHTNR-CYBMUJFWSA-N	0	3	307.419	2.166	10	0		DEAEHN
O=C1CCCN1C[C@@H](O)CN[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000127987166	401758120	/nfs/dbraw/zinc/75/81/20/401758120.db2.gz	PMDHFXMTWKQMIT-RDJZCZTQSA-N	0	3	322.836	2.364	10	0		DEAEHN
CC(C)OC(=O)CCN1CCC(NC(=O)CC2CCCC2)CC1	ZINC000075719700	401767344	/nfs/dbraw/zinc/76/73/44/401767344.db2.gz	CTHBRRZQBPDFLB-UHFFFAOYSA-N	0	3	324.465	2.489	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(F)cc2nccnc21	ZINC000113226986	401770291	/nfs/dbraw/zinc/77/02/91/401770291.db2.gz	FIMHAGMBDUYWTM-DGCLKSJQSA-N	0	3	314.364	2.078	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)CCC(=O)c1cccs1	ZINC000113226600	401770522	/nfs/dbraw/zinc/77/05/22/401770522.db2.gz	IQXBFBZVYKXFFZ-CHWSQXEVSA-N	0	3	306.431	2.406	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)N[C@@H](CO)CC(C)(C)C	ZINC000128785790	401791841	/nfs/dbraw/zinc/79/18/41/401791841.db2.gz	FMRJCXGXQRVTDR-CQSZACIVSA-N	0	3	322.449	2.154	10	0		DEAEHN
CC1(C)NC(=O)N(CCCN2CCC[C@H]2c2ccco2)C1=O	ZINC000116290480	401848831	/nfs/dbraw/zinc/84/88/31/401848831.db2.gz	JVUJUYQKYHWKPV-LBPRGKRZSA-N	0	3	305.378	2.137	10	0		DEAEHN
COC(=O)c1cc(CN2CC[C@@H](c3cnn(C)c3)C2)oc1C	ZINC000116314967	401849361	/nfs/dbraw/zinc/84/93/61/401849361.db2.gz	XKKUMOCGBAAOLU-GFCCVEGCSA-N	0	3	303.362	2.098	10	0		DEAEHN
c1csc(-c2noc(-c3ccc(N4CCNCC4)nc3)n2)c1	ZINC000040351989	401925016	/nfs/dbraw/zinc/92/50/16/401925016.db2.gz	XDUNITBXYNUMKO-UHFFFAOYSA-N	0	3	313.386	2.270	10	0		DEAEHN
CC[C@@H]1CCCN(C(=O)NC[C@@H]2CCCN2CCOC)CC1	ZINC000117495179	401878479	/nfs/dbraw/zinc/87/84/79/401878479.db2.gz	HXZQHVMJZZTNKN-CVEARBPZSA-N	0	3	311.470	2.319	10	0		DEAEHN
C[C@@H](Oc1cccnc1)C(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000117746966	401882796	/nfs/dbraw/zinc/88/27/96/401882796.db2.gz	PCTBBNHFUMNBLV-PBHICJAKSA-N	0	3	313.401	2.268	10	0		DEAEHN
C[C@H]1c2ccccc2O[C@@H]1C(=O)NCCN1CCC(C)CC1	ZINC000117756268	401883333	/nfs/dbraw/zinc/88/33/33/401883333.db2.gz	IPJVTKWLKBRVMW-YOEHRIQHSA-N	0	3	302.418	2.399	10	0		DEAEHN
CC(C)Oc1cncc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000133381513	401883723	/nfs/dbraw/zinc/88/37/23/401883723.db2.gz	WEEGYBLPZHYTPB-DZGCQCFKSA-N	0	3	303.406	2.178	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)Nc2ccc(Cl)cc2F)CCO1	ZINC000118790860	401907738	/nfs/dbraw/zinc/90/77/38/401907738.db2.gz	SDWDHQDFLWKONY-NSHDSACASA-N	0	3	315.776	2.273	10	0		DEAEHN
O=C(c1cccc(Br)c1)N1CCN2CCC[C@H]2C1	ZINC000037503245	401914376	/nfs/dbraw/zinc/91/43/76/401914376.db2.gz	PEUOYHUIIAYRNL-ZDUSSCGKSA-N	0	3	309.207	2.369	10	0		DEAEHN
O=S(=O)([C@@H]1CCN(CCC2CCCC2)C1)N1CCCC1	ZINC000135737079	401952368	/nfs/dbraw/zinc/95/23/68/401952368.db2.gz	AVQAOXBYNVWPNU-OAHLLOKOSA-N	0	3	300.468	2.067	10	0		DEAEHN
CC[C@H](CO)NC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000119583359	401960079	/nfs/dbraw/zinc/96/00/79/401960079.db2.gz	VNTCDWUGFMSDQQ-AEFFLSMTSA-N	0	3	319.449	2.111	10	0		DEAEHN
COc1ccc(OCCC(=O)NCCN2CCCC[C@H]2C)cc1	ZINC000046859077	401974077	/nfs/dbraw/zinc/97/40/77/401974077.db2.gz	PGCIYTHZMPXFEO-OAHLLOKOSA-N	0	3	320.433	2.455	10	0		DEAEHN
C[C@H](NCCCN1CCCC1=O)c1nc2ccccc2n1C	ZINC000091265503	401995695	/nfs/dbraw/zinc/99/56/95/401995695.db2.gz	CTDWJKDRAGGRHR-ZDUSSCGKSA-N	0	3	300.406	2.236	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2ncc(-c3ccccc3F)o2)CCO1	ZINC000119298978	401939189	/nfs/dbraw/zinc/93/91/89/401939189.db2.gz	AOPCEURVARQEAK-CYBMUJFWSA-N	0	3	319.380	2.243	10	0		DEAEHN
C[C@H]1CC[C@H](C(=O)N(CCN(C)C)Cc2ccccc2F)O1	ZINC000150817441	401997013	/nfs/dbraw/zinc/99/70/13/401997013.db2.gz	NJVIZMPCTOAOSH-XJKSGUPXSA-N	0	3	308.397	2.283	10	0		DEAEHN
C[C@H](N[C@@H]1CCCCC[C@@H]1O)c1ccc(S(C)(=O)=O)cc1	ZINC000135665755	401949960	/nfs/dbraw/zinc/94/99/60/401949960.db2.gz	WZFADEFKDCBMKU-MAZHCROVSA-N	0	3	311.447	2.434	10	0		DEAEHN
NC(=O)NC(=O)OCCCN1CC=C(c2cccs2)CC1	ZINC000093174773	402013257	/nfs/dbraw/zinc/01/32/57/402013257.db2.gz	HSZKHSXFXXQCGI-UHFFFAOYSA-N	0	3	309.391	2.032	10	0		DEAEHN
Cn1c(Cl)c(Cl)cc1C(=O)N1CCN2CCC[C@H]2C1	ZINC000049516002	402018437	/nfs/dbraw/zinc/01/84/37/402018437.db2.gz	AHBVYWCCXLDFER-VIFPVBQESA-N	0	3	302.205	2.252	10	0		DEAEHN
CC[N@@H+]1CC[C@H](N(C)C(=O)c2ccc(OC)cc2[O-])[C@H](C)C1	ZINC000122302400	402071148	/nfs/dbraw/zinc/07/11/48/402071148.db2.gz	WGMGSDFVNYETTN-DOMZBBRYSA-N	0	3	306.406	2.203	10	0		DEAEHN
CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(OC)cc2[O-])[C@H](C)C1	ZINC000122302400	402071149	/nfs/dbraw/zinc/07/11/49/402071149.db2.gz	WGMGSDFVNYETTN-DOMZBBRYSA-N	0	3	306.406	2.203	10	0		DEAEHN
CC(C)N(CCN1CCCCCC1)C(=O)[C@H](C)N1CCCC1=O	ZINC000055169113	402077183	/nfs/dbraw/zinc/07/71/83/402077183.db2.gz	CAOCHICGJPYUKC-INIZCTEOSA-N	0	3	323.481	2.110	10	0		DEAEHN
COc1cc(C)c([C@@H](C)N[C@H]2CCC(=O)N(C)C2)cc1OC	ZINC000152362597	402092158	/nfs/dbraw/zinc/09/21/58/402092158.db2.gz	FRYQOOSXGBOZLD-OLZOCXBDSA-N	0	3	306.406	2.284	10	0		DEAEHN
CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)NC[C@](C)(O)CN(C)C)cc1	ZINC000153083719	402125942	/nfs/dbraw/zinc/12/59/42/402125942.db2.gz	RXNIXUDIDGNLGW-LNLFQRSKSA-N	0	3	318.461	2.342	10	0		DEAEHN
CC(C)c1ccc([C@@H]2C[C@H]2C(=O)NC[C@](C)(O)CN(C)C)cc1	ZINC000153083933	402126098	/nfs/dbraw/zinc/12/60/98/402126098.db2.gz	RXNIXUDIDGNLGW-SCTDSRPQSA-N	0	3	318.461	2.342	10	0		DEAEHN
COc1cccc(C(=O)N[C@@H](CN(C)C)c2ccccc2)c1O	ZINC000123456843	402128871	/nfs/dbraw/zinc/12/88/71/402128871.db2.gz	QZNVVCBOWOEYQD-HNNXBMFYSA-N	0	3	314.385	2.434	10	0		DEAEHN
O=C(N[C@H]1CCOc2ccccc21)N1CC[C@H](N2CCCC2)C1	ZINC000066174550	402129168	/nfs/dbraw/zinc/12/91/68/402129168.db2.gz	CCSSIHOKHAXTDC-HOCLYGCPSA-N	0	3	315.417	2.390	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)C(=O)c2ccc(Cl)cc2)CCN1C	ZINC000123761816	402144933	/nfs/dbraw/zinc/14/49/33/402144933.db2.gz	VMPCUPSGPCQDKP-RISCZKNCSA-N	0	3	308.809	2.464	10	0		DEAEHN
CCCCCCNC(=O)[C@H]1CCCN([C@@H]2CCCCNC2=O)C1	ZINC000153381840	402141997	/nfs/dbraw/zinc/14/19/97/402141997.db2.gz	QYLOFGOBTIVPMU-JKSUJKDBSA-N	0	3	323.481	2.064	10	0		DEAEHN
Cc1cc(F)ccc1CN1CCC[C@H](C(=O)N2CCOCC2)C1	ZINC000124484978	402182082	/nfs/dbraw/zinc/18/20/82/402182082.db2.gz	QGUJMIWUZIRVQU-INIZCTEOSA-N	0	3	320.408	2.205	10	0		DEAEHN
COC[C@@H](C)C(=O)Nc1ccccc1NC1CCN(C)CC1	ZINC000103434364	402187834	/nfs/dbraw/zinc/18/78/34/402187834.db2.gz	BCBJTIRKUMYSMF-CYBMUJFWSA-N	0	3	305.422	2.414	10	0		DEAEHN
COC[C@@H](C)C(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1	ZINC000103432744	402188072	/nfs/dbraw/zinc/18/80/72/402188072.db2.gz	OMAOYFXLIYWQIR-GFCCVEGCSA-N	0	3	314.376	2.138	10	0		DEAEHN
COC[C@H](C)C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000103432970	402188102	/nfs/dbraw/zinc/18/81/02/402188102.db2.gz	NOWAVZUOCDZFJI-ZDUSSCGKSA-N	0	3	310.463	2.359	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)CCOc1ccc(C=O)cc1	ZINC000068279500	402190226	/nfs/dbraw/zinc/19/02/26/402190226.db2.gz	NURFOIZTULPMEY-OAHLLOKOSA-N	0	3	318.417	2.259	10	0		DEAEHN
CC1CCC(N2CCN(C(=O)CCc3ccnn3C)CC2)CC1	ZINC000124826383	402199383	/nfs/dbraw/zinc/19/93/83/402199383.db2.gz	VVLRABVBJMBSKV-UHFFFAOYSA-N	0	3	318.465	2.076	10	0		DEAEHN
CCC(C)(CC)NC(=O)NCc1ccnc(OCCN(C)C)c1	ZINC000153680245	402162593	/nfs/dbraw/zinc/16/25/93/402162593.db2.gz	WLKLSAPTKWIEAL-UHFFFAOYSA-N	0	3	322.453	2.400	10	0		DEAEHN
CC(C)C[C@H](N)C(=O)N1CCC(NC(=O)C2CCCCC2)CC1	ZINC000153815145	402171614	/nfs/dbraw/zinc/17/16/14/402171614.db2.gz	KCCHUZUTAARWKM-INIZCTEOSA-N	0	3	323.481	2.047	10	0		DEAEHN
CN(CC(=O)N1CCC[C@H](C(F)(F)F)C1)C[C@H]1CCCOC1	ZINC000107686669	402237854	/nfs/dbraw/zinc/23/78/54/402237854.db2.gz	PKXJRRNRKLQVBU-OLZOCXBDSA-N	0	3	322.371	2.146	10	0		DEAEHN
COc1cc(Cl)ccc1CNC(=O)N1CC[C@H](N(C)C)C1	ZINC000107858178	402242038	/nfs/dbraw/zinc/24/20/38/402242038.db2.gz	VIKNAWXMVQLGRW-ZDUSSCGKSA-N	0	3	311.813	2.194	10	0		DEAEHN
CC(C)CN1CCC[C@@H]1CN[C@@H](C(N)=O)c1ccc(F)cc1	ZINC000155208570	402248861	/nfs/dbraw/zinc/24/88/61/402248861.db2.gz	SEEVIFOCNIAXTK-HZPDHXFCSA-N	0	3	307.413	2.062	10	0		DEAEHN
CC(C)(O)CNC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000108566858	402257486	/nfs/dbraw/zinc/25/74/86/402257486.db2.gz	GYJLIJFNXJNWSU-MRXNPFEDSA-N	0	3	319.449	2.111	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(CC(=O)N2CCCCC2)C1	ZINC000105896601	402210625	/nfs/dbraw/zinc/21/06/25/402210625.db2.gz	UOFTXCCSZFHZNN-OAHLLOKOSA-N	0	3	304.438	2.095	10	0		DEAEHN
CCCCOC(=O)CCN1CCC(Cc2nccn2C)CC1	ZINC000105918468	402211515	/nfs/dbraw/zinc/21/15/15/402211515.db2.gz	MKNKXNCNOITQAC-UHFFFAOYSA-N	0	3	307.438	2.408	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2ncc(-c3ccccc3)o2)CCO1	ZINC000105925218	402211558	/nfs/dbraw/zinc/21/15/58/402211558.db2.gz	HWXDZYAZIWQJIS-HNNXBMFYSA-N	0	3	301.390	2.104	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)NCCCc2cccc(F)c2)C1	ZINC000109399727	402271917	/nfs/dbraw/zinc/27/19/17/402271917.db2.gz	GSJMUAMUQGXKBY-HNNXBMFYSA-N	0	3	307.413	2.399	10	0		DEAEHN
CC[C@@H]1CCC[C@@H](NC(=O)NC[C@H](O)CN2CCCCC2)C1	ZINC000155953005	402272772	/nfs/dbraw/zinc/27/27/72/402272772.db2.gz	CXYMLZSXKPHZAN-OAGGEKHMSA-N	0	3	311.470	2.101	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NC[C@@H](c1ccco1)N(C)C	ZINC000176143765	402283678	/nfs/dbraw/zinc/28/36/78/402283678.db2.gz	CJWTXBPYLPPEQW-GJZGRUSLSA-N	0	3	322.453	2.008	10	0		DEAEHN
C[C@H]1c2ccccc2CCN1C[C@@H]1CCCN(S(C)(=O)=O)C1	ZINC000176333223	402300517	/nfs/dbraw/zinc/30/05/17/402300517.db2.gz	OZNRKZYPHHQSLM-GJZGRUSLSA-N	0	3	322.474	2.277	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@@H](COC)c1ccc(C)o1	ZINC000176436743	402309231	/nfs/dbraw/zinc/30/92/31/402309231.db2.gz	WRDMLURIMFZYBV-GJZGRUSLSA-N	0	3	323.437	2.401	10	0		DEAEHN
CO[C@@H](C)c1nc(C)c(C(=O)NC[C@H](C)N(C)C2CC2)s1	ZINC000176438060	402309868	/nfs/dbraw/zinc/30/98/68/402309868.db2.gz	VZHSWCKFWNFPOJ-ONGXEEELSA-N	0	3	311.451	2.371	10	0		DEAEHN
CC[C@H](Oc1cccc(C)c1)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000176519903	402316694	/nfs/dbraw/zinc/31/66/94/402316694.db2.gz	KWXNMLIFJFPGIP-WBVHZDCISA-N	0	3	302.418	2.459	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000185058384	402321263	/nfs/dbraw/zinc/32/12/63/402321263.db2.gz	IQUVYCSBKZIUSO-OAHLLOKOSA-N	0	3	303.406	2.246	10	0		DEAEHN
Cc1cnn(CCCCCN2CC[C@@](O)(C(F)(F)F)C2)c1	ZINC000177281789	402387401	/nfs/dbraw/zinc/38/74/01/402387401.db2.gz	XWTMZDWWRRNEKU-ZDUSSCGKSA-N	0	3	305.344	2.361	10	0		DEAEHN
CN1CCN(S(=O)(=O)/C=C/c2ccccc2)c2cnccc21	ZINC000176975944	402355928	/nfs/dbraw/zinc/35/59/28/402355928.db2.gz	AZEYQCDLWUVODK-XYOKQWHBSA-N	0	3	315.398	2.339	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1ccccc1OC	ZINC000177025505	402360913	/nfs/dbraw/zinc/36/09/13/402360913.db2.gz	XPTZFCXPWPOIPV-OAHLLOKOSA-N	0	3	305.422	2.321	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCOc1cccc(C)c1	ZINC000177025095	402361010	/nfs/dbraw/zinc/36/10/10/402361010.db2.gz	NCVOCQRWOZWNRM-MRXNPFEDSA-N	0	3	319.449	2.500	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(OCCOC)cc1	ZINC000177043772	402362881	/nfs/dbraw/zinc/36/28/81/402362881.db2.gz	MSEZXRPRCRNDNH-MRXNPFEDSA-N	0	3	320.433	2.268	10	0		DEAEHN
C/C=C/C[C@H](CO)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000185906273	402388304	/nfs/dbraw/zinc/38/83/04/402388304.db2.gz	RUIZNSDYMRKRSX-KRJKFKNKSA-N	0	3	317.433	2.058	10	0		DEAEHN
Cc1ccc(CS(=O)(=O)C(C)C(=O)N2CCCCC2)c(C)n1	ZINC000185246563	402337972	/nfs/dbraw/zinc/33/79/72/402337972.db2.gz	LZKNOZLGCZBTIL-CQSZACIVSA-N	0	3	324.446	2.014	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)Nc1cccn(Cc2ccccc2)c1=O	ZINC000161869996	402402043	/nfs/dbraw/zinc/40/20/43/402402043.db2.gz	KUXGOBDKODEUBE-CZUORRHYSA-N	0	3	313.401	2.209	10	0		DEAEHN
COCCC1(CNC(=O)N2CCN3CCC[C@@H]3C2)CCCCC1	ZINC000186283698	402417768	/nfs/dbraw/zinc/41/77/68/402417768.db2.gz	MJHGHRRCXBMZPH-MRXNPFEDSA-N	0	3	323.481	2.463	10	0		DEAEHN
CN1CCO[C@H](CNCc2ccc(F)c(C(F)(F)F)c2)C1	ZINC000162602905	402425936	/nfs/dbraw/zinc/42/59/36/402425936.db2.gz	GDYICZSEXNODBE-LLVKDONJSA-N	0	3	306.303	2.265	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)NCc1ccn2ccnc2c1	ZINC000177712415	402429362	/nfs/dbraw/zinc/42/93/62/402429362.db2.gz	XRSGIKMMBNSWFI-CQSZACIVSA-N	0	3	315.421	2.008	10	0		DEAEHN
C[C@@H](C(=O)N1CCC[C@@H]1Cn1ccnc1)N1CCCCCC1	ZINC000177774969	402434446	/nfs/dbraw/zinc/43/44/46/402434446.db2.gz	PKJXOAYEXUPHLF-JKSUJKDBSA-N	0	3	304.438	2.139	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](N[C@@H](Cc2ccc(Cl)cc2)C(N)=O)C1	ZINC000185947599	402391817	/nfs/dbraw/zinc/39/18/17/402391817.db2.gz	ABYGCGGRDMUVKX-KCXAZCMYSA-N	0	3	323.868	2.055	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN([C@H]2CCN(C(C)C)C2=O)C1	ZINC000245469648	402463940	/nfs/dbraw/zinc/46/39/40/402463940.db2.gz	MAXACAXGTWJAQV-GJZGRUSLSA-N	0	3	304.438	2.092	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN([C@H](C)C(=O)N(C)C(C)C)C1	ZINC000245481387	402464661	/nfs/dbraw/zinc/46/46/61/402464661.db2.gz	YFIZHTVPGOXAKW-CABCVRRESA-N	0	3	306.454	2.338	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN([C@H](C)C(=O)N(C)C(C)C)C1	ZINC000245481388	402464804	/nfs/dbraw/zinc/46/48/04/402464804.db2.gz	YFIZHTVPGOXAKW-HUUCEWRRSA-N	0	3	306.454	2.338	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N(C)CCc2nccs2)C1	ZINC000245502671	402466571	/nfs/dbraw/zinc/46/65/71/402466571.db2.gz	CBNXIDIDQPWHPC-CHWSQXEVSA-N	0	3	310.467	2.056	10	0		DEAEHN
COc1cccc([C@@H](C)N[C@H](C(=O)N2CCOCC2)C(C)C)c1	ZINC000164898072	402470153	/nfs/dbraw/zinc/47/01/53/402470153.db2.gz	HMSSADFNGIQTHI-PBHICJAKSA-N	0	3	320.433	2.229	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)NC1CCC(C)CC1	ZINC000178286583	402479678	/nfs/dbraw/zinc/47/96/78/402479678.db2.gz	PDTLNCHHZVKCCE-PREGVCBESA-N	0	3	318.465	2.351	10	0		DEAEHN
CNC(=O)c1ccc(CN2CCC[C@@H]2Cn2ccnc2C)cc1	ZINC000178290520	402480545	/nfs/dbraw/zinc/48/05/45/402480545.db2.gz	KFKHAULIBLUHMI-QGZVFWFLSA-N	0	3	312.417	2.216	10	0		DEAEHN
CCO[C@H]1C[C@H](O)C12CCN(Cc1ccc(C)nc1C)CC2	ZINC000187075719	402481069	/nfs/dbraw/zinc/48/10/69/402481069.db2.gz	MQIOWEIVPSSTNZ-IRXDYDNUSA-N	0	3	304.434	2.450	10	0		DEAEHN
CCO[C@@H]1C[C@H](O)C12CCN(Cc1ccc(C)nc1C)CC2	ZINC000187075702	402481123	/nfs/dbraw/zinc/48/11/23/402481123.db2.gz	MQIOWEIVPSSTNZ-DLBZAZTESA-N	0	3	304.434	2.450	10	0		DEAEHN
CC(C)[C@@H](C(=O)NCc1ccc(CO)c(F)c1)N1CCCCC1	ZINC000178313057	402483764	/nfs/dbraw/zinc/48/37/64/402483764.db2.gz	XWLFUMUBVUDCBG-KRWDZBQOSA-N	0	3	322.424	2.445	10	0		DEAEHN
C[C@@H](CCNCc1cncc(Br)c1)[S@@](C)=O	ZINC000166506152	402484930	/nfs/dbraw/zinc/48/49/30/402484930.db2.gz	PLSSCEYHKHGREX-FVMDXXJSSA-N	0	3	305.241	2.091	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2ccnc(OC3CCC3)c2)C1	ZINC000245748720	402485485	/nfs/dbraw/zinc/48/54/85/402485485.db2.gz	APCFYLQOAKXSDY-XJKSGUPXSA-N	0	3	317.433	2.471	10	0		DEAEHN
c1ccc(-c2nnc3ccc(N4CCN5CCC[C@H]5C4)nn32)cc1	ZINC000245839917	402490244	/nfs/dbraw/zinc/49/02/44/402490244.db2.gz	FQPPHTZOJLJJHQ-HNNXBMFYSA-N	0	3	320.400	2.076	10	0		DEAEHN
O=C(N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)N1CCN2CCC[C@@H]2C1	ZINC000178448173	402500268	/nfs/dbraw/zinc/50/02/68/402500268.db2.gz	VDMFLRWSAPNSRG-NRSFXHEJSA-N	0	3	311.429	2.204	10	0		DEAEHN
Cc1cccc(CS(=O)(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000246041955	402505567	/nfs/dbraw/zinc/50/55/67/402505567.db2.gz	BHWGYCJRQUISCR-GOEBONIOSA-N	0	3	310.463	2.239	10	0		DEAEHN
Cc1ccc(N2CCC[C@@H](N[C@H]3CCCS(=O)(=O)C3)C2)cc1	ZINC000246095420	402509390	/nfs/dbraw/zinc/50/93/90/402509390.db2.gz	XHVPDQVPFARJDG-CVEARBPZSA-N	0	3	322.474	2.131	10	0		DEAEHN
C[C@@H](C(=O)N1C[C@H](C)C[C@H](C)C1)N1CC[C@H]2OCCC[C@@H]2C1	ZINC000246762286	402543995	/nfs/dbraw/zinc/54/39/95/402543995.db2.gz	QCSVAFAALGVPDZ-DMRKSPOLSA-N	0	3	308.466	2.380	10	0		DEAEHN
CCC1(CC)[C@H](NC(=O)N2CC[C@@H](N3CC=CC3)C2)C[C@H]1OC	ZINC000246774487	402544369	/nfs/dbraw/zinc/54/43/69/402544369.db2.gz	IEZJJMMVFQGHQN-BZUAXINKSA-N	0	3	321.465	2.236	10	0		DEAEHN
C[C@@H](C(=O)NC(=O)NCC(F)(F)F)N1CC[C@@H](C)C[C@H](C)C1	ZINC000246884963	402548438	/nfs/dbraw/zinc/54/84/38/402548438.db2.gz	WZGPLDQVBXXPAN-VWYCJHECSA-N	0	3	323.359	2.131	10	0		DEAEHN
CN(C)[C@@H](CNC(=O)CSC1CCOCC1)c1ccccc1	ZINC000178881576	402550334	/nfs/dbraw/zinc/55/03/34/402550334.db2.gz	CVVULCUAGMMHFG-INIZCTEOSA-N	0	3	322.474	2.318	10	0		DEAEHN
COc1ccc(SCC(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1	ZINC000247313569	402563661	/nfs/dbraw/zinc/56/36/61/402563661.db2.gz	OESOVVQAXFSGEN-KGLIPLIRSA-N	0	3	320.458	2.482	10	0		DEAEHN
Cc1ccc(N2CCCN(C[C@@H](O)c3ccccc3)CC2)nn1	ZINC000247377961	402565758	/nfs/dbraw/zinc/56/57/58/402565758.db2.gz	VOFFQYHTSLGOBX-QGZVFWFLSA-N	0	3	312.417	2.031	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(-c2ccccc2)n[nH]1	ZINC000247475058	402568331	/nfs/dbraw/zinc/56/83/31/402568331.db2.gz	SAGRMXFEEAITBB-ZFWWWQNUSA-N	0	3	310.401	2.385	10	0		DEAEHN
Cc1cnc(CCN(C)C(=O)NC2CCN(C3CC3)CC2)s1	ZINC000179073171	402570376	/nfs/dbraw/zinc/57/03/76/402570376.db2.gz	SUNJBLBVTHJQOG-UHFFFAOYSA-N	0	3	322.478	2.262	10	0		DEAEHN
COc1cc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)cc(OC)c1C	ZINC000247559558	402571971	/nfs/dbraw/zinc/57/19/71/402571971.db2.gz	ZXXLPMYFNMEIJJ-IUODEOHRSA-N	0	3	318.417	2.321	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(F)cc2nc[nH]c21	ZINC000247560450	402572148	/nfs/dbraw/zinc/57/21/48/402572148.db2.gz	ZZXIXTYLCMASDW-JQWIXIFHSA-N	0	3	302.353	2.011	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCCc2cccnc2)[C@@H]1c1ccccc1	ZINC000179098670	402572810	/nfs/dbraw/zinc/57/28/10/402572810.db2.gz	QJDNTCJRCIPASE-ROUUACIJSA-N	0	3	324.428	2.369	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Cc2c[nH]c3cc(F)ccc23)C1	ZINC000171268618	402573275	/nfs/dbraw/zinc/57/32/75/402573275.db2.gz	NLVYRMZWHCHJCZ-AWEZNQCLSA-N	0	3	303.381	2.450	10	0		DEAEHN
CC(C)[C@H](C(=O)N[C@H]1Cc2ccccc2[C@H]1O)N1CCCCC1	ZINC000246193328	402517444	/nfs/dbraw/zinc/51/74/44/402517444.db2.gz	IXKTUBSMUAAWET-RCCFBDPRSA-N	0	3	316.445	2.271	10	0		DEAEHN
Cc1ccccc1[C@H](C)NC(=O)[C@H](C)N1CCN2CCC[C@@H]2C1	ZINC000178626371	402518855	/nfs/dbraw/zinc/51/88/55/402518855.db2.gz	VYFRHOHSGLGZIM-YESZJQIVSA-N	0	3	315.461	2.341	10	0		DEAEHN
COc1ccc(C)cc1NC(=O)[C@H](C)N1CCN2CCC[C@@H]2C1	ZINC000178630081	402519441	/nfs/dbraw/zinc/51/94/41/402519441.db2.gz	IMVKDRDQPRAORX-LSDHHAIUSA-N	0	3	317.433	2.111	10	0		DEAEHN
CC(C)N(C(=O)CN1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000178628241	402519484	/nfs/dbraw/zinc/51/94/84/402519484.db2.gz	GHWSYUUJCLXYKM-QGZVFWFLSA-N	0	3	301.434	2.208	10	0		DEAEHN
COC(=O)c1cccc(NC(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)c1	ZINC000246249197	402520091	/nfs/dbraw/zinc/52/00/91/402520091.db2.gz	PEHPKIVQSAXLIX-IUODEOHRSA-N	0	3	319.405	2.323	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccc(N2CCCC2=O)cc1)N(C)C	ZINC000178646332	402521229	/nfs/dbraw/zinc/52/12/29/402521229.db2.gz	IKIBZYTXKKRVHX-INIZCTEOSA-N	0	3	317.433	2.160	10	0		DEAEHN
CC(C)CN1CCC[C@@H]1CNC(=O)c1cn2ccnc2s1	ZINC000188718775	402524925	/nfs/dbraw/zinc/52/49/25/402524925.db2.gz	PXNXTVKZQFMOPB-GFCCVEGCSA-N	0	3	306.435	2.246	10	0		DEAEHN
Cc1noc2nc(C3CC3)cc(C(=O)N3CC[C@@H](N(C)C)C3)c12	ZINC000170857017	402533639	/nfs/dbraw/zinc/53/36/39/402533639.db2.gz	HZQVZDLTCJCGEZ-GFCCVEGCSA-N	0	3	314.389	2.185	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCc2nc3ccccc3s2)C1	ZINC000170861277	402534117	/nfs/dbraw/zinc/53/41/17/402534117.db2.gz	WMAFRDNVRAPCHQ-LLVKDONJSA-N	0	3	304.419	2.142	10	0		DEAEHN
CCOC(=O)C(C)(C)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179427825	402589356	/nfs/dbraw/zinc/58/93/56/402589356.db2.gz	YQLSAUMKCAANCG-LSDHHAIUSA-N	0	3	318.417	2.137	10	0		DEAEHN
O=C(NCCc1ccc(F)c(F)c1)N1CC[C@@H](N2CC=CC2)C1	ZINC000190332375	402593098	/nfs/dbraw/zinc/59/30/98/402593098.db2.gz	UUVJZAZKSALPOQ-CQSZACIVSA-N	0	3	321.371	2.163	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)N[C@H]2CCOc3ccccc32)C1	ZINC000171582816	402597148	/nfs/dbraw/zinc/59/71/48/402597148.db2.gz	GKXPWZUXYFRYJX-HIFRSBDPSA-N	0	3	303.406	2.246	10	0		DEAEHN
CN1CC[C@H](NC(=O)N[C@@H]2CCCOCC2)[C@@H]1c1ccccc1	ZINC000179676308	402597708	/nfs/dbraw/zinc/59/77/08/402597708.db2.gz	YTNQZWWUOFOIGF-IKGGRYGDSA-N	0	3	317.433	2.300	10	0		DEAEHN
CCn1nccc1CN1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190478318	402604202	/nfs/dbraw/zinc/60/42/02/402604202.db2.gz	OJMDAGVYNWRFAC-QGZVFWFLSA-N	0	3	313.449	2.252	10	0		DEAEHN
C[C@H]1OCCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccccc1	ZINC000190475239	402604233	/nfs/dbraw/zinc/60/42/33/402604233.db2.gz	CJUHDITZZRNCIM-WBVHZDCISA-N	0	3	304.434	2.392	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)[C@H]2CCCO[C@@H]2C)o1	ZINC000190478425	402604237	/nfs/dbraw/zinc/60/42/37/402604237.db2.gz	JMGZKLQXVPJGRQ-ZBFHGGJFSA-N	0	3	308.422	2.293	10	0		DEAEHN
CSc1cccc(NC(=O)CN2CCN3CCC[C@@H]3C2)c1	ZINC000171642433	402605217	/nfs/dbraw/zinc/60/52/17/402605217.db2.gz	NWBLZUCIJXHPPH-CQSZACIVSA-N	0	3	305.447	2.127	10	0		DEAEHN
COc1cc(CN2CCC(N3CCO[C@H](C)C3)CC2)ccc1O	ZINC000180069333	402606495	/nfs/dbraw/zinc/60/64/95/402606495.db2.gz	CCJPJPVXBOVIFL-CQSZACIVSA-N	0	3	320.433	2.086	10	0		DEAEHN
COc1cc(CN[C@@H]2CCN(c3ncccc3F)C2)ccc1O	ZINC000180162862	402609147	/nfs/dbraw/zinc/60/91/47/402609147.db2.gz	NAINTNVTAWJVLE-CYBMUJFWSA-N	0	3	317.364	2.303	10	0		DEAEHN
CCN(CC)CC(=O)N1CCC(Oc2ccc(C)cn2)CC1	ZINC000180856186	402628223	/nfs/dbraw/zinc/62/82/23/402628223.db2.gz	XPWHRWKMPARIEA-UHFFFAOYSA-N	0	3	305.422	2.102	10	0		DEAEHN
CCC[C@@H](CC)NC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000180437137	402616904	/nfs/dbraw/zinc/61/69/04/402616904.db2.gz	QDQSZLWAFPCUDZ-SJORKVTESA-N	0	3	324.513	2.377	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N[C@@H]1CCc3ncnn3C1)CCCO2	ZINC000180604048	402621237	/nfs/dbraw/zinc/62/12/37/402621237.db2.gz	WRUZMHUAFYMUIX-DOMZBBRYSA-N	0	3	314.389	2.105	10	0		DEAEHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)NC[C@H]1CCC(C)(C)O1	ZINC000249131230	402621965	/nfs/dbraw/zinc/62/19/65/402621965.db2.gz	DQWPMCVCUGXHMI-RBSFLKMASA-N	0	3	311.470	2.364	10	0		DEAEHN
CCc1nc([C@H](C)NC(=O)N2CCN3CCC[C@@H]3C2)cs1	ZINC000171780352	402622153	/nfs/dbraw/zinc/62/21/53/402622153.db2.gz	SXFGEBPVVPOZTJ-NWDGAFQWSA-N	0	3	308.451	2.256	10	0		DEAEHN
C[C@@H](CNC(=O)Nc1nncs1)N(C)Cc1ccccc1	ZINC000171810079	402624681	/nfs/dbraw/zinc/62/46/81/402624681.db2.gz	GIKXOLSBPZSRNI-NSHDSACASA-N	0	3	305.407	2.180	10	0		DEAEHN
C[C@@H](CNC(=O)NCCCc1ccccn1)N1CCC[C@@H](C)C1	ZINC000179170795	402577610	/nfs/dbraw/zinc/57/76/10/402577610.db2.gz	WPMAWNCQMFSXBS-CVEARBPZSA-N	0	3	318.465	2.434	10	0		DEAEHN
CC(C)Oc1cccc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)n1	ZINC000179168858	402577670	/nfs/dbraw/zinc/57/76/70/402577670.db2.gz	VVFQTULOPBQTMC-ZFWWWQNUSA-N	0	3	305.422	2.327	10	0		DEAEHN
CCOc1ccc(CNC(=O)N2CCN3CCC[C@@H]3C2)cc1F	ZINC000171907553	402633277	/nfs/dbraw/zinc/63/32/77/402633277.db2.gz	GLXHBRWZVSMTIH-CQSZACIVSA-N	0	3	321.396	2.214	10	0		DEAEHN
CC[C@H](CNC(=O)N1CCO[C@@H](CN(C)C)C1)c1ccccc1	ZINC000172116847	402640822	/nfs/dbraw/zinc/64/08/22/402640822.db2.gz	QHMAVLMIYYZMDA-WBVHZDCISA-N	0	3	319.449	2.152	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)N[C@H]2COc3ccccc32)C1	ZINC000250219782	402646170	/nfs/dbraw/zinc/64/61/70/402646170.db2.gz	YHZZNSJJJRNQTJ-HIFRSBDPSA-N	0	3	303.406	2.151	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)CN[C@@H]2CCCC[C@H]2n2cccn2)C1	ZINC000251927426	402651398	/nfs/dbraw/zinc/65/13/98/402651398.db2.gz	XQFQYOZWZRTGJZ-BZUAXINKSA-N	0	3	304.438	2.215	10	0		DEAEHN
CCN(CC)C(=O)[C@H]1CCCN1C(=O)[C@H](C)N1CCCCCC1	ZINC000172365028	402652784	/nfs/dbraw/zinc/65/27/84/402652784.db2.gz	CDDJPIILEBYDDA-JKSUJKDBSA-N	0	3	323.481	2.110	10	0		DEAEHN
Cc1ccc(Br)nc1C(=O)N1CCN2CCC[C@H]2C1	ZINC000191264802	402655770	/nfs/dbraw/zinc/65/57/70/402655770.db2.gz	GXTISYXVPRHGRM-NSHDSACASA-N	0	3	324.222	2.073	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)Cc1ccccc1C	ZINC000173831265	402714494	/nfs/dbraw/zinc/71/44/94/402714494.db2.gz	ZOOGMQUBXBNMFJ-DLBZAZTESA-N	0	3	322.474	2.383	10	0		DEAEHN
CC(C)N1C[C@H](NS(=O)(=O)CC2CCCCC2)[C@@H](C)C1	ZINC000173886201	402717173	/nfs/dbraw/zinc/71/71/73/402717173.db2.gz	WVZDNLZMOXSLDX-ZFWWWQNUSA-N	0	3	302.484	2.215	10	0		DEAEHN
Cc1c([C@H](C)NC[C@@]2(CCO)CCOC2)cnn1C(C)(C)C	ZINC000191344707	402662634	/nfs/dbraw/zinc/66/26/34/402662634.db2.gz	CBBDVMLUNLYIIY-SUMWQHHRSA-N	0	3	309.454	2.386	10	0		DEAEHN
CN1CCC(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCO3)CC1	ZINC000172765948	402674921	/nfs/dbraw/zinc/67/49/21/402674921.db2.gz	YCVCTQVVTBCVMV-OAHLLOKOSA-N	0	3	316.401	2.421	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N[C@H]1CCc3ncnn3C1)CCS2	ZINC000191529763	402676725	/nfs/dbraw/zinc/67/67/25/402676725.db2.gz	SXZXYVGGKAQBBR-FZMZJTMJSA-N	0	3	316.430	2.428	10	0		DEAEHN
CC[C@@H]1CN(C[C@H](O)CCc2ccccc2)CCN1CCOC	ZINC000182341765	402682260	/nfs/dbraw/zinc/68/22/60/402682260.db2.gz	OTLTVZWOJRZHPF-RTBURBONSA-N	0	3	320.477	2.023	10	0		DEAEHN
O=C(CCN1CCCC[C@@H]1CN1CCOCC1)c1ccccc1	ZINC000182368815	402684745	/nfs/dbraw/zinc/68/47/45/402684745.db2.gz	NAKCYDNNHPXFNP-GOSISDBHSA-N	0	3	316.445	2.446	10	0		DEAEHN
Cc1ccc(/C=C\CC(=O)NC[C@@H](O)CN2CCCCC2)cc1	ZINC000255382557	402686264	/nfs/dbraw/zinc/68/62/64/402686264.db2.gz	ORJVMCIUHFYWFK-OOFWQKGWSA-N	0	3	316.445	2.361	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@H](C)C(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000173215468	402688936	/nfs/dbraw/zinc/68/89/36/402688936.db2.gz	ZKDAUBPUQCVBSF-ZENOOKHLSA-N	0	3	320.481	2.157	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)S(=O)(=O)Cc2cccc(F)c2)CCN1C	ZINC000173268069	402690330	/nfs/dbraw/zinc/69/03/30/402690330.db2.gz	MPYVYUDEBYZEBN-IUODEOHRSA-N	0	3	314.426	2.070	10	0		DEAEHN
CCc1nnc(CN[C@@H]2CCC[C@H]2CNC(=O)OC(C)(C)C)[nH]1	ZINC000191916317	402698507	/nfs/dbraw/zinc/69/85/07/402698507.db2.gz	MXECWJSHIWHUSC-NWDGAFQWSA-N	0	3	323.441	2.150	10	0		DEAEHN
CCc1nnc(C[NH2+][C@@H]2CCC[C@H]2CNC(=O)OC(C)(C)C)[n-]1	ZINC000191916317	402698510	/nfs/dbraw/zinc/69/85/10/402698510.db2.gz	MXECWJSHIWHUSC-NWDGAFQWSA-N	0	3	323.441	2.150	10	0		DEAEHN
CN(C(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C)c1ccc(F)cc1	ZINC000262468424	402726210	/nfs/dbraw/zinc/72/62/10/402726210.db2.gz	JBDZXNWZGVPNCI-JKIFEVAISA-N	0	3	306.381	2.321	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)N1Cc2ccccc2C1	ZINC000262544608	402727376	/nfs/dbraw/zinc/72/73/76/402727376.db2.gz	RPCQTKDBGKMILX-RKVPGOIHSA-N	0	3	300.402	2.061	10	0		DEAEHN
CCc1ccc([C@H](COC)NC(=O)N[C@H]2CCCN(CC)C2)o1	ZINC000174236552	402733334	/nfs/dbraw/zinc/73/33/34/402733334.db2.gz	SPWVCAUDILRVDZ-ZFWWWQNUSA-N	0	3	323.437	2.313	10	0		DEAEHN
C[C@@H](NCC(=O)N(C)CCCOc1ccccc1)[C@H]1CCCO1	ZINC000183124632	402741282	/nfs/dbraw/zinc/74/12/82/402741282.db2.gz	VCPRSCAAYOHKKK-NVXWUHKLSA-N	0	3	320.433	2.071	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)Nc2cnn(CC3CC3)c2)CCN1C	ZINC000174452738	402741930	/nfs/dbraw/zinc/74/19/30/402741930.db2.gz	ZEQGSBPFACNRPU-SWLSCSKDSA-N	0	3	305.426	2.240	10	0		DEAEHN
CCCCNC(=O)CN[C@@H](C)c1ccccc1-n1cccn1	ZINC000183142915	402742772	/nfs/dbraw/zinc/74/27/72/402742772.db2.gz	NSUNLYYFWRAOEV-AWEZNQCLSA-N	0	3	300.406	2.439	10	0		DEAEHN
Cc1cnc([C@@H](C)CNC(=O)N2CC[C@H](N3CC=CC3)C2)s1	ZINC000183192978	402746430	/nfs/dbraw/zinc/74/64/30/402746430.db2.gz	NPUIRPNOXRHMJG-JSGCOSHPSA-N	0	3	320.462	2.211	10	0		DEAEHN
CNC(=O)C(C)(C)CN[C@@H](C)c1ccc(OC)c(NC(C)=O)c1	ZINC000183215918	402747732	/nfs/dbraw/zinc/74/77/32/402747732.db2.gz	WGHSAGDXMPHRRL-NSHDSACASA-N	0	3	321.421	2.076	10	0		DEAEHN
C[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)c1ccnn1C	ZINC000192750837	402747949	/nfs/dbraw/zinc/74/79/49/402747949.db2.gz	YYALBOLHORBWST-CQSZACIVSA-N	0	3	312.417	2.376	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)C1CCN(C2CC2)CC1	ZINC000192857047	402753712	/nfs/dbraw/zinc/75/37/12/402753712.db2.gz	XYPPCHNBTFFKMI-UHFFFAOYSA-N	0	3	306.381	2.325	10	0		DEAEHN
CCCC[C@H](CC)CN1CCN(c2ccc3nncn3n2)CC1	ZINC000183613053	402781600	/nfs/dbraw/zinc/78/16/00/402781600.db2.gz	HLWDLZPWQOZGDO-HNNXBMFYSA-N	0	3	316.453	2.463	10	0		DEAEHN
Cc1cccc(CSCc2nc([C@@H]3CNCCN3C)no2)c1	ZINC000263299896	402755704	/nfs/dbraw/zinc/75/57/04/402755704.db2.gz	WXROHBBERUIUCC-AWEZNQCLSA-N	0	3	318.446	2.388	10	0		DEAEHN
C[C@@H](OC1CCCCCC1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263318517	402758302	/nfs/dbraw/zinc/75/83/02/402758302.db2.gz	ZVWCKBLWZSXJOO-OCCSQVGLSA-N	0	3	308.426	2.446	10	0		DEAEHN
C[C@H](NC(=O)N(CCN(C)C)C[C@@H]1CCCO1)C1CCCC1	ZINC000174921882	402763248	/nfs/dbraw/zinc/76/32/48/402763248.db2.gz	NSTJDBOLXURPHC-HOCLYGCPSA-N	0	3	311.470	2.317	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cccc2c1OCCO2	ZINC000174962915	402766564	/nfs/dbraw/zinc/76/65/64/402766564.db2.gz	SOXVLFSLXKHSQI-ZIAGYGMSSA-N	0	3	316.401	2.157	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@H]2C[NH2+]CC[C@H]2C)c(Cl)cc1F	ZINC000193399932	402771110	/nfs/dbraw/zinc/77/11/10/402771110.db2.gz	XTEAGIINMUMSMZ-PELKAZGASA-N	0	3	320.817	2.064	10	0		DEAEHN
CN(C)c1ccncc1C(=O)NCCN(C)Cc1ccccc1	ZINC000183533949	402774539	/nfs/dbraw/zinc/77/45/39/402774539.db2.gz	IFWAKAMVUYIWSD-UHFFFAOYSA-N	0	3	312.417	2.009	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)NCCN1CCC[C@H](C)C1	ZINC000175477635	402810237	/nfs/dbraw/zinc/81/02/37/402810237.db2.gz	UEXPJVUMXGSFIZ-HNNXBMFYSA-N	0	3	321.469	2.070	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C1CC1)C1CCCC1	ZINC000175492544	402811410	/nfs/dbraw/zinc/81/14/10/402811410.db2.gz	JVKZVIRZFGIHLK-MRXNPFEDSA-N	0	3	309.454	2.214	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)CCc1ncc(-c2ccccc2)o1	ZINC000194714092	402811949	/nfs/dbraw/zinc/81/19/49/402811949.db2.gz	NHRWNUDHQOFDCN-HNNXBMFYSA-N	0	3	313.401	2.485	10	0		DEAEHN
C[C@@H](N[C@H]1CCCN(c2cnn(C)c2)C1)c1cccc(O)c1	ZINC000194901116	402821612	/nfs/dbraw/zinc/82/16/12/402821612.db2.gz	OWFWVWTXUWZTAG-HIFRSBDPSA-N	0	3	300.406	2.445	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cnc(OCC3CC3)c(Cl)c2)C1	ZINC000184244998	402830300	/nfs/dbraw/zinc/83/03/00/402830300.db2.gz	PEGAWCMFKVQICN-ZDUSSCGKSA-N	0	3	323.824	2.300	10	0		DEAEHN
CCOC(=O)[C@]1(C(C)C)CCN(Cc2c(C)nn(C)c2OC)C1	ZINC000195196252	402836031	/nfs/dbraw/zinc/83/60/31/402836031.db2.gz	GOQOAJNKMUFXMV-QGZVFWFLSA-N	0	3	323.437	2.148	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc(Oc2cnccn2)cc1	ZINC000175848607	402838149	/nfs/dbraw/zinc/83/81/49/402838149.db2.gz	QCCHTWULMDGPOG-KRWDZBQOSA-N	0	3	317.389	2.146	10	0		DEAEHN
COC(=O)c1coc(C(=O)N(CCN(C)C)C2CCCCC2)c1	ZINC000184380979	402839725	/nfs/dbraw/zinc/83/97/25/402839725.db2.gz	DOUQYMKHSCOXSZ-UHFFFAOYSA-N	0	3	322.405	2.403	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000184404911	402841794	/nfs/dbraw/zinc/84/17/94/402841794.db2.gz	WWHVDVBGQGHYQR-WFASDCNBSA-N	0	3	306.454	2.405	10	0		DEAEHN
Cc1c(-c2cc(CN3CCCN(C4CC4)CC3)on2)cnn1C	ZINC000184487339	402846454	/nfs/dbraw/zinc/84/64/54/402846454.db2.gz	RQZFQXHQVDDCCP-UHFFFAOYSA-N	0	3	315.421	2.054	10	0		DEAEHN
COc1cccc(/C(C)=C/C(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000176014088	402848381	/nfs/dbraw/zinc/84/83/81/402848381.db2.gz	WGNIEHLBXQDBNM-WSYSLRRZSA-N	0	3	300.402	2.405	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@@H](C)N1CC[C@H](CNc2ccccn2)C1	ZINC000195515878	402848543	/nfs/dbraw/zinc/84/85/43/402848543.db2.gz	BFPAPIHJEYMPMR-RRFJBIMHSA-N	0	3	304.438	2.119	10	0		DEAEHN
Cc1c(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)[nH]c2c1C(=O)CCC2	ZINC000265023401	402893576	/nfs/dbraw/zinc/89/35/76/402893576.db2.gz	YPSHLOVXMAENAE-WCQYABFASA-N	0	3	315.417	2.151	10	0		DEAEHN
c1cc(CN2CCC[C@H](C3OCCO3)C2)n(-c2ccccc2)n1	ZINC000279859088	402965265	/nfs/dbraw/zinc/96/52/65/402965265.db2.gz	PUCHGUMTGYTCFD-HNNXBMFYSA-N	0	3	313.401	2.457	10	0		DEAEHN
Cc1ncc(C(=O)N2CC[C@@H](n3c(C)nc4c3CCCC4)C2)[nH]1	ZINC000275827198	403126806	/nfs/dbraw/zinc/12/68/06/403126806.db2.gz	ZFAQDPAZTCCEDP-CYBMUJFWSA-N	0	3	313.405	2.189	10	0		DEAEHN
C[C@H]1C[C@H](N(C)c2ncnc3c2ncn3C2CC2)CCN1C	ZINC000292665066	403374018	/nfs/dbraw/zinc/37/40/18/403374018.db2.gz	HKPMGIKHCCZAAZ-WCQYABFASA-N	0	3	300.410	2.080	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)C12CCC2	ZINC000246109459	286347091	/nfs/dbraw/zinc/34/70/91/286347091.db2.gz	HREUFLGZELPWDJ-XUWVNRHRSA-N	0	3	323.481	2.458	10	0		DEAEHN
Cc1cc(C)n(-c2cncc(N(C)C[C@@H]3CCCN(C)C3)n2)n1	ZINC000301381126	403622841	/nfs/dbraw/zinc/62/28/41/403622841.db2.gz	YMPBYFMRSDNYHL-OAHLLOKOSA-N	0	3	314.437	2.057	10	0		DEAEHN
NC(=O)[C@H]1CCCN1C1CCN(c2ccc3ccccc3n2)CC1	ZINC000301964295	403705036	/nfs/dbraw/zinc/70/50/36/403705036.db2.gz	NRDGZAWCCORFSA-QGZVFWFLSA-N	0	3	324.428	2.153	10	0		DEAEHN
CC(C)c1nc([C@H]2CCCN2C(=O)NC[C@H]2CCCN2C)no1	ZINC000333038476	403650928	/nfs/dbraw/zinc/65/09/28/403650928.db2.gz	YBLRINTZGHELEN-CHWSQXEVSA-N	0	3	321.425	2.134	10	0		DEAEHN
Nc1cccnc1C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000310101069	403967020	/nfs/dbraw/zinc/96/70/20/403967020.db2.gz	XUDZJMJHJSKQCF-INIZCTEOSA-N	0	3	324.428	2.306	10	0		DEAEHN
c1nc2c(ncnc2N2CCC[C@@H](c3ncc4n3CCCC4)C2)[nH]1	ZINC000369750988	404217574	/nfs/dbraw/zinc/21/75/74/404217574.db2.gz	SJALDUPBXBAQSY-GFCCVEGCSA-N	0	3	323.404	2.270	10	0		DEAEHN
CC(C)OC1CC(N[C@H](c2nccn2C)C2CCOCC2)C1	ZINC000344508291	404192133	/nfs/dbraw/zinc/19/21/33/404192133.db2.gz	GBIJZDYRMQZLPB-GPANFISMSA-N	0	3	307.438	2.433	10	0		DEAEHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)/C=C/c2ccnn2C)C1	ZINC000369709172	404201979	/nfs/dbraw/zinc/20/19/79/404201979.db2.gz	BGMHRDUGXOMOFG-GFOMBABLSA-N	0	3	324.428	2.166	10	0		DEAEHN
CN(C(=O)c1cc2ccccc2c(=O)[nH]1)[C@@H]1CN2CCC1CC2	ZINC000329454694	404340608	/nfs/dbraw/zinc/34/06/08/404340608.db2.gz	MIVHGJRBFAMTHV-MRXNPFEDSA-N	0	3	311.385	2.107	10	0		DEAEHN
Cc1nc([C@H](C)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)no1	ZINC000330251724	404600751	/nfs/dbraw/zinc/60/07/51/404600751.db2.gz	NRIGRMXAVJHSJA-MJBXVCDLSA-N	0	3	322.453	2.260	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2ccccc2SC)CC12COC2	ZINC000451138181	404877744	/nfs/dbraw/zinc/87/77/44/404877744.db2.gz	QDRFTTZCIRFVIZ-CQSZACIVSA-N	0	3	321.442	2.420	10	0		DEAEHN
C/C(=C\c1ccccc1)CN[C@H]1CCN(C2CCOCC2)C1=O	ZINC000367058864	404913736	/nfs/dbraw/zinc/91/37/36/404913736.db2.gz	YOHNBQSGYCJZHL-DUVHGLKDSA-N	0	3	314.429	2.459	10	0		DEAEHN
CC(=O)c1cc(NC(=O)N[C@@H]2CNCCC2(F)F)ccc1F	ZINC000415719779	404924755	/nfs/dbraw/zinc/92/47/55/404924755.db2.gz	HPONSYRFSLEHIO-GFCCVEGCSA-N	0	3	315.295	2.147	10	0		DEAEHN
C[C@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21	ZINC000361124570	404932314	/nfs/dbraw/zinc/93/23/14/404932314.db2.gz	QFFNKMQPMXNTKR-UNEWFSDZSA-N	0	3	317.433	2.059	10	0		DEAEHN
Cc1cccnc1NC(=O)[C@H]1CCCN(CC2=CCCOC2)C1	ZINC000378335733	404932355	/nfs/dbraw/zinc/93/23/55/404932355.db2.gz	SKVQNTBTEVMUTD-INIZCTEOSA-N	0	3	315.417	2.387	10	0		DEAEHN
O[C@H](CC1CCCC1)CN1CCOC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000408041273	405096975	/nfs/dbraw/zinc/09/69/75/405096975.db2.gz	BXNLTTVMFJIDFF-XDNAFOTISA-N	0	3	311.466	2.180	10	0		DEAEHN
c1ccc(N2CCN(CCCN3C[C@H]4CC[C@@H](C3)O4)CC2)cc1	ZINC000367540213	405078058	/nfs/dbraw/zinc/07/80/58/405078058.db2.gz	JHPQXMCODYATCA-KDURUIRLSA-N	0	3	315.461	2.062	10	0		DEAEHN
Cc1cc(=O)[nH]c(C(=O)N2CCCN(C3CCCC3)CC2)c1	ZINC000408014030	405090369	/nfs/dbraw/zinc/09/03/69/405090369.db2.gz	QIFBJOHJPGSQMK-UHFFFAOYSA-N	0	3	303.406	2.186	10	0		DEAEHN
Cc1cccn2c(=O)cc(CNC3(CCO)CCCCC3)nc12	ZINC000440906987	405330298	/nfs/dbraw/zinc/33/02/98/405330298.db2.gz	IVCBPRROFIMFNK-UHFFFAOYSA-N	0	3	315.417	2.178	10	0		DEAEHN
CN(C)CCn1nccc1NC(=O)N(C)C[C@H]1CC=CCC1	ZINC000455663396	405441954	/nfs/dbraw/zinc/44/19/54/405441954.db2.gz	XNFNCIJRPYVIBU-AWEZNQCLSA-N	0	3	305.426	2.265	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2ccc(C)c(C)c2)CC12COC2	ZINC000449365805	405526643	/nfs/dbraw/zinc/52/66/43/405526643.db2.gz	QIYFBMGALXEIRE-INIZCTEOSA-N	0	3	303.402	2.315	10	0		DEAEHN
Cc1nc(CN[C@@H]2CN(C)C[C@H]2C)sc1Br	ZINC000449404366	405547947	/nfs/dbraw/zinc/54/79/47/405547947.db2.gz	ZHSOQNLHTXUTJU-VXNVDRBHSA-N	0	3	304.257	2.254	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N[C@H]2C[C@H](N(C)C)C2(C)C)c1C	ZINC000636087322	405728259	/nfs/dbraw/zinc/72/82/59/405728259.db2.gz	OUQKKFDCRJPTBA-STQMWFEESA-N	0	3	305.422	2.293	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCC(c2c[nH]nc2C)CC1	ZINC000560813264	405870788	/nfs/dbraw/zinc/87/07/88/405870788.db2.gz	JERKDYYXYSKVFP-MRXNPFEDSA-N	0	3	304.438	2.299	10	0		DEAEHN
CCn1nncc1CN(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000459372912	405876289	/nfs/dbraw/zinc/87/62/89/405876289.db2.gz	ZYQJFJNKJDWHJP-KRWDZBQOSA-N	0	3	313.449	2.394	10	0		DEAEHN
COCCOC[C@H](O)CN1CC[C@H](C)C[C@@H]1c1ccc(C)o1	ZINC000450460032	405911220	/nfs/dbraw/zinc/91/12/20/405911220.db2.gz	ZAUPXVYFJKJQTN-NUEKZKHPSA-N	0	3	311.422	2.385	10	0		DEAEHN
c1nc(CNC[C@H]2CC23CCSCC3)cc2c1OCCO2	ZINC000639274005	406014858	/nfs/dbraw/zinc/01/48/58/406014858.db2.gz	ULOBJZZDKJCXQH-GFCCVEGCSA-N	0	3	306.431	2.476	10	0		DEAEHN
O=C([C@@H]1CCCN1C1CC1)N1CCC(C2CCOCC2)CC1	ZINC000562370920	405995989	/nfs/dbraw/zinc/99/59/89/405995989.db2.gz	MZBFADFSDWULAA-KRWDZBQOSA-N	0	3	306.450	2.278	10	0		DEAEHN
Cc1ccc2[nH]c(CNC3CCN(c4cnccn4)CC3)nc2c1	ZINC000531728608	405999228	/nfs/dbraw/zinc/99/92/28/405999228.db2.gz	BZKUQXRFSCUBNJ-UHFFFAOYSA-N	0	3	322.416	2.420	10	0		DEAEHN
Cc1ccc2nc(CNC3CCN(c4cnccn4)CC3)[nH]c2c1	ZINC000531728608	405999229	/nfs/dbraw/zinc/99/92/29/405999229.db2.gz	BZKUQXRFSCUBNJ-UHFFFAOYSA-N	0	3	322.416	2.420	10	0		DEAEHN
CCN(CCNC(=O)N1CC[C@H](C(F)(F)F)[C@@H]1C)C1CC1	ZINC000471816323	406121496	/nfs/dbraw/zinc/12/14/96/406121496.db2.gz	NCQUKIXGMWDAPL-JQWIXIFHSA-N	0	3	307.360	2.453	10	0		DEAEHN
C[C@@H](c1ccc(F)cc1)N(C)C(=O)CN1CC[C@H](CO)[C@H]1C	ZINC000488808743	406350266	/nfs/dbraw/zinc/35/02/66/406350266.db2.gz	ROLSYBNTZPGCBF-GZBFAFLISA-N	0	3	308.397	2.048	10	0		DEAEHN
CCNC(=O)N1CC[C@@H](NCc2c[nH]nc2-c2ccsc2)C1	ZINC000548034291	406470671	/nfs/dbraw/zinc/47/06/71/406470671.db2.gz	UKRYHAMDUYLNOP-CYBMUJFWSA-N	0	3	319.434	2.032	10	0		DEAEHN
CCN(C[C@H]1CCCN1CC)C(=O)Cn1ncc2ccccc21	ZINC000548126987	406483375	/nfs/dbraw/zinc/48/33/75/406483375.db2.gz	SCYFJYKIZKRCBN-MRXNPFEDSA-N	0	3	314.433	2.369	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@@H]2CCC(=O)NC2(C)C)c2ccccc21	ZINC000571261064	406497733	/nfs/dbraw/zinc/49/77/33/406497733.db2.gz	SQKNCFRALDRFJE-GOEBONIOSA-N	0	3	315.417	2.131	10	0		DEAEHN
Cc1cc(CN2CCC(C(N)=O)(c3ccccc3)CC2)sn1	ZINC000638090060	406564827	/nfs/dbraw/zinc/56/48/27/406564827.db2.gz	AWRSKSOJQCURKQ-UHFFFAOYSA-N	0	3	315.442	2.471	10	0		DEAEHN
C[C@H]1CC[C@H](NC(=O)[C@H](N)CN(C)Cc2ccccc2)CC1	ZINC000637987945	406510948	/nfs/dbraw/zinc/51/09/48/406510948.db2.gz	UYCMPXPJCUIVJA-DJIMGWMZSA-N	0	3	303.450	2.141	10	0		DEAEHN
Cc1cc(CNC[C@@H]2CN(Cc3ccccc3)CCO2)ccn1	ZINC000527631221	406696857	/nfs/dbraw/zinc/69/68/57/406696857.db2.gz	KMEGBZYJHTYPDM-LJQANCHMSA-N	0	3	311.429	2.381	10	0		DEAEHN
COC[C@@]1(C(=O)Nc2ccc(Br)cc2)CCCN1	ZINC000643613887	407016746	/nfs/dbraw/zinc/01/67/46/407016746.db2.gz	GAMHCVNJXXCPCO-CYBMUJFWSA-N	0	3	313.195	2.156	10	0		DEAEHN
CN1CCO[C@H](CNCc2cc(F)cc(C(F)(F)F)c2)C1	ZINC000129457921	196050630	/nfs/dbraw/zinc/05/06/30/196050630.db2.gz	VESVACWWVIOEGK-CYBMUJFWSA-N	0	3	306.303	2.265	10	0		DEAEHN
Cc1cc([C@H](C)NC(=O)C(C)(C)N2CCNCC2)c(C)s1	ZINC000129617614	196062685	/nfs/dbraw/zinc/06/26/85/196062685.db2.gz	KOGMGYIGSMKKNL-LBPRGKRZSA-N	0	3	309.479	2.226	10	0		DEAEHN
CC(C)(CN[C@H]1CCc2sc(Cl)cc21)NS(C)(=O)=O	ZINC000129666903	196066029	/nfs/dbraw/zinc/06/60/29/196066029.db2.gz	SSMWVMCTKIASTL-VIFPVBQESA-N	0	3	322.883	2.306	10	0		DEAEHN
COCCN(Cc1cc(C(N)=S)ccc1OC)CC(C)C	ZINC000130587435	196093464	/nfs/dbraw/zinc/09/34/64/196093464.db2.gz	VYLARPAXOVGGCM-UHFFFAOYSA-N	0	3	310.463	2.434	10	0		DEAEHN
CNCc1ccc(CS(=O)(=O)c2cc(F)ccc2F)o1	ZINC000130905472	196120392	/nfs/dbraw/zinc/12/03/92/196120392.db2.gz	GOIJPQWDTJITBY-UHFFFAOYSA-N	0	3	301.314	2.251	10	0		DEAEHN
C[C@@H](Cc1ccsc1)Nc1nc(N)nc(N2CCCC2)n1	ZINC000130987699	196130184	/nfs/dbraw/zinc/13/01/84/196130184.db2.gz	TUQKLIITSWJRKI-JTQLQIEISA-N	0	3	304.423	2.159	10	0		DEAEHN
CC1(C)CC(NS(=O)(=O)[C@H]2CCCNC2)CC(C)(C)C1	ZINC000131069264	196137076	/nfs/dbraw/zinc/13/70/76/196137076.db2.gz	ZHKZXMRPWHWKLI-ZDUSSCGKSA-N	0	3	302.484	2.263	10	0		DEAEHN
O=S1(=O)CCC[C@H]1CNC1=NCC2(CCCCC2)CS1	ZINC000131173248	196146378	/nfs/dbraw/zinc/14/63/78/196146378.db2.gz	LDIHJAPNIGPTOU-LBPRGKRZSA-N	0	3	316.492	2.207	10	0		DEAEHN
CCc1ccc(S(=O)(=O)NCCCC(F)(F)F)cc1CN	ZINC000131220484	196151561	/nfs/dbraw/zinc/15/15/61/196151561.db2.gz	XNTZZWRXDZFNEC-UHFFFAOYSA-N	0	3	324.368	2.329	10	0		DEAEHN
CS(=O)(=O)CCC[C@@H](N)c1cc(F)ccc1Br	ZINC000131322849	196160239	/nfs/dbraw/zinc/16/02/39/196160239.db2.gz	KPRFPYCPQXWTOS-LLVKDONJSA-N	0	3	324.215	2.413	10	0		DEAEHN
CN[C@H](c1ncccc1F)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000131547783	196178356	/nfs/dbraw/zinc/17/83/56/196178356.db2.gz	GYAPQBMIGZPOMF-MDZLAQPJSA-N	0	3	300.399	2.085	10	0		DEAEHN
C[C@@H]1CCN(S(=O)(=O)c2cc(CN)ccc2Cl)C[C@@H]1C	ZINC000131762969	196197164	/nfs/dbraw/zinc/19/71/64/196197164.db2.gz	VBGFXUHJGODTNB-MNOVXSKESA-N	0	3	316.854	2.465	10	0		DEAEHN
Cn1cc(CN)c(NC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)n1	ZINC000131859880	196204623	/nfs/dbraw/zinc/20/46/23/196204623.db2.gz	FPJMBCLSXAJIQE-SCZZXKLOSA-N	0	3	304.316	2.186	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1[C@H](O)C1CCCC1	ZINC000132131135	196228720	/nfs/dbraw/zinc/22/87/20/196228720.db2.gz	KZURTXYOZQOAQC-CYBMUJFWSA-N	0	3	316.243	2.431	10	0		DEAEHN
C[C@H]1CNC[C@@H](COCc2ccccc2Br)O1	ZINC000132652379	196273761	/nfs/dbraw/zinc/27/37/61/196273761.db2.gz	ONRYMLJRROIMAD-JQWIXIFHSA-N	0	3	300.196	2.343	10	0		DEAEHN
C[C@H]1CNC[C@H](COCc2ccc(Br)cc2)O1	ZINC000132682820	196275584	/nfs/dbraw/zinc/27/55/84/196275584.db2.gz	OFZMUOSBSLYQQL-GXFFZTMASA-N	0	3	300.196	2.343	10	0		DEAEHN
CC(C)(CNC(=O)N1CC[C@@H]2OCCC[C@H]2C1)N1CCCCC1	ZINC000132808156	196286102	/nfs/dbraw/zinc/28/61/02/196286102.db2.gz	RVHVAIIUTSRLRR-HOTGVXAUSA-N	0	3	323.481	2.461	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)N[C@@H]1CCC[C@H]2OCC[C@@H]21	ZINC000177682012	287269800	/nfs/dbraw/zinc/26/98/00/287269800.db2.gz	AMJFGYXVTPPNLM-KLHDSHLOSA-N	0	3	309.454	2.118	10	0		DEAEHN
CN[C@@H](Cc1cc(C)ccc1OC)[C@H]1CCCCS1(=O)=O	ZINC000133307122	196329350	/nfs/dbraw/zinc/32/93/50/196329350.db2.gz	KYGICFOWIPPZCC-GOEBONIOSA-N	0	3	311.447	2.101	10	0		DEAEHN
COC(=O)c1ccc(Cl)cc1N[C@H](C)C[C@@H]1COCCN1	ZINC000133568750	196331373	/nfs/dbraw/zinc/33/13/73/196331373.db2.gz	QGEOEQBCVIYAOL-ZYHUDNBSSA-N	0	3	312.797	2.306	10	0		DEAEHN
CCNCc1c(N2CCCCC[C@@H]2CO)nc2sccn12	ZINC000133862366	196341035	/nfs/dbraw/zinc/34/10/35/196341035.db2.gz	LXNLRJGNQBGRCL-GFCCVEGCSA-N	0	3	308.451	2.247	10	0		DEAEHN
CCS(=O)(=O)N1CC(CNc2ccnc3ccc(C)cc32)C1	ZINC000302564907	230301825	/nfs/dbraw/zinc/30/18/25/230301825.db2.gz	OCQHRSUSBFBWMS-UHFFFAOYSA-N	0	3	319.430	2.237	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC[C@](C)(O)C(F)(F)F	ZINC000381928607	424909837	/nfs/dbraw/zinc/90/98/37/424909837.db2.gz	QWPWZGUXUFCYTN-JSGCOSHPSA-N	0	3	304.356	2.410	10	0		DEAEHN
C[C@H](O)CCCN1CCO[C@H]2CCN(Cc3ccccc3)C[C@@H]21	ZINC000404219066	424926200	/nfs/dbraw/zinc/92/62/00/424926200.db2.gz	WGUITJKECAIZRJ-WDSOQIARSA-N	0	3	318.461	2.123	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)c2nscc2Br)CCN1C	ZINC000404942001	424930905	/nfs/dbraw/zinc/93/09/05/424930905.db2.gz	MILOHDNXHOXTQR-SFYZADRCSA-N	0	3	318.240	2.118	10	0		DEAEHN
CN1C[C@@H](CNCc2ccc(F)cc2Br)CC1=O	ZINC000657697637	425387065	/nfs/dbraw/zinc/38/70/65/425387065.db2.gz	QTDPBLNCJHKLGC-SECBINFHSA-N	0	3	315.186	2.156	10	0		DEAEHN
Cc1nc(-c2ccccc2NC(=O)N2CC[C@@H](N(C)C)C2)no1	ZINC000363470143	269064806	/nfs/dbraw/zinc/06/48/06/269064806.db2.gz	KUDWDYZXIXYXMF-GFCCVEGCSA-N	0	3	315.377	2.213	10	0		DEAEHN
Cc1nc(N2CCc3ccccc3C2)nc(N2CCNCC2)c1C	ZINC000045947565	274842893	/nfs/dbraw/zinc/84/28/93/274842893.db2.gz	ZJCCUTWRHFORGA-UHFFFAOYSA-N	0	3	323.444	2.066	10	0		DEAEHN
O=C([C@@H]1SCCc2sccc21)N1CCN2CCC[C@@H]2C1	ZINC000173098813	275007285	/nfs/dbraw/zinc/00/72/85/275007285.db2.gz	BFVAWRJTKAVOAD-BXUZGUMPSA-N	0	3	308.472	2.385	10	0		DEAEHN
O=C1NCCC[C@@H]1N[C@@H]1CCc2cc(Br)ccc2C1	ZINC000104358121	275022952	/nfs/dbraw/zinc/02/29/52/275022952.db2.gz	SIUJPPZUZAVBMX-KGLIPLIRSA-N	0	3	323.234	2.175	10	0		DEAEHN
OCCN1CCCN(c2ccnc3c(F)cc(F)cc23)CC1	ZINC000159271661	275047120	/nfs/dbraw/zinc/04/71/20/275047120.db2.gz	HMCUYSFEQDSMMR-UHFFFAOYSA-N	0	3	307.344	2.017	10	0		DEAEHN
O[C@H](CN1CCC[C@@H](n2cncn2)C1)c1ccc(Cl)cc1	ZINC000247034667	275057059	/nfs/dbraw/zinc/05/70/59/275057059.db2.gz	DIUJGIYUAMKCIT-HUUCEWRRSA-N	0	3	306.797	2.302	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)N1CCc2ccccc21	ZINC000177702578	276183483	/nfs/dbraw/zinc/18/34/83/276183483.db2.gz	DHGHHFCWSXZXQO-RDJZCZTQSA-N	0	3	315.461	2.380	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C(=O)NC1CC1)c1ccccc1	ZINC000177714011	276183545	/nfs/dbraw/zinc/18/35/45/276183545.db2.gz	SNTGAHDAZWJOFJ-ROUUACIJSA-N	0	3	315.461	2.422	10	0		DEAEHN
CCOc1ccc(OC[C@H](O)CN2CC[C@@H](C)[C@@H](OC)C2)cc1	ZINC000251679347	276376040	/nfs/dbraw/zinc/37/60/40/276376040.db2.gz	IWNRRURPFYVKFZ-RKVPGOIHSA-N	0	3	323.433	2.182	10	0		DEAEHN
CCS(=O)(=O)NCCCN1C[C@@H](c2ccccc2)C[C@H]1C	ZINC000245530314	276391447	/nfs/dbraw/zinc/39/14/47/276391447.db2.gz	XCCJBPJMQPKGLA-ZBFHGGJFSA-N	0	3	310.463	2.194	10	0		DEAEHN
CC[C@@](C)(O)CN1CCC(n2c3ccccc3[nH]c2=O)CC1	ZINC000123245268	276534935	/nfs/dbraw/zinc/53/49/35/276534935.db2.gz	SQNSDZWTIARCGB-QGZVFWFLSA-N	0	3	303.406	2.128	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2CCSc3ccccc32)n1	ZINC000263298550	277116639	/nfs/dbraw/zinc/11/66/39/277116639.db2.gz	WSYQYZPVDRFMCU-CHWSQXEVSA-N	0	3	316.430	2.273	10	0		DEAEHN
CN1CC[C@H](NC(=O)NC2CCC(O)CC2)[C@@H]1c1ccccc1	ZINC000179093401	277166244	/nfs/dbraw/zinc/16/62/44/277166244.db2.gz	OZXHLKWIQKYJKB-GQGLESIBSA-N	0	3	317.433	2.035	10	0		DEAEHN
CC(C)(C)NC(=O)NC(=O)CN1CCC[C@@]2(CC=CCC2)C1	ZINC000114495733	277169449	/nfs/dbraw/zinc/16/94/49/277169449.db2.gz	BNJGHJAALHGTPK-KRWDZBQOSA-N	0	3	307.438	2.433	10	0		DEAEHN
CC(C)c1nnc(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)n1C	ZINC000179179791	278099513	/nfs/dbraw/zinc/09/95/13/278099513.db2.gz	FZAJQYZKQOJHEN-GDBMZVCRSA-N	0	3	317.481	2.387	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1cccc2c1OCCO2	ZINC000124095915	279132912	/nfs/dbraw/zinc/13/29/12/279132912.db2.gz	HJLRWNOICAMLDK-CYBMUJFWSA-N	0	3	306.406	2.164	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)N(C1CC1)C1CCCC1	ZINC000175346962	279326983	/nfs/dbraw/zinc/32/69/83/279326983.db2.gz	SQUVZYMPBKCQAG-KRWDZBQOSA-N	0	3	307.482	2.336	10	0		DEAEHN
C[C@H](CS(=O)(=O)c1ccccc1)NC[C@H]1CCC(C)(C)O1	ZINC000187850117	279362742	/nfs/dbraw/zinc/36/27/42/279362742.db2.gz	CTGVROXYRCAQJW-ZIAGYGMSSA-N	0	3	311.447	2.396	10	0		DEAEHN
CC[C@@H]1CCCCCN1C(=O)NC[C@H]1CCCN1CCOC	ZINC000120341319	280236070	/nfs/dbraw/zinc/23/60/70/280236070.db2.gz	UNHUTEUTJGFMFZ-HZPDHXFCSA-N	0	3	311.470	2.461	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(C(C)C)n(C)n1	ZINC000245407600	281198405	/nfs/dbraw/zinc/19/84/05/281198405.db2.gz	BWZGFEXRYJTKJZ-KBPBESRZSA-N	0	3	304.438	2.242	10	0		DEAEHN
CC1(C)C[N@H+](CCC[N-]C(=O)C(F)(F)F)CC2(CCCC2)O1	ZINC000190974558	281236193	/nfs/dbraw/zinc/23/61/93/281236193.db2.gz	VHWXUULLJXJUDE-UHFFFAOYSA-N	0	3	322.371	2.479	10	0		DEAEHN
CC1(C)C[N@@H+](CCC[N-]C(=O)C(F)(F)F)CC2(CCCC2)O1	ZINC000190974558	281236194	/nfs/dbraw/zinc/23/61/94/281236194.db2.gz	VHWXUULLJXJUDE-UHFFFAOYSA-N	0	3	322.371	2.479	10	0		DEAEHN
CC1(C)C[C@@H](NC(=O)N2CCCN(C3CC3)CC2)C(C)(C)O1	ZINC000183589938	281306619	/nfs/dbraw/zinc/30/66/19/281306619.db2.gz	ICXVYLTUXMTYKH-CQSZACIVSA-N	0	3	309.454	2.212	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2ccnc(OC3CCC3)c2)C1	ZINC000134480148	282043568	/nfs/dbraw/zinc/04/35/68/282043568.db2.gz	APCFYLQOAKXSDY-CJNGLKHVSA-N	0	3	317.433	2.471	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)N[C@@H]2CCCOc3c(F)cccc32)C1	ZINC000183827662	289383270	/nfs/dbraw/zinc/38/32/70/289383270.db2.gz	MUWKKVZORDGMQN-SWLSCSKDSA-N	0	3	321.396	2.385	10	0		DEAEHN
C[C@H](c1nnnn1C1CCCCC1)N1CCCN(C2CC2)CC1	ZINC000188953632	290290116	/nfs/dbraw/zinc/29/01/16/290290116.db2.gz	HXGFFTQNZRNAOP-CQSZACIVSA-N	0	3	318.469	2.409	10	0		DEAEHN
Cc1nn(C)cc1CC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000450701074	293782080	/nfs/dbraw/zinc/78/20/80/293782080.db2.gz	VMHMITPLNZAFMF-KSSFIOAISA-N	0	3	314.433	2.079	10	0		DEAEHN
C[C@H]1CC[NH2+]C[C@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000193397776	300004300	/nfs/dbraw/zinc/00/43/00/300004300.db2.gz	IPMGWJWUULSXAX-GZMMTYOYSA-N	0	3	323.245	2.270	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)N[C@@H](CN(C)C)c2ccccc2)n1	ZINC000120257127	301253181	/nfs/dbraw/zinc/25/31/81/301253181.db2.gz	MBRKGYSREXVDFV-WBVHZDCISA-N	0	3	314.433	2.480	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNC[C@H]1CSCCS1	ZINC000291953937	304865178	/nfs/dbraw/zinc/86/51/78/304865178.db2.gz	OKWFSKMEDQTCMO-HNNXBMFYSA-N	0	3	320.487	2.265	10	0		DEAEHN
CC1(C)COc2c1cccc2C(=O)NCCNc1ccncc1	ZINC000584331257	333118731	/nfs/dbraw/zinc/11/87/31/333118731.db2.gz	DSSWTLLVPOAZDK-UHFFFAOYSA-N	0	3	311.385	2.015	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N[C@H]1C[C@H](C)N(C2CC2)C1	ZINC000189977525	336257558	/nfs/dbraw/zinc/25/75/58/336257558.db2.gz	CJQHZYBDPIDBQZ-AVGNSLFASA-N	0	3	318.421	2.076	10	0		DEAEHN
C[C@H](CNC(=O)NCCOCC1CCC1)N1CCC(C)CC1	ZINC000583735459	337327501	/nfs/dbraw/zinc/32/75/01/337327501.db2.gz	GNFKFBIWNOBJQS-OAHLLOKOSA-N	0	3	311.470	2.223	10	0		DEAEHN
COc1ccc(C[C@H](C)CNCc2cc(C(N)=O)co2)cc1F	ZINC000190010666	533787006	/nfs/dbraw/zinc/78/70/06/533787006.db2.gz	FKDGWNURSCQTAW-NSHDSACASA-N	0	3	320.364	2.495	10	0		DEAEHN
C[C@@H](CN1CCC[C@H](C)C1)NC(=O)c1cn2ccnc2s1	ZINC000248941215	533829385	/nfs/dbraw/zinc/82/93/85/533829385.db2.gz	OAEDKGXEYGXAQJ-RYUDHWBXSA-N	0	3	306.435	2.246	10	0		DEAEHN
COc1ccc(O)cc1C(=O)NC[C@H](C)N1CCC[C@@H](C)C1	ZINC000188084942	534210949	/nfs/dbraw/zinc/21/09/49/534210949.db2.gz	NQPAATHCTHFZPQ-OLZOCXBDSA-N	0	3	306.406	2.251	10	0		DEAEHN
CC(C)CC[C@H]1CCCCN1CC(=O)N1CCC[C@@H](C(N)=O)C1	ZINC000246878750	519693701	/nfs/dbraw/zinc/69/37/01/519693701.db2.gz	DNNVCHIXIIRZLT-HZPDHXFCSA-N	0	3	323.481	2.001	10	0		DEAEHN
Cc1ccc2cc(C(=O)NCCNc3ccncc3)ccc2n1	ZINC000448454733	534461968	/nfs/dbraw/zinc/46/19/68/534461968.db2.gz	NUIIFEJRJPMBMF-UHFFFAOYSA-N	0	3	306.369	2.202	10	0		DEAEHN
NC(=O)c1ccc(CN2CC[C@@H](n3cnc4c3CCCC4)C2)cc1	ZINC000299744095	534480343	/nfs/dbraw/zinc/48/03/43/534480343.db2.gz	QVPDCKRHDVSDLA-MRXNPFEDSA-N	0	3	324.428	2.308	10	0		DEAEHN
CCOc1cc2c(cc1CNC(=O)[C@H](N)[C@@H](C)CC)O[C@H](C)C2	ZINC000246504944	520793076	/nfs/dbraw/zinc/79/30/76/520793076.db2.gz	QDMOIIIQPINQJE-XWCIJXRUSA-N	0	3	320.433	2.398	10	0		DEAEHN
CCN1CC[C@H]2OCCN(Cc3ncc(Cl)s3)[C@H]2C1	ZINC000339391776	521723129	/nfs/dbraw/zinc/72/31/29/521723129.db2.gz	IHHNZGXTTMKYOS-WDEREUQCSA-N	0	3	301.843	2.092	10	0		DEAEHN
CCc1nc(CNC(=O)N2CC[C@H](N3CCCC3)C2)cs1	ZINC000107854084	522331467	/nfs/dbraw/zinc/33/14/67/522331467.db2.gz	ZWYKHMNLKFSXAW-ZDUSSCGKSA-N	0	3	308.451	2.085	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)[C@@H](C)c1ccco1	ZINC000111865126	523824969	/nfs/dbraw/zinc/82/49/69/523824969.db2.gz	PILSVHDJANFBJZ-UONOGXRCSA-N	0	3	309.410	2.093	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCC[C@@H]1C1CCC1	ZINC000111866104	523825848	/nfs/dbraw/zinc/82/58/48/523825848.db2.gz	MPPKZDVICNDKQN-HZPDHXFCSA-N	0	3	309.454	2.071	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCCc1csc(C(C)(C)C)n1	ZINC000130106166	523850265	/nfs/dbraw/zinc/85/02/65/523850265.db2.gz	JOBONYQUAAFUFP-ZDUSSCGKSA-N	0	3	324.494	2.377	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000450661156	534789890	/nfs/dbraw/zinc/78/98/90/534789890.db2.gz	DEXSLPOAAOAXPV-DIFFPNOSSA-N	0	3	304.390	2.026	10	0		DEAEHN
Cc1cc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)ccc1F	ZINC000249153398	525101118	/nfs/dbraw/zinc/10/11/18/525101118.db2.gz	HTPIVFWXBATWPE-GXTWGEPZSA-N	0	3	321.396	2.014	10	0		DEAEHN
C[C@H](C(=O)N(CCN(C)C)Cc1ccco1)c1cccnc1	ZINC000156472004	525947145	/nfs/dbraw/zinc/94/71/45/525947145.db2.gz	GODSPUYQYYZKNL-AWEZNQCLSA-N	0	3	301.390	2.369	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cnn([C@@H](C)C3CC3)c2)C1	ZINC000189654720	529057013	/nfs/dbraw/zinc/05/70/13/529057013.db2.gz	WJQMRUUFMVHCKI-GXTWGEPZSA-N	0	3	305.426	2.460	10	0		DEAEHN
CCOC(=O)CC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000190751088	535611599	/nfs/dbraw/zinc/61/15/99/535611599.db2.gz	UILMYHPMTSWKLB-GOSISDBHSA-N	0	3	318.417	2.111	10	0		DEAEHN
CCC[C@](C)(N)C(=O)N1CCN(c2ccc(F)cc2OC)CC1	ZINC000262701798	535758626	/nfs/dbraw/zinc/75/86/26/535758626.db2.gz	IYZDZAJYPPPYOI-KRWDZBQOSA-N	0	3	323.412	2.000	10	0		DEAEHN
CN(C)CCCCNC(=O)C1(c2cccc(Cl)c2)CC(=O)C1	ZINC000362762735	535827743	/nfs/dbraw/zinc/82/77/43/535827743.db2.gz	LVTPADGSFSLDIJ-UHFFFAOYSA-N	0	3	322.836	2.399	10	0		DEAEHN
CN(C)CCN1CCN(C(=O)c2ccc(C3CCC3)cc2)CC1	ZINC000358545809	535875220	/nfs/dbraw/zinc/87/52/20/535875220.db2.gz	NEDYEFLVTISZPE-UHFFFAOYSA-N	0	3	315.461	2.274	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1cn(C(C)(C)C)nn1)c1ccccc1	ZINC000191366624	535952758	/nfs/dbraw/zinc/95/27/58/535952758.db2.gz	BMGYMIPTNZBPJN-AWEZNQCLSA-N	0	3	315.421	2.066	10	0		DEAEHN
CNC(=O)Cc1nc(CN2C[C@H](C)[C@@H]3CCCC[C@H]32)cs1	ZINC000248444266	536303291	/nfs/dbraw/zinc/30/32/91/536303291.db2.gz	WBBBOVGJJKSHEL-FPMFFAJLSA-N	0	3	307.463	2.442	10	0		DEAEHN
COC(=O)Cc1ccccc1NC(=O)C1CCN(C2CC2)CC1	ZINC000192673665	536371037	/nfs/dbraw/zinc/37/10/37/536371037.db2.gz	STPFMSHCISNOQK-UHFFFAOYSA-N	0	3	316.401	2.215	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2ccc(F)c(F)c2)C1	ZINC000246491533	536471255	/nfs/dbraw/zinc/47/12/55/536471255.db2.gz	DRTAOLLTVKDCCT-XJKSGUPXSA-N	0	3	308.372	2.450	10	0		DEAEHN
COc1cccc([C@H]2C[C@@H]2C(=O)N2CCN3CCC2CC3)c1	ZINC000188634432	536902467	/nfs/dbraw/zinc/90/24/67/536902467.db2.gz	CMFIFYTTZMSQDA-SJORKVTESA-N	0	3	300.402	2.105	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(F)nc1	ZINC000309770911	625333391	/nfs/dbraw/zinc/33/33/91/625333391.db2.gz	AZPSVYWSKGSAKA-ZDUSSCGKSA-N	0	3	301.365	2.471	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-]C[C@@H]2CC[C@H]([NH3+])C2)sc1Cl	ZINC000311116855	625543004	/nfs/dbraw/zinc/54/30/04/625543004.db2.gz	GIKSPQHJGCWFON-BDAKNGLRSA-N	0	3	308.856	2.116	10	0		DEAEHN
CC(C)(C)OC(=O)N(CC1(CO)CC1)c1ccc(CN)nc1	ZINC000757132553	623023800	/nfs/dbraw/zinc/02/38/00/623023800.db2.gz	BPCQIVRASGDEPS-UHFFFAOYSA-N	0	3	307.394	2.054	10	0		DEAEHN
O=S1(=O)CC(CCNCc2cscc2Br)C1	ZINC000309369275	625063390	/nfs/dbraw/zinc/06/33/90/625063390.db2.gz	PWKFLRWBOZBHEZ-UHFFFAOYSA-N	0	3	324.265	2.035	10	0		DEAEHN
c1nc2c(c(NC[C@H]3CN4CCC[C@H]4CO3)n1)CCCCC2	ZINC000317077670	635109213	/nfs/dbraw/zinc/10/92/13/635109213.db2.gz	NTIZLTADHOOWGH-KBPBESRZSA-N	0	3	302.422	2.021	10	0		DEAEHN
CC[S@](=O)CCN[C@H](C)c1ccc(NC(C)=O)cc1OC	ZINC000747870019	638486513	/nfs/dbraw/zinc/48/65/13/638486513.db2.gz	BVTOXTLOIXYUCE-FIKIJFGZSA-N	0	3	312.435	2.073	10	0		DEAEHN
C[C@@H]1CN(C[C@@H](O)Cc2ccccc2C(F)(F)F)CCN1C	ZINC000751572820	639439310	/nfs/dbraw/zinc/43/93/10/639439310.db2.gz	CKSSGMAJVQOFHP-OCCSQVGLSA-N	0	3	316.367	2.245	10	0		DEAEHN
CCNC(=O)CCCC(=O)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000174210387	646797068	/nfs/dbraw/zinc/79/70/68/646797068.db2.gz	GOUZHWDLMTXAJR-MRXNPFEDSA-N	0	3	318.417	2.111	10	0		DEAEHN
Cc1ccn2c(CN3CCC[C@H](Cn4ccnn4)C3)cnc2c1	ZINC000092070115	684040916	/nfs/dbraw/zinc/04/09/16/684040916.db2.gz	SWWKDXQXFWLXIB-HNNXBMFYSA-N	0	3	310.405	2.146	10	0		DEAEHN
Cn1cc(CCC(=O)O[C@@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000117092744	684067286	/nfs/dbraw/zinc/06/72/86/684067286.db2.gz	JDVFMVSCPYFQHW-QGZVFWFLSA-N	0	3	313.401	2.170	10	0		DEAEHN
CN(Cc1cc(Cl)nc2ccccc12)CC(C)(CO)CO	ZINC000128963713	684175374	/nfs/dbraw/zinc/17/53/74/684175374.db2.gz	QGHHAONXXPPBEW-UHFFFAOYSA-N	0	3	308.809	2.311	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)C2=CCCCO2)C1	ZINC000190655885	684410367	/nfs/dbraw/zinc/41/03/67/684410367.db2.gz	RQBQGPXFMLJSGC-INIZCTEOSA-N	0	3	315.417	2.056	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCC2(O)CCCC2)[C@H]1c1ccccc1	ZINC000248088209	685154944	/nfs/dbraw/zinc/15/49/44/685154944.db2.gz	TUYHXSNEQHKTGF-HZPDHXFCSA-N	0	3	317.433	2.036	10	0		DEAEHN
Brc1ccccc1CNC[C@@H]1C[C@@H]2COC[C@@H]2O1	ZINC000724636581	777418070	/nfs/dbraw/zinc/41/80/70/777418070.db2.gz	NIEMUFNJISYYGC-DYEKYZERSA-N	0	3	312.207	2.343	10	0		DEAEHN
C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CNCc1cnccn1	ZINC000723823164	787345658	/nfs/dbraw/zinc/34/56/58/787345658.db2.gz	HHCACKHGULELFU-CHWSQXEVSA-N	0	3	306.410	2.069	10	0		DEAEHN
Cn1cc(CNCC(C)(C)CCCO)c(Br)n1	ZINC000712494707	792190219	/nfs/dbraw/zinc/19/02/19/792190219.db2.gz	AMFWYVOVEVJYDT-UHFFFAOYSA-N	0	3	304.232	2.071	10	0		DEAEHN
CS(=O)(=O)[C@H]1C[C@H](NCc2ccc(C(F)(F)F)cc2)C1	ZINC000714252621	792305973	/nfs/dbraw/zinc/30/59/73/792305973.db2.gz	CJNJTZSFDVRSDT-HAQNSBGRSA-N	0	3	307.337	2.371	10	0		DEAEHN
c1ccc(-c2ncc(CNCCOC[C@H]3CCOC3)cn2)cc1	ZINC000068993971	1082130223	/nfs/dbraw/zinc/13/02/23/1082130223.db2.gz	LQDDKZRQLYCVGJ-HNNXBMFYSA-N	0	3	313.401	2.286	10	0		DEAEHN
CN1CCC[C@H]2[C@H]1CCN2C(=O)c1ccoc1Br	ZINC000720817239	1086168311	/nfs/dbraw/zinc/16/83/11/1086168311.db2.gz	RHUJXQFVHPBNTK-MNOVXSKESA-N	0	3	313.195	2.351	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@@]2(NCc3cncnc3)CCC[C@@H]12	ZINC000711639358	1087175875	/nfs/dbraw/zinc/17/58/75/1087175875.db2.gz	KOGQPVRYQRJKSB-PBHICJAKSA-N	0	3	318.421	2.498	10	0		DEAEHN
C[C@H](NCc1cnc2n1CCC2)[C@H](C)NC(=O)OC(C)(C)C	ZINC000719117137	1088843342	/nfs/dbraw/zinc/84/33/42/1088843342.db2.gz	QKLAKAUMWAYCHG-RYUDHWBXSA-N	0	3	308.426	2.221	10	0		DEAEHN
Cc1nc(CNCCC2CC(O)C2)sc1Br	ZINC000719286430	1088926599	/nfs/dbraw/zinc/92/65/99/1088926599.db2.gz	FCIOCMOKKUPXFJ-UHFFFAOYSA-N	0	3	305.241	2.465	10	0		DEAEHN
C[C@@H]1[C@@H](NC(=O)c2csc(Br)c2)CCN1C	ZINC000719387038	1089057257	/nfs/dbraw/zinc/05/72/57/1089057257.db2.gz	WGPYBEXFNPIERV-APPZFPTMSA-N	0	3	303.225	2.333	10	0		DEAEHN
C[C@@H]1[C@H](NC(=O)c2ccsc2Br)CCN1C	ZINC000719399082	1089086141	/nfs/dbraw/zinc/08/61/41/1089086141.db2.gz	YXJBYFNBIUOVFU-VXNVDRBHSA-N	0	3	303.225	2.333	10	0		DEAEHN
Cc1ccc(CN[C@@]2(CO)CCOC2)c(C)c1Br	ZINC000719552332	1089289657	/nfs/dbraw/zinc/28/96/57/1089289657.db2.gz	DPROLHBVCDIDLB-CQSZACIVSA-N	0	3	314.223	2.307	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc(C(=O)N(C)C)cc1	ZINC000076856325	185047080	/nfs/dbraw/zinc/04/70/80/185047080.db2.gz	FDZMYKSGOQJCDK-INIZCTEOSA-N	0	3	319.449	2.095	10	0		DEAEHN
Cn1nnnc1SC[C@H](N)c1cccc(C(F)(F)F)c1	ZINC000081845360	192331324	/nfs/dbraw/zinc/33/13/24/192331324.db2.gz	RJJGDXGTOTZIDE-VIFPVBQESA-N	0	3	303.313	2.021	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)CCO1	ZINC000245944596	282125592	/nfs/dbraw/zinc/12/55/92/282125592.db2.gz	UKKVCIBZAPYFHI-QBPKDAKJSA-N	0	3	308.466	2.382	10	0		DEAEHN
NCc1cccc(S(=O)(=O)CCOc2ccc(F)cc2)c1	ZINC000163050283	197609298	/nfs/dbraw/zinc/60/92/98/197609298.db2.gz	MWMQFCIPDFXLAF-UHFFFAOYSA-N	0	3	309.362	2.137	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2cnn(CC(F)(F)F)c2)C1	ZINC000151920531	282130174	/nfs/dbraw/zinc/13/01/74/282130174.db2.gz	RCRSUQHQVQITCI-SNVBAGLBSA-N	0	3	319.331	2.051	10	0		DEAEHN
CCN[C@H](C)CS(=O)(=O)c1ccc(Br)cc1	ZINC000081933675	192340934	/nfs/dbraw/zinc/34/09/34/192340934.db2.gz	RBKRLKPZCPFYQX-SECBINFHSA-N	0	3	306.225	2.221	10	0		DEAEHN
COCCn1ncc(Br)c1[C@@](F)(CN)C(C)(C)C	ZINC000164024137	197652003	/nfs/dbraw/zinc/65/20/03/197652003.db2.gz	DEIPYBPZFROHOF-LBPRGKRZSA-N	0	3	322.222	2.462	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H](C)[C@@H]1CCCO1	ZINC000181286609	199275558	/nfs/dbraw/zinc/27/55/58/199275558.db2.gz	XPVSIBIWWVCYEY-VYDXJSESSA-N	0	3	319.449	2.374	10	0		DEAEHN
CC(C)N[C@](CSc1ncccc1Cl)(C(N)=O)C1CC1	ZINC000079448576	185172246	/nfs/dbraw/zinc/17/22/46/185172246.db2.gz	HMVMODQIVTXTPP-AWEZNQCLSA-N	0	3	313.854	2.459	10	0		DEAEHN
Cn1ccc2c1ncnc2Nc1ccc(N2CCN(C)CC2)cc1	ZINC000082359434	185177794	/nfs/dbraw/zinc/17/77/94/185177794.db2.gz	AJNYLXGBPAJJLW-UHFFFAOYSA-N	0	3	322.416	2.464	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(N3CCCCCC3)nc2)C1	ZINC000170867172	282180490	/nfs/dbraw/zinc/18/04/90/282180490.db2.gz	LLOTULXARDPHJK-MRXNPFEDSA-N	0	3	316.449	2.238	10	0		DEAEHN
CCC[C@@H](C[NH3+])[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000087403884	185223779	/nfs/dbraw/zinc/22/37/79/185223779.db2.gz	IMZOTWRSGCZYCM-QMMMGPOBSA-N	0	3	311.234	2.399	10	0		DEAEHN
CN[C@@H](c1sccc1Br)[C@H]1CCS(=O)(=O)C1	ZINC000087630648	185229555	/nfs/dbraw/zinc/22/95/55/185229555.db2.gz	QJQPSNIBVYANCE-IONNQARKSA-N	0	3	324.265	2.206	10	0		DEAEHN
CC[C@H](N)CS(=O)(=O)Cc1ccccc1Br	ZINC000088074705	185239022	/nfs/dbraw/zinc/23/90/22/185239022.db2.gz	CDIUHDVISGEPND-JTQLQIEISA-N	0	3	306.225	2.101	10	0		DEAEHN
O=C1[C@H](NC2CC2)CCN1c1c2nsnc2ccc1Cl	ZINC000088128046	185240339	/nfs/dbraw/zinc/24/03/39/185240339.db2.gz	RLBIORWAPOKPDH-SNVBAGLBSA-N	0	3	308.794	2.202	10	0		DEAEHN
CCN[C@@H]1CCN(c2ccc(OC)c(Br)c2)C1=O	ZINC000088320462	185245413	/nfs/dbraw/zinc/24/54/13/185245413.db2.gz	SEZLRPJXVSKSDT-LLVKDONJSA-N	0	3	313.195	2.173	10	0		DEAEHN
COc1ccc(-n2nnc([C@@H](C)N)c2C)cc1Br	ZINC000088321112	185245597	/nfs/dbraw/zinc/24/55/97/185245597.db2.gz	GSSWCYGCAMFLLS-SSDOTTSWSA-N	0	3	311.183	2.367	10	0		DEAEHN
Cc1nn(C)c(C)c1Oc1ncc(Br)cc1CN	ZINC000088453638	185251760	/nfs/dbraw/zinc/25/17/60/185251760.db2.gz	KGZNNDHFUZODJA-UHFFFAOYSA-N	0	3	311.183	2.445	10	0		DEAEHN
C[NH+](C)[C@@H]1CCN(C(=O)c2cc([O-])ccc2C(F)(F)F)C1	ZINC000193137681	282200247	/nfs/dbraw/zinc/20/02/47/282200247.db2.gz	URYAHZINJQXEFW-SECBINFHSA-N	0	3	302.296	2.187	10	0		DEAEHN
C[C@H]1CCC[C@@](N)(C(=O)Nc2cnc(Br)cn2)C1	ZINC000088446385	185251335	/nfs/dbraw/zinc/25/13/35/185251335.db2.gz	VAJOOEOHERGNSX-UFBFGSQYSA-N	0	3	313.199	2.085	10	0		DEAEHN
CN[C@@H](Cc1nc2ccccc2s1)C(C)(C)S(C)(=O)=O	ZINC000088518735	185254501	/nfs/dbraw/zinc/25/45/01/185254501.db2.gz	AIMPVAFYCLFJHV-LBPRGKRZSA-N	0	3	312.460	2.250	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1c(C)c(C)cc(C)c1C	ZINC000090293251	185289892	/nfs/dbraw/zinc/28/98/92/185289892.db2.gz	FFGILAYYUABMEY-UHFFFAOYSA-N	0	3	310.463	2.293	10	0		DEAEHN
N[C@H]1COC[C@@H]1c1nc(Cc2c(Cl)cccc2Cl)no1	ZINC000090364594	185292671	/nfs/dbraw/zinc/29/26/71/185292671.db2.gz	QGDSQTQMWZTUSS-KWQFWETISA-N	0	3	314.172	2.408	10	0		DEAEHN
CCCOc1ccc(NC(=O)[C@H]2COC[C@@H]2NC)cc1Cl	ZINC000090434324	185296187	/nfs/dbraw/zinc/29/61/87/185296187.db2.gz	JUZQDJNOOUZHKJ-AAEUAGOBSA-N	0	3	312.797	2.302	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1cc(C(F)(F)F)ccc1F	ZINC000090437617	185296240	/nfs/dbraw/zinc/29/62/40/185296240.db2.gz	QDLQYSWVAPQGDF-GZMMTYOYSA-N	0	3	306.259	2.017	10	0		DEAEHN
COc1ccc(CC(=O)N2CCCSC[C@@H]2CN(C)C)cc1	ZINC000090699955	185310557	/nfs/dbraw/zinc/31/05/57/185310557.db2.gz	WXLOVQVOKUVFEE-HNNXBMFYSA-N	0	3	322.474	2.133	10	0		DEAEHN
CN[C@@H]1C(=O)Nc2cc(OCCN3CCCC3)c(Cl)cc21	ZINC000092770043	185339370	/nfs/dbraw/zinc/33/93/70/185339370.db2.gz	ZIEAAXSPVYCRDF-AWEZNQCLSA-N	0	3	309.797	2.027	10	0		DEAEHN
Cc1[nH]ncc1CN1CCCC[C@@H]1c1nnc2n1CCCC2	ZINC000092812331	185343688	/nfs/dbraw/zinc/34/36/88/185343688.db2.gz	LRMVYOWJBFJMKI-CQSZACIVSA-N	0	3	300.410	2.373	10	0		DEAEHN
CCc1nc(CN(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)no1	ZINC000328654734	529735493	/nfs/dbraw/zinc/73/54/93/529735493.db2.gz	XSVBJOXDJJXEQF-YOEHRIQHSA-N	0	3	315.421	2.152	10	0		DEAEHN
Clc1ccc(OC[C@@H]2CNCCO2)c(Br)c1	ZINC000070834092	539345606	/nfs/dbraw/zinc/34/56/06/539345606.db2.gz	XKFBXZJLFCDJEG-VIFPVBQESA-N	0	3	306.587	2.470	10	0		DEAEHN
CN(CC(=O)OC(C)(C)C)C1CCN(CC2=CCCOC2)CC1	ZINC000190580463	529840504	/nfs/dbraw/zinc/84/05/04/529840504.db2.gz	ROQUWDJRLGFEPF-UHFFFAOYSA-N	0	3	324.465	2.071	10	0		DEAEHN
CN(C)c1ccncc1C(=O)NC[C@@H](c1cccs1)N(C)C	ZINC000183471113	282307716	/nfs/dbraw/zinc/30/77/16/282307716.db2.gz	IOXRFWPPBASHBH-AWEZNQCLSA-N	0	3	318.446	2.242	10	0		DEAEHN
C[C@H](NC(=O)C[C@@H]1CSCCN1)c1cc(F)ccc1F	ZINC000091134713	539418133	/nfs/dbraw/zinc/41/81/33/539418133.db2.gz	ULEOUNBQOVTTAC-GXSJLCMTSA-N	0	3	300.374	2.237	10	0		DEAEHN
CNCc1c(Cl)cccc1Sc1n[nH]c(=O)n1C1CC1	ZINC000111566372	185613559	/nfs/dbraw/zinc/61/35/59/185613559.db2.gz	UVMIZJUULUXVDN-UHFFFAOYSA-N	0	3	310.810	2.430	10	0		DEAEHN
c1ccc2c(c1)CC[C@H]2CCN1CCN(c2nccnn2)CC1	ZINC000625644467	365859590	/nfs/dbraw/zinc/85/95/90/365859590.db2.gz	ICFZXODQDXDDJX-INIZCTEOSA-N	0	3	309.417	2.114	10	0		DEAEHN
NC1(C(=O)NC[C@H]2C[C@@H]2c2ccccc2)Cc2ccccc2C1	ZINC000157778220	539573655	/nfs/dbraw/zinc/57/36/55/539573655.db2.gz	NVDGDQHVOWOKKO-QZTJIDSGSA-N	0	3	306.409	2.403	10	0		DEAEHN
CCOc1ccccc1[C@H](CC)NC[C@@H](O)CN1CCCC1=O	ZINC000179741322	539642331	/nfs/dbraw/zinc/64/23/31/539642331.db2.gz	YFKFOTFXDULKJH-ZBFHGGJFSA-N	0	3	320.433	2.109	10	0		DEAEHN
CN(C(=O)c1cnn(CCC(F)(F)F)c1)C1CCN(C)CC1	ZINC000182022631	199375303	/nfs/dbraw/zinc/37/53/03/199375303.db2.gz	IQKMQVAMLRNAOR-UHFFFAOYSA-N	0	3	318.343	2.002	10	0		DEAEHN
c1cc2cnccc2c(CN2CCN(C[C@H]3CCOC3)CC2)c1	ZINC000183380421	539661833	/nfs/dbraw/zinc/66/18/33/539661833.db2.gz	JYSPSSWCSOJEOJ-MRXNPFEDSA-N	0	3	311.429	2.389	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)NCc1ccc(Cl)cn1	ZINC000183472704	539663307	/nfs/dbraw/zinc/66/33/07/539663307.db2.gz	RPALIRFHTLQGJQ-GFCCVEGCSA-N	0	3	310.829	2.409	10	0		DEAEHN
CNC(=O)[C@H](NCCOc1ccccc1C(F)(F)F)C(C)C	ZINC000183642320	539663722	/nfs/dbraw/zinc/66/37/22/539663722.db2.gz	ILKWZKWEVIAFBE-CYBMUJFWSA-N	0	3	318.339	2.444	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cc(F)ccc2Br)C1	ZINC000071139975	190935368	/nfs/dbraw/zinc/93/53/68/190935368.db2.gz	NEMVDPFAZLBBHK-SNVBAGLBSA-N	0	3	315.186	2.364	10	0		DEAEHN
O=C1[C@H](N[C@@H]2CCCOC2)CCCN1Cc1ccc(F)cc1F	ZINC000191647617	539703058	/nfs/dbraw/zinc/70/30/58/539703058.db2.gz	OXQFOWKLQRIYQN-GDBMZVCRSA-N	0	3	324.371	2.224	10	0		DEAEHN
C[C@@H](NCc1cc(=O)n(C)c(=O)n1C)c1ccc2ccccc2c1	ZINC000192479764	539707133	/nfs/dbraw/zinc/70/71/33/539707133.db2.gz	ZJBZUVBAHDLHNO-CYBMUJFWSA-N	0	3	323.396	2.088	10	0		DEAEHN
Cc1c(C(=O)N(CCN(C)C)Cc2cccc(O)c2)ccn1C	ZINC000192540769	539707749	/nfs/dbraw/zinc/70/77/49/539707749.db2.gz	WENCPUXQQSGDQE-UHFFFAOYSA-N	0	3	315.417	2.243	10	0		DEAEHN
COc1cccc2c1CN(CCc1c(C)nn(C)c1C)[C@H]2CN	ZINC000071683160	191007106	/nfs/dbraw/zinc/00/71/06/191007106.db2.gz	NUCMYTJZVKZNMM-KRWDZBQOSA-N	0	3	314.433	2.104	10	0		DEAEHN
C[C@@H](c1cccnc1)N1CCN(C(=O)c2ccccc2CN)CC1	ZINC000071700473	191009279	/nfs/dbraw/zinc/00/92/79/191009279.db2.gz	GSZPFCFMEDKIRN-HNNXBMFYSA-N	0	3	324.428	2.059	10	0		DEAEHN
NC[C@H](c1ccc(Cl)s1)N1CCCC2(C1)OCCO2	ZINC000133660758	186004117	/nfs/dbraw/zinc/00/41/17/186004117.db2.gz	XHIQUZNNGCGJIC-SNVBAGLBSA-N	0	3	302.827	2.240	10	0		DEAEHN
CCNCc1cc(F)c(F)c(S(=O)(=O)N(C)[C@H](C)CC)c1	ZINC000138458424	186017043	/nfs/dbraw/zinc/01/70/43/186017043.db2.gz	OMEIDTRSWXYJIU-SNVBAGLBSA-N	0	3	320.405	2.493	10	0		DEAEHN
CC[C@H](C)N(C)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138457583	186017213	/nfs/dbraw/zinc/01/72/13/186017213.db2.gz	NPPFSHGPCIDVBN-VIFPVBQESA-N	0	3	306.378	2.103	10	0		DEAEHN
CC(C)[C@@H]1N[C@@H](c2cccs2)N(C[C@@H]2CCN(C)C2)C1=O	ZINC000142172289	186032159	/nfs/dbraw/zinc/03/21/59/186032159.db2.gz	SBEJSNHXTIWLKV-VHDGCEQUSA-N	0	3	307.463	2.155	10	0		DEAEHN
CCCCN(CC)[C@@]1(CN)CCS(=O)(=O)c2ccccc21	ZINC000147637479	186040950	/nfs/dbraw/zinc/04/09/50/186040950.db2.gz	SEJCMAOWSAYNKL-MRXNPFEDSA-N	0	3	310.463	2.140	10	0		DEAEHN
CCC[NH2+]Cc1cc(F)c(C)c(S(=O)(=O)[N-]CC(F)F)c1	ZINC000148181011	186044073	/nfs/dbraw/zinc/04/40/73/186044073.db2.gz	HNWJCGPGVMYBIV-UHFFFAOYSA-N	0	3	324.368	2.177	10	0		DEAEHN
CC[C@H]1N[C@@H](c2cccs2)N(CCN2CCCCC2)C1=O	ZINC000144061155	186034850	/nfs/dbraw/zinc/03/48/50/186034850.db2.gz	OGCCOTZBVCQHBH-UKRRQHHQSA-N	0	3	307.463	2.443	10	0		DEAEHN
C[C@@H](O)C(C)(C)NCC(=O)Nc1cccc(Br)c1	ZINC000145022624	186036523	/nfs/dbraw/zinc/03/65/23/186036523.db2.gz	SWZCBBYTDHMBHO-SECBINFHSA-N	0	3	315.211	2.137	10	0		DEAEHN
CC(C)CCC[C@H](C)NC(=O)CN1CCCN(C2CC2)CC1	ZINC000145761287	186037934	/nfs/dbraw/zinc/03/79/34/186037934.db2.gz	BVJGMJWPBPZMOC-INIZCTEOSA-N	0	3	309.498	2.488	10	0		DEAEHN
CC[C@H]1CN(c2ncnc3c(C)csc32)CCN1C[C@H](C)O	ZINC000248960513	539777480	/nfs/dbraw/zinc/77/74/80/539777480.db2.gz	MJMFWNKVHRGPKV-STQMWFEESA-N	0	3	320.462	2.281	10	0		DEAEHN
CCN(CCCN[C@H]1CSc2ccccc21)S(C)(=O)=O	ZINC000155832007	186116378	/nfs/dbraw/zinc/11/63/78/186116378.db2.gz	IWQPJYUPSAFJOB-ZDUSSCGKSA-N	0	3	314.476	2.095	10	0		DEAEHN
Fc1ccc(Br)cc1COC[C@H]1CNCCO1	ZINC000163992364	186145706	/nfs/dbraw/zinc/14/57/06/186145706.db2.gz	SCZVLCKDWSQTPU-LLVKDONJSA-N	0	3	304.159	2.093	10	0		DEAEHN
CCn1ncc(Br)c1C(=O)[C@H]1CCCCCN1	ZINC000164396580	186158716	/nfs/dbraw/zinc/15/87/16/186158716.db2.gz	HFPOBXXZKQAHLG-SNVBAGLBSA-N	0	3	300.200	2.380	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccccc1-n1cccn1)N(C)C	ZINC000179686247	186205389	/nfs/dbraw/zinc/20/53/89/186205389.db2.gz	MUEHKQHVPORDMB-MRXNPFEDSA-N	0	3	300.406	2.219	10	0		DEAEHN
CC(=O)c1cccc(OCC(=O)NC[C@H]2CCN2C(C)(C)C)c1	ZINC000617021382	363002865	/nfs/dbraw/zinc/00/28/65/363002865.db2.gz	WRJHRCLIZBLKCE-OAHLLOKOSA-N	0	3	318.417	2.257	10	0		DEAEHN
O=C(Nc1ccc(-n2cccn2)cc1)N1CCN2CCC[C@H]2C1	ZINC000171888177	198002120	/nfs/dbraw/zinc/00/21/20/198002120.db2.gz	PKSKGRLVYUBQKF-INIZCTEOSA-N	0	3	311.389	2.184	10	0		DEAEHN
CN1CCC(NC(=O)N2CCC(Cc3ccccn3)CC2)CC1	ZINC000171897800	198004392	/nfs/dbraw/zinc/00/43/92/198004392.db2.gz	OZENSAKJJJEEJL-UHFFFAOYSA-N	0	3	316.449	2.140	10	0		DEAEHN
C[C@H](Cc1ccccc1F)NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171903847	198004696	/nfs/dbraw/zinc/00/46/96/198004696.db2.gz	HPYKJBXDKFBRCC-UKRRQHHQSA-N	0	3	305.397	2.246	10	0		DEAEHN
CCC[C@H](NC(=O)N1CCO[C@H](CN(C)C)C1)c1ccccc1	ZINC000172116218	198041555	/nfs/dbraw/zinc/04/15/55/198041555.db2.gz	HGKYBWDBUOKYQE-SJORKVTESA-N	0	3	319.449	2.500	10	0		DEAEHN
O=C([C@@H]1C[C@H]1c1c(F)cccc1F)N1CCN2CCC[C@@H]2C1	ZINC000172290128	198071942	/nfs/dbraw/zinc/07/19/42/198071942.db2.gz	QASYMQWHGBQXQM-JHJVBQTASA-N	0	3	306.356	2.375	10	0		DEAEHN
c1c[nH]c([C@@H](N[C@H]2CCc3nnnn3CC2)C2CCCCC2)n1	ZINC000333707450	539969706	/nfs/dbraw/zinc/96/97/06/539969706.db2.gz	HXNROJMACJLFRH-ZFWWWQNUSA-N	0	3	315.425	2.012	10	0		DEAEHN
CN(C)CCOc1ccc(CNC(=O)N(C)C2CCC2)cc1	ZINC000173753744	198248129	/nfs/dbraw/zinc/24/81/29/198248129.db2.gz	PTYUTAIWDFBUBM-UHFFFAOYSA-N	0	3	305.422	2.321	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCc2ccc3c(c2)OCO3)CCN1C	ZINC000173891972	198264730	/nfs/dbraw/zinc/26/47/30/198264730.db2.gz	WQXTWUVMHUCORK-TZMCWYRMSA-N	0	3	319.405	2.039	10	0		DEAEHN
C[C@H](COCc1ccccc1)NC(=O)NC[C@@H](C)N(C)C1CC1	ZINC000174735002	198377219	/nfs/dbraw/zinc/37/72/19/198377219.db2.gz	NGHBGUYDQNQJMI-HUUCEWRRSA-N	0	3	319.449	2.374	10	0		DEAEHN
CN1CC[C@@H](NC(=O)Cc2ccc(O)cc2)[C@H]1c1ccccc1	ZINC000247988566	283047998	/nfs/dbraw/zinc/04/79/98/283047998.db2.gz	ITGDFWKFMWBRHZ-IEBWSBKVSA-N	0	3	310.397	2.496	10	0		DEAEHN
CC(C)N1CC[C@H](Nc2ccc3nnc(C(F)(F)F)n3n2)C1	ZINC000069000715	354843656	/nfs/dbraw/zinc/84/36/56/354843656.db2.gz	MBQKASZQRFJULX-VIFPVBQESA-N	0	3	314.315	2.038	10	0		DEAEHN
O[C@@H](CN1CCC2(CC1)OCCO2)c1ccc2cc[nH]c2c1	ZINC000004959191	181179628	/nfs/dbraw/zinc/17/96/28/181179628.db2.gz	CTXJSJUNCBVUFF-INIZCTEOSA-N	0	3	302.374	2.040	10	0		DEAEHN
NC[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1)C(F)(F)F	ZINC000401722272	540142584	/nfs/dbraw/zinc/14/25/84/540142584.db2.gz	OEWQBLUROHAHHV-MRVPVSSYSA-N	0	3	300.202	2.325	10	0		DEAEHN
C(O[C@@H]1CCCN(C2CCOCC2)C1)c1nc(C2CC2)no1	ZINC000097942599	355706630	/nfs/dbraw/zinc/70/66/30/355706630.db2.gz	BYVBRCIFIBGJAN-CQSZACIVSA-N	0	3	307.394	2.107	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCCCn1ccc2ccccc21	ZINC000139233517	355874571	/nfs/dbraw/zinc/87/45/71/355874571.db2.gz	PITBCFYKCZYGNH-INIZCTEOSA-N	0	3	314.433	2.425	10	0		DEAEHN
CC(C)CCN1CC[C@@H](N2CCN(CCC(C)C)CC2)C1=O	ZINC000169793235	355984568	/nfs/dbraw/zinc/98/45/68/355984568.db2.gz	MAPDUFSQCAECNA-QGZVFWFLSA-N	0	3	309.498	2.297	10	0		DEAEHN
CNc1cc(N2CCC[C@H]2CN[C@H](C)c2ccoc2)ncn1	ZINC000180572802	356053113	/nfs/dbraw/zinc/05/31/13/356053113.db2.gz	OUEDEORRBBDWRD-OCCSQVGLSA-N	0	3	301.394	2.431	10	0		DEAEHN
COc1ccc([C@H](C)NC[C@@H](C)CS(C)(=O)=O)cc1F	ZINC000182021117	356104577	/nfs/dbraw/zinc/10/45/77/356104577.db2.gz	NDUWKMRCGVBGIP-MNOVXSKESA-N	0	3	303.399	2.166	10	0		DEAEHN
COC(=O)CCN1CCN(C[C@@H](C)c2ccccc2)[C@@H](C)C1	ZINC000182109611	356109764	/nfs/dbraw/zinc/10/97/64/356109764.db2.gz	CRBJBJAGRVBHFP-CVEARBPZSA-N	0	3	304.434	2.359	10	0		DEAEHN
CCS(=O)(=O)NCCN[C@@H]1c2ccccc2CCC1(C)C	ZINC000183131224	356161471	/nfs/dbraw/zinc/16/14/71/356161471.db2.gz	COZQUQLEHXEDLU-OAHLLOKOSA-N	0	3	310.463	2.229	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ncn(C3CCCCC3)n2)C1	ZINC000184514536	356192648	/nfs/dbraw/zinc/19/26/48/356192648.db2.gz	YXVWEZXCBKBPKK-ZDUSSCGKSA-N	0	3	320.441	2.389	10	0		DEAEHN
Cc1ccc(C[C@H](C)NS(=O)(=O)C[C@H]2CCCCN2)s1	ZINC000080248278	192016592	/nfs/dbraw/zinc/01/65/92/192016592.db2.gz	UUWGSQBRAWVHEO-WCQYABFASA-N	0	3	316.492	2.049	10	0		DEAEHN
NCc1nc(C(F)(F)F)ccc1I	ZINC000307183518	356407890	/nfs/dbraw/zinc/40/78/90/356407890.db2.gz	YFTFFJXBUCVKBG-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
O=C(Nc1ccc2ccccc2c1)C(=O)N1CCN2CCC[C@H]2C1	ZINC000177694222	198763006	/nfs/dbraw/zinc/76/30/06/198763006.db2.gz	JZZGZQGHWZKNLO-KRWDZBQOSA-N	0	3	323.396	2.085	10	0		DEAEHN
CCCCN(c1ccccc1)[C@@]1(CN)CCCS(=O)(=O)C1	ZINC000081580810	192295733	/nfs/dbraw/zinc/29/57/33/192295733.db2.gz	RVMBKKAKLKEERY-MRXNPFEDSA-N	0	3	310.463	2.199	10	0		DEAEHN
CC[C@H](NC)c1cccc(S(=O)(=O)N[C@@H](C)CCOC)c1	ZINC000081717817	192316574	/nfs/dbraw/zinc/31/65/74/192316574.db2.gz	MGDGRKFUKGABNJ-WFASDCNBSA-N	0	3	314.451	2.060	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)Nc1nc2cc3c(cc2s1)OCCO3	ZINC000236938856	202082885	/nfs/dbraw/zinc/08/28/85/202082885.db2.gz	UTKJVBGQTNGOJC-SDBXPKJASA-N	0	3	321.402	2.379	10	0		DEAEHN
O[C@@H](CNC[C@H]1CCCN1Cc1ccccc1)C(F)(F)F	ZINC000390698252	356709924	/nfs/dbraw/zinc/70/99/24/356709924.db2.gz	IPYVMSVJLYWEAK-KGLIPLIRSA-N	0	3	302.340	2.164	10	0		DEAEHN
CCc1ccc(CN)cc1S(=O)(=O)NC(C1CC1)C1CC1	ZINC000088999197	192690369	/nfs/dbraw/zinc/69/03/69/192690369.db2.gz	DUQGWZDYNBVXQH-UHFFFAOYSA-N	0	3	308.447	2.175	10	0		DEAEHN
O=C([O-])CN(CC1CC1)C1CC([NH2+][C@H]2CCC[C@@H]2C2CC2)C1	ZINC000263536582	304066421	/nfs/dbraw/zinc/06/64/21/304066421.db2.gz	ZOCKFHSIGJBNNB-BACDZXNISA-N	0	3	306.450	2.482	10	0		DEAEHN
O=C([O-])C[N@H+](CC1CC1)C1CC(N[C@H]2CCC[C@@H]2C2CC2)C1	ZINC000263536582	304066424	/nfs/dbraw/zinc/06/64/24/304066424.db2.gz	ZOCKFHSIGJBNNB-BACDZXNISA-N	0	3	306.450	2.482	10	0		DEAEHN
O=C([O-])C[N@@H+](CC1CC1)C1CC(N[C@H]2CCC[C@@H]2C2CC2)C1	ZINC000263536582	304066427	/nfs/dbraw/zinc/06/64/27/304066427.db2.gz	ZOCKFHSIGJBNNB-BACDZXNISA-N	0	3	306.450	2.482	10	0		DEAEHN
CNC(=O)CCN(C)Cc1cccc(OCc2ccccn2)c1	ZINC000179413423	199030802	/nfs/dbraw/zinc/03/08/02/199030802.db2.gz	XBFFJFGCTKRLMN-UHFFFAOYSA-N	0	3	313.401	2.229	10	0		DEAEHN
CC(C)C[C@H](CO)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179464012	199039766	/nfs/dbraw/zinc/03/97/66/199039766.db2.gz	WJNBCAVPDYVXES-BRWVUGGUSA-N	0	3	319.449	2.138	10	0		DEAEHN
CN(Cc1cccc2nccn21)[C@@H]1CCCN(c2cccnn2)C1	ZINC000180078903	199114796	/nfs/dbraw/zinc/11/47/96/199114796.db2.gz	FDPKSFGLKKWYGN-OAHLLOKOSA-N	0	3	322.416	2.225	10	0		DEAEHN
CC[C@@H](C(=O)N1CCN2CCC[C@@H]2C1)c1ccc(OC)cc1	ZINC000180472238	199163379	/nfs/dbraw/zinc/16/33/79/199163379.db2.gz	QHOZPBPYUZAWDZ-NVXWUHKLSA-N	0	3	302.418	2.495	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C)c1F	ZINC000180471879	199163525	/nfs/dbraw/zinc/16/35/25/199163525.db2.gz	SNVURODVSJVNML-CYBMUJFWSA-N	0	3	323.412	2.165	10	0		DEAEHN
CCCNCc1sccc1S(=O)(=O)N[C@H]1CC1(C)C	ZINC000089014075	192698955	/nfs/dbraw/zinc/69/89/55/192698955.db2.gz	IDNQJJMHWLFVHA-LBPRGKRZSA-N	0	3	302.465	2.325	10	0		DEAEHN
CNCc1ccccc1S(=O)(=O)N(C)c1cccc(F)c1	ZINC000089021246	192699580	/nfs/dbraw/zinc/69/95/80/192699580.db2.gz	BPVFNSALHMNGDN-UHFFFAOYSA-N	0	3	308.378	2.370	10	0		DEAEHN
CCN1CCN(c2cccc(NC(=O)C[C@H](O)C(C)C)c2)CC1	ZINC000187401275	200107306	/nfs/dbraw/zinc/10/73/06/200107306.db2.gz	SJDXEAYZXDRFCG-KRWDZBQOSA-N	0	3	319.449	2.174	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NCCN(C)Cc2ccccc2)CC[C@H]1C	ZINC000187424579	200111184	/nfs/dbraw/zinc/11/11/84/200111184.db2.gz	KATFFGUGYLNGBI-NVXWUHKLSA-N	0	3	319.449	2.185	10	0		DEAEHN
Cc1nccnc1[C@@H](C)NC1CCN(Cc2ccccn2)CC1	ZINC000187788014	200156764	/nfs/dbraw/zinc/15/67/64/200156764.db2.gz	HOYUWQOKNWMJDQ-OAHLLOKOSA-N	0	3	311.433	2.495	10	0		DEAEHN
Cc1cc(C(=O)NCC2(N(C)C)Cc3ccccc3C2)c(C)[nH]1	ZINC000607535441	361094854	/nfs/dbraw/zinc/09/48/54/361094854.db2.gz	BLFYXOPJKDONEG-UHFFFAOYSA-N	0	3	311.429	2.461	10	0		DEAEHN
O=C(CN1CCC[C@@H]1CCCO)NC12CC3CC(CC(C3)C1)C2	ZINC000607733496	361109491	/nfs/dbraw/zinc/10/94/91/361109491.db2.gz	WWLPJEBETXDRAH-YMVOSSCXSA-N	0	3	320.477	2.308	10	0		DEAEHN
O=C(N[C@@H]1C[C@H]1c1ccc(F)cc1)N1CCN2CCC[C@H]2C1	ZINC000195234252	201363135	/nfs/dbraw/zinc/36/31/35/201363135.db2.gz	HRYNLYPDHCVWDQ-HRCADAONSA-N	0	3	303.381	2.171	10	0		DEAEHN
CC(=O)[C@@H](C)CCCCC(=O)NC1CCN([C@@H]2CCOC2)CC1	ZINC000620012285	363932396	/nfs/dbraw/zinc/93/23/96/363932396.db2.gz	YIZYDMLQVXTBDG-WMLDXEAASA-N	0	3	324.465	2.141	10	0		DEAEHN
C[C@](C[NH3+])([N-]S(=O)(=O)c1cccc(Cl)c1Cl)C1CC1	ZINC000130370523	291332832	/nfs/dbraw/zinc/33/28/32/291332832.db2.gz	DVTXYFXYEXBKEN-GFCCVEGCSA-N	0	3	323.245	2.399	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2cc(C)ccc2OC)CC12COC2	ZINC000449360221	240393207	/nfs/dbraw/zinc/39/32/07/240393207.db2.gz	HONQMTWHGREAOO-OAHLLOKOSA-N	0	3	319.401	2.015	10	0		DEAEHN
OCCN1CCC[C@@H](NCc2csc(C(F)(F)F)c2)C1	ZINC000623406829	365018569	/nfs/dbraw/zinc/01/85/69/365018569.db2.gz	LNEFXYKIDMVHMZ-LLVKDONJSA-N	0	3	308.369	2.313	10	0		DEAEHN
O[C@]1(CNCc2ccsc2Br)CCSC1	ZINC000623438654	365030358	/nfs/dbraw/zinc/03/03/58/365030358.db2.gz	GYECGPNERZVOFX-JTQLQIEISA-N	0	3	308.266	2.468	10	0		DEAEHN
COc1cccc2c1N(C(=O)C[C@H]1CSCCN1)CCC2	ZINC000091137042	193003471	/nfs/dbraw/zinc/00/34/71/193003471.db2.gz	UGGAHLALHQSKDN-ZDUSSCGKSA-N	0	3	306.431	2.070	10	0		DEAEHN
CN1CCOC[C@H]1CNCc1ccc(F)cc1Br	ZINC000623711412	365139388	/nfs/dbraw/zinc/13/93/88/365139388.db2.gz	DORMRJNSQJBMKI-GFCCVEGCSA-N	0	3	317.202	2.008	10	0		DEAEHN
CCNc1cc(C(=O)N2CCC[C@H](N(C)C)C2)cc(Cl)n1	ZINC000091427516	193053988	/nfs/dbraw/zinc/05/39/88/193053988.db2.gz	KXHFWWDQIFLAHH-LBPRGKRZSA-N	0	3	310.829	2.333	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000091480039	193062055	/nfs/dbraw/zinc/06/20/55/193062055.db2.gz	JBXZCGVLMJQBPQ-ZYHUDNBSSA-N	0	3	302.296	2.187	10	0		DEAEHN
CCS(=O)(=O)CCC[C@@H](O)C1(N(C)C)CCCCCC1	ZINC000091653978	193084857	/nfs/dbraw/zinc/08/48/57/193084857.db2.gz	SZMVKLHBOFIWCY-CQSZACIVSA-N	0	3	305.484	2.217	10	0		DEAEHN
[NH3+]C1CCC([N-]S(=O)(=O)c2ccc(Cl)cc2F)CC1	ZINC000091843376	193116146	/nfs/dbraw/zinc/11/61/46/193116146.db2.gz	PFEZRDIXMFZUTB-UHFFFAOYSA-N	0	3	306.790	2.027	10	0		DEAEHN
CCOC[C@H](C)NCc1cnc2cnc(Br)cn12	ZINC000092049818	193148628	/nfs/dbraw/zinc/14/86/28/193148628.db2.gz	SGRNDWDOIHSVLF-VIFPVBQESA-N	0	3	313.199	2.006	10	0		DEAEHN
COc1ccccc1CN1CCC(N2CCO[C@H](C)C2)CC1	ZINC000092079716	193154677	/nfs/dbraw/zinc/15/46/77/193154677.db2.gz	HMDDVLIMCWXVIZ-OAHLLOKOSA-N	0	3	304.434	2.380	10	0		DEAEHN
C[C@@H]1CN(S(=O)(=O)c2ccc(CNC3CC3)cc2)C[C@H]1C	ZINC000092091459	193155931	/nfs/dbraw/zinc/15/59/31/193155931.db2.gz	DRHNXUBHWAZTJK-CHWSQXEVSA-N	0	3	308.447	2.215	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)c(F)c1	ZINC000092115533	193163573	/nfs/dbraw/zinc/16/35/73/193163573.db2.gz	ADPLLJOJXCHASU-VXGBXAGGSA-N	0	3	314.426	2.212	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1N(C)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115972	193164334	/nfs/dbraw/zinc/16/43/34/193164334.db2.gz	VRVBLUKWXVQWNH-RISCZKNCSA-N	0	3	314.426	2.484	10	0		DEAEHN
C[C@H](N[C@@H]1CCO[C@@H]1C)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000121392013	299392217	/nfs/dbraw/zinc/39/22/17/299392217.db2.gz	QBLKTQAGYQEVMK-OPQQBVKSSA-N	0	3	301.383	2.057	10	0		DEAEHN
Cc1ccc(Oc2ccc(NC(=O)[C@@H]3C[C@@H](O)CN3)cc2)cc1	ZINC000261786548	203116758	/nfs/dbraw/zinc/11/67/58/203116758.db2.gz	SLZRRSDRTUIGOL-PBHICJAKSA-N	0	3	312.369	2.449	10	0		DEAEHN
[NH3+][C@@]1(C(=O)[O-])CCC[C@H]1CCN1CCC(C(F)(F)F)CC1	ZINC000093596145	193271329	/nfs/dbraw/zinc/27/13/29/193271329.db2.gz	SPRWFZKVWVBDTA-GWCFXTLKSA-N	0	3	308.344	2.233	10	0		DEAEHN
CCC[NH2+][C@]1(C(=O)[O-])CC[C@H](N(CCOC)[C@@H](C)CC)C1	ZINC000093827662	193312874	/nfs/dbraw/zinc/31/28/74/193312874.db2.gz	YYCGAZNTZHUVDR-OFQRWUPVSA-N	0	3	300.443	2.109	10	0		DEAEHN
CN[C@@]1(C(N)=O)CC[C@H](Sc2nc3ccccc3s2)C1	ZINC000093849278	193318066	/nfs/dbraw/zinc/31/80/66/193318066.db2.gz	WYQPCHNPQQETFG-XPTSAGLGSA-N	0	3	307.444	2.384	10	0		DEAEHN
CN[C@H](c1ccccc1C(F)(F)F)[C@H]1CN(C)CCN1C	ZINC000093894706	193325514	/nfs/dbraw/zinc/32/55/14/193325514.db2.gz	QACYFNSDJBGOEE-ZIAGYGMSSA-N	0	3	301.356	2.212	10	0		DEAEHN
N=C(N)c1ccc(C(F)(F)F)nc1OCC1CCOCC1	ZINC000094336866	193361040	/nfs/dbraw/zinc/36/10/40/193361040.db2.gz	PMZBBIKIIARFQR-UHFFFAOYSA-N	0	3	303.284	2.190	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@H](N2CCC[C@@H]2[C@@H]2CCCC2=O)C1	ZINC000094636741	193387138	/nfs/dbraw/zinc/38/71/38/193387138.db2.gz	YOXPUFJRTAFLAX-LJISPDSOSA-N	0	3	313.463	2.176	10	0		DEAEHN
CN[C@H](c1ccc(F)cn1)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094643098	193389077	/nfs/dbraw/zinc/38/90/77/193389077.db2.gz	FAJXCVCMRZKXKF-JKOKRWQUSA-N	0	3	300.399	2.085	10	0		DEAEHN
CCS(=O)(=O)CCCN1CC(C)(C)NCc2ccccc21	ZINC000094420923	193369030	/nfs/dbraw/zinc/36/90/30/193369030.db2.gz	NPYRBUPZEJYGCR-UHFFFAOYSA-N	0	3	310.463	2.200	10	0		DEAEHN
CCCN[C@@H]1CCCc2sc([C@H]3CN4CCN3CC4)nc21	ZINC000094511098	193375218	/nfs/dbraw/zinc/37/52/18/193375218.db2.gz	CJNANCRKOWUXQC-CHWSQXEVSA-N	0	3	306.479	2.192	10	0		DEAEHN
CC[C@@H](C)[NH2+]CC(=O)Nc1cc(Br)ccc1[O-]	ZINC000094573591	193381495	/nfs/dbraw/zinc/38/14/95/193381495.db2.gz	CXPLHYHTUNJGHU-MRVPVSSYSA-N	0	3	301.184	2.481	10	0		DEAEHN
CC[NH2+]C(C)(C)C(=O)Nc1cc(Br)ccc1[O-]	ZINC000094573520	193381749	/nfs/dbraw/zinc/38/17/49/193381749.db2.gz	RCIRIDUPWWKKGI-UHFFFAOYSA-N	0	3	301.184	2.481	10	0		DEAEHN
N[C@@H](C[S@@](=O)c1cccc(F)c1)c1ccc2c(c1)OCO2	ZINC000094625458	193385118	/nfs/dbraw/zinc/38/51/18/193385118.db2.gz	UDABKWFYAVNIHB-ZSEKCTLFSA-N	0	3	307.346	2.362	10	0		DEAEHN
CCN[C@H](C)c1cc(F)ccc1OCCS(=O)(=O)CC	ZINC000094618984	193385141	/nfs/dbraw/zinc/38/51/41/193385141.db2.gz	XIKYRNLWYIYPMA-LLVKDONJSA-N	0	3	303.399	2.310	10	0		DEAEHN
CCN[C@@H](C)c1cc(F)ccc1OCCCS(C)(=O)=O	ZINC000094618720	193385255	/nfs/dbraw/zinc/38/52/55/193385255.db2.gz	VIXVUAMNVDFXDW-NSHDSACASA-N	0	3	303.399	2.310	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)N1CCN(C)[C@@H](C)[C@@H]1C)CC2	ZINC000530289637	284396597	/nfs/dbraw/zinc/39/65/97/284396597.db2.gz	FKVROCGMKNQUAX-MELADBBJSA-N	0	3	318.465	2.189	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N1CCN(C)[C@@H](C)[C@@H]1C)C2	ZINC000530289637	284396601	/nfs/dbraw/zinc/39/66/01/284396601.db2.gz	FKVROCGMKNQUAX-MELADBBJSA-N	0	3	318.465	2.189	10	0		DEAEHN
Cc1cc(F)ccc1S(=O)(=O)[N-]c1ccc(CC[NH3+])cc1	ZINC000020224452	182198769	/nfs/dbraw/zinc/19/87/69/182198769.db2.gz	ZCABDOKIRVFLGO-UHFFFAOYSA-N	0	3	308.378	2.436	10	0		DEAEHN
COc1c(Cl)cc(CNCCN2CCOCC2)cc1Cl	ZINC000020967753	182257214	/nfs/dbraw/zinc/25/72/14/182257214.db2.gz	OFIBUWZDGWMZJV-UHFFFAOYSA-N	0	3	319.232	2.424	10	0		DEAEHN
C[C@H](N[C@H]1CCc2cc(Cl)ccc21)C(=O)N1CCOCC1	ZINC000098123303	193788853	/nfs/dbraw/zinc/78/88/53/193788853.db2.gz	ZIFQVLFSDZQBKW-NHYWBVRUSA-N	0	3	308.809	2.164	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@@H]1CCC[C@H]2OCC[C@H]21	ZINC000487322190	248754826	/nfs/dbraw/zinc/75/48/26/248754826.db2.gz	PWVCPHWMUZFHCY-UFGOTCBOSA-N	0	3	314.227	2.230	10	0		DEAEHN
CCOC(=O)c1cc(CC)sc1NC(=O)CNCC1CC1	ZINC000040833616	183140323	/nfs/dbraw/zinc/14/03/23/183140323.db2.gz	QDAJAEUOEHNZRS-UHFFFAOYSA-N	0	3	310.419	2.425	10	0		DEAEHN
Nc1cc(Br)cnc1OCCN1CCCCC1	ZINC000040714000	183121938	/nfs/dbraw/zinc/12/19/38/183121938.db2.gz	VZLAXEJWRAEDKM-UHFFFAOYSA-N	0	3	300.200	2.291	10	0		DEAEHN
COc1cc(Br)cc(C)c1NC(=O)C(C)(C)N	ZINC000040922833	183149053	/nfs/dbraw/zinc/14/90/53/183149053.db2.gz	DRAISASXBOSGFZ-UHFFFAOYSA-N	0	3	301.184	2.442	10	0		DEAEHN
C[C@](N)(C(=O)NCc1cc(Br)ccc1F)C1CC1	ZINC000041069512	183162271	/nfs/dbraw/zinc/16/22/71/183162271.db2.gz	RVDCKHRAMRSUCO-CYBMUJFWSA-N	0	3	315.186	2.332	10	0		DEAEHN
C[C@H](C(=O)N1C[C@@H](C)N(CCN(C)C)[C@@H](C)C1)C1CCCC1	ZINC000041313782	183184718	/nfs/dbraw/zinc/18/47/18/183184718.db2.gz	XRRDQWZIJLAVDT-XHSDSOJGSA-N	0	3	309.498	2.296	10	0		DEAEHN
OC[C@@H](NC[C@H]1CCCO1)c1cc(Br)cs1	ZINC000041678624	183216354	/nfs/dbraw/zinc/21/63/54/183216354.db2.gz	PBOSYOJBHUIVMQ-NXEZZACHSA-N	0	3	306.225	2.313	10	0		DEAEHN
COC[C@@H](C)NC(=O)CNCCc1ccc(Cl)cc1Cl	ZINC000042312293	183252971	/nfs/dbraw/zinc/25/29/71/183252971.db2.gz	CNEZCSXZONCBQY-SNVBAGLBSA-N	0	3	319.232	2.277	10	0		DEAEHN
CNCc1cccc(Br)c1OCC(=O)NC(C)C	ZINC000042411557	183265430	/nfs/dbraw/zinc/26/54/30/183265430.db2.gz	NPKYLUHTDNOFPN-UHFFFAOYSA-N	0	3	315.211	2.072	10	0		DEAEHN
CCCNCc1cccc(Br)c1O[C@@H](C)C(N)=O	ZINC000042411781	183265809	/nfs/dbraw/zinc/26/58/09/183265809.db2.gz	RCAVAVMOZQEPBQ-VIFPVBQESA-N	0	3	315.211	2.201	10	0		DEAEHN
COCCN(C)[C@@H](CN)c1cc(Br)ccc1OC	ZINC000042458842	183272636	/nfs/dbraw/zinc/27/26/36/183272636.db2.gz	FAJCSRMLVDRNBV-LBPRGKRZSA-N	0	3	317.227	2.036	10	0		DEAEHN
COCCN([C@@H](C)COC)[C@@H](CN)c1ccc(Cl)s1	ZINC000042602958	183290311	/nfs/dbraw/zinc/29/03/11/183290311.db2.gz	FAAVDJSSTLZFOF-QWRGUYRKSA-N	0	3	306.859	2.385	10	0		DEAEHN
N[C@H](CN(CC(F)(F)F)C1CC1)c1ccc2c(c1)OCO2	ZINC000042748913	183304312	/nfs/dbraw/zinc/30/43/12/183304312.db2.gz	YKXLZANZZJTEGW-LLVKDONJSA-N	0	3	302.296	2.442	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccccc1Cl)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043051530	183333173	/nfs/dbraw/zinc/33/31/73/183333173.db2.gz	LGQYOMVDLCXDMW-GLQYFDAESA-N	0	3	309.841	2.281	10	0		DEAEHN
C[C@H](N)[C@H](c1cccc(Cl)c1)N(CC(N)=O)C1CCCC1	ZINC000043015968	183327853	/nfs/dbraw/zinc/32/78/53/183327853.db2.gz	ABQGUYAHVHPELO-MEDUHNTESA-N	0	3	309.841	2.458	10	0		DEAEHN
Cc1ccccc1[C@@H](CN)Oc1cccc(S(C)(=O)=O)c1	ZINC000043040301	183331806	/nfs/dbraw/zinc/33/18/06/183331806.db2.gz	JBHGZZWUCLIKMX-MRXNPFEDSA-N	0	3	305.399	2.477	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccc(Br)s1)N1CCOCC1	ZINC000043258517	183348229	/nfs/dbraw/zinc/34/82/29/183348229.db2.gz	BJGPKJWDBUZDSZ-KWQFWETISA-N	0	3	305.241	2.231	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccc(Br)s1)N1CCC[C@@H]1CO	ZINC000043261354	183349114	/nfs/dbraw/zinc/34/91/14/183349114.db2.gz	XNMCCSBEQTVXFP-KBVBSXBZSA-N	0	3	319.268	2.356	10	0		DEAEHN
C[C@H](N)[C@@H](c1cc(Br)cs1)N1CCC(O)CC1	ZINC000043284548	183350864	/nfs/dbraw/zinc/35/08/64/183350864.db2.gz	MLEHQINHMFWOSH-UFBFGSQYSA-N	0	3	319.268	2.356	10	0		DEAEHN
CCN[C@H](c1ccccc1OC(F)F)[C@@H]1CCS(=O)(=O)C1	ZINC000043300990	183352089	/nfs/dbraw/zinc/35/20/89/183352089.db2.gz	FXBAYXMNLLMVBH-MFKMUULPSA-N	0	3	319.373	2.373	10	0		DEAEHN
Cc1cccc(CNCc2ccc(S(N)(=O)=O)cc2)c1C	ZINC000043304733	183353064	/nfs/dbraw/zinc/35/30/64/183353064.db2.gz	MKGVUFUTNTYJLJ-UHFFFAOYSA-N	0	3	304.415	2.241	10	0		DEAEHN
CNCc1cc(Br)ccc1O[C@@H](C)C(=O)OC	ZINC000043624135	183375865	/nfs/dbraw/zinc/37/58/65/183375865.db2.gz	YELONTRFLLASSC-QMMMGPOBSA-N	0	3	302.168	2.109	10	0		DEAEHN
CCNCc1cccc(Br)c1O[C@H](C)C(=O)OC	ZINC000043625540	183376080	/nfs/dbraw/zinc/37/60/80/183376080.db2.gz	BMXUPIXWCQBYAG-SECBINFHSA-N	0	3	316.195	2.499	10	0		DEAEHN
CCCN(CCc1ccccn1)C(=O)NC1CCN(C)CC1	ZINC000105080016	194071106	/nfs/dbraw/zinc/07/11/06/194071106.db2.gz	RBODNLNFWUVMSA-UHFFFAOYSA-N	0	3	304.438	2.140	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2ccc(OC(F)F)cc2)C[C@H]1C	ZINC000106097766	194186418	/nfs/dbraw/zinc/18/64/18/194186418.db2.gz	SXIFDRNOQHVCRE-CHWSQXEVSA-N	0	3	314.376	2.175	10	0		DEAEHN
COc1cc(C)cc(C(=O)NCCN2CCCC[C@H]2C)c1O	ZINC000106458410	194216818	/nfs/dbraw/zinc/21/68/18/194216818.db2.gz	ISIOBXOIIVCBNZ-CYBMUJFWSA-N	0	3	306.406	2.313	10	0		DEAEHN
COc1cc(C)cc(C(=O)NCCN2CCCC[C@@H]2C)c1O	ZINC000106458405	194217622	/nfs/dbraw/zinc/21/76/22/194217622.db2.gz	ISIOBXOIIVCBNZ-ZDUSSCGKSA-N	0	3	306.406	2.313	10	0		DEAEHN
Cc1ccc(CN2CCN(C(C)(C)C(N)=S)CC2)cc1C	ZINC000109470721	194267260	/nfs/dbraw/zinc/26/72/60/194267260.db2.gz	MFGGLANIAMBHNJ-UHFFFAOYSA-N	0	3	305.491	2.486	10	0		DEAEHN
CCOc1ccccc1NC(=O)CN1CCCN(C2CC2)CC1	ZINC000061040966	184160475	/nfs/dbraw/zinc/16/04/75/184160475.db2.gz	SDJOSQUOPMDGCY-UHFFFAOYSA-N	0	3	317.433	2.194	10	0		DEAEHN
CNC(C)(C)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000061318532	184168453	/nfs/dbraw/zinc/16/84/53/184168453.db2.gz	JRHWLAOZKHIPOG-UHFFFAOYSA-N	0	3	309.797	2.403	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)C1(C(N)=S)CCCCCC1	ZINC000061646156	184181335	/nfs/dbraw/zinc/18/13/35/184181335.db2.gz	YCMHPXJJOWSYIC-ZDUSSCGKSA-N	0	3	311.495	2.166	10	0		DEAEHN
NCc1ccccc1CNS(=O)(=O)c1ccc(Cl)s1	ZINC000061841357	184189322	/nfs/dbraw/zinc/18/93/22/184189322.db2.gz	WYUYZPIQKLQWCD-UHFFFAOYSA-N	0	3	316.835	2.339	10	0		DEAEHN
CCCc1nc(N(C)CCCOC)sc1CNCCOC	ZINC000062037804	184202766	/nfs/dbraw/zinc/20/27/66/184202766.db2.gz	BRMUOKNMTLLJLN-UHFFFAOYSA-N	0	3	315.483	2.304	10	0		DEAEHN
COCCN1C(=O)C[C@@H](N)[C@@H]1c1c(Cl)cccc1Cl	ZINC000062210262	184220519	/nfs/dbraw/zinc/22/05/19/184220519.db2.gz	FCMGBGIVIDXCLS-ZWNOBZJWSA-N	0	3	303.189	2.241	10	0		DEAEHN
CCCN1C(=O)CC[C@@H](N)[C@H]1c1ccc(Br)o1	ZINC000062212207	184221650	/nfs/dbraw/zinc/22/16/50/184221650.db2.gz	KWBZKJRJHADFQA-PELKAZGASA-N	0	3	301.184	2.443	10	0		DEAEHN
CN(Cc1nccn1C)[C@H](CN)c1cccc(Br)c1	ZINC000062247659	184225274	/nfs/dbraw/zinc/22/52/74/184225274.db2.gz	VTURPMMHDXDOSQ-CYBMUJFWSA-N	0	3	323.238	2.314	10	0		DEAEHN
CCC1(CC)CCN(S(=O)(=O)C[C@H]2CCCCN2)CC1	ZINC000062960076	184262255	/nfs/dbraw/zinc/26/22/55/184262255.db2.gz	PGPHHLBIWRXOMX-CQSZACIVSA-N	0	3	302.484	2.361	10	0		DEAEHN
COCCNCc1ccc(O[C@@H](C)C(=O)OC)c(Cl)c1	ZINC000062730580	184251496	/nfs/dbraw/zinc/25/14/96/184251496.db2.gz	CHUSUDJPOODJAI-JTQLQIEISA-N	0	3	301.770	2.016	10	0		DEAEHN
CCCN[C@H](C)c1ccc(F)cc1OCCS(C)(=O)=O	ZINC000062747225	184252141	/nfs/dbraw/zinc/25/21/41/184252141.db2.gz	VBZOSMCKNHUSLK-LLVKDONJSA-N	0	3	303.399	2.310	10	0		DEAEHN
[NH3+][C@@H]1CCCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1F	ZINC000063213794	184278841	/nfs/dbraw/zinc/27/88/41/184278841.db2.gz	SITMCBBSDCISDH-NEPJUHHUSA-N	0	3	320.817	2.417	10	0		DEAEHN
CCN[C@@H](C)c1ccc(F)cc1OCCCS(C)(=O)=O	ZINC000063014500	184266386	/nfs/dbraw/zinc/26/63/86/184266386.db2.gz	WKSYGICDLJVXKK-NSHDSACASA-N	0	3	303.399	2.310	10	0		DEAEHN
CNCC(=O)Nc1cccc(C(=O)N[C@@H](C)c2ccccc2)c1	ZINC000066225865	184397869	/nfs/dbraw/zinc/39/78/69/184397869.db2.gz	FLWMVJAVDQZOCM-ZDUSSCGKSA-N	0	3	311.385	2.336	10	0		DEAEHN
C[C@@H]1CNC[C@H](C)N1C(=O)c1ccc(Br)c(F)c1	ZINC000069132539	184499900	/nfs/dbraw/zinc/49/99/00/184499900.db2.gz	PYSIFQFCPZNUGY-DTORHVGOSA-N	0	3	315.186	2.411	10	0		DEAEHN
CCc1c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)[nH]c(C)c1C(C)=O	ZINC000113225988	194566303	/nfs/dbraw/zinc/56/63/03/194566303.db2.gz	DPNHGGZOCQYVKG-FZMZJTMJSA-N	0	3	317.433	2.397	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1C[C@H](C)[C@H]2CCCC[C@H]21	ZINC000248409792	285023775	/nfs/dbraw/zinc/02/37/75/285023775.db2.gz	CVDKKDNGWHQUCH-YLFCFFPRSA-N	0	3	323.481	2.317	10	0		DEAEHN
Cc1cc(N[C@@H]2CCN(C)[C@H]2c2ccccc2)n2ncnc2n1	ZINC000270269179	208333555	/nfs/dbraw/zinc/33/35/55/208333555.db2.gz	JZOWANFTBBMXOU-ZBFHGGJFSA-N	0	3	308.389	2.290	10	0		DEAEHN
NC[C@H](Cc1cc(F)cc(C(F)(F)F)c1)C(=O)NC1CC1	ZINC000159198817	197335339	/nfs/dbraw/zinc/33/53/39/197335339.db2.gz	XLAZXRAIXJHQBQ-VIFPVBQESA-N	0	3	304.287	2.241	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)CC2CCCC2)cc(CN)c1F	ZINC000159116557	197328880	/nfs/dbraw/zinc/32/88/80/197328880.db2.gz	SEBHEKQPURTLPV-UHFFFAOYSA-N	0	3	314.426	2.404	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1cc(Cl)c(OC)cc1OC	ZINC000159101185	197327165	/nfs/dbraw/zinc/32/71/65/197327165.db2.gz	OKWXLBGSDIHWBD-SNVBAGLBSA-N	0	3	316.785	2.050	10	0		DEAEHN
COc1ccc(C[C@@H](N)c2c(Br)cnn2C)cc1	ZINC000158882735	197308132	/nfs/dbraw/zinc/30/81/32/197308132.db2.gz	MJQZLOHGHIIZNP-GFCCVEGCSA-N	0	3	310.195	2.434	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	ZINC000158910182	197310239	/nfs/dbraw/zinc/31/02/39/197310239.db2.gz	BJFIUPLYHRBZET-YFKPBYRVSA-N	0	3	312.238	2.075	10	0		DEAEHN
CC(C)CO[C@H]1CCN(C(=O)N[C@H](CC(C)C)CN(C)C)C1	ZINC000158618284	197289224	/nfs/dbraw/zinc/28/92/24/197289224.db2.gz	YQGKPABRTDSZGN-CVEARBPZSA-N	0	3	313.486	2.419	10	0		DEAEHN
C[C@H]1C[C@H](Nc2nc(Br)cn3ccnc23)CCN1C	ZINC000158595461	197287072	/nfs/dbraw/zinc/28/70/72/197287072.db2.gz	PQDWDXQEOCGNBS-VHSXEESVSA-N	0	3	324.226	2.386	10	0		DEAEHN
CC1(C)CC(=O)N(c2ccc(C(F)(F)F)cc2CN)C1=O	ZINC000158345234	197264305	/nfs/dbraw/zinc/26/43/05/197264305.db2.gz	WWHZOBYDUCDKPF-UHFFFAOYSA-N	0	3	300.280	2.454	10	0		DEAEHN
COc1ccc2[nH]cc(C3CCN(C(=O)[C@H](C)N)CC3)c2c1	ZINC000157222198	197170548	/nfs/dbraw/zinc/17/05/48/197170548.db2.gz	SNGWJQKTSJSGNB-NSHDSACASA-N	0	3	301.390	2.230	10	0		DEAEHN
C[C@@](O)(Cc1ccc(Br)s1)C[C@@H]1COCCN1	ZINC000156804506	197142291	/nfs/dbraw/zinc/14/22/91/197142291.db2.gz	NSPDCQQVNNTSJZ-SKDRFNHKSA-N	0	3	320.252	2.183	10	0		DEAEHN
CCCNc1nc(N(C)C)nc(N(C)CCC(F)(F)F)n1	ZINC000156643118	197129732	/nfs/dbraw/zinc/12/97/32/197129732.db2.gz	IGTQVUCXCKIXGP-UHFFFAOYSA-N	0	3	306.336	2.148	10	0		DEAEHN
Cc1ccc(NC(=O)c2nc(C)c(C)[nH]c2=O)c(CN(C)C)c1	ZINC000155932680	197075878	/nfs/dbraw/zinc/07/58/78/197075878.db2.gz	DZYLIUKMXKKAGC-UHFFFAOYSA-N	0	3	314.389	2.009	10	0		DEAEHN
COc1cc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc(OC)c1C	ZINC000155608599	197071528	/nfs/dbraw/zinc/07/15/28/197071528.db2.gz	ASTUDWJQULQKPZ-WFASDCNBSA-N	0	3	320.433	2.471	10	0		DEAEHN
COC(=O)Nc1cccc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000155299969	197041835	/nfs/dbraw/zinc/04/18/35/197041835.db2.gz	YKZBUHVVHQPNEV-WFASDCNBSA-N	0	3	319.405	2.323	10	0		DEAEHN
Cc1ccc(F)cc1NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000120626275	195203782	/nfs/dbraw/zinc/20/37/82/195203782.db2.gz	QTYGVKLJQHGGJI-TZMCWYRMSA-N	0	3	321.396	2.014	10	0		DEAEHN
CC[C@@H]1CN(Cc2cc(F)c(F)c(F)c2)CCN1C[C@@H](C)O	ZINC000120728779	195225216	/nfs/dbraw/zinc/22/52/16/195225216.db2.gz	ONNXXNRQRCLLIG-DGCLKSJQSA-N	0	3	316.367	2.381	10	0		DEAEHN
CCOC[C@@H]1CCN(C)C2(CN(Cc3cccnc3OC)C2)C1	ZINC000248145473	257107863	/nfs/dbraw/zinc/10/78/63/257107863.db2.gz	RQAGLJMRBPHHQY-OAHLLOKOSA-N	0	3	319.449	2.023	10	0		DEAEHN
Cc1ccc(CN2C[C@H](C(=O)NC3CC3)C[C@@H]3OCC[C@@H]32)s1	ZINC000248109512	257109246	/nfs/dbraw/zinc/10/92/46/257109246.db2.gz	QCXLXHKJXVSOGM-KCXAZCMYSA-N	0	3	320.458	2.315	10	0		DEAEHN
Cc1ccccc1CN1CC[C@@H]2C[C@@H](C(=O)N(C)C)O[C@@H]2C1	ZINC000247999068	257111655	/nfs/dbraw/zinc/11/16/55/257111655.db2.gz	NEVOQVPCNHNNTH-HYVNUMGLSA-N	0	3	302.418	2.063	10	0		DEAEHN
COc1cccc(CN2CCOC[C@@H](CC(=O)N(C)C)[C@@H]2C)c1	ZINC000247973778	257113074	/nfs/dbraw/zinc/11/30/74/257113074.db2.gz	IEOZLHBUNINMIT-GOEBONIOSA-N	0	3	320.433	2.010	10	0		DEAEHN
O=C(C1CCN(CC2=CCCOC2)CC1)N1CCCCCC1	ZINC000121047724	195286789	/nfs/dbraw/zinc/28/67/89/195286789.db2.gz	RVWMWLDZYSPJOU-UHFFFAOYSA-N	0	3	306.450	2.448	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C)c(C)c1	ZINC000121814167	195353235	/nfs/dbraw/zinc/35/32/35/195353235.db2.gz	JWGLTXXKZGBXHJ-OAHLLOKOSA-N	0	3	319.449	2.334	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc(OC[C@H]2CCCO2)cc1	ZINC000175852618	132515707	/nfs/dbraw/zinc/51/57/07/132515707.db2.gz	NJGAKXHEZQGWSM-QZTJIDSGSA-N	0	3	323.433	2.122	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(C2(Cc3ccccc3)CCC2)n1	ZINC000263278759	132580361	/nfs/dbraw/zinc/58/03/61/132580361.db2.gz	TXMZPKVWVWUMNJ-OAHLLOKOSA-N	0	3	312.417	2.310	10	0		DEAEHN
Cc1nn(C)c(C)c1NC(=O)N(CCN(C)C)C1CCCC1	ZINC000357798542	133101028	/nfs/dbraw/zinc/10/10/28/133101028.db2.gz	JDFHUXPJJDVRGJ-UHFFFAOYSA-N	0	3	307.442	2.375	10	0		DEAEHN
Cc1cc(CCNC(=O)N(CCN(C)C)C2CCCC2)on1	ZINC000358069100	133119196	/nfs/dbraw/zinc/11/91/96/133119196.db2.gz	RVZMKCIFNSLDQX-UHFFFAOYSA-N	0	3	308.426	2.041	10	0		DEAEHN
C[C@H](NCc1ccn(C)n1)c1ccc(OCCN(C)C)cc1	ZINC000358243146	133130783	/nfs/dbraw/zinc/13/07/83/133130783.db2.gz	WONLCIUBSXUTSJ-AWEZNQCLSA-N	0	3	302.422	2.211	10	0		DEAEHN
C[C@H]1CCOCCN1C[C@H](O)COc1cccc2[nH]ccc21	ZINC000362235377	133218827	/nfs/dbraw/zinc/21/88/27/133218827.db2.gz	KMMBHCKRMJESEH-KBPBESRZSA-N	0	3	304.390	2.018	10	0		DEAEHN
CCCCOC(=O)CCN1C[C@@H](c2ccsc2)[C@H](CO)C1	ZINC000188162153	145007511	/nfs/dbraw/zinc/00/75/11/145007511.db2.gz	JSAXDOYEHAEEJN-GJZGRUSLSA-N	0	3	311.447	2.489	10	0		DEAEHN
C[C@@H]1CC[C@H](CN2CCC(c3nnc4ccccn43)CC2)O1	ZINC000188568837	145013902	/nfs/dbraw/zinc/01/39/02/145013902.db2.gz	FISFVGCZOCXVSZ-UKRRQHHQSA-N	0	3	300.406	2.476	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1cc(-c2ccco2)on1	ZINC000188720149	145016133	/nfs/dbraw/zinc/01/61/33/145016133.db2.gz	OBAYCMZCYZWBAQ-UHFFFAOYSA-N	0	3	309.325	2.468	10	0		DEAEHN
O=C(/C=C/c1ccc2c(c1)OCO2)NCc1ccc2c(c1)CNC2	ZINC000188691595	145016465	/nfs/dbraw/zinc/01/64/65/145016465.db2.gz	NDAMIQHLNYDHCP-ZZXKWVIFSA-N	0	3	322.364	2.348	10	0		DEAEHN
CCOc1cc(Cl)ccc1CNC(=O)[C@H]1C[C@H](F)CN1	ZINC000188974178	145020678	/nfs/dbraw/zinc/02/06/78/145020678.db2.gz	PKKMCUBCFCJEQD-NWDGAFQWSA-N	0	3	300.761	2.055	10	0		DEAEHN
CN(Cc1ccc(F)nc1)C1CCN(CCn2cccn2)CC1	ZINC000189339311	145026378	/nfs/dbraw/zinc/02/63/78/145026378.db2.gz	PXUGFLIKZBHXKB-UHFFFAOYSA-N	0	3	317.412	2.014	10	0		DEAEHN
C[C@@H](CCNC(=O)N1CCO[C@H](CN(C)C)C1)CC(C)(C)C	ZINC000190991895	145051647	/nfs/dbraw/zinc/05/16/47/145051647.db2.gz	WLTDUIKYNNARTC-LSDHHAIUSA-N	0	3	313.486	2.421	10	0		DEAEHN
NC(=O)[C@H]1CCC[C@H](NCc2ccc(Br)o2)C1	ZINC000191148430	145053314	/nfs/dbraw/zinc/05/33/14/145053314.db2.gz	YMGMFKJANNSYBF-IUCAKERBSA-N	0	3	301.184	2.176	10	0		DEAEHN
COC[C@H](Cc1ccccc1)N(C)C[C@@H](O)COC(C)(C)C	ZINC000191496395	145059553	/nfs/dbraw/zinc/05/95/53/145059553.db2.gz	XKQKXPROJPTSAY-DLBZAZTESA-N	0	3	309.450	2.352	10	0		DEAEHN
COc1ccc(C(=O)N2CCN3CCC[C@H]3C2)c(OC(C)C)c1	ZINC000191584400	145061187	/nfs/dbraw/zinc/06/11/87/145061187.db2.gz	YQPNNCBDBHIVTL-AWEZNQCLSA-N	0	3	318.417	2.403	10	0		DEAEHN
C[C@H](N[C@@H]1CCOC[C@H]1C)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000191824202	145064981	/nfs/dbraw/zinc/06/49/81/145064981.db2.gz	XOEJUUVWTZCJFT-UHIISALHSA-N	0	3	315.410	2.305	10	0		DEAEHN
Cn1ccnc1C[C@@H]1CCCN(C[C@@H]2CC3(CCC3)C(=O)O2)C1	ZINC000192136506	145071511	/nfs/dbraw/zinc/07/15/11/145071511.db2.gz	OLJWULHSMVFJMQ-GJZGRUSLSA-N	0	3	317.433	2.160	10	0		DEAEHN
Cc1csc(C2CCN(CCN3CCO[C@@H](C)C3)CC2)n1	ZINC000192729203	145078352	/nfs/dbraw/zinc/07/83/52/145078352.db2.gz	ZBJZFXSONPMIEE-AWEZNQCLSA-N	0	3	309.479	2.352	10	0		DEAEHN
c1coc(-c2ncc(CNC[C@@H]3CN(C4CC4)CCO3)s2)c1	ZINC000193093382	145081995	/nfs/dbraw/zinc/08/19/95/145081995.db2.gz	VRABNVSOQXLQQE-CYBMUJFWSA-N	0	3	319.430	2.356	10	0		DEAEHN
C[C@@H](NCC(=O)Nc1ccccc1OC(F)F)[C@@H]1CCCO1	ZINC000193130060	145083015	/nfs/dbraw/zinc/08/30/15/145083015.db2.gz	FWKCDHYPJGSYOS-PWSUYJOCSA-N	0	3	314.332	2.384	10	0		DEAEHN
COc1ncc(C)cc1NC(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000246284365	145097147	/nfs/dbraw/zinc/09/71/47/145097147.db2.gz	BUXLOERSONUQJP-TZMCWYRMSA-N	0	3	306.410	2.249	10	0		DEAEHN
C[C@@H]1CN(C[C@H](O)c2ccccc2Cl)C[C@H]1N1CCOCC1	ZINC000246325145	145098852	/nfs/dbraw/zinc/09/88/52/145098852.db2.gz	DIGOKKVIXAKSTA-XYPHTWIQSA-N	0	3	324.852	2.026	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)[C@H]1CCCc2n[nH]cc21	ZINC000246536040	145106462	/nfs/dbraw/zinc/10/64/62/145106462.db2.gz	LNVCQLVPEJREGI-KBPBESRZSA-N	0	3	304.438	2.210	10	0		DEAEHN
C[C@@H]1OCC[C@@H]1N[C@H](CO)c1cccc(Br)c1	ZINC000246575594	145107183	/nfs/dbraw/zinc/10/71/83/145107183.db2.gz	YGIZUKBSADCLEB-TVYUQYBPSA-N	0	3	300.196	2.250	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H]2[C@@H]3c4ccccc4C[C@H]23)C1	ZINC000246608727	145108269	/nfs/dbraw/zinc/10/82/69/145108269.db2.gz	DKIWPBKJMFYHKN-DZOHQFGASA-N	0	3	313.445	2.356	10	0		DEAEHN
O[C@@H](COCc1ccco1)CN1CCCC[C@H]1c1cn[nH]c1	ZINC000246797164	145114299	/nfs/dbraw/zinc/11/42/99/145114299.db2.gz	MQHSADRALMVEME-ZBFHGGJFSA-N	0	3	305.378	2.107	10	0		DEAEHN
CC[C@H](Oc1ccccc1F)C(=O)N1CCN2CCC[C@H]2C1	ZINC000246843962	145116650	/nfs/dbraw/zinc/11/66/50/145116650.db2.gz	LKIPEYXRITYHDH-ZFWWWQNUSA-N	0	3	306.381	2.290	10	0		DEAEHN
CC[C@H]1CN(Cc2cccc(COC)c2)CCN1C[C@H](C)O	ZINC000246913162	145118965	/nfs/dbraw/zinc/11/89/65/145118965.db2.gz	SBBYKQPMIFSNBE-YJBOKZPZSA-N	0	3	306.450	2.110	10	0		DEAEHN
O=C(CCN1CCS[C@H]2COCC[C@H]21)Nc1ccc(F)cc1	ZINC000246991177	145122591	/nfs/dbraw/zinc/12/25/91/145122591.db2.gz	PFZCGQLPUDBFPN-CABCVRRESA-N	0	3	324.421	2.361	10	0		DEAEHN
Cc1cccc(C)c1OCCCN1CCN(C[C@H](C)O)[C@@H](C)C1	ZINC000247102191	145126501	/nfs/dbraw/zinc/12/65/01/145126501.db2.gz	VAPAZGQYKDLBOZ-ROUUACIJSA-N	0	3	320.477	2.459	10	0		DEAEHN
Cc1ccc(N2CCC[C@@H](N(C)C[C@H]3CCOC3)C2=O)cc1	ZINC000247098392	145126581	/nfs/dbraw/zinc/12/65/81/145126581.db2.gz	QFNPADQGXMTZQH-NVXWUHKLSA-N	0	3	302.418	2.459	10	0		DEAEHN
COC(=O)Nc1ccc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1	ZINC000247192819	145128925	/nfs/dbraw/zinc/12/89/25/145128925.db2.gz	LHOJYUILKSZIPA-WFASDCNBSA-N	0	3	317.389	2.174	10	0		DEAEHN
Cc1nc2ccccc2n1CC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000247560868	145141411	/nfs/dbraw/zinc/14/14/11/145141411.db2.gz	ZOKHPRNALUXJGG-DZGCQCFKSA-N	0	3	314.433	2.286	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCC(F)(F)F	ZINC000248391970	145152488	/nfs/dbraw/zinc/15/24/88/145152488.db2.gz	JVUPWCOPTWRVFB-WCQYABFASA-N	0	3	315.339	2.368	10	0		DEAEHN
O=S1(=O)CC[C@H](N[C@@H]2CCC[C@@H]3OCC[C@@H]32)c2ccccc21	ZINC000248587163	145160357	/nfs/dbraw/zinc/16/03/57/145160357.db2.gz	YBTGMCUUEOMSST-OJLVUWQFSA-N	0	3	321.442	2.452	10	0		DEAEHN
Cc1cc2c(cc1C)[C@H](C(=O)N1CCN3CCC[C@H]3C1)CO2	ZINC000248679312	145163980	/nfs/dbraw/zinc/16/39/80/145163980.db2.gz	DYPUKQQRGKEOEE-GOEBONIOSA-N	0	3	300.402	2.086	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N[C@H]1CCO[C@@H](C2CC2)C1	ZINC000248843182	145170188	/nfs/dbraw/zinc/17/01/88/145170188.db2.gz	OACWEPYFGQQUJN-ARFHVFGLSA-N	0	3	311.470	2.220	10	0		DEAEHN
COC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1CCCCn1ccnc1C	ZINC000248849483	145170321	/nfs/dbraw/zinc/17/03/21/145170321.db2.gz	PTNYFNCCCGWDBZ-PMPSAXMXSA-N	0	3	305.422	2.245	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@H]2c3ccccc3C[C@H]2O)C12CCOCC2	ZINC000249048151	145177025	/nfs/dbraw/zinc/17/70/25/145177025.db2.gz	WJOJPPJKOUTQRI-XDNAFOTISA-N	0	3	317.429	2.209	10	0		DEAEHN
c1coc(-c2cc(CN3CCNC[C@@H]3c3cccnc3)no2)c1	ZINC000261819218	145230641	/nfs/dbraw/zinc/23/06/41/145230641.db2.gz	SBVTUKCMANZGPS-OAHLLOKOSA-N	0	3	310.357	2.476	10	0		DEAEHN
CCc1ccc(O)c(NC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000261924559	145242422	/nfs/dbraw/zinc/24/24/22/145242422.db2.gz	SBTMGKJBROWVBO-XLWVJDPXSA-N	0	3	318.417	2.426	10	0		DEAEHN
CCSc1ccc([C@H](C)NC(=O)C2(N)CCOCC2)cc1	ZINC000261922519	145242524	/nfs/dbraw/zinc/24/25/24/145242524.db2.gz	VEFYKDNZLPWJEK-LBPRGKRZSA-N	0	3	308.447	2.484	10	0		DEAEHN
NCC1(c2nc(-c3nccc4ccccc43)no2)CCOCC1	ZINC000261937187	145244092	/nfs/dbraw/zinc/24/40/92/145244092.db2.gz	UCRWBESMQSJJPB-UHFFFAOYSA-N	0	3	310.357	2.292	10	0		DEAEHN
N[C@H](C(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F)C1CCOCC1	ZINC000261940367	145245094	/nfs/dbraw/zinc/24/50/94/145245094.db2.gz	JHRRVEQQQINXQZ-AVGNSLFASA-N	0	3	322.371	2.225	10	0		DEAEHN
Cc1cccc(CNC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000261983536	145250353	/nfs/dbraw/zinc/25/03/53/145250353.db2.gz	ASIWEZPAVYQBTK-RVKKMQEKSA-N	0	3	302.418	2.144	10	0		DEAEHN
N[C@H](C(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1)C1CCOCC1	ZINC000261996132	145250901	/nfs/dbraw/zinc/25/09/01/145250901.db2.gz	NCMBBVHKNJLLOF-DRZSPHRISA-N	0	3	322.371	2.225	10	0		DEAEHN
COC(=O)c1cccc(CN2CCNC[C@H]2c2cccnc2)c1	ZINC000262041897	145256381	/nfs/dbraw/zinc/25/63/81/145256381.db2.gz	YLQPSEHLGVTDFI-KRWDZBQOSA-N	0	3	311.385	2.015	10	0		DEAEHN
CC(=O)Nc1cccc(CN2CCNC[C@@H]2c2cccnc2)c1	ZINC000262265192	145272503	/nfs/dbraw/zinc/27/25/03/145272503.db2.gz	RTOLEXWKQZTCKK-GOSISDBHSA-N	0	3	310.401	2.187	10	0		DEAEHN
CCc1ccc(CNC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)s1	ZINC000262419552	145283044	/nfs/dbraw/zinc/28/30/44/145283044.db2.gz	DWCDAQWKNKMCQB-CKEIUWERSA-N	0	3	322.474	2.459	10	0		DEAEHN
Cc1ccc(CNC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)cc1	ZINC000262553501	145292156	/nfs/dbraw/zinc/29/21/56/145292156.db2.gz	SWEWQFFAPASAJS-RLFYNMQTSA-N	0	3	302.418	2.144	10	0		DEAEHN
C[C@H](NC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C)c1ccccc1	ZINC000262587094	145295802	/nfs/dbraw/zinc/29/58/02/145295802.db2.gz	ZWJPMQRMFMRBNS-ADOMEBDSSA-N	0	3	302.418	2.396	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)NCc1cc(OC)nc2ccccc12	ZINC000262708629	145301420	/nfs/dbraw/zinc/30/14/20/145301420.db2.gz	OEPHTRKCYGQBLK-BDJLRTHQSA-N	0	3	301.390	2.233	10	0		DEAEHN
C[C@H]1C[NH2+]CC[C@H]1[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000262745937	145303019	/nfs/dbraw/zinc/30/30/19/145303019.db2.gz	DTXOVJOIKQDJPG-GZMMTYOYSA-N	0	3	323.245	2.270	10	0		DEAEHN
COc1ccccc1/C(C)=C/c1nc([C@H]2CNCCN2C)no1	ZINC000263130998	145328503	/nfs/dbraw/zinc/32/85/03/145328503.db2.gz	BQUNEUUNXRMHQD-IEZBTEQYSA-N	0	3	314.389	2.215	10	0		DEAEHN
CC(C)Cc1ccc(Cc2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263203181	145336210	/nfs/dbraw/zinc/33/62/10/145336210.db2.gz	JIUDNHSOWMYSQB-INIZCTEOSA-N	0	3	314.433	2.435	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2ccccc2C(F)(F)F)n1	ZINC000263216153	145337240	/nfs/dbraw/zinc/33/72/40/145337240.db2.gz	KXHNQPLVNWUBRU-NSHDSACASA-N	0	3	312.295	2.332	10	0		DEAEHN
c1ccc(N2CCO[C@H](CN3CCC[C@]4(CCOC4)C3)C2)cc1	ZINC000565174490	292141088	/nfs/dbraw/zinc/14/10/88/292141088.db2.gz	WYWRRLKRWHXHDN-MOPGFXCFSA-N	0	3	316.445	2.394	10	0		DEAEHN
O=C(N[C@@H]1CCN(C2CC2)C1)[C@H]1C[C@H]1c1cc(F)ccc1F	ZINC000357056633	147032316	/nfs/dbraw/zinc/03/23/16/147032316.db2.gz	SLBXDLLDUJIRKH-ZLDLUXBVSA-N	0	3	306.356	2.421	10	0		DEAEHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)NC[C@@](C)(O)C1CCCCC1	ZINC000359208658	147282292	/nfs/dbraw/zinc/28/22/92/147282292.db2.gz	KAVPHVYDWNRLQL-RPVQJOFSSA-N	0	3	323.481	2.100	10	0		DEAEHN
Cc1ccnc(NC[C@@H]2CCN(Cc3cnc4cnccn34)C2)c1	ZINC000371374147	148094267	/nfs/dbraw/zinc/09/42/67/148094267.db2.gz	PQBRFYWQZBETMD-HNNXBMFYSA-N	0	3	322.416	2.367	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2C[C@H]3CCCN3C[C@@H]2C)c(C)c1	ZINC000113306091	292180051	/nfs/dbraw/zinc/18/00/51/292180051.db2.gz	CXCJVRJOXBPWMZ-LSDHHAIUSA-N	0	3	308.447	2.161	10	0		DEAEHN
c1cn(-c2ccc(CN3CCC(c4c[nH]cn4)CC3)cn2)cn1	ZINC000374211130	148217871	/nfs/dbraw/zinc/21/78/71/148217871.db2.gz	YHVFMHGEVNJQRN-UHFFFAOYSA-N	0	3	308.389	2.370	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)C(=O)Nc2ccc(Cl)cc2)CCN1C	ZINC000127585749	401741196	/nfs/dbraw/zinc/74/11/96/401741196.db2.gz	WJMOLTKHDLYCAV-BXUZGUMPSA-N	0	3	323.824	2.220	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N(C)C1CCC(CO)CC1	ZINC000126425698	401693678	/nfs/dbraw/zinc/69/36/78/401693678.db2.gz	SDNWEHGEFSRXTH-PCKAHOCUSA-N	0	3	313.486	2.155	10	0		DEAEHN
C[C@@H](N[C@@H]1CCC(=O)N(C)C1=O)c1cc2c(s1)CCCC2	ZINC000129521309	401805332	/nfs/dbraw/zinc/80/53/32/401805332.db2.gz	QQOLLIHLEPCOTJ-ZYHUDNBSSA-N	0	3	306.431	2.425	10	0		DEAEHN
Cc1ccc(CN2CCCN(Cc3noc(C)n3)CC2)s1	ZINC000127927444	401756142	/nfs/dbraw/zinc/75/61/42/401756142.db2.gz	MCLFIKUFWJMIPK-UHFFFAOYSA-N	0	3	306.435	2.456	10	0		DEAEHN
COc1ccccc1NCC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000112881649	401760759	/nfs/dbraw/zinc/76/07/59/401760759.db2.gz	CUVBJBRENNLXSS-AWEZNQCLSA-N	0	3	307.438	2.200	10	0		DEAEHN
CCOc1ccc(OCC(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1	ZINC000113226721	401770330	/nfs/dbraw/zinc/77/03/30/401770330.db2.gz	LQXBLINQKUDDMU-GJZGRUSLSA-N	0	3	318.417	2.159	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc(-c2cccnc2)on1	ZINC000113226093	401770864	/nfs/dbraw/zinc/77/08/64/401770864.db2.gz	QVNQTKMGCLSMDY-TZMCWYRMSA-N	0	3	312.373	2.045	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)COc1ccc(Cl)cc1	ZINC000113226760	401770882	/nfs/dbraw/zinc/77/08/82/401770882.db2.gz	OCFZSKLGRPSHEB-TZMCWYRMSA-N	0	3	308.809	2.414	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)CSCc1ccccn1	ZINC000113232835	401771440	/nfs/dbraw/zinc/77/14/40/401771440.db2.gz	OYYNWSDIDCNWNO-DZGCQCFKSA-N	0	3	305.447	2.010	10	0		DEAEHN
CCCN1CCC(CNS(=O)(=O)CC(CC)CC)CC1	ZINC000113285659	401775136	/nfs/dbraw/zinc/77/51/36/401775136.db2.gz	BPZSOBHEGLBTPW-UHFFFAOYSA-N	0	3	304.500	2.464	10	0		DEAEHN
C[C@H](C(=O)NC1CCCCC1)N1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000128510664	401780068	/nfs/dbraw/zinc/78/00/68/401780068.db2.gz	IJGPTBQBQJJMQV-IIDMSEBBSA-N	0	3	308.466	2.451	10	0		DEAEHN
CCC[C@@]1(C)CCCN([C@@H](C)C(=O)N(C)CC(=O)NC2CC2)C1	ZINC000076145514	401784867	/nfs/dbraw/zinc/78/48/67/401784867.db2.gz	ARUHFQGDSWHZMM-KSSFIOAISA-N	0	3	323.481	2.014	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000115157959	401820209	/nfs/dbraw/zinc/82/02/09/401820209.db2.gz	BAHBDUDXUAGIBO-OLMNPRSZSA-N	0	3	316.445	2.204	10	0		DEAEHN
COc1cccc(N2CCC[C@@H](NC(=O)CN(C)C(C)C)C2)c1	ZINC000117270133	401870899	/nfs/dbraw/zinc/87/08/99/401870899.db2.gz	WWCBDOOTIZECDA-OAHLLOKOSA-N	0	3	319.449	2.120	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1ccc([S@](C)=O)cc1	ZINC000078615033	401858556	/nfs/dbraw/zinc/85/85/56/401858556.db2.gz	BFSBZIWQAMLUFI-SPLOXXLWSA-N	0	3	310.463	2.130	10	0		DEAEHN
C[C@H]1CC[C@@H](C(=O)NCCCN2CCc3ccccc3C2)O1	ZINC000129961510	401813123	/nfs/dbraw/zinc/81/31/23/401813123.db2.gz	UKAYDBXVLHJPDW-YOEHRIQHSA-N	0	3	302.418	2.119	10	0		DEAEHN
CCCNC(=O)CCN[C@@H](C)c1ccc(OC)c(NC(C)=O)c1	ZINC000129960724	401813184	/nfs/dbraw/zinc/81/31/84/401813184.db2.gz	MMQWMZOVMQCBMH-LBPRGKRZSA-N	0	3	321.421	2.221	10	0		DEAEHN
C[C@H]1c2ccccc2O[C@@H]1C(=O)NC1CCN(C2CC2)CC1	ZINC000117748514	401882850	/nfs/dbraw/zinc/88/28/50/401882850.db2.gz	DRKHUOHUTAFTIJ-SJCJKPOMSA-N	0	3	300.402	2.294	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)C[C@H]2CCOc3ccccc32)C1	ZINC000117783718	401884424	/nfs/dbraw/zinc/88/44/24/401884424.db2.gz	INTXIWWGELFYIH-HUUCEWRRSA-N	0	3	302.418	2.495	10	0		DEAEHN
C[C@H]1CO[C@H](c2ccccc2)CN1C(=O)C1CCN(C)CC1	ZINC000081329981	401894888	/nfs/dbraw/zinc/89/48/88/401894888.db2.gz	KYGIWCHVVZYMBM-YOEHRIQHSA-N	0	3	302.418	2.317	10	0		DEAEHN
CC[C@@H](C(=O)N1CCO[C@H](c2ccc(F)c(C)c2)C1)N(C)C	ZINC000134798517	401914943	/nfs/dbraw/zinc/91/49/43/401914943.db2.gz	OMGTUYVNUBIPHF-HOTGVXAUSA-N	0	3	308.397	2.374	10	0		DEAEHN
CC(=O)NCCCN1CCC[C@@H]1CC(=O)c1ccc(F)cc1	ZINC000134832121	401916520	/nfs/dbraw/zinc/91/65/20/401916520.db2.gz	FSTUASOGHDMLSO-MRXNPFEDSA-N	0	3	306.381	2.389	10	0		DEAEHN
COCc1csc(NC(=O)N(CCN(C)C)CC(C)C)n1	ZINC000085614687	401917809	/nfs/dbraw/zinc/91/78/09/401917809.db2.gz	KMQMCJFFHHZQAG-UHFFFAOYSA-N	0	3	314.455	2.341	10	0		DEAEHN
C[C@H]1CC[C@H](C(N)=O)CN1Cc1ccc2c(c1)CC(C)(C)O2	ZINC000136381111	401966905	/nfs/dbraw/zinc/96/69/05/401966905.db2.gz	BGHXTLRGSHJEEH-JSGCOSHPSA-N	0	3	302.418	2.486	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCC2(CCOC)CCCC2)C1	ZINC000119958065	401972512	/nfs/dbraw/zinc/97/25/12/401972512.db2.gz	CYMUFJQCTKZLFD-OAHLLOKOSA-N	0	3	311.470	2.367	10	0		DEAEHN
CCOc1cc(Cl)ccc1CNC1CCN(C(N)=O)CC1	ZINC000090772391	401987272	/nfs/dbraw/zinc/98/72/72/401987272.db2.gz	WUVJRMCOSKZQAB-UHFFFAOYSA-N	0	3	311.813	2.371	10	0		DEAEHN
Cc1nn(C)c(C)c1-c1ccnc(N[C@@H]2CCCN(C)C2)n1	ZINC000048159275	401995085	/nfs/dbraw/zinc/99/50/85/401995085.db2.gz	IGIXQMKIHJAWSU-CYBMUJFWSA-N	0	3	300.410	2.000	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2ncc(-c3ccccc3F)o2)CCO1	ZINC000119299093	401939423	/nfs/dbraw/zinc/93/94/23/401939423.db2.gz	AOPCEURVARQEAK-ZDUSSCGKSA-N	0	3	319.380	2.243	10	0		DEAEHN
CCc1ccc(S(=O)(=O)NC[C@H](N)c2ccccc2)s1	ZINC000049044862	402011098	/nfs/dbraw/zinc/01/10/98/402011098.db2.gz	AMFXPZATIWZJCZ-ZDUSSCGKSA-N	0	3	310.444	2.289	10	0		DEAEHN
C[C@H]1CC[C@@H](C(=O)N(CCN(C)C)Cc2ccc(F)cc2)O1	ZINC000151040386	402012588	/nfs/dbraw/zinc/01/25/88/402012588.db2.gz	RSQAIOMPUQTQJP-BBRMVZONSA-N	0	3	308.397	2.283	10	0		DEAEHN
CCOc1ccnc(N2CCN(C[C@@H]3CC=CCC3)CC2)n1	ZINC000121500450	402040600	/nfs/dbraw/zinc/04/06/00/402040600.db2.gz	LLNWWMOFVBDVLE-OAHLLOKOSA-N	0	3	302.422	2.354	10	0		DEAEHN
Fc1ccc2oc(CN3CC[C@@H](CN4CCOCC4)C3)nc2c1	ZINC000151686834	402051030	/nfs/dbraw/zinc/05/10/30/402051030.db2.gz	VCJUYKJPRSBQLP-ZDUSSCGKSA-N	0	3	319.380	2.121	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cc(-c3ccncc3)on2)CCN1C	ZINC000123284049	402119862	/nfs/dbraw/zinc/11/98/62/402119862.db2.gz	KNYIGTODTSMFSY-JSGCOSHPSA-N	0	3	314.389	2.291	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)NCC(C)(C)C2CCCC2)CCO1	ZINC000152010051	402070882	/nfs/dbraw/zinc/07/08/82/402070882.db2.gz	CQXKOIGQCITQFR-HNNXBMFYSA-N	0	3	311.470	2.175	10	0		DEAEHN
O=C(NCCc1cccc(F)c1)N1CCCN(C2CC2)CC1	ZINC000061855493	402108994	/nfs/dbraw/zinc/10/89/94/402108994.db2.gz	HOQGIUHNKDATMH-UHFFFAOYSA-N	0	3	305.397	2.248	10	0		DEAEHN
CC(=O)c1cccc(OCC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000123131776	402112310	/nfs/dbraw/zinc/11/23/10/402112310.db2.gz	ZUGDTIGDQPWBFP-CJNGLKHVSA-N	0	3	318.417	2.209	10	0		DEAEHN
COc1ccccc1OCCC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000123143916	402112536	/nfs/dbraw/zinc/11/25/36/402112536.db2.gz	FPGWNHCAFYSTPK-LSDHHAIUSA-N	0	3	320.433	2.405	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)CN(C)Cc2ccccc2)CCN1C	ZINC000123265418	402118962	/nfs/dbraw/zinc/11/89/62/402118962.db2.gz	OGICMNJKIHYKKL-DOTOQJQBSA-N	0	3	303.450	2.060	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2cc(F)c(Cl)cc2F)CCO1	ZINC000122195254	402065838	/nfs/dbraw/zinc/06/58/38/402065838.db2.gz	PBIDBKNOLUUZLY-VIFPVBQESA-N	0	3	318.751	2.021	10	0		DEAEHN
Cc1cc(F)cc(NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C)c1	ZINC000153202970	402132774	/nfs/dbraw/zinc/13/27/74/402132774.db2.gz	WGGQXLDJVXFXSP-OAHLLOKOSA-N	0	3	323.412	2.165	10	0		DEAEHN
O=C(CCN1CCC[C@H](n2cncn2)C1)NCC1CCCCC1	ZINC000066874533	402145273	/nfs/dbraw/zinc/14/52/73/402145273.db2.gz	ZDZXLRXLJNSQDH-INIZCTEOSA-N	0	3	319.453	2.002	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccc(C)cc1OCCOC)N(C)C	ZINC000153565449	402152982	/nfs/dbraw/zinc/15/29/82/402152982.db2.gz	SSFXNOUUNIXTED-INIZCTEOSA-N	0	3	322.449	2.367	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H]1CCN(c2ccccc2OC)C1)N(C)C	ZINC000153932614	402181375	/nfs/dbraw/zinc/18/13/75/402181375.db2.gz	WQSGVBIAZSQMCV-ZBFHGGJFSA-N	0	3	319.449	2.120	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)CCOc1cccc(C=O)c1	ZINC000068279515	402190446	/nfs/dbraw/zinc/19/04/46/402190446.db2.gz	WCYJIIFDQZKJKO-HNNXBMFYSA-N	0	3	318.417	2.259	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)c1ccc2nccn2c1	ZINC000068291964	402191672	/nfs/dbraw/zinc/19/16/72/402191672.db2.gz	JGSVYAUYXMDMJF-KRWDZBQOSA-N	0	3	322.412	2.237	10	0		DEAEHN
CCc1ccc([C@@H]2CCCCN2CCCN2C(=O)CNC2=O)o1	ZINC000124830749	402199203	/nfs/dbraw/zinc/19/92/03/402199203.db2.gz	GYTRWCLYSFPMTQ-AWEZNQCLSA-N	0	3	319.405	2.311	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)CSCc2cccnc2)CCN1C	ZINC000124119543	402165200	/nfs/dbraw/zinc/16/52/00/402165200.db2.gz	AXYGFJVLXWFADC-DZGCQCFKSA-N	0	3	307.463	2.256	10	0		DEAEHN
COc1cc([C@H](C)N[C@H](C)CCS(C)(=O)=O)ccc1F	ZINC000154271610	402202785	/nfs/dbraw/zinc/20/27/85/402202785.db2.gz	VEKDUUCUAZZDEF-MNOVXSKESA-N	0	3	303.399	2.308	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCC1(CCOC)CCC1	ZINC000124298464	402174046	/nfs/dbraw/zinc/17/40/46/402174046.db2.gz	OBJDVEAYOHKYLR-HNNXBMFYSA-N	0	3	311.470	2.319	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H](C)N(C)CCCn1ccnc1)c1ccccc1	ZINC000124319215	402174590	/nfs/dbraw/zinc/17/45/90/402174590.db2.gz	ZDMATJKRADKLBF-HZPDHXFCSA-N	0	3	314.433	2.471	10	0		DEAEHN
CC[C@@H](C(=O)N[C@H](C)c1cccc(-n2ccnc2)c1)N(C)C	ZINC000125366861	402228039	/nfs/dbraw/zinc/22/80/39/402228039.db2.gz	VOQDMVIAMOGQHU-CJNGLKHVSA-N	0	3	300.406	2.390	10	0		DEAEHN
CCCOc1cccc(CCNC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000154785761	402231597	/nfs/dbraw/zinc/23/15/97/402231597.db2.gz	UARPGLZBZGJHCI-MRXNPFEDSA-N	0	3	319.449	2.363	10	0		DEAEHN
CCCn1cc(CN2CCC[C@@H](C(=O)NCC3CC3)C2)cn1	ZINC000154824831	402234648	/nfs/dbraw/zinc/23/46/48/402234648.db2.gz	SCLFLGVVSTWCLD-MRXNPFEDSA-N	0	3	304.438	2.031	10	0		DEAEHN
Cc1cc(C(=O)NC[C@H]2CCCN(C)C2)nn1-c1ccccc1	ZINC000108333965	402250449	/nfs/dbraw/zinc/25/04/49/402250449.db2.gz	FXYYNYYOSTUCCE-OAHLLOKOSA-N	0	3	312.417	2.252	10	0		DEAEHN
CCc1noc(C)c1NC(=O)NC1CCN(CCCOC)CC1	ZINC000155321295	402252471	/nfs/dbraw/zinc/25/24/71/402252471.db2.gz	GSBPEEPBEDLAOZ-UHFFFAOYSA-N	0	3	324.425	2.168	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)CSCc1cscn1	ZINC000125926881	402257100	/nfs/dbraw/zinc/25/71/00/402257100.db2.gz	COMHVFIGETWDRK-GFCCVEGCSA-N	0	3	313.492	2.367	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2noc3c2CCCCC3)CCN1C	ZINC000154338805	402207196	/nfs/dbraw/zinc/20/71/96/402207196.db2.gz	JNIIXAPDBIPJRO-OLZOCXBDSA-N	0	3	305.422	2.498	10	0		DEAEHN
Cc1ccc(N2CCCN(C[C@H](O)c3ccccc3)CC2)nn1	ZINC000105801211	402209996	/nfs/dbraw/zinc/20/99/96/402209996.db2.gz	VOFFQYHTSLGOBX-KRWDZBQOSA-N	0	3	312.417	2.031	10	0		DEAEHN
CC(C)CCOCCN(C)[C@H]1CCCN(c2cccnn2)C1	ZINC000105909623	402211478	/nfs/dbraw/zinc/21/14/78/402211478.db2.gz	DHRFSMDNHBXNTO-INIZCTEOSA-N	0	3	306.454	2.440	10	0		DEAEHN
COc1cccc([C@H]2C[C@H](O)CN2Cc2ccc(CO)cc2)c1	ZINC000225731133	402323036	/nfs/dbraw/zinc/32/30/36/402323036.db2.gz	QZCKZBWTPSLQBI-PKOBYXMFSA-N	0	3	313.397	2.495	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1occc1Br	ZINC000176078297	402276302	/nfs/dbraw/zinc/27/63/02/402276302.db2.gz	UPAFMXZCBVHGNO-VHSXEESVSA-N	0	3	313.195	2.351	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1ccc2c(c1)OCCO2	ZINC000176244347	402293929	/nfs/dbraw/zinc/29/39/29/402293929.db2.gz	RFRAWXXBKMFVQC-CQSZACIVSA-N	0	3	319.405	2.406	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2ccc(OCCCOC)cc2)C1	ZINC000176268238	402295754	/nfs/dbraw/zinc/29/57/54/402295754.db2.gz	DQMAUOYXWUBVST-MRXNPFEDSA-N	0	3	320.433	2.316	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cnc(C(F)(F)F)nc2)CCN1C	ZINC000157554950	402295953	/nfs/dbraw/zinc/29/59/53/402295953.db2.gz	NDTTZYQAIGFJDM-KOLCDFICSA-N	0	3	316.327	2.050	10	0		DEAEHN
Cc1cnc(CCN(C)Cc2cc(=O)n3ccccc3n2)s1	ZINC000157729600	402298220	/nfs/dbraw/zinc/29/82/20/402298220.db2.gz	SFGYZOWBTKTNLZ-UHFFFAOYSA-N	0	3	314.414	2.134	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCc1ccc2c(c1)OCO2	ZINC000176367551	402303930	/nfs/dbraw/zinc/30/39/30/402303930.db2.gz	GFQGNWAJYBCTOT-CQSZACIVSA-N	0	3	319.405	2.041	10	0		DEAEHN
CCN(CC)CC(=O)N1CCCC[C@@H]1c1nnc2n1CCCC2	ZINC000176406989	402306439	/nfs/dbraw/zinc/30/64/39/402306439.db2.gz	JDQZYWWCOVMYBL-CQSZACIVSA-N	0	3	319.453	2.010	10	0		DEAEHN
C[C@@H](NC(=O)N(C)CCN(C)C)c1cccc(-n2ccnc2)c1	ZINC000176425483	402307968	/nfs/dbraw/zinc/30/79/68/402307968.db2.gz	JKUCKEPTHDQJEG-CQSZACIVSA-N	0	3	315.421	2.136	10	0		DEAEHN
Cc1ccsc1[C@@H](Cc1ccccc1)NCC(=O)NC(N)=O	ZINC000184960400	402312839	/nfs/dbraw/zinc/31/28/39/402312839.db2.gz	MZLSMAPXMOAYKO-CYBMUJFWSA-N	0	3	317.414	2.125	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C(=O)Nc1ccc(C)c(F)c1	ZINC000176900820	402348375	/nfs/dbraw/zinc/34/83/75/402348375.db2.gz	VNGAKMUYOVZFAD-AWEZNQCLSA-N	0	3	321.396	2.015	10	0		DEAEHN
CC[C@@H](CNC(=O)N1CC[C@H](N(C)C)C1)Oc1ccccc1C	ZINC000176912116	402349081	/nfs/dbraw/zinc/34/90/81/402349081.db2.gz	BOIVJPTZFVGHIJ-HOTGVXAUSA-N	0	3	319.449	2.498	10	0		DEAEHN
COC1(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)CCCCC1	ZINC000185897475	402387553	/nfs/dbraw/zinc/38/75/53/402387553.db2.gz	MKYRSROJPTURKX-GJZGRUSLSA-N	0	3	311.470	2.460	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C[C@@H]1c2ccccc2NC1=O	ZINC000177000915	402358182	/nfs/dbraw/zinc/35/81/82/402358182.db2.gz	JOGVCEWJAIKGFZ-UKRRQHHQSA-N	0	3	315.417	2.055	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)COCCOc1ccccc1	ZINC000177040410	402363138	/nfs/dbraw/zinc/36/31/38/402363138.db2.gz	FRDVADUBNCRROD-MRXNPFEDSA-N	0	3	320.433	2.025	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCOc1ccccc1	ZINC000177296352	402388936	/nfs/dbraw/zinc/38/89/36/402388936.db2.gz	XOHIAYXIDANESF-HNNXBMFYSA-N	0	3	305.422	2.191	10	0		DEAEHN
CCN(CC)C(=O)CN[C@@H](C)c1ccccc1-n1cccn1	ZINC000177254770	402385651	/nfs/dbraw/zinc/38/56/51/402385651.db2.gz	FAOGBDUQVMACQJ-AWEZNQCLSA-N	0	3	300.406	2.391	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CCC[C@H](c3cc[nH]n3)C2)C1	ZINC000176681766	402328050	/nfs/dbraw/zinc/32/80/50/402328050.db2.gz	NLYZWYQRIDYRPW-YCPHGPKFSA-N	0	3	319.453	2.027	10	0		DEAEHN
CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)N1CC[C@@](C)(O)C1	ZINC000177989074	402449508	/nfs/dbraw/zinc/44/95/08/402449508.db2.gz	JHJOBOWAYHDRJL-CRAIPNDOSA-N	0	3	304.434	2.269	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCOc1ccccc1C	ZINC000177421888	402400752	/nfs/dbraw/zinc/40/07/52/402400752.db2.gz	YIJRNQDSPXFOLI-INIZCTEOSA-N	0	3	319.449	2.500	10	0		DEAEHN
O[C@H](COC1CCOCC1)CN1Cc2ccccc2C2(CC2)C1	ZINC000186152893	402406210	/nfs/dbraw/zinc/40/62/10/402406210.db2.gz	FJEYARDVRGABEF-INIZCTEOSA-N	0	3	317.429	2.090	10	0		DEAEHN
CCC[C@H](C(=O)NCCOc1ccc(F)c(F)c1)N(C)C	ZINC000162033818	402407180	/nfs/dbraw/zinc/40/71/80/402407180.db2.gz	MYUSHQQXFRTNIR-CQSZACIVSA-N	0	3	300.349	2.190	10	0		DEAEHN
CC(C)C[C@@H]1OCCC[C@H]1NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000186212392	402410567	/nfs/dbraw/zinc/41/05/67/402410567.db2.gz	ROHZLBCPHPRJGP-OAGGEKHMSA-N	0	3	309.454	2.070	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)NCC1CCCCC1	ZINC000177696223	402427419	/nfs/dbraw/zinc/42/74/19/402427419.db2.gz	QPGHGUAIDSLMII-RDJZCZTQSA-N	0	3	309.498	2.488	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)NCc1sccc1C	ZINC000177697610	402428100	/nfs/dbraw/zinc/42/81/00/402428100.db2.gz	WPAZVENXRNAUDH-CQSZACIVSA-N	0	3	309.479	2.089	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H](C)C(=O)NCc1ccc(C)cc1	ZINC000177704530	402428343	/nfs/dbraw/zinc/42/83/43/402428343.db2.gz	FCGXWJSAYHAJIS-FUHWJXTLSA-N	0	3	317.477	2.416	10	0		DEAEHN
O=C1[C@H](N2CCN3CCC[C@H]3C2)CCN1c1cccc(Cl)c1	ZINC000246114426	402511150	/nfs/dbraw/zinc/51/11/50/402511150.db2.gz	CPWXJBAJDZLONJ-JKSUJKDBSA-N	0	3	319.836	2.225	10	0		DEAEHN
O=C(NCc1ccc([O-])c(F)c1)N1CCC([NH+]2CCCC2)CC1	ZINC000163738376	402456288	/nfs/dbraw/zinc/45/62/88/402456288.db2.gz	JGNDSZLXJNQLSP-UHFFFAOYSA-N	0	3	321.396	2.301	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@H]1COc2ccccc21	ZINC000245426403	402459001	/nfs/dbraw/zinc/45/90/01/402459001.db2.gz	UWMJKCOMSHVYDL-ZFWWWQNUSA-N	0	3	303.406	2.246	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C[C@H]1c2ccccc2NC1=O	ZINC000245428838	402459665	/nfs/dbraw/zinc/45/96/65/402459665.db2.gz	JOGVCEWJAIKGFZ-ZFWWWQNUSA-N	0	3	315.417	2.055	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN([C@H]3CCN(C(C)C)C3=O)C2)n1	ZINC000245459256	402462754	/nfs/dbraw/zinc/46/27/54/402462754.db2.gz	DJTYJQNZLRTCEI-CVEARBPZSA-N	0	3	316.449	2.133	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCN2CCC[C@H]2C1)Oc1ccc(F)cc1	ZINC000245482986	402464634	/nfs/dbraw/zinc/46/46/34/402464634.db2.gz	DSGKYNNMIXLUKD-ZFWWWQNUSA-N	0	3	321.396	2.083	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C)C(=O)N(C)Cc1ccccc1	ZINC000245477398	402464852	/nfs/dbraw/zinc/46/48/52/402464852.db2.gz	UKQVFLJQFOPPRV-AEFFLSMTSA-N	0	3	317.477	2.450	10	0		DEAEHN
COc1cccc([C@H](C)N[C@@H](C(=O)N2CCOCC2)C(C)C)c1	ZINC000164897952	402470030	/nfs/dbraw/zinc/47/00/30/402470030.db2.gz	HMSSADFNGIQTHI-WMLDXEAASA-N	0	3	320.433	2.229	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)CSCc2cscn2)C1	ZINC000246145884	402512859	/nfs/dbraw/zinc/51/28/59/402512859.db2.gz	UGEUSLDPPNLIBM-DGCLKSJQSA-N	0	3	313.492	2.221	10	0		DEAEHN
COCCN1CCN(C[C@H](C)c2ccc(OC)cc2)C[C@H]1C	ZINC000245650582	402476702	/nfs/dbraw/zinc/47/67/02/402476702.db2.gz	HHKKTGWKZJRMAV-JKSUJKDBSA-N	0	3	306.450	2.451	10	0		DEAEHN
CCOCCCNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245691357	402479938	/nfs/dbraw/zinc/47/99/38/402479938.db2.gz	XDJXBUYQBCMENI-HOTGVXAUSA-N	0	3	305.422	2.158	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1C[C@H](O)COc1ccccc1	ZINC000178312127	402483369	/nfs/dbraw/zinc/48/33/69/402483369.db2.gz	PQHHMPKESOHVEG-SJORKVTESA-N	0	3	315.417	2.096	10	0		DEAEHN
CCOc1cccc(CN2C[C@@H](C)[C@@H](N3CCOCC3)C2)c1	ZINC000245729813	402483409	/nfs/dbraw/zinc/48/34/09/402483409.db2.gz	JNHMWCJMKMMUBZ-QAPCUYQASA-N	0	3	304.434	2.238	10	0		DEAEHN
Cc1c(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cnn1CC(C)C	ZINC000245746037	402484875	/nfs/dbraw/zinc/48/48/75/402484875.db2.gz	MUQABUXFFRSHRI-HIFRSBDPSA-N	0	3	304.438	2.156	10	0		DEAEHN
COc1c(C)cc(CN2CCN(C[C@H](C)O)[C@@H](C)C2)cc1C	ZINC000245747220	402485501	/nfs/dbraw/zinc/48/55/01/402485501.db2.gz	NAVOWZBIMCMCJU-HOTGVXAUSA-N	0	3	306.450	2.199	10	0		DEAEHN
COC(=O)[C@]1(C)CCN(CCN(C)Cc2ccc(F)cc2)C1	ZINC000187167669	402485943	/nfs/dbraw/zinc/48/59/43/402485943.db2.gz	OCXLHVZOZLTYIF-QGZVFWFLSA-N	0	3	308.397	2.143	10	0		DEAEHN
CC[C@]1(C)C[C@@H]1C(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000246151550	402513344	/nfs/dbraw/zinc/51/33/44/402513344.db2.gz	ZNXXKNYRBNFGCR-JFIYKMOQSA-N	0	3	307.482	2.051	10	0		DEAEHN
CCc1ccccc1S(=O)(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000187233758	402489256	/nfs/dbraw/zinc/48/92/56/402489256.db2.gz	XYCIQFDAZNWPCX-ZFWWWQNUSA-N	0	3	310.463	2.256	10	0		DEAEHN
CC(C)CCNC(=O)[C@H](C)N1CCC[C@@H](Cc2nccn2C)C1	ZINC000245859854	402491782	/nfs/dbraw/zinc/49/17/82/402491782.db2.gz	KOUPXTWVSDHLJM-HOTGVXAUSA-N	0	3	320.481	2.225	10	0		DEAEHN
O=C(/C=C/Sc1ccccc1)NC[C@H](O)CN1CCCCC1	ZINC000178515037	402505902	/nfs/dbraw/zinc/50/59/02/402505902.db2.gz	KRZAMUONQHOHED-RZXPCSSPSA-N	0	3	320.458	2.255	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000246056565	402506039	/nfs/dbraw/zinc/50/60/39/402506039.db2.gz	CXOAJCRHIUUIBQ-KBPBESRZSA-N	0	3	312.410	2.073	10	0		DEAEHN
CCCC[C@@H]1CCC[C@H]1NC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000246934053	402549514	/nfs/dbraw/zinc/54/95/14/402549514.db2.gz	BUHFJIVSUCRZKQ-OWCLPIDISA-N	0	3	311.470	2.317	10	0		DEAEHN
CCOC(=O)CCCN1CC[C@H](CNc2cccc(C)n2)C1	ZINC000171037701	402551691	/nfs/dbraw/zinc/55/16/91/402551691.db2.gz	SDPUJASKBREXRQ-OAHLLOKOSA-N	0	3	305.422	2.467	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)NC[C@@H]2CCCN(C)C2)c1	ZINC000247149253	402558696	/nfs/dbraw/zinc/55/86/96/402558696.db2.gz	NJERGMCQDWKLGM-JQFCIGGWSA-N	0	3	302.418	2.257	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CCCN2c2nccs2)CCN1C	ZINC000247151981	402558834	/nfs/dbraw/zinc/55/88/34/402558834.db2.gz	ADLUKWCEWRJZFF-HZSPNIEDSA-N	0	3	322.478	2.053	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000189958690	402568152	/nfs/dbraw/zinc/56/81/52/402568152.db2.gz	YPASLEHCGXPLRL-KGLIPLIRSA-N	0	3	322.453	2.427	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)cc1	ZINC000247517675	402570783	/nfs/dbraw/zinc/57/07/83/402570783.db2.gz	NTJFYRAZTGXNHH-GDBMZVCRSA-N	0	3	308.447	2.100	10	0		DEAEHN
O=C(CN1CCN2CCC[C@@H]2C1)N[C@@H](c1ccccc1)C1CC1	ZINC000178641920	402520752	/nfs/dbraw/zinc/52/07/52/402520752.db2.gz	PCVNFSGQSUILJY-MJGOQNOKSA-N	0	3	313.445	2.034	10	0		DEAEHN
CN1CC[C@H](NC(=O)Cc2cncs2)[C@@H]1c1ccccc1	ZINC000188651293	402522769	/nfs/dbraw/zinc/52/27/69/402522769.db2.gz	XKYNDNWKDVUKKU-HOCLYGCPSA-N	0	3	301.415	2.247	10	0		DEAEHN
COc1cccc(C(=O)N2CCC[C@@H]2C[NH+]2CCCCC2)c1[O-]	ZINC000170804452	402527178	/nfs/dbraw/zinc/52/71/78/402527178.db2.gz	CAYIIDSVELFSOA-CQSZACIVSA-N	0	3	318.417	2.491	10	0		DEAEHN
COC(=O)CCCCC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000188965186	402528920	/nfs/dbraw/zinc/52/89/20/402528920.db2.gz	QLVIGIIABPHVMA-YJBOKZPZSA-N	0	3	318.417	2.281	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)N1CC[C@H](N(C)C)C1)c1ccco1	ZINC000170834779	402531009	/nfs/dbraw/zinc/53/10/09/402531009.db2.gz	PTDQJDRBOBWUHJ-LSDHHAIUSA-N	0	3	322.453	2.008	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCCCn2ccc3ccccc32)C1	ZINC000170861297	402534165	/nfs/dbraw/zinc/53/41/65/402534165.db2.gz	BCDMECCIJOYUEW-INIZCTEOSA-N	0	3	314.433	2.377	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Cc2cccc(Br)c2)C1	ZINC000170863817	402534292	/nfs/dbraw/zinc/53/42/92/402534292.db2.gz	AFYNMCSSNOAREW-CYBMUJFWSA-N	0	3	311.223	2.154	10	0		DEAEHN
O=C(c1c(O)cnc2ccccc21)N1CC2CCCC(C1)C2O	ZINC000178780666	402538992	/nfs/dbraw/zinc/53/89/92/402538992.db2.gz	UDPHGGQFCUNUNS-GTKHYJCHSA-N	0	3	312.369	2.173	10	0		DEAEHN
COCCC1(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)CC1	ZINC000248145084	402583615	/nfs/dbraw/zinc/58/36/15/402583615.db2.gz	ZKYSDXMRLJYCGK-JKSUJKDBSA-N	0	3	302.418	2.365	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc(C(=O)OC)c(C)c2)C1	ZINC000171520857	402591058	/nfs/dbraw/zinc/59/10/58/402591058.db2.gz	WWAIODSQACUGDI-CQSZACIVSA-N	0	3	319.405	2.387	10	0		DEAEHN
Cc1ccc(-c2cc(C(=O)N3CCN4CCC[C@@H]4C3)[nH]n2)cc1	ZINC000171585627	402597861	/nfs/dbraw/zinc/59/78/61/402597861.db2.gz	LEDMWPXBHYCMAD-OAHLLOKOSA-N	0	3	310.401	2.305	10	0		DEAEHN
O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@H]1CCCOC1	ZINC000171589943	402598600	/nfs/dbraw/zinc/59/86/00/402598600.db2.gz	AUORJIKNWPUDEC-IRXDYDNUSA-N	0	3	317.433	2.302	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H]1COC2(CCCCCC2)O1)N(C)C	ZINC000180874310	402628819	/nfs/dbraw/zinc/62/88/19/402628819.db2.gz	JGGMEZOBCUFNRE-HUUCEWRRSA-N	0	3	312.454	2.299	10	0		DEAEHN
CC(C)(C)n1ncc2c1ncnc2N1CCCN(C2CC2)CC1	ZINC000179768521	402600472	/nfs/dbraw/zinc/60/04/72/402600472.db2.gz	AKICZEFWRHCWGS-UHFFFAOYSA-N	0	3	314.437	2.256	10	0		DEAEHN
C[C@H]1C[C@H](CC[N@@H+]2CCC[C@]3(C2)NC(=O)[N-]C3=O)C[C@@H](C)C1	ZINC000248682415	402603323	/nfs/dbraw/zinc/60/33/23/402603323.db2.gz	PUFQIBHDKAUZBS-XJIUQZFPSA-N	0	3	307.438	2.123	10	0		DEAEHN
C[C@H]1C[C@H](CC[N@H+]2CCC[C@]3(C2)NC(=O)[N-]C3=O)C[C@@H](C)C1	ZINC000248682415	402603325	/nfs/dbraw/zinc/60/33/25/402603325.db2.gz	PUFQIBHDKAUZBS-XJIUQZFPSA-N	0	3	307.438	2.123	10	0		DEAEHN
O=C1C[C@@H](c2ccccc2)N(C[C@H](O)CC2CCCC2)CCN1	ZINC000190499013	402605689	/nfs/dbraw/zinc/60/56/89/402605689.db2.gz	QTWDAIUGSMRRCN-MSOLQXFVSA-N	0	3	316.445	2.491	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)[C@H]1CC(=O)Nc2ccccc21	ZINC000248742245	402606348	/nfs/dbraw/zinc/60/63/48/402606348.db2.gz	BGEFMBHPDRVNAT-HIFRSBDPSA-N	0	3	315.417	2.103	10	0		DEAEHN
CC[C@H](O)CN1CCN(C[C@@H](C)c2ccc(OC)cc2)CC1	ZINC000180163544	402609037	/nfs/dbraw/zinc/60/90/37/402609037.db2.gz	GHJZZDSKBVDTOA-WBVHZDCISA-N	0	3	306.450	2.187	10	0		DEAEHN
C[C@H](NCC(=O)NCC1CCC1)c1cccc(-n2ccnc2)c1	ZINC000180662376	402622482	/nfs/dbraw/zinc/62/24/82/402622482.db2.gz	FAMNNMCVIFVUOQ-AWEZNQCLSA-N	0	3	312.417	2.439	10	0		DEAEHN
Cc1ccn(-c2ccccc2NC(=O)N2CCCN(C)CC2)n1	ZINC000180704092	402623900	/nfs/dbraw/zinc/62/39/00/402623900.db2.gz	QRIMANIPUMLXKE-UHFFFAOYSA-N	0	3	313.405	2.350	10	0		DEAEHN
O=C(Nc1cnc(-c2ccccc2)nc1)N1CCN2CCC[C@H]2C1	ZINC000171807319	402623992	/nfs/dbraw/zinc/62/39/92/402623992.db2.gz	HDSKLLORAXGQKA-INIZCTEOSA-N	0	3	323.400	2.456	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1)N(C)C	ZINC000249341249	402626077	/nfs/dbraw/zinc/62/60/77/402626077.db2.gz	IXOMFWYCGWXBJE-YRGRVCCFSA-N	0	3	324.387	2.317	10	0		DEAEHN
C[C@H]1CCCN(CCNC(=O)NCCCc2ccccn2)C1	ZINC000179170866	402577602	/nfs/dbraw/zinc/57/76/02/402577602.db2.gz	LEVUMZOMRBPRBJ-HNNXBMFYSA-N	0	3	304.438	2.045	10	0		DEAEHN
CN(C)CCNC(=O)N[C@H]1CCCOc2c(Cl)cccc21	ZINC000181078241	402635254	/nfs/dbraw/zinc/63/52/54/402635254.db2.gz	VJGBDYNHOKDICU-ZDUSSCGKSA-N	0	3	311.813	2.415	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C[C@H](O)Cc1ccccc1	ZINC000249720107	402638837	/nfs/dbraw/zinc/63/88/37/402638837.db2.gz	LTWLKVIZQSXFGJ-MLHJIOFPSA-N	0	3	317.429	2.396	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000249751786	402640770	/nfs/dbraw/zinc/64/07/70/402640770.db2.gz	DKAIBFDLCLFOPX-VXGBXAGGSA-N	0	3	307.360	2.455	10	0		DEAEHN
COc1ccc([C@H](C)N[C@H]2C[C@@H](O)C2(C)C)cc1NC(C)=O	ZINC000249788286	402641721	/nfs/dbraw/zinc/64/17/21/402641721.db2.gz	DUMPVKPRDJHWGM-CIISACIHSA-N	0	3	306.406	2.464	10	0		DEAEHN
CCN1CCN(CCCCNC(=O)N[C@@H](C)C2CCCC2)CC1	ZINC000172182750	402644083	/nfs/dbraw/zinc/64/40/83/402644083.db2.gz	GOOPRMNZCIGCRG-INIZCTEOSA-N	0	3	324.513	2.282	10	0		DEAEHN
CO[C@@H]1CN(C(=O)N[C@H](C)CN2CCC[C@@H](C)C2)CC[C@H]1C	ZINC000251911557	402651487	/nfs/dbraw/zinc/65/14/87/402651487.db2.gz	RTCZDMUUXDDZMP-KLHDSHLOSA-N	0	3	311.470	2.173	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NC[C@H](c2ccccc2)N(C)C)CC[C@@H]1C	ZINC000251943333	402651544	/nfs/dbraw/zinc/65/15/44/402651544.db2.gz	UUIUWNZMOXIESH-USXIJHARSA-N	0	3	319.449	2.356	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)N1CC[C@@H](C)[C@@H](OC)C1	ZINC000252061381	402652999	/nfs/dbraw/zinc/65/29/99/402652999.db2.gz	ZYKBTBBSEZUACJ-OAGGEKHMSA-N	0	3	311.470	2.317	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1ncc(F)cc1F)c1ccccc1	ZINC000192094934	402710818	/nfs/dbraw/zinc/71/08/18/402710818.db2.gz	UQWSTLQZYGHVBY-AWEZNQCLSA-N	0	3	305.328	2.393	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)Nc1nc2ccccc2[nH]1	ZINC000261648988	402715364	/nfs/dbraw/zinc/71/53/64/402715364.db2.gz	FMVMQVRKQDBFFF-JUKMUDQWSA-N	0	3	314.389	2.034	10	0		DEAEHN
CCn1cc(CN2C[C@@H](c3ccncc3)[C@H](COC)C2)cn1	ZINC000253413682	402663924	/nfs/dbraw/zinc/66/39/24/402663924.db2.gz	VKMXURFTJMQJJN-IRXDYDNUSA-N	0	3	300.406	2.160	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N[C@@H]1CCC(=O)N(C)C1)CCS2	ZINC000191516762	402675552	/nfs/dbraw/zinc/67/55/52/402675552.db2.gz	RMHVPVIZBNFHBM-RISCZKNCSA-N	0	3	306.431	2.443	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1ccc2nnn(C)c2c1)c1ccccc1	ZINC000182372793	402684371	/nfs/dbraw/zinc/68/43/71/402684371.db2.gz	JJWCIGXFURDXTG-MRXNPFEDSA-N	0	3	323.400	2.001	10	0		DEAEHN
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)/C=C\c1cncc([O-])c1	ZINC000255420410	402687241	/nfs/dbraw/zinc/68/72/41/402687241.db2.gz	CEQJTQCFMLHSHT-IYKSTZQJSA-N	0	3	303.406	2.037	10	0		DEAEHN
CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)/C=C\c1cncc([O-])c1	ZINC000255420410	402687245	/nfs/dbraw/zinc/68/72/45/402687245.db2.gz	CEQJTQCFMLHSHT-IYKSTZQJSA-N	0	3	303.406	2.037	10	0		DEAEHN
COc1ccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1O	ZINC000174072219	402725776	/nfs/dbraw/zinc/72/57/76/402725776.db2.gz	KYBGYKBBGMPANU-TZMCWYRMSA-N	0	3	321.421	2.025	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000174233220	402732817	/nfs/dbraw/zinc/73/28/17/402732817.db2.gz	OUVPKARKLAMVEP-RDJZCZTQSA-N	0	3	319.449	2.375	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](C)c2nc(C(C)(C)C)no2)C1	ZINC000174239296	402733281	/nfs/dbraw/zinc/73/32/81/402733281.db2.gz	RQPDGBVJNMGUJL-RYUDHWBXSA-N	0	3	323.441	2.212	10	0		DEAEHN
COCc1csc(NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)n1	ZINC000174376705	402738508	/nfs/dbraw/zinc/73/85/08/402738508.db2.gz	WWFUYWSDXYCRKJ-ZYHUDNBSSA-N	0	3	312.439	2.236	10	0		DEAEHN
COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@@H](C)[C@@H]1CCCO1	ZINC000183105877	402739347	/nfs/dbraw/zinc/73/93/47/402739347.db2.gz	PMIBDJDWCMFSRZ-YXWQFLTLSA-N	0	3	320.433	2.418	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)c2nc3cccnc3s2)[C@@H](C)C1	ZINC000193984832	402780930	/nfs/dbraw/zinc/78/09/30/402780930.db2.gz	PENWNAMAVVCTGH-JQWIXIFHSA-N	0	3	304.419	2.150	10	0		DEAEHN
CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@@H](C)[C@H]2CCCO2)c1	ZINC000183142398	402743039	/nfs/dbraw/zinc/74/30/39/402743039.db2.gz	FVFSHXAHSBBSSM-MQIPJXDCSA-N	0	3	319.405	2.129	10	0		DEAEHN
CCCOc1cccc(CNC(=O)CN[C@@H](C)[C@@H]2CCCO2)c1	ZINC000183222185	402748506	/nfs/dbraw/zinc/74/85/06/402748506.db2.gz	GKJFHSFWWKIBND-YOEHRIQHSA-N	0	3	320.433	2.249	10	0		DEAEHN
CN1CCNC[C@H]1c1noc([C@H]2Cc3ccccc3S2)n1	ZINC000263269680	402752844	/nfs/dbraw/zinc/75/28/44/402752844.db2.gz	SARWOIBWJNQOAP-WCQYABFASA-N	0	3	302.403	2.035	10	0		DEAEHN
COc1ccc([C@H](C)Cc2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263295426	402755256	/nfs/dbraw/zinc/75/52/56/402755256.db2.gz	WEVIMTQTYOYURA-IUODEOHRSA-N	0	3	316.405	2.001	10	0		DEAEHN
Cc1ccc([C@H](O)CN2CCC[C@H](Cn3cncn3)C2)cc1	ZINC000174788092	402757379	/nfs/dbraw/zinc/75/73/79/402757379.db2.gz	BGRIBPCMCBHGDC-DOTOQJQBSA-N	0	3	300.406	2.032	10	0		DEAEHN
CC(C)Nc1ncccc1C(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000174849022	402760487	/nfs/dbraw/zinc/76/04/87/402760487.db2.gz	DRVYPGHAUHAIGG-UONOGXRCSA-N	0	3	302.422	2.211	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1cc2ccccc2[nH]c1=O	ZINC000193268711	402769295	/nfs/dbraw/zinc/76/92/95/402769295.db2.gz	LIEWUQICZJVLCR-AWEZNQCLSA-N	0	3	315.417	2.234	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc(C)c(C(=O)OC)c2)C1	ZINC000175037763	402773693	/nfs/dbraw/zinc/77/36/93/402773693.db2.gz	ARRAREZGRSKSPL-AWEZNQCLSA-N	0	3	319.405	2.387	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc(OC)c(OC)c2)C1	ZINC000194317053	402792046	/nfs/dbraw/zinc/79/20/46/402792046.db2.gz	FRSGGGXYEDYCPS-CYBMUJFWSA-N	0	3	307.394	2.310	10	0		DEAEHN
CC1CCC(N2CCN(C(=O)[C@H]3CCOC[C@@H]3C)CC2)CC1	ZINC000194374731	402794488	/nfs/dbraw/zinc/79/44/88/402794488.db2.gz	FXDQHVKOZDJHNW-XGHPGWEVSA-N	0	3	308.466	2.382	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)NCc1ccccc1C	ZINC000175345312	402798921	/nfs/dbraw/zinc/79/89/21/402798921.db2.gz	OYAVIAFDWIFKDF-QGZVFWFLSA-N	0	3	303.450	2.027	10	0		DEAEHN
COc1ccc(S[C@H](C)C(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000195335548	402842577	/nfs/dbraw/zinc/84/25/77/402842577.db2.gz	UXBFYWDTHXEREU-ZIAGYGMSSA-N	0	3	320.458	2.482	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000175477794	402810331	/nfs/dbraw/zinc/81/03/31/402810331.db2.gz	KTJSRKMMRZWZNK-GJZGRUSLSA-N	0	3	321.469	2.163	10	0		DEAEHN
COCCN1CCCN(CC[C@H](C)c2ccccc2)CC1=O	ZINC000194846559	402818173	/nfs/dbraw/zinc/81/81/73/402818173.db2.gz	RIXWYGFWUUOKKZ-INIZCTEOSA-N	0	3	304.434	2.361	10	0		DEAEHN
CCn1cc([C@@H](C)NC2CCN(c3ncccn3)CC2)cn1	ZINC000194981687	402825197	/nfs/dbraw/zinc/82/51/97/402825197.db2.gz	SBIBDYAIJPKVPX-CYBMUJFWSA-N	0	3	300.410	2.013	10	0		DEAEHN
CCc1nnc(CN2CCCN(Cc3ccccc3)CC2)n1C	ZINC000195047489	402829173	/nfs/dbraw/zinc/82/91/73/402829173.db2.gz	VWHUOARALMRFSC-UHFFFAOYSA-N	0	3	313.449	2.085	10	0		DEAEHN
CCCCCS(=O)(=O)N1CCCC[C@@H](N2CCCC2)C1	ZINC000184448867	402844271	/nfs/dbraw/zinc/84/42/71/402844271.db2.gz	QRLLFNMKWJWQSG-OAHLLOKOSA-N	0	3	302.484	2.457	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2ccc([S@](C)=O)cc2)CCN1C	ZINC000175834929	402836895	/nfs/dbraw/zinc/83/68/95/402836895.db2.gz	AYBHQKOGDRAZCM-OQQHHNTDSA-N	0	3	323.462	2.370	10	0		DEAEHN
CCOC(=O)N[C@H]1CCCN(C[C@](C)(O)c2ccccc2)C1	ZINC000195234795	402838490	/nfs/dbraw/zinc/83/84/90/402838490.db2.gz	CQAINOUJVZXEQV-RDJZCZTQSA-N	0	3	306.406	2.105	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCCCNc1ccccn1	ZINC000194065136	402783297	/nfs/dbraw/zinc/78/32/97/402783297.db2.gz	JXJJVLVJDYLMTQ-HNNXBMFYSA-N	0	3	321.469	2.159	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCc2c1cccc2F	ZINC000184507946	402847805	/nfs/dbraw/zinc/84/78/05/402847805.db2.gz	CIPBLHCGBZZMOW-CYBMUJFWSA-N	0	3	321.396	2.009	10	0		DEAEHN
C[C@@H]1C[C@H](C)CN(C(=O)CN2CCC(c3ccn[nH]3)CC2)C1	ZINC000195506065	402848334	/nfs/dbraw/zinc/84/83/34/402848334.db2.gz	AHHGDIBOLJBYCP-OKILXGFUSA-N	0	3	304.438	2.094	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN(CC(=O)NC3CCCC3)C2)n1	ZINC000195516128	402849575	/nfs/dbraw/zinc/84/95/75/402849575.db2.gz	BULJMHSSRSHYBL-OAHLLOKOSA-N	0	3	316.449	2.183	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N(C)CC2CCN(C)CC2)cc1	ZINC000278851169	402878063	/nfs/dbraw/zinc/87/80/63/402878063.db2.gz	DJJLIJZMNJKKDP-UHFFFAOYSA-N	0	3	317.433	2.083	10	0		DEAEHN
COc1ccc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1OC	ZINC000247520568	286282699	/nfs/dbraw/zinc/28/26/99/286282699.db2.gz	WQZZDLXSTARDIC-OCCSQVGLSA-N	0	3	304.390	2.013	10	0		DEAEHN
Cc1nnc2ccc(N[C@@H]3CN(Cc4ccccc4)C[C@H]3C)nn12	ZINC000274133049	403029568	/nfs/dbraw/zinc/02/95/68/403029568.db2.gz	FOCJIUVDAWSENW-CZUORRHYSA-N	0	3	322.416	2.365	10	0		DEAEHN
Brc1cccc2c1OCC[C@@H]2NCCn1cncn1	ZINC000268795985	403114490	/nfs/dbraw/zinc/11/44/90/403114490.db2.gz	DPGXPHMQZYQPSC-LBPRGKRZSA-N	0	3	323.194	2.154	10	0		DEAEHN
Cc1ncc(C(=O)N2CC[C@H](n3c(C)nc4c3CCCC4)C2)[nH]1	ZINC000275827201	403126877	/nfs/dbraw/zinc/12/68/77/403126877.db2.gz	ZFAQDPAZTCCEDP-ZDUSSCGKSA-N	0	3	313.405	2.189	10	0		DEAEHN
Cc1n[nH]c(C)c1CN1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000275887427	403130633	/nfs/dbraw/zinc/13/06/33/403130633.db2.gz	ZFTPDWYAJWAGLH-QGZVFWFLSA-N	0	3	313.449	2.375	10	0		DEAEHN
Cc1cc(CO)oc1C(=O)N1CCN(C2CCC2)C[C@@H](C)C1	ZINC000293646080	403527551	/nfs/dbraw/zinc/52/75/51/403527551.db2.gz	HVVCWGWDQAIUHN-GFCCVEGCSA-N	0	3	306.406	2.027	10	0		DEAEHN
Cc1cc(N2CCNC(=O)C2)c2cc(OC(F)F)ccc2n1	ZINC000301336052	403616723	/nfs/dbraw/zinc/61/67/23/403616723.db2.gz	CZUIZISGABHEMY-UHFFFAOYSA-N	0	3	307.300	2.081	10	0		DEAEHN
Cc1cc(Cl)cnc1NC(=O)NC[C@@H]1NC(C)(C)O[C@@H]1C	ZINC000333280133	403714550	/nfs/dbraw/zinc/71/45/50/403714550.db2.gz	HMCCRXWVIDVTES-KOLCDFICSA-N	0	3	312.801	2.278	10	0		DEAEHN
O=C(Nc1ccc2cc[nH]c(=O)c2c1)N1CCN2CCC[C@H]2C1	ZINC000333368944	403735574	/nfs/dbraw/zinc/73/55/74/403735574.db2.gz	IQGZANJVSVLDOL-AWEZNQCLSA-N	0	3	312.373	2.252	10	0		DEAEHN
CC(C)c1nc([C@@H](C)N[C@H]2CCc3nnnn3CC2)cs1	ZINC000333714876	403829534	/nfs/dbraw/zinc/82/95/34/403829534.db2.gz	IWEWIGNBJLPQJU-MNOVXSKESA-N	0	3	306.439	2.309	10	0		DEAEHN
c1ncn(CCN2CCC(CN3CCc4ccccc43)CC2)n1	ZINC000369179968	403993479	/nfs/dbraw/zinc/99/34/79/403993479.db2.gz	HGJBVRHYWINJBI-UHFFFAOYSA-N	0	3	311.433	2.053	10	0		DEAEHN
C/C(=C\c1ccc(F)cc1)C(=O)NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000363360316	404156080	/nfs/dbraw/zinc/15/60/80/404156080.db2.gz	GEUSPMWENQKBSN-WZFZXHKMSA-N	0	3	318.392	2.208	10	0		DEAEHN
C[C@@H]1CN(C2CCOCC2)CCN1CCOc1ccc(F)cc1	ZINC000369733117	404212168	/nfs/dbraw/zinc/21/21/68/404212168.db2.gz	VGIYWLHWHSKCIW-OAHLLOKOSA-N	0	3	322.424	2.390	10	0		DEAEHN
CC(=O)N1CC[C@H](NCC[C@@H](C)[S@@](C)=O)c2ccccc2C1	ZINC000352847749	404661575	/nfs/dbraw/zinc/66/15/75/404661575.db2.gz	GGTUOBVTPBOJKF-LEXZLQQCSA-N	0	3	322.474	2.227	10	0		DEAEHN
CCOC(=O)[C@H]1CN(CCCc2ccsc2)CC12COC2	ZINC000451141292	404877189	/nfs/dbraw/zinc/87/71/89/404877189.db2.gz	VEJUWICHDPTBIS-CQSZACIVSA-N	0	3	309.431	2.192	10	0		DEAEHN
O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)N1CCC2(C1)CCCCC2	ZINC000377877461	404849441	/nfs/dbraw/zinc/84/94/41/404849441.db2.gz	BRRBAYVIWCWJBL-HZPDHXFCSA-N	0	3	321.465	2.215	10	0		DEAEHN
C/C(=C/c1ccccc1)CN1CCC[C@@H](CS(N)(=O)=O)C1	ZINC000353542772	404861359	/nfs/dbraw/zinc/86/13/59/404861359.db2.gz	LKQVYULHEWPTTQ-SCOADAFUSA-N	0	3	308.447	2.090	10	0		DEAEHN
C/C(=C/c1ccccc1)CN1CCC[C@H](CS(N)(=O)=O)C1	ZINC000353542771	404861687	/nfs/dbraw/zinc/86/16/87/404861687.db2.gz	LKQVYULHEWPTTQ-DNXIFWLFSA-N	0	3	308.447	2.090	10	0		DEAEHN
COC(=O)[C@H](C1CC1)N1CCC(c2ncc3n2CCCC3)CC1	ZINC000434688314	404923797	/nfs/dbraw/zinc/92/37/97/404923797.db2.gz	KWEHZYGVWVWXRI-INIZCTEOSA-N	0	3	317.433	2.350	10	0		DEAEHN
C[C@H]1OCC[C@@]1(O)CNCc1ccsc1Br	ZINC000388965560	405036748	/nfs/dbraw/zinc/03/67/48/405036748.db2.gz	HMPTUXSSCSHHNH-LDYMZIIASA-N	0	3	306.225	2.140	10	0		DEAEHN
CC(C)C[C@H](C)C(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000361209612	404974828	/nfs/dbraw/zinc/97/48/28/404974828.db2.gz	HFLCSJJNTAWFNY-LPHOPBHVSA-N	0	3	318.461	2.422	10	0		DEAEHN
CC(C)NC(=O)N1CCO[C@H]2CCN(Cc3ccccc3)C[C@@H]21	ZINC000404162389	405068522	/nfs/dbraw/zinc/06/85/22/405068522.db2.gz	YXMHIVQBHZMZDQ-IRXDYDNUSA-N	0	3	317.433	2.080	10	0		DEAEHN
C/C=C\C[C@H](NC(=O)[C@H](C)N1CCCCCC1)C(=O)OCC	ZINC000361548188	405126818	/nfs/dbraw/zinc/12/68/18/405126818.db2.gz	GWLWBSWVRWQDEU-SNPDBEFISA-N	0	3	310.438	2.265	10	0		DEAEHN
CC[NH+]1CCC(CCNC(=O)c2ccc(C(C)=O)c([O-])c2)CC1	ZINC000436646429	405115029	/nfs/dbraw/zinc/11/50/29/405115029.db2.gz	GCFGHCAWOPWJGF-UHFFFAOYSA-N	0	3	318.417	2.447	10	0		DEAEHN
CCN1C[C@@H](C)N(C(=O)c2cc3[nH]cnc3cc2F)C[C@H]1C	ZINC000408471562	405214522	/nfs/dbraw/zinc/21/45/22/405214522.db2.gz	STFQBDMHEBCHFB-GHMZBOCLSA-N	0	3	304.369	2.257	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@H]1C[C@H]1c1cccc(F)c1F	ZINC000439044796	405263751	/nfs/dbraw/zinc/26/37/51/405263751.db2.gz	ZXJFMQXEYRVKPQ-KBPBESRZSA-N	0	3	317.339	2.114	10	0		DEAEHN
CC(=O)CCc1ccc(OC[C@@H](O)CN2CC[C@H]2C2CC2)cc1	ZINC000453043661	405278855	/nfs/dbraw/zinc/27/88/55/405278855.db2.gz	UNFQCBPTZZMYDE-HKUYNNGSSA-N	0	3	317.429	2.432	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)NC[C@@H](C)N1CCC(C)CC1	ZINC000454623331	405373795	/nfs/dbraw/zinc/37/37/95/405373795.db2.gz	ANSAUNQORVOFNA-CYBMUJFWSA-N	0	3	322.453	2.465	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NCC[C@H]1CC=CCC1	ZINC000638597810	405565249	/nfs/dbraw/zinc/56/52/49/405565249.db2.gz	BEQWZQHHQQPHPL-WMZOPIPTSA-N	0	3	315.461	2.308	10	0		DEAEHN
CCN1C[C@H](NCc2ccc(C(=O)OC(C)(C)C)cc2)CC1=O	ZINC000449520967	405595056	/nfs/dbraw/zinc/59/50/56/405595056.db2.gz	SYUHYOKWRPRFOB-OAHLLOKOSA-N	0	3	318.417	2.352	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)NCCN2CCCC2(C)C)cc1	ZINC000457053007	405671193	/nfs/dbraw/zinc/67/11/93/405671193.db2.gz	JHTDBWNLFMROMG-UHFFFAOYSA-N	0	3	317.433	2.274	10	0		DEAEHN
CN1C(=O)C[C@@H](NC2Cc3ccccc3C2)[C@@H]1c1cccnc1	ZINC000583619474	405776920	/nfs/dbraw/zinc/77/69/20/405776920.db2.gz	IROQTNWCEVEWQT-MJGOQNOKSA-N	0	3	307.397	2.110	10	0		DEAEHN
CC(=O)[C@](C)(O)CN1CCC(OCCc2ccccc2)CC1	ZINC000450298771	405823095	/nfs/dbraw/zinc/82/30/95/405823095.db2.gz	NNQHHEJQHBUTEV-GOSISDBHSA-N	0	3	305.418	2.050	10	0		DEAEHN
C[C@H]1CC[C@@](C)(C(=O)N2CCN(CCN(C)C)CC2)C1(C)C	ZINC000457398183	405825299	/nfs/dbraw/zinc/82/52/99/405825299.db2.gz	WNSCNIVHCYBWAQ-YJBOKZPZSA-N	0	3	309.498	2.155	10	0		DEAEHN
Cn1cccc1[C@@H]1CCCCN1C[C@@H](O)COC[C@@H]1CCCO1	ZINC000530867735	405873322	/nfs/dbraw/zinc/87/33/22/405873322.db2.gz	KUCAECKXJFZBPP-RYRKJORJSA-N	0	3	322.449	2.109	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN(C)CCCc1cc(-c2ccccc2)n[nH]1	ZINC000450328407	405837651	/nfs/dbraw/zinc/83/76/51/405837651.db2.gz	BTXJLKZFNQPGFM-SFHVURJKSA-N	0	3	315.417	2.281	10	0		DEAEHN
CCC(=O)N[C@@H]1CCCN(C[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000450327884	405837830	/nfs/dbraw/zinc/83/78/30/405837830.db2.gz	NLIYBLPYZAGUKN-OIISXLGYSA-N	0	3	304.434	2.142	10	0		DEAEHN
c1ccc(-n2nnnc2CCN2CCC[C@@H]2c2ccccn2)cc1	ZINC000530724689	405851946	/nfs/dbraw/zinc/85/19/46/405851946.db2.gz	ZKHZPOXWYHCEHH-QGZVFWFLSA-N	0	3	320.400	2.437	10	0		DEAEHN
COCCOC[C@H](O)CN1CC[C@@H](C)C[C@@H]1c1ccc(C)o1	ZINC000450460030	405909378	/nfs/dbraw/zinc/90/93/78/405909378.db2.gz	ZAUPXVYFJKJQTN-FVQBIDKESA-N	0	3	311.422	2.385	10	0		DEAEHN
c1ccc(CN2CCO[C@H]3CN(CCC[C@@H]4CCO4)C[C@H]32)cc1	ZINC000639305605	406032320	/nfs/dbraw/zinc/03/23/20/406032320.db2.gz	ACIBTWDHDBHSFW-QRVBRYPASA-N	0	3	316.445	2.141	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)N[C@H]3CN(C4CC4)C[C@@H]3C)cc2)c1	ZINC000531567234	405979607	/nfs/dbraw/zinc/97/96/07/405979607.db2.gz	GPVLITRMSGIJIK-KSSFIOAISA-N	0	3	324.428	2.393	10	0		DEAEHN
COc1nsc(CNC[C@@H](C)CCCO)c1Br	ZINC000639220521	405984413	/nfs/dbraw/zinc/98/44/13/405984413.db2.gz	DLAAOENAIAMONU-QMMMGPOBSA-N	0	3	323.256	2.412	10	0		DEAEHN
C(c1noc(CN2CCC[C@@H]2CN2CCCCC2)n1)C1CC1	ZINC000639471469	406103789	/nfs/dbraw/zinc/10/37/89/406103789.db2.gz	OWBZIYWUJYULRG-OAHLLOKOSA-N	0	3	304.438	2.472	10	0		DEAEHN
COc1cc(CN[C@@H]2CCCN(Cc3ccccc3)C2)on1	ZINC000639325403	406045318	/nfs/dbraw/zinc/04/53/18/406045318.db2.gz	XEMHRQDVHPCNMK-OAHLLOKOSA-N	0	3	301.390	2.437	10	0		DEAEHN
C[C@@H]1C[C@H]1CNC(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000471668754	406107487	/nfs/dbraw/zinc/10/74/87/406107487.db2.gz	LYJQIACMXRWRLK-OIISXLGYSA-N	0	3	301.434	2.464	10	0		DEAEHN
CO[C@@H]1CC[C@H](NC(=O)NC[C@H](Cc2ccccc2)N(C)C)C1	ZINC000471825256	406122348	/nfs/dbraw/zinc/12/23/48/406122348.db2.gz	KBTSHBUQXKWRIJ-YESZJQIVSA-N	0	3	319.449	2.026	10	0		DEAEHN
CCOC1CC(CCNCc2c(Br)cnn2C)C1	ZINC000487150034	406209214	/nfs/dbraw/zinc/20/92/14/406209214.db2.gz	BLJUNWKQGUDPCX-UHFFFAOYSA-N	0	3	316.243	2.477	10	0		DEAEHN
C[C@H]1C[C@@H](CCNCc2c(Br)cnn2C)CCO1	ZINC000487567793	406248013	/nfs/dbraw/zinc/24/80/13/406248013.db2.gz	BFZBDXKKLWYRFI-QWRGUYRKSA-N	0	3	316.243	2.477	10	0		DEAEHN
CC1(c2ccccc2)CC(NC(=O)NCCNc2ccncc2)C1	ZINC000545245440	406306846	/nfs/dbraw/zinc/30/68/46/406306846.db2.gz	RIDUMRSQAQSGAK-UHFFFAOYSA-N	0	3	324.428	2.335	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNCCOc1ccccc1	ZINC000490579845	406472425	/nfs/dbraw/zinc/47/24/25/406472425.db2.gz	NZAVHRNDJWEROA-UHFFFAOYSA-N	0	3	308.385	2.495	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CCC[C@@H]2CCC[C@@H]21	ZINC000637954256	406493991	/nfs/dbraw/zinc/49/39/91/406493991.db2.gz	UZQKAZKHHCXHPE-BZSNNMDCSA-N	0	3	315.461	2.237	10	0		DEAEHN
C[C@H]1Cc2ccccc2N1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637868529	406453726	/nfs/dbraw/zinc/45/37/26/406453726.db2.gz	OMMGWNQODDUFKC-YJBOKZPZSA-N	0	3	323.440	2.424	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H]1OCC[C@@H]1N)c1ccc(Cl)cc1Cl	ZINC000637885270	406462665	/nfs/dbraw/zinc/46/26/65/406462665.db2.gz	UAWVWMWOOGFEAF-VSYUYLJXSA-N	0	3	303.189	2.287	10	0		DEAEHN
NC(=O)c1csc(CNCC[C@H]2COc3ccccc3O2)c1	ZINC000571593205	406540262	/nfs/dbraw/zinc/54/02/62/406540262.db2.gz	BALWGDAJLFGFJS-LBPRGKRZSA-N	0	3	318.398	2.167	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N(C(=O)[C@H](N)CN(C)Cc2ccccc2)C1	ZINC000638007408	406520284	/nfs/dbraw/zinc/52/02/84/406520284.db2.gz	NJMNNTFUYLHKSB-BFYDXBDKSA-N	0	3	303.450	2.093	10	0		DEAEHN
Cc1nn(C)c2ncc(CNC[C@@H](CO)c3ccccc3)cc12	ZINC000572504879	406682557	/nfs/dbraw/zinc/68/25/57/406682557.db2.gz	MUNFONLUKUULJR-INIZCTEOSA-N	0	3	310.401	2.142	10	0		DEAEHN
C[C@@H](CCC1CC1)NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638308746	406690365	/nfs/dbraw/zinc/69/03/65/406690365.db2.gz	XHIDMJGZBQSAMY-WMLDXEAASA-N	0	3	303.450	2.141	10	0		DEAEHN
C[C@H]1CCCCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)C1	ZINC000638313507	406692389	/nfs/dbraw/zinc/69/23/89/406692389.db2.gz	XJGBCSKFEFTSTQ-DOTOQJQBSA-N	0	3	303.450	2.094	10	0		DEAEHN
CCc1nc(NC(=O)NCCNc2ccncc2)sc1C	ZINC000551819636	406638701	/nfs/dbraw/zinc/63/87/01/406638701.db2.gz	FHILDNZFTXCGFV-UHFFFAOYSA-N	0	3	305.407	2.064	10	0		DEAEHN
Cc1n[nH]c(CCNCc2ccsc2Br)n1	ZINC000527685536	406717179	/nfs/dbraw/zinc/71/71/79/406717179.db2.gz	FWNIYUPQMZUOBN-UHFFFAOYSA-N	0	3	301.213	2.269	10	0		DEAEHN
Cc1nc(CCNCc2ccsc2Br)n[nH]1	ZINC000527685536	406717186	/nfs/dbraw/zinc/71/71/86/406717186.db2.gz	FWNIYUPQMZUOBN-UHFFFAOYSA-N	0	3	301.213	2.269	10	0		DEAEHN
O=C([C@@H]1CNCCOC1)N(Cc1ccccc1)Cc1ccccc1	ZINC000643614412	407016722	/nfs/dbraw/zinc/01/67/22/407016722.db2.gz	VQFDQTKCRANHPD-LJQANCHMSA-N	0	3	324.424	2.451	10	0		DEAEHN
CCN(CC)c1ncc(CNCC[C@@H](C)[S@](C)=O)s1	ZINC000129399078	196044668	/nfs/dbraw/zinc/04/46/68/196044668.db2.gz	MZEBODCLPCSDEG-NSPYISDASA-N	0	3	303.497	2.236	10	0		DEAEHN
Cc1cc(Br)cc2nc(C[C@H]3COCCN3)[nH]c21	ZINC000129662987	196066081	/nfs/dbraw/zinc/06/60/81/196066081.db2.gz	JPFPGONGJUZZJD-JTQLQIEISA-N	0	3	310.195	2.165	10	0		DEAEHN
Cc1cc(Br)cc2[nH]c(C[C@H]3COCCN3)nc21	ZINC000129662987	196066083	/nfs/dbraw/zinc/06/60/83/196066083.db2.gz	JPFPGONGJUZZJD-JTQLQIEISA-N	0	3	310.195	2.165	10	0		DEAEHN
CCS(=O)(=O)NCCCN(C)Cc1ccc(Cl)cc1	ZINC000130604663	196095296	/nfs/dbraw/zinc/09/52/96/196095296.db2.gz	IGLPNZQEIIQFOB-UHFFFAOYSA-N	0	3	304.843	2.101	10	0		DEAEHN
CCc1cc(C[C@@H](N)c2ccc(Br)cn2)n(C)n1	ZINC000130765339	196108798	/nfs/dbraw/zinc/10/87/98/196108798.db2.gz	AZPGUMPIVLXPKZ-GFCCVEGCSA-N	0	3	309.211	2.383	10	0		DEAEHN
CNCc1ccc(CS(=O)(=O)c2ccc(F)c(F)c2)o1	ZINC000130899243	196121043	/nfs/dbraw/zinc/12/10/43/196121043.db2.gz	HUOPVSMLTWCXNH-UHFFFAOYSA-N	0	3	301.314	2.251	10	0		DEAEHN
C[C@H]1CC[C@H](C(=O)NCC2(N3CCSCC3)CCCC2)O1	ZINC000130943011	196124722	/nfs/dbraw/zinc/12/47/22/196124722.db2.gz	URGQCBHRLCDEAF-UONOGXRCSA-N	0	3	312.479	2.032	10	0		DEAEHN
CN(c1nc(C(F)(F)F)ccc1CN)[C@H]1CCCC[C@@H]1O	ZINC000131177836	196147338	/nfs/dbraw/zinc/14/73/38/196147338.db2.gz	ORASUBZTPBAKCU-QWRGUYRKSA-N	0	3	303.328	2.299	10	0		DEAEHN
CCO[C@@H](C)CNS(=O)(=O)c1cccc([C@H](CC)NC)c1	ZINC000131228409	196151518	/nfs/dbraw/zinc/15/15/18/196151518.db2.gz	BKWUTQTWKNTELO-WFASDCNBSA-N	0	3	314.451	2.060	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1cccc(C)c1Br	ZINC000131394463	196165102	/nfs/dbraw/zinc/16/51/02/196165102.db2.gz	LMKHVEOVMKHKEV-SNVBAGLBSA-N	0	3	315.211	2.450	10	0		DEAEHN
CCOC(=O)[C@H](NCCN(C)C)c1cccc(C(F)F)c1	ZINC000131965066	196214344	/nfs/dbraw/zinc/21/43/44/196214344.db2.gz	KOMSMRXRRCHOQK-CYBMUJFWSA-N	0	3	300.349	2.380	10	0		DEAEHN
CC[C@@H](C)[C@@H](O)c1c(Br)cnn1CCN(C)C	ZINC000132029535	196220334	/nfs/dbraw/zinc/22/03/34/196220334.db2.gz	LBBWFHATFRCFCG-BXKDBHETSA-N	0	3	304.232	2.287	10	0		DEAEHN
CN(Cc1cc(Cl)cc(Cl)c1)C(=O)C1(N)CCOCC1	ZINC000132189817	196234602	/nfs/dbraw/zinc/23/46/02/196234602.db2.gz	KVXOIRIBEYFGSF-UHFFFAOYSA-N	0	3	317.216	2.460	10	0		DEAEHN
CCNc1ncc(Br)c(NC[C@H](C)N(C)C)n1	ZINC000132224120	196237029	/nfs/dbraw/zinc/23/70/29/196237029.db2.gz	FWXLRQASKICHNO-QMMMGPOBSA-N	0	3	302.220	2.033	10	0		DEAEHN
C[C@H]1CCC[C@]1(O)c1c(Br)cnn1CCN(C)C	ZINC000132489196	196259750	/nfs/dbraw/zinc/25/97/50/196259750.db2.gz	ZRHFBGNGEQDWPZ-GXFFZTMASA-N	0	3	316.243	2.215	10	0		DEAEHN
O=C(NCC1CCN(CCO)CC1)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000132982889	196302229	/nfs/dbraw/zinc/30/22/29/196302229.db2.gz	ZCYPLXGQFWYTQB-RCCFBDPRSA-N	0	3	322.493	2.413	10	0		DEAEHN
CC[C@@H](C)c1nc(N(CCOC)CCOC)sc1CN	ZINC000133134696	196313847	/nfs/dbraw/zinc/31/38/47/196313847.db2.gz	BOQNRTLXDFVFSU-LLVKDONJSA-N	0	3	301.456	2.215	10	0		DEAEHN
C[C@@H]1CCCC[C@H]1NC(=O)NC(=O)CN1CCCC12CCC2	ZINC000444787714	287314524	/nfs/dbraw/zinc/31/45/24/287314524.db2.gz	YOFUTTBWGWBWLQ-ZIAGYGMSSA-N	0	3	307.438	2.409	10	0		DEAEHN
Cc1ccc2c(CCN[C@H]3CCCS(=O)(=O)C3)cn(C)c2c1	ZINC000188699921	225029424	/nfs/dbraw/zinc/02/94/24/225029424.db2.gz	VVRDNHIPWRKRMM-HNNXBMFYSA-N	0	3	320.458	2.196	10	0		DEAEHN
C[C@@H](N[C@@H]1CCN(c2ncccc2Cl)C1)c1ccnn1C	ZINC000192953546	225147432	/nfs/dbraw/zinc/14/74/32/225147432.db2.gz	UGYFALPRUOBASN-VXGBXAGGSA-N	0	3	305.813	2.398	10	0		DEAEHN
CC[C@@](C)(CCO)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000153803248	287385279	/nfs/dbraw/zinc/38/52/79/287385279.db2.gz	NMNJYGBKNRFROA-WMZOPIPTSA-N	0	3	321.465	2.010	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCCC[C@H](n2ccc(N)n2)C1	ZINC000616628720	422517320	/nfs/dbraw/zinc/51/73/20/422517320.db2.gz	QLVMIHXWZWSCFJ-ZDUSSCGKSA-N	0	3	323.441	2.017	10	0		DEAEHN
CCCCc1cc(=O)[n-]c(-c2cccc(C[N@H+](C)CCO)c2)n1	ZINC000048267946	424830601	/nfs/dbraw/zinc/83/06/01/424830601.db2.gz	SHUZONJXLPQLAJ-UHFFFAOYSA-N	0	3	315.417	2.204	10	0		DEAEHN
CCCCc1cc(=O)[n-]c(-c2cccc(C[N@@H+](C)CCO)c2)n1	ZINC000048267946	424830605	/nfs/dbraw/zinc/83/06/05/424830605.db2.gz	SHUZONJXLPQLAJ-UHFFFAOYSA-N	0	3	315.417	2.204	10	0		DEAEHN
CC(C)(N)c1cn(Cc2csc(-c3ccccn3)n2)nn1	ZINC000070118896	424842079	/nfs/dbraw/zinc/84/20/79/424842079.db2.gz	VOBJBRGQHVAEPY-UHFFFAOYSA-N	0	3	300.391	2.039	10	0		DEAEHN
Cc1nccn1C[C@H](C)CNC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000194895966	424879765	/nfs/dbraw/zinc/87/97/65/424879765.db2.gz	WOOIQXBVEDEXDO-ZBFHGGJFSA-N	0	3	323.485	2.103	10	0		DEAEHN
N#Cc1cnnc(NC[C@H]2CCCCN2Cc2ccccc2)c1	ZINC000396979817	424921458	/nfs/dbraw/zinc/92/14/58/424921458.db2.gz	IOZOYHPNGYYTGX-QGZVFWFLSA-N	0	3	307.401	2.815	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC(c2ccc(N)nc2)CC1	ZINC000616620016	425097792	/nfs/dbraw/zinc/09/77/92/425097792.db2.gz	UEFRDXGIZTZVNE-UHFFFAOYSA-N	0	3	320.437	2.368	10	0		DEAEHN
NC[C@H](NC(=O)CCOc1cccc(Cl)c1)C(F)(F)F	ZINC000655509958	425587287	/nfs/dbraw/zinc/58/72/87/425587287.db2.gz	QNLBSPQWDNEMBE-JTQLQIEISA-N	0	3	310.703	2.115	10	0		DEAEHN
CN(C(=O)COc1ccc(Cl)cc1)[C@@H](CN)C(F)(F)F	ZINC000662974862	425769158	/nfs/dbraw/zinc/76/91/58/425769158.db2.gz	BLDBTUQKHDWHQW-JTQLQIEISA-N	0	3	310.703	2.067	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)[C@H]2CCOC[C@@H]2C)o1	ZINC000194690594	268554334	/nfs/dbraw/zinc/55/43/34/268554334.db2.gz	KARMMOCTBZSEOX-BBRMVZONSA-N	0	3	308.422	2.151	10	0		DEAEHN
CC(C)C[C@@H]1C(=O)NCCCN1C(=O)[C@@H](C)N1[C@H](C)CC[C@@H]1C	ZINC000334130745	269022872	/nfs/dbraw/zinc/02/28/72/269022872.db2.gz	UCLQSIAWSHUKOC-QKPAOTATSA-N	0	3	323.481	2.011	10	0		DEAEHN
CC1(C)C[C@H]1C(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000397638864	269106753	/nfs/dbraw/zinc/10/67/53/269106753.db2.gz	RCPGZBBBQRQFOA-INIZCTEOSA-N	0	3	316.445	2.176	10	0		DEAEHN
Brc1cc(N2CCNCC2)cnc1Br	ZINC000034052839	273473113	/nfs/dbraw/zinc/47/31/13/273473113.db2.gz	HXFVAAQNKJIFHH-UHFFFAOYSA-N	0	3	321.016	2.016	10	0		DEAEHN
O=C([C@H]1COc2ccc(Cl)cc2C1)N1CCN2CCC[C@H]2C1	ZINC000249825357	275009218	/nfs/dbraw/zinc/00/92/18/275009218.db2.gz	JUDCAEKZPOSTTK-HIFRSBDPSA-N	0	3	320.820	2.198	10	0		DEAEHN
O=c1[nH]c2ccccc2n1C1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000028234719	275042898	/nfs/dbraw/zinc/04/28/98/275042898.db2.gz	QJCCAWADLGRXFF-IRXDYDNUSA-N	0	3	315.417	2.270	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)Nc1nc2ccccc2[nH]1	ZINC000261648996	275888234	/nfs/dbraw/zinc/88/82/34/275888234.db2.gz	FMVMQVRKQDBFFF-OMXAPOSASA-N	0	3	314.389	2.034	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@@]2(CCc3ccccc32)C1)N(C)C	ZINC000121536887	276020819	/nfs/dbraw/zinc/02/08/19/276020819.db2.gz	BILUSEWYCGTCQD-HKUYNNGSSA-N	0	3	316.445	2.417	10	0		DEAEHN
CCN(CC)Cc1cccc(NC(=O)[C@@H]2CC(F)(F)CN2)c1	ZINC000262950879	276110483	/nfs/dbraw/zinc/11/04/83/276110483.db2.gz	JPWWXSHAQGFHFG-AWEZNQCLSA-N	0	3	311.376	2.464	10	0		DEAEHN
CCS(=O)(=O)NCCCN1CCC[C@@]2(CC=CCC2)C1	ZINC000132877920	276391460	/nfs/dbraw/zinc/39/14/60/276391460.db2.gz	MIZSPKISSSBQFB-HNNXBMFYSA-N	0	3	300.468	2.138	10	0		DEAEHN
COC1(CNC(=O)N[C@@H](Cc2ccccc2)CN(C)C)CCC1	ZINC000181501495	277467932	/nfs/dbraw/zinc/46/79/32/277467932.db2.gz	FIMOJDPLWLTMPT-INIZCTEOSA-N	0	3	319.449	2.028	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)[C@H]1CCCN1c1nccs1	ZINC000110628060	278187025	/nfs/dbraw/zinc/18/70/25/278187025.db2.gz	MNVCSJNRHRHMOA-ZIAGYGMSSA-N	0	3	322.478	2.103	10	0		DEAEHN
C[C@@H](CN[C@@H](C)c1nc2c(s1)CCCC2)N1CCOCC1	ZINC000093371630	278284297	/nfs/dbraw/zinc/28/42/97/278284297.db2.gz	FIKPEJKMVQNTEO-STQMWFEESA-N	0	3	309.479	2.393	10	0		DEAEHN
C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000471971392	279097898	/nfs/dbraw/zinc/09/78/98/279097898.db2.gz	AHDFOSLNRZJTPH-DDHJBXDOSA-N	0	3	307.360	2.451	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)[C@@H](C)N1[C@H](C)CC[C@@H]1C	ZINC000247419618	279258928	/nfs/dbraw/zinc/25/89/28/279258928.db2.gz	KDMCBYZXHDYMLM-QLFBSQMISA-N	0	3	306.454	2.417	10	0		DEAEHN
C[C@H](CNC(=O)N1CC[C@@H]2OCCC[C@@H]2C1)N1CCC[C@@H](C)C1	ZINC000246695416	279332055	/nfs/dbraw/zinc/33/20/55/279332055.db2.gz	NBDQDRDSMDRZEY-VQHPVUNQSA-N	0	3	323.481	2.317	10	0		DEAEHN
C[C@H](NC(=O)CCc1ccnn1C)[C@H](c1ccccc1)N(C)C	ZINC000185949698	279427592	/nfs/dbraw/zinc/42/75/92/279427592.db2.gz	YSIIYOAPCOWODX-KBXCAEBGSA-N	0	3	314.433	2.160	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)N1CC[C@H]2OCCC[C@H]2C1	ZINC000246630743	280250709	/nfs/dbraw/zinc/25/07/09/280250709.db2.gz	KHXFRERIJPUGPQ-GVDBMIGSSA-N	0	3	323.481	2.461	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cccc(F)c1	ZINC000173827858	288313091	/nfs/dbraw/zinc/31/30/91/288313091.db2.gz	OIAVGKOOHYHIFW-UONOGXRCSA-N	0	3	312.410	2.073	10	0		DEAEHN
Cc1c(CNC[C@H](NC(=O)OC(C)(C)C)C2CC2)cnn1C	ZINC000133635915	282020837	/nfs/dbraw/zinc/02/08/37/282020837.db2.gz	MTHPIKGJQKPRLV-AWEZNQCLSA-N	0	3	308.426	2.121	10	0		DEAEHN
C[C@@]1(CCc2ccccc2)CCN(C(=O)C2(N)CCOCC2)C1	ZINC000261668460	289161413	/nfs/dbraw/zinc/16/14/13/289161413.db2.gz	BSUXOAPNBVFEHP-GOSISDBHSA-N	0	3	316.445	2.366	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)N[C@@H]2CCCOc3ccccc32)C1	ZINC000170836039	289383172	/nfs/dbraw/zinc/38/31/72/289383172.db2.gz	MIRNVLIHXIOIRF-DZGCQCFKSA-N	0	3	303.406	2.246	10	0		DEAEHN
C[C@H](N[C@H]1CCCCC[C@@H]1O)c1ccc(S(C)(=O)=O)cc1	ZINC000135665808	290042861	/nfs/dbraw/zinc/04/28/61/290042861.db2.gz	WZFADEFKDCBMKU-RCBQFDQVSA-N	0	3	311.447	2.434	10	0		DEAEHN
C[C@H](O)C[C@H](C)CNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000248047686	290139536	/nfs/dbraw/zinc/13/95/36/290139536.db2.gz	NFXNBXDIESAEOB-NXNVCVFFSA-N	0	3	319.449	2.138	10	0		DEAEHN
CO[C@@]1(C)C[C@@H](NC(=O)N2CCCN(C3CC3)CC2)C1(C)C	ZINC000074943820	294146807	/nfs/dbraw/zinc/14/68/07/294146807.db2.gz	SXRNRVGFCFCQLT-PBHICJAKSA-N	0	3	309.454	2.070	10	0		DEAEHN
Fc1ccc2c(c1)[C@H](N[C@@H]1CCc3ncnn3C1)CCCO2	ZINC000180599510	303133901	/nfs/dbraw/zinc/13/39/01/303133901.db2.gz	AEJVPTIWHMSVNC-TZMCWYRMSA-N	0	3	302.353	2.236	10	0		DEAEHN
NC(=O)NC(=O)CNC1(c2ccc(Cl)cc2)CCCCC1	ZINC000120852736	303270830	/nfs/dbraw/zinc/27/08/30/303270830.db2.gz	NLJFQRVLCSRBIV-UHFFFAOYSA-N	0	3	309.797	2.284	10	0		DEAEHN
C[C@@H]1CCCN(c2cc(NC[C@H]3CCCN(C)C3)ncn2)C1	ZINC000302004846	533703277	/nfs/dbraw/zinc/70/32/77/533703277.db2.gz	ZNSPPTLSUMRVSV-HUUCEWRRSA-N	0	3	303.454	2.467	10	0		DEAEHN
CCOc1cccc(CNC[C@@H]2CCC3(CCOCC3)[C@H]2O)n1	ZINC000577126307	326344592	/nfs/dbraw/zinc/34/45/92/326344592.db2.gz	KRDFGDRBCJVCJS-YOEHRIQHSA-N	0	3	320.433	2.138	10	0		DEAEHN
CC[C@@]1(CO)CCCN(C[C@H](O)COc2ccc(C)cc2)C1	ZINC000187603008	333235082	/nfs/dbraw/zinc/23/50/82/333235082.db2.gz	RGQYUUZINJPGFK-FUHWJXTLSA-N	0	3	307.434	2.219	10	0		DEAEHN
COc1cc2c(cc1OC)[C@@H](CC(=O)NCCC(C)C)NCC2	ZINC000584620028	337371661	/nfs/dbraw/zinc/37/16/61/337371661.db2.gz	VZWVYKMKFVQOTR-OAHLLOKOSA-N	0	3	320.433	2.443	10	0		DEAEHN
CC(C)n1ncnc1CN[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000389839274	500636819	/nfs/dbraw/zinc/63/68/19/500636819.db2.gz	MMHDDRCEOKFLAR-NVXWUHKLSA-N	0	3	313.449	2.469	10	0		DEAEHN
CCCCc1nnc(NC(=O)N[C@H]2CCCN(CC)C2)s1	ZINC000194320779	500660934	/nfs/dbraw/zinc/66/09/34/500660934.db2.gz	WXFSMTOPZZSFNY-NSHDSACASA-N	0	3	311.455	2.487	10	0		DEAEHN
COCCCNC(=O)C1CCN(Cc2ccc(C)nc2C)CC1	ZINC000186722886	500809381	/nfs/dbraw/zinc/80/93/81/500809381.db2.gz	LQFMZIKEOFRFOZ-UHFFFAOYSA-N	0	3	319.449	2.063	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCCCCOc2ccc(F)cc2)C1	ZINC000170827204	522051762	/nfs/dbraw/zinc/05/17/62/522051762.db2.gz	PYVYRVGSDNEIPN-OAHLLOKOSA-N	0	3	323.412	2.330	10	0		DEAEHN
CCc1nc(CNC(=O)NCCN2CCCC[C@H]2C)cs1	ZINC000107721638	522332199	/nfs/dbraw/zinc/33/21/99/522332199.db2.gz	IIAKRCDSUZCRPH-GFCCVEGCSA-N	0	3	310.467	2.379	10	0		DEAEHN
COc1ccc(-c2nc(CN3CCN4CCC[C@H]4C3)no2)cc1	ZINC000247017397	523202652	/nfs/dbraw/zinc/20/26/52/523202652.db2.gz	CLFHWSNVZCDRKM-AWEZNQCLSA-N	0	3	314.389	2.025	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(C)[C@@H](C)c1ccco1	ZINC000111865120	523831031	/nfs/dbraw/zinc/83/10/31/523831031.db2.gz	PILSVHDJANFBJZ-KBPBESRZSA-N	0	3	309.410	2.093	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(C)[C@@H](C)c1ccccc1	ZINC000111866011	523831335	/nfs/dbraw/zinc/83/13/35/523831335.db2.gz	BPTQFANMFQTAGB-RDJZCZTQSA-N	0	3	319.449	2.500	10	0		DEAEHN
C[C@H]1CN(CCCNC(=O)N2CCCC23CCC3)CCCO1	ZINC000365805612	524593018	/nfs/dbraw/zinc/59/30/18/524593018.db2.gz	MEOAMCBITRLBFB-HNNXBMFYSA-N	0	3	309.454	2.215	10	0		DEAEHN
C[C@@]1(CNC(=O)Cc2cc[nH]n2)CCCN1Cc1ccccc1	ZINC000154827683	525835091	/nfs/dbraw/zinc/83/50/91/525835091.db2.gz	APBPUJRYNNHSQT-SFHVURJKSA-N	0	3	312.417	2.123	10	0		DEAEHN
C[C@H](C(=O)N1CC[C@@H](c2cnn(C)c2)C1)[C@@H](N)c1ccccc1	ZINC000246221736	525992526	/nfs/dbraw/zinc/99/25/26/525992526.db2.gz	GTZUXTXDPUVEFZ-YSVLISHTSA-N	0	3	312.417	2.072	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000411129551	527137188	/nfs/dbraw/zinc/13/71/88/527137188.db2.gz	HBIJUMFHUGLKPT-KRWDZBQOSA-N	0	3	324.852	2.188	10	0		DEAEHN
CC(C)(C)c1nnc(CN[C@@H]2CCC[C@@H]2[C@H]2COCCN2)s1	ZINC000261978223	534926555	/nfs/dbraw/zinc/92/65/55/534926555.db2.gz	RIXIQTGFXKHCCW-YNEHKIRRSA-N	0	3	324.494	2.082	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CC[C@@H](n2cc(Cl)cn2)C1	ZINC000358489502	535364838	/nfs/dbraw/zinc/36/48/38/535364838.db2.gz	YSWNEAOKAZEZBW-KGLIPLIRSA-N	0	3	310.829	2.184	10	0		DEAEHN
CC[C@@H](C(=O)NCCNc1ccncc1)c1ccc(F)cc1	ZINC000359953553	535413237	/nfs/dbraw/zinc/41/32/37/535413237.db2.gz	CRTKGTBKKIMWQK-MRXNPFEDSA-N	0	3	301.365	2.365	10	0		DEAEHN
CCC[C@H](C(=O)OCC)N1CCC(c2nnc(CC)[nH]2)CC1	ZINC000190679764	535585896	/nfs/dbraw/zinc/58/58/96/535585896.db2.gz	AMNLOYSDWNZNHJ-CYBMUJFWSA-N	0	3	308.426	2.278	10	0		DEAEHN
COc1ccc(F)c(NC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)c1	ZINC000261948272	536608060	/nfs/dbraw/zinc/60/80/60/536608060.db2.gz	VXHIYOGAIUSORR-FABXCBLPSA-N	0	3	322.380	2.305	10	0		DEAEHN
COc1cc([C@H]2[C@@H](N)CCN2C(=O)OC(C)(C)C)ccc1O	ZINC000536952606	563889813	/nfs/dbraw/zinc/88/98/13/563889813.db2.gz	DLNXXEBQTYULFU-FZMZJTMJSA-N	0	3	308.378	2.410	10	0		DEAEHN
CCN1CCN([C@H]2CCCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000685952293	568422180	/nfs/dbraw/zinc/42/21/80/568422180.db2.gz	DDRRFSIGISUUOZ-HNNXBMFYSA-N	0	3	311.470	2.414	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)Nc1ccc(C)c(C(=O)NC(C)C)c1	ZINC000237005692	636232023	/nfs/dbraw/zinc/23/20/23/636232023.db2.gz	FMHJLGOIFKDGHA-IAQYHMDHSA-N	0	3	305.422	2.445	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@@H]1CCCN(C/C=C(\C)C(=O)OC)C1	ZINC000746501450	638350534	/nfs/dbraw/zinc/35/05/34/638350534.db2.gz	LSHALLSWSXDMHK-WMHHWXMBSA-N	0	3	310.438	2.123	10	0		DEAEHN
CC(=O)N(C)C1CCN(C[C@H](O)c2ccc(F)cc2C)CC1	ZINC000746662974	638367334	/nfs/dbraw/zinc/36/73/34/638367334.db2.gz	JKDBFECBKDKUKP-KRWDZBQOSA-N	0	3	308.397	2.110	10	0		DEAEHN
CC[C@@H]1CN(C[C@H](O)c2cc(C)cc(C)c2)CCN1C[C@@H](C)O	ZINC000174782200	645191983	/nfs/dbraw/zinc/19/19/83/645191983.db2.gz	VEFCEHRBAXHPQE-QRQLOZEOSA-N	0	3	320.477	2.114	10	0		DEAEHN
Cn1ccnc1[C@]([O-])(C[NH2+][C@@H]1CC[C@@H]1C1CCC1)C(F)(F)F	ZINC000800979596	645326424	/nfs/dbraw/zinc/32/64/24/645326424.db2.gz	SQGDDYJHEFMTLB-YRGRVCCFSA-N	0	3	317.355	2.338	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NC[C@@H](O)c1cc(C)cc(C)c1	ZINC000801532687	645410147	/nfs/dbraw/zinc/41/01/47/645410147.db2.gz	CWKXPPKVKJZSTG-DLBZAZTESA-N	0	3	304.434	2.327	10	0		DEAEHN
Cn1ccc(CN[C@@H]2CCC[C@@H]2CNC(=O)OC(C)(C)C)n1	ZINC000230685107	646743496	/nfs/dbraw/zinc/74/34/96/646743496.db2.gz	PMFIAXJMVPDVQC-TZMCWYRMSA-N	0	3	308.426	2.203	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)S(=O)(=O)/C=C/c2ccccc2)CCN1C	ZINC000173277113	646764848	/nfs/dbraw/zinc/76/48/48/646764848.db2.gz	XJRFVWBOBRTAOG-SPBMYTGYSA-N	0	3	308.447	2.402	10	0		DEAEHN
CC(=O)N1CCC(NCc2nc(-c3ccncc3)cs2)CC1	ZINC000733331606	649546258	/nfs/dbraw/zinc/54/62/58/649546258.db2.gz	DVOXCPGWWWSUCQ-UHFFFAOYSA-N	0	3	316.430	2.306	10	0		DEAEHN
COC(=O)/C(C)=C/CN1CCN(Cc2ccccc2)C[C@H]1C	ZINC000382562587	685403907	/nfs/dbraw/zinc/40/39/07/685403907.db2.gz	XVJTYQSVYFSUEL-HTRKUNOGSA-N	0	3	302.418	2.312	10	0		DEAEHN
CCCn1cc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cn1	ZINC000116917643	684066161	/nfs/dbraw/zinc/06/61/61/684066161.db2.gz	DJEHPECLBWIVQS-CQSZACIVSA-N	0	3	308.426	2.392	10	0		DEAEHN
CCN(CC)CC(=O)NCc1ccc(N2CCCCC2=O)cc1	ZINC000130892865	684194241	/nfs/dbraw/zinc/19/42/41/684194241.db2.gz	ULYSHJFYPBFKNA-UHFFFAOYSA-N	0	3	317.433	2.162	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2ccnc(Br)c2)C1	ZINC000135385400	684235138	/nfs/dbraw/zinc/23/51/38/684235138.db2.gz	WZXBOGCWZBIQRT-NSHDSACASA-N	0	3	312.211	2.058	10	0		DEAEHN
C[C@@H]1COCC[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000192577957	684453231	/nfs/dbraw/zinc/45/32/31/684453231.db2.gz	BUYJAORCVWUDOS-OIISXLGYSA-N	0	3	303.402	2.477	10	0		DEAEHN
C[C@H]1CN2CCCC[C@H]2CN1c1nc(Cl)nc2nc[nH]c21	ZINC000252837548	685194567	/nfs/dbraw/zinc/19/45/67/685194567.db2.gz	YHRIHFYIDRDJIE-UWVGGRQHSA-N	0	3	306.801	2.069	10	0		DEAEHN
CN1C[C@H](CNCc2cscc2Br)CC1=O	ZINC000723563174	777125060	/nfs/dbraw/zinc/12/50/60/777125060.db2.gz	QLUHJPZSODDZDZ-QMMMGPOBSA-N	0	3	303.225	2.079	10	0		DEAEHN
CCOC[C@H]1CCN(C[C@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724113659	777243982	/nfs/dbraw/zinc/24/39/82/777243982.db2.gz	GAAOOZWSTJBOBC-UWVGGRQHSA-N	0	3	305.287	2.293	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@@H]1CN[C@@H]1CCCc2n[nH]cc21	ZINC000724915358	777519107	/nfs/dbraw/zinc/51/91/07/777519107.db2.gz	SUSCHUFEVRNYKP-DGCLKSJQSA-N	0	3	306.410	2.386	10	0		DEAEHN
OCCN(Cc1ccccc1)C[C@H]1CC2(CO1)CCOCC2	ZINC000712695315	792203572	/nfs/dbraw/zinc/20/35/72/792203572.db2.gz	OQYDKBYOJCXVIW-QGZVFWFLSA-N	0	3	305.418	2.067	10	0		DEAEHN
O=S(=O)(c1ccccc1Cl)N1CCNCCC12CCC2	ZINC000713210511	792216614	/nfs/dbraw/zinc/21/66/14/792216614.db2.gz	FCHIRVHOLSMHPF-UHFFFAOYSA-N	0	3	314.838	2.247	10	0		DEAEHN
CN1CC[C@H](NC(=O)N[C@@H]2CCCOCC2)[C@H]1c1ccccc1	ZINC000245640540	797935484	/nfs/dbraw/zinc/93/54/84/797935484.db2.gz	YTNQZWWUOFOIGF-IXDOHACOSA-N	0	3	317.433	2.300	10	0		DEAEHN
Cc1nc([C@H](C)N[C@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)n[nH]1	ZINC000401853356	801854705	/nfs/dbraw/zinc/85/47/05/801854705.db2.gz	ULJIKEDIUFCRBK-GVXVVHGQSA-N	0	3	323.441	2.409	10	0		DEAEHN
CCOc1ccc(C(=O)NCCN(C)Cc2ccccc2)cn1	ZINC000053349857	1078569166	/nfs/dbraw/zinc/56/91/66/1078569166.db2.gz	GPACSYGERWDIAL-UHFFFAOYSA-N	0	3	313.401	2.342	10	0		DEAEHN
CC[C@H]1C[C@H](NCc2cn(C)nc2Br)CCO1	ZINC000720644799	1085809834	/nfs/dbraw/zinc/80/98/34/1085809834.db2.gz	GJQCRVRUQBPIJT-MNOVXSKESA-N	0	3	302.216	2.230	10	0		DEAEHN
Cc1nc(CNC[C@H]2CCCN2C)sc1Br	ZINC000719305093	1088944266	/nfs/dbraw/zinc/94/42/66/1088944266.db2.gz	LYMJSFCECUBBBT-SECBINFHSA-N	0	3	304.257	2.398	10	0		DEAEHN
COCCCNCc1ccccc1I	ZINC000379601719	1144373430	/nfs/dbraw/zinc/37/34/30/1144373430.db2.gz	MCZGTBHBVOZGAB-UHFFFAOYSA-N	0	3	305.159	2.417	10	0		DEAEHN
CN[C@@H](CSCCC(=O)OC)c1cc(OC)ccc1OC	ZINC000081790229	192324225	/nfs/dbraw/zinc/32/42/25/192324225.db2.gz	AGWUNHJNMACSGU-ZDUSSCGKSA-N	0	3	313.419	2.261	10	0		DEAEHN
Cc1cnc(SC[C@H](N)c2ccc3c(c2)OCCO3)nc1	ZINC000081893956	192334590	/nfs/dbraw/zinc/33/45/90/192334590.db2.gz	CBXBTDDRQVXWBX-LBPRGKRZSA-N	0	3	303.387	2.348	10	0		DEAEHN
N[C@H]1CCCC[C@@H]1S(=O)(=O)c1ccc(Br)cc1	ZINC000081933820	192340572	/nfs/dbraw/zinc/34/05/72/192340572.db2.gz	DEQFBIQIBIFBGC-RYUDHWBXSA-N	0	3	318.236	2.493	10	0		DEAEHN
CN(C)[C@H]1CCCN(C(=O)c2n[nH]c3ccc(Cl)cc32)C1	ZINC000278507516	214200292	/nfs/dbraw/zinc/20/02/92/214200292.db2.gz	AGLCVLBQBBEQEI-NSHDSACASA-N	0	3	306.797	2.383	10	0		DEAEHN
N[C@H]1CCCC[C@H]1S(=O)(=O)c1ccccc1Br	ZINC000081931993	192340715	/nfs/dbraw/zinc/34/07/15/192340715.db2.gz	MBIBISLNBXKBIZ-CMPLNLGQSA-N	0	3	318.236	2.493	10	0		DEAEHN
CCOc1ccc2c(c1)[C@@H](N[C@H]1CCC(=O)N(C)C1)CCO2	ZINC000152387564	282143541	/nfs/dbraw/zinc/14/35/41/282143541.db2.gz	LUAJGWNRDNFAJY-WFASDCNBSA-N	0	3	304.390	2.119	10	0		DEAEHN
CCCN[C@H](CS(=O)(=O)CCOC)c1ccc(C)cc1C	ZINC000081943825	192344043	/nfs/dbraw/zinc/34/40/43/192344043.db2.gz	WJWFAXUFYRDZFS-MRXNPFEDSA-N	0	3	313.463	2.405	10	0		DEAEHN
CC(C)N[C@](CSc1ccc(Cl)cn1)(C(N)=O)C1CC1	ZINC000079447792	185171900	/nfs/dbraw/zinc/17/19/00/185171900.db2.gz	QEQMVPIKSIRFBQ-AWEZNQCLSA-N	0	3	313.854	2.459	10	0		DEAEHN
NC(=O)[C@](CSc1ccc(Cl)cn1)(NC1CC1)C1CC1	ZINC000079447821	185172148	/nfs/dbraw/zinc/17/21/48/185172148.db2.gz	XVUCINRFZXUOFT-CQSZACIVSA-N	0	3	311.838	2.213	10	0		DEAEHN
CCCN[C@@](CSc1ncccc1Cl)(C(N)=O)C1CC1	ZINC000079449145	185172230	/nfs/dbraw/zinc/17/22/30/185172230.db2.gz	MJDJDVJZGQIDQO-CQSZACIVSA-N	0	3	313.854	2.461	10	0		DEAEHN
CCCN[C@@H]1c2ccccc2CC[C@H]1S(=O)(=O)CCOC	ZINC000081944547	192346123	/nfs/dbraw/zinc/34/61/23/192346123.db2.gz	URKPGMHITAUUHX-HZPDHXFCSA-N	0	3	311.447	2.103	10	0		DEAEHN
CN1C[C@H](NCc2cc(Br)cs2)CCC1=O	ZINC000082756548	185202445	/nfs/dbraw/zinc/20/24/45/185202445.db2.gz	NXSJPTOGOAXSAY-SECBINFHSA-N	0	3	303.225	2.221	10	0		DEAEHN
C[C@H]1CN(c2ccccc2I)CCN1	ZINC000083061371	185212416	/nfs/dbraw/zinc/21/24/16/185212416.db2.gz	QSEZHZDIPUPSPM-VIFPVBQESA-N	0	3	302.159	2.089	10	0		DEAEHN
C[C@H]1CN(c2cccc(I)c2)CCN1	ZINC000083061327	185212464	/nfs/dbraw/zinc/21/24/64/185212464.db2.gz	VDURCNIVPAKKHK-VIFPVBQESA-N	0	3	302.159	2.089	10	0		DEAEHN
C[C@@](N)(C(=O)NCc1sccc1Br)C1CC1	ZINC000087575721	185228658	/nfs/dbraw/zinc/22/86/58/185228658.db2.gz	DYFUEJKBEUQPQJ-NSHDSACASA-N	0	3	303.225	2.254	10	0		DEAEHN
NC[C@@H](NC[C@H]1CCCO1)c1ccc(Br)cc1F	ZINC000087928580	185237649	/nfs/dbraw/zinc/23/76/49/185237649.db2.gz	FCIKQTIYEWDMAR-ZWNOBZJWSA-N	0	3	317.202	2.357	10	0		DEAEHN
COc1cc(C)c(Br)cc1[C@H](N)[C@H]1COCCO1	ZINC000088078062	185238848	/nfs/dbraw/zinc/23/88/48/185238848.db2.gz	XYGGRDMZEWWWLS-OLZOCXBDSA-N	0	3	316.195	2.181	10	0		DEAEHN
CC[C@H](N)CS(=O)(=O)Cc1cc(Br)cs1	ZINC000088074845	185238905	/nfs/dbraw/zinc/23/89/05/185238905.db2.gz	PZUFLBBNXHFULP-QMMMGPOBSA-N	0	3	312.254	2.163	10	0		DEAEHN
O=C1[C@@H](NC2CC2)CCN1c1ccc(Br)c(F)c1	ZINC000088085369	185239296	/nfs/dbraw/zinc/23/92/96/185239296.db2.gz	VIGKQXSTRSBOFE-LBPRGKRZSA-N	0	3	313.170	2.446	10	0		DEAEHN
COC(=O)[C@](C)(N)CCCCN1CCC[C@H](C(F)(F)F)C1	ZINC000088435181	185250209	/nfs/dbraw/zinc/25/02/09/185250209.db2.gz	VNKCMPSHTDTLIG-WCQYABFASA-N	0	3	310.360	2.321	10	0		DEAEHN
N[C@](CO)(CN1CCC(C(F)(F)F)CC1)c1ccccc1	ZINC000088439723	185250782	/nfs/dbraw/zinc/25/07/82/185250782.db2.gz	LLABCQHRDNGTRU-AWEZNQCLSA-N	0	3	302.340	2.107	10	0		DEAEHN
CN[C@H]1CCC[C@H]1S(=O)(=O)c1cccc(Br)c1	ZINC000081982653	192349486	/nfs/dbraw/zinc/34/94/86/192349486.db2.gz	LDKJXTCJKQPJJX-NWDGAFQWSA-N	0	3	318.236	2.363	10	0		DEAEHN
COc1nc(N(C)C)sc1CNC[C@](C)(O)CC(C)C	ZINC000090270523	185288570	/nfs/dbraw/zinc/28/85/70/185288570.db2.gz	KRQVAIDPMUBEBZ-CQSZACIVSA-N	0	3	301.456	2.104	10	0		DEAEHN
N[C@H]1COC[C@@H]1C(=O)Nc1ccc(C(F)(F)F)cc1Cl	ZINC000090380499	185293539	/nfs/dbraw/zinc/29/35/39/185293539.db2.gz	CMVABRZEWQCGQO-CBAPKCEASA-N	0	3	308.687	2.271	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)Nc1ccc(SC(F)F)cc1	ZINC000090432826	185295782	/nfs/dbraw/zinc/29/57/82/185295782.db2.gz	BSUFMSHNAATDRM-WDEREUQCSA-N	0	3	302.346	2.174	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1cc(Cl)cc2cccnc21	ZINC000090432812	185296016	/nfs/dbraw/zinc/29/60/16/185296016.db2.gz	ZWHYTUHNMOOISZ-DGCLKSJQSA-N	0	3	305.765	2.061	10	0		DEAEHN
C[C@]1(C(=O)Nc2ccc(-c3nccs3)cc2)COC[C@H]1N	ZINC000090589676	185305511	/nfs/dbraw/zinc/30/55/11/185305511.db2.gz	LMBFDXQGFXLJSV-DOMZBBRYSA-N	0	3	303.387	2.112	10	0		DEAEHN
CN(Cc1cc(Cl)cc(Cl)c1)C(=O)[C@@]1(C)COC[C@@H]1N	ZINC000090593632	185305806	/nfs/dbraw/zinc/30/58/06/185305806.db2.gz	MRBRZIVGYPMDGB-JSGCOSHPSA-N	0	3	317.216	2.316	10	0		DEAEHN
C[C@@]1(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)COC[C@@H]1N	ZINC000090597732	185305928	/nfs/dbraw/zinc/30/59/28/185305928.db2.gz	GXZXBSXPKCZWQU-CMPLNLGQSA-N	0	3	306.259	2.147	10	0		DEAEHN
COc1ccccc1C(=O)N1CCCSC[C@H]1CN(C)C	ZINC000090699816	185310324	/nfs/dbraw/zinc/31/03/24/185310324.db2.gz	YZWMKGMVFBCHKP-CYBMUJFWSA-N	0	3	308.447	2.205	10	0		DEAEHN
CN[C@@H]1c2cc(OC)ccc2CC[C@@H]1Sc1nncn1C	ZINC000092389746	185315664	/nfs/dbraw/zinc/31/56/64/185315664.db2.gz	ODKFEHRHCSHKLK-UONOGXRCSA-N	0	3	304.419	2.191	10	0		DEAEHN
CCCC(CCC)(C(N)=S)C(=O)N(C)C[C@H]1CCCN1C	ZINC000092631786	185330600	/nfs/dbraw/zinc/33/06/00/185330600.db2.gz	XMXVMNHEYXJWLU-CYBMUJFWSA-N	0	3	313.511	2.412	10	0		DEAEHN
C[C@H](CCN1CCN(C)CC1)NC(=O)C(C)(C)c1cccs1	ZINC000184316227	282251936	/nfs/dbraw/zinc/25/19/36/282251936.db2.gz	FVPNGBJXTPBGDJ-CQSZACIVSA-N	0	3	323.506	2.168	10	0		DEAEHN
CC1(C)C(CNS(=O)(=O)c2cc(CN)cs2)C1(C)C	ZINC000092833171	185345049	/nfs/dbraw/zinc/34/50/49/185345049.db2.gz	PHEOWFMLOWVOIY-UHFFFAOYSA-N	0	3	302.465	2.167	10	0		DEAEHN
Cc1cc(C)n([C@@H](C)C(=O)NC[C@@H](C)N2CCC(C)CC2)n1	ZINC000195067418	282368218	/nfs/dbraw/zinc/36/82/18/282368218.db2.gz	GCJFJPZVFUQASY-CVEARBPZSA-N	0	3	306.454	2.298	10	0		DEAEHN
CC(=O)c1ccccc1C(=O)N1CCC2(C1)CCN(C)CC2	ZINC000614963983	362500744	/nfs/dbraw/zinc/50/07/44/362500744.db2.gz	LOQYAUVUGTUWLQ-UHFFFAOYSA-N	0	3	300.402	2.447	10	0		DEAEHN
CN(Cc1ccc(Cl)cc1Cl)C(=O)COC1(C)CNC1	ZINC000098060421	539435915	/nfs/dbraw/zinc/43/59/15/539435915.db2.gz	ZNEYEFQJWZLTFA-UHFFFAOYSA-N	0	3	317.216	2.330	10	0		DEAEHN
CCc1cnc(CCNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)s1	ZINC000245418330	282386255	/nfs/dbraw/zinc/38/62/55/282386255.db2.gz	AGQBTZVDMPOESY-STQMWFEESA-N	0	3	324.494	2.372	10	0		DEAEHN
C[C@@H](NCCOCC(F)(F)F)c1ccc(NC(N)=O)cc1	ZINC000111637253	185619843	/nfs/dbraw/zinc/61/98/43/185619843.db2.gz	VGDXDPACUATLCU-SECBINFHSA-N	0	3	305.300	2.407	10	0		DEAEHN
CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@H]2CCOc3ccccc32)C1	ZINC000250949577	282587071	/nfs/dbraw/zinc/58/70/71/282587071.db2.gz	OAQWJVWYPBIUCP-NFAWXSAZSA-N	0	3	309.431	2.456	10	0		DEAEHN
Cc1ccccc1[C@H](C)NCC(=O)N(C)Cc1cnn(C)c1	ZINC000181538668	539651604	/nfs/dbraw/zinc/65/16/04/539651604.db2.gz	DSVRISPGCZMTTD-AWEZNQCLSA-N	0	3	300.406	2.038	10	0		DEAEHN
CC1(C)Cc2cccc(CNC3CCS(=O)(=O)CC3)c2O1	ZINC000080507769	192163807	/nfs/dbraw/zinc/16/38/07/192163807.db2.gz	PVBVINWINGYSBN-UHFFFAOYSA-N	0	3	309.431	2.067	10	0		DEAEHN
C[C@@H](NCC(=O)N(C)c1nc2ccccc2s1)[C@@H]1CCCO1	ZINC000183098477	539659457	/nfs/dbraw/zinc/65/94/57/539659457.db2.gz	BEMZAKXPUTXDQM-YPMHNXCESA-N	0	3	319.430	2.416	10	0		DEAEHN
CC(C)N(CC1CC1)S(=O)(=O)c1ccc(F)c(CN)c1	ZINC000071243793	190948274	/nfs/dbraw/zinc/94/82/74/190948274.db2.gz	HEUWVCCTZBCGJX-UHFFFAOYSA-N	0	3	300.399	2.094	10	0		DEAEHN
CCOc1ccccc1[C@H](C[S@](=O)C1CCOCC1)NC	ZINC000084055017	192397710	/nfs/dbraw/zinc/39/77/10/192397710.db2.gz	KDCGNEXOMKOBJV-YCRPNKLZSA-N	0	3	311.447	2.274	10	0		DEAEHN
COc1ccc(F)c2c1CN(CCCCn1ccnc1)[C@H]2CN	ZINC000071683523	191006471	/nfs/dbraw/zinc/00/64/71/191006471.db2.gz	FVWGOHCTCBHZAK-HNNXBMFYSA-N	0	3	318.396	2.327	10	0		DEAEHN
COc1cc2c(c(F)c1)CN(CCc1nccs1)[C@@H]2CN	ZINC000071683457	191006553	/nfs/dbraw/zinc/00/65/53/191006553.db2.gz	USHIPOCGMJPFEE-CQSZACIVSA-N	0	3	307.394	2.349	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](CN)N(CCc1c(C)nn(C)c1C)C2	ZINC000071683130	191006979	/nfs/dbraw/zinc/00/69/79/191006979.db2.gz	GOTPHJGFRXPXPC-GOSISDBHSA-N	0	3	314.433	2.104	10	0		DEAEHN
C[C@@H]1CCC[C@](N)(c2nc3c(cccc3S(C)(=O)=O)[nH]2)C1	ZINC000138156669	186014519	/nfs/dbraw/zinc/01/45/19/186014519.db2.gz	QMZYXUVYRIGUIP-MEBBXXQBSA-N	0	3	307.419	2.331	10	0		DEAEHN
CCCN(CCC)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138279694	186015698	/nfs/dbraw/zinc/01/56/98/186015698.db2.gz	UZUXDUWIAVICOH-UHFFFAOYSA-N	0	3	320.405	2.495	10	0		DEAEHN
C[C@@H]1CCC[C@@H](C)N1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138363414	186016421	/nfs/dbraw/zinc/01/64/21/186016421.db2.gz	BIYHFQPEQKKNTL-NXEZZACHSA-N	0	3	318.389	2.375	10	0		DEAEHN
CC[C@@H]1CCCCN1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138444722	186017129	/nfs/dbraw/zinc/01/71/29/186017129.db2.gz	BZVOBAGUYFGEDX-LLVKDONJSA-N	0	3	318.389	2.377	10	0		DEAEHN
CC[C@H]1CCCN1S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138574158	186017540	/nfs/dbraw/zinc/01/75/40/186017540.db2.gz	ZDDONFQGROKWEF-NSHDSACASA-N	0	3	318.389	2.247	10	0		DEAEHN
C[C@H]1CCCN(S(=O)(=O)c2cc(CN)cc(F)c2F)CC1	ZINC000139068417	186019420	/nfs/dbraw/zinc/01/94/20/186019420.db2.gz	FSGIPWRJYYCHAY-JTQLQIEISA-N	0	3	318.389	2.234	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2ccc(C)s2)N(C[C@@H]2CCN(C)C2)C1=O	ZINC000142184515	186031869	/nfs/dbraw/zinc/03/18/69/186031869.db2.gz	QJJWEWDIERFKOP-VNHYZAJKSA-N	0	3	307.463	2.217	10	0		DEAEHN
CCC[C@@H]1N[C@H](c2ccsc2)N([C@@H]2CCCN(C)C2)C1=O	ZINC000142806814	186032334	/nfs/dbraw/zinc/03/23/34/186032334.db2.gz	NWTWZIUSVNMNDR-ILXRZTDVSA-N	0	3	307.463	2.441	10	0		DEAEHN
CC[C@]1(C)N[C@@H](c2ccsc2)N(C2CCN(C)CC2)C1=O	ZINC000141183476	186029067	/nfs/dbraw/zinc/02/90/67/186029067.db2.gz	LOMNBZVVILAQPF-ZBFHGGJFSA-N	0	3	307.463	2.441	10	0		DEAEHN
CN[C@@H](Cc1c(Br)c(C)nn1C)c1cncs1	ZINC000147637045	186040653	/nfs/dbraw/zinc/04/06/53/186040653.db2.gz	PFXFETRASOMMJD-QMMMGPOBSA-N	0	3	315.240	2.451	10	0		DEAEHN
CN(C)c1ccc(Br)cc1NC(=O)C1(N)CCC1	ZINC000147742034	186041565	/nfs/dbraw/zinc/04/15/65/186041565.db2.gz	PYWKNBJZMOYSTL-UHFFFAOYSA-N	0	3	312.211	2.335	10	0		DEAEHN
CCC[C@@H]1N[C@@H](c2ccsc2)N([C@@H]2CCCN(C)C2)C1=O	ZINC000142806391	186032940	/nfs/dbraw/zinc/03/29/40/186032940.db2.gz	NWTWZIUSVNMNDR-QLFBSQMISA-N	0	3	307.463	2.441	10	0		DEAEHN
C[C@H](CN1C(=O)C2(CCCC2)N[C@H]1c1ccsc1)N(C)C	ZINC000144941307	186035934	/nfs/dbraw/zinc/03/59/34/186035934.db2.gz	FRLYSJCAYDKHBR-TZMCWYRMSA-N	0	3	307.463	2.441	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@H](C(C)C)C(=O)N2C[C@@H](C)N(C)C)s1	ZINC000144951660	186036293	/nfs/dbraw/zinc/03/62/93/186036293.db2.gz	RBGCJPOENBOMOO-KCPJHIHWSA-N	0	3	309.479	2.462	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NC2CCN(c3cccs3)CC2)C1	ZINC000155719481	186106268	/nfs/dbraw/zinc/10/62/68/186106268.db2.gz	QDQHBFXKTBCPJP-CQSZACIVSA-N	0	3	322.478	2.062	10	0		DEAEHN
C[C@H](NC(C)(C)CNC(=O)[C@@H]1CSC(=O)N1)c1ccccc1	ZINC000155776096	186112041	/nfs/dbraw/zinc/11/20/41/186112041.db2.gz	FESGACUJDONZFV-AAEUAGOBSA-N	0	3	321.446	2.057	10	0		DEAEHN
Cc1ccc([C@H](CN)N2CCCOCC2)c(Br)c1	ZINC000164074592	186148147	/nfs/dbraw/zinc/14/81/47/186148147.db2.gz	DFHYDYZWLTUYRV-AWEZNQCLSA-N	0	3	313.239	2.480	10	0		DEAEHN
CCCNc1nc(N(C)C)nc(N2C[C@@H](C)S[C@@H](C)C2)n1	ZINC000155889605	186120941	/nfs/dbraw/zinc/12/09/41/186120941.db2.gz	BRIANOLUFKVTSO-PHIMTYICSA-N	0	3	310.471	2.090	10	0		DEAEHN
CC(C(=O)N(Cc1cccs1)C[C@@H]1CCCO1)=C1CNC1	ZINC000164168708	186151137	/nfs/dbraw/zinc/15/11/37/186151137.db2.gz	MCVVYKXMFNJFFN-AWEZNQCLSA-N	0	3	306.431	2.175	10	0		DEAEHN
COC(=O)CCCN[C@H](CO)c1cccc(Br)c1	ZINC000183895236	186228509	/nfs/dbraw/zinc/22/85/09/186228509.db2.gz	KXSMVAJKUIBSHO-GFCCVEGCSA-N	0	3	316.195	2.025	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)NC[C@@H]2CCN2C(C)(C)C)cc1	ZINC000617008722	362995388	/nfs/dbraw/zinc/99/53/88/362995388.db2.gz	KUNNQXGPMDICSL-INIZCTEOSA-N	0	3	317.433	2.272	10	0		DEAEHN
CC(C)(C)c1nnc(NC(=O)N2CCN3CCC[C@@H]3C2)s1	ZINC000171891157	198002198	/nfs/dbraw/zinc/00/21/98/198002198.db2.gz	QQFZZEVHZLIVGJ-SNVBAGLBSA-N	0	3	309.439	2.148	10	0		DEAEHN
O=C(NCc1cccc2cccnc21)N1CCN2CCC[C@H]2C1	ZINC000171905214	198005262	/nfs/dbraw/zinc/00/52/62/198005262.db2.gz	NIAHQOORSDUFKT-INIZCTEOSA-N	0	3	310.401	2.224	10	0		DEAEHN
COc1ccc(F)cc1[C@@H](C)NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171901775	198005285	/nfs/dbraw/zinc/00/52/85/198005285.db2.gz	KTQGKJOAIFYJED-TZMCWYRMSA-N	0	3	321.396	2.385	10	0		DEAEHN
O=C(NCC1(c2ccc(F)cc2)CC1)N1CCN2CCC[C@H]2C1	ZINC000171902051	198005353	/nfs/dbraw/zinc/00/53/53/198005353.db2.gz	RNLKJXUEJIMENU-INIZCTEOSA-N	0	3	317.408	2.347	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)C[C@H]2CCCc3ccccc32)CCO1	ZINC000172306682	198076973	/nfs/dbraw/zinc/07/69/73/198076973.db2.gz	NKXWYICRLONDDZ-IAGOWNOFSA-N	0	3	316.445	2.286	10	0		DEAEHN
O=C([C@@H]1C[C@H]1c1cccc(F)c1F)N1CCN2CCC[C@@H]2C1	ZINC000172907585	198166231	/nfs/dbraw/zinc/16/62/31/198166231.db2.gz	HRSBPRRBUWCVPO-KWCYVHTRSA-N	0	3	306.356	2.375	10	0		DEAEHN
Cc1nc([C@@H](C)NC(=O)N[C@@H](C)C2=CCN(C)CC2)cs1	ZINC000332843472	539941388	/nfs/dbraw/zinc/94/13/88/539941388.db2.gz	WOBKCOLKMJCNJO-WDEREUQCSA-N	0	3	308.451	2.462	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)S(=O)(=O)Cc2ccc(F)cc2)CCN1C	ZINC000173269720	198204457	/nfs/dbraw/zinc/20/44/57/198204457.db2.gz	ARYZUZAKNGLRSD-DOMZBBRYSA-N	0	3	314.426	2.070	10	0		DEAEHN
C[C@@]12CN(C(=O)Nc3ncccc3CN)C[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000333272730	539954212	/nfs/dbraw/zinc/95/42/12/539954212.db2.gz	GHWLKNBBEOFIOK-WFTWPBCJSA-N	0	3	300.406	2.440	10	0		DEAEHN
Cc1csc([C@H](NC(=O)N2CCN3CCC[C@@H]3C2)C2CC2)n1	ZINC000173506443	198221625	/nfs/dbraw/zinc/22/16/25/198221625.db2.gz	WYPNCUUZALVOQQ-ZIAGYGMSSA-N	0	3	320.462	2.392	10	0		DEAEHN
[NH3+]CC1([N-]S(=O)(=O)c2ccccc2F)CCCCCC1	ZINC000034940839	354161871	/nfs/dbraw/zinc/16/18/71/354161871.db2.gz	VZNVWZBDICFPHZ-UHFFFAOYSA-N	0	3	300.399	2.156	10	0		DEAEHN
CC1CCC(C[NH3+])([N-]S(=O)(=O)c2ccccc2F)CC1	ZINC000034955490	354161967	/nfs/dbraw/zinc/16/19/67/354161967.db2.gz	VEZUOOWGNGYMBC-UHFFFAOYSA-N	0	3	300.399	2.012	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc(OCCOC)cc1	ZINC000177043787	198655770	/nfs/dbraw/zinc/65/57/70/198655770.db2.gz	MSEZXRPRCRNDNH-INIZCTEOSA-N	0	3	320.433	2.268	10	0		DEAEHN
CCCNC(=O)c1ccc(N2CCCN(CCC)CC2)nc1	ZINC000078251243	355248995	/nfs/dbraw/zinc/24/89/95/355248995.db2.gz	YOWOGTNRQASZTI-UHFFFAOYSA-N	0	3	304.438	2.144	10	0		DEAEHN
Nc1nc(Cl)cc(Nc2cnn(CCN3CCCCC3)c2)n1	ZINC000092978343	355659599	/nfs/dbraw/zinc/65/95/99/355659599.db2.gz	RZCPDYSVSAHYKM-UHFFFAOYSA-N	0	3	321.816	2.138	10	0		DEAEHN
CCOC(=O)c1nn(-c2ccc(F)cc2)cc1CCN(C)C	ZINC000113242594	355758397	/nfs/dbraw/zinc/75/83/97/355758397.db2.gz	IKIXFUOWRHWYJV-UHFFFAOYSA-N	0	3	305.353	2.292	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)c1ccccc1SC	ZINC000170809280	355994484	/nfs/dbraw/zinc/99/44/84/355994484.db2.gz	IYAQZXALXUPPKE-CYBMUJFWSA-N	0	3	308.447	2.249	10	0		DEAEHN
CCC[C@H](C)CN1CCN(CC(=O)N2CCCCCC2)CC1	ZINC000179621645	356030071	/nfs/dbraw/zinc/03/00/71/356030071.db2.gz	DCUPTPCBBPZXDX-KRWDZBQOSA-N	0	3	309.498	2.443	10	0		DEAEHN
COc1ccc([C@@H](C)NC[C@H](C)CS(C)(=O)=O)cc1F	ZINC000182021134	356105088	/nfs/dbraw/zinc/10/50/88/356105088.db2.gz	NDUWKMRCGVBGIP-WDEREUQCSA-N	0	3	303.399	2.166	10	0		DEAEHN
CNC(=O)[C@@H]1C[C@H](c2ccccc2OC(F)(F)F)CCN1	ZINC000080129553	192003990	/nfs/dbraw/zinc/00/39/90/192003990.db2.gz	XEHQKPNLUQMTAJ-KOLCDFICSA-N	0	3	302.296	2.167	10	0		DEAEHN
CC(C)c1nnc(CN2CCN(CCC(C)(C)C)CC2)n1C	ZINC000195101894	356249876	/nfs/dbraw/zinc/24/98/76/356249876.db2.gz	LBGOPJLSOLKGTR-UHFFFAOYSA-N	0	3	307.486	2.492	10	0		DEAEHN
CCOC(=O)C[C@@H](N)c1cc(OC)ccc1Br	ZINC000228763402	356281078	/nfs/dbraw/zinc/28/10/78/356281078.db2.gz	BNSNSRKHJRJHRT-LLVKDONJSA-N	0	3	302.168	2.411	10	0		DEAEHN
CCOC(=O)C(C(=O)OCC)[C@@H](c1ccc(C)cc1)N(C)C	ZINC000199147035	356265987	/nfs/dbraw/zinc/26/59/87/356265987.db2.gz	VYKKMRGMOLNTJO-OAHLLOKOSA-N	0	3	307.390	2.340	10	0		DEAEHN
CN1CC[C@H](NC(=O)[C@H]2CCn3ccnc3C2)[C@H]1c1ccccc1	ZINC000247914438	356320937	/nfs/dbraw/zinc/32/09/37/356320937.db2.gz	AUVAELWREBMFRB-XYJFISCASA-N	0	3	324.428	2.007	10	0		DEAEHN
COC[C@@H]1CCN(c2nc3sccn3c2CNC2CC2)C1	ZINC000081072607	192222324	/nfs/dbraw/zinc/22/23/24/192222324.db2.gz	CICQGHNJNDQPHX-LLVKDONJSA-N	0	3	306.435	2.121	10	0		DEAEHN
NCc1c(I)nccc1C(F)(F)F	ZINC000307023377	356407015	/nfs/dbraw/zinc/40/70/15/356407015.db2.gz	FPZQVODPMJNVOH-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
Cc1cc(C)c(C(=O)N2CCO[C@H](CN(C)CC3CC3)C2)o1	ZINC000328640366	356465494	/nfs/dbraw/zinc/46/54/94/356465494.db2.gz	QBHNMQHTPJIXCC-OAHLLOKOSA-N	0	3	306.406	2.079	10	0		DEAEHN
Brc1nnc(N[C@@H]2CCN3CCCC[C@@H]23)s1	ZINC000081664128	192307216	/nfs/dbraw/zinc/30/72/16/192307216.db2.gz	AYHLBZUWJYDJPG-SFYZADRCSA-N	0	3	303.229	2.339	10	0		DEAEHN
CC[C@H]1[C@@H](CO)CCN1CC(=O)N(CC)Cc1ccccc1	ZINC000385934453	356693566	/nfs/dbraw/zinc/69/35/66/356693566.db2.gz	VHEAZUQQOWAGQD-SJORKVTESA-N	0	3	304.434	2.128	10	0		DEAEHN
O=C(NCc1ccc(F)cc1)c1ccc(OC2CNC2)cc1	ZINC000584592208	357290011	/nfs/dbraw/zinc/29/00/11/357290011.db2.gz	MZNBNIFTOCBKFI-UHFFFAOYSA-N	0	3	300.333	2.106	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCC2(O)CCCC2)[C@@H]1c1ccccc1	ZINC000179462109	199040101	/nfs/dbraw/zinc/04/01/01/199040101.db2.gz	TUYHXSNEQHKTGF-CVEARBPZSA-N	0	3	317.433	2.036	10	0		DEAEHN
COc1ccc([C@@H](C)CN2CCN(c3cccnn3)CC2)cc1	ZINC000179972446	199101384	/nfs/dbraw/zinc/10/13/84/199101384.db2.gz	PEAAKUBUVKIDAF-HNNXBMFYSA-N	0	3	312.417	2.411	10	0		DEAEHN
CC[C@H](C)Oc1cc(CNC(=O)NC[C@@H]2CCCN2C)ccn1	ZINC000180784422	199209179	/nfs/dbraw/zinc/20/91/79/199209179.db2.gz	YXCBQTAUNNUEJY-ZFWWWQNUSA-N	0	3	320.437	2.152	10	0		DEAEHN
C[C@@H]([NH2+]CCCOC([O-])=NC(N)=O)c1ccc(F)c(Cl)c1	ZINC000180741313	199203871	/nfs/dbraw/zinc/20/38/71/199203871.db2.gz	ZPSPNFOPTNKZEB-MRVPVSSYSA-N	0	3	317.748	2.325	10	0		DEAEHN
C[C@@H]([NH2+]CCCOC(=O)N=C(N)[O-])c1ccc(F)c(Cl)c1	ZINC000180741313	199203873	/nfs/dbraw/zinc/20/38/73/199203873.db2.gz	ZPSPNFOPTNKZEB-MRVPVSSYSA-N	0	3	317.748	2.325	10	0		DEAEHN
CC[C@@H](C)Oc1cc(CNC(=O)NC[C@@H]2CCCN2C)ccn1	ZINC000180784407	199208928	/nfs/dbraw/zinc/20/89/28/199208928.db2.gz	YXCBQTAUNNUEJY-HIFRSBDPSA-N	0	3	320.437	2.152	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@H](Cc2ccccc2)C1)N(C)C	ZINC000181181715	199261825	/nfs/dbraw/zinc/26/18/25/199261825.db2.gz	UJAUVSMJVBNHCZ-IAGOWNOFSA-N	0	3	304.434	2.187	10	0		DEAEHN
C[C@H]1OCCC[C@@H]1C(=O)Nc1ccc(OCCN(C)C)cc1	ZINC000188956788	291197642	/nfs/dbraw/zinc/19/76/42/291197642.db2.gz	AFFQPCJQJBQKIE-CJNGLKHVSA-N	0	3	306.406	2.381	10	0		DEAEHN
COC(=O)C1(CNCc2ccc(-c3cc[nH]n3)o2)CCCC1	ZINC000619073374	363694081	/nfs/dbraw/zinc/69/40/81/363694081.db2.gz	BHTCVZKKDBUCAW-UHFFFAOYSA-N	0	3	303.362	2.493	10	0		DEAEHN
Cc1cccc(NC[C@@H]2CCN(C[C@H](O)CC(F)(F)F)C2)n1	ZINC000189367271	200388980	/nfs/dbraw/zinc/38/89/80/200388980.db2.gz	MKTBBXLYOJNYQH-QWHCGFSZSA-N	0	3	317.355	2.437	10	0		DEAEHN
COC(=O)c1ccccc1OCCN1CC[C@@H](C)[C@@H](OC)C1	ZINC000189372458	200389379	/nfs/dbraw/zinc/38/93/79/200389379.db2.gz	AHFPASWXBHKKFL-CJNGLKHVSA-N	0	3	307.390	2.209	10	0		DEAEHN
CCN1CC[C@H](CNC(=O)C[C@@H](C)C(=O)c2ccccc2)C1	ZINC000602103555	360266421	/nfs/dbraw/zinc/26/64/21/360266421.db2.gz	FYVBTJGNTCLADZ-HUUCEWRRSA-N	0	3	302.418	2.354	10	0		DEAEHN
CSCC[C@H](C)N(C)C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000602455399	360381453	/nfs/dbraw/zinc/38/14/53/360381453.db2.gz	RXZYOLMGTTUNNB-HOCLYGCPSA-N	0	3	323.506	2.046	10	0		DEAEHN
CN(C)[C@H]1CN(c2nc3cc(Cl)cc(Cl)c3o2)C[C@@H]1O	ZINC000292426262	223070788	/nfs/dbraw/zinc/07/07/88/223070788.db2.gz	UMKKOUDNJBQMCG-QWRGUYRKSA-N	0	3	316.188	2.246	10	0		DEAEHN
COC(=O)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1OC(=O)c1ccc(F)cc1)N2C	ZINC000005996010	181304214	/nfs/dbraw/zinc/30/42/14/181304214.db2.gz	JRPRINGETIYVSV-LJISPDSOSA-N	0	3	321.348	2.007	10	0	in-vitro	DEAEHN
CCCNc1ccc(CNC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000192440833	200876408	/nfs/dbraw/zinc/87/64/08/200876408.db2.gz	GFYKBUIOKVJZFM-INIZCTEOSA-N	0	3	304.438	2.402	10	0		DEAEHN
CCSCC[C@H](C)NC(=O)Nc1cnn(CCN(C)C)c1	ZINC000610478317	361405489	/nfs/dbraw/zinc/40/54/89/361405489.db2.gz	TZXPUBIETYDXAC-LBPRGKRZSA-N	0	3	313.471	2.098	10	0		DEAEHN
COC[C@@H](N[C@@H]1CCc2ncnn2C1)c1ccc(Cl)cc1	ZINC000194094669	201176683	/nfs/dbraw/zinc/17/66/83/201176683.db2.gz	VEBWEWBDZWCNLD-ZIAGYGMSSA-N	0	3	306.797	2.224	10	0		DEAEHN
O=C(NCc1ccc2ncccc2c1)N1CCN2CCC[C@H]2C1	ZINC000194608367	201262089	/nfs/dbraw/zinc/26/20/89/201262089.db2.gz	YOOMDPWVJIXCQP-INIZCTEOSA-N	0	3	310.401	2.224	10	0		DEAEHN
c1cc(CN[C@H]2CCc3c[nH]nc3C2)n(CCc2ccccc2)n1	ZINC000621340682	364360152	/nfs/dbraw/zinc/36/01/52/364360152.db2.gz	NKULFHCXGLPQEF-KRWDZBQOSA-N	0	3	321.428	2.496	10	0		DEAEHN
Cn1cncc1[C@@H]1C[C@@H](NCc2cccc3c2OCO3)CCO1	ZINC000275399907	212310704	/nfs/dbraw/zinc/31/07/04/212310704.db2.gz	CLEHTMPPIBJAKN-BBRMVZONSA-N	0	3	315.373	2.159	10	0		DEAEHN
COc1ccc(-n2cc(CN3CC[C@H](CO)[C@@H]3C)cn2)cc1	ZINC000449290820	240311787	/nfs/dbraw/zinc/31/17/87/240311787.db2.gz	YYGOMCILQWNXEO-DZGCQCFKSA-N	0	3	301.390	2.084	10	0		DEAEHN
COc1ccc(Cl)c(NC(=O)C[C@@H]2CSCCN2)c1	ZINC000091290574	193031295	/nfs/dbraw/zinc/03/12/95/193031295.db2.gz	HNAHZCVNGMXWAJ-SECBINFHSA-N	0	3	300.811	2.382	10	0		DEAEHN
CN(CC1CC(O)C1)[C@H](CN)c1ccc(Br)s1	ZINC000091451485	193058628	/nfs/dbraw/zinc/05/86/28/193058628.db2.gz	QHVNYXLZBUIKCH-UDNWOFFPSA-N	0	3	319.268	2.213	10	0		DEAEHN
CC(C)(C)NCc1cncc(-n2cc(Br)cn2)n1	ZINC000091422428	193053838	/nfs/dbraw/zinc/05/38/38/193053838.db2.gz	KPRSUEHWHDCZCA-UHFFFAOYSA-N	0	3	310.199	2.313	10	0		DEAEHN
COc1c(C)cc(CN(C)[C@@H](C)CN2CCOCC2)cc1C	ZINC000091510286	193066617	/nfs/dbraw/zinc/06/66/17/193066617.db2.gz	JRUKLKKUPNXCHQ-INIZCTEOSA-N	0	3	306.450	2.465	10	0		DEAEHN
C[C@@H](NC[C@@H]1CN(C)CCO1)c1ccc(Br)s1	ZINC000091667432	193088077	/nfs/dbraw/zinc/08/80/77/193088077.db2.gz	FZBXFOIFCQQZPV-NXEZZACHSA-N	0	3	319.268	2.492	10	0		DEAEHN
C[C@@H](NC[C@@H]1CN(C)CCO1)c1ccccc1OC(F)F	ZINC000091667761	193088516	/nfs/dbraw/zinc/08/85/16/193088516.db2.gz	YQTQZUHQCYFOMT-VXGBXAGGSA-N	0	3	300.349	2.269	10	0		DEAEHN
C[C@H](NC[C@H]1CN(C)CCO1)c1cccc(Br)c1	ZINC000091666883	193088573	/nfs/dbraw/zinc/08/85/73/193088573.db2.gz	YBZFUXJCOJLHOY-FZMZJTMJSA-N	0	3	313.239	2.430	10	0		DEAEHN
C[C@H]1CC[C@H](C(N)=O)CN1CCOc1ccc(F)cc1Cl	ZINC000091741665	193100362	/nfs/dbraw/zinc/10/03/62/193100362.db2.gz	XRKWUTXBPVQMSN-QWRGUYRKSA-N	0	3	314.788	2.444	10	0		DEAEHN
C[C@@H]1[NH2+]CC[C@H]1[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000624415596	365415440	/nfs/dbraw/zinc/41/54/40/365415440.db2.gz	UFIQPVXMJWJOPY-OIBJUYFYSA-N	0	3	309.218	2.022	10	0		DEAEHN
C[C@@H]1[NH2+]CC[C@H]1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000624415640	365415851	/nfs/dbraw/zinc/41/58/51/365415851.db2.gz	VESZKTWQXONNFF-IONNQARKSA-N	0	3	309.218	2.022	10	0		DEAEHN
COC(=O)[C@H](O)C1CCN(Cc2cc(C)c(OC)c(C)c2)CC1	ZINC000092014740	193142695	/nfs/dbraw/zinc/14/26/95/193142695.db2.gz	SBMWFQJCVRBHBJ-MRXNPFEDSA-N	0	3	321.417	2.058	10	0		DEAEHN
Brc1ccc2c(c1)N(C[C@H]1CNCCO1)CC21CC1	ZINC000629558584	367251422	/nfs/dbraw/zinc/25/14/22/367251422.db2.gz	JTBDMDGAYNODGH-GFCCVEGCSA-N	0	3	323.234	2.289	10	0		DEAEHN
c1c(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)nnn1CC1CC1	ZINC000450605021	242007472	/nfs/dbraw/zinc/00/74/72/242007472.db2.gz	YDAHVZBHLBPXMF-YJBOKZPZSA-N	0	3	315.465	2.137	10	0		DEAEHN
CCNCc1ccc(F)c(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)c1	ZINC000092113458	193161442	/nfs/dbraw/zinc/16/14/42/193161442.db2.gz	PLDXHFDLOIEUHN-VXGBXAGGSA-N	0	3	314.426	2.212	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)c(F)c1	ZINC000092115532	193163028	/nfs/dbraw/zinc/16/30/28/193163028.db2.gz	ADPLLJOJXCHASU-RYUDHWBXSA-N	0	3	314.426	2.212	10	0		DEAEHN
CN(C1CCCCC1)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115521	193163367	/nfs/dbraw/zinc/16/33/67/193163367.db2.gz	RHBJHUAHKHRNMR-UHFFFAOYSA-N	0	3	300.399	2.238	10	0		DEAEHN
CCC[C@@H](C(=O)NCC1CCN(c2ccncc2)CC1)N(C)C	ZINC000093065230	193199520	/nfs/dbraw/zinc/19/95/20/193199520.db2.gz	YLZKWRAGMOSENR-KRWDZBQOSA-N	0	3	318.465	2.145	10	0		DEAEHN
CCOc1cccc(CN2CC[C@@H](N3CCN(CC)CC3)C2)c1	ZINC000093132628	193205761	/nfs/dbraw/zinc/20/57/61/193205761.db2.gz	JYQLREJWWKPYFL-GOSISDBHSA-N	0	3	317.477	2.297	10	0		DEAEHN
C[C@@H](Cc1cccs1)N(C)S(=O)(=O)C[C@@H]1CCCCN1	ZINC000093292162	193225157	/nfs/dbraw/zinc/22/51/57/193225157.db2.gz	RDLZNSOMHLZQGZ-STQMWFEESA-N	0	3	316.492	2.083	10	0		DEAEHN
CN[C@@H](C[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1F	ZINC000093700273	193293929	/nfs/dbraw/zinc/29/39/29/193293929.db2.gz	ULEBUHQJMRRBLH-WFASDCNBSA-N	0	3	314.426	2.148	10	0		DEAEHN
COC(=O)[C@@]1(N)CCC[C@H](N2CCC(C(F)(F)F)CC2)C1	ZINC000093756677	193302195	/nfs/dbraw/zinc/30/21/95/193302195.db2.gz	IPISGOAFRIKOGT-WCQYABFASA-N	0	3	308.344	2.074	10	0		DEAEHN
CC1(C)C([NH3+])C(C)(C)C1[N-]S(=O)(=O)c1ccc(Cl)s1	ZINC000094006542	193338142	/nfs/dbraw/zinc/33/81/42/193338142.db2.gz	MTUSERIIHYPJQS-UHFFFAOYSA-N	0	3	322.883	2.442	10	0		DEAEHN
COc1cc(CN(C)[C@H](CO)C(C)(C)C)cc2c1OCCO2	ZINC000093821904	193313428	/nfs/dbraw/zinc/31/34/28/193313428.db2.gz	XZJVESCZIYBGJO-OAHLLOKOSA-N	0	3	309.406	2.305	10	0		DEAEHN
CCN[C@]1(C(=O)OCC)CC[C@@H](N(C)CCC(F)(F)F)C1	ZINC000093831814	193314253	/nfs/dbraw/zinc/31/42/53/193314253.db2.gz	XTDLLINJQPRBBA-DGCLKSJQSA-N	0	3	310.360	2.335	10	0		DEAEHN
CCCCCNC(=O)[C@H](C)Oc1c(F)cc(CN)cc1F	ZINC000094346199	193363206	/nfs/dbraw/zinc/36/32/06/193363206.db2.gz	ZAYDUJDNBBNKEU-JTQLQIEISA-N	0	3	300.349	2.497	10	0		DEAEHN
CCN[C@@H](c1cc(C)c(F)cc1F)[C@H]1CCS(=O)(=O)C1	ZINC000094077965	193344157	/nfs/dbraw/zinc/34/41/57/193344157.db2.gz	ZFQRTMAGRWTXCM-IINYFYTJSA-N	0	3	303.374	2.359	10	0		DEAEHN
CC[C@](C)(N)C(=O)NCc1cc(Br)ccc1F	ZINC000094237139	193353621	/nfs/dbraw/zinc/35/36/21/193353621.db2.gz	QQGOUMVLWARVNA-LBPRGKRZSA-N	0	3	303.175	2.332	10	0		DEAEHN
CCN[C@@H](C)c1cc(F)ccc1O[C@@H]1CCS(=O)(=O)C1	ZINC000094618893	193385596	/nfs/dbraw/zinc/38/55/96/193385596.db2.gz	IHOJRYRMXQDDLJ-CMPLNLGQSA-N	0	3	301.383	2.062	10	0		DEAEHN
CCCN[C@H]1CCCc2sc([C@@H]3CN4CCN3CC4)nc21	ZINC000094511097	193375903	/nfs/dbraw/zinc/37/59/03/193375903.db2.gz	CJNANCRKOWUXQC-STQMWFEESA-N	0	3	306.479	2.192	10	0		DEAEHN
CCOC(=O)COC[C@@H](N)c1cc(C)c(Br)s1	ZINC000094539545	193377858	/nfs/dbraw/zinc/37/78/58/193377858.db2.gz	AIECTXIZXGAXGZ-MRVPVSSYSA-N	0	3	322.224	2.399	10	0		DEAEHN
CN1CCC(NC(=O)c2cccc(C(F)(F)F)c2N)CC1	ZINC000094598516	193383291	/nfs/dbraw/zinc/38/32/91/193383291.db2.gz	FEEZWVHXGLIVHG-UHFFFAOYSA-N	0	3	301.312	2.112	10	0		DEAEHN
CCN1CCC(Nc2nc3ccc(Br)cn3n2)CC1	ZINC000094603764	193383653	/nfs/dbraw/zinc/38/36/53/193383653.db2.gz	WVORIDVNBVMHQS-UHFFFAOYSA-N	0	3	324.226	2.388	10	0		DEAEHN
CCCN[C@@H](Cc1ncnn1C)c1cncc(Br)c1	ZINC000094825060	193401910	/nfs/dbraw/zinc/40/19/10/193401910.db2.gz	VNDYOUSMVXCKDB-LBPRGKRZSA-N	0	3	324.226	2.256	10	0		DEAEHN
CCN[C@H](C)c1cc(F)c(C)cc1Sc1n[nH]c(=O)n1C	ZINC000094768530	193396414	/nfs/dbraw/zinc/39/64/14/193396414.db2.gz	DWKLVMMZEMQQQL-SECBINFHSA-N	0	3	310.398	2.378	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)N[C@@H]2CCOC[C@@H]2C)c1C	ZINC000277963939	213884012	/nfs/dbraw/zinc/88/40/12/213884012.db2.gz	SFLXYWJATIITPU-DUFXMDAXSA-N	0	3	306.406	2.420	10	0		DEAEHN
CN(C)C[C@H]1C[C@@H](O)CN1Cc1ccccc1C(F)(F)F	ZINC000097265018	193702003	/nfs/dbraw/zinc/70/20/03/193702003.db2.gz	MLVWWBQJIMGULP-CHWSQXEVSA-N	0	3	302.340	2.202	10	0		DEAEHN
c1c2c(cc3c1OCCC[C@H]3NC[C@@H]1COCCN1)CCCC2	ZINC000530220129	284376904	/nfs/dbraw/zinc/37/69/04/284376904.db2.gz	IZXVZSKHXNYCNQ-SJLPKXTDSA-N	0	3	316.445	2.357	10	0		DEAEHN
CCN[C@H](c1c(Br)cnn1CC)[C@H]1CCOC1	ZINC000160321969	197401190	/nfs/dbraw/zinc/40/11/90/197401190.db2.gz	IVDQOEOHEWFYHP-ONGXEEELSA-N	0	3	302.216	2.353	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)C1CCN(CCc2ccncc2)CC1	ZINC000153842895	291577410	/nfs/dbraw/zinc/57/74/10/291577410.db2.gz	QLSBVGHAGHWUBA-OAHLLOKOSA-N	0	3	303.450	2.497	10	0		DEAEHN
CCC1(CNC(=O)c2cccc(CN3CCCC3)c2)COC1	ZINC000456470207	247216578	/nfs/dbraw/zinc/21/65/78/247216578.db2.gz	JSKXAHJAKJIBDH-UHFFFAOYSA-N	0	3	302.418	2.439	10	0		DEAEHN
CC(C)CCSc1nc(=O)n(CCN(C)C)c2c1CCC2	ZINC000038786367	183010187	/nfs/dbraw/zinc/01/01/87/183010187.db2.gz	RYRSQYOQAINXOT-UHFFFAOYSA-N	0	3	309.479	2.432	10	0		DEAEHN
COc1cc([C@H](CN)N2CCC(C)CC2)cc(OC)c1OC	ZINC000039789180	183021938	/nfs/dbraw/zinc/02/19/38/183021938.db2.gz	CWMXAWQKDZVRLX-AWEZNQCLSA-N	0	3	308.422	2.444	10	0		DEAEHN
Cc1ccc([C@H](C)N2CCC[C@@H]2C(=O)N2CCNCC2)s1	ZINC000040508132	183085418	/nfs/dbraw/zinc/08/54/18/183085418.db2.gz	CLJKQGIHZHGMPA-UONOGXRCSA-N	0	3	307.463	2.014	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)[C@@H]1C[C@H](OC)CN1	ZINC000040634268	183111991	/nfs/dbraw/zinc/11/19/91/183111991.db2.gz	SPAPNYLKJMOGKM-AAEUAGOBSA-N	0	3	312.797	2.444	10	0		DEAEHN
CN1CCC[C@@H](Nc2c(C(N)=S)cnc3ccccc32)C1	ZINC000040716157	183122706	/nfs/dbraw/zinc/12/27/06/183122706.db2.gz	NLMMXGBOSUINNB-LLVKDONJSA-N	0	3	300.431	2.375	10	0		DEAEHN
CCOc1cc(CNCCCO)cc(Br)c1OC	ZINC000040721055	183123889	/nfs/dbraw/zinc/12/38/89/183123889.db2.gz	PXLGHAMPKMJBEX-UHFFFAOYSA-N	0	3	318.211	2.328	10	0		DEAEHN
CCN1CCN(CCNc2cccc(Br)c2)CC1	ZINC000041563174	183202797	/nfs/dbraw/zinc/20/27/97/183202797.db2.gz	NZEZDMMDXWPVMZ-UHFFFAOYSA-N	0	3	312.255	2.499	10	0		DEAEHN
Cc1cccc(-n2nc(C(=O)NCCN(C)C)cc2C2CC2)c1	ZINC000041453358	183191928	/nfs/dbraw/zinc/19/19/28/183191928.db2.gz	OXUOUSQWDCKGHT-UHFFFAOYSA-N	0	3	312.417	2.350	10	0		DEAEHN
COc1ccc2nc(C)cc(N(C)[C@@H]3CCS(=O)(=O)C3)c2c1	ZINC000041478863	183194018	/nfs/dbraw/zinc/19/40/18/183194018.db2.gz	SGKUUKMGBQBWDE-GFCCVEGCSA-N	0	3	320.414	2.175	10	0		DEAEHN
CC1CC(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000681765588	542203805	/nfs/dbraw/zinc/20/38/05/542203805.db2.gz	WPPYXMPHKWPDNP-GXOAENINSA-N	0	3	316.445	2.128	10	0		DEAEHN
COCCCN(CCOC)[C@H](CN)c1ccc(Cl)s1	ZINC000042420754	183267786	/nfs/dbraw/zinc/26/77/86/183267786.db2.gz	CKTICTONCAZAQU-LLVKDONJSA-N	0	3	306.859	2.386	10	0		DEAEHN
CCN(CCC(=O)Nc1ccccc1CN)CC(F)(F)F	ZINC000042739567	183303391	/nfs/dbraw/zinc/30/33/91/183303391.db2.gz	CQFQBEHWTJESMJ-UHFFFAOYSA-N	0	3	303.328	2.358	10	0		DEAEHN
CC[C@H](N)[C@H](c1cccc(Cl)c1)N1CCC[C@@H]1C(=O)NC	ZINC000043015794	183327835	/nfs/dbraw/zinc/32/78/35/183327835.db2.gz	PHPNBFVCNLXAIM-ZNMIVQPWSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(C)s1)N1CCCC[C@@H]1C(=O)NC	ZINC000043242687	183346582	/nfs/dbraw/zinc/34/65/82/183346582.db2.gz	GJTYHUXKLARJDE-NFAWXSAZSA-N	0	3	309.479	2.435	10	0		DEAEHN
N[C@H](c1ccc(F)c(Br)c1)[C@H]1CCS(=O)(=O)C1	ZINC000043299828	183351491	/nfs/dbraw/zinc/35/14/91/183351491.db2.gz	SAZBQZCEEBDZJO-GZMMTYOYSA-N	0	3	322.199	2.023	10	0		DEAEHN
CCCN[C@@H](c1ccc(F)c(F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000043301257	183352412	/nfs/dbraw/zinc/35/24/12/183352412.db2.gz	YJUSQFCHDBYYAJ-FZMZJTMJSA-N	0	3	303.374	2.440	10	0		DEAEHN
NC(=S)c1cc2c(nc1OCCN1CCCC1)CCCC2	ZINC000043411021	183360271	/nfs/dbraw/zinc/36/02/71/183360271.db2.gz	FOQMRLFVPZIJJJ-UHFFFAOYSA-N	0	3	305.447	2.069	10	0		DEAEHN
CC(C)c1ccc([C@@H](O)CN[C@@]2(C)CCS(=O)(=O)C2)cc1	ZINC000044930260	183459800	/nfs/dbraw/zinc/45/98/00/183459800.db2.gz	XXEOIHHMELBDHZ-HOTGVXAUSA-N	0	3	311.447	2.010	10	0		DEAEHN
CCN(CC)[C@H](C(=O)NC[C@@H]1CCCN1C)c1ccccc1	ZINC000104867314	194048873	/nfs/dbraw/zinc/04/88/73/194048873.db2.gz	FPRDFZKZIQPRDT-IRXDYDNUSA-N	0	3	303.450	2.280	10	0		DEAEHN
C[C@@H]1CN(Cc2cc(Cl)cc3cccnc32)C[C@H]1C(N)=O	ZINC000284904904	218228590	/nfs/dbraw/zinc/22/85/90/218228590.db2.gz	SDBCVOJDXYMALZ-QMTHXVAHSA-N	0	3	303.793	2.441	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)c2ccccc2)C[C@H]1CC	ZINC000105838017	194143970	/nfs/dbraw/zinc/14/39/70/194143970.db2.gz	SBFHFYLWMGJQGZ-MSOLQXFVSA-N	0	3	306.450	2.153	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(C(=O)[C@@H]2CCCCN2CC)C1	ZINC000105852814	194146864	/nfs/dbraw/zinc/14/68/64/194146864.db2.gz	GVAUMRZHBWMOMV-HOTGVXAUSA-N	0	3	318.465	2.483	10	0		DEAEHN
CC(=O)Nc1cccc(CN2CCC[C@@H](Cn3cncn3)C2)c1	ZINC000105884566	194156617	/nfs/dbraw/zinc/15/66/17/194156617.db2.gz	NDGPRMZWICKVRE-MRXNPFEDSA-N	0	3	313.405	2.149	10	0		DEAEHN
O=C(C[C@@H]1CCc2ccccc2C1)NCCNc1ccncc1	ZINC000533812434	284807483	/nfs/dbraw/zinc/80/74/83/284807483.db2.gz	GZCXZSWINIAOQV-OAHLLOKOSA-N	0	3	309.413	2.227	10	0		DEAEHN
O=C(C[C@H]1CCc2ccccc2C1)NCCNc1ccncc1	ZINC000533812430	284807868	/nfs/dbraw/zinc/80/78/68/284807868.db2.gz	GZCXZSWINIAOQV-HNNXBMFYSA-N	0	3	309.413	2.227	10	0		DEAEHN
CC[C@H](C(N)=S)N1CCN(c2nc3ccccc3o2)CC1	ZINC000109471534	194266705	/nfs/dbraw/zinc/26/67/05/194266705.db2.gz	CFSYPGFKTFCWTO-GFCCVEGCSA-N	0	3	304.419	2.015	10	0		DEAEHN
CC[C@@H](C(N)=S)N1CCN(Cc2cc(C)ccc2C)CC1	ZINC000109468942	194266996	/nfs/dbraw/zinc/26/69/96/194266996.db2.gz	KFEYCGFEHGQIEE-INIZCTEOSA-N	0	3	305.491	2.486	10	0		DEAEHN
CC[C@H](C(N)=S)N1CCN(Cc2cc(C)cc(C)c2)CC1	ZINC000109469495	194267348	/nfs/dbraw/zinc/26/73/48/194267348.db2.gz	VVLWDXCLKUHJDC-MRXNPFEDSA-N	0	3	305.491	2.486	10	0		DEAEHN
CC[C@H](C(N)=S)N1CCN(Cc2cccc(F)c2F)CC1	ZINC000109469385	194267358	/nfs/dbraw/zinc/26/73/58/194267358.db2.gz	FKMXAXWSWYXBNR-CYBMUJFWSA-N	0	3	313.417	2.147	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1cccc(COC)c1	ZINC000110088543	194308684	/nfs/dbraw/zinc/30/86/84/194308684.db2.gz	GXAKZNQJFLVYLU-INIZCTEOSA-N	0	3	321.421	2.065	10	0		DEAEHN
CN([C@H]1CCCNC1)S(=O)(=O)c1ccc2ccccc2c1	ZINC000110928323	194370464	/nfs/dbraw/zinc/37/04/64/194370464.db2.gz	OBRRDEGHHHZANI-HNNXBMFYSA-N	0	3	304.415	2.212	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cccc(F)c2Br)C1	ZINC000156583891	197125795	/nfs/dbraw/zinc/12/57/95/197125795.db2.gz	ALZFUACUXVNZIH-SECBINFHSA-N	0	3	315.186	2.364	10	0		DEAEHN
CNc1nc(CN(C)CCN(C)C)nc2sc(C)c(C)c21	ZINC000111146161	194395154	/nfs/dbraw/zinc/39/51/54/194395154.db2.gz	RQPSKWCJFCUKFU-UHFFFAOYSA-N	0	3	307.467	2.343	10	0		DEAEHN
COc1ccc(OCCN(C)C[C@@H](O)COC(C)(C)C)cc1	ZINC000057158956	184028952	/nfs/dbraw/zinc/02/89/52/184028952.db2.gz	IVGOMAXOMLJJCI-CQSZACIVSA-N	0	3	311.422	2.182	10	0		DEAEHN
CCCOc1nc(Cl)nc(N(CCN(C)C)CC(C)C)n1	ZINC000061540452	184173378	/nfs/dbraw/zinc/17/33/78/184173378.db2.gz	OBZFYIPGEVPBGX-UHFFFAOYSA-N	0	3	315.849	2.338	10	0		DEAEHN
CC(C)NCCS(=O)(=O)NCc1ccccc1C(F)(F)F	ZINC000061627349	184178905	/nfs/dbraw/zinc/17/89/05/184178905.db2.gz	RGLOLTAGFNLTEX-UHFFFAOYSA-N	0	3	324.368	2.123	10	0		DEAEHN
CCNCc1cccc(Br)c1O[C@H](CC)C(N)=O	ZINC000061675987	184181760	/nfs/dbraw/zinc/18/17/60/184181760.db2.gz	JKUDBJSJBODUTP-LLVKDONJSA-N	0	3	315.211	2.201	10	0		DEAEHN
CN(C)C[C@H](O)CNc1cc(Br)ccc1Cl	ZINC000061691228	184182981	/nfs/dbraw/zinc/18/29/81/184182981.db2.gz	BAUALOSCFDYIEE-SECBINFHSA-N	0	3	307.619	2.437	10	0		DEAEHN
NCc1ccccc1CNC(=O)c1cc(Br)c[nH]1	ZINC000061840966	184189410	/nfs/dbraw/zinc/18/94/10/184189410.db2.gz	SYDAEURALGKLHA-UHFFFAOYSA-N	0	3	308.179	2.166	10	0		DEAEHN
C[C@@H]1CN(CCC(=O)Nc2ccc(Cl)cc2N)CCCO1	ZINC000061912926	184195046	/nfs/dbraw/zinc/19/50/46/184195046.db2.gz	OLKCLOLSTLOAFK-LLVKDONJSA-N	0	3	311.813	2.362	10	0		DEAEHN
CC[C@H](NC)c1cccc(S(=O)(=O)N(C)CCCOC)c1	ZINC000062037796	184202957	/nfs/dbraw/zinc/20/29/57/184202957.db2.gz	QSJVKFOTSWHSDY-HNNXBMFYSA-N	0	3	314.451	2.014	10	0		DEAEHN
[NH3+][C@@H]1CCCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)s1	ZINC000063213904	184279052	/nfs/dbraw/zinc/27/90/52/184279052.db2.gz	MPWRYTIUHHGSFF-BDAKNGLRSA-N	0	3	308.856	2.340	10	0		DEAEHN
CC[NH2+][C@H](C)c1ccccc1[N-]S(=O)(=O)C[C@H]1CCCO1	ZINC000063155746	184274721	/nfs/dbraw/zinc/27/47/21/184274721.db2.gz	COQQGIATUQZSGD-CHWSQXEVSA-N	0	3	312.435	2.278	10	0		DEAEHN
[NH3+][C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000063176016	184276620	/nfs/dbraw/zinc/27/66/20/184276620.db2.gz	OVHOBPUVVMNWEX-ZJUUUORDSA-N	0	3	309.218	2.152	10	0		DEAEHN
CC[C@H]1CN(c2ccccc2)CCN1C[C@H](O)COC(C)C	ZINC000184015522	207363740	/nfs/dbraw/zinc/36/37/40/207363740.db2.gz	XVBPLXSFVSFFMF-WMZOPIPTSA-N	0	3	306.450	2.373	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N([C@@H](C)C(C)C)C1CC1	ZINC000086396079	285032996	/nfs/dbraw/zinc/03/29/96/285032996.db2.gz	RDMYTKXFIQAPBY-HOCLYGCPSA-N	0	3	311.470	2.316	10	0		DEAEHN
C[C@H](CC(=O)c1ccccc1F)C(=O)N(C)CCCN(C)C	ZINC000539417533	285076703	/nfs/dbraw/zinc/07/67/03/285076703.db2.gz	XNVZQPWPFJEXBW-CYBMUJFWSA-N	0	3	308.397	2.445	10	0		DEAEHN
CCOc1ccc(NC(=O)[C@H](N)CCCOC)cc1Cl	ZINC000159266173	197340688	/nfs/dbraw/zinc/34/06/88/197340688.db2.gz	GCBXDQKYTCWMSS-GFCCVEGCSA-N	0	3	300.786	2.431	10	0		DEAEHN
Cn1cnnc1CCNCc1cc(F)cc(C(F)(F)F)c1	ZINC000159250802	197339689	/nfs/dbraw/zinc/33/96/89/197339689.db2.gz	HSIBVJKKQNYETG-UHFFFAOYSA-N	0	3	302.275	2.305	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CC[C@H](C)C[C@@H]2C)cc(CN)c1F	ZINC000159105399	197327614	/nfs/dbraw/zinc/32/76/14/197327614.db2.gz	HTEHKVOVRNQHNF-JQWIXIFHSA-N	0	3	314.426	2.402	10	0		DEAEHN
CCC1CCN(S(=O)(=O)c2cc(C)c(F)c(CN)c2)CC1	ZINC000159094610	197326490	/nfs/dbraw/zinc/32/64/90/197326490.db2.gz	NXQDXEMDSWUCQF-UHFFFAOYSA-N	0	3	314.426	2.404	10	0		DEAEHN
CCS(=O)(=O)CCCOc1c(Cl)cccc1CNC	ZINC000159017599	197319894	/nfs/dbraw/zinc/31/98/94/197319894.db2.gz	HRSLAODULAQYMT-UHFFFAOYSA-N	0	3	305.827	2.263	10	0		DEAEHN
CC[C@@H](C[NH3+])CC(=O)Nc1cc(Br)ccc1[O-]	ZINC000158977191	197316147	/nfs/dbraw/zinc/31/61/47/197316147.db2.gz	JWKXRRTWSRWDNQ-MRVPVSSYSA-N	0	3	301.184	2.468	10	0		DEAEHN
C[C@H](NCc1ccc(I)o1)[C@H]1CCOC1	ZINC000158490049	197277817	/nfs/dbraw/zinc/27/78/17/197277817.db2.gz	FTPSWKZXZLHCQY-IUCAKERBSA-N	0	3	321.158	2.399	10	0		DEAEHN
CC(C)Oc1cncc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000158446346	197272593	/nfs/dbraw/zinc/27/25/93/197272593.db2.gz	OFERCINPTFGVCE-UKRRQHHQSA-N	0	3	305.422	2.424	10	0		DEAEHN
CC(C)(C)[C@@H](N)C(=O)Nc1cccc(Cl)c1-n1cncn1	ZINC000158255684	197256823	/nfs/dbraw/zinc/25/68/23/197256823.db2.gz	MYIQWGZLKBTTTC-LBPRGKRZSA-N	0	3	307.785	2.233	10	0		DEAEHN
CC(C)(C)[C@@H](N)C(=O)N[C@H]1CCC[C@@H](OCC(F)(F)F)C1	ZINC000158238264	197255991	/nfs/dbraw/zinc/25/59/91/197255991.db2.gz	XGBRDLBRKKFTNB-AXFHLTTASA-N	0	3	310.360	2.366	10	0		DEAEHN
CCn1ncc(Br)c1[C@@H](O)[C@](C)(CC)N(C)C	ZINC000157611707	197201745	/nfs/dbraw/zinc/20/17/45/197201745.db2.gz	UAYRGPLNNQTYCB-NEPJUHHUSA-N	0	3	304.232	2.429	10	0		DEAEHN
O=C1NCCCC[C@@H]1N1CCC([C@H](O)c2ccc(F)cc2)CC1	ZINC000120326039	195143843	/nfs/dbraw/zinc/14/38/43/195143843.db2.gz	RDUQQWPQFYOMSP-DLBZAZTESA-N	0	3	320.408	2.240	10	0		DEAEHN
CCCN(CC(F)(F)F)C(=O)[C@@]1(N)C[C@H](OCC)C1(C)C	ZINC000156945974	197151492	/nfs/dbraw/zinc/15/14/92/197151492.db2.gz	LOMJMCXZOKAVRO-GWCFXTLKSA-N	0	3	310.360	2.320	10	0		DEAEHN
C[C@@H]1CNC[C@@H](C)N1C(=O)c1ccc(OC(F)(F)F)cc1	ZINC000156713240	197134743	/nfs/dbraw/zinc/13/47/43/197134743.db2.gz	MRCGVJOGZDRZGR-NXEZZACHSA-N	0	3	302.296	2.408	10	0		DEAEHN
COCC(=O)N1CCC(N[C@@H]2CSc3ccccc32)CC1	ZINC000156335078	197105273	/nfs/dbraw/zinc/10/52/73/197105273.db2.gz	GNZRHAGJRXFUSK-CQSZACIVSA-N	0	3	306.431	2.060	10	0		DEAEHN
CC(C)CNCc1cc(-c2ccc(S(C)(=O)=O)cc2)on1	ZINC000156241025	197097822	/nfs/dbraw/zinc/09/78/22/197097822.db2.gz	YIFDPVXJVFOISV-UHFFFAOYSA-N	0	3	308.403	2.491	10	0		DEAEHN
COc1cccc(F)c1[C@H](N)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000156088651	197086106	/nfs/dbraw/zinc/08/61/06/197086106.db2.gz	YICFMRZECCGWGB-JRPNMDOOSA-N	0	3	315.410	2.438	10	0		DEAEHN
C[C@@H]1C[C@@H](Nc2ccc(F)c([N-]S(C)(=O)=O)c2)CC[N@@H+]1C	ZINC000155963064	197077724	/nfs/dbraw/zinc/07/77/24/197077724.db2.gz	YBCBYQRJWONPDP-PWSUYJOCSA-N	0	3	315.414	2.092	10	0		DEAEHN
C[C@@H]1C[C@@H](Nc2ccc(F)c([N-]S(C)(=O)=O)c2)CC[N@H+]1C	ZINC000155963064	197077725	/nfs/dbraw/zinc/07/77/25/197077725.db2.gz	YBCBYQRJWONPDP-PWSUYJOCSA-N	0	3	315.414	2.092	10	0		DEAEHN
COC(=O)Nc1ccc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1	ZINC000155520871	197062958	/nfs/dbraw/zinc/06/29/58/197062958.db2.gz	ISKKCTURWQPAAS-DOMZBBRYSA-N	0	3	319.405	2.323	10	0		DEAEHN
CCc1noc(C)c1NC(=O)N(CCN(C)C)C[C@@H]1CCCO1	ZINC000155481262	197059021	/nfs/dbraw/zinc/05/90/21/197059021.db2.gz	NHBDQAMTAZCYEP-ZDUSSCGKSA-N	0	3	324.425	2.120	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2ccc(N(C)C)cc2F)CCN1C	ZINC000155087730	197020463	/nfs/dbraw/zinc/02/04/63/197020463.db2.gz	CXRPTPNSADYDGT-TZMCWYRMSA-N	0	3	307.413	2.446	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@H](Cc1ccccc1)N(C)C	ZINC000245425010	285237967	/nfs/dbraw/zinc/23/79/67/285237967.db2.gz	DIOKHSLEQYZGPH-MSOLQXFVSA-N	0	3	317.477	2.102	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@H](Cc1ccccc1)N(C)C	ZINC000245425012	285272511	/nfs/dbraw/zinc/27/25/11/285272511.db2.gz	DIOKHSLEQYZGPH-ROUUACIJSA-N	0	3	317.477	2.102	10	0		DEAEHN
c1cncc(CN2C[C@H]3COC[C@@]3(COCC3CCC3)C2)c1	ZINC000247848993	257117016	/nfs/dbraw/zinc/11/70/16/257117016.db2.gz	NYYYDULJDUSPFK-ROUUACIJSA-N	0	3	302.418	2.347	10	0		DEAEHN
O=C(NC1CCC1)[C@@H]1CN(Cc2ccsc2)C[C@@H]2OCC[C@@H]21	ZINC000247745892	257118685	/nfs/dbraw/zinc/11/86/85/257118685.db2.gz	QQPQWVLRSBAZTG-OAGGEKHMSA-N	0	3	320.458	2.254	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc(OC)c(OC)c2)CCN1CCOC	ZINC000120953467	195270865	/nfs/dbraw/zinc/27/08/65/195270865.db2.gz	FHWNVCSSGSQTFT-MRXNPFEDSA-N	0	3	322.449	2.246	10	0		DEAEHN
COc1ccc(OCCCC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000195314515	132546479	/nfs/dbraw/zinc/54/64/79/132546479.db2.gz	UOLLNJHNRVIWCG-OAHLLOKOSA-N	0	3	318.417	2.161	10	0		DEAEHN
CC(C)[C@H](NC(=O)OC(C)(C)C)[C@]1(C)NCCc2nc[nH]c21	ZINC000725242525	542769778	/nfs/dbraw/zinc/76/97/78/542769778.db2.gz	CCJUOAKBVXDUBX-LRDDRELGSA-N	0	3	308.426	2.320	10	0		DEAEHN
Cn1cnc2c1[C@@]1(CCCN(C(=O)OC(C)(C)C)CC1)NCC2	ZINC000725242544	542770259	/nfs/dbraw/zinc/77/02/59/542770259.db2.gz	DMZOMMDUQQZNPZ-KRWDZBQOSA-N	0	3	320.437	2.182	10	0		DEAEHN
C[C@@H]1C[C@@]2(CCN1C(=O)OC(C)(C)C)NCCc1ncn(C)c12	ZINC000725242530	542770282	/nfs/dbraw/zinc/77/02/82/542770282.db2.gz	CCOAJLOSKMXREB-SJKOYZFVSA-N	0	3	320.437	2.181	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)NCc1ccc2cc[nH]c2n1	ZINC000357985114	133113530	/nfs/dbraw/zinc/11/35/30/133113530.db2.gz	JDGALORGAJRBMS-CYBMUJFWSA-N	0	3	315.421	2.237	10	0		DEAEHN
C[C@H]1CC(C)(C)CC[C@H]1NC(=O)NCCNc1ccncc1	ZINC000361915045	133199414	/nfs/dbraw/zinc/19/94/14/133199414.db2.gz	GZVZVUZOZDAWOM-DZGCQCFKSA-N	0	3	304.438	2.429	10	0		DEAEHN
COC[C@H](NC(=O)CC1CCN(C)CC1)c1ccc(F)cc1	ZINC000362869189	133256173	/nfs/dbraw/zinc/25/61/73/133256173.db2.gz	UGKOHLPYVFHLER-INIZCTEOSA-N	0	3	308.397	2.361	10	0		DEAEHN
COC[C@H](Cc1ccccc1)NC(=O)CC1CCN(C)CC1	ZINC000362878563	133257180	/nfs/dbraw/zinc/25/71/80/133257180.db2.gz	XGBGCMMFGXXQLE-KRWDZBQOSA-N	0	3	304.434	2.092	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@@H]2C=C[C@H](CO)C2)c2ccc(F)cc2C1	ZINC000368402918	133271872	/nfs/dbraw/zinc/27/18/72/133271872.db2.gz	OVYMSQSGPXSUGG-XCRHUMRWSA-N	0	3	318.392	2.146	10	0		DEAEHN
O[C@H](COC1CCOCC1)CN1CCCC[C@H]1c1ccco1	ZINC000368550406	133277570	/nfs/dbraw/zinc/27/75/70/133277570.db2.gz	ZKIQFSPLAXSXHV-HOCLYGCPSA-N	0	3	309.406	2.363	10	0		DEAEHN
c1ncn(-c2ccc(CN3CCC(c4c[nH]cn4)CC3)cc2)n1	ZINC000377231037	133323471	/nfs/dbraw/zinc/32/34/71/133323471.db2.gz	HWYAJGVXFFJUEW-UHFFFAOYSA-N	0	3	308.389	2.370	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@@H](C(=O)NCC1=CCN(C)CC1)CC2	ZINC000372466571	133354836	/nfs/dbraw/zinc/35/48/36/133354836.db2.gz	PZXUTXJCFSSZCA-AWEZNQCLSA-N	0	3	316.449	2.016	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NCC1=CCN(C)CC1)C2	ZINC000372466571	133354837	/nfs/dbraw/zinc/35/48/37/133354837.db2.gz	PZXUTXJCFSSZCA-AWEZNQCLSA-N	0	3	316.449	2.016	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@@H]2CCCC[C@H]2O)C1	ZINC000373019544	133374485	/nfs/dbraw/zinc/37/44/85/133374485.db2.gz	HWBGUXPUVMDBTF-MWDXBVQZSA-N	0	3	323.481	2.196	10	0		DEAEHN
O=C(c1cn2ccnc2s1)N1CCC[C@H]1CN1CCCC1	ZINC000188448061	145012283	/nfs/dbraw/zinc/01/22/83/145012283.db2.gz	SCWRGCXNWKOBAJ-LBPRGKRZSA-N	0	3	304.419	2.096	10	0		DEAEHN
O=C(COc1ccc(F)cc1F)NCc1ccc2c(c1)CNC2	ZINC000188760264	145017480	/nfs/dbraw/zinc/01/74/80/145017480.db2.gz	IGWVEAQUVNSOCP-UHFFFAOYSA-N	0	3	318.323	2.263	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1C[C@@H]1CC2(CCC2)C(=O)O1	ZINC000192058468	145069906	/nfs/dbraw/zinc/06/99/06/145069906.db2.gz	GWTJAHIRULTFKD-CABCVRRESA-N	0	3	303.406	2.142	10	0		DEAEHN
C[C@@H](N[C@@H](C)C(=O)N(C)Cc1cccc(F)c1)[C@@H]1CCCO1	ZINC000193128376	145083021	/nfs/dbraw/zinc/08/30/21/145083021.db2.gz	OMCOFKWIFSNNSK-WWGRRREGSA-N	0	3	308.397	2.330	10	0		DEAEHN
C[C@H]1CN(C2CCN(Cc3cn4ccccc4n3)CC2)CCO1	ZINC000193430430	145085784	/nfs/dbraw/zinc/08/57/84/145085784.db2.gz	MEEDCJJJTPTTAT-HNNXBMFYSA-N	0	3	314.433	2.019	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(CC[C@H]3CCOC3=O)C2)c1	ZINC000246304420	145098304	/nfs/dbraw/zinc/09/83/04/145098304.db2.gz	BINZGKSOTUOFOR-KBPBESRZSA-N	0	3	319.401	2.446	10	0		DEAEHN
Cc1cc(CN2CCN(C[C@H](C)O)[C@H](C)C2)c2ccccc2n1	ZINC000246587839	145107539	/nfs/dbraw/zinc/10/75/39/145107539.db2.gz	BPFWJYSJJZAXTK-CVEARBPZSA-N	0	3	313.445	2.430	10	0		DEAEHN
C[C@H](C(=O)NCCc1cccs1)N1CC[C@@H]2OCCC[C@H]2C1	ZINC000246613070	145108999	/nfs/dbraw/zinc/10/89/99/145108999.db2.gz	JPDHYOAAVCWURF-YCPHGPKFSA-N	0	3	322.474	2.296	10	0		DEAEHN
C[N@@H+]1CCC[C@H]2CN(C(=O)NCc3ccc([O-])c(F)c3)CC[C@H]21	ZINC000246711414	145111636	/nfs/dbraw/zinc/11/16/36/145111636.db2.gz	FHXLPXPLEKRCBI-DZGCQCFKSA-N	0	3	321.396	2.157	10	0		DEAEHN
C[N@H+]1CCC[C@H]2CN(C(=O)NCc3ccc([O-])c(F)c3)CC[C@H]21	ZINC000246711414	145111637	/nfs/dbraw/zinc/11/16/37/145111637.db2.gz	FHXLPXPLEKRCBI-DZGCQCFKSA-N	0	3	321.396	2.157	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NC(=O)N1CCN2CCC[C@H]2C1	ZINC000246889888	145118704	/nfs/dbraw/zinc/11/87/04/145118704.db2.gz	HDGTUBKBADDKNS-RDJZCZTQSA-N	0	3	317.433	2.081	10	0		DEAEHN
Cc1ccc(F)c(OCC(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000246952220	145120206	/nfs/dbraw/zinc/12/02/06/145120206.db2.gz	IIWRKIKAEQXADF-KGLIPLIRSA-N	0	3	306.381	2.208	10	0		DEAEHN
NC(=O)c1cccc(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)c1	ZINC000246976216	145121895	/nfs/dbraw/zinc/12/18/95/145121895.db2.gz	VRJASDJYINUBIQ-FUHWJXTLSA-N	0	3	313.445	2.234	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)c2cccc(C[S@@](C)=O)c2)C1	ZINC000247302287	145132297	/nfs/dbraw/zinc/13/22/97/145132297.db2.gz	LLHGWVFQQQMTKL-GGRMYQCBSA-N	0	3	322.474	2.024	10	0		DEAEHN
CCc1ccc([C@H](CNC(=O)N[C@@H](C)[C@H](C)CO)N(C)C)cc1	ZINC000247294981	145132430	/nfs/dbraw/zinc/13/24/30/145132430.db2.gz	USJOHNIXSLDGIL-KEYYUXOJSA-N	0	3	321.465	2.168	10	0		DEAEHN
Cc1ccc(OCCCN2CCN(C[C@H](C)O)[C@@H](C)C2)cc1C	ZINC000247404736	145136114	/nfs/dbraw/zinc/13/61/14/145136114.db2.gz	YYCQFOMMNUKDAK-ROUUACIJSA-N	0	3	320.477	2.459	10	0		DEAEHN
CCOc1ccccc1OCC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000247412756	145136674	/nfs/dbraw/zinc/13/66/74/145136674.db2.gz	NJAMYNDNTHNMDQ-LSDHHAIUSA-N	0	3	320.433	2.405	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000247518703	145140099	/nfs/dbraw/zinc/14/00/99/145140099.db2.gz	WMSOGDJGYFHSRF-KCMWZYNZSA-N	0	3	314.429	2.494	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000247518714	145140291	/nfs/dbraw/zinc/14/02/91/145140291.db2.gz	WMSOGDJGYFHSRF-WCZJQEMASA-N	0	3	314.429	2.494	10	0		DEAEHN
Cc1nc2ccccc2n1CC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000247560874	145141569	/nfs/dbraw/zinc/14/15/69/145141569.db2.gz	ZOKHPRNALUXJGG-ZFWWWQNUSA-N	0	3	314.433	2.286	10	0		DEAEHN
Cc1ccc(OC[C@H](O)CN2CC[C@@]3(O)CCCC[C@@H]3C2)cc1	ZINC000247985988	145146931	/nfs/dbraw/zinc/14/69/31/145146931.db2.gz	IUNRXFXFYKHBFA-LMMKCTJWSA-N	0	3	319.445	2.362	10	0		DEAEHN
Cc1ccc(OC[C@H](O)CN2CCN3CCCC[C@H]3C2)c(C)c1	ZINC000248330916	145151223	/nfs/dbraw/zinc/15/12/23/145151223.db2.gz	DSNCTBSWERTCTO-ZWKOTPCHSA-N	0	3	318.461	2.213	10	0		DEAEHN
COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@H](C)[C@@H]1CCCO1	ZINC000248607844	145160613	/nfs/dbraw/zinc/16/06/13/145160613.db2.gz	PMIBDJDWCMFSRZ-FQLMCAECSA-N	0	3	320.433	2.418	10	0		DEAEHN
COc1ccccc1[C@H](C)NC(=O)CN[C@@H](C)[C@H]1CCCO1	ZINC000248634282	145162185	/nfs/dbraw/zinc/16/21/85/145162185.db2.gz	XHSYFUJWTXUWHP-KCQAQPDRSA-N	0	3	306.406	2.030	10	0		DEAEHN
CCN(C(=O)[C@H](C)COC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000248719223	145164930	/nfs/dbraw/zinc/16/49/30/145164930.db2.gz	HCCKMCRWAALSRE-NVXWUHKLSA-N	0	3	304.434	2.392	10	0		DEAEHN
Cc1nc(C[C@@H]2CCCN(C[C@H]3CC4(CCC4)C(=O)O3)C2)no1	ZINC000248915401	145173985	/nfs/dbraw/zinc/17/39/85/145173985.db2.gz	ZNZSCOQCMJXUDK-UONOGXRCSA-N	0	3	319.405	2.118	10	0		DEAEHN
COc1ccc(F)c(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1OC	ZINC000248986729	145174917	/nfs/dbraw/zinc/17/49/17/145174917.db2.gz	FEHOPYPHGAYUEM-WCQYABFASA-N	0	3	324.396	2.301	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1C[C@H](CO)[C@@H](c2ccsc2)C1	ZINC000249527089	145186001	/nfs/dbraw/zinc/18/60/01/145186001.db2.gz	YUDZJEXFCDOMHA-BZUAXINKSA-N	0	3	322.474	2.157	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)[C@@H]1COc2ccc(Cl)cc2C1	ZINC000249745961	145189436	/nfs/dbraw/zinc/18/94/36/145189436.db2.gz	MOAHSRRXMFAHTE-JSGCOSHPSA-N	0	3	308.809	2.102	10	0		DEAEHN
C[C@H](C(=O)NCc1cccnc1N(C)C)N1[C@H](C)CC[C@H]1C	ZINC000249763378	145190136	/nfs/dbraw/zinc/19/01/36/145190136.db2.gz	XYJPIEUFHKLRFM-MGPQQGTHSA-N	0	3	304.438	2.025	10	0		DEAEHN
COc1ccc(OC)c(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1	ZINC000252656854	145199924	/nfs/dbraw/zinc/19/99/24/145199924.db2.gz	WGPVLNMRXNJSNH-BBRMVZONSA-N	0	3	318.417	2.260	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cc[nH]c(=O)c1	ZINC000253563811	145203398	/nfs/dbraw/zinc/20/33/98/145203398.db2.gz	GMNCRFCEMIWTBO-XJKSGUPXSA-N	0	3	311.385	2.038	10	0		DEAEHN
N[C@H](C(=O)NCC1(c2ccc(F)cc2)CCC1)C1CCOCC1	ZINC000261669270	145215060	/nfs/dbraw/zinc/21/50/60/145215060.db2.gz	GDQSJKFLPZPOJZ-INIZCTEOSA-N	0	3	320.408	2.118	10	0		DEAEHN
COc1cc(N[C@@H]2CCC[C@H]2[C@H]2COCCN2)cc(OC)c1	ZINC000261888055	145238097	/nfs/dbraw/zinc/23/80/97/145238097.db2.gz	GDQMBRSSCRDPSK-BRWVUGGUSA-N	0	3	306.406	2.273	10	0		DEAEHN
C[C@]1(CN2CCC(C(=O)Nc3ccccc3[O-])CC2)CC[NH2+]C1	ZINC000261918657	145241711	/nfs/dbraw/zinc/24/17/11/145241711.db2.gz	BIYPYTAYSPYJPZ-SFHVURJKSA-N	0	3	317.433	2.042	10	0		DEAEHN
CCc1ccc(O)c(NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000261924556	145242521	/nfs/dbraw/zinc/24/25/21/145242521.db2.gz	SBTMGKJBROWVBO-HNJNHCNJSA-N	0	3	318.417	2.426	10	0		DEAEHN
CCSc1ccc([C@@H](C)NC(=O)C2(N)CCOCC2)cc1	ZINC000261922518	145242742	/nfs/dbraw/zinc/24/27/42/145242742.db2.gz	VEFYKDNZLPWJEK-GFCCVEGCSA-N	0	3	308.447	2.484	10	0		DEAEHN
CCOC(=O)C[C@@H]1C[C@@H](OC)CN1Cc1cccc2c1NCC2	ZINC000261928391	145243619	/nfs/dbraw/zinc/24/36/19/145243619.db2.gz	LFPSXPZQGRSACG-JKSUJKDBSA-N	0	3	318.417	2.197	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)Nc1ccc(Cn2cncn2)cc1	ZINC000261949495	145245716	/nfs/dbraw/zinc/24/57/16/145245716.db2.gz	WDEJPDILWJKIJU-HNNXBMFYSA-N	0	3	313.405	2.043	10	0		DEAEHN
C[C@H](NC(=O)C1(N)CCOCC1)c1cccc(C(F)(F)F)c1	ZINC000262051088	145256878	/nfs/dbraw/zinc/25/68/78/145256878.db2.gz	CVGZCIALDOLPIX-JTQLQIEISA-N	0	3	316.323	2.391	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(CCSc2ccccc2F)n1	ZINC000263213589	145336560	/nfs/dbraw/zinc/33/65/60/145336560.db2.gz	KNUYAIWILGPAGW-LBPRGKRZSA-N	0	3	322.409	2.120	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@@H]2c2ccc(F)cc2F)n1	ZINC000263210832	145336675	/nfs/dbraw/zinc/33/66/75/145336675.db2.gz	KFYAPPXUZXXHQQ-YRGRVCCFSA-N	0	3	320.343	2.195	10	0		DEAEHN
C[C@@H](Oc1cccc(Cl)c1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263217862	145337198	/nfs/dbraw/zinc/33/71/98/145337198.db2.gz	LFRZWZZWQWRHKV-MFKMUULPSA-N	0	3	322.796	2.439	10	0		DEAEHN
C[C@@H](Cc1ccccc1F)c1nc([C@H]2CNCCN2C)no1	ZINC000263227214	145338659	/nfs/dbraw/zinc/33/86/59/145338659.db2.gz	MZLSMISFBVSHJN-SMDDNHRTSA-N	0	3	304.369	2.131	10	0		DEAEHN
CC(=O)CCC(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]12	ZINC000309812880	145350672	/nfs/dbraw/zinc/35/06/72/145350672.db2.gz	XBMHPRCTAJRZST-KZNAEPCWSA-N	0	3	314.429	2.382	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCC[C@@](C)(O)CC1	ZINC000336718202	145397423	/nfs/dbraw/zinc/39/74/23/145397423.db2.gz	REQWVULMEJXGBX-GOSISDBHSA-N	0	3	304.434	2.272	10	0		DEAEHN
COC(=O)c1cncc(N[C@H](C)CN(C)Cc2ccccc2)n1	ZINC000336713364	145397465	/nfs/dbraw/zinc/39/74/65/145397465.db2.gz	MSXXURIFPXOGCG-CYBMUJFWSA-N	0	3	314.389	2.196	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCCOCc1ccc(OC)cc1	ZINC000357169973	147055642	/nfs/dbraw/zinc/05/56/42/147055642.db2.gz	CQFYZFMICQSYMB-KRWDZBQOSA-N	0	3	320.433	2.202	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@H](C)N2CCC[C@@H](C)C2)C1	ZINC000358603414	147164702	/nfs/dbraw/zinc/16/47/02/147164702.db2.gz	KAHVULVVURLCFE-CABCVRRESA-N	0	3	311.470	2.175	10	0		DEAEHN
O=C1[C@H](NCc2ccc(C3CC3)cc2)CCN1C1CCOCC1	ZINC000359079506	147258212	/nfs/dbraw/zinc/25/82/12/147258212.db2.gz	GSTAPYWLJZZTCH-GOSISDBHSA-N	0	3	314.429	2.434	10	0		DEAEHN
C[C@@H](C(=O)NCc1ccc2cc[nH]c2n1)N1[C@H](C)CC[C@H]1C	ZINC000359422358	147325129	/nfs/dbraw/zinc/32/51/29/147325129.db2.gz	MRKLHTLHBXQNHT-UPJWGTAASA-N	0	3	300.406	2.440	10	0		DEAEHN
CCOCc1nc([C@H](C)NC(=O)[C@H](C)N2[C@H](C)CC[C@@H]2C)no1	ZINC000359506327	147339485	/nfs/dbraw/zinc/33/94/85/147339485.db2.gz	MBRNGKWKAQGLFL-RNJOBUHISA-N	0	3	324.425	2.045	10	0		DEAEHN
CN(Cc1cccc(Br)c1)[C@]1(CO)CCOC1	ZINC000359571643	147353544	/nfs/dbraw/zinc/35/35/44/147353544.db2.gz	LOKWDRAXQIPLRW-ZDUSSCGKSA-N	0	3	300.196	2.032	10	0		DEAEHN
COc1cccc(CNC[C@@H]2CCC3(CCOCC3)[C@H]2O)c1F	ZINC000374719587	148282246	/nfs/dbraw/zinc/28/22/46/148282246.db2.gz	VVTZXGZMVXYHOM-YOEHRIQHSA-N	0	3	323.408	2.492	10	0		DEAEHN
Cc1c(C(=O)NCCN(C)C)cnn1-c1ccccc1Cl	ZINC000112206568	401733621	/nfs/dbraw/zinc/73/36/21/401733621.db2.gz	ORILVPGYHCSSID-UHFFFAOYSA-N	0	3	306.797	2.126	10	0		DEAEHN
Fc1ccc(Br)cc1CNCCCn1ccnn1	ZINC000126467346	401695933	/nfs/dbraw/zinc/69/59/33/401695933.db2.gz	RIUGNIZNIDTNFA-UHFFFAOYSA-N	0	3	313.174	2.360	10	0		DEAEHN
CCOc1ccccc1OCCN1CCC(C(=O)N(C)C)CC1	ZINC000075590513	401763235	/nfs/dbraw/zinc/76/32/35/401763235.db2.gz	VBSKPTIGDNRAGG-UHFFFAOYSA-N	0	3	320.433	2.264	10	0		DEAEHN
Cc1ccc(OCC(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1C	ZINC000113232234	401771538	/nfs/dbraw/zinc/77/15/38/401771538.db2.gz	PAWQQTHDTBZAGY-JKSUJKDBSA-N	0	3	302.418	2.377	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1Cc1nc(-c2ccsc2)no1	ZINC000113269356	401773721	/nfs/dbraw/zinc/77/37/21/401773721.db2.gz	KKMVXHOHWPVFNG-WCQYABFASA-N	0	3	304.419	2.467	10	0		DEAEHN
COc1ccc(C(=O)NC2CCC(C[NH+](C)C)CC2)c([O-])c1	ZINC000130440587	401832112	/nfs/dbraw/zinc/83/21/12/401832112.db2.gz	VRDHOBSIMHVYKF-UHFFFAOYSA-N	0	3	306.406	2.251	10	0		DEAEHN
CN(C)C(=O)c1cccc(CN2CC[C@H](c3cnn(C)c3)C2)c1	ZINC000116313410	401849656	/nfs/dbraw/zinc/84/96/56/401849656.db2.gz	XIPZXXDCVHWZPO-INIZCTEOSA-N	0	3	312.417	2.111	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1cccc(C[S@](C)=O)c1	ZINC000078614811	401858632	/nfs/dbraw/zinc/85/86/32/401858632.db2.gz	IQWLWFQBHDTECD-KSFYIVLOSA-N	0	3	324.490	2.271	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2cc(Cl)ccc2Cl)CCO1	ZINC000116788391	401859315	/nfs/dbraw/zinc/85/93/15/401859315.db2.gz	DNHNUVDKSQJSJU-LLVKDONJSA-N	0	3	317.216	2.396	10	0		DEAEHN
C[C@H](SCc1ccccc1)C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000116793516	401859321	/nfs/dbraw/zinc/85/93/21/401859321.db2.gz	OCWMVFVJVPQTNG-HOCLYGCPSA-N	0	3	322.474	2.097	10	0		DEAEHN
Cc1ccc(CCCCC(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000116789311	401859448	/nfs/dbraw/zinc/85/94/48/401859448.db2.gz	JCKREYJNQMOPRG-GOSISDBHSA-N	0	3	318.461	2.497	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2csc3ccccc23)CCO1	ZINC000116789938	401859451	/nfs/dbraw/zinc/85/94/51/401859451.db2.gz	KTBDIBWOEQVXKX-LBPRGKRZSA-N	0	3	304.415	2.304	10	0		DEAEHN
C[C@H](NC[C@@H](O)COCc1ccco1)c1ccc2c(c1)OCO2	ZINC000030536021	401864103	/nfs/dbraw/zinc/86/41/03/401864103.db2.gz	KFKKOUQTVYFTNN-GXTWGEPZSA-N	0	3	319.357	2.237	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC[C@H](c2cc[nH]n2)C1	ZINC000114933357	401815138	/nfs/dbraw/zinc/81/51/38/401815138.db2.gz	RISKXKWKOZBMPQ-GJZGRUSLSA-N	0	3	321.469	2.275	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)C[C@H]1CCCCO1	ZINC000087159801	401928331	/nfs/dbraw/zinc/92/83/31/401928331.db2.gz	OUBIBHDXYXHJBL-IAGOWNOFSA-N	0	3	304.434	2.235	10	0		DEAEHN
O=C(NCCN1CCCC1)c1ccn(-c2cccc(Cl)c2)n1	ZINC000079796251	401881169	/nfs/dbraw/zinc/88/11/69/401881169.db2.gz	NCKPWBZXVMRCMK-UHFFFAOYSA-N	0	3	318.808	2.351	10	0		DEAEHN
C[C@@H](Oc1cccnc1)C(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000117746970	401882691	/nfs/dbraw/zinc/88/26/91/401882691.db2.gz	PCTBBNHFUMNBLV-RHSMWYFYSA-N	0	3	313.401	2.268	10	0		DEAEHN
COc1cc(C[NH2+][C@@H]2CCO[C@H]2C)cc(Br)c1[O-]	ZINC000135312061	401935156	/nfs/dbraw/zinc/93/51/56/401935156.db2.gz	SIDMTCYVGRJIFF-GZMMTYOYSA-N	0	3	316.195	2.430	10	0		DEAEHN
Cc1ccc(CN[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1	ZINC000035230391	401896945	/nfs/dbraw/zinc/89/69/45/401896945.db2.gz	JOCJCYBWIJPVBI-CYBMUJFWSA-N	0	3	304.415	2.493	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCC(C)(C)c1cccc(F)c1	ZINC000118572415	401901169	/nfs/dbraw/zinc/90/11/69/401901169.db2.gz	VAXNQSYIWORPGZ-HNNXBMFYSA-N	0	3	307.413	2.497	10	0		DEAEHN
CCc1ccc(S(=O)(=O)NC[C@@H](C)N(CC)CC)s1	ZINC000036076789	401901776	/nfs/dbraw/zinc/90/17/76/401901776.db2.gz	ZQCTYSINTOEJAO-LLVKDONJSA-N	0	3	304.481	2.319	10	0		DEAEHN
CCCOc1ccccc1NC(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000118794967	401907784	/nfs/dbraw/zinc/90/77/84/401907784.db2.gz	KMLOKUBYBOJEFZ-AWEZNQCLSA-N	0	3	321.421	2.270	10	0		DEAEHN
COC(=O)[C@@H](O)C1CCN([C@@H](C)c2cccc(OC)c2)CC1	ZINC000135352498	401936930	/nfs/dbraw/zinc/93/69/30/401936930.db2.gz	RTZQKDMHUVXJMB-LRDDRELGSA-N	0	3	307.390	2.002	10	0		DEAEHN
C[C@@H]1CC[C@H](CC(=O)N2CCCC[C@H](N3CCN(C)CC3)C2)C1	ZINC000150823335	401997858	/nfs/dbraw/zinc/99/78/58/401997858.db2.gz	FRYQCIMYNAWYRT-SQNIBIBYSA-N	0	3	321.509	2.441	10	0		DEAEHN
CCOCCC1(CNC(=O)NC[C@@H]2CCCN2C)CCCC1	ZINC000119922744	401971507	/nfs/dbraw/zinc/97/15/07/401971507.db2.gz	HZLIPBKAHQLTTI-HNNXBMFYSA-N	0	3	311.470	2.367	10	0		DEAEHN
CCN(C[C@H](O)COC(C)(C)C)C[C@H]1COc2ccccc2O1	ZINC000046704970	401971996	/nfs/dbraw/zinc/97/19/96/401971996.db2.gz	DCORKMQWYRVKEN-GJZGRUSLSA-N	0	3	323.433	2.324	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)NCCc1cccnc1)c1ccccc1	ZINC000119963044	401973342	/nfs/dbraw/zinc/97/33/42/401973342.db2.gz	PSTGTIFSKJYHQT-QGZVFWFLSA-N	0	3	312.417	2.226	10	0		DEAEHN
CCOc1cccc(CN2CCN(C[C@@H](C)O)[C@@H](CC)C2)c1	ZINC000120677882	401998599	/nfs/dbraw/zinc/99/85/99/401998599.db2.gz	RLVYEZJSSVELLJ-WBVHZDCISA-N	0	3	306.450	2.362	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@H](c1ccccc1)N(C)C	ZINC000137111504	401979187	/nfs/dbraw/zinc/97/91/87/401979187.db2.gz	LBCIXODEBOHKAJ-SJORKVTESA-N	0	3	305.466	2.382	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCO[C@@H](c2cccs2)C1)N(C)C1CC1	ZINC000120166019	401980674	/nfs/dbraw/zinc/98/06/74/401980674.db2.gz	QKKLIMBQFRXJOM-GXTWGEPZSA-N	0	3	323.462	2.314	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H]1CCN(C)c2ccccc21)N(C)C	ZINC000137717258	401985153	/nfs/dbraw/zinc/98/51/53/401985153.db2.gz	FECJXLLRYQLVAX-WMLDXEAASA-N	0	3	303.450	2.457	10	0		DEAEHN
CCc1cccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000120452261	401990487	/nfs/dbraw/zinc/99/04/87/401990487.db2.gz	UBCMZBQFAKSPMN-CJNGLKHVSA-N	0	3	317.433	2.129	10	0		DEAEHN
CC(C)(C)OC(=O)N1C[C@H](N)[C@H](c2nccc3[nH]ccc32)C1	ZINC000089220770	401938954	/nfs/dbraw/zinc/93/89/54/401938954.db2.gz	VCNPCIVVKYWICT-NEPJUHHUSA-N	0	3	302.378	2.225	10	0		DEAEHN
O=C(c1cc(C2CCCCC2)[nH]n1)N1CCN(C2CC2)CC1	ZINC000119342394	401942937	/nfs/dbraw/zinc/94/29/37/401942937.db2.gz	YIOJNKSEIBUJMX-UHFFFAOYSA-N	0	3	302.422	2.378	10	0		DEAEHN
COc1cc(OCc2ccccc2)c([C@@H](N)CN)cc1OC	ZINC000044470018	401943391	/nfs/dbraw/zinc/94/33/91/401943391.db2.gz	QEWZKBMGXBZJFJ-AWEZNQCLSA-N	0	3	302.374	2.241	10	0		DEAEHN
Cc1ccn(-c2ccccc2NC(=O)N(C)CCN(C)C)n1	ZINC000151248679	402025992	/nfs/dbraw/zinc/02/59/92/402025992.db2.gz	MHQQJFORHVRLLN-UHFFFAOYSA-N	0	3	301.394	2.206	10	0		DEAEHN
CC(C)c1ncc(Cl)c(C(=O)N2CCN3CCC[C@@H]3C2)n1	ZINC000050227589	402026780	/nfs/dbraw/zinc/02/67/80/402026780.db2.gz	ONJZYZLCDBCXBK-LLVKDONJSA-N	0	3	308.813	2.174	10	0		DEAEHN
O[C@H](COCc1ccco1)CN1CCCC[C@@H]1c1cn[nH]c1	ZINC000121826294	402053898	/nfs/dbraw/zinc/05/38/98/402053898.db2.gz	MQHSADRALMVEME-GOEBONIOSA-N	0	3	305.378	2.107	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)C(=O)c2ccc(Cl)cc2)[C@@H](C)C1	ZINC000150851327	401999939	/nfs/dbraw/zinc/99/99/39/401999939.db2.gz	KIRZFUGQQBFIPC-FZMZJTMJSA-N	0	3	308.809	2.368	10	0		DEAEHN
CC(C)C[C@H](CCO)CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000120861153	402004606	/nfs/dbraw/zinc/00/46/06/402004606.db2.gz	YOYNLUQJBYXUHU-OWCLPIDISA-N	0	3	313.486	2.155	10	0		DEAEHN
Cc1nn(C)cc1CN1CCC(C(=O)N[C@H](C)C(C)C)CC1	ZINC000092754568	402008555	/nfs/dbraw/zinc/00/85/55/402008555.db2.gz	XMEOGKXRVPMEOV-CYBMUJFWSA-N	0	3	306.454	2.101	10	0		DEAEHN
CCC(CC)CN1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000122718322	402091382	/nfs/dbraw/zinc/09/13/82/402091382.db2.gz	FEAFYLFQWKKIJZ-SFHVURJKSA-N	0	3	320.477	2.480	10	0		DEAEHN
CC(C)(C)OC(=O)N1CCC(N[C@@H]2CCCn3ncnc32)CC1	ZINC000152502837	402098145	/nfs/dbraw/zinc/09/81/45/402098145.db2.gz	SLGYYUCNCKDNHE-CYBMUJFWSA-N	0	3	321.425	2.102	10	0		DEAEHN
CCN(C(=O)CN1CCCN(C2CC2)CC1)C1CCCCC1	ZINC000061041337	402106954	/nfs/dbraw/zinc/10/69/54/402106954.db2.gz	WAJYOJXQZSAEGM-UHFFFAOYSA-N	0	3	307.482	2.338	10	0		DEAEHN
COc1ccccc1OCCC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000123144331	402112844	/nfs/dbraw/zinc/11/28/44/402112844.db2.gz	FPGWNHCAFYSTPK-GJZGRUSLSA-N	0	3	320.433	2.405	10	0		DEAEHN
COc1ccc(OC)c(CC(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000097359391	402122187	/nfs/dbraw/zinc/12/21/87/402122187.db2.gz	VAVAIRDBQYYUMR-HNNXBMFYSA-N	0	3	322.449	2.339	10	0		DEAEHN
CCCN(C)[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000123554027	402134351	/nfs/dbraw/zinc/13/43/51/402134351.db2.gz	IVNTTZAYVMZKIA-DOTOQJQBSA-N	0	3	303.450	2.107	10	0		DEAEHN
CCC1(CC)[C@H](NC(=O)N2CC[C@H](N3CC=CC3)C2)C[C@@H]1OC	ZINC000123740130	402144161	/nfs/dbraw/zinc/14/41/61/402144161.db2.gz	IEZJJMMVFQGHQN-XHSDSOJGSA-N	0	3	321.465	2.236	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cc3c(s2)CCOC3)CCN1C	ZINC000123771082	402145073	/nfs/dbraw/zinc/14/50/73/402145073.db2.gz	YEULMPPJNDHROU-YPMHNXCESA-N	0	3	308.447	2.376	10	0		DEAEHN
COCCOc1cccc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000123776004	402145862	/nfs/dbraw/zinc/14/58/62/402145862.db2.gz	DMLKIAKZCFRMKA-GDBMZVCRSA-N	0	3	320.433	2.267	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)Cc1ccccc1O	ZINC000101649931	402153112	/nfs/dbraw/zinc/15/31/12/402153112.db2.gz	KEKGYWGROZHOOP-QGZVFWFLSA-N	0	3	312.413	2.224	10	0		DEAEHN
COc1cccc(CNC(=O)[C@H](C(C)C)N2CCCCC2)n1	ZINC000104346594	402203484	/nfs/dbraw/zinc/20/34/84/402203484.db2.gz	QXFFYLYLNTWHRS-INIZCTEOSA-N	0	3	305.422	2.217	10	0		DEAEHN
CC(C)CO[C@@H]1CCN(C[C@H](O)COCc2ccccc2)C1	ZINC000124618940	402188843	/nfs/dbraw/zinc/18/88/43/402188843.db2.gz	JKJVYNMXOVNTHL-ZWKOTPCHSA-N	0	3	307.434	2.311	10	0		DEAEHN
CN(C(=O)C[C@@H]1CCOc2ccccc21)[C@H]1CCCN(C)C1	ZINC000153747330	402168182	/nfs/dbraw/zinc/16/81/82/402168182.db2.gz	PNKOMVWPOYMXCU-GJZGRUSLSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCOCCNC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000067734299	402170583	/nfs/dbraw/zinc/17/05/83/402170583.db2.gz	LPKKJOWFLCHGOF-QGZVFWFLSA-N	0	3	319.449	2.377	10	0		DEAEHN
CC(C)N(C)CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2	ZINC000102915309	402174686	/nfs/dbraw/zinc/17/46/86/402174686.db2.gz	AUROPWODEXDBAA-AWEZNQCLSA-N	0	3	304.390	2.419	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)[C@@H](Cc1ccccc1)N(C)C	ZINC000106905640	402221128	/nfs/dbraw/zinc/22/11/28/402221128.db2.gz	WIUKIYKPHOTIGD-SJLPKXTDSA-N	0	3	317.477	2.150	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000107839982	402241683	/nfs/dbraw/zinc/24/16/83/402241683.db2.gz	KHHWKSWCOQRRLL-HNNXBMFYSA-N	0	3	314.433	2.494	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N[C@@H]1CCO[C@H](C2CC2)C1	ZINC000125788114	402250524	/nfs/dbraw/zinc/25/05/24/402250524.db2.gz	OACWEPYFGQQUJN-OAGGEKHMSA-N	0	3	311.470	2.220	10	0		DEAEHN
Cc1ccc([C@H](CNC(=O)c2c[nH]c(=O)cc2C)N(C)C)cc1	ZINC000125944272	402257744	/nfs/dbraw/zinc/25/77/44/402257744.db2.gz	XCXDVGLBRQWPPE-INIZCTEOSA-N	0	3	313.401	2.024	10	0		DEAEHN
COc1cccc([C@H]2C[C@@H](O)CN2Cc2ccc(CO)cc2)c1	ZINC000225731190	402323291	/nfs/dbraw/zinc/32/32/91/402323291.db2.gz	QZCKZBWTPSLQBI-IEBWSBKVSA-N	0	3	313.397	2.495	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)CCC(=O)c2ccccc2)[C@@H](C)C1	ZINC000155798547	402267831	/nfs/dbraw/zinc/26/78/31/402267831.db2.gz	PBJGEKYDPFBUJU-HOCLYGCPSA-N	0	3	302.418	2.494	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)Nc2cnc(C3CC3)nc2)CCN1C	ZINC000176113432	402280138	/nfs/dbraw/zinc/28/01/38/402280138.db2.gz	LLPCZIPXTJAAFT-FZMZJTMJSA-N	0	3	303.410	2.300	10	0		DEAEHN
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C1(O)CCC1	ZINC000184709851	402293736	/nfs/dbraw/zinc/29/37/36/402293736.db2.gz	MUCHJAYMPOPTID-MRXNPFEDSA-N	0	3	302.418	2.072	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NC2Cc3ccccc3C2)CCN1C	ZINC000184918450	402309251	/nfs/dbraw/zinc/30/92/51/402309251.db2.gz	FSVUCCZJTJKBQR-CXAGYDPISA-N	0	3	301.434	2.278	10	0		DEAEHN
CCN(CCNC(=O)c1sc([C@H](C)OC)nc1C)C1CC1	ZINC000176458368	402311157	/nfs/dbraw/zinc/31/11/57/402311157.db2.gz	DGEBBFPMZOJJRX-NSHDSACASA-N	0	3	311.451	2.373	10	0		DEAEHN
CC(C)[C@](C)(O)CN1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000184956271	402312625	/nfs/dbraw/zinc/31/26/25/402312625.db2.gz	OROFZSKWFNIEAJ-GOSISDBHSA-N	0	3	322.424	2.381	10	0		DEAEHN
CCOc1cccnc1C(=O)NC1C[C@H]2CCC[C@@H](C1)N2C	ZINC000176497581	402314501	/nfs/dbraw/zinc/31/45/01/402314501.db2.gz	VVAJOUMXSKDWMW-AGUYFDCRSA-N	0	3	303.406	2.225	10	0		DEAEHN
c1ncc(N2CCN3CCC[C@@H]3C2)nc1OC1CCCCC1	ZINC000185379658	402348450	/nfs/dbraw/zinc/34/84/50/402348450.db2.gz	AXWUAXGMIZJZTA-CQSZACIVSA-N	0	3	302.422	2.473	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NC(=O)N(C)CCN(C)C1CC1	ZINC000185478412	402355071	/nfs/dbraw/zinc/35/50/71/402355071.db2.gz	ROEZEVNWZPZOQL-HNNXBMFYSA-N	0	3	319.449	2.327	10	0		DEAEHN
CCOc1ccccc1OCC(=O)N(C)C[C@@H]1CCCN1CC	ZINC000176985075	402356878	/nfs/dbraw/zinc/35/68/78/402356878.db2.gz	XJLUUWGTICZTSG-HNNXBMFYSA-N	0	3	320.433	2.407	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cccc(OC)c1OC	ZINC000177016434	402359925	/nfs/dbraw/zinc/35/99/25/402359925.db2.gz	WBZCHNYKJUXMJL-ZDUSSCGKSA-N	0	3	306.406	2.260	10	0		DEAEHN
COC(=O)[C@@](C)(O)CN[C@H](C)c1ccc(Br)cc1	ZINC000228641928	402339077	/nfs/dbraw/zinc/33/90/77/402339077.db2.gz	QIQFAJBSYNSQKS-RNCFNFMXSA-N	0	3	316.195	2.024	10	0		DEAEHN
C[C@H](c1ccccc1Cl)N1CCN(C(=O)C2(N)CC2)CC1	ZINC000237413962	402407578	/nfs/dbraw/zinc/40/75/78/402407578.db2.gz	OUUGFFMMOMRFRQ-GFCCVEGCSA-N	0	3	307.825	2.037	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCOCc1ccccc1	ZINC000177577473	402417533	/nfs/dbraw/zinc/41/75/33/402417533.db2.gz	NHYMOXXCFNBWTC-QGZVFWFLSA-N	0	3	319.449	2.329	10	0		DEAEHN
CC(C)c1cccc(NC(=O)C(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000177680501	402426110	/nfs/dbraw/zinc/42/61/10/402426110.db2.gz	JYCIADFEQMCUCJ-INIZCTEOSA-N	0	3	315.417	2.055	10	0		DEAEHN
C[C@H](NCC(=O)NC(C)(C)C)c1ccc(-n2cccn2)cc1	ZINC000177765689	402434078	/nfs/dbraw/zinc/43/40/78/402434078.db2.gz	CBBNCMSCDBBGTC-ZDUSSCGKSA-N	0	3	300.406	2.438	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)CN[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000163077978	402440783	/nfs/dbraw/zinc/44/07/83/402440783.db2.gz	ZRQQVLOYMKNNNE-KBPBESRZSA-N	0	3	315.421	2.079	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N[C@@H](CCO)c2ccco2)C12CCOCC2	ZINC000186556995	402441857	/nfs/dbraw/zinc/44/18/57/402441857.db2.gz	XBPXTALGBPITMZ-NUEKZKHPSA-N	0	3	309.406	2.267	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)[C@H](O)c1ccccc1Cl	ZINC000161636727	402394099	/nfs/dbraw/zinc/39/40/99/402394099.db2.gz	AEUBZVWRCLFRQG-SWLSCSKDSA-N	0	3	312.841	2.466	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C(=O)NC1CC1)c1ccccc1	ZINC000245476172	402464521	/nfs/dbraw/zinc/46/45/21/402464521.db2.gz	SNTGAHDAZWJOFJ-ZWKOTPCHSA-N	0	3	315.461	2.422	10	0		DEAEHN
Cc1ccc(CN2CCC(c3ccnn3CCO)CC2)c(C)n1	ZINC000186913833	402471334	/nfs/dbraw/zinc/47/13/34/402471334.db2.gz	OEVQOSUTLWRODT-UHFFFAOYSA-N	0	3	314.433	2.267	10	0		DEAEHN
CN(C)CCNC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1	ZINC000186976689	402475095	/nfs/dbraw/zinc/47/50/95/402475095.db2.gz	NUPPKYWEEMDFMU-UHFFFAOYSA-N	0	3	300.324	2.415	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cnn(C(C)C)c1C	ZINC000245640250	402476058	/nfs/dbraw/zinc/47/60/58/402476058.db2.gz	YJFPZJOXXUBTQD-CABCVRRESA-N	0	3	304.438	2.471	10	0		DEAEHN
Cc1ccc(CN2CCC[C@@H](CN3CCOCC3)C2)c(C)n1	ZINC000187024731	402478445	/nfs/dbraw/zinc/47/84/45/402478445.db2.gz	RYDCEBPYBOSLSJ-KRWDZBQOSA-N	0	3	303.450	2.243	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@@H]1CCN(c2ccccc2)C1=O	ZINC000178296562	402481139	/nfs/dbraw/zinc/48/11/39/402481139.db2.gz	SMIFZRXUANJBPU-ZWKOTPCHSA-N	0	3	324.428	2.461	10	0		DEAEHN
CCN(CCO)CCNC(=O)N[C@@H](C)c1ccc(C(C)C)cc1	ZINC000187083278	402481493	/nfs/dbraw/zinc/48/14/93/402481493.db2.gz	YVDPDIGEDDEVOX-HNNXBMFYSA-N	0	3	321.465	2.484	10	0		DEAEHN
COC(=O)[C@@]1(C)CCN(CCN(C)Cc2ccc(F)cc2)C1	ZINC000187167648	402486030	/nfs/dbraw/zinc/48/60/30/402486030.db2.gz	OCXLHVZOZLTYIF-KRWDZBQOSA-N	0	3	308.397	2.143	10	0		DEAEHN
COc1c(C)cc(CN2C[C@H](N3CCOCC3)[C@@H](C)C2)cc1C	ZINC000245810988	402489695	/nfs/dbraw/zinc/48/96/95/402489695.db2.gz	ZJXIYKOOPIHHDE-WMZOPIPTSA-N	0	3	318.461	2.465	10	0		DEAEHN
CCCC(=O)N[C@@H]1CCCN([C@H]2Cc3ccccc3[C@H]2O)C1	ZINC000245859425	402492071	/nfs/dbraw/zinc/49/20/71/402492071.db2.gz	OKJIMKRQQZYDPO-UWWQBHOKSA-N	0	3	302.418	2.025	10	0		DEAEHN
C[C@H](C(=O)N[C@@H]1Cc2ccccc2[C@@H]1O)N1[C@H](C)CC[C@@H]1C	ZINC000246026028	402504081	/nfs/dbraw/zinc/50/40/81/402504081.db2.gz	WSFOAFXJIXSUMU-IJNPPISZSA-N	0	3	302.418	2.022	10	0		DEAEHN
CC1(C)CC[C@H](CN[C@H](Cc2ccc(Cl)cc2)C(N)=O)O1	ZINC000187648314	402507200	/nfs/dbraw/zinc/50/72/00/402507200.db2.gz	NBQKFJTXIFGQIN-ZIAGYGMSSA-N	0	3	310.825	2.284	10	0		DEAEHN
CC[C@@H]1CN(Cc2cccc(COC)c2)CCN1C[C@H](C)O	ZINC000246913150	402548876	/nfs/dbraw/zinc/54/88/76/402548876.db2.gz	SBBYKQPMIFSNBE-MAUKXSAKSA-N	0	3	306.450	2.110	10	0		DEAEHN
CC(=O)Nc1ccc(C)c(NC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000171077443	402555339	/nfs/dbraw/zinc/55/53/39/402555339.db2.gz	LEGZENYLUBMEDV-CQSZACIVSA-N	0	3	304.394	2.121	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCC[C@H]2CCC[C@H]21	ZINC000247069268	402555811	/nfs/dbraw/zinc/55/58/11/402555811.db2.gz	YFNOKXGOEWPRAH-BZUAXINKSA-N	0	3	309.454	2.071	10	0		DEAEHN
Cc1nn(-c2ccccc2)cc1C(=O)N1CCN2CCC[C@@H]2C1	ZINC000171089890	402556484	/nfs/dbraw/zinc/55/64/84/402556484.db2.gz	NKQCKJKZYPSTAD-MRXNPFEDSA-N	0	3	310.401	2.101	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1c(Cl)nc2ccccn21	ZINC000247313726	402563593	/nfs/dbraw/zinc/56/35/93/402563593.db2.gz	OFLKTOZYRCDGJK-NEPJUHHUSA-N	0	3	318.808	2.296	10	0		DEAEHN
COCCCN1CCC(NC(=O)N[C@@H](C)c2ccc(C)o2)CC1	ZINC000171192037	402565521	/nfs/dbraw/zinc/56/55/21/402565521.db2.gz	ROKQPGLFPSUHIX-AWEZNQCLSA-N	0	3	323.437	2.449	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)C2C[C@H]3CCC[C@@H](C2)C3=O)C1	ZINC000247442922	402567209	/nfs/dbraw/zinc/56/72/09/402567209.db2.gz	SDGAVEPLJIQAMU-WOFIAXNJSA-N	0	3	306.450	2.227	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)CC1CCCCC1	ZINC000247486032	402568832	/nfs/dbraw/zinc/56/88/32/402568832.db2.gz	TVJDGKAOLWNPFD-ZFWWWQNUSA-N	0	3	300.468	2.065	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1Cc1nc(Cc2ccccc2)no1	ZINC000247492966	402569306	/nfs/dbraw/zinc/56/93/06/402569306.db2.gz	UJEZQHMYKHKBIQ-HOCLYGCPSA-N	0	3	312.417	2.329	10	0		DEAEHN
Cc1nn(C)c2sc(C(=O)N[C@H]3CN(C(C)C)C[C@H]3C)cc12	ZINC000247491911	402569584	/nfs/dbraw/zinc/56/95/84/402569584.db2.gz	WXIMRUVCQVZQLD-MFKMUULPSA-N	0	3	320.462	2.402	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(-n2cccn2)cc1	ZINC000247499533	402569653	/nfs/dbraw/zinc/56/96/53/402569653.db2.gz	UXUUWTXLKPGNII-YOEHRIQHSA-N	0	3	310.401	2.181	10	0		DEAEHN
Cc1ccsc1CNC(=O)CN(C)[C@]1(CO)CC[C@H](C)C1	ZINC000188008853	402514972	/nfs/dbraw/zinc/51/49/72/402514972.db2.gz	MSGDHNHHYRWZFN-BLLLJJGKSA-N	0	3	310.463	2.156	10	0		DEAEHN
CSc1ccc(NC(=O)CN2CCN3CCC[C@H]3C2)cc1	ZINC000246222130	402519216	/nfs/dbraw/zinc/51/92/16/402519216.db2.gz	BMEHLDRYZVUGOO-AWEZNQCLSA-N	0	3	305.447	2.127	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](C)c1ccccc1)N1CC[C@H](N2CCCC2)C1	ZINC000170746543	402519694	/nfs/dbraw/zinc/51/96/94/402519694.db2.gz	PZBJNHGLJCOYKL-JZXOWHBKSA-N	0	3	315.461	2.422	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)[C@H](Cc1ccccc1)N(C)C	ZINC000247653865	402573655	/nfs/dbraw/zinc/57/36/55/402573655.db2.gz	XMYSAZBASYVXIJ-ROUUACIJSA-N	0	3	317.477	2.150	10	0		DEAEHN
CC(C)N(CCN(C)C)C(=O)N[C@H](C)c1ccc2c(c1)OCO2	ZINC000178715425	402529635	/nfs/dbraw/zinc/52/96/35/402529635.db2.gz	UQNRKUOENICFNG-CYBMUJFWSA-N	0	3	321.421	2.458	10	0		DEAEHN
CO[C@@H]1CN(C[C@H](O)COc2c(C)cccc2C)CC[C@@H]1C	ZINC000189313630	402534198	/nfs/dbraw/zinc/53/41/98/402534198.db2.gz	QBEMHJPJZMDPEN-RRQGHBQHSA-N	0	3	307.434	2.400	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000246532671	402535573	/nfs/dbraw/zinc/53/55/73/402535573.db2.gz	IXMPLQNRYLZPJO-OZSLIKBDSA-N	0	3	318.461	2.467	10	0		DEAEHN
CC1CCN(c2ccc(C(=O)N3CC[C@@H](N(C)C)C3)cn2)CC1	ZINC000170868391	402535648	/nfs/dbraw/zinc/53/56/48/402535648.db2.gz	HXDTYEKSCLZSOD-MRXNPFEDSA-N	0	3	316.449	2.094	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1sc(COC)nc1C	ZINC000247980004	402579342	/nfs/dbraw/zinc/57/93/42/402579342.db2.gz	HHELGXQBCDHFKM-STQMWFEESA-N	0	3	323.462	2.297	10	0		DEAEHN
CC[C@H](C)c1ccc(S(=O)(=O)N[C@@H]2CNCC[C@H]2C)cc1	ZINC000249360079	402626716	/nfs/dbraw/zinc/62/67/16/402626716.db2.gz	AFOPAZWEKMJYQP-WOSRLPQWSA-N	0	3	310.463	2.476	10	0		DEAEHN
CCN(CC(C)(C)O)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248145713	402583718	/nfs/dbraw/zinc/58/37/18/402583718.db2.gz	ZOEFJBZHTBQPRM-HOTGVXAUSA-N	0	3	319.449	2.234	10	0		DEAEHN
CCN(C)[C@H](C(=O)N1CCN2CCCC[C@@H]2C1)c1ccccc1	ZINC000171477298	402588989	/nfs/dbraw/zinc/58/89/89/402588989.db2.gz	VQTAGBCKMBXNFC-MSOLQXFVSA-N	0	3	315.461	2.376	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)C[C@H](C)c2nccs2)C1	ZINC000248452740	402591203	/nfs/dbraw/zinc/59/12/03/402591203.db2.gz	JSQOHDSOZMXNOT-QWHCGFSZSA-N	0	3	310.467	2.372	10	0		DEAEHN
CCSCc1cc(C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)no1	ZINC000248646266	402601078	/nfs/dbraw/zinc/60/10/78/402601078.db2.gz	RSTJLCPHXMSPAG-BXUZGUMPSA-N	0	3	311.451	2.386	10	0		DEAEHN
CCOC(=O)[C@H](CC)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000248657359	402602247	/nfs/dbraw/zinc/60/22/47/402602247.db2.gz	SITDGDGMLQEAAH-IRXDYDNUSA-N	0	3	319.449	2.177	10	0		DEAEHN
CN(Cc1cccnc1)C[C@H]1CCN(Cc2cscn2)C1	ZINC000190477606	402604045	/nfs/dbraw/zinc/60/40/45/402604045.db2.gz	CXLVCEXTEMUEFF-OAHLLOKOSA-N	0	3	302.447	2.492	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1nc2cccnc2s1	ZINC000248733644	402605968	/nfs/dbraw/zinc/60/59/68/402605968.db2.gz	MEXURVAJMKGKDQ-QWRGUYRKSA-N	0	3	302.403	2.000	10	0		DEAEHN
Cc1cccc(C)c1OC[C@H](O)CN1[C@H](C)C[C@@H](O)C[C@@H]1C	ZINC000248823207	402610065	/nfs/dbraw/zinc/61/00/65/402610065.db2.gz	JMXOSSFRTCNOQU-YYIAUSFCSA-N	0	3	307.434	2.277	10	0		DEAEHN
CC(C)[C@@H](C)CNC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000180461509	402617519	/nfs/dbraw/zinc/61/75/19/402617519.db2.gz	VSMHVUJYNJZFGL-IRXDYDNUSA-N	0	3	324.513	2.090	10	0		DEAEHN
CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)NC(C)(C)C)C1	ZINC000190677680	402617617	/nfs/dbraw/zinc/61/76/17/402617617.db2.gz	ZRGSLMFGTBNJRD-HNNXBMFYSA-N	0	3	304.438	2.343	10	0		DEAEHN
Cc1cc2c(cc1C)[C@@H](NC[C@H]1CN(C)CCO1)CCCO2	ZINC000180490053	402618218	/nfs/dbraw/zinc/61/82/18/402618218.db2.gz	YJFPPYAMQNYUMF-RDJZCZTQSA-N	0	3	304.434	2.437	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@@H]2c3ccccc3C[C@H]2O)C12CCOCC2	ZINC000249048153	402618432	/nfs/dbraw/zinc/61/84/32/402618432.db2.gz	WJOJPPJKOUTQRI-XMTFNYHQSA-N	0	3	317.429	2.209	10	0		DEAEHN
CC[C@](C)(O)CN[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1	ZINC000249076574	402619436	/nfs/dbraw/zinc/61/94/36/402619436.db2.gz	RCCGEVROHORUDB-BPUTZDHNSA-N	0	3	310.825	2.362	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1noc2c1CCCCC2	ZINC000249091250	402620100	/nfs/dbraw/zinc/62/01/00/402620100.db2.gz	VVFQXYLHSIDHBF-STQMWFEESA-N	0	3	303.406	2.252	10	0		DEAEHN
CCN1CC[C@@H](N(C)C(=O)[C@H]2C[C@@H](C(C)=O)C2(C)C)[C@@H](C)C1	ZINC000249084505	402620298	/nfs/dbraw/zinc/62/02/98/402620298.db2.gz	RWLQURBLOQPZOE-ARLBYUKCSA-N	0	3	308.466	2.426	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000249140126	402621780	/nfs/dbraw/zinc/62/17/80/402621780.db2.gz	FNITWOFKRXTLOX-BBRMVZONSA-N	0	3	317.433	2.129	10	0		DEAEHN
COCCN1CCC[C@H]1CN[C@@H](c1ncc[nH]1)c1ccccc1	ZINC000249182771	402623221	/nfs/dbraw/zinc/62/32/21/402623221.db2.gz	JBROTAPHLLFFGL-DLBZAZTESA-N	0	3	314.433	2.200	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(C(=O)CN(CC)C2CC2)C1	ZINC000179168836	402577741	/nfs/dbraw/zinc/57/77/41/402577741.db2.gz	AHWSDBXHUYMUFT-OAHLLOKOSA-N	0	3	304.438	2.093	10	0		DEAEHN
COCCN1CCC(NC(=O)NC/C=C/c2ccccc2)CC1	ZINC000171869530	402630526	/nfs/dbraw/zinc/63/05/26/402630526.db2.gz	PPWPOEWRNLYEGW-VMPITWQZSA-N	0	3	317.433	2.110	10	0		DEAEHN
CC(=O)Nc1cccc2c1CCN(C(=O)[C@@]1(C)CCCCN1)C2	ZINC000180932412	402630695	/nfs/dbraw/zinc/63/06/95/402630695.db2.gz	PAXLICJUTFSOBD-GOSISDBHSA-N	0	3	315.417	2.062	10	0		DEAEHN
CC(C)c1nc(CCNC(=O)N2CCN3CCC[C@@H]3C2)cs1	ZINC000171906662	402632600	/nfs/dbraw/zinc/63/26/00/402632600.db2.gz	SXCQSCUIDPFAMH-CQSZACIVSA-N	0	3	322.478	2.299	10	0		DEAEHN
CC(C)c1nc(CCNC(=O)N2CCN3CCC[C@H]3C2)cs1	ZINC000171906663	402632698	/nfs/dbraw/zinc/63/26/98/402632698.db2.gz	SXCQSCUIDPFAMH-AWEZNQCLSA-N	0	3	322.478	2.299	10	0		DEAEHN
Cc1ccc2cc(CN3CCN(C[C@H](C)O)[C@H](C)C3)ccc2n1	ZINC000249985591	402643696	/nfs/dbraw/zinc/64/36/96/402643696.db2.gz	ZBNPFZHMVBFMDF-CVEARBPZSA-N	0	3	313.445	2.430	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCSCC[C@H]1C	ZINC000191119630	402643865	/nfs/dbraw/zinc/64/38/65/402643865.db2.gz	QXEPDAZIGQOGKH-KGLIPLIRSA-N	0	3	301.500	2.500	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NC[C@H](O)CC(C)(C)C	ZINC000172326691	402650084	/nfs/dbraw/zinc/65/00/84/402650084.db2.gz	FFFGZHHRPJKYQN-UONOGXRCSA-N	0	3	301.475	2.059	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@H](C)N2CCc3ccccc3C2)C1	ZINC000252441898	402652763	/nfs/dbraw/zinc/65/27/63/402652763.db2.gz	DKDKSSCQDFJUDL-MAUKXSAKSA-N	0	3	315.461	2.034	10	0		DEAEHN
C[C@@H]1C[C@H](C(=O)NC[C@H](O)CN2CCCCC2)CC(C)(C)C1	ZINC000182841883	402721059	/nfs/dbraw/zinc/72/10/59/402721059.db2.gz	GFQMFTQJKJKHEG-PMPSAXMXSA-N	0	3	310.482	2.412	10	0		DEAEHN
CCOCCN1CCN(Cc2ccccc2N(C)C)C[C@@H]1C	ZINC000173679689	402708049	/nfs/dbraw/zinc/70/80/49/402708049.db2.gz	FWASGJOZFLRIHK-INIZCTEOSA-N	0	3	305.466	2.295	10	0		DEAEHN
C[C@H](CNC(=O)N1CCCC[C@@H]1c1cn[nH]c1)N(C)C1CC1	ZINC000182701818	402710312	/nfs/dbraw/zinc/71/03/12/402710312.db2.gz	ZFHQGEMRDGXMDI-IUODEOHRSA-N	0	3	305.426	2.129	10	0		DEAEHN
Cc1nc(C)n(C[C@@H]2CCCN(Cc3ccc(CO)cc3)C2)n1	ZINC000182756804	402714064	/nfs/dbraw/zinc/71/40/64/402714064.db2.gz	HXEXPFYDPDIPKS-GOSISDBHSA-N	0	3	314.433	2.299	10	0		DEAEHN
CCc1nc(NC(=O)CN2CCCN(C3CC3)CC2)sc1C	ZINC000172544094	402662073	/nfs/dbraw/zinc/66/20/73/402662073.db2.gz	GYBWPPXMXFDCMP-UHFFFAOYSA-N	0	3	322.478	2.123	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N[C@H]1CCC(=O)N(C)C1)CCS2	ZINC000191516775	402675130	/nfs/dbraw/zinc/67/51/30/402675130.db2.gz	RMHVPVIZBNFHBM-FZMZJTMJSA-N	0	3	306.431	2.443	10	0		DEAEHN
CC1(C)[C@@H]2CN(CC(=O)N3CCC[C@H](C(F)(F)F)C3)C[C@@H]21	ZINC000172974747	402681480	/nfs/dbraw/zinc/68/14/80/402681480.db2.gz	QOMUNFUPWBMJBB-SDDRHHMPSA-N	0	3	304.356	2.375	10	0		DEAEHN
C[C@@H]1CN(CCC(=O)c2ccc(F)cc2)C[C@@H]1N1CCOCC1	ZINC000182421110	402688655	/nfs/dbraw/zinc/68/86/55/402688655.db2.gz	SIGOMSCWPBBEKQ-PBHICJAKSA-N	0	3	320.408	2.051	10	0		DEAEHN
O=C(N[C@H]1CCOc2ccccc21)N1CC[C@@H](N2CC=CC2)C1	ZINC000173373537	402694588	/nfs/dbraw/zinc/69/45/88/402694588.db2.gz	APSPGQNMZQBAHC-ZBFHGGJFSA-N	0	3	313.401	2.166	10	0		DEAEHN
C[C@@H](NCCN1C(=O)NC2(CCCC2)C1=O)c1cccs1	ZINC000182560118	402699707	/nfs/dbraw/zinc/69/97/07/402699707.db2.gz	FKQYUYZHCIFEHX-LLVKDONJSA-N	0	3	307.419	2.263	10	0		DEAEHN
Cn1nccc1C1CCN(C[C@H]2CC3(CCC3)C(=O)O2)CC1	ZINC000191978605	402701980	/nfs/dbraw/zinc/70/19/80/402701980.db2.gz	LGVAICYCWSCRHY-CQSZACIVSA-N	0	3	303.406	2.085	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2cn(C)nc2C2CCCCC2)CCO1	ZINC000182933626	402727790	/nfs/dbraw/zinc/72/77/90/402727790.db2.gz	QXWAJXCDLZVGJS-KRWDZBQOSA-N	0	3	320.481	2.230	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)NC[C@H](CC)N1CCc2ccccc2C1	ZINC000262653735	402729036	/nfs/dbraw/zinc/72/90/36/402729036.db2.gz	BODAKCGCSAJPOB-JCGIZDLHSA-N	0	3	317.477	2.313	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC(C(F)(F)F)CC2)C1	ZINC000174232500	402732953	/nfs/dbraw/zinc/73/29/53/402732953.db2.gz	JXCOYTXSZOQQOF-GFCCVEGCSA-N	0	3	307.360	2.455	10	0		DEAEHN
C[C@H](NCC(=O)N(C)CCCOc1ccccc1)[C@H]1CCCO1	ZINC000183124611	402741032	/nfs/dbraw/zinc/74/10/32/402741032.db2.gz	VCPRSCAAYOHKKK-DOTOQJQBSA-N	0	3	320.433	2.071	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2cnn(CC3CC3)c2)CCN1C	ZINC000174452726	402741764	/nfs/dbraw/zinc/74/17/64/402741764.db2.gz	ZEQGSBPFACNRPU-IUODEOHRSA-N	0	3	305.426	2.240	10	0		DEAEHN
CC(C)OC[C@@H](O)CN[C@H](C)c1ccccc1-n1cccn1	ZINC000183143777	402743041	/nfs/dbraw/zinc/74/30/41/402743041.db2.gz	XNXLOJTVXLMKPQ-CABCVRRESA-N	0	3	303.406	2.309	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@@]23CCCc2ccccc23)n1	ZINC000263228124	402748014	/nfs/dbraw/zinc/74/80/14/402748014.db2.gz	NCCNIDAIPYIBES-FRQCXROJSA-N	0	3	324.428	2.407	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2csc3c2CCCC3)n1	ZINC000263282428	402753838	/nfs/dbraw/zinc/75/38/38/402753838.db2.gz	UMWGUSVPYACQIT-LBPRGKRZSA-N	0	3	304.419	2.253	10	0		DEAEHN
Cc1ccccc1NC(=O)CCN1CCC(n2cncn2)CC1	ZINC000174764903	402756393	/nfs/dbraw/zinc/75/63/93/402756393.db2.gz	ZEEVGERAVHISBY-UHFFFAOYSA-N	0	3	313.405	2.252	10	0		DEAEHN
CCN1CCN(C[C@H](C)CNC(=O)N[C@@H](C)C2CCCC2)CC1	ZINC000174920236	402763074	/nfs/dbraw/zinc/76/30/74/402763074.db2.gz	UKZHCWZZGOTSNF-CVEARBPZSA-N	0	3	324.513	2.138	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)CSCc1ccccn1	ZINC000174972151	402768162	/nfs/dbraw/zinc/76/81/62/402768162.db2.gz	OLNWBQPRWQKNRO-HZPDHXFCSA-N	0	3	319.474	2.400	10	0		DEAEHN
COC[C@H](NC[C@@H](C)CS(C)(=O)=O)c1ccc(Cl)cc1	ZINC000193677655	402775275	/nfs/dbraw/zinc/77/52/75/402775275.db2.gz	OUBOCTUXUDMSDM-RISCZKNCSA-N	0	3	319.854	2.298	10	0		DEAEHN
Cc1nc(C(F)(F)F)ccc1C(=O)N1CCN2CCC[C@H]2C1	ZINC000195329380	402842060	/nfs/dbraw/zinc/84/20/60/402842060.db2.gz	OAADKGVVGNUVSG-NSHDSACASA-N	0	3	313.323	2.329	10	0		DEAEHN
CCOC(=O)CCCCN1CCCN(c2ccccn2)CC1	ZINC000183813542	402799762	/nfs/dbraw/zinc/79/97/62/402799762.db2.gz	CESVMSAWBRKDDT-UHFFFAOYSA-N	0	3	305.422	2.327	10	0		DEAEHN
CCCO[C@@H]1CCCN(C(=O)NC[C@H]2CCCN2CC)CC1	ZINC000175368438	402800860	/nfs/dbraw/zinc/80/08/60/402800860.db2.gz	BPCWJPTUDPLJTD-HZPDHXFCSA-N	0	3	311.470	2.461	10	0		DEAEHN
COc1ccccc1[C@@H](O)CNC(=O)[C@@H](C)N1CCCCCC1	ZINC000175375421	402801243	/nfs/dbraw/zinc/80/12/43/402801243.db2.gz	URSXZPMSRQJXNU-ZBFHGGJFSA-N	0	3	320.433	2.109	10	0		DEAEHN
CCOc1ccc2cc(C(=O)N3CCN4CCC[C@H]4C3)[nH]c2c1	ZINC000195335041	402842571	/nfs/dbraw/zinc/84/25/71/402842571.db2.gz	USULPPQIERSTQA-AWEZNQCLSA-N	0	3	313.401	2.487	10	0		DEAEHN
CN(C)c1ccncc1C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000184205480	402826406	/nfs/dbraw/zinc/82/64/06/402826406.db2.gz	YAJXNHXTJXCUFB-WMZOPIPTSA-N	0	3	324.428	2.323	10	0		DEAEHN
C[C@H](O)C[C@H]1CCCN1Cc1ccc2c(c1)sc(=O)n2C	ZINC000195024977	402827347	/nfs/dbraw/zinc/82/73/47/402827347.db2.gz	IQUUBMDWZPDYML-WCQYABFASA-N	0	3	306.431	2.335	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2ccc([S@](C)=O)cc2)CCN1C	ZINC000175834977	402836892	/nfs/dbraw/zinc/83/68/92/402836892.db2.gz	AYBHQKOGDRAZCM-BWFKNJDFSA-N	0	3	323.462	2.370	10	0		DEAEHN
O=C(NCCC[C@@H]1CCCCO1)N1CCCN(C2CC2)CC1	ZINC000184386308	402840301	/nfs/dbraw/zinc/84/03/01/402840301.db2.gz	PQUPJGPJGKMVFB-INIZCTEOSA-N	0	3	309.454	2.215	10	0		DEAEHN
NC(=O)[C@H](Cc1ccc(Cl)cc1)N1CC[C@H]2OCCC[C@@H]2C1	ZINC000183634955	402783942	/nfs/dbraw/zinc/78/39/42/402783942.db2.gz	NPDOBMPNFGCWJD-VNQPRFMTSA-N	0	3	322.836	2.237	10	0		DEAEHN
Cc1noc(C)c1C[C@H](C)NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000175155268	402784089	/nfs/dbraw/zinc/78/40/89/402784089.db2.gz	RTLMGXQKMNTGHL-ZOWXZIJZSA-N	0	3	322.453	2.347	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN([C@@H]2CCN(C(C)C)C2=O)C1	ZINC000175202460	402787817	/nfs/dbraw/zinc/78/78/17/402787817.db2.gz	MAXACAXGTWJAQV-HUUCEWRRSA-N	0	3	304.438	2.092	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N[C@H]1COc2ccccc2C1	ZINC000194191762	402787849	/nfs/dbraw/zinc/78/78/49/402787849.db2.gz	FDIYVHRYIHPQJP-HZPDHXFCSA-N	0	3	319.449	2.266	10	0		DEAEHN
CCC[C@H](C)CC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000176003896	402847244	/nfs/dbraw/zinc/84/72/44/402847244.db2.gz	KKJAMYVOKIQCLD-DLBZAZTESA-N	0	3	309.498	2.441	10	0		DEAEHN
CCCCNC(=O)[C@@H](C)N1CC[C@H](CNc2ccccn2)C1	ZINC000195515883	402848725	/nfs/dbraw/zinc/84/87/25/402848725.db2.gz	FCUKZMQSGUBTEO-HUUCEWRRSA-N	0	3	304.438	2.120	10	0		DEAEHN
FC(F)(F)COCCN1CC[C@@H](CNc2ccccn2)C1	ZINC000195516004	402849035	/nfs/dbraw/zinc/84/90/35/402849035.db2.gz	KBMWOGHELXPDOR-LBPRGKRZSA-N	0	3	303.328	2.394	10	0		DEAEHN
CC/C=C/CCN1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000184528695	402849176	/nfs/dbraw/zinc/84/91/76/402849176.db2.gz	INJBLHGWOKPQOF-OAJJDEHYSA-N	0	3	318.461	2.400	10	0		DEAEHN
CC(=O)c1ccc(CC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1	ZINC000265947326	402964566	/nfs/dbraw/zinc/96/45/66/402964566.db2.gz	KBUNWJKECHIQAZ-DYVFJYSZSA-N	0	3	302.418	2.373	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)N2CCC[C@H]2c2ccc[nH]2)CN1C1CC1	ZINC000267912125	403041100	/nfs/dbraw/zinc/04/11/00/403041100.db2.gz	ZYAXVKZIHLWZSC-IOASZLSFSA-N	0	3	302.422	2.486	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@H]1NCc1ccc(Br)cc1F	ZINC000282262645	403137546	/nfs/dbraw/zinc/13/75/46/403137546.db2.gz	HCIXSCSNBCVYAX-PRHODGIISA-N	0	3	315.186	2.345	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)[C@H](C)N[C@@H]1CCOC[C@@H]1C	ZINC000277544896	403229419	/nfs/dbraw/zinc/22/94/19/403229419.db2.gz	SHOGXOXSWKBXRO-SLEUVZQESA-N	0	3	304.390	2.231	10	0		DEAEHN
c1ccc(COCCCN2CCO[C@@]3(CCCOC3)C2)cc1	ZINC000285440101	403296872	/nfs/dbraw/zinc/29/68/72/403296872.db2.gz	XLWBMDISMXEHNL-SFHVURJKSA-N	0	3	305.418	2.475	10	0		DEAEHN
C[C@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cn[nH]c1	ZINC000285084458	403277666	/nfs/dbraw/zinc/27/76/66/403277666.db2.gz	JSWBJIXJABRAMI-MAUKXSAKSA-N	0	3	314.433	2.351	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)NCCN2CCCC[C@H]2C)cc1	ZINC000331181803	403347412	/nfs/dbraw/zinc/34/74/12/403347412.db2.gz	RMRCKBQXLVBOBQ-CQSZACIVSA-N	0	3	317.433	2.274	10	0		DEAEHN
c1c(CNC[C@@H]2CCN(c3ccccc3)C2)nc2ncccn12	ZINC000298454014	403385291	/nfs/dbraw/zinc/38/52/91/403385291.db2.gz	OBCYGGSUFNHKJV-HNNXBMFYSA-N	0	3	307.401	2.345	10	0		DEAEHN
CC(=O)c1cc(C(=O)NCCN2[C@H](C)CCC[C@@H]2C)n(C)c1	ZINC000343164484	403483968	/nfs/dbraw/zinc/48/39/68/403483968.db2.gz	LAMZOHRIKQPCHE-BETUJISGSA-N	0	3	305.422	2.220	10	0		DEAEHN
C=Cc1ccc(C(=O)N2CCO[C@@H]3CCN(CC)C[C@@H]32)cc1	ZINC000293895737	403592984	/nfs/dbraw/zinc/59/29/84/403592984.db2.gz	MEOBZEZMUBHUHB-DLBZAZTESA-N	0	3	300.402	2.265	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)[C@@H](C)N[C@H]1CCOC1(C)C	ZINC000295366564	403884417	/nfs/dbraw/zinc/88/44/17/403884417.db2.gz	ZOLGPKRSWHLLAA-ABAIWWIYSA-N	0	3	304.390	2.373	10	0		DEAEHN
C[C@@H]1CC(CNCc2c(Br)cnn2C)C[C@@H](C)O1	ZINC000341489047	403995301	/nfs/dbraw/zinc/99/53/01/403995301.db2.gz	QDMSTOJVYUZNOM-NXEZZACHSA-N	0	3	316.243	2.476	10	0		DEAEHN
Cn1ccnc(N2CCC[C@@H](NC/C=C\c3ccccc3)C2)c1=O	ZINC000337542136	404086275	/nfs/dbraw/zinc/08/62/75/404086275.db2.gz	ZPLZLTIRSLDLOI-VWTAQGJOSA-N	0	3	324.428	2.052	10	0		DEAEHN
CC[C@@H](C(=O)N1CCC(Nc2nc(C)cs2)CC1)N(C)C	ZINC000364284844	404334091	/nfs/dbraw/zinc/33/40/91/404334091.db2.gz	XNAIVINBNAAZHG-ZDUSSCGKSA-N	0	3	310.467	2.195	10	0		DEAEHN
C[C@@H]1CN(Cc2ncc(C3CC3)o2)CC[C@@H]1N1CCN(C)CC1	ZINC000370149760	404350592	/nfs/dbraw/zinc/35/05/92/404350592.db2.gz	POUVJGJPQXWDOI-ZBFHGGJFSA-N	0	3	318.465	2.010	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)Nc2cn(C)nc2C2CC2)CCN1C	ZINC000292018775	404630093	/nfs/dbraw/zinc/63/00/93/404630093.db2.gz	JMJRKMYSSBWNSP-WCQYABFASA-N	0	3	305.426	2.244	10	0		DEAEHN
C[C@@H]1CN(CCCNC(=O)N2CCCC23CCC3)CCCO1	ZINC000365805614	404724442	/nfs/dbraw/zinc/72/44/42/404724442.db2.gz	MEOAMCBITRLBFB-OAHLLOKOSA-N	0	3	309.454	2.215	10	0		DEAEHN
C[C@H]1CN(C2CCOCC2)CCN1Cc1ncc(C2CC2)o1	ZINC000365819409	404725958	/nfs/dbraw/zinc/72/59/58/404725958.db2.gz	JOOOUYHLFPSTDV-ZDUSSCGKSA-N	0	3	305.422	2.237	10	0		DEAEHN
CCOC(=O)[C@@H]1CN([C@@H](C)c2ccc(F)cc2)CC12COC2	ZINC000451141770	404879636	/nfs/dbraw/zinc/87/96/36/404879636.db2.gz	VZYSQZPURXZUNX-WFASDCNBSA-N	0	3	307.365	2.398	10	0		DEAEHN
CN(Cc1ccccc1)CC(C)(C)NC(=O)c1ncccc1N	ZINC000379664771	405027768	/nfs/dbraw/zinc/02/77/68/405027768.db2.gz	QHMOCJDANYAANH-UHFFFAOYSA-N	0	3	312.417	2.304	10	0		DEAEHN
Brc1sccc1CNCCCN1CCOCC1	ZINC000388900923	405036055	/nfs/dbraw/zinc/03/60/55/405036055.db2.gz	UXYDISUAIZEIFH-UHFFFAOYSA-N	0	3	319.268	2.323	10	0		DEAEHN
CCN1CC[C@H](CNC(=O)[C@@H](C)CC(=O)c2ccccc2F)C1	ZINC000361364072	405040486	/nfs/dbraw/zinc/04/04/86/405040486.db2.gz	ABSLJZCCSLYAJJ-UONOGXRCSA-N	0	3	320.408	2.493	10	0		DEAEHN
CN(CC1CC1)C(=O)CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000361379328	405046598	/nfs/dbraw/zinc/04/65/98/405046598.db2.gz	USFOEQNRRUFAOF-GVDBMIGSSA-N	0	3	308.466	2.260	10	0		DEAEHN
Cc1cc(CNC[C@H]2CN(Cc3ccccc3)CCCO2)on1	ZINC000390702591	405047542	/nfs/dbraw/zinc/04/75/42/405047542.db2.gz	FJJGQNSVBHFOSM-SFHVURJKSA-N	0	3	315.417	2.364	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)CCN2CC[C@H](O)C2(C)C)cc1	ZINC000361426066	405070378	/nfs/dbraw/zinc/07/03/78/405070378.db2.gz	LBOCXZVXSDJELO-HNNXBMFYSA-N	0	3	304.390	2.063	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N[C@@H]1CCc2cn(C(C)C)nc2C1	ZINC000361456535	405082049	/nfs/dbraw/zinc/08/20/49/405082049.db2.gz	IDPQZKAXCQELFX-WBVHZDCISA-N	0	3	318.465	2.312	10	0		DEAEHN
Cn1c2ccc(CN3CC[C@]4(O)CCCC[C@H]4C3)cc2oc1=O	ZINC000408066785	405103345	/nfs/dbraw/zinc/10/33/45/405103345.db2.gz	CRZWQEHNZXPKRU-KBXCAEBGSA-N	0	3	316.401	2.259	10	0		DEAEHN
CCN1CCCN(C(=O)N[C@@H]2CCCC[C@H]2n2cccn2)CC1	ZINC000408379528	405190378	/nfs/dbraw/zinc/19/03/78/405190378.db2.gz	LPQAFSYUQQHDNG-HZPDHXFCSA-N	0	3	319.453	2.104	10	0		DEAEHN
CC(C(=O)N[C@@H]1C[C@H]1c1ccc2ccccc2c1)S(C)(=O)=O	ZINC000437279547	405193508	/nfs/dbraw/zinc/19/35/08/405193508.db2.gz	YKLSKCWEOBRCNG-XFBWCDHKSA-N	0	3	317.410	2.245	10	0		DEAEHN
CN(CC[C@H]1CCOC1)[C@@H]1CCN(c2ccccc2F)C1=O	ZINC000438118807	405232879	/nfs/dbraw/zinc/23/28/79/405232879.db2.gz	YBOWCKZCUXYVHL-XJKSGUPXSA-N	0	3	306.381	2.289	10	0		DEAEHN
c1nc(-c2ccncc2)sc1CNCCCN1CCOCC1	ZINC000440348767	405309638	/nfs/dbraw/zinc/30/96/38/405309638.db2.gz	XYHJZABFJITWKI-UHFFFAOYSA-N	0	3	318.446	2.017	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)NC[C@@H](C)N1CCC[C@H](C)C1	ZINC000454504159	405354936	/nfs/dbraw/zinc/35/49/36/405354936.db2.gz	JIBIYUPOHLFICL-QWHCGFSZSA-N	0	3	322.453	2.465	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)N2CCC[C@H]2CN2CCCC2)nc1	ZINC000455153425	405381551	/nfs/dbraw/zinc/38/15/51/405381551.db2.gz	VXJYVIZKLMCMOU-HNNXBMFYSA-N	0	3	316.405	2.376	10	0		DEAEHN
CN(CCN1CCCC1)C(=O)c1cccc(C(F)(F)F)n1	ZINC000448904771	405461638	/nfs/dbraw/zinc/46/16/38/405461638.db2.gz	UKSDQFBTKSMJDO-UHFFFAOYSA-N	0	3	301.312	2.268	10	0		DEAEHN
COCCCN1CCCC[C@@]12CC(=O)N(Cc1ccccn1)C2	ZINC000063527355	292350681	/nfs/dbraw/zinc/35/06/81/292350681.db2.gz	WQYCYTCUXMVREU-SFHVURJKSA-N	0	3	317.433	2.075	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NC[C@@H]1CCCC12CC2	ZINC000638794585	405673662	/nfs/dbraw/zinc/67/36/62/405673662.db2.gz	FBDWWKFWEGLGTC-IRXDYDNUSA-N	0	3	315.461	2.142	10	0		DEAEHN
COC(=O)C(C)(C)N1CCN(CCCc2cccc(C)c2)CC1	ZINC000494381825	405685155	/nfs/dbraw/zinc/68/51/55/405685155.db2.gz	BFQPJOGKRBBFLK-UHFFFAOYSA-N	0	3	318.461	2.497	10	0		DEAEHN
CC(=O)N1CCC[C@H](CN[C@H](C)c2cn3ccccc3n2)C1	ZINC000559903205	405760597	/nfs/dbraw/zinc/76/05/97/405760597.db2.gz	KJVZCTRJPGBWCD-UKRRQHHQSA-N	0	3	300.406	2.243	10	0		DEAEHN
CC(C)Oc1ccc2nccc(N3CC[C@H](NC(N)=O)C3)c2c1	ZINC000450407458	405882046	/nfs/dbraw/zinc/88/20/46/405882046.db2.gz	IABLNYMCJYRABT-LBPRGKRZSA-N	0	3	314.389	2.269	10	0		DEAEHN
c1cc(CNCCC[C@H]2CCO2)c(OC[C@@H]2CCOC2)cn1	ZINC000639184143	405952935	/nfs/dbraw/zinc/95/29/35/405952935.db2.gz	ISGLWNYOMRRBDT-ZBFHGGJFSA-N	0	3	306.406	2.156	10	0		DEAEHN
O[C@H](CNCc1cc(-c2ccccc2)cs1)Cn1ccnn1	ZINC000459704905	406011223	/nfs/dbraw/zinc/01/12/23/406011223.db2.gz	TZJAABAJVIBSIR-OAHLLOKOSA-N	0	3	314.414	2.157	10	0		DEAEHN
CO[C@@H](C)[C@H](C)N[C@@H](C)c1cccc(NS(C)(=O)=O)c1	ZINC000467382160	406096412	/nfs/dbraw/zinc/09/64/12/406096412.db2.gz	OVXJCGITDKOZDR-SRVKXCTJSA-N	0	3	300.424	2.132	10	0		DEAEHN
C[C@@]1(C(=O)NCCNc2ccncc2)CCc2ccccc2C1	ZINC000533814690	406163481	/nfs/dbraw/zinc/16/34/81/406163481.db2.gz	GNWRAWCOULTNMJ-LJQANCHMSA-N	0	3	309.413	2.227	10	0		DEAEHN
C[C@@H](Cc1ccncc1)NCc1c(Br)cnn1C	ZINC000487275731	406219697	/nfs/dbraw/zinc/21/96/97/406219697.db2.gz	PWYKFRGAZOOHIQ-JTQLQIEISA-N	0	3	309.211	2.298	10	0		DEAEHN
CC(C)[C@H]1C[C@H](NCc2c(Br)cnn2C)CCO1	ZINC000487579354	406248958	/nfs/dbraw/zinc/24/89/58/406248958.db2.gz	VMOFSYDREUDFKM-ZWNOBZJWSA-N	0	3	316.243	2.476	10	0		DEAEHN
CSc1ccc(CN(C)C(=O)CN2CC[C@@H](CO)[C@@H]2C)cc1	ZINC000488809419	406351224	/nfs/dbraw/zinc/35/12/24/406351224.db2.gz	TXDLRVKXTWEVHW-ZFWWWQNUSA-N	0	3	322.474	2.070	10	0		DEAEHN
C[C@H](N[C@H]1CCC(=O)N(C)C1)c1cncc(Br)c1	ZINC000569121951	292392250	/nfs/dbraw/zinc/39/22/50/292392250.db2.gz	OLFPHGBGPUSXNG-CABZTGNLSA-N	0	3	312.211	2.116	10	0		DEAEHN
c1cnc(N2CCC[C@@H](NCc3ccc4nccnc4c3)C2)nc1	ZINC000634954126	406368750	/nfs/dbraw/zinc/36/87/50/406368750.db2.gz	ULQXHTBGTQFYPK-OAHLLOKOSA-N	0	3	320.400	2.178	10	0		DEAEHN
Cc1cccc(N(C)C(=O)[C@@H](N)CN(C)Cc2ccccc2)c1	ZINC000637907366	406472639	/nfs/dbraw/zinc/47/26/39/406472639.db2.gz	NFPLMPOGOXXAGJ-SFHVURJKSA-N	0	3	311.429	2.417	10	0		DEAEHN
CCN(C[C@@H]1CCCN1CC)C(=O)Cn1ncc2ccccc21	ZINC000548126986	406483363	/nfs/dbraw/zinc/48/33/63/406483363.db2.gz	SCYFJYKIZKRCBN-INIZCTEOSA-N	0	3	314.433	2.369	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CCCC(C)(C)C1	ZINC000637938704	406485651	/nfs/dbraw/zinc/48/56/51/406485651.db2.gz	RQQLBLYXSLKFOI-INIZCTEOSA-N	0	3	303.450	2.094	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CCC[C@@H]2CCC[C@H]21	ZINC000637954258	406493924	/nfs/dbraw/zinc/49/39/24/406493924.db2.gz	UZQKAZKHHCXHPE-OKZBNKHCSA-N	0	3	315.461	2.237	10	0		DEAEHN
CC(=O)N1CC[C@@H](N[C@H]2CCC(=O)NC2(C)C)c2ccccc21	ZINC000571261066	406497481	/nfs/dbraw/zinc/49/74/81/406497481.db2.gz	SQKNCFRALDRFJE-ZBFHGGJFSA-N	0	3	315.417	2.131	10	0		DEAEHN
CSC[C@H](O)CN1CCC[C@@H](CC(=O)OC(C)(C)C)C1	ZINC000548296162	406497574	/nfs/dbraw/zinc/49/75/74/406497574.db2.gz	WCVJKUZQOXZADF-QWHCGFSZSA-N	0	3	303.468	2.154	10	0		DEAEHN
CSC[C@@H](O)CN1CCC[C@@H](CC(=O)OC(C)(C)C)C1	ZINC000548296163	406497950	/nfs/dbraw/zinc/49/79/50/406497950.db2.gz	WCVJKUZQOXZADF-STQMWFEESA-N	0	3	303.468	2.154	10	0		DEAEHN
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637868528	406454094	/nfs/dbraw/zinc/45/40/94/406454094.db2.gz	OMMGWNQODDUFKC-QAPCUYQASA-N	0	3	323.440	2.424	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)N1C[C@H](C)N(C)C[C@H]1C)CC2	ZINC000526010066	406532669	/nfs/dbraw/zinc/53/26/69/406532669.db2.gz	NFFYGVBIAGLKDH-BFHYXJOUSA-N	0	3	318.465	2.189	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N1C[C@H](C)N(C)C[C@H]1C)C2	ZINC000526010066	406532672	/nfs/dbraw/zinc/53/26/72/406532672.db2.gz	NFFYGVBIAGLKDH-BFHYXJOUSA-N	0	3	318.465	2.189	10	0		DEAEHN
CC[C@@H]1CCC[C@H]1NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638032764	406533028	/nfs/dbraw/zinc/53/30/28/406533028.db2.gz	APJPZPUZDLQUMG-BRWVUGGUSA-N	0	3	303.450	2.141	10	0		DEAEHN
C[C@H](NC(=O)c1cn2cccnc2n1)[C@H](c1ccccc1)N(C)C	ZINC000548432758	406514808	/nfs/dbraw/zinc/51/48/08/406514808.db2.gz	XMOUUJGKVLTFOT-XJKSGUPXSA-N	0	3	323.400	2.151	10	0		DEAEHN
Cc1ccncc1CN[C@@H](CN1CCN(C)CC1)c1ccccc1	ZINC000527223049	406598885	/nfs/dbraw/zinc/59/88/85/406598885.db2.gz	LXYURPBXWAGZRJ-FQEVSTJZSA-N	0	3	324.472	2.468	10	0		DEAEHN
Cc1ccc(O)c(NC(=O)[C@@H](N)CN(C)Cc2ccccc2)c1	ZINC000638200221	406619254	/nfs/dbraw/zinc/61/92/54/406619254.db2.gz	CKEIXJWLANRNTA-HNNXBMFYSA-N	0	3	313.401	2.098	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCc1nccn1-c1ccccc1	ZINC000555104785	406833531	/nfs/dbraw/zinc/83/35/31/406833531.db2.gz	DHEGOTIDNLTZEI-INIZCTEOSA-N	0	3	312.417	2.363	10	0		DEAEHN
Cc1cc(Br)cc2nc(C[C@@H]3CNCCO3)[nH]c21	ZINC000129608152	196061542	/nfs/dbraw/zinc/06/15/42/196061542.db2.gz	PVTOMKHWMGORCG-SNVBAGLBSA-N	0	3	310.195	2.165	10	0		DEAEHN
Cc1cc(Br)cc2[nH]c(C[C@@H]3CNCCO3)nc21	ZINC000129608152	196061543	/nfs/dbraw/zinc/06/15/43/196061543.db2.gz	PVTOMKHWMGORCG-SNVBAGLBSA-N	0	3	310.195	2.165	10	0		DEAEHN
CC(C)CC1(CNC(=O)N2CCO[C@@H](CN(C)C)C2)CCC1	ZINC000129750936	196072857	/nfs/dbraw/zinc/07/28/57/196072857.db2.gz	BTVAABBODSSSMJ-HNNXBMFYSA-N	0	3	311.470	2.175	10	0		DEAEHN
CCCN(CCN(C)C)Cc1cc(C(N)=S)ccc1OC	ZINC000130599080	196093871	/nfs/dbraw/zinc/09/38/71/196093871.db2.gz	JTWAXVOFJXKLDF-UHFFFAOYSA-N	0	3	309.479	2.103	10	0		DEAEHN
CC(C)(C)NCc1ccc(CSCCS(C)(=O)=O)o1	ZINC000131061867	196136854	/nfs/dbraw/zinc/13/68/54/196136854.db2.gz	LOWNMNCXVVOFGV-UHFFFAOYSA-N	0	3	305.465	2.446	10	0		DEAEHN
CCO[C@@H](C)CNS(=O)(=O)c1cccc([C@@H](CC)NC)c1	ZINC000131228606	196151301	/nfs/dbraw/zinc/15/13/01/196151301.db2.gz	BKWUTQTWKNTELO-SWLSCSKDSA-N	0	3	314.451	2.060	10	0		DEAEHN
CC[C@@](O)(c1c(Br)cnn1CCN(C)C)C(C)C	ZINC000131450311	196170164	/nfs/dbraw/zinc/17/01/64/196170164.db2.gz	KOAAICCEAHYALD-ZDUSSCGKSA-N	0	3	318.259	2.461	10	0		DEAEHN
CN[C@H](Cc1ccc(C(F)(F)F)cc1)[C@@H](C)S(C)(=O)=O	ZINC000131473491	196172233	/nfs/dbraw/zinc/17/22/33/196172233.db2.gz	GPTJHHKAOWSSEM-BXKDBHETSA-N	0	3	309.353	2.269	10	0		DEAEHN
CN[C@@H](Cc1cccc(F)c1F)[C@H]1CCCCS1(=O)=O	ZINC000131482748	196173057	/nfs/dbraw/zinc/17/30/57/196173057.db2.gz	UKRMGSRYWIVYPU-QWHCGFSZSA-N	0	3	303.374	2.063	10	0		DEAEHN
N[C@@H]1COC[C@@H]1C(=O)Nc1ccc(Cl)cc1Br	ZINC000131538652	196177724	/nfs/dbraw/zinc/17/77/24/196177724.db2.gz	PHBYXSCHOLJQNA-IONNQARKSA-N	0	3	319.586	2.015	10	0		DEAEHN
CNCc1csc(S(=O)(=O)N2CC[C@H](C)[C@@H](C)C2)c1	ZINC000131787559	196199077	/nfs/dbraw/zinc/19/90/77/196199077.db2.gz	ASEMPQHPEUWAAL-QWRGUYRKSA-N	0	3	302.465	2.134	10	0		DEAEHN
C[C@@H](C(=O)N1CCC(c2ccnn2C)CC1)N1[C@H](C)CC[C@H]1C	ZINC000131909220	196209138	/nfs/dbraw/zinc/20/91/38/196209138.db2.gz	NANCEZGPUHNKRT-KFWWJZLASA-N	0	3	318.465	2.387	10	0		DEAEHN
CN(C(=O)c1sc2cccnc2c1N)C1CCN(C)CC1	ZINC000132136762	196229361	/nfs/dbraw/zinc/22/93/61/196229361.db2.gz	ZOIPSZLHQKQBIN-UHFFFAOYSA-N	0	3	304.419	2.045	10	0		DEAEHN
C[C@@H]1CNC[C@H](COCc2ccc(Br)cc2)O1	ZINC000132682607	196276280	/nfs/dbraw/zinc/27/62/80/196276280.db2.gz	OFZMUOSBSLYQQL-ZWNOBZJWSA-N	0	3	300.196	2.343	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1[C@H](O)C1CCC1	ZINC000132856621	196290556	/nfs/dbraw/zinc/29/05/56/196290556.db2.gz	PSVMUWMIYYVMFI-GFCCVEGCSA-N	0	3	302.216	2.041	10	0		DEAEHN
CN[C@H](Cc1cc(C)ccc1OC)[C@H]1CCCCS1(=O)=O	ZINC000133307324	196329171	/nfs/dbraw/zinc/32/91/71/196329171.db2.gz	KYGICFOWIPPZCC-GDBMZVCRSA-N	0	3	311.447	2.101	10	0		DEAEHN
CCNCc1cnc(-n2nc(C)c(Br)c2C)nc1C	ZINC000134500598	196397149	/nfs/dbraw/zinc/39/71/49/196397149.db2.gz	QZFJPLDHARHAOM-UHFFFAOYSA-N	0	3	324.226	2.460	10	0		DEAEHN
C[C@@H](C(=O)N1CCC(C)CC1)N1CCC(Cn2cccn2)CC1	ZINC000105886037	424849629	/nfs/dbraw/zinc/84/96/29/424849629.db2.gz	OPJMIJVHPCSNHJ-INIZCTEOSA-N	0	3	318.465	2.242	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NCc1nccs1)c1ccccc1	ZINC000194363801	424875456	/nfs/dbraw/zinc/87/54/56/424875456.db2.gz	KZFWQQHNPVKLLM-ZDUSSCGKSA-N	0	3	304.419	2.245	10	0		DEAEHN
Cc1ccc([C@H](C)NC(=O)NC[C@H](O)CN2CCCCC2)cc1	ZINC000194452100	424876265	/nfs/dbraw/zinc/87/62/65/424876265.db2.gz	YSEYBUCWJNIEGJ-RDJZCZTQSA-N	0	3	319.449	2.202	10	0		DEAEHN
CN(C)CCOc1ccccc1CNC(=O)Cc1ccccc1	ZINC000194960527	424880572	/nfs/dbraw/zinc/88/05/72/424880572.db2.gz	RDMJVMWEDDBGDL-UHFFFAOYSA-N	0	3	312.413	2.486	10	0		DEAEHN
O=C(c1c[nH]nc1-c1ccc(F)cc1)N1CCN2CCC[C@H]2C1	ZINC000195325236	424882076	/nfs/dbraw/zinc/88/20/76/424882076.db2.gz	OOACOXPYNCZJMP-AWEZNQCLSA-N	0	3	314.364	2.136	10	0		DEAEHN
Brc1ccsc1CN1CC[C@H]2OCCN[C@@H]2C1	ZINC000404248874	424926132	/nfs/dbraw/zinc/92/61/32/424926132.db2.gz	IAAQEXKYBAOGIW-GHMZBOCLSA-N	0	3	317.252	2.073	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1nscc1Br	ZINC000404789537	424928553	/nfs/dbraw/zinc/92/85/53/424928553.db2.gz	GSXSSSUELPZSLS-QMMMGPOBSA-N	0	3	318.240	2.072	10	0		DEAEHN
Cc1ccc(CNC[C@H]2CC(=O)N(C)C2)c(Br)c1	ZINC000657694261	425386847	/nfs/dbraw/zinc/38/68/47/425386847.db2.gz	BLQNFWWZDGEQQE-LLVKDONJSA-N	0	3	311.223	2.325	10	0		DEAEHN
CC[C@@H]1CN(c2ncnc3c(C)cccc32)CCN1CCOC	ZINC000177929754	267568630	/nfs/dbraw/zinc/56/86/30/267568630.db2.gz	YPRQHAJGTSTMRY-OAHLLOKOSA-N	0	3	314.433	2.485	10	0		DEAEHN
C[C@H](NC(=O)N1CCC[C@H]1CN1CCCCC1)c1csnn1	ZINC000334119644	269021617	/nfs/dbraw/zinc/02/16/17/269021617.db2.gz	KFEPXNKOOPXDGH-STQMWFEESA-N	0	3	323.466	2.259	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN1CC[C@@H]([C@@H]2CCOC2)C1	ZINC000430233212	269127064	/nfs/dbraw/zinc/12/70/64/269127064.db2.gz	KESQSMTUZVQUBS-IAGOWNOFSA-N	0	3	312.417	2.185	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)Nc2ccccc2Cl)c1	ZINC000105881391	274830209	/nfs/dbraw/zinc/83/02/09/274830209.db2.gz	XPLDTXMGXHFKDV-LBPRGKRZSA-N	0	3	306.797	2.462	10	0		DEAEHN
O=c1cc(N2CC[C@H]3[C@H](CCCN3C3CC3)C2)nc2ccccn12	ZINC000161935412	275043831	/nfs/dbraw/zinc/04/38/31/275043831.db2.gz	VANDJNBHSXHEMF-ZBFHGGJFSA-N	0	3	324.428	2.148	10	0		DEAEHN
c1cnc2c(c1)nccc2N1CCN(CC2CCOCC2)CC1	ZINC000338673555	275073714	/nfs/dbraw/zinc/07/37/14/275073714.db2.gz	ZXCCTNFCNHLKJX-UHFFFAOYSA-N	0	3	312.417	2.178	10	0		DEAEHN
CC1CCN(C(=O)CN[C@@H]2CCCC[C@@H]2n2cccn2)CC1	ZINC000128421615	275935220	/nfs/dbraw/zinc/93/52/20/275935220.db2.gz	JIUDFLLNFBUAKA-CVEARBPZSA-N	0	3	304.438	2.215	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)N1c2ccccc2C[C@H]1C	ZINC000245478935	276182335	/nfs/dbraw/zinc/18/23/35/276182335.db2.gz	VYGNXUJXTFPUJP-WBVHZDCISA-N	0	3	315.461	2.380	10	0		DEAEHN
CCOC(=O)[C@H]1CN([C@@H]2CCc3ccc(F)cc32)CC12COC2	ZINC000451137800	276294298	/nfs/dbraw/zinc/29/42/98/276294298.db2.gz	PNVCFBRZUUPKMW-HZPDHXFCSA-N	0	3	319.376	2.325	10	0		DEAEHN
CCn1c(CN[C@@H]2CCCC[C@H]2C(N)=O)nc2cc(F)ccc21	ZINC000184822265	276711294	/nfs/dbraw/zinc/71/12/94/276711294.db2.gz	GDIUXGQWWQALBV-CHWSQXEVSA-N	0	3	318.396	2.329	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](NCC1(O)CCOCC1)CCCO2	ZINC000178634988	277981833	/nfs/dbraw/zinc/98/18/33/277981833.db2.gz	DEZVEKSVVYGDDN-HNNXBMFYSA-N	0	3	307.390	2.040	10	0		DEAEHN
COc1cccc2c(N3C[C@H]4OCCN(C)[C@@H]4C3)cc(C)nc12	ZINC000130259661	278025517	/nfs/dbraw/zinc/02/55/17/278025517.db2.gz	FQZVJYRGVPTLFD-NVXWUHKLSA-N	0	3	313.401	2.071	10	0		DEAEHN
CC(=O)NCCCN1[C@H](C(=O)OC(C)(C)C)C[C@@H]2CCCC[C@@H]21	ZINC000249463072	278100750	/nfs/dbraw/zinc/10/07/50/278100750.db2.gz	ROGXHOPBABFTJR-JYJNAYRXSA-N	0	3	324.465	2.487	10	0		DEAEHN
CS[C@H](C)CNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179208883	278158966	/nfs/dbraw/zinc/15/89/66/278158966.db2.gz	HIZKFQBDCKMSLW-VHDGCEQUSA-N	0	3	307.463	2.483	10	0		DEAEHN
C[C@@H](N)[C@@H](C)C(=O)/N=c1/sccn1Cc1ccccc1F	ZINC000192086077	278309708	/nfs/dbraw/zinc/30/97/08/278309708.db2.gz	TTWJYBOBNMWVCD-JZROHQOYSA-N	0	3	307.394	2.148	10	0		DEAEHN
CC(C)C[C@H](C)S(=O)(=O)N1CC[C@@H]2[C@H](CCCN2C)C1	ZINC000122420797	279118086	/nfs/dbraw/zinc/11/80/86/279118086.db2.gz	CIIKSKWOEMYWTR-RRFJBIMHSA-N	0	3	302.484	2.167	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000247496141	288300740	/nfs/dbraw/zinc/30/07/40/288300740.db2.gz	UQNYMMQLXAHDFE-WOFIAXNJSA-N	0	3	304.434	2.077	10	0		DEAEHN
CCc1noc(CC)c1CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000132967760	282004236	/nfs/dbraw/zinc/00/42/36/282004236.db2.gz	GLCWCLLBBMGVEU-CHWSQXEVSA-N	0	3	322.453	2.424	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@H]2CCC[NH2+][C@@H]2C)c(Cl)cc1F	ZINC000193450361	301400863	/nfs/dbraw/zinc/40/08/63/301400863.db2.gz	DNZQIKVWQJWLBI-SKDRFNHKSA-N	0	3	320.817	2.206	10	0		DEAEHN
CCc1ccc(C(=O)CCC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170861337	325715824	/nfs/dbraw/zinc/71/58/24/325715824.db2.gz	BKXSPKFILTZNOH-INIZCTEOSA-N	0	3	302.418	2.374	10	0		DEAEHN
Cc1cccc(CNC(=O)CC2(N3CCOCC3)CCCC2)n1	ZINC000174084781	325738642	/nfs/dbraw/zinc/73/86/42/325738642.db2.gz	AMJLJFULQBUZKY-UHFFFAOYSA-N	0	3	317.433	2.041	10	0		DEAEHN
c1ccc(-n2nnnc2CCN2CC[C@@H](c3ccncc3)C2)cc1	ZINC000574925404	326201526	/nfs/dbraw/zinc/20/15/26/326201526.db2.gz	ZTZMOCVTGWZSBP-MRXNPFEDSA-N	0	3	320.400	2.089	10	0		DEAEHN
Cc1cccc2c(N[C@H](CO)CN3CCCCC3)ncnc12	ZINC000575092402	326217535	/nfs/dbraw/zinc/21/75/35/326217535.db2.gz	ILFLVIMPBGMURI-AWEZNQCLSA-N	0	3	300.406	2.197	10	0		DEAEHN
CC[C@H]1CN(c2nc3c(cccc3F)o2)CCN1C[C@@H](C)O	ZINC000577445700	326365969	/nfs/dbraw/zinc/36/59/69/326365969.db2.gz	HEJNXLRFERBCLP-NEPJUHHUSA-N	0	3	307.369	2.248	10	0		DEAEHN
COC[C@@H](C)CN1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000189640566	333191038	/nfs/dbraw/zinc/19/10/38/333191038.db2.gz	MAFYPEJQJAGGPS-AWEZNQCLSA-N	0	3	308.397	2.256	10	0		DEAEHN
CN1CCC(O)(CNC(=O)c2cc3sccc3s2)CC1	ZINC000397558030	337276128	/nfs/dbraw/zinc/27/61/28/337276128.db2.gz	OKIXTSGNKXIULC-UHFFFAOYSA-N	0	3	310.444	2.149	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CCCCCS(=O)(=O)CC	ZINC000190624833	535590684	/nfs/dbraw/zinc/59/06/84/535590684.db2.gz	IGMIMKWIQZYTAL-HNNXBMFYSA-N	0	3	304.500	2.008	10	0		DEAEHN
C[C@@H](CS(=O)(=O)c1ccccc1)NC[C@@H]1CCC(C)(C)O1	ZINC000187850028	534176544	/nfs/dbraw/zinc/17/65/44/534176544.db2.gz	CTGVROXYRCAQJW-KBPBESRZSA-N	0	3	311.447	2.396	10	0		DEAEHN
CCC[C@@H](C(=O)NCCN(C)Cc1ccc(F)cc1)N(C)C	ZINC000132351806	520587533	/nfs/dbraw/zinc/58/75/33/520587533.db2.gz	DYWGEDUIUJSNSU-INIZCTEOSA-N	0	3	309.429	2.104	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H]1CCN(C(=O)C2CCCCC2)C1)N(C)C	ZINC000154897101	520594687	/nfs/dbraw/zinc/59/46/87/520594687.db2.gz	LDPDUXWIUCGEGW-HOTGVXAUSA-N	0	3	323.481	2.014	10	0		DEAEHN
CCC(C)(C)[C@@H]1CCCN1CC(=O)N1CCC[C@H](NC(C)=O)C1	ZINC000156974071	521360888	/nfs/dbraw/zinc/36/08/88/521360888.db2.gz	DKXGRACBUQOOHA-HOTGVXAUSA-N	0	3	323.481	2.014	10	0		DEAEHN
CCOc1ccccc1C(F)(F)C(=O)N1CC[C@H](N(C)C)C1	ZINC000127457750	521462222	/nfs/dbraw/zinc/46/22/22/521462222.db2.gz	GWANZTHBWALRMZ-LBPRGKRZSA-N	0	3	312.360	2.340	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](C)[C@@H]2COc3ccccc32)C1	ZINC000247028146	521646353	/nfs/dbraw/zinc/64/63/53/521646353.db2.gz	UUPUXMASRZCRDK-YCPHGPKFSA-N	0	3	317.433	2.335	10	0		DEAEHN
CCCN(C[C@@H]1CCCCO1)C(=O)NC[C@H](C)N(C)C1CC1	ZINC000106561032	521675617	/nfs/dbraw/zinc/67/56/17/521675617.db2.gz	RGJUMGSZRCCJPZ-HOCLYGCPSA-N	0	3	311.470	2.460	10	0		DEAEHN
CC[N@@H+]1CC[C@@H](N(C)C(=O)c2cc(OC)ccc2[O-])[C@@H](C)C1	ZINC000247417474	521712655	/nfs/dbraw/zinc/71/26/55/521712655.db2.gz	NRGIMLIIYAMLJE-SWLSCSKDSA-N	0	3	306.406	2.203	10	0		DEAEHN
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(OC)ccc2[O-])[C@@H](C)C1	ZINC000247417474	521712657	/nfs/dbraw/zinc/71/26/57/521712657.db2.gz	NRGIMLIIYAMLJE-SWLSCSKDSA-N	0	3	306.406	2.203	10	0		DEAEHN
CCN1CC[C@@H](N(C)C(=O)c2cn(CCC(C)C)nn2)[C@@H](C)C1	ZINC000247484469	521712798	/nfs/dbraw/zinc/71/27/98/521712798.db2.gz	TUYXTGATMSWZLO-GOEBONIOSA-N	0	3	321.469	2.127	10	0		DEAEHN
COC(=O)c1ccc(CN(C)C[C@H](O)COC(C)(C)C)cc1	ZINC000157544703	521999683	/nfs/dbraw/zinc/99/96/83/521999683.db2.gz	YFJRKAVAHVJPDA-HNNXBMFYSA-N	0	3	309.406	2.081	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)CCc2cccc(OC(C)(C)C)n2)C1	ZINC000130457594	522049970	/nfs/dbraw/zinc/04/99/70/522049970.db2.gz	NVSKBLRRQFLRKA-OAHLLOKOSA-N	0	3	319.449	2.354	10	0		DEAEHN
CC[C@H](COC)NCc1ccc(N2C[C@@H](C)O[C@@H](C)C2)nc1	ZINC000157254873	522259603	/nfs/dbraw/zinc/25/96/03/522259603.db2.gz	NNGSWJWKMPDMAG-IJEWVQPXSA-N	0	3	307.438	2.210	10	0		DEAEHN
CCc1nc(CNC(=O)N(C)CC2CCN(C)CC2)cs1	ZINC000107753984	522329482	/nfs/dbraw/zinc/32/94/82/522329482.db2.gz	LSXBLRRMGOBMJS-UHFFFAOYSA-N	0	3	310.467	2.189	10	0		DEAEHN
C[C@@H](Cc1ccccc1F)N[C@H]1CCN(C2CCOCC2)C1=O	ZINC000364848274	524923224	/nfs/dbraw/zinc/92/32/24/524923224.db2.gz	PTUGJECDRXSLBV-GUYCJALGSA-N	0	3	320.408	2.126	10	0		DEAEHN
Cc1ccc(NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1C(N)=O	ZINC000246850284	525115184	/nfs/dbraw/zinc/11/51/84/525115184.db2.gz	RBUDKKAWKAWIBL-JSGCOSHPSA-N	0	3	318.421	2.040	10	0		DEAEHN
Cc1ccc([C@H](O)CNC(=O)[C@@H](C)[C@@H](N)c2ccccc2)cc1	ZINC000246280608	525973962	/nfs/dbraw/zinc/97/39/62/525973962.db2.gz	MNHRBBIPCWBQSR-BMGDILEWSA-N	0	3	312.413	2.481	10	0		DEAEHN
c1ccc(OCCCCCN2CCN3CCOC[C@H]3C2)cc1	ZINC000364838552	526484327	/nfs/dbraw/zinc/48/43/27/526484327.db2.gz	KMIGHPOWTROLQU-QGZVFWFLSA-N	0	3	304.434	2.252	10	0		DEAEHN
c1onc(Cc2ccccc2)c1CNCCc1nnc2n1CCC2	ZINC000339188017	526628692	/nfs/dbraw/zinc/62/86/92/526628692.db2.gz	NTRBZGPDJYEMRC-UHFFFAOYSA-N	0	3	323.400	2.135	10	0		DEAEHN
CC(C)C(=O)N1CCC(NC(=O)[C@H](C)N2[C@H](C)CC[C@H]2C)CC1	ZINC000195527023	527464886	/nfs/dbraw/zinc/46/48/86/527464886.db2.gz	RXWXCNNJTIAULX-KFWWJZLASA-N	0	3	323.481	2.011	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)[C@H](C)OCc2ccccc2)C1	ZINC000248926838	529098552	/nfs/dbraw/zinc/09/85/52/529098552.db2.gz	GBBBQYJWDPRGHV-YQQAZPJKSA-N	0	3	304.434	2.437	10	0		DEAEHN
CC(C)N(C(=O)[C@H](C)N1CC[C@@H](c2cnn(C)c2)C1)C(C)C	ZINC000246876488	534951595	/nfs/dbraw/zinc/95/15/95/534951595.db2.gz	FUJAWGSEMJCQHU-LSDHHAIUSA-N	0	3	306.454	2.243	10	0		DEAEHN
CC(C)[C@H](c1nc([C@H]2CNCCN2C)no1)c1ccccc1	ZINC000263174531	535170386	/nfs/dbraw/zinc/17/03/86/535170386.db2.gz	GCAAGDWKVIPXJX-CABCVRRESA-N	0	3	300.406	2.434	10	0		DEAEHN
CC(C)[C@H]1C[C@@H](NCc2cccc(N3CCOCC3)n2)CCO1	ZINC000359101407	535250268	/nfs/dbraw/zinc/25/02/68/535250268.db2.gz	IDNGALDXFPBPNC-DOTOQJQBSA-N	0	3	319.449	2.211	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)CSCc2ccncc2)C1	ZINC000246836070	535256043	/nfs/dbraw/zinc/25/60/43/535256043.db2.gz	DYFWKYDBSNUBCQ-UKRRQHHQSA-N	0	3	307.463	2.160	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](N[C@H](C(=O)NC2CC2)c2ccccc2)C1	ZINC000246300479	535258642	/nfs/dbraw/zinc/25/86/42/535258642.db2.gz	VFGACBOMCKLDIW-OLMNPRSZSA-N	0	3	315.461	2.325	10	0		DEAEHN
CCCOc1nc(C)ccc1C(=O)N1CCC[C@H](N(C)C)C1	ZINC000191102468	535291761	/nfs/dbraw/zinc/29/17/61/535291761.db2.gz	QCJOROINDCTOGM-AWEZNQCLSA-N	0	3	305.422	2.345	10	0		DEAEHN
CCS[C@@H]1CCC[C@@H](NC(=O)NCCNc2ccncc2)C1	ZINC000361917009	535708890	/nfs/dbraw/zinc/70/88/90/535708890.db2.gz	VRDDUNRYDZYBRD-HUUCEWRRSA-N	0	3	322.478	2.279	10	0		DEAEHN
COc1ccc(F)c(NC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000261948278	536608438	/nfs/dbraw/zinc/60/84/38/536608438.db2.gz	VXHIYOGAIUSORR-PZSREKOKSA-N	0	3	322.380	2.305	10	0		DEAEHN
COc1ccc(F)c(NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000261948274	536608699	/nfs/dbraw/zinc/60/86/99/536608699.db2.gz	VXHIYOGAIUSORR-HYSWKAIVSA-N	0	3	322.380	2.305	10	0		DEAEHN
COc1ccc(Br)cc1CN[C@H]1CN(C)C[C@@H]1C	ZINC000358102834	536639555	/nfs/dbraw/zinc/63/95/55/536639555.db2.gz	WRPPZHVEQMKRMW-GWCFXTLKSA-N	0	3	313.239	2.497	10	0		DEAEHN
COC[C@@H](C)C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000247121941	536863263	/nfs/dbraw/zinc/86/32/63/536863263.db2.gz	WOQPFLXNLAMQFV-HZPDHXFCSA-N	0	3	304.434	2.392	10	0		DEAEHN
COCCN1CCN(C/C=C\c2ccccc2OC)C[C@H]1C	ZINC000255596077	536873288	/nfs/dbraw/zinc/87/32/88/536873288.db2.gz	WZSYZNHXOFJEDF-QKIRZYONSA-N	0	3	304.434	2.361	10	0		DEAEHN
COCCn1cc([C@H]2OCC[C@@H]2NCc2ccoc2C)cn1	ZINC000888076033	625048831	/nfs/dbraw/zinc/04/88/31/625048831.db2.gz	QWKPXSMZNSVROM-JKSUJKDBSA-N	0	3	305.378	2.051	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2c(C)c3ccccc3oc2=O)C1	ZINC000177199380	625880329	/nfs/dbraw/zinc/88/03/29/625880329.db2.gz	VJYXJEJLPSIHCN-ZDUSSCGKSA-N	0	3	314.385	2.316	10	0		DEAEHN
c1nc2c(c(NC[C@H]3CN4CCC[C@@H]4CO3)n1)CCCCC2	ZINC000317077672	635109009	/nfs/dbraw/zinc/10/90/09/635109009.db2.gz	NTIZLTADHOOWGH-KGLIPLIRSA-N	0	3	302.422	2.021	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCC[C@](C)(O)c2ccccc2)C1	ZINC000187068014	636932577	/nfs/dbraw/zinc/93/25/77/636932577.db2.gz	HROFMMXHAASSPC-AEFFLSMTSA-N	0	3	319.449	2.068	10	0		DEAEHN
CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C/C=C(/C)C(=O)OC)C1	ZINC000746503939	638350291	/nfs/dbraw/zinc/35/02/91/638350291.db2.gz	QEJLPONOQLJZBM-MJBYGXEJSA-N	0	3	310.438	2.123	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)[C@@H]1CC(c2ccccc2)=NO1	ZINC000044533212	646393307	/nfs/dbraw/zinc/39/33/07/646393307.db2.gz	FFTSBWJPDLNWMD-PBHICJAKSA-N	0	3	315.417	2.170	10	0		DEAEHN
Cc1sc(CN[C@H]2CCCNC2=O)cc1Br	ZINC000227824735	646608481	/nfs/dbraw/zinc/60/84/81/646608481.db2.gz	BUCPVYZVNMJLIF-JTQLQIEISA-N	0	3	303.225	2.187	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)NCC2CCCCCCC2)CCO1	ZINC000172126099	646723645	/nfs/dbraw/zinc/72/36/45/646723645.db2.gz	BPXDFBJNHUVWQJ-MRXNPFEDSA-N	0	3	311.470	2.319	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)S(=O)(=O)/C=C/c1ccccc1	ZINC000175393720	648346969	/nfs/dbraw/zinc/34/69/69/648346969.db2.gz	WNOISYXHFRIEGF-BYIUCRAPSA-N	0	3	308.447	2.403	10	0		DEAEHN
COC(=O)C[C@H](C)C(=O)O[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000183173234	649045488	/nfs/dbraw/zinc/04/54/88/649045488.db2.gz	FXUMJHXPOVBBTG-GOEBONIOSA-N	0	3	319.401	2.393	10	0		DEAEHN
COC(=O)C[C@H](C)C(=O)O[C@H]1CCCN(Cc2ccccc2)C1	ZINC000183173269	649045668	/nfs/dbraw/zinc/04/56/68/649045668.db2.gz	FXUMJHXPOVBBTG-HOCLYGCPSA-N	0	3	319.401	2.393	10	0		DEAEHN
C[C@@H](C[C@H]1CCC(=O)N1)NCc1ccn(Cc2ccccc2)n1	ZINC000389971816	685436964	/nfs/dbraw/zinc/43/69/64/685436964.db2.gz	VRIIAVIPWPGFIR-GOEBONIOSA-N	0	3	312.417	2.078	10	0		DEAEHN
COC(=O)CCN[C@H]1CCOc2ccc(Br)cc21	ZINC000037252244	683882014	/nfs/dbraw/zinc/88/20/14/683882014.db2.gz	BVSUXHASNKVWNM-NSHDSACASA-N	0	3	314.179	2.425	10	0		DEAEHN
O=C(c1cc(Cl)nc(Cl)c1)N1CCN2CCC[C@H]2C1	ZINC000038107482	683887118	/nfs/dbraw/zinc/88/71/18/683887118.db2.gz	RWNGPEJLHSDDLH-JTQLQIEISA-N	0	3	300.189	2.309	10	0		DEAEHN
Cn1cc(CCC(=O)O[C@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000117100058	684067395	/nfs/dbraw/zinc/06/73/95/684067395.db2.gz	JDVFMVSCPYFQHW-KRWDZBQOSA-N	0	3	313.401	2.170	10	0		DEAEHN
COCCO[C@@H]1CCCN(C[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000245857674	685119095	/nfs/dbraw/zinc/11/90/95/685119095.db2.gz	KJOXDFDXTODPQH-MSOLQXFVSA-N	0	3	307.434	2.464	10	0		DEAEHN
CC[C@@H]1CN(C[C@@H](O)c2cc(C)cc(C)c2)CCN1C[C@@H](C)O	ZINC000246797635	685136995	/nfs/dbraw/zinc/13/69/95/685136995.db2.gz	VEFCEHRBAXHPQE-BHIYHBOVSA-N	0	3	320.477	2.114	10	0		DEAEHN
O[C@@H](CN1CCC(OC[C@H]2CCCCO2)CC1)c1cccnc1	ZINC000878173173	690335665	/nfs/dbraw/zinc/33/56/65/690335665.db2.gz	PUHFKSNOFDLRFT-MSOLQXFVSA-N	0	3	320.433	2.165	10	0		DEAEHN
Cc1c[nH]c(CNC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)n1	ZINC000723785112	777169731	/nfs/dbraw/zinc/16/97/31/777169731.db2.gz	JJEYJELPMCCTPR-DGCLKSJQSA-N	0	3	308.426	2.311	10	0		DEAEHN
C[C@](O)(CN1CCC[C@@H](CCO)C1)C(F)(F)C(F)(F)F	ZINC000724041730	777228894	/nfs/dbraw/zinc/22/88/94/777228894.db2.gz	OLHCRSFGKOMWMR-UWVGGRQHSA-N	0	3	305.287	2.029	10	0		DEAEHN
C[C@@](O)(CN1CCC[C@@H](CCO)C1)C(F)(F)C(F)(F)F	ZINC000724041731	777228994	/nfs/dbraw/zinc/22/89/94/777228994.db2.gz	OLHCRSFGKOMWMR-VHSXEESVSA-N	0	3	305.287	2.029	10	0		DEAEHN
OC1CC2(C[C@H]2NCc2cc(Br)cc3c2OCC3)C1	ZINC000724999656	777551361	/nfs/dbraw/zinc/55/13/61/777551361.db2.gz	SCQVOLCJBHOFRH-JVWICGRDSA-N	0	3	324.218	2.387	10	0		DEAEHN
CC1(C)C[NH2+]C[C@@H]1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000721888486	781563556	/nfs/dbraw/zinc/56/35/56/781563556.db2.gz	NVMQRCGUSPDVRG-JTQLQIEISA-N	0	3	323.245	2.270	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCNCCC2(C)C)c(C)s1	ZINC000712508235	792191919	/nfs/dbraw/zinc/19/19/19/792191919.db2.gz	YEIIISOXROKYIN-UHFFFAOYSA-N	0	3	302.465	2.128	10	0		DEAEHN
C[C@H](N[C@H]1CCC[C@H]1CNC(=O)OC(C)(C)C)c1cn(C)nn1	ZINC000715858043	792527238	/nfs/dbraw/zinc/52/72/38/792527238.db2.gz	VQGZSZCLYBTAGN-AVGNSLFASA-N	0	3	323.441	2.159	10	0		DEAEHN
Cc1c(CN[C@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)cnn1C	ZINC000401717215	801844933	/nfs/dbraw/zinc/84/49/33/801844933.db2.gz	YTOAYCSSIFFGPI-DOMZBBRYSA-N	0	3	322.453	2.464	10	0		DEAEHN
C[C@H]1C[C@H](NCc2cncn2C)CN(C(=O)OC(C)(C)C)C1	ZINC000401765058	801850066	/nfs/dbraw/zinc/85/00/66/801850066.db2.gz	XWJMNPSFQVRXIC-STQMWFEESA-N	0	3	308.426	2.155	10	0		DEAEHN
CC[C@@H]1C[C@H](NCc2cn(C)nc2Br)CCO1	ZINC000720644797	1085809111	/nfs/dbraw/zinc/80/91/11/1085809111.db2.gz	GJQCRVRUQBPIJT-GHMZBOCLSA-N	0	3	302.216	2.230	10	0		DEAEHN
CN1CCC[C@@H]2[C@H]1CCN2C(=O)c1ccoc1Br	ZINC000720817236	1086167444	/nfs/dbraw/zinc/16/74/44/1086167444.db2.gz	RHUJXQFVHPBNTK-GHMZBOCLSA-N	0	3	313.195	2.351	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC2CC1(CNCc1ccc(CO)o1)C2	ZINC000701863074	1086392133	/nfs/dbraw/zinc/39/21/33/1086392133.db2.gz	DGGCNJUVHVQPPF-UHFFFAOYSA-N	0	3	322.405	2.261	10	0		DEAEHN
C[C@H](CNC(=O)[C@H](N)CN(C)Cc1ccccc1)C(C)(C)C	ZINC000702358471	1086423170	/nfs/dbraw/zinc/42/31/70/1086423170.db2.gz	SALLJVAOXSRNPB-GDBMZVCRSA-N	0	3	305.466	2.244	10	0		DEAEHN
COC1(OC)CC[C@@H]1N[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000710908960	1086690344	/nfs/dbraw/zinc/69/03/44/1086690344.db2.gz	XUCCUGMXZZARSM-STQMWFEESA-N	0	3	314.426	2.127	10	0		DEAEHN
COC1(OC)CC[C@@H]1NC[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000710906661	1086690701	/nfs/dbraw/zinc/69/07/01/1086690701.db2.gz	PQRJQHOGMKGKIB-STQMWFEESA-N	0	3	314.426	2.127	10	0		DEAEHN
CC[C@@H](NC)[C@@H](C)S(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000081936069	192342832	/nfs/dbraw/zinc/34/28/32/192342832.db2.gz	CTNATFLGWRTPKR-DGCLKSJQSA-N	0	3	313.419	2.008	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc(C)c(OC)c2)CCN1C[C@@H](C)O	ZINC000193899855	529396781	/nfs/dbraw/zinc/39/67/81/529396781.db2.gz	PUPBXGWBNMQRMM-NVXWUHKLSA-N	0	3	306.450	2.281	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCC[C@H](C(F)(F)F)C1)N(C)C1CC1	ZINC000171696884	282181181	/nfs/dbraw/zinc/18/11/81/282181181.db2.gz	YNPUFKWUQYKNFF-QWRGUYRKSA-N	0	3	307.360	2.453	10	0		DEAEHN
C[C@H](CNC(=O)N1CCC[C@@H](C(F)(F)F)C1)N(C)C1CC1	ZINC000171696900	282181246	/nfs/dbraw/zinc/18/12/46/282181246.db2.gz	YNPUFKWUQYKNFF-GHMZBOCLSA-N	0	3	307.360	2.453	10	0		DEAEHN
COc1ccc(C[C@H](N)c2ccn(C)n2)cc1Br	ZINC000087424185	185224268	/nfs/dbraw/zinc/22/42/68/185224268.db2.gz	NUFGYPFBOKFOHN-NSHDSACASA-N	0	3	310.195	2.434	10	0		DEAEHN
COc1ccc(Br)c(C[C@H](N)c2ccncn2)c1	ZINC000087795548	185232171	/nfs/dbraw/zinc/23/21/71/185232171.db2.gz	IMHLESGUYCBLRR-LBPRGKRZSA-N	0	3	308.179	2.490	10	0		DEAEHN
COc1ccccc1CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000173189392	282189062	/nfs/dbraw/zinc/18/90/62/282189062.db2.gz	KCKNTWQRPAWTBM-UKRRQHHQSA-N	0	3	305.422	2.319	10	0		DEAEHN
CN[C@@H](Cc1cc(OC)ccc1Br)c1nc[nH]n1	ZINC000087879014	185234422	/nfs/dbraw/zinc/23/44/22/185234422.db2.gz	HLXPAKZEIAPYPG-NSHDSACASA-N	0	3	311.183	2.079	10	0		DEAEHN
C[NH2+][C@@H](Cc1cc(OC)ccc1Br)c1nnc[n-]1	ZINC000087879014	185234423	/nfs/dbraw/zinc/23/44/23/185234423.db2.gz	HLXPAKZEIAPYPG-NSHDSACASA-N	0	3	311.183	2.079	10	0		DEAEHN
CN[C@@H](Cc1cc(OC)ccc1Br)c1nnc[nH]1	ZINC000087879014	185234424	/nfs/dbraw/zinc/23/44/24/185234424.db2.gz	HLXPAKZEIAPYPG-NSHDSACASA-N	0	3	311.183	2.079	10	0		DEAEHN
CN[C@H](Cc1ccc(OC)c(Br)c1)c1nc[nH]n1	ZINC000087879297	185234525	/nfs/dbraw/zinc/23/45/25/185234525.db2.gz	UQSNZSQJSKYRFD-SNVBAGLBSA-N	0	3	311.183	2.079	10	0		DEAEHN
CN[C@H](Cc1ccc(OC)c(Br)c1)c1nnc[nH]1	ZINC000087879297	185234526	/nfs/dbraw/zinc/23/45/26/185234526.db2.gz	UQSNZSQJSKYRFD-SNVBAGLBSA-N	0	3	311.183	2.079	10	0		DEAEHN
CC(C)(N)CS(=O)(=O)Cc1cccc(Br)c1	ZINC000088072419	185238907	/nfs/dbraw/zinc/23/89/07/185238907.db2.gz	DVUZNBAWBVXXPJ-UHFFFAOYSA-N	0	3	306.225	2.101	10	0		DEAEHN
CCc1cnc(CCNC(=O)NC[C@@H]2CCCN2CC)s1	ZINC000175365189	282195002	/nfs/dbraw/zinc/19/50/02/282195002.db2.gz	NDPOWNFBYJAGDX-LBPRGKRZSA-N	0	3	310.467	2.032	10	0		DEAEHN
CN(C)C[C@@H](O)CNc1c(F)cc(Br)cc1F	ZINC000088170824	185241053	/nfs/dbraw/zinc/24/10/53/185241053.db2.gz	GWTVWVPVYWYCDT-QMMMGPOBSA-N	0	3	309.154	2.062	10	0		DEAEHN
CCc1ccc(CNC)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H]1C	ZINC000165698065	197680205	/nfs/dbraw/zinc/68/02/05/197680205.db2.gz	ZEBSJASNAAGFER-STQMWFEESA-N	0	3	310.463	2.387	10	0		DEAEHN
CC[C@@H](C)C[C@H](C)NS(=O)(=O)c1cccc(F)c1CN	ZINC000088299314	185245071	/nfs/dbraw/zinc/24/50/71/185245071.db2.gz	PVKGVPNXHCFMTN-MNOVXSKESA-N	0	3	302.415	2.387	10	0		DEAEHN
CC[C@H](C)C[C@H](C)NS(=O)(=O)c1ccc(F)c(CN)c1	ZINC000088299331	185245088	/nfs/dbraw/zinc/24/50/88/185245088.db2.gz	OXTDFVLDMQACIA-QWRGUYRKSA-N	0	3	302.415	2.387	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N[C@@H](C)C[C@H](C)CC)o1	ZINC000088551585	185257338	/nfs/dbraw/zinc/25/73/38/185257338.db2.gz	LUXKMLPYWMSVCA-NEPJUHHUSA-N	0	3	302.440	2.492	10	0		DEAEHN
CCC1CCC([NH2+]Cc2ccc(S(=O)(=O)[N-]C)o2)CC1	ZINC000088540459	185255674	/nfs/dbraw/zinc/25/56/74/185255674.db2.gz	OWZUDQSMYNAQJQ-UHFFFAOYSA-N	0	3	300.424	2.246	10	0		DEAEHN
CCc1ccc([C@H](NC)[C@H](C)S(=O)(=O)CCCOC)cc1	ZINC000081986314	192348983	/nfs/dbraw/zinc/34/89/83/192348983.db2.gz	PFFAJXSVXWGWIW-XJKSGUPXSA-N	0	3	313.463	2.349	10	0		DEAEHN
CC(C)[C@@H]1CCCN1CC(=O)Nc1ccc(C(N)=S)cc1	ZINC000088837011	185266976	/nfs/dbraw/zinc/26/69/76/185266976.db2.gz	LNPRINWJEXWSJE-AWEZNQCLSA-N	0	3	305.447	2.380	10	0		DEAEHN
CCN[C@@H]1c2ccccc2CC[C@H]1S(=O)(=O)CCCOC	ZINC000081986165	192349828	/nfs/dbraw/zinc/34/98/28/192349828.db2.gz	YRUUUTKNXHGDNM-HZPDHXFCSA-N	0	3	311.447	2.103	10	0		DEAEHN
CN[C@@H](CS(=O)(=O)CCCOC)c1c(C)cc(C)cc1C	ZINC000081986120	192349921	/nfs/dbraw/zinc/34/99/21/192349921.db2.gz	IBNMRZXGVCLMEQ-HNNXBMFYSA-N	0	3	313.463	2.324	10	0		DEAEHN
CCN([C@@H](CN)c1cncc(Br)c1)[C@@H](C)COC	ZINC000166123125	197688079	/nfs/dbraw/zinc/68/80/79/197688079.db2.gz	AMKKACHJMOEHFO-GWCFXTLKSA-N	0	3	316.243	2.201	10	0		DEAEHN
CN(Cc1ccc(Br)cc1)[C@@H](CN)c1cncn1C	ZINC000090167501	185284664	/nfs/dbraw/zinc/28/46/64/185284664.db2.gz	ZYFJHXMEUOZLSH-ZDUSSCGKSA-N	0	3	323.238	2.314	10	0		DEAEHN
N[C@H]1COC[C@H]1C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000090379192	185293781	/nfs/dbraw/zinc/29/37/81/185293781.db2.gz	ZRDGCLNFWHXERL-XCBNKYQSSA-N	0	3	308.687	2.271	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)N(Cc1cccc(Cl)c1)C(C)C	ZINC000090435002	185296288	/nfs/dbraw/zinc/29/62/88/185296288.db2.gz	QKZPMXMQCMRHLV-GJZGRUSLSA-N	0	3	310.825	2.311	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1c2ncsc2ccc1Cl	ZINC000090432865	185296352	/nfs/dbraw/zinc/29/63/52/185296352.db2.gz	FSAASTYZGUFZJV-APPZFPTMSA-N	0	3	311.794	2.123	10	0		DEAEHN
C[C@@]1(C(=O)Nc2ccc(Cl)c3cccnc23)COC[C@@H]1N	ZINC000090589701	185305450	/nfs/dbraw/zinc/30/54/50/185305450.db2.gz	MTZFWSUPRIBARV-SWLSCSKDSA-N	0	3	305.765	2.191	10	0		DEAEHN
C[C@@]1(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)COC[C@@H]1N	ZINC000090599241	185305966	/nfs/dbraw/zinc/30/59/66/185305966.db2.gz	FRHSYZLNQRFVGS-GXFFZTMASA-N	0	3	320.723	2.244	10	0		DEAEHN
c1ccc(NC2CCN(CCOC3CCOCC3)CC2)nc1	ZINC000625277932	365710536	/nfs/dbraw/zinc/71/05/36/365710536.db2.gz	USGGIPCPXTVINJ-UHFFFAOYSA-N	0	3	305.422	2.154	10	0		DEAEHN
CN(C)C[C@@H]1CSCCCN1C(=O)c1cccc(N(C)C)c1	ZINC000090700134	185310508	/nfs/dbraw/zinc/31/05/08/185310508.db2.gz	ZISVBQJQWZTTAJ-MRXNPFEDSA-N	0	3	321.490	2.262	10	0		DEAEHN
COc1ccc2c(c1)[C@@H](N[C@@H]1CCCS(=O)(=O)C1)CCC2	ZINC000092384057	185315316	/nfs/dbraw/zinc/31/53/16/185315316.db2.gz	ZBYPNIFRJWBIJJ-CJNGLKHVSA-N	0	3	309.431	2.239	10	0		DEAEHN
CCCNCc1c(Cl)cccc1N1C[C@H](CO)OC[C@@H]1C	ZINC000167310380	197706685	/nfs/dbraw/zinc/70/66/85/197706685.db2.gz	KGUFHZPPPWVEEY-QWHCGFSZSA-N	0	3	312.841	2.426	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cnc(NC)c(Cl)c1	ZINC000092674758	185333149	/nfs/dbraw/zinc/33/31/49/185333149.db2.gz	YXRYCUXYLIBREX-GFCCVEGCSA-N	0	3	310.829	2.333	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CCc1cccc2c1OCO2	ZINC000186221128	282270047	/nfs/dbraw/zinc/27/00/47/282270047.db2.gz	QMPCMTLSUINAPE-OAHLLOKOSA-N	0	3	318.417	2.291	10	0		DEAEHN
CN(CCNC(=O)NC[C@@H]1CCC(C)(C)O1)Cc1ccccc1	ZINC000186387403	282274584	/nfs/dbraw/zinc/27/45/84/282274584.db2.gz	CEIBHUNGCJBJFA-INIZCTEOSA-N	0	3	319.449	2.375	10	0		DEAEHN
CCCNC(=O)c1cccc(N2CCN[C@H](c3ccccc3)C2)n1	ZINC000065256207	539344551	/nfs/dbraw/zinc/34/45/51/539344551.db2.gz	GMUNUKBPUXVCEJ-KRWDZBQOSA-N	0	3	324.428	2.372	10	0		DEAEHN
CCN(CC)CC(=O)NCCc1cn(C)c2cc(C)ccc12	ZINC000188438169	282300503	/nfs/dbraw/zinc/30/05/03/282300503.db2.gz	YZFOKTBIORABEH-UHFFFAOYSA-N	0	3	301.434	2.487	10	0		DEAEHN
CS[C@H]1CN(C(=O)c2cc(C)[nH]c2C)C[C@@H]1N1CCCC1	ZINC000614279331	362338167	/nfs/dbraw/zinc/33/81/67/362338167.db2.gz	VBQZMBPXCWWLCG-GJZGRUSLSA-N	0	3	307.463	2.283	10	0		DEAEHN
CN(Cc1cc(-c2ccccc2)n[nH]1)CC1(O)CCOCC1	ZINC000188834264	529975205	/nfs/dbraw/zinc/97/52/05/529975205.db2.gz	YIWHMTHVIYQQTB-UHFFFAOYSA-N	0	3	301.390	2.050	10	0		DEAEHN
CN(Cc1nccs1)C[C@@H]1CCCN(C)[C@H]1c1cnn(C)c1	ZINC000328656546	530028755	/nfs/dbraw/zinc/02/87/55/530028755.db2.gz	ZLOWISRZQNTAFS-XJKSGUPXSA-N	0	3	319.478	2.392	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@H](C)Cc1c(C)nn(C)c1C	ZINC000245433268	282387937	/nfs/dbraw/zinc/38/79/37/282387937.db2.gz	PPSCZMYYISXHFA-CZUORRHYSA-N	0	3	320.481	2.158	10	0		DEAEHN
COc1cc(OC)cc(OCCCNCc2cncnc2)c1	ZINC000151146332	539525875	/nfs/dbraw/zinc/52/58/75/539525875.db2.gz	CCADFZBRAHNZKE-UHFFFAOYSA-N	0	3	303.362	2.053	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)c1cnn(CCC(F)(F)F)c1	ZINC000181847847	199362024	/nfs/dbraw/zinc/36/20/24/199362024.db2.gz	UPFSOYQMDPUXCN-LBPRGKRZSA-N	0	3	318.343	2.050	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@@H](C)OC[C@H]1CCCCO1	ZINC000249809089	282583762	/nfs/dbraw/zinc/58/37/62/282583762.db2.gz	HFRLDXHXHXIIFG-BZUAXINKSA-N	0	3	314.470	2.053	10	0		DEAEHN
NC(=O)c1ccccc1[C@@H]1COCCN(Cc2ccccc2)C1	ZINC000616661805	362906118	/nfs/dbraw/zinc/90/61/18/362906118.db2.gz	ZIRFALUVAVFUAQ-INIZCTEOSA-N	0	3	310.397	2.402	10	0		DEAEHN
NC[C@@H](NC[C@H]1CCCO1)c1ccc(Br)s1	ZINC000083774173	192382957	/nfs/dbraw/zinc/38/29/57/192382957.db2.gz	KMQFJYVDTSCPCA-RKDXNWHRSA-N	0	3	305.241	2.279	10	0		DEAEHN
Cc1c(C(=O)NCc2ccccc2OCCN(C)C)ccn1C	ZINC000195151537	539720505	/nfs/dbraw/zinc/72/05/05/539720505.db2.gz	RXJLGFPEBZHPNB-UHFFFAOYSA-N	0	3	315.417	2.204	10	0		DEAEHN
COC[C@H](O)CCNCc1ccc(Br)c(F)c1	ZINC000231605127	539734913	/nfs/dbraw/zinc/73/49/13/539734913.db2.gz	LITFXCZKXQPYSO-SNVBAGLBSA-N	0	3	306.175	2.075	10	0		DEAEHN
COC[C@@H](O)CCNCc1ccc(Br)c(F)c1	ZINC000231605122	539735090	/nfs/dbraw/zinc/73/50/90/539735090.db2.gz	LITFXCZKXQPYSO-JTQLQIEISA-N	0	3	306.175	2.075	10	0		DEAEHN
[NH3+]CCCCCc1nc(CC(=O)Nc2ncccc2[O-])cs1	ZINC000071694409	191008361	/nfs/dbraw/zinc/00/83/61/191008361.db2.gz	NYLBJIHMSPYGQL-UHFFFAOYSA-N	0	3	320.418	2.096	10	0		DEAEHN
CN(c1ccccc1)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138264603	186015808	/nfs/dbraw/zinc/01/58/08/186015808.db2.gz	KZWJWHNETJXATR-UHFFFAOYSA-N	0	3	312.341	2.249	10	0		DEAEHN
CCCN(C1CC1)S(=O)(=O)c1cc(CNC)cc(F)c1F	ZINC000138451983	186017113	/nfs/dbraw/zinc/01/71/13/186017113.db2.gz	IQMKVICGHNZLQA-UHFFFAOYSA-N	0	3	318.389	2.247	10	0		DEAEHN
CCNCc1cc(F)c(F)c(S(=O)(=O)N(C)[C@@H](C)CC)c1	ZINC000138458533	186017347	/nfs/dbraw/zinc/01/73/47/186017347.db2.gz	OMEIDTRSWXYJIU-JTQLQIEISA-N	0	3	320.405	2.493	10	0		DEAEHN
NCC1(c2nc(-c3cncc(Br)c3)no2)CCC1	ZINC000138621578	186017759	/nfs/dbraw/zinc/01/77/59/186017759.db2.gz	AAMBMCYNLMUGMK-UHFFFAOYSA-N	0	3	309.167	2.275	10	0		DEAEHN
CC1(C)CCCN(S(=O)(=O)c2cc(CN)cc(F)c2F)C1	ZINC000139101124	186020275	/nfs/dbraw/zinc/02/02/75/186020275.db2.gz	KJHWAAAIMTWABB-UHFFFAOYSA-N	0	3	318.389	2.234	10	0		DEAEHN
CC[C@@H]1N[C@H](c2cccs2)N(C[C@@H]2CCCN2CC)C1=O	ZINC000140298852	186026169	/nfs/dbraw/zinc/02/61/69/186026169.db2.gz	SXJHZMOASBURJL-YDHLFZDLSA-N	0	3	307.463	2.441	10	0		DEAEHN
CN[C@H](Cc1cnccc1N)c1ccc(Br)cn1	ZINC000140217327	186026310	/nfs/dbraw/zinc/02/63/10/186026310.db2.gz	SUPYVDDLSGOBDD-CYBMUJFWSA-N	0	3	307.195	2.325	10	0		DEAEHN
CCc1ccc(CNC(C)C)cc1S(=O)(=O)NCC(F)F	ZINC000148180434	186043418	/nfs/dbraw/zinc/04/34/18/186043418.db2.gz	SXEUXHONRRIWDP-UHFFFAOYSA-N	0	3	320.405	2.290	10	0		DEAEHN
CC[C@@H]1N[C@H](c2cccs2)N(C[C@@H]2CCCCN2C)C1=O	ZINC000144354619	186034980	/nfs/dbraw/zinc/03/49/80/186034980.db2.gz	QYZDKKKYHJEZHD-YDHLFZDLSA-N	0	3	307.463	2.441	10	0		DEAEHN
CC[C@@H]1N[C@H](c2ccsc2)N([C@@H]2CCCN(CC)C2)C1=O	ZINC000144312283	186035068	/nfs/dbraw/zinc/03/50/68/186035068.db2.gz	FJXMVCUFNLWXHQ-ILXRZTDVSA-N	0	3	307.463	2.441	10	0		DEAEHN
CNCc1cc(F)c(C)c(S(=O)(=O)N(C)C2CCC2)c1	ZINC000144651575	186035657	/nfs/dbraw/zinc/03/56/57/186035657.db2.gz	NLDICIXATRPPPK-UHFFFAOYSA-N	0	3	300.399	2.027	10	0		DEAEHN
CC[C@@H]1CN(Cc2cccc(OC)c2F)CCN1C[C@H](C)O	ZINC000249455350	539780430	/nfs/dbraw/zinc/78/04/30/539780430.db2.gz	XQSIPOWJYXZJBV-DZGCQCFKSA-N	0	3	310.413	2.111	10	0		DEAEHN
CCOc1cc(NC(=O)N2CC[C@@H](N(C)C)C2)ccc1OC	ZINC000171078521	197877032	/nfs/dbraw/zinc/87/70/32/197877032.db2.gz	UIDPMYQLHVNSIJ-CYBMUJFWSA-N	0	3	307.394	2.262	10	0		DEAEHN
Cc1ccc(S(C)(=O)=O)cc1N[C@H]1CCN2CCC[C@@H]2C1	ZINC000155888039	186121106	/nfs/dbraw/zinc/12/11/06/186121106.db2.gz	YAELBERUFOPOSE-UONOGXRCSA-N	0	3	308.447	2.437	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1ccc(Br)cc1F	ZINC000159556200	186127053	/nfs/dbraw/zinc/12/70/53/186127053.db2.gz	FDDXRHOOPIQPDI-SNVBAGLBSA-N	0	3	319.174	2.281	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1ccccc1Br	ZINC000159569533	186127473	/nfs/dbraw/zinc/12/74/73/186127473.db2.gz	LUOJQLHQTJZOJS-JTQLQIEISA-N	0	3	301.184	2.142	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000164135341	186150083	/nfs/dbraw/zinc/15/00/83/186150083.db2.gz	LJIJUGNQBBDCNE-CABCVRRESA-N	0	3	317.433	2.425	10	0		DEAEHN
CCC[C@@H](NCC(=O)NC(N)=O)c1cccc(C(F)(F)F)c1	ZINC000181868010	186212726	/nfs/dbraw/zinc/21/27/26/186212726.db2.gz	WKGKZPBPKAKMHU-LLVKDONJSA-N	0	3	317.311	2.331	10	0		DEAEHN
COC(=O)c1coc(C(=O)N[C@@H](CN(C)C)c2ccccc2)c1	ZINC000183866395	186224901	/nfs/dbraw/zinc/22/49/01/186224901.db2.gz	WOIGNZCFXAPOSS-AWEZNQCLSA-N	0	3	316.357	2.099	10	0		DEAEHN
CCOC(=O)CN(C)C(=O)CN[C@H](C)c1ccc(C(C)C)cc1	ZINC000171912699	198007378	/nfs/dbraw/zinc/00/73/78/198007378.db2.gz	UMKGFUATHXUBDS-CQSZACIVSA-N	0	3	320.433	2.482	10	0		DEAEHN
CC(C)(CNC(=O)N1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000171901312	198003650	/nfs/dbraw/zinc/00/36/50/198003650.db2.gz	YXKXKUFWDKJJDE-MRXNPFEDSA-N	0	3	301.434	2.454	10	0		DEAEHN
CC(C)Oc1ccccc1CNC(=O)N1CCN2CCC[C@H]2C1	ZINC000171903651	198004946	/nfs/dbraw/zinc/00/49/46/198004946.db2.gz	KXANRJIMVVOFLU-INIZCTEOSA-N	0	3	317.433	2.463	10	0		DEAEHN
CNCC(=O)N1CCC[C@H]1c1n[nH]cc1-c1ccccc1F	ZINC000072367532	191137822	/nfs/dbraw/zinc/13/78/22/191137822.db2.gz	HGPYZOOPSFNCNW-AWEZNQCLSA-N	0	3	302.353	2.099	10	0		DEAEHN
CN(C[C@@H]1CCCN(C)C1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000172124999	198042620	/nfs/dbraw/zinc/04/26/20/198042620.db2.gz	CBJCUPALWWXZRL-GDBMZVCRSA-N	0	3	317.433	2.493	10	0		DEAEHN
COCc1csc(NC(=O)C2Oc3ccccc3O[C@H]2C)n1	ZINC000172152641	198047768	/nfs/dbraw/zinc/04/77/68/198047768.db2.gz	OZCURHAARLSBKI-TVQRCGJNSA-N	0	3	320.370	2.457	10	0		DEAEHN
CCn1cc(C(=O)N2CCO[C@@H](CN(C)C)C2)c2ccccc21	ZINC000172308287	198077031	/nfs/dbraw/zinc/07/70/31/198077031.db2.gz	LEHILEGIANPRCN-AWEZNQCLSA-N	0	3	315.417	2.064	10	0		DEAEHN
CSc1ccc(O[C@@H](C)C(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000172605218	198122457	/nfs/dbraw/zinc/12/24/57/198122457.db2.gz	RCVHAWMMMMHXKC-UONOGXRCSA-N	0	3	320.458	2.482	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2ccc3c(c2)OCCCO3)CCN1C	ZINC000172622006	198126662	/nfs/dbraw/zinc/12/66/62/198126662.db2.gz	OIQAAYGFKLSIMB-ZFWWWQNUSA-N	0	3	318.417	2.403	10	0		DEAEHN
CN(C[C@H]1CC[N@H+](C)C1)C(=O)c1ccc2c(c1[O-])OC(C)(C)C2	ZINC000333274939	539954243	/nfs/dbraw/zinc/95/42/43/539954243.db2.gz	OFNMIFOLXHMXOY-LBPRGKRZSA-N	0	3	318.417	2.129	10	0		DEAEHN
CN(C[C@H]1CC[N@@H+](C)C1)C(=O)c1ccc2c(c1[O-])OC(C)(C)C2	ZINC000333274939	539954245	/nfs/dbraw/zinc/95/42/45/539954245.db2.gz	OFNMIFOLXHMXOY-LBPRGKRZSA-N	0	3	318.417	2.129	10	0		DEAEHN
C[C@H]1CN(C(=O)Nc2ccc3c(c2F)CCNC3)C[C@H](C)O1	ZINC000333305186	539955315	/nfs/dbraw/zinc/95/53/15/539955315.db2.gz	KWCWPTSPJMXPSL-QWRGUYRKSA-N	0	3	307.369	2.113	10	0		DEAEHN
COc1ccccc1CCNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000173425774	198213396	/nfs/dbraw/zinc/21/33/96/198213396.db2.gz	RWSHTTBZGBBIDG-ZBFHGGJFSA-N	0	3	319.449	2.362	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1c[nH]nc1-c1ccccc1	ZINC000173584309	198230097	/nfs/dbraw/zinc/23/00/97/198230097.db2.gz	YMPOOPJRCSOFFJ-UKRRQHHQSA-N	0	3	310.401	2.385	10	0		DEAEHN
CC(C)N(C)CC(=O)N[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000173920131	198269842	/nfs/dbraw/zinc/26/98/42/198269842.db2.gz	HEMLEEYPVRFBFD-CQSZACIVSA-N	0	3	300.406	2.390	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCCCNc2ccccn2)CCN1C	ZINC000173955087	198273271	/nfs/dbraw/zinc/27/32/71/198273271.db2.gz	HHFWIJJOOFECOF-LSDHHAIUSA-N	0	3	319.453	2.008	10	0		DEAEHN
CC[C@H](O)CN1CCN(CCCOc2c(C)cccc2C)CC1	ZINC000174079063	198289072	/nfs/dbraw/zinc/28/90/72/198289072.db2.gz	ACUPNOHNSAXKNZ-SFHVURJKSA-N	0	3	320.477	2.461	10	0		DEAEHN
CC[C@H](O)CN1CCN(Cc2cccc(OC(F)F)c2)CC1	ZINC000174082968	198289467	/nfs/dbraw/zinc/28/94/67/198289467.db2.gz	SEPGJBNXHMPWRD-AWEZNQCLSA-N	0	3	314.376	2.177	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCc2ccc(Cl)nc2)CCN1C	ZINC000174120561	198294157	/nfs/dbraw/zinc/29/41/57/198294157.db2.gz	MBXQVSJGYKVPKG-AAEUAGOBSA-N	0	3	310.829	2.359	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2cnn(CC(F)F)c2)CCN1C	ZINC000174852986	198393401	/nfs/dbraw/zinc/39/34/01/198393401.db2.gz	PRPYEKHBUHNYQT-PWSUYJOCSA-N	0	3	315.368	2.095	10	0		DEAEHN
C[C@H]1CCc2nc(NC(=O)NC3CCN(C)CC3)sc2C1	ZINC000043577612	354224104	/nfs/dbraw/zinc/22/41/04/354224104.db2.gz	XLIZJUGXSJSBEH-JTQLQIEISA-N	0	3	308.451	2.484	10	0		DEAEHN
c1nc(CNC[C@H]2CN(Cc3ccccc3)CCCO2)co1	ZINC000277018801	213242619	/nfs/dbraw/zinc/24/26/19/213242619.db2.gz	MLCXHSRCDRUNCB-KRWDZBQOSA-N	0	3	301.390	2.055	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)c1c[nH]nc1-c1ccc(F)cc1	ZINC000055209296	354488439	/nfs/dbraw/zinc/48/84/39/354488439.db2.gz	SXVJLMOCSYVHCZ-AWEZNQCLSA-N	0	3	316.380	2.430	10	0		DEAEHN
CCCOc1ncccc1CNC(=O)N[C@@H]1CCCN(CC)C1	ZINC000068365019	354808750	/nfs/dbraw/zinc/80/87/50/354808750.db2.gz	IZEHICXPPVXTIO-OAHLLOKOSA-N	0	3	320.437	2.154	10	0		DEAEHN
O=S1(=O)CC(CCNCc2csc(Br)c2)C1	ZINC000381561809	540123031	/nfs/dbraw/zinc/12/30/31/540123031.db2.gz	QPYARMFWHXZKRN-UHFFFAOYSA-N	0	3	324.265	2.035	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCC(C)(C)C[C@H](C)O	ZINC000073722214	191345890	/nfs/dbraw/zinc/34/58/90/191345890.db2.gz	ZSNABQNWBJRWEL-UONOGXRCSA-N	0	3	301.475	2.059	10	0		DEAEHN
CN(C[C@H]1CCCN(C)C1)C(=O)Nc1ccc([S@](C)=O)cc1	ZINC000080126810	355348182	/nfs/dbraw/zinc/34/81/82/355348182.db2.gz	HRCGNBHXJOLXCU-WHEQGISXSA-N	0	3	323.462	2.230	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)N[C@H]2CNCCC2(F)F)cc1C	ZINC000415374982	540159824	/nfs/dbraw/zinc/15/98/24/540159824.db2.gz	KYRBDAFSJHJAMC-ZDUSSCGKSA-N	0	3	311.332	2.316	10	0		DEAEHN
Cc1c(C(=O)N[C@@H]2CC[C@@H](N(C)C)C2)oc2c1C(=O)CCC2	ZINC000093988773	355690894	/nfs/dbraw/zinc/69/08/94/355690894.db2.gz	DRAONSMHVGHOJF-VXGBXAGGSA-N	0	3	304.390	2.320	10	0		DEAEHN
CCCC1CCC(CN2CC[C@H](NS(C)(=O)=O)C2)CC1	ZINC000180333132	356048017	/nfs/dbraw/zinc/04/80/17/356048017.db2.gz	WVFGDYAEEKKGOW-NRXISQOPSA-N	0	3	302.484	2.216	10	0		DEAEHN
CC(C)Oc1cccc(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)n1	ZINC000179116452	356014916	/nfs/dbraw/zinc/01/49/16/356014916.db2.gz	QLIQHWXWZLEMJR-UONOGXRCSA-N	0	3	305.422	2.424	10	0		DEAEHN
CCCCN(CCCO)CC(=O)N1CCC[C@H](C(F)(F)F)C1	ZINC000182155792	356111868	/nfs/dbraw/zinc/11/18/68/356111868.db2.gz	XLTYOECOHFBFMP-ZDUSSCGKSA-N	0	3	324.387	2.272	10	0		DEAEHN
CNC(=O)[C@H]1C[C@@H](c2ccccc2OC(F)(F)F)CCN1	ZINC000080129563	192003651	/nfs/dbraw/zinc/00/36/51/192003651.db2.gz	XEHQKPNLUQMTAJ-GXSJLCMTSA-N	0	3	302.296	2.167	10	0		DEAEHN
CCS(=O)(=O)C[C@H](C)NC[C@@H](C)c1ccc(F)cc1F	ZINC000183051795	356157619	/nfs/dbraw/zinc/15/76/19/356157619.db2.gz	UTRHDWZEZFNOGW-MNOVXSKESA-N	0	3	305.390	2.481	10	0		DEAEHN
COc1cc([C@H](C)NC[C@@H]2CC[C@H](C(=O)N(C)C)O2)ccc1F	ZINC000183464252	356172844	/nfs/dbraw/zinc/17/28/44/356172844.db2.gz	PINBEBPELUNHSZ-CORIIIEPSA-N	0	3	324.396	2.121	10	0		DEAEHN
CCN(CC)C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000192937921	356221683	/nfs/dbraw/zinc/22/16/83/356221683.db2.gz	HMSOKGBQEOTEEU-INIZCTEOSA-N	0	3	304.438	2.297	10	0		DEAEHN
Cc1ccc(C[C@@H](C)NS(=O)(=O)C[C@H]2CCCCN2)s1	ZINC000080248273	192016289	/nfs/dbraw/zinc/01/62/89/192016289.db2.gz	UUWGSQBRAWVHEO-DGCLKSJQSA-N	0	3	316.492	2.049	10	0		DEAEHN
C[C@H]1CN[C@H](C(=O)N(Cc2ccccc2)Cc2ccccc2)CN1	ZINC000307733900	356409466	/nfs/dbraw/zinc/40/94/66/356409466.db2.gz	UCAGOTDVYANPQO-LPHOPBHVSA-N	0	3	323.440	2.165	10	0		DEAEHN
CCC[C@H](N)C(=O)Nc1nc2cc3c(cc2s1)OCCO3	ZINC000236964726	202097884	/nfs/dbraw/zinc/09/78/84/202097884.db2.gz	DARGBVHUYWFHMO-QMMMGPOBSA-N	0	3	307.375	2.133	10	0		DEAEHN
CC[C@@H]1[C@H](CO)CCN1CC(=O)N(CC)Cc1ccccc1	ZINC000385934447	356693289	/nfs/dbraw/zinc/69/32/89/356693289.db2.gz	VHEAZUQQOWAGQD-DLBZAZTESA-N	0	3	304.434	2.128	10	0		DEAEHN
OCCN1CCC[C@@H](NCc2csc(Br)c2)C1	ZINC000384276769	356682520	/nfs/dbraw/zinc/68/25/20/356682520.db2.gz	ALJCFOOMDJWVEO-LLVKDONJSA-N	0	3	319.268	2.057	10	0		DEAEHN
CC(=O)N1C[C@@H]2CCC[C@H](N[C@H](C)c3nccnc3C)[C@@H]2C1	ZINC000579400815	356968810	/nfs/dbraw/zinc/96/88/10/356968810.db2.gz	ALDFCKCIURPGDH-BVUBDWEXSA-N	0	3	302.422	2.083	10	0		DEAEHN
C[C@@H]1Cc2ccccc2N1C1CCN(CCn2cncn2)CC1	ZINC000589152152	357447940	/nfs/dbraw/zinc/44/79/40/357447940.db2.gz	WYMJGVFUCKILGW-OAHLLOKOSA-N	0	3	311.433	2.194	10	0		DEAEHN
C[C@H]1Cc2ccccc2N1C1CCN(CCn2cncn2)CC1	ZINC000589152148	357448542	/nfs/dbraw/zinc/44/85/42/357448542.db2.gz	WYMJGVFUCKILGW-HNNXBMFYSA-N	0	3	311.433	2.194	10	0		DEAEHN
CN(Cc1ccc2c[nH]nc2c1)[C@H]1CCCN(c2cccnn2)C1	ZINC000179495663	199045027	/nfs/dbraw/zinc/04/50/27/199045027.db2.gz	MBTNINOQLOINHT-INIZCTEOSA-N	0	3	322.416	2.454	10	0		DEAEHN
CCC[C@@H](C)CN1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000180132828	199121175	/nfs/dbraw/zinc/12/11/75/199121175.db2.gz	BZQNBZRZJUJSDW-QZTJIDSGSA-N	0	3	320.477	2.480	10	0		DEAEHN
Cc1cc(C)n(CC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)n1	ZINC000180189887	199128248	/nfs/dbraw/zinc/12/82/48/199128248.db2.gz	UEFKTICFONUSDA-SJLPKXTDSA-N	0	3	312.417	2.062	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cc(CC(C)C)[nH]c(=O)c2)C1	ZINC000180278898	199140749	/nfs/dbraw/zinc/14/07/49/199140749.db2.gz	UBWVJOCSLDOZHF-CQSZACIVSA-N	0	3	305.422	2.200	10	0		DEAEHN
Cc1ccc(Cl)c(OC[C@H](O)CN(C)CC2(CO)CC2)c1	ZINC000186758169	200004746	/nfs/dbraw/zinc/00/47/46/200004746.db2.gz	PARCDZLYAWWJJH-CYBMUJFWSA-N	0	3	313.825	2.092	10	0		DEAEHN
CCN(CCO)CCNC(=O)N[C@@H]1CC[C@H](C)c2ccccc21	ZINC000187380881	200104133	/nfs/dbraw/zinc/10/41/33/200104133.db2.gz	KADICSSBIJCDOD-WMLDXEAASA-N	0	3	319.449	2.238	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)NCc1cc(F)ccc1OC	ZINC000187259148	200085317	/nfs/dbraw/zinc/08/53/17/200085317.db2.gz	FNZWJRACTYGQHP-CQSZACIVSA-N	0	3	309.385	2.118	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)CN(C)c1ccc(Cl)cn1	ZINC000600439529	359743081	/nfs/dbraw/zinc/74/30/81/359743081.db2.gz	JJEUACXDAXFVQJ-CQSZACIVSA-N	0	3	324.856	2.162	10	0		DEAEHN
CCC[C@H](C(=O)NCc1cc(COC(C)(C)C)on1)N(C)C	ZINC000188572513	200268753	/nfs/dbraw/zinc/26/87/53/200268753.db2.gz	MFAWNJHKVLXRQA-CQSZACIVSA-N	0	3	311.426	2.336	10	0		DEAEHN
O=C1[C@@H](N[C@H]2CCCSC2)CCN1Cc1ccc(F)cc1	ZINC000189055789	200342655	/nfs/dbraw/zinc/34/26/55/200342655.db2.gz	YYHPNUSGVXVGTF-GJZGRUSLSA-N	0	3	308.422	2.412	10	0		DEAEHN
Brc1ccc2ncc(CNC[C@@H]3CCCO3)n2c1	ZINC000608053194	361160776	/nfs/dbraw/zinc/16/07/76/361160776.db2.gz	NFSSLRPFTLTAMV-LBPRGKRZSA-N	0	3	310.195	2.365	10	0		DEAEHN
CCc1nc(NC(=O)Nc2cnn(CCN(C)C)c2)sc1C	ZINC000608335191	361199021	/nfs/dbraw/zinc/19/90/21/361199021.db2.gz	DVMBJZWOVISGKC-UHFFFAOYSA-N	0	3	322.438	2.416	10	0		DEAEHN
C[C@H](CO)CN(C)CCOc1ccc(Br)cc1	ZINC000608498647	361227913	/nfs/dbraw/zinc/22/79/13/361227913.db2.gz	XIXNPBWEJJOTIB-NSHDSACASA-N	0	3	302.212	2.388	10	0		DEAEHN
C[C@H]1CCNC(=O)[C@@H]1NCc1ccc(SC(=O)N(C)C)cc1	ZINC000193635511	201092544	/nfs/dbraw/zinc/09/25/44/201092544.db2.gz	LQSKTXNBPINNBC-SMDDNHRTSA-N	0	3	321.446	2.075	10	0		DEAEHN
CCN(CC)CC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000610825900	361473588	/nfs/dbraw/zinc/47/35/88/361473588.db2.gz	RYXGRJHIRBGYCM-MRXNPFEDSA-N	0	3	320.433	2.385	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCC[C@H](CCC(=O)OCC)C1	ZINC000611043610	361518286	/nfs/dbraw/zinc/51/82/86/361518286.db2.gz	RMAWHQZMZGPDFI-HZPDHXFCSA-N	0	3	324.465	2.443	10	0		DEAEHN
O=C(NCc1ccc2ncccc2c1)N1CC[C@H](N2CC=CC2)C1	ZINC000194595381	201259633	/nfs/dbraw/zinc/25/96/33/201259633.db2.gz	VLCXYNMRWUJHCA-KRWDZBQOSA-N	0	3	322.412	2.391	10	0		DEAEHN
Cc1nc(C[C@@H]2CCCN(C[C@H](O)Cc3ccccc3)C2)no1	ZINC000195518140	201396797	/nfs/dbraw/zinc/39/67/97/201396797.db2.gz	UXSSVIUJYFLMBV-DLBZAZTESA-N	0	3	315.417	2.236	10	0		DEAEHN
CCn1nccc1[C@@H]1OCC[C@H]1C[NH2+]Cc1nc(C)ccc1[O-]	ZINC000275356352	212289292	/nfs/dbraw/zinc/28/92/92/212289292.db2.gz	AOKGQXAHKQJLNA-SUMWQHHRSA-N	0	3	316.405	2.179	10	0		DEAEHN
O=C(C[C@H]1CSCCN1)N1CC=C(c2ccccc2)CC1	ZINC000091135874	193001898	/nfs/dbraw/zinc/00/18/98/193001898.db2.gz	KIAGGNJQHQDEGB-INIZCTEOSA-N	0	3	302.443	2.397	10	0		DEAEHN
Cc1ccc(C(F)(F)F)cc1NC(=O)[C@@]1(C)COC[C@H]1N	ZINC000091479815	193062110	/nfs/dbraw/zinc/06/21/10/193062110.db2.gz	YURNFOKEQXUDOS-YPMHNXCESA-N	0	3	302.296	2.316	10	0		DEAEHN
c1ccc2c(c1)CSC[C@@H]2NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000091666429	193087813	/nfs/dbraw/zinc/08/78/13/193087813.db2.gz	DYRBFUGLUFQZKP-INMHGKMJSA-N	0	3	304.459	2.427	10	0		DEAEHN
O=c1cc(CNC[C@H](O)c2ccccc2)[nH]c2ccc(F)cc12	ZINC000091738557	193100567	/nfs/dbraw/zinc/10/05/67/193100567.db2.gz	MGZGZPCJEFBYAB-SFHVURJKSA-N	0	3	312.344	2.490	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@@H]1O)c1ccccc1Br	ZINC000624235188	365343310	/nfs/dbraw/zinc/34/33/10/365343310.db2.gz	GECLJQDDDHKECW-XDTLVQLUSA-N	0	3	300.196	2.250	10	0		DEAEHN
C[C@@H]1[NH2+]CC[C@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000624415698	365416096	/nfs/dbraw/zinc/41/60/96/365416096.db2.gz	WNNFYDLQKDSNEZ-OIBJUYFYSA-N	0	3	309.218	2.022	10	0		DEAEHN
CC[C@@H]1[NH2+]CC[C@H]1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000624392648	365407650	/nfs/dbraw/zinc/40/76/50/365407650.db2.gz	WNDBDVUFAQYNRT-NWDGAFQWSA-N	0	3	323.245	2.412	10	0		DEAEHN
Cn1ncc(Br)c1CNCCN1CCCC1(C)C	ZINC000449778410	241074111	/nfs/dbraw/zinc/07/41/11/241074111.db2.gz	BRLNPOXGBAAEOX-UHFFFAOYSA-N	0	3	315.259	2.147	10	0		DEAEHN
CC(=O)[C@](C)(O)CN[C@@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000450661155	242074866	/nfs/dbraw/zinc/07/48/66/242074866.db2.gz	DEXSLPOAAOAXPV-APPDUMDISA-N	0	3	304.390	2.026	10	0		DEAEHN
CC[C@@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)cc1F	ZINC000092115786	193163043	/nfs/dbraw/zinc/16/30/43/193163043.db2.gz	XIIKSSFFACWJOX-LLVKDONJSA-N	0	3	302.415	2.401	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2C[C@@H](C)CC[C@@H]2C)c(F)c1	ZINC000092116276	193163812	/nfs/dbraw/zinc/16/38/12/193163812.db2.gz	NAXUBEGZKSGONN-RYUDHWBXSA-N	0	3	314.426	2.354	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCCC(C)(C)C2)c(F)c1	ZINC000092116219	193164243	/nfs/dbraw/zinc/16/42/43/193164243.db2.gz	HTULVFZKAAJNFJ-UHFFFAOYSA-N	0	3	314.426	2.356	10	0		DEAEHN
c1cc(CNCCCOC[C@@H]2CCCO2)n(CC2CCC2)n1	ZINC000631037552	367982184	/nfs/dbraw/zinc/98/21/84/367982184.db2.gz	UOHODOKCHDCFGP-KRWDZBQOSA-N	0	3	307.438	2.359	10	0		DEAEHN
COC[C@@H](O)CN1CC[C@@H](c2cccc(Br)c2)C1	ZINC000451573230	243142654	/nfs/dbraw/zinc/14/26/54/243142654.db2.gz	UFUGFHILBFHKPD-OCCSQVGLSA-N	0	3	314.223	2.246	10	0		DEAEHN
COCCNCc1ccnn1C[C@H]1Cc2ccccc2S1	ZINC000092271936	193183484	/nfs/dbraw/zinc/18/34/84/193183484.db2.gz	STVZRMWDHUOTMC-OAHLLOKOSA-N	0	3	303.431	2.336	10	0		DEAEHN
Cc1ccc(-c2nc(NC(=O)[C@@H]3C[C@@H](O)CN3)sc2C)s1	ZINC000262549670	203326254	/nfs/dbraw/zinc/32/62/54/203326254.db2.gz	ONFVMUCZALKRQG-ZJUUUORDSA-N	0	3	323.443	2.150	10	0		DEAEHN
CSCC[C@H](N)C(=O)NCC1(Cc2ccc(F)cc2)CC1	ZINC000262592162	203342093	/nfs/dbraw/zinc/34/20/93/203342093.db2.gz	VDRIVGWLDFGEJA-AWEZNQCLSA-N	0	3	310.438	2.345	10	0		DEAEHN
CN[C@@H](Cc1ccc(OC)c(Br)c1)C(OC)OC	ZINC000093304947	193227883	/nfs/dbraw/zinc/22/78/83/193227883.db2.gz	KSJGWWCVIDYZGZ-NSHDSACASA-N	0	3	318.211	2.207	10	0		DEAEHN
CN[C@@H](Cc1cc(Br)ccc1F)C(OC)OC	ZINC000093304943	193227899	/nfs/dbraw/zinc/22/78/99/193227899.db2.gz	UVXFYBJCLOVTDD-NSHDSACASA-N	0	3	306.175	2.338	10	0		DEAEHN
CCC(CC)N(CC(C)C)S(=O)(=O)c1c(C)[nH]nc1CN	ZINC000093326618	193233487	/nfs/dbraw/zinc/23/34/87/193233487.db2.gz	YVOMQOSMLHFNRI-UHFFFAOYSA-N	0	3	316.471	2.012	10	0		DEAEHN
NC(=O)[C@@]1(N)CCC[C@H]1CCSc1ccc(F)cc1F	ZINC000093627349	193276342	/nfs/dbraw/zinc/27/63/42/193276342.db2.gz	YFXKLOUXVGYQGL-LKFCYVNXSA-N	0	3	300.374	2.430	10	0		DEAEHN
Cc1nn([C@@H]2CCC[C@@](NC3CC3)(C(N)=O)C2)c(C)c1Cl	ZINC000093759585	193301354	/nfs/dbraw/zinc/30/13/54/193301354.db2.gz	BLUVUUNMEDRXIG-DOMZBBRYSA-N	0	3	310.829	2.245	10	0		DEAEHN
CCN[C@H](c1ccc(Cl)c(OC)c1)[C@@H]1CN(C)CCN1C	ZINC000094009138	193338427	/nfs/dbraw/zinc/33/84/27/193338427.db2.gz	MYTSIOIJHPGMTE-GOEBONIOSA-N	0	3	311.857	2.245	10	0		DEAEHN
COC(=O)[C@@]1(NC(C)C)CC[C@@H](N(C)CCC(F)(F)F)C1	ZINC000093831810	193314403	/nfs/dbraw/zinc/31/44/03/193314403.db2.gz	JVGFNFGBFGPPJK-DGCLKSJQSA-N	0	3	310.360	2.333	10	0		DEAEHN
NC(=O)[C@]1(N)CC[C@H](Sc2ccc(Br)cc2)C1	ZINC000093848880	193317059	/nfs/dbraw/zinc/31/70/59/193317059.db2.gz	YIKXJFQGDZORSE-JQWIXIFHSA-N	0	3	315.236	2.277	10	0		DEAEHN
CN1C[C@@H](NCc2cc(F)cc(Br)c2)CCC1=O	ZINC000093982454	193333790	/nfs/dbraw/zinc/33/37/90/193333790.db2.gz	WXZRHQCFUBMVBI-LBPRGKRZSA-N	0	3	315.186	2.299	10	0		DEAEHN
CCNCc1cc(F)c(OCC(=O)N(C)C(C)C)c(F)c1	ZINC000094346783	193363710	/nfs/dbraw/zinc/36/37/10/193363710.db2.gz	BUYOUSGPRKJSIL-UHFFFAOYSA-N	0	3	300.349	2.320	10	0		DEAEHN
CCN[C@@H](c1cc(F)c(C)cc1F)[C@@H]1CCS(=O)(=O)C1	ZINC000094707855	193392968	/nfs/dbraw/zinc/39/29/68/193392968.db2.gz	ALOKMSGXEYTSFO-QMTHXVAHSA-N	0	3	303.374	2.359	10	0		DEAEHN
CC[C@](C)([C@H](O)[C@@H]1CCC[C@H](S(C)(=O)=O)C1)N1CCCC1	ZINC000094641347	193388750	/nfs/dbraw/zinc/38/87/50/193388750.db2.gz	ATOPRKVRVURBKG-QKPAOTATSA-N	0	3	317.495	2.215	10	0		DEAEHN
[NH3+]C1(c2ncc(-c3nc([C@H]4CSCCS4)no3)[n-]2)CCC1	ZINC000094496074	193373481	/nfs/dbraw/zinc/37/34/81/193373481.db2.gz	OBQHPYOGCWXYRU-SECBINFHSA-N	0	3	323.447	2.319	10	0		DEAEHN
NC1(c2nc(-c3nc([C@H]4CSCCS4)no3)c[nH]2)CCC1	ZINC000094496074	193373483	/nfs/dbraw/zinc/37/34/83/193373483.db2.gz	OBQHPYOGCWXYRU-SECBINFHSA-N	0	3	323.447	2.319	10	0		DEAEHN
CN1CCCC[C@@H]1CNc1nc(Br)cn2ccnc12	ZINC000094489914	193373641	/nfs/dbraw/zinc/37/36/41/193373641.db2.gz	COKOTVBNLAPUHZ-SNVBAGLBSA-N	0	3	324.226	2.388	10	0		DEAEHN
CCCN[C@@H](c1cc(Cl)cnc1N)[C@@H]1CSCCO1	ZINC000094504389	193374337	/nfs/dbraw/zinc/37/43/37/193374337.db2.gz	XTMWSOBOLCJZQG-RYUDHWBXSA-N	0	3	301.843	2.490	10	0		DEAEHN
Cc1c(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)[nH]c2c1C(=O)CCC2	ZINC000266103257	205099647	/nfs/dbraw/zinc/09/96/47/205099647.db2.gz	SITOPOPQRDDRKT-WCQYABFASA-N	0	3	317.433	2.397	10	0		DEAEHN
CN[C@@H](CC1CC1)c1c(Br)cnn1CCOC	ZINC000161502518	197499701	/nfs/dbraw/zinc/49/97/01/197499701.db2.gz	GUTMFKMSSCEZMZ-NSHDSACASA-N	0	3	302.216	2.353	10	0		DEAEHN
c1c2c(cc3c1OCCC[C@@H]3NC[C@@H]1COCCN1)CCCC2	ZINC000530220125	284376862	/nfs/dbraw/zinc/37/68/62/284376862.db2.gz	IZXVZSKHXNYCNQ-AEFFLSMTSA-N	0	3	316.445	2.357	10	0		DEAEHN
C[C@H]1CN([C@@H](CN)c2ccc(F)c(Br)c2)CCO1	ZINC000019257468	182111957	/nfs/dbraw/zinc/11/19/57/182111957.db2.gz	YQWSZJTWXHRNSZ-ZANVPECISA-N	0	3	317.202	2.309	10	0		DEAEHN
CC1(O)CCN(CCC(=O)Nc2ccc(Cl)cc2N)CC1	ZINC000160404363	197407187	/nfs/dbraw/zinc/40/71/87/197407187.db2.gz	NOKPBWDYXCAPJR-UHFFFAOYSA-N	0	3	311.813	2.098	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1ccc(C)c(Br)c1	ZINC000159923715	197374033	/nfs/dbraw/zinc/37/40/33/197374033.db2.gz	HNINMKHWSPPVGW-LBPRGKRZSA-N	0	3	315.211	2.450	10	0		DEAEHN
CC(C)C[C@@H](NC(=O)[C@@H](N)C(C)C)C(=O)Nc1ccccc1	ZINC000022067439	182307789	/nfs/dbraw/zinc/30/77/89/182307789.db2.gz	LODYUHYUFPJMPF-CABCVRRESA-N	0	3	305.422	2.139	10	0	in-vitro	DEAEHN
CC(C)(C)NC(=O)CN1CCCN(Cc2ccccc2)CC1	ZINC000022806324	182336209	/nfs/dbraw/zinc/33/62/09/182336209.db2.gz	VXLFCLADZYBJOE-UHFFFAOYSA-N	0	3	303.450	2.109	10	0		DEAEHN
CC(C)[C@H](CNC(=O)c1nnc(Cl)s1)N1CCCC1	ZINC000159856470	197368980	/nfs/dbraw/zinc/36/89/80/197368980.db2.gz	BTHIIPRAIGFAKE-VIFPVBQESA-N	0	3	302.831	2.042	10	0		DEAEHN
Cc1cccc(C(=O)N2C[C@H](C)N(CCN(C)C)[C@@H](C)C2)c1	ZINC000036126158	182804032	/nfs/dbraw/zinc/80/40/32/182804032.db2.gz	JCOSCYLUFLVOPH-HOTGVXAUSA-N	0	3	303.450	2.091	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2ccc3nc(SC)sc3c2)C1	ZINC000040632871	183111967	/nfs/dbraw/zinc/11/19/67/183111967.db2.gz	DMRXGIXEPTWSJK-MWLCHTKSSA-N	0	3	323.443	2.334	10	0		DEAEHN
COc1cc(OC)cc(C(=O)NCC(C)(C)N2CCCC2)c1	ZINC000040616082	183109588	/nfs/dbraw/zinc/10/95/88/183109588.db2.gz	AMVRQVOZODWVLS-UHFFFAOYSA-N	0	3	306.406	2.308	10	0		DEAEHN
COCCCN(CCOC)[C@H](CN)c1cccc(Cl)c1	ZINC000042421023	183267827	/nfs/dbraw/zinc/26/78/27/183267827.db2.gz	ZEHGVUQXLUBFQR-OAHLLOKOSA-N	0	3	300.830	2.325	10	0		DEAEHN
CCC(CC)N(CCO)CC(=O)Nc1ccc(Cl)cc1N	ZINC000042483338	183276332	/nfs/dbraw/zinc/27/63/32/183276332.db2.gz	CHKKNIKKBCXACN-UHFFFAOYSA-N	0	3	313.829	2.344	10	0		DEAEHN
CS(=O)(=O)c1ccc(O[C@@H](CN)c2ccccc2F)cc1	ZINC000043048662	183331714	/nfs/dbraw/zinc/33/17/14/183331714.db2.gz	AWRBEOPDDFUXNR-HNNXBMFYSA-N	0	3	309.362	2.308	10	0		DEAEHN
CS(=O)(=O)c1cccc(O[C@@H](CN)c2ccccc2F)c1	ZINC000043048667	183332073	/nfs/dbraw/zinc/33/20/73/183332073.db2.gz	BUHKDYCRZGPWRY-HNNXBMFYSA-N	0	3	309.362	2.308	10	0		DEAEHN
CCN1CCC[C@@H]1CNc1nc2c(cc1C(N)=S)CCC2	ZINC000043408375	183359687	/nfs/dbraw/zinc/35/96/87/183359687.db2.gz	RSXZMNIGBUYZHZ-GFCCVEGCSA-N	0	3	304.463	2.101	10	0		DEAEHN
Cn1cc([C@@H](CN)Oc2ccc(F)cc2Br)cn1	ZINC000043233228	183346075	/nfs/dbraw/zinc/34/60/75/183346075.db2.gz	OMLSKQARHUCAET-GFCCVEGCSA-N	0	3	314.158	2.401	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccc(Cl)s1)N(C)CC(=O)NC1CC1	ZINC000043252658	183347112	/nfs/dbraw/zinc/34/71/12/183347112.db2.gz	DTTMHWWENHWEGM-SDBXPKJASA-N	0	3	301.843	2.000	10	0		DEAEHN
CCN(CC)C(=O)CN(C)[C@@H](CN)c1ccc(Cl)s1	ZINC000043253547	183347604	/nfs/dbraw/zinc/34/76/04/183347604.db2.gz	UUOUDFOODYUKJM-JTQLQIEISA-N	0	3	303.859	2.202	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)s1)N1CCS(=O)CC1	ZINC000043253569	183347812	/nfs/dbraw/zinc/34/78/12/183347812.db2.gz	GLSFXWAZRITGFY-SKDRFNHKSA-N	0	3	306.884	2.244	10	0		DEAEHN
CNC(=O)C1CCN([C@@H](c2ccc(Cl)s2)[C@H](C)N)CC1	ZINC000043252801	183347959	/nfs/dbraw/zinc/34/79/59/183347959.db2.gz	FQBZSZRZTBMZRO-TVQRCGJNSA-N	0	3	315.870	2.248	10	0		DEAEHN
COCCN(CCOC)[C@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043252904	183348463	/nfs/dbraw/zinc/34/84/63/183348463.db2.gz	ZMBAHFNRUOKGAO-MFKMUULPSA-N	0	3	306.859	2.385	10	0		DEAEHN
CC(C)N(CCO)[C@@H](CN)c1cc(Br)cs1	ZINC000043287363	183351283	/nfs/dbraw/zinc/35/12/83/183351283.db2.gz	PMEYMNWFYROONM-JTQLQIEISA-N	0	3	307.257	2.213	10	0		DEAEHN
Cc1ccc([C@H]([C@@H](C)N)N2CCN(c3nccs3)CC2)o1	ZINC000043363895	183357576	/nfs/dbraw/zinc/35/75/76/183357576.db2.gz	WKBGOXIUHLARHJ-OCCSQVGLSA-N	0	3	306.435	2.255	10	0		DEAEHN
Cc1ccc([C@H](Oc2ccc(S(C)(=O)=O)cc2)[C@H](C)N)o1	ZINC000043366991	183357617	/nfs/dbraw/zinc/35/76/17/183357617.db2.gz	UJBJXWSZZTXMIH-XHDPSFHLSA-N	0	3	309.387	2.459	10	0		DEAEHN
NCc1cccc(S(=O)(=O)N2CCC[C@H]2C2CCCC2)c1	ZINC000045086526	183480462	/nfs/dbraw/zinc/48/04/62/183480462.db2.gz	QOGRRMLBRAXOKU-INIZCTEOSA-N	0	3	308.447	2.489	10	0		DEAEHN
Brc1ccc(OCCNCc2cncnc2)cc1	ZINC000105461854	194105746	/nfs/dbraw/zinc/10/57/46/194105746.db2.gz	JNKUHKMZMHFXRE-UHFFFAOYSA-N	0	3	308.179	2.408	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1CNC(C)(C)C	ZINC000159761533	197362728	/nfs/dbraw/zinc/36/27/28/197362728.db2.gz	WLGJAHYIWKIGRF-UHFFFAOYSA-N	0	3	303.248	2.095	10	0		DEAEHN
C[C@@H](O)CN1CCN(CCCOCCc2ccccc2)C[C@@H]1C	ZINC000105824125	194138336	/nfs/dbraw/zinc/13/83/36/194138336.db2.gz	FGSJYOCPKLIZSB-ZWKOTPCHSA-N	0	3	320.477	2.023	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(C(=O)[C@H]2CCCCN2CC)C1	ZINC000105852823	194146168	/nfs/dbraw/zinc/14/61/68/194146168.db2.gz	GVAUMRZHBWMOMV-JKSUJKDBSA-N	0	3	318.465	2.483	10	0		DEAEHN
CC[C@H]1CN(CCC(=O)Nc2ccccc2)CCN1CCOC	ZINC000105903102	194166769	/nfs/dbraw/zinc/16/67/69/194166769.db2.gz	VXHAOWKARUZQOP-KRWDZBQOSA-N	0	3	319.449	2.058	10	0		DEAEHN
COc1cccc(CN2CCCN(Cc3cnn(C)c3)CC2)c1	ZINC000105917765	194167788	/nfs/dbraw/zinc/16/77/88/194167788.db2.gz	OAODJNXQTIZRKQ-UHFFFAOYSA-N	0	3	314.433	2.137	10	0		DEAEHN
FC(F)Oc1ccccc1CNC[C@@H]1CN(C2CC2)CCO1	ZINC000106380812	194203885	/nfs/dbraw/zinc/20/38/85/194203885.db2.gz	KTXSTSHKVGJEBJ-CQSZACIVSA-N	0	3	312.360	2.241	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)[C@@H](Cc1ccccc1)N(C)C	ZINC000106458399	194217096	/nfs/dbraw/zinc/21/70/96/194217096.db2.gz	BQVHZRMLNLMZTC-SJLPKXTDSA-N	0	3	317.477	2.150	10	0		DEAEHN
CC[C@H](C(N)=S)N1CCN(Cc2ccc(C)c(C)c2)CC1	ZINC000109469232	194267579	/nfs/dbraw/zinc/26/75/79/194267579.db2.gz	SGDLSMCWFIHSCI-MRXNPFEDSA-N	0	3	305.491	2.486	10	0		DEAEHN
CNCc1nc(C(C)C)ncc1-n1cc(Br)cn1	ZINC000051493319	183828726	/nfs/dbraw/zinc/82/87/26/183828726.db2.gz	FRYQKUYRSCXMFW-UHFFFAOYSA-N	0	3	310.199	2.268	10	0		DEAEHN
Cc1n[nH]c(C)c1CCC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000111139390	194394296	/nfs/dbraw/zinc/39/42/96/194394296.db2.gz	AGGGVNHKUCLYHT-KRWDZBQOSA-N	0	3	314.433	2.378	10	0		DEAEHN
COCCC[C@H](N)C(=O)N(C)[C@H](C)c1cc(F)ccc1F	ZINC000159321539	197344682	/nfs/dbraw/zinc/34/46/82/197344682.db2.gz	YWFZTTCTCSMBMQ-YGRLFVJLSA-N	0	3	300.349	2.238	10	0		DEAEHN
CCn1cc(NC(=O)N[C@H](Cc2ccccc2)CN(C)C)cn1	ZINC000057202848	184029777	/nfs/dbraw/zinc/02/97/77/184029777.db2.gz	XJSKBFCZLMFQQP-OAHLLOKOSA-N	0	3	315.421	2.197	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(NC[C@H]2CCCN(C)C2)n1	ZINC000061540817	184173316	/nfs/dbraw/zinc/17/33/16/184173316.db2.gz	YAVUFWXKQYSFBJ-LLVKDONJSA-N	0	3	312.849	2.125	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(NCCN2CCCCC2)n1	ZINC000061539597	184173321	/nfs/dbraw/zinc/17/33/21/184173321.db2.gz	HPHKRYJIXWDWHC-UHFFFAOYSA-N	0	3	312.849	2.269	10	0		DEAEHN
CCNc1ccc(Cl)c(C(=O)N2CCC[C@@H]2CN(C)C)n1	ZINC000061656047	184181005	/nfs/dbraw/zinc/18/10/05/184181005.db2.gz	HUQOFZNDLYNLBA-LLVKDONJSA-N	0	3	310.829	2.333	10	0		DEAEHN
Cc1noc(Cl)c1CCC(=O)N1CCCN(C2CC2)CC1	ZINC000061647196	184181200	/nfs/dbraw/zinc/18/12/00/184181200.db2.gz	VIKIXUDLTOYOBD-UHFFFAOYSA-N	0	3	311.813	2.266	10	0		DEAEHN
CCN[C@H](C)c1cnc(N2CCN(CC(F)(F)F)CC2)s1	ZINC000061948526	184198201	/nfs/dbraw/zinc/19/82/01/184198201.db2.gz	HDZRMYRTHJGMSM-SNVBAGLBSA-N	0	3	322.400	2.498	10	0		DEAEHN
COCCCN(C)[C@@H](CN)c1cc(Br)cs1	ZINC000062029495	184202260	/nfs/dbraw/zinc/20/22/60/184202260.db2.gz	WJTXDVLUMZVFEG-JTQLQIEISA-N	0	3	307.257	2.479	10	0		DEAEHN
COCCCN(C)[C@@H](CN)c1cc(Cl)c2c(c1)OCCO2	ZINC000062029981	184202493	/nfs/dbraw/zinc/20/24/93/184202493.db2.gz	HWDVEKHSEQCHAA-ZDUSSCGKSA-N	0	3	314.813	2.079	10	0		DEAEHN
CC1(C)Cc2nc(N3CCn4ccnc4C3)sc2[C@@H](N)C1	ZINC000062327777	184230987	/nfs/dbraw/zinc/23/09/87/184230987.db2.gz	VIEYQWOIZGHOMD-JTQLQIEISA-N	0	3	303.435	2.332	10	0		DEAEHN
NCc1cccc(S(=O)(=O)N2CCC3(CCCC3)CC2)c1	ZINC000062955466	184262597	/nfs/dbraw/zinc/26/25/97/184262597.db2.gz	LZIJHIHESUTPGR-UHFFFAOYSA-N	0	3	308.447	2.490	10	0		DEAEHN
O=c1cc2c(nn1Cc1ccc(Cl)c(Cl)c1)CCNC2	ZINC000063169779	184275581	/nfs/dbraw/zinc/27/55/81/184275581.db2.gz	KFEIWMQMCSBOCT-UHFFFAOYSA-N	0	3	310.184	2.244	10	0		DEAEHN
[NH3+][C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000063176014	184276694	/nfs/dbraw/zinc/27/66/94/184276694.db2.gz	OVHOBPUVVMNWEX-NXEZZACHSA-N	0	3	309.218	2.152	10	0		DEAEHN
C[C@@H](CCO)NC(=O)NC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000119161692	207355969	/nfs/dbraw/zinc/35/59/69/207355969.db2.gz	MEZQKHPSTXCROM-MAUKXSAKSA-N	0	3	319.449	2.111	10	0		DEAEHN
CC[C@@H]1CN(c2ccccc2)CCN1CCCN1CCOCC1	ZINC000184004460	207364315	/nfs/dbraw/zinc/36/43/15/207364315.db2.gz	YRAMPNCMCYFLMV-GOSISDBHSA-N	0	3	317.477	2.310	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1CNC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000262579238	296328184	/nfs/dbraw/zinc/32/81/84/296328184.db2.gz	YQKXFFZVOJJTRG-ZURLZEQWSA-N	0	3	308.466	2.461	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N1CCC[C@H]1C1CCCC1	ZINC000247499883	285033489	/nfs/dbraw/zinc/03/34/89/285033489.db2.gz	NJAPXTPMBOMDEM-IRXDYDNUSA-N	0	3	323.481	2.461	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)NC1(C)CCC(C)CC1	ZINC000111856384	285034624	/nfs/dbraw/zinc/03/46/24/285034624.db2.gz	JKUOGCIHDPGNOK-CKDBGZEDSA-N	0	3	311.470	2.365	10	0		DEAEHN
c1nc(N2CCCC2)ncc1CN1CCC[C@H]2COCC[C@H]21	ZINC000538790549	285056056	/nfs/dbraw/zinc/05/60/56/285056056.db2.gz	ITIOLBNPVZJFOV-JKSUJKDBSA-N	0	3	302.422	2.078	10	0		DEAEHN
C[C@@H](CC(=O)c1ccccc1F)C(=O)N(C)CCCN(C)C	ZINC000539417534	285076779	/nfs/dbraw/zinc/07/67/79/285076779.db2.gz	XNVZQPWPFJEXBW-ZDUSSCGKSA-N	0	3	308.397	2.445	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)c1cccc(F)c1)[C@H]1CCOC1	ZINC000159131710	197330595	/nfs/dbraw/zinc/33/05/95/197330595.db2.gz	MAQZQRPBCJWFIS-WFASDCNBSA-N	0	3	315.410	2.004	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC2C(C)(C)C2(C)C)cc(CN)c1F	ZINC000159125355	197329104	/nfs/dbraw/zinc/32/91/04/197329104.db2.gz	WZESDVATIYGYKS-UHFFFAOYSA-N	0	3	314.426	2.306	10	0		DEAEHN
CC[C@@H]1CCCN(S(=O)(=O)c2cc(C)c(F)c(CN)c2)C1	ZINC000159073142	197324898	/nfs/dbraw/zinc/32/48/98/197324898.db2.gz	MXVSPNSPCIYWCN-GFCCVEGCSA-N	0	3	314.426	2.404	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCC[C@@H](C)C2)cc(CN)c1F	ZINC000159052170	197322338	/nfs/dbraw/zinc/32/23/38/197322338.db2.gz	QDQJGKDKWRRIBR-SNVBAGLBSA-N	0	3	300.399	2.013	10	0		DEAEHN
CCN[C@H]1CCCN(c2c(F)c(F)c(F)c(F)c2F)C1=O	ZINC000159002448	197318209	/nfs/dbraw/zinc/31/82/09/197318209.db2.gz	OBHKCDFTRFVQQB-LURJTMIESA-N	0	3	308.250	2.487	10	0		DEAEHN
CC(C)(C)c1ccc(S(=O)(=O)C[C@H](N)[C@@H]2CCOC2)cc1	ZINC000158771146	197300123	/nfs/dbraw/zinc/30/01/23/197300123.db2.gz	MCNIHVAMZNZRCR-DOMZBBRYSA-N	0	3	311.447	2.122	10	0		DEAEHN
CC(C)[C@@H](O)CC(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000158301567	197260837	/nfs/dbraw/zinc/26/08/37/197260837.db2.gz	RCYASUZMHNWXOT-ZBFHGGJFSA-N	0	3	324.490	2.483	10	0		DEAEHN
CC(C)(N)CS(=O)(=O)Cc1cccc(F)c1Br	ZINC000157997531	197233807	/nfs/dbraw/zinc/23/38/07/197233807.db2.gz	YSKJFWPDJBZHSY-UHFFFAOYSA-N	0	3	324.215	2.240	10	0		DEAEHN
CC(C)(C)[C@@H](N)C(=O)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000157633504	197203611	/nfs/dbraw/zinc/20/36/11/197203611.db2.gz	JMQTUOBHGHBPMX-AWEZNQCLSA-N	0	3	309.841	2.362	10	0		DEAEHN
CCNc1cc(N2CCN3CCCC[C@@H]3C2)nc(SC)n1	ZINC000157374928	197182502	/nfs/dbraw/zinc/18/25/02/197182502.db2.gz	SIEQPLJNKLCGQD-GFCCVEGCSA-N	0	3	307.467	2.305	10	0		DEAEHN
CNc1nc(N(C)C)nc(N(C)[C@H](C)Cc2cccs2)n1	ZINC000157266386	197175183	/nfs/dbraw/zinc/17/51/83/197175183.db2.gz	FXFMNRVHRVMMQW-SNVBAGLBSA-N	0	3	306.439	2.108	10	0		DEAEHN
CC(C)OCCN(C)CCCOc1ccc(C(N)=S)cc1	ZINC000157255501	197174471	/nfs/dbraw/zinc/17/44/71/197174471.db2.gz	HGSYTDVKWADPPD-UHFFFAOYSA-N	0	3	310.463	2.447	10	0		DEAEHN
Cn1cnnc1CCNCc1cccc(F)c1Br	ZINC000156756118	197138235	/nfs/dbraw/zinc/13/82/35/197138235.db2.gz	KYSTZPAYLSQLGA-UHFFFAOYSA-N	0	3	313.174	2.049	10	0		DEAEHN
O=S(=O)([N-]CC[NH2+][C@H]1CC[C@H]1C1CCC1)c1cccs1	ZINC000558696784	291903268	/nfs/dbraw/zinc/90/32/68/291903268.db2.gz	CKJVKPYEFOYHHC-STQMWFEESA-N	0	3	314.476	2.195	10	0		DEAEHN
CN(CC(=O)NC(=O)NCc1cccs1)C[C@H]1CC=CCC1	ZINC000542247140	285214592	/nfs/dbraw/zinc/21/45/92/285214592.db2.gz	HHZZXVLJVWPXOT-ZDUSSCGKSA-N	0	3	321.446	2.362	10	0		DEAEHN
CC(=O)Nc1ccccc1CN1CCC[C@@H](Cn2cncn2)C1	ZINC000155227093	197033682	/nfs/dbraw/zinc/03/36/82/197033682.db2.gz	SRFFTCCEGDEPPH-OAHLLOKOSA-N	0	3	313.405	2.149	10	0		DEAEHN
CC(=O)N1CCC[C@@H](CN[C@H](C)c2cn3ccccc3n2)C1	ZINC000559903202	291919308	/nfs/dbraw/zinc/91/93/08/291919308.db2.gz	KJVZCTRJPGBWCD-HIFRSBDPSA-N	0	3	300.406	2.243	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2ccccc2OCC(F)F)C1	ZINC000120391047	195157420	/nfs/dbraw/zinc/15/74/20/195157420.db2.gz	VDQNORYQNWWCIK-NSHDSACASA-N	0	3	313.348	2.498	10	0		DEAEHN
CC[C@@H](C)CN1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000120593456	195197353	/nfs/dbraw/zinc/19/73/53/195197353.db2.gz	COPQHNAUIJJITR-SJORKVTESA-N	0	3	306.450	2.090	10	0		DEAEHN
CC[C@@H](C)CN1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000120593757	195197545	/nfs/dbraw/zinc/19/75/45/195197545.db2.gz	COPQHNAUIJJITR-IAGOWNOFSA-N	0	3	306.450	2.090	10	0		DEAEHN
CC(C)CCn1cccc1CN1CCN(C[C@@H](C)O)[C@H](C)C1	ZINC000120675996	195214479	/nfs/dbraw/zinc/21/44/79/195214479.db2.gz	VFUDTDXKUXOYHA-IAGOWNOFSA-N	0	3	307.482	2.421	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000120677335	195214538	/nfs/dbraw/zinc/21/45/38/195214538.db2.gz	AEKJYGVIOXBOPD-GDBMZVCRSA-N	0	3	317.433	2.183	10	0		DEAEHN
Cn1nccc1CCC(=O)N1C[C@H]2CCCN2Cc2ccccc21	ZINC000120912189	195263583	/nfs/dbraw/zinc/26/35/83/195263583.db2.gz	LQPFSDBADFCZGN-QGZVFWFLSA-N	0	3	324.428	2.364	10	0		DEAEHN
O=C(N1CCCC1)[C@]12CCO[C@H]1CCN(Cc1ccsc1)C2	ZINC000247734252	257118597	/nfs/dbraw/zinc/11/85/97/257118597.db2.gz	JWUZKWCDSDMYDE-RDJZCZTQSA-N	0	3	320.458	2.352	10	0		DEAEHN
CN(C[C@H]1CNCCO1)C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000126078349	195807786	/nfs/dbraw/zinc/80/77/86/195807786.db2.gz	OHEMPYZMBYPKLX-SNVBAGLBSA-N	0	3	318.204	2.446	10	0		DEAEHN
CO[C@@H]1COC[C@H]1n1cc(CN[C@H]2CCCC23CCCC3)nn1	ZINC000328803675	533524974	/nfs/dbraw/zinc/52/49/74/533524974.db2.gz	BJKXPCULVZWKSD-OAGGEKHMSA-N	0	3	320.437	2.067	10	0		DEAEHN
COC(=O)CCn1nc(C)c(CNC[C@@H]2CCC(C)(C)O2)c1C	ZINC000190254539	533465075	/nfs/dbraw/zinc/46/50/75/533465075.db2.gz	PLSUYDVVOAELKH-AWEZNQCLSA-N	0	3	323.437	2.110	10	0		DEAEHN
COc1ccc(OCCCC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000195314521	132546515	/nfs/dbraw/zinc/54/65/15/132546515.db2.gz	UOLLNJHNRVIWCG-HNNXBMFYSA-N	0	3	318.417	2.161	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCc1ccc2cc[nH]c2n1	ZINC000357959273	133112241	/nfs/dbraw/zinc/11/22/41/133112241.db2.gz	PAGOOXJRDWRRHH-HNNXBMFYSA-N	0	3	317.437	2.338	10	0		DEAEHN
O=C(NCCNc1ccncc1)NC(C1CCC1)C1CCC1	ZINC000358209691	133128688	/nfs/dbraw/zinc/12/86/88/133128688.db2.gz	OGSWFZKWINZBQX-UHFFFAOYSA-N	0	3	302.422	2.183	10	0		DEAEHN
C[C@@H]1C[C@@H]1CNC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000360430106	133181622	/nfs/dbraw/zinc/18/16/22/133181622.db2.gz	PGUDDGAWAZSUHW-MUIFIZLQSA-N	0	3	301.434	2.462	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NC[C@H](C)Oc1ccccc1OC	ZINC000362039793	133206940	/nfs/dbraw/zinc/20/69/40/133206940.db2.gz	UJSAITKYYMPSHF-LSDHHAIUSA-N	0	3	320.433	2.453	10	0		DEAEHN
C[C@H](CNC(=O)CC1CCN(C)CC1)N1CCc2ccccc21	ZINC000362493552	133233539	/nfs/dbraw/zinc/23/35/39/133233539.db2.gz	XDPYWGGHHPOIEZ-OAHLLOKOSA-N	0	3	315.461	2.286	10	0		DEAEHN
NC1(C(=O)NCc2cccc(Cl)c2Cl)CCOCC1	ZINC000562973626	292020762	/nfs/dbraw/zinc/02/07/62/292020762.db2.gz	SWUNEKLMACSPPZ-UHFFFAOYSA-N	0	3	303.189	2.118	10	0		DEAEHN
CC(C)[C@@H](NC(=O)CC1CCN(C)CC1)c1nc(C2CC2)no1	ZINC000362718553	133247398	/nfs/dbraw/zinc/24/73/98/133247398.db2.gz	YUVCONZDYWHICF-OAHLLOKOSA-N	0	3	320.437	2.492	10	0		DEAEHN
Cc1ccc([C@H]2CCCN2C[C@@H](O)COC2CCOCC2)o1	ZINC000368549487	133277905	/nfs/dbraw/zinc/27/79/05/133277905.db2.gz	QCRYAFWYURYLBX-GDBMZVCRSA-N	0	3	309.406	2.281	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(C[C@H](O)CSC)C2)c1	ZINC000187935263	145005072	/nfs/dbraw/zinc/00/50/72/145005072.db2.gz	XFOTXZMXFYCKPJ-JSGCOSHPSA-N	0	3	311.447	2.217	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)c1cn2ccnc2s1	ZINC000188493870	145012789	/nfs/dbraw/zinc/01/27/89/145012789.db2.gz	NAOFHEKJUGUPHY-LBPRGKRZSA-N	0	3	306.435	2.390	10	0		DEAEHN
O=C(Cc1coc(-c2cccs2)n1)N1CCN2CCC1CC2	ZINC000188607270	145014629	/nfs/dbraw/zinc/01/46/29/145014629.db2.gz	XFYFBTNHZPEXOH-UHFFFAOYSA-N	0	3	317.414	2.252	10	0		DEAEHN
Cc1cccc2c1OCC[C@@H]2NC(=O)NC1CCN(C)CC1	ZINC000189741222	145032636	/nfs/dbraw/zinc/03/26/36/145032636.db2.gz	LFBFLDPJKAYBTQ-HNNXBMFYSA-N	0	3	303.406	2.212	10	0		DEAEHN
CC1(C)CN(C[C@H](O)Cn2cccn2)CC[C@H]1C(F)(F)F	ZINC000190173550	145038926	/nfs/dbraw/zinc/03/89/26/145038926.db2.gz	UDCRNWFVAXNHAN-NWDGAFQWSA-N	0	3	305.344	2.154	10	0		DEAEHN
CCC(=O)CCN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000190290911	145039812	/nfs/dbraw/zinc/03/98/12/145039812.db2.gz	NBVSNMPMJGFZBB-AWEZNQCLSA-N	0	3	303.406	2.410	10	0		DEAEHN
CCc1nc(C2CCN([C@H](C)C(=O)NC(CC)CC)CC2)n[nH]1	ZINC000190662692	145045474	/nfs/dbraw/zinc/04/54/74/145045474.db2.gz	MSQDOHYGLLIGIF-GFCCVEGCSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCc1n[nH]c(C2CCN([C@H](C)C(=O)NC(CC)CC)CC2)n1	ZINC000190662692	145045475	/nfs/dbraw/zinc/04/54/75/145045475.db2.gz	MSQDOHYGLLIGIF-GFCCVEGCSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCc1nnc(C2CCN([C@H](C)C(=O)NC(CC)CC)CC2)[nH]1	ZINC000190662692	145045476	/nfs/dbraw/zinc/04/54/76/145045476.db2.gz	MSQDOHYGLLIGIF-GFCCVEGCSA-N	0	3	321.469	2.240	10	0		DEAEHN
NC(=O)[C@@H]1CCC[C@H](NCc2ccc(Br)o2)C1	ZINC000191148461	145053659	/nfs/dbraw/zinc/05/36/59/145053659.db2.gz	YMGMFKJANNSYBF-BDAKNGLRSA-N	0	3	301.184	2.176	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC(Oc2ccc(F)nc2)CC1)N(C)C	ZINC000191134298	145053698	/nfs/dbraw/zinc/05/36/98/145053698.db2.gz	KPTKAHQDMSGZQA-OAHLLOKOSA-N	0	3	323.412	2.321	10	0		DEAEHN
NC(=O)[C@@H]1CCC[C@@H](NCc2ccc(Br)o2)C1	ZINC000191148447	145053734	/nfs/dbraw/zinc/05/37/34/145053734.db2.gz	YMGMFKJANNSYBF-RKDXNWHRSA-N	0	3	301.184	2.176	10	0		DEAEHN
CCc1n[nH]c(C2CCN(Cc3ccc(C(=O)OC)o3)CC2)n1	ZINC000191693942	145062827	/nfs/dbraw/zinc/06/28/27/145062827.db2.gz	MHQMISYCSOUEJH-UHFFFAOYSA-N	0	3	318.377	2.126	10	0		DEAEHN
CCc1nc(C2CCN(Cc3ccc(C(=O)OC)o3)CC2)n[nH]1	ZINC000191693942	145062828	/nfs/dbraw/zinc/06/28/28/145062828.db2.gz	MHQMISYCSOUEJH-UHFFFAOYSA-N	0	3	318.377	2.126	10	0		DEAEHN
CCc1nnc(C2CCN(Cc3ccc(C(=O)OC)o3)CC2)[nH]1	ZINC000191693942	145062830	/nfs/dbraw/zinc/06/28/30/145062830.db2.gz	MHQMISYCSOUEJH-UHFFFAOYSA-N	0	3	318.377	2.126	10	0		DEAEHN
O=C1O[C@@H](CN2CCC(Cn3cccn3)CC2)CC12CCC2	ZINC000192007743	145068972	/nfs/dbraw/zinc/06/89/72/145068972.db2.gz	YGSYWNRHRRWATE-OAHLLOKOSA-N	0	3	303.406	2.081	10	0		DEAEHN
COC[C@@](C)(CCO)NCCOc1ccc(Cl)c(F)c1	ZINC000192066372	145070367	/nfs/dbraw/zinc/07/03/67/145070367.db2.gz	JKYRMPNBWVFSQX-CQSZACIVSA-N	0	3	305.777	2.235	10	0		DEAEHN
Cn1c2ccc(CN3CCC[C@H]3C(C)(C)O)cc2sc1=O	ZINC000192720201	145077838	/nfs/dbraw/zinc/07/78/38/145077838.db2.gz	FWQMHIRHLCKPRG-AWEZNQCLSA-N	0	3	306.431	2.335	10	0		DEAEHN
Cc1csc(C2CCN(CCN3CCOC[C@H]3C)CC2)n1	ZINC000192705799	145077841	/nfs/dbraw/zinc/07/78/41/145077841.db2.gz	YNXFCUPJKDYSAQ-CQSZACIVSA-N	0	3	309.479	2.352	10	0		DEAEHN
COc1ccc(OC)c(NC(=O)[C@H](C)N[C@H](C)[C@H]2CCCO2)c1	ZINC000193129100	145083269	/nfs/dbraw/zinc/08/32/69/145083269.db2.gz	CNRFZADPMDQVDP-TYNCELHUSA-N	0	3	322.405	2.188	10	0		DEAEHN
CO[C@H](CNC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)c1ccccc1	ZINC000246368856	145100066	/nfs/dbraw/zinc/10/00/66/145100066.db2.gz	QEDYSBYAJLVVAA-HYVNUMGLSA-N	0	3	319.449	2.498	10	0		DEAEHN
Cn1c(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)nnc1C1CC1	ZINC000246532380	145105728	/nfs/dbraw/zinc/10/57/28/145105728.db2.gz	JMBZWOCHIFLMMB-GOEBONIOSA-N	0	3	315.465	2.141	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1occc1Br	ZINC000246557375	145106720	/nfs/dbraw/zinc/10/67/20/145106720.db2.gz	UPAFMXZCBVHGNO-ZJUUUORDSA-N	0	3	313.195	2.351	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)[C@H](C)N2CCN3CCC[C@H]3C2)c1	ZINC000246588296	145107733	/nfs/dbraw/zinc/10/77/33/145107733.db2.gz	SRZXZJPBWZPPHB-RDJZCZTQSA-N	0	3	301.434	2.410	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)Cc1ccccc1C	ZINC000246705681	145111236	/nfs/dbraw/zinc/11/12/36/145111236.db2.gz	ZOOGMQUBXBNMFJ-IRXDYDNUSA-N	0	3	322.474	2.383	10	0		DEAEHN
O[C@H](CN1CCC[C@@H](Cn2cncn2)C1)c1cccc(Cl)c1	ZINC000246743753	145112364	/nfs/dbraw/zinc/11/23/64/145112364.db2.gz	OKPZJCNAAJDYBS-CZUORRHYSA-N	0	3	320.824	2.377	10	0		DEAEHN
COCc1cccc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1	ZINC000246772093	145113872	/nfs/dbraw/zinc/11/38/72/145113872.db2.gz	QMVLVNRVPRWBKJ-DLBZAZTESA-N	0	3	302.418	2.389	10	0		DEAEHN
COc1cccc(F)c1[C@H](C)NC(=O)N1CCN2CCC[C@H]2C1	ZINC000246884250	145117548	/nfs/dbraw/zinc/11/75/48/145117548.db2.gz	GWDOQBHASYPTCD-STQMWFEESA-N	0	3	321.396	2.385	10	0		DEAEHN
COC(=O)[C@@H]1C[C@H](c2ccccc2)CN(Cc2ccnn2C)C1	ZINC000246888429	145118530	/nfs/dbraw/zinc/11/85/30/145118530.db2.gz	TYRXHTMOUCGKOM-JKSUJKDBSA-N	0	3	313.401	2.199	10	0		DEAEHN
CCC[C@@]1(C)CCCN([C@H](C)C(=O)N(C)CC(=O)NC2CC2)C1	ZINC000246947779	145120302	/nfs/dbraw/zinc/12/03/02/145120302.db2.gz	ARUHFQGDSWHZMM-KDOFPFPSSA-N	0	3	323.481	2.014	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](C)c1ccccc1)N1CCN2CCC[C@H]2C1	ZINC000246995091	145122511	/nfs/dbraw/zinc/12/25/11/145122511.db2.gz	BENTYPUMPWCUCO-UXLLHSPISA-N	0	3	301.434	2.032	10	0		DEAEHN
CC(C)[C@@H]1CCC[C@@H](NC(=O)N2CCO[C@@H](CN(C)C)C2)C1	ZINC000247274205	145131290	/nfs/dbraw/zinc/13/12/90/145131290.db2.gz	ZQUOHACUABOASH-OAGGEKHMSA-N	0	3	311.470	2.173	10	0		DEAEHN
C[C@@H]1CCCCN1C(=O)CN1CC[C@@H](CNc2ccccn2)C1	ZINC000247352135	145134859	/nfs/dbraw/zinc/13/48/59/145134859.db2.gz	LKGNTYSBQUBZKA-CVEARBPZSA-N	0	3	316.449	2.216	10	0		DEAEHN
C[C@H](O)CN1CCN(CCOc2ccccc2Cl)C[C@@H]1C	ZINC000247399406	145136271	/nfs/dbraw/zinc/13/62/71/145136271.db2.gz	YGPBEDOPPVYSSS-KBPBESRZSA-N	0	3	312.841	2.106	10	0		DEAEHN
C[C@H](Oc1ccc(F)c(F)c1)C(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000247505096	145139613	/nfs/dbraw/zinc/13/96/13/145139613.db2.gz	VIOSZWKOAMFKLU-RWMBFGLXSA-N	0	3	324.371	2.427	10	0		DEAEHN
Cc1cc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)nn1C(C)(C)C	ZINC000247556781	145140727	/nfs/dbraw/zinc/14/07/27/145140727.db2.gz	ZSYONWJUBJOWPS-ZIAGYGMSSA-N	0	3	304.438	2.255	10	0		DEAEHN
CC[C@@H]1C[C@H](C(=O)N[C@H](Cc2ccccc2)CN(C)C)CCO1	ZINC000248567643	145159233	/nfs/dbraw/zinc/15/92/33/145159233.db2.gz	NQMLFSCCIGCSNR-KZNAEPCWSA-N	0	3	318.461	2.481	10	0		DEAEHN
C[C@H](CCN1CCN(C)CC1)NC(=O)[C@H]1C[C@H]1C1CCCCC1	ZINC000248683458	145163983	/nfs/dbraw/zinc/16/39/83/145163983.db2.gz	GKKRTRQPGWBCHM-NJAFHUGGSA-N	0	3	321.509	2.345	10	0		DEAEHN
Cc1cccnc1C(F)(F)C(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000248738760	145165633	/nfs/dbraw/zinc/16/56/33/145165633.db2.gz	PIXJLJGPJXVFCF-OLZOCXBDSA-N	0	3	309.360	2.177	10	0		DEAEHN
CCN1CC[C@@H](N(C)C(=O)c2nc3cccnc3s2)[C@@H](C)C1	ZINC000248738375	145165660	/nfs/dbraw/zinc/16/56/60/145165660.db2.gz	OJKZUSUIXHAICE-WCQYABFASA-N	0	3	318.446	2.494	10	0		DEAEHN
C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1cn2ccnc2s1	ZINC000248990630	145175491	/nfs/dbraw/zinc/17/54/91/145175491.db2.gz	XAOAJFBTGGHHQC-UPJWGTAASA-N	0	3	320.462	2.492	10	0		DEAEHN
CCCN(C)[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000249824201	145191072	/nfs/dbraw/zinc/19/10/72/145191072.db2.gz	IVNTTZAYVMZKIA-RDJZCZTQSA-N	0	3	303.450	2.107	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N2CCC([C@@H]3CCCO3)CC2)C1	ZINC000251898667	145196930	/nfs/dbraw/zinc/19/69/30/145196930.db2.gz	QVBLMDFOVQTCAW-OIISXLGYSA-N	0	3	323.481	2.316	10	0		DEAEHN
COc1ccccc1[C@H]1CNCCN1Cc1nc(C2CC2)no1	ZINC000261681287	145216134	/nfs/dbraw/zinc/21/61/34/145216134.db2.gz	IKDHNYUEBBXZQL-CQSZACIVSA-N	0	3	314.389	2.102	10	0		DEAEHN
O=C(c1cnc(C2CC2)[nH]1)N1CCNC[C@@H]1c1cccc(F)c1	ZINC000261696219	145217527	/nfs/dbraw/zinc/21/75/27/145217527.db2.gz	CQVQGAASXDRNON-OAHLLOKOSA-N	0	3	314.364	2.213	10	0		DEAEHN
C[C@H](c1ccc(C(C)(C)C)cc1)N(C)CC(=O)N1CCNCC1	ZINC000261737710	145222313	/nfs/dbraw/zinc/22/23/13/145222313.db2.gz	NOPMZISFPMQXFC-OAHLLOKOSA-N	0	3	317.477	2.409	10	0		DEAEHN
C[C@H](NC(=O)[C@@H](N)C1CCOCC1)c1ccc2c(c1)CCCC2	ZINC000261796766	145227277	/nfs/dbraw/zinc/22/72/77/145227277.db2.gz	NWWDZHZUOWFTDL-UGSOOPFHSA-N	0	3	316.445	2.497	10	0		DEAEHN
CN(CC12CC3CC(CC(C3)C1)C2)C(=O)[C@@H](N)C1CCOCC1	ZINC000261796781	145227311	/nfs/dbraw/zinc/22/73/11/145227311.db2.gz	GUCQNUDYXFJLHI-QBNKABOXSA-N	0	3	320.477	2.415	10	0		DEAEHN
NC1(C(=O)Nc2cccc(C(=O)c3ccccc3)c2)CCOCC1	ZINC000261817777	145229616	/nfs/dbraw/zinc/22/96/16/145229616.db2.gz	KAUOBGUCBPENDB-UHFFFAOYSA-N	0	3	324.380	2.364	10	0		DEAEHN
CCc1ccccc1CNC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000261845456	145232875	/nfs/dbraw/zinc/23/28/75/145232875.db2.gz	IYZVNUXTWQSIEZ-JTDSTZFVSA-N	0	3	316.445	2.398	10	0		DEAEHN
NC1(C(=O)NCc2ccccc2OC2CCCC2)CCOCC1	ZINC000261913596	145240700	/nfs/dbraw/zinc/24/07/00/145240700.db2.gz	UDRQCZMPQKAKBF-UHFFFAOYSA-N	0	3	318.417	2.132	10	0		DEAEHN
CCc1ccc(O)c(NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)c1	ZINC000261924552	145242699	/nfs/dbraw/zinc/24/26/99/145242699.db2.gz	SBTMGKJBROWVBO-CDHAZOANSA-N	0	3	318.417	2.426	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)NCCc1ccccc1F	ZINC000261958524	145247300	/nfs/dbraw/zinc/24/73/00/145247300.db2.gz	XKAUKDGLVBPWKU-JOQOYGCGSA-N	0	3	320.408	2.017	10	0		DEAEHN
Cc1cccc(CNC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)c1	ZINC000261983534	145250343	/nfs/dbraw/zinc/25/03/43/145250343.db2.gz	ASIWEZPAVYQBTK-IIDMSEBBSA-N	0	3	302.418	2.144	10	0		DEAEHN
COc1ccc(OCCN2CCNC[C@H]2c2cccnc2)cc1	ZINC000262263960	145272316	/nfs/dbraw/zinc/27/23/16/145272316.db2.gz	RRLHCBVATUQRLQ-SFHVURJKSA-N	0	3	313.401	2.116	10	0		DEAEHN
CC(C)C(=O)Nc1ccc(N[C@H](C)C[C@@H]2COCCN2)cc1	ZINC000262298433	145274196	/nfs/dbraw/zinc/27/41/96/145274196.db2.gz	OFGKJVBPSJSZJU-CZUORRHYSA-N	0	3	305.422	2.460	10	0		DEAEHN
CCC[C@](C)(N)C(=O)NCCOc1ccc(C(F)(F)F)cn1	ZINC000262305461	145274830	/nfs/dbraw/zinc/27/48/30/145274830.db2.gz	MDQHVSGRMRGUJB-ZDUSSCGKSA-N	0	3	319.327	2.113	10	0		DEAEHN
Cc1ccc(O)c(NC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)c1	ZINC000262425991	145283296	/nfs/dbraw/zinc/28/32/96/145283296.db2.gz	FKGQVQCCVOYFQP-PZSREKOKSA-N	0	3	304.390	2.172	10	0		DEAEHN
CC(C)(C)[C@H](N)C(=O)N1CCC[C@H](c2noc(C3CC3)n2)C1	ZINC000262626975	145297130	/nfs/dbraw/zinc/29/71/30/145297130.db2.gz	LPHURHHZXCHCGY-NWDGAFQWSA-N	0	3	306.410	2.026	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-]CC[C@H]2CC[NH2+]C2)c(Cl)cc1F	ZINC000262726843	145302360	/nfs/dbraw/zinc/30/23/60/145302360.db2.gz	BCOMCJNDEMWHON-SNVBAGLBSA-N	0	3	320.817	2.065	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@H]2CC[NH2+][C@H](C)C2)c(Cl)cc1F	ZINC000262763244	145304040	/nfs/dbraw/zinc/30/40/40/145304040.db2.gz	GNPORYCHMRLEEL-ZJUUUORDSA-N	0	3	320.817	2.206	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2cc(C3CCCCC3)[nH]n2)n1	ZINC000263190784	145334111	/nfs/dbraw/zinc/33/41/11/145334111.db2.gz	HWDKUFXUSUONQZ-CQSZACIVSA-N	0	3	316.409	2.084	10	0		DEAEHN
CC(C)c1cccc(OCc2nc([C@H]3CNCCN3C)no2)c1	ZINC000263186971	145334170	/nfs/dbraw/zinc/33/41/70/145334170.db2.gz	HKZALDPKQKCMEP-OAHLLOKOSA-N	0	3	316.405	2.348	10	0		DEAEHN
CC(C)c1cccc(OCc2nc([C@@H]3CNCCN3C)no2)c1	ZINC000263186969	145334200	/nfs/dbraw/zinc/33/42/00/145334200.db2.gz	HKZALDPKQKCMEP-HNNXBMFYSA-N	0	3	316.405	2.348	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2cc(C3CCCCC3)[nH]n2)n1	ZINC000263190781	145334314	/nfs/dbraw/zinc/33/43/14/145334314.db2.gz	HWDKUFXUSUONQZ-AWEZNQCLSA-N	0	3	316.409	2.084	10	0		DEAEHN
CC(C)[C@@H](C(=O)N1CCC[C@@H](c2noc(C3CC3)n2)C1)N(C)C	ZINC000349570628	146386863	/nfs/dbraw/zinc/38/68/63/146386863.db2.gz	SWOVKRZNVOQIME-KGLIPLIRSA-N	0	3	320.437	2.239	10	0		DEAEHN
C[C@@H]1COCCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000374362637	148235664	/nfs/dbraw/zinc/23/56/64/148235664.db2.gz	RRCVVCLMUSMKHI-HNNXBMFYSA-N	0	3	302.418	2.391	10	0		DEAEHN
CN(Cc1cccc2ccccc21)C[C@H](O)CN1CCCC1=O	ZINC000111684057	401721162	/nfs/dbraw/zinc/72/11/62/401721162.db2.gz	VXLJUKRFPOAKPL-KRWDZBQOSA-N	0	3	312.413	2.255	10	0		DEAEHN
CCC1CCC(NC(=O)NC[C@H]2CCCN2CCOC)CC1	ZINC000111833783	401725322	/nfs/dbraw/zinc/72/53/22/401725322.db2.gz	AETRJYLGZSLYPY-UYSNPLJNSA-N	0	3	311.470	2.365	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cc(Br)c[nH]2)CCN1C	ZINC000127725832	401747519	/nfs/dbraw/zinc/74/75/19/401747519.db2.gz	WKEAFYSXPQGGTE-MWLCHTKSSA-N	0	3	314.227	2.332	10	0		DEAEHN
CC(C)NC(=O)NC(=O)[C@H](C)N1CCC[C@@]2(CC=CCC2)C1	ZINC000114494245	401802539	/nfs/dbraw/zinc/80/25/39/401802539.db2.gz	BFMKHMWJGUNIIV-YOEHRIQHSA-N	0	3	307.438	2.431	10	0		DEAEHN
Cc1cccc(C)c1OCCCN1CCO[C@H](CN(C)C)C1	ZINC000112697945	401754799	/nfs/dbraw/zinc/75/47/99/401754799.db2.gz	ZZMXHAPUQAFHEU-QGZVFWFLSA-N	0	3	306.450	2.335	10	0		DEAEHN
CC(C)N(Cc1cc(=O)n2ccsc2n1)C1CCOCC1	ZINC000077323237	401809984	/nfs/dbraw/zinc/80/99/84/401809984.db2.gz	ZWMALQGFLLZMNF-UHFFFAOYSA-N	0	3	307.419	2.145	10	0		DEAEHN
CN1CCC[C@@H]1CNC(=O)Cc1coc(-c2ccc(F)cc2)n1	ZINC000113185604	401769492	/nfs/dbraw/zinc/76/94/92/401769492.db2.gz	UOCWWPYSXVZWCM-OAHLLOKOSA-N	0	3	317.364	2.234	10	0		DEAEHN
Cc1c(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cnn1-c1ccccc1	ZINC000113224760	401770711	/nfs/dbraw/zinc/77/07/11/401770711.db2.gz	SUECECRERBXQJL-WMLDXEAASA-N	0	3	324.428	2.489	10	0		DEAEHN
Cc1ccc(C)c(OCC(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000113233333	401772476	/nfs/dbraw/zinc/77/24/76/401772476.db2.gz	VOLPSUIDEIXMCM-JKSUJKDBSA-N	0	3	302.418	2.377	10	0		DEAEHN
COc1cccc(CN2CCCC[C@H]2CN2CCOCC2)c1	ZINC000075968741	401775107	/nfs/dbraw/zinc/77/51/07/401775107.db2.gz	BHEAARFQALRIFA-KRWDZBQOSA-N	0	3	304.434	2.382	10	0		DEAEHN
Cn1cc([C@@H]2CCN(Cc3ccc(N4CCCC4)nc3)C2)cn1	ZINC000128427954	401776784	/nfs/dbraw/zinc/77/67/84/401776784.db2.gz	KPTWWHGLRXXBTM-MRXNPFEDSA-N	0	3	311.433	2.405	10	0		DEAEHN
CCc1ccc([C@H]2CCCCN2C(=O)C(C)S(C)(=O)=O)o1	ZINC000128558505	401782418	/nfs/dbraw/zinc/78/24/18/401782418.db2.gz	ZOQPWSQMEAGBOM-WCQYABFASA-N	0	3	313.419	2.329	10	0		DEAEHN
Cc1cc(OC(F)F)c(C(=O)N2CC[C@H](N(C)C)C2)s1	ZINC000114328131	401796405	/nfs/dbraw/zinc/79/64/05/401796405.db2.gz	YTLSWGGQFVKKTH-VIFPVBQESA-N	0	3	304.362	2.434	10	0		DEAEHN
CN1C[C@H](NCc2ccc(F)c(Br)c2)CCC1=O	ZINC000077899909	401836044	/nfs/dbraw/zinc/83/60/44/401836044.db2.gz	JVINKHKEXWKWHL-SNVBAGLBSA-N	0	3	315.186	2.299	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)COc1ccc2c(c1)CCCC2	ZINC000130715314	401838057	/nfs/dbraw/zinc/83/80/57/401838057.db2.gz	ZRDAIQAXCIVQOY-INIZCTEOSA-N	0	3	302.418	2.155	10	0		DEAEHN
COCCN1CCC(NC(=O)N2CCC[C@H]2c2ccco2)CC1	ZINC000116538060	401854143	/nfs/dbraw/zinc/85/41/43/401854143.db2.gz	TYKQVYAVPJYYLP-HNNXBMFYSA-N	0	3	321.421	2.237	10	0		DEAEHN
CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](C)c1nnc2n1CCCC2	ZINC000131720964	401855568	/nfs/dbraw/zinc/85/55/68/401855568.db2.gz	INRYOFNDTSRFAZ-UONOGXRCSA-N	0	3	319.453	2.055	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2cccc(Cl)c2Cl)CCO1	ZINC000116784511	401858452	/nfs/dbraw/zinc/85/84/52/401858452.db2.gz	UFSGWTMUEDADBN-JTQLQIEISA-N	0	3	317.216	2.396	10	0		DEAEHN
CCSCc1ccc(C(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000116784884	401858494	/nfs/dbraw/zinc/85/84/94/401858494.db2.gz	DCMXKHSWWJBAJL-MRXNPFEDSA-N	0	3	322.474	2.342	10	0		DEAEHN
CC(C)CCn1cccc1CNC[C@H]1CN(C2CC2)CCO1	ZINC000119131188	401927781	/nfs/dbraw/zinc/92/77/81/401927781.db2.gz	SKHLDAOSMQTJFS-SFHVURJKSA-N	0	3	305.466	2.487	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1sc(COC)nc1C	ZINC000119215315	401933688	/nfs/dbraw/zinc/93/36/88/401933688.db2.gz	VFZIZGGMAUGNKG-GFCCVEGCSA-N	0	3	311.451	2.154	10	0		DEAEHN
COCCCN(Cc1ccc(F)cc1)C[C@H](O)COC(C)C	ZINC000036095468	401901977	/nfs/dbraw/zinc/90/19/77/401901977.db2.gz	AOBHZAHGAYSIFA-KRWDZBQOSA-N	0	3	313.413	2.450	10	0		DEAEHN
Cc1cc([C@@H]2CN(C(=O)CN(C)C(C)C)CCO2)ccc1F	ZINC000134826719	401916235	/nfs/dbraw/zinc/91/62/35/401916235.db2.gz	UXPNLFIPVZSPHS-INIZCTEOSA-N	0	3	308.397	2.374	10	0		DEAEHN
O=C(c1ccccc1Br)N1CCN2CCC[C@@H]2C1	ZINC000037845333	401917719	/nfs/dbraw/zinc/91/77/19/401917719.db2.gz	WGNZNXZIWLQGTB-LLVKDONJSA-N	0	3	309.207	2.369	10	0		DEAEHN
CCC[C@](C)(CO)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000086369834	401922540	/nfs/dbraw/zinc/92/25/40/401922540.db2.gz	IBGZOEXYOTZTEI-SJLPKXTDSA-N	0	3	321.465	2.010	10	0		DEAEHN
COCCC1(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)CCC1	ZINC000119497644	401954041	/nfs/dbraw/zinc/95/40/41/401954041.db2.gz	LCUSZIJHRZMVOW-GJZGRUSLSA-N	0	3	311.470	2.317	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cnc([C@@H]2CCCO2)s1	ZINC000089827348	401966853	/nfs/dbraw/zinc/96/68/53/401966853.db2.gz	IOJUZRLZEBCQJS-UPJWGTAASA-N	0	3	321.446	2.303	10	0		DEAEHN
CCC[C@H](C(=O)NCc1cccc(Cn2cccn2)c1)N(C)C	ZINC000137636766	401985033	/nfs/dbraw/zinc/98/50/33/401985033.db2.gz	USPZJERFIJZAJB-QGZVFWFLSA-N	0	3	314.433	2.278	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000150793014	401995857	/nfs/dbraw/zinc/99/58/57/401995857.db2.gz	BRDKQGQCZMCIDB-GOEBONIOSA-N	0	3	317.433	2.087	10	0		DEAEHN
CCC(C)(C)c1ccc(CNC(=O)C(C)S(C)(=O)=O)cc1	ZINC000151821736	402058908	/nfs/dbraw/zinc/05/89/08/402058908.db2.gz	VAYJIHOJXBECMJ-GFCCVEGCSA-N	0	3	311.447	2.424	10	0		DEAEHN
Cc1ccccc1[C@@H](C)NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000049172806	402013504	/nfs/dbraw/zinc/01/35/04/402013504.db2.gz	DEKSCPILBCYQFF-HZPDHXFCSA-N	0	3	319.449	2.202	10	0		DEAEHN
Cc1ccccc1[C@H](C)NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000049172808	402013859	/nfs/dbraw/zinc/01/38/59/402013859.db2.gz	DEKSCPILBCYQFF-JKSUJKDBSA-N	0	3	319.449	2.202	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H](C)Oc1cccc(OC)c1)N(C)C	ZINC000121193799	402019373	/nfs/dbraw/zinc/01/93/73/402019373.db2.gz	MEYKZTWDOJDOCB-CJNGLKHVSA-N	0	3	308.422	2.309	10	0		DEAEHN
C[NH+](C)[C@@H]1CC[C@H](NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)C1	ZINC000093994645	402021800	/nfs/dbraw/zinc/02/18/00/402021800.db2.gz	SOYYJLILDMNPQR-QWHCGFSZSA-N	0	3	318.417	2.318	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NCCc1nccs1	ZINC000050772408	402030044	/nfs/dbraw/zinc/03/00/44/402030044.db2.gz	MFCNRHNKEAXFJP-UHFFFAOYSA-N	0	3	319.430	2.056	10	0		DEAEHN
C[C@H](N[C@H]1CCO[C@H]1C)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000121392497	402032751	/nfs/dbraw/zinc/03/27/51/402032751.db2.gz	QBLKTQAGYQEVMK-KWBADKCTSA-N	0	3	301.383	2.057	10	0		DEAEHN
Cc1cccc([C@H](O)CNC(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000121391518	402032844	/nfs/dbraw/zinc/03/28/44/402032844.db2.gz	UQOMLDJWXOJNPY-DLBZAZTESA-N	0	3	321.465	2.304	10	0		DEAEHN
CCOC(=O)c1cnc2cc(Cl)ccc2c1N1CCNCC1	ZINC000053994910	402061167	/nfs/dbraw/zinc/06/11/67/402061167.db2.gz	DIKHDMLZKGIUNX-UHFFFAOYSA-N	0	3	319.792	2.475	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2c(F)cccc2F)C1	ZINC000052553040	402043715	/nfs/dbraw/zinc/04/37/15/402043715.db2.gz	GRAAYFVNIGBONR-GFCCVEGCSA-N	0	3	311.376	2.291	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)CCOc2ccccc2C)C1	ZINC000052593447	402044259	/nfs/dbraw/zinc/04/42/59/402044259.db2.gz	KQTPTXDLVVXEHH-INIZCTEOSA-N	0	3	319.449	2.500	10	0		DEAEHN
O=C(CN1CCC[C@@H]1CCCO)NCc1ccc(Cl)cc1	ZINC000052762889	402046166	/nfs/dbraw/zinc/04/61/66/402046166.db2.gz	QXYDKPQZOYJMTR-OAHLLOKOSA-N	0	3	310.825	2.193	10	0		DEAEHN
O=S(=O)(/C=C/c1ccccc1)N1CC[C@H](CN2CCCC2)C1	ZINC000151634583	402047318	/nfs/dbraw/zinc/04/73/18/402047318.db2.gz	UXRSYFSCRLDSNZ-JZUUQJBKSA-N	0	3	320.458	2.405	10	0		DEAEHN
CCOCCC1(CNC(=O)N[C@@H]2CCCN(CC)C2)CCC1	ZINC000151642471	402048356	/nfs/dbraw/zinc/04/83/56/402048356.db2.gz	SQJLRJVCQBKROO-OAHLLOKOSA-N	0	3	311.470	2.367	10	0		DEAEHN
CCC[C@H]1CN(C[C@](C)(O)c2ccccc2)CCN1CCOC	ZINC000121798289	402052924	/nfs/dbraw/zinc/05/29/24/402052924.db2.gz	HQVCQAOZQCBYTB-OALUTQOASA-N	0	3	320.477	2.327	10	0		DEAEHN
CCOCCN1CCN(CCCCn2ccnc2C)C[C@H]1CC	ZINC000120771628	402001649	/nfs/dbraw/zinc/00/16/49/402001649.db2.gz	MQWNIEMHKREFQP-GOSISDBHSA-N	0	3	322.497	2.404	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cc(-c3ccncc3)on2)CCN1C	ZINC000123283554	402119897	/nfs/dbraw/zinc/11/98/97/402119897.db2.gz	KNYIGTODTSMFSY-TZMCWYRMSA-N	0	3	314.389	2.291	10	0		DEAEHN
Cc1cccc(CN(CCN(C)C)C(=O)[C@H]2CC[C@@H](C)O2)c1	ZINC000152349365	402091153	/nfs/dbraw/zinc/09/11/53/402091153.db2.gz	MIEKPHONBUSLFO-NVXWUHKLSA-N	0	3	304.434	2.453	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2cccc3c2OCCO3)CCN1C	ZINC000122732700	402092289	/nfs/dbraw/zinc/09/22/89/402092289.db2.gz	YPQWGYQVBPWVND-STQMWFEESA-N	0	3	304.390	2.013	10	0		DEAEHN
CC(C)OC(=O)CCN1CCC[C@@H](c2nncn2C2CC2)C1	ZINC000152426988	402095630	/nfs/dbraw/zinc/09/56/30/402095630.db2.gz	OFMNSDHIDUOZJF-CYBMUJFWSA-N	0	3	306.410	2.134	10	0		DEAEHN
CN[C@H](C)C(=O)N[C@H](C)c1ccc(OC)c(Br)c1	ZINC000054074379	402062483	/nfs/dbraw/zinc/06/24/83/402062483.db2.gz	NTNOCCLPMBWIDQ-RKDXNWHRSA-N	0	3	315.211	2.243	10	0		DEAEHN
Cc1ccc([C@H]2CCCCN2CCC(=O)N2CCOCC2)o1	ZINC000124601881	402187995	/nfs/dbraw/zinc/18/79/95/402187995.db2.gz	ZQWORRBCPGIAHX-OAHLLOKOSA-N	0	3	306.406	2.364	10	0		DEAEHN
CC(=O)CCN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000103469140	402190711	/nfs/dbraw/zinc/19/07/11/402190711.db2.gz	YEONKBZKHKJYTI-GFCCVEGCSA-N	0	3	309.797	2.365	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1)N(C)C	ZINC000154088327	402191745	/nfs/dbraw/zinc/19/17/45/402191745.db2.gz	MWLIBKYMWRRTCP-RYQLBKOJSA-N	0	3	317.477	2.496	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)ccc1F	ZINC000124072164	402162179	/nfs/dbraw/zinc/16/21/79/402162179.db2.gz	FQUZXSPGSPOQJD-FZMZJTMJSA-N	0	3	321.396	2.339	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)C(=O)c2ccc3c(c2)CCC3)CCN1C	ZINC000124082511	402163160	/nfs/dbraw/zinc/16/31/60/402163160.db2.gz	GDDLQCZIXPJGOA-SUMWQHHRSA-N	0	3	314.429	2.299	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)Nc1nnc(C(F)F)s1	ZINC000067586873	402163798	/nfs/dbraw/zinc/16/37/98/402163798.db2.gz	MPJDEVQEYOGYQJ-MRVPVSSYSA-N	0	3	319.381	2.472	10	0		DEAEHN
Cc1ccc([C@@H](Cn2c(=O)[nH]c3ccccc3c2=O)N(C)C)cc1	ZINC000067648505	402165866	/nfs/dbraw/zinc/16/58/66/402165866.db2.gz	DQNUBNVTLGGIOU-QGZVFWFLSA-N	0	3	323.396	2.301	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@@H]2CCOc3ccccc32)C1	ZINC000108929176	402264602	/nfs/dbraw/zinc/26/46/02/402264602.db2.gz	MOBDYGSZNUYEGJ-LSDHHAIUSA-N	0	3	317.433	2.336	10	0		DEAEHN
CC[C@H]1CN(C(=O)[C@@H]2CCCCN2CC)CCN1CC(F)F	ZINC000125692355	402245432	/nfs/dbraw/zinc/24/54/32/402245432.db2.gz	HXDZGIODXWYFRV-KBPBESRZSA-N	0	3	317.424	2.049	10	0		DEAEHN
CCOc1ccc(OCC(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc1	ZINC000155421679	402256454	/nfs/dbraw/zinc/25/64/54/402256454.db2.gz	CRSPZHOJWWZJCA-YOEHRIQHSA-N	0	3	320.433	2.309	10	0		DEAEHN
CCCO[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(CC)C2)CC1	ZINC000108562000	402257076	/nfs/dbraw/zinc/25/70/76/402257076.db2.gz	YISSUMHUPKKDFZ-HZPDHXFCSA-N	0	3	311.470	2.461	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(F)cc2Br)C1	ZINC000071139979	402270380	/nfs/dbraw/zinc/27/03/80/402270380.db2.gz	VSUHJVZUIAFSCI-SNVBAGLBSA-N	0	3	315.186	2.364	10	0		DEAEHN
CC[C@@H]1CCC[C@H](NC(=O)NC[C@H](O)CN2CCCCC2)C1	ZINC000155952750	402272454	/nfs/dbraw/zinc/27/24/54/402272454.db2.gz	CXYMLZSXKPHZAN-PMPSAXMXSA-N	0	3	311.470	2.101	10	0		DEAEHN
ClC(Cl)(Cl)CCN1CC[C@H](CN2CCOCC2)C1	ZINC000184576951	402278209	/nfs/dbraw/zinc/27/82/09/402278209.db2.gz	PSRVTJNHZXKRSM-NSHDSACASA-N	0	3	315.672	2.401	10	0		DEAEHN
CCc1cccc(NC(=O)NC[C@H]2CCCN2CCOC)c1	ZINC000110085873	402280732	/nfs/dbraw/zinc/28/07/32/402280732.db2.gz	KCYHGABYAMBERA-MRXNPFEDSA-N	0	3	305.422	2.481	10	0		DEAEHN
CCO[C@H](CCNC(=O)NC[C@@H]1CCCN1C)C1CCCC1	ZINC000176272400	402295748	/nfs/dbraw/zinc/29/57/48/402295748.db2.gz	KGLYRQZVRAMFMY-JKSUJKDBSA-N	0	3	311.470	2.365	10	0		DEAEHN
Cc1ccn2c(c1)nnc2NC(=O)C1Oc2ccccc2O[C@H]1C	ZINC000176307563	402298431	/nfs/dbraw/zinc/29/84/31/402298431.db2.gz	ZLQNNSRFTLKGER-XHDPSFHLSA-N	0	3	324.340	2.205	10	0		DEAEHN
CC(C)C[C@@H](C)C(=O)NC[C@H](O)CN1CCc2ccccc2C1	ZINC000184863166	402305302	/nfs/dbraw/zinc/30/53/02/402305302.db2.gz	HXCFZVFOTJZFDP-QAPCUYQASA-N	0	3	318.461	2.204	10	0		DEAEHN
CC(C)C[C@@H](C)C(=O)NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000184863207	402305334	/nfs/dbraw/zinc/30/53/34/402305334.db2.gz	HXCFZVFOTJZFDP-CRAIPNDOSA-N	0	3	318.461	2.204	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1ccc(-c2nc[nH]n2)cc1	ZINC000184878561	402306338	/nfs/dbraw/zinc/30/63/38/402306338.db2.gz	UECUDUOTKHXUCI-HNNXBMFYSA-N	0	3	315.421	2.178	10	0		DEAEHN
CO[C@@H](C)c1nc(C)c(C(=O)N2CCC[C@H](N(C)C)C2)s1	ZINC000176407892	402306463	/nfs/dbraw/zinc/30/64/63/402306463.db2.gz	JLPUZLGRFWISBE-RYUDHWBXSA-N	0	3	311.451	2.325	10	0		DEAEHN
CC[C@@H]1CN(Cc2cn3cc(C)ccc3n2)CCN1CCOC	ZINC000176917243	402349763	/nfs/dbraw/zinc/34/97/63/402349763.db2.gz	OMPRTBKOHQZAJY-QGZVFWFLSA-N	0	3	316.449	2.185	10	0		DEAEHN
C[C@H](COCc1ccccc1)NC(=O)N(C)CCN(C)C1CC1	ZINC000185478431	402354893	/nfs/dbraw/zinc/35/48/93/402354893.db2.gz	ROEZEVNWZPZOQL-OAHLLOKOSA-N	0	3	319.449	2.327	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Cn1c(C)nc2ccccc21	ZINC000176975131	402355941	/nfs/dbraw/zinc/35/59/41/402355941.db2.gz	ICDGWXOCLLAEGL-OAHLLOKOSA-N	0	3	314.433	2.287	10	0		DEAEHN
CCc1noc2ncc(C(=O)N(C)C[C@H]3CCCN3CC)cc12	ZINC000176990956	402357614	/nfs/dbraw/zinc/35/76/14/402357614.db2.gz	MMOFZMIWCHMZLA-CYBMUJFWSA-N	0	3	316.405	2.342	10	0		DEAEHN
CCc1noc2ncc(C(=O)N(C)C[C@@H]3CCCN3CC)cc12	ZINC000176990943	402357695	/nfs/dbraw/zinc/35/76/95/402357695.db2.gz	MMOFZMIWCHMZLA-ZDUSSCGKSA-N	0	3	316.405	2.342	10	0		DEAEHN
CNC(=O)[C@@H](C)CN(C)Cc1ccc(SC(=O)N(C)C)cc1	ZINC000177084586	402368217	/nfs/dbraw/zinc/36/82/17/402368217.db2.gz	BGTROBWYUMKQDC-LBPRGKRZSA-N	0	3	323.462	2.274	10	0		DEAEHN
COc1cc(C[NH2+]C(C)(C)[C@H](C)O)cc(Br)c1[O-]	ZINC000161134528	402374674	/nfs/dbraw/zinc/37/46/74/402374674.db2.gz	CXTXWBYPERGIOX-QMMMGPOBSA-N	0	3	318.211	2.412	10	0		DEAEHN
C[C@H]1CN(CCOc2ccccc2Cl)C[C@@H]1N1CCOCC1	ZINC000177221542	402383042	/nfs/dbraw/zinc/38/30/42/402383042.db2.gz	JSSNYZPTBKKBDB-HOCLYGCPSA-N	0	3	324.852	2.371	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)Nc2ccc3c(c2)C(=O)CCC3)C1	ZINC000177306152	402389062	/nfs/dbraw/zinc/38/90/62/402389062.db2.gz	KCBBACFVPDVZTK-AWEZNQCLSA-N	0	3	301.390	2.373	10	0		DEAEHN
Cc1ccc(C)c(OCCN2C[C@H](C)[C@H](N3CCOCC3)C2)c1	ZINC000177248289	402384911	/nfs/dbraw/zinc/38/49/11/402384911.db2.gz	LCYRHPFHUYGMFI-ZWKOTPCHSA-N	0	3	318.461	2.335	10	0		DEAEHN
COCc1ccc(C(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)o1	ZINC000176693970	402328992	/nfs/dbraw/zinc/32/89/92/402328992.db2.gz	WBAXVYTYXVUBCI-OKILXGFUSA-N	0	3	324.421	2.045	10	0		DEAEHN
COc1cc(Br)ccc1CN[C@@H](C)CN(C)C	ZINC000228129563	402336175	/nfs/dbraw/zinc/33/61/75/402336175.db2.gz	PUFZSUMEXKJSGW-JTQLQIEISA-N	0	3	301.228	2.497	10	0		DEAEHN
C[C@@H]1CN(c2ccc(CNCc3cccn3C)cn2)C[C@@H](C)O1	ZINC000161657332	402394862	/nfs/dbraw/zinc/39/48/62/402394862.db2.gz	XPBUOONJQKHXHI-HUUCEWRRSA-N	0	3	314.433	2.324	10	0		DEAEHN
COCCCN(C)CCNc1ncnc2cc(F)c(OC)cc21	ZINC000186077197	402399168	/nfs/dbraw/zinc/39/91/68/402399168.db2.gz	UPBFHYNTVDXIEN-UHFFFAOYSA-N	0	3	322.384	2.158	10	0		DEAEHN
C[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)c1ccc2c(c1)OCO2	ZINC000237327948	402404529	/nfs/dbraw/zinc/40/45/29/402404529.db2.gz	IAYQATGLJLFUJW-DOMZBBRYSA-N	0	3	312.369	2.163	10	0		DEAEHN
COc1ccccc1C(=O)C(=O)NC[C@H]1CCCN1CC(C)C	ZINC000186194723	402409691	/nfs/dbraw/zinc/40/96/91/402409691.db2.gz	SWRYKHOVXXXGEA-CQSZACIVSA-N	0	3	318.417	2.115	10	0		DEAEHN
C[C@@]1(C(=O)NCc2cnn(Cc3ccccc3)c2)CCCCN1	ZINC000237600756	402414839	/nfs/dbraw/zinc/41/48/39/402414839.db2.gz	DFECYZJTYUIUCG-SFHVURJKSA-N	0	3	312.417	2.080	10	0		DEAEHN
COCCC1(CNC(=O)N2CC[C@H](N(C)C)C2)CCCCC1	ZINC000186291220	402418419	/nfs/dbraw/zinc/41/84/19/402418419.db2.gz	DKUXSJRDVFYRPL-HNNXBMFYSA-N	0	3	311.470	2.319	10	0		DEAEHN
O=C(Nc1ccc2ccccc2c1)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000177694202	402427125	/nfs/dbraw/zinc/42/71/25/402427125.db2.gz	JZZGZQGHWZKNLO-QGZVFWFLSA-N	0	3	323.396	2.085	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)Nc1cccc(C(C)=O)c1	ZINC000177699906	402427881	/nfs/dbraw/zinc/42/78/81/402427881.db2.gz	OHQPLKLBYJKAJA-KRWDZBQOSA-N	0	3	317.433	2.244	10	0		DEAEHN
CCN(CCNC(=O)NCc1cc(F)ccc1OC)C1CC1	ZINC000186569777	402442566	/nfs/dbraw/zinc/44/25/66/402442566.db2.gz	NWDVTNQKLFAGDN-UHFFFAOYSA-N	0	3	309.385	2.118	10	0		DEAEHN
N[C@H](CC(=O)N1CCn2c3ccccc3nc21)c1ccccc1	ZINC000163289829	402446457	/nfs/dbraw/zinc/44/64/57/402446457.db2.gz	ZFDGSTBRZNUVCP-CQSZACIVSA-N	0	3	306.369	2.473	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1cnn(Cc2ccccc2)c1)N(C)C	ZINC000161596999	402392705	/nfs/dbraw/zinc/39/27/05/402392705.db2.gz	NTPRKLCOEZHNNM-KRWDZBQOSA-N	0	3	314.433	2.278	10	0		DEAEHN
O=C(c1c[nH]nc1-c1ccsc1)N1CCN2CCC[C@H]2C1	ZINC000186683060	402455394	/nfs/dbraw/zinc/45/53/94/402455394.db2.gz	ITAQSYWQJVWAHD-LBPRGKRZSA-N	0	3	302.403	2.058	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cccc(C[S@@](C)=O)c1	ZINC000245426271	402459399	/nfs/dbraw/zinc/45/93/99/402459399.db2.gz	FVQAANUDBFQCQY-KSFYIVLOSA-N	0	3	322.474	2.121	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@H]1CCCN1c1nccs1	ZINC000245435410	402460710	/nfs/dbraw/zinc/46/07/10/402460710.db2.gz	STAWWXHTBBOPBP-UONOGXRCSA-N	0	3	322.478	2.055	10	0		DEAEHN
O=C(COc1ccc2c(c1)CCCC2)N1CCN2CCC[C@@H]2C1	ZINC000178113501	402461638	/nfs/dbraw/zinc/46/16/38/402461638.db2.gz	WMOZBEBTCAZEMO-QGZVFWFLSA-N	0	3	314.429	2.251	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C)C(=O)NCc1ccc(F)cc1	ZINC000245465955	402463263	/nfs/dbraw/zinc/46/32/63/402463263.db2.gz	IZKXGJIXFOCQEA-PBHICJAKSA-N	0	3	321.440	2.247	10	0		DEAEHN
CN(C)C1(CN(C)C(=O)[C@H]2CCCN2c2nccs2)CCC1	ZINC000187010173	402477548	/nfs/dbraw/zinc/47/75/48/402477548.db2.gz	LLRAJFQOGLHPDE-CYBMUJFWSA-N	0	3	322.478	2.055	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCc2nccs2)[C@H]1c1ccccc1	ZINC000245678332	402478509	/nfs/dbraw/zinc/47/85/09/402478509.db2.gz	UQHKUCRQWVHTPA-UKRRQHHQSA-N	0	3	316.430	2.388	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC[C@H]2c2c(C)n[nH]c2C)C1	ZINC000246153839	402513094	/nfs/dbraw/zinc/51/30/94/402513094.db2.gz	TVXANLIUNJKRRC-GJZGRUSLSA-N	0	3	319.453	2.357	10	0		DEAEHN
COc1ccc(O)cc1C(=O)NC[C@@H](c1ccccc1)N(C)C	ZINC000187108973	402483443	/nfs/dbraw/zinc/48/34/43/402483443.db2.gz	OVTFBJHIKPPBSC-INIZCTEOSA-N	0	3	314.385	2.434	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@H](Cc2ccccc2)C(=O)N(C)C)C1(C)C	ZINC000245877078	402493950	/nfs/dbraw/zinc/49/39/50/402493950.db2.gz	KGQIVZPRWKCPIR-IXDOHACOSA-N	0	3	318.461	2.479	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1CCC[C@@H](Cc2noc(C)n2)C1	ZINC000245912337	402496742	/nfs/dbraw/zinc/49/67/42/402496742.db2.gz	PLARXMAUTUFGQU-LSDHHAIUSA-N	0	3	320.437	2.034	10	0		DEAEHN
CN(CC(=O)N1CCC[C@@H](C(F)(F)F)C1)C[C@@H]1CCCOC1	ZINC000245929532	402498177	/nfs/dbraw/zinc/49/81/77/402498177.db2.gz	PKXJRRNRKLQVBU-QWHCGFSZSA-N	0	3	322.371	2.146	10	0		DEAEHN
COC[C@H](C)CN1CCN(Cc2cc(OC)cc(OC)c2)CC1	ZINC000187425043	402500121	/nfs/dbraw/zinc/50/01/21/402500121.db2.gz	IIFMDWDRGIFBLQ-OAHLLOKOSA-N	0	3	322.449	2.104	10	0		DEAEHN
C[C@H](NC(=O)N1CCC[C@H]2CN(C)CC[C@H]21)c1ccncc1	ZINC000245976104	402501524	/nfs/dbraw/zinc/50/15/24/402501524.db2.gz	OSAIGCCNNHFGTQ-CWRNSKLLSA-N	0	3	302.422	2.268	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)N(CCN(C)C)CC(C)C	ZINC000187496994	402502835	/nfs/dbraw/zinc/50/28/35/402502835.db2.gz	KIGADAVFRJYVBS-CQSZACIVSA-N	0	3	322.453	2.380	10	0		DEAEHN
CCC[C@H](C)CS(=O)(=O)N1C[C@H]2CCCN2C[C@H]1CC	ZINC000246051383	402505945	/nfs/dbraw/zinc/50/59/45/402505945.db2.gz	CIJCTMGIJARYBS-RRFJBIMHSA-N	0	3	302.484	2.311	10	0		DEAEHN
CN(C)C[C@H]1CN(CCCCCOc2ccccc2)CCO1	ZINC000189510444	402542205	/nfs/dbraw/zinc/54/22/05/402542205.db2.gz	QCOAZPGMGAWZHN-SFHVURJKSA-N	0	3	306.450	2.498	10	0		DEAEHN
O=C(N[C@@H]1CCCOC1)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000170934242	402543132	/nfs/dbraw/zinc/54/31/32/402543132.db2.gz	UBFVVLWCFGPREC-DOTOQJQBSA-N	0	3	320.408	2.333	10	0		DEAEHN
O=C(NC[C@H]1CCCCN1Cc1ccccc1)N[C@H]1CCOC1	ZINC000246902338	402548999	/nfs/dbraw/zinc/54/89/99/402548999.db2.gz	XSBQIWFSQRIXKK-DLBZAZTESA-N	0	3	317.433	2.129	10	0		DEAEHN
CCc1c(C(=O)N2C[C@H]3CCCN3C[C@H]2C)[nH]c(C)c1C(C)=O	ZINC000246970217	402551404	/nfs/dbraw/zinc/55/14/04/402551404.db2.gz	DPNHGGZOCQYVKG-BXUZGUMPSA-N	0	3	317.433	2.397	10	0		DEAEHN
CC(C)[C@H](O)CC(=O)Nc1ccc(N2CCCN(C)CC2)cc1	ZINC000178901026	402552468	/nfs/dbraw/zinc/55/24/68/402552468.db2.gz	ISTXBWJQKSKPGP-QGZVFWFLSA-N	0	3	319.449	2.174	10	0		DEAEHN
CC(C)COC[C@H](NC(=O)NC[C@@H]1CCCN1C)c1ccco1	ZINC000171191641	402565036	/nfs/dbraw/zinc/56/50/36/402565036.db2.gz	KMIHLOYVARHBTD-GJZGRUSLSA-N	0	3	323.437	2.387	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(Br)cn1	ZINC000247494851	402569576	/nfs/dbraw/zinc/56/95/76/402569576.db2.gz	UORFEHKHFAXYTN-PWSUYJOCSA-N	0	3	324.222	2.153	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)N[C@H]1COc2ccccc21	ZINC000247508422	402570311	/nfs/dbraw/zinc/57/03/11/402570311.db2.gz	OYYHUGHORQMIBO-ZFWWWQNUSA-N	0	3	303.406	2.294	10	0		DEAEHN
CCN(CCNC(=O)N1CC[C@H](N(C)C)C1)c1ccccc1C	ZINC000170830186	402530347	/nfs/dbraw/zinc/53/03/47/402530347.db2.gz	ZZVOAXFKNJWNOL-INIZCTEOSA-N	0	3	318.465	2.167	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)C1	ZINC000189199250	402531747	/nfs/dbraw/zinc/53/17/47/402531747.db2.gz	MGMILVLHUNVZAY-QWHCGFSZSA-N	0	3	318.373	2.044	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cccc(OC[C@@H]3CCCO3)c2)C1	ZINC000170856253	402532939	/nfs/dbraw/zinc/53/29/39/402532939.db2.gz	VFQJGQYLPHSPJA-WBVHZDCISA-N	0	3	318.417	2.021	10	0		DEAEHN
COC(=O)CC1(CC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)CCCC1	ZINC000189322090	402534042	/nfs/dbraw/zinc/53/40/42/402534042.db2.gz	JZIGBIXYTMIYRR-GJZGRUSLSA-N	0	3	324.465	2.441	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170866543	402535011	/nfs/dbraw/zinc/53/50/11/402535011.db2.gz	LMZDJDKLISRMSK-UHOFOFEASA-N	0	3	315.417	2.057	10	0		DEAEHN
CC(C)C[C@H](CO)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179464039	402590675	/nfs/dbraw/zinc/59/06/75/402590675.db2.gz	WJNBCAVPDYVXES-IXDOHACOSA-N	0	3	319.449	2.138	10	0		DEAEHN
Cc1cc(NC(=O)NC[C@@H](O)CN2CCCCC2)ccc1F	ZINC000171520442	402591060	/nfs/dbraw/zinc/59/10/60/402591060.db2.gz	WTIONAHAFHJWGU-CQSZACIVSA-N	0	3	309.385	2.102	10	0		DEAEHN
Cc1cc2c(cc1C)[C@H](C(=O)N1C[C@@H]3CCCN3C[C@H]1C)CO2	ZINC000248584755	402597525	/nfs/dbraw/zinc/59/75/25/402597525.db2.gz	VCUYQHFILUWAAI-HLLBOEOZSA-N	0	3	314.429	2.475	10	0		DEAEHN
C[C@@H](Nc1ccc(OC2CCN(C)CC2)nc1)c1cnn(C)c1	ZINC000179744371	402599529	/nfs/dbraw/zinc/59/95/29/402599529.db2.gz	QUTIVCIMXXJAMH-CYBMUJFWSA-N	0	3	315.421	2.461	10	0		DEAEHN
CCO[C@@H]1C[C@H](N[C@H](CC)c2nccn2C)C12CCOCC2	ZINC000248644354	402601211	/nfs/dbraw/zinc/60/12/11/402601211.db2.gz	PTQSWXLIUHLESN-QLFBSQMISA-N	0	3	307.438	2.435	10	0		DEAEHN
Cc1ccc(F)cc1CN1CCC[C@@H](C(=O)N2CCOCC2)C1	ZINC000179903114	402602738	/nfs/dbraw/zinc/60/27/38/402602738.db2.gz	PPXYSLPPJQOMEA-OAHLLOKOSA-N	0	3	320.408	2.205	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@H](C)N2CCN3CCC[C@@H]3C2)c(C)c1	ZINC000171639470	402604647	/nfs/dbraw/zinc/60/46/47/402604647.db2.gz	XEMWYTRKEYBVTM-HZPDHXFCSA-N	0	3	301.434	2.410	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)[C@@H](C)N1CCN2CCC[C@@H]2C1	ZINC000171639075	402604693	/nfs/dbraw/zinc/60/46/93/402604693.db2.gz	AHRDPCPOTLJSRJ-HZPDHXFCSA-N	0	3	301.434	2.410	10	0		DEAEHN
O=C([C@@H]1C[C@H]1c1ccc(F)c(F)c1)N1CCN2CCC[C@@H]2C1	ZINC000171744911	402617364	/nfs/dbraw/zinc/61/73/64/402617364.db2.gz	NMHZQBXHURNWSS-HZSPNIEDSA-N	0	3	306.356	2.375	10	0		DEAEHN
C[C@@H]1C[C@@H](O)C[C@H](C)N1Cc1cc(=O)n2cc(Cl)ccc2n1	ZINC000249066713	402619571	/nfs/dbraw/zinc/61/95/71/402619571.db2.gz	QJWIGPLBNUGTGG-GNXNZQSNSA-N	0	3	321.808	2.082	10	0		DEAEHN
COCc1cc([C@H](C)N[C@@H]2CCc3ncnn3C2)ccc1OC	ZINC000180599839	402621349	/nfs/dbraw/zinc/62/13/49/402621349.db2.gz	FBAIULXCXUBTDO-SWLSCSKDSA-N	0	3	316.405	2.099	10	0		DEAEHN
COCc1cc([C@H](C)N[C@H]2CCc3ncnn3C2)ccc1OC	ZINC000180599875	402621519	/nfs/dbraw/zinc/62/15/19/402621519.db2.gz	FBAIULXCXUBTDO-WFASDCNBSA-N	0	3	316.405	2.099	10	0		DEAEHN
CCc1nc2n(n1)C[C@@H](N[C@@H](C)c1cnn(C(C)C)c1)CC2	ZINC000180632774	402621845	/nfs/dbraw/zinc/62/18/45/402621845.db2.gz	QXVIYPHOMHHBJB-JSGCOSHPSA-N	0	3	302.426	2.284	10	0		DEAEHN
C[C@]1(C(=O)NCCCc2nc3ccccc3[nH]2)CCCCN1	ZINC000180981786	402631463	/nfs/dbraw/zinc/63/14/63/402631463.db2.gz	FMVJSWYUHXZXLR-QGZVFWFLSA-N	0	3	300.406	2.144	10	0		DEAEHN
O=C(NCCCOc1ccc(F)cc1)N1CCN2CCC[C@@H]2C1	ZINC000171905306	402632536	/nfs/dbraw/zinc/63/25/36/402632536.db2.gz	GOMMMKFIVBYFLQ-OAHLLOKOSA-N	0	3	321.396	2.084	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)CC1CCCCC1	ZINC000171908337	402633154	/nfs/dbraw/zinc/63/31/54/402633154.db2.gz	DKTVTWMBWFTRFY-MRXNPFEDSA-N	0	3	311.470	2.319	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1cccc(C)c1F	ZINC000181213909	402637866	/nfs/dbraw/zinc/63/78/66/402637866.db2.gz	OADBBIGDRHKJIG-LBPRGKRZSA-N	0	3	302.415	2.143	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1cccc(C)c1F	ZINC000181213926	402638067	/nfs/dbraw/zinc/63/80/67/402638067.db2.gz	OADBBIGDRHKJIG-GFCCVEGCSA-N	0	3	302.415	2.143	10	0		DEAEHN
COC(=O)c1oc(CN2CC[C@H](c3cnn(C)c3)C2)cc1C	ZINC000172057004	402638419	/nfs/dbraw/zinc/63/84/19/402638419.db2.gz	WZOARPPFFFGCJD-LBPRGKRZSA-N	0	3	303.362	2.098	10	0		DEAEHN
COC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1CCC(=O)NC1CCCC1	ZINC000249772178	402641098	/nfs/dbraw/zinc/64/10/98/402641098.db2.gz	TXEFUCWUQRGZCC-BMFZPTHFSA-N	0	3	322.449	2.241	10	0		DEAEHN
COC[C@@H](C)CN(C)C[C@H](c1cccs1)N1CCOCC1	ZINC000249960670	402643648	/nfs/dbraw/zinc/64/36/48/402643648.db2.gz	WHOSAHQIXLZFFO-LSDHHAIUSA-N	0	3	312.479	2.336	10	0		DEAEHN
CCc1ccc(CCNC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000172472628	402657944	/nfs/dbraw/zinc/65/79/44/402657944.db2.gz	UQNHDGAKKYLYEW-KRWDZBQOSA-N	0	3	301.434	2.281	10	0		DEAEHN
CC(C)[C@@H](NCC(=O)NC(N)=O)c1ccc(C(F)(F)F)cc1	ZINC000181509598	402647957	/nfs/dbraw/zinc/64/79/57/402647957.db2.gz	FTOWHYZGJIJHHY-GFCCVEGCSA-N	0	3	317.311	2.187	10	0		DEAEHN
CC[C@H]1CCCCN1C(=O)[C@H](C)N1CCCN(C2CC2)CC1	ZINC000172347895	402651442	/nfs/dbraw/zinc/65/14/42/402651442.db2.gz	ZBQDDMMCSBMMRK-HOTGVXAUSA-N	0	3	307.482	2.336	10	0		DEAEHN
C[C@H](C(=O)Nc1cccnc1Cl)N1CCCN(C2CC2)CC1	ZINC000172347238	402651790	/nfs/dbraw/zinc/65/17/90/402651790.db2.gz	BQGMRIRICQTZGQ-GFCCVEGCSA-N	0	3	322.840	2.232	10	0		DEAEHN
CCCC(=O)N[C@@H]1CCCN([C@@H]2Cc3ccccc3[C@@H]2O)C1	ZINC000182745451	402713309	/nfs/dbraw/zinc/71/33/09/402713309.db2.gz	OKJIMKRQQZYDPO-KYJSFNMBSA-N	0	3	302.418	2.025	10	0		DEAEHN
C[C@@H]1CN(C2CCN(CCC(=O)c3ccccc3)CC2)CCO1	ZINC000182073108	402666107	/nfs/dbraw/zinc/66/61/07/402666107.db2.gz	FLYXBBVIHWOLRS-MRXNPFEDSA-N	0	3	316.445	2.445	10	0		DEAEHN
CC1CCN(CCNC(=O)N2CCCC[C@H]2c2cn[nH]c2)CC1	ZINC000182334750	402681636	/nfs/dbraw/zinc/68/16/36/402681636.db2.gz	YZFABLMPHNBUED-INIZCTEOSA-N	0	3	319.453	2.378	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@H]2CC[NH2+]C[C@@H]2C)c(Cl)cc1F	ZINC000262787402	402731715	/nfs/dbraw/zinc/73/17/15/402731715.db2.gz	QRIYRDBKKLOHQM-CABZTGNLSA-N	0	3	320.817	2.064	10	0		DEAEHN
COc1ccc(CNC[C@H]2CN(C3CC3)CCO2)cc1Cl	ZINC000174364590	402737995	/nfs/dbraw/zinc/73/79/95/402737995.db2.gz	SIWOOZBTFLTVSR-AWEZNQCLSA-N	0	3	310.825	2.301	10	0		DEAEHN
C[C@H](NCc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1CCCO1	ZINC000183125151	402741335	/nfs/dbraw/zinc/74/13/35/402741335.db2.gz	WSTRGUIDVPONDK-GWCFXTLKSA-N	0	3	319.373	2.340	10	0		DEAEHN
C[C@@H](NCC(=O)NCc1ccc(Cl)s1)[C@@H]1CCCO1	ZINC000183138298	402742512	/nfs/dbraw/zinc/74/25/12/402742512.db2.gz	RCXUDTLHKWNLCE-KOLCDFICSA-N	0	3	302.827	2.175	10	0		DEAEHN
C/C(=C/c1nc([C@@H]2CNCCN2C)no1)c1cccc(F)c1	ZINC000263238999	402748845	/nfs/dbraw/zinc/74/88/45/402748845.db2.gz	OJXWIYLEUFCFIH-MSKHEQNASA-N	0	3	302.353	2.345	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)C1CCN(C2CC2)CC1	ZINC000192779917	402749872	/nfs/dbraw/zinc/74/98/72/402749872.db2.gz	LDGZHYPDZUFCHQ-UHFFFAOYSA-N	0	3	307.463	2.409	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cccc(-c3nnc(C)o3)c2)C1	ZINC000174646075	402750165	/nfs/dbraw/zinc/75/01/65/402750165.db2.gz	VJXDGIHVSNFVGK-OAHLLOKOSA-N	0	3	314.389	2.259	10	0		DEAEHN
CC(C)OCc1ccc(-c2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263256308	402751284	/nfs/dbraw/zinc/75/12/84/402751284.db2.gz	QNOOCQOMGSUFRE-OAHLLOKOSA-N	0	3	316.405	2.238	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2ccc(C(F)(F)F)cc2)n1	ZINC000263302751	402756403	/nfs/dbraw/zinc/75/64/03/402756403.db2.gz	XGUCCMQHXVNWGX-LLVKDONJSA-N	0	3	312.295	2.332	10	0		DEAEHN
COC(=O)COc1ccccc1[C@H](C)N[C@@H](C)[C@@H]1CCCO1	ZINC000183348782	402759030	/nfs/dbraw/zinc/75/90/30/402759030.db2.gz	MIOUSEQAXQBDJC-YDHLFZDLSA-N	0	3	307.390	2.457	10	0		DEAEHN
C[C@@H](CNCc1cnc(-c2ccco2)s1)N1CCOCC1	ZINC000192994277	402759571	/nfs/dbraw/zinc/75/95/71/402759571.db2.gz	FAVWLKXPMLODBB-LBPRGKRZSA-N	0	3	307.419	2.213	10	0		DEAEHN
C[C@H](NCCO[C@H]1CCCCO1)c1ccc(-n2cncn2)cc1	ZINC000193083828	402764081	/nfs/dbraw/zinc/76/40/81/402764081.db2.gz	WWEUASYUGWJOBP-YOEHRIQHSA-N	0	3	316.405	2.461	10	0		DEAEHN
COC(=O)c1coc(C(=O)N[C@H](C)CN2C[C@H](C)C[C@H](C)C2)c1	ZINC000183449989	402768684	/nfs/dbraw/zinc/76/86/84/402768684.db2.gz	FZNQTRHVDSHFKI-FRRDWIJNSA-N	0	3	322.405	2.162	10	0		DEAEHN
CCCCOC[C@H](O)CN[C@H](C)c1cccc(NC(C)=O)c1	ZINC000193241410	402768918	/nfs/dbraw/zinc/76/89/18/402768918.db2.gz	XBUVLGQNZJJECO-CXAGYDPISA-N	0	3	308.422	2.473	10	0		DEAEHN
CC(C)N1CCC[C@H](N[C@@H](C)c2ccc3c(c2)OCO3)C1=O	ZINC000174986825	402769086	/nfs/dbraw/zinc/76/90/86/402769086.db2.gz	KKKIYKKKQKWWTD-JSGCOSHPSA-N	0	3	304.390	2.465	10	0		DEAEHN
C[C@H]1COCC[C@@H]1C(=O)N(Cc1ccco1)C1CCN(C)CC1	ZINC000193944592	402779742	/nfs/dbraw/zinc/77/97/42/402779742.db2.gz	JNTDMWIRXMTJOT-YOEHRIQHSA-N	0	3	320.433	2.375	10	0		DEAEHN
CN(C)c1ccncc1C(=O)NCc1nc2ccc(F)cc2[nH]1	ZINC000183594038	402779964	/nfs/dbraw/zinc/77/99/64/402779964.db2.gz	IHPVFAPDOVVOAH-UHFFFAOYSA-N	0	3	313.336	2.093	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)NCc1ccc(C)cc1	ZINC000175344316	402798903	/nfs/dbraw/zinc/79/89/03/402798903.db2.gz	LMVKOWWXDFWUDY-KRWDZBQOSA-N	0	3	303.450	2.027	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N[C@@H](C)COCc1ccccc1	ZINC000175369491	402800999	/nfs/dbraw/zinc/80/09/99/402800999.db2.gz	BFQOVZAUBBNZEL-DOTOQJQBSA-N	0	3	319.449	2.375	10	0		DEAEHN
O=C(c1csc(-c2ccccn2)n1)N1CCN2CCC[C@H]2C1	ZINC000194524514	402801554	/nfs/dbraw/zinc/80/15/54/402801554.db2.gz	PCWVTYJFKWFHML-LBPRGKRZSA-N	0	3	314.414	2.125	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)CCCc2nc(C(C)(C)C)no2)C1	ZINC000194658798	402808847	/nfs/dbraw/zinc/80/88/47/402808847.db2.gz	KXMDTLDEFNQGPQ-CYBMUJFWSA-N	0	3	322.453	2.290	10	0		DEAEHN
CCN(CCO)CCNC(=O)c1ccc(-c2ccc(F)cc2)o1	ZINC000183982679	402810588	/nfs/dbraw/zinc/81/05/88/402810588.db2.gz	CCKGDJDIAFHCHZ-UHFFFAOYSA-N	0	3	320.364	2.130	10	0		DEAEHN
COc1ccc(S[C@@H](C)C(=O)NC[C@@H]2CCCN2C)cc1	ZINC000194692151	402810732	/nfs/dbraw/zinc/81/07/32/402810732.db2.gz	SSTZJQUVLBQWGW-STQMWFEESA-N	0	3	308.447	2.386	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1cccc(OC[C@@H]2CCCO2)c1	ZINC000194711628	402811678	/nfs/dbraw/zinc/81/16/78/402811678.db2.gz	OIKPNBLXGKVYIM-RDJZCZTQSA-N	0	3	318.417	2.068	10	0		DEAEHN
Cc1cc([N-]C(=O)[C@@H](C)N2CCC(C[NH+]3CCCC3)CC2)on1	ZINC000194733134	402813253	/nfs/dbraw/zinc/81/32/53/402813253.db2.gz	JDAKTQPHAKQHTC-CQSZACIVSA-N	0	3	320.437	2.118	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccc(OC(F)(F)F)cc1	ZINC000194734151	402813856	/nfs/dbraw/zinc/81/38/56/402813856.db2.gz	YXQNRKDTDKIUQQ-NSHDSACASA-N	0	3	302.296	2.409	10	0		DEAEHN
CCn1cc([C@H](C)NC2CCN(c3ncccn3)CC2)cn1	ZINC000194981699	402825043	/nfs/dbraw/zinc/82/50/43/402825043.db2.gz	SBIBDYAIJPKVPX-ZDUSSCGKSA-N	0	3	300.410	2.013	10	0		DEAEHN
O=C(c1cc(-c2cccs2)[nH]n1)N1CCN2CCCC[C@@H]2C1	ZINC000195056369	402829956	/nfs/dbraw/zinc/82/99/56/402829956.db2.gz	FQFMNBAWRLNCAU-GFCCVEGCSA-N	0	3	316.430	2.449	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc(OC(C)C)c(OC)c1	ZINC000175855965	402838296	/nfs/dbraw/zinc/83/82/96/402838296.db2.gz	NQXHYAUPZRXLRH-KRWDZBQOSA-N	0	3	311.422	2.360	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H]2CCCO[C@@H]2C(C)C)C1	ZINC000175953487	402844512	/nfs/dbraw/zinc/84/45/12/402844512.db2.gz	QGYDLHRDLVSDKH-HRCADAONSA-N	0	3	311.470	2.221	10	0		DEAEHN
CC[C@@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1nccs1	ZINC000175157819	402783917	/nfs/dbraw/zinc/78/39/17/402783917.db2.gz	DLCVEFYBCBWMGF-QWHCGFSZSA-N	0	3	306.435	2.250	10	0		DEAEHN
CCn1cc(C2CCN(CCn3c(C)csc3=O)CC2)cn1	ZINC000195499915	402847551	/nfs/dbraw/zinc/84/75/51/402847551.db2.gz	AOZXENDAKHECJZ-UHFFFAOYSA-N	0	3	320.462	2.314	10	0		DEAEHN
CCSCc1cc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)no1	ZINC000184525400	402849157	/nfs/dbraw/zinc/84/91/57/402849157.db2.gz	JWNBECQEXRELDZ-NWDGAFQWSA-N	0	3	309.435	2.236	10	0		DEAEHN
C[C@H](CCc1cccn1C)NC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000176032830	402849173	/nfs/dbraw/zinc/84/91/73/402849173.db2.gz	MIIVFEZUQLKJNV-WBVHZDCISA-N	0	3	316.449	2.002	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1cc2c([nH]c1=O)CCCCC2	ZINC000268210823	403062372	/nfs/dbraw/zinc/06/23/72/403062372.db2.gz	VKACHPQXXHLLFZ-CQSZACIVSA-N	0	3	317.433	2.222	10	0		DEAEHN
CC(=O)N(C[C@@H]1CCCN1Cc1cccc2nccn21)C1CC1	ZINC000275767289	403121671	/nfs/dbraw/zinc/12/16/71/403121671.db2.gz	RBHOKPBQFKJTEV-INIZCTEOSA-N	0	3	312.417	2.310	10	0		DEAEHN
C[C@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cn[nH]c1	ZINC000285084466	403277737	/nfs/dbraw/zinc/27/77/37/403277737.db2.gz	JSWBJIXJABRAMI-YJBOKZPZSA-N	0	3	314.433	2.351	10	0		DEAEHN
c1c(CNC[C@H]2CCN(c3ccccc3)C2)nc2ncccn12	ZINC000298454152	403385756	/nfs/dbraw/zinc/38/57/56/403385756.db2.gz	OBCYGGSUFNHKJV-OAHLLOKOSA-N	0	3	307.401	2.345	10	0		DEAEHN
CC(=O)c1cc(C(=O)NCCN2[C@H](C)CCC[C@H]2C)n(C)c1	ZINC000343164485	403484102	/nfs/dbraw/zinc/48/41/02/403484102.db2.gz	LAMZOHRIKQPCHE-CHWSQXEVSA-N	0	3	305.422	2.220	10	0		DEAEHN
Cc1ccc2c(c1C)OC[C@H]2NC(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000332834918	403623209	/nfs/dbraw/zinc/62/32/09/403623209.db2.gz	YFVZBMOAEFTOMV-CZUORRHYSA-N	0	3	315.417	2.273	10	0		DEAEHN
Cc1cc(C)n(-c2cncc(N3CCN(CC(C)C)CC3)n2)n1	ZINC000301664156	403660868	/nfs/dbraw/zinc/66/08/68/403660868.db2.gz	ZAJNLLXEHRWONC-UHFFFAOYSA-N	0	3	314.437	2.057	10	0		DEAEHN
CN(C[C@@H]1CCCO1)C(=O)Nc1ccc2c(c1F)CCNC2	ZINC000333102756	403666545	/nfs/dbraw/zinc/66/65/45/403666545.db2.gz	AYUWMXZDDRBUTM-LBPRGKRZSA-N	0	3	307.369	2.114	10	0		DEAEHN
c1ccc(OC2CC2)c(CN2CC[C@@H](CN3CCOCC3)C2)c1	ZINC000289023775	403810457	/nfs/dbraw/zinc/81/04/57/403810457.db2.gz	AWCWLCIEJLVECP-INIZCTEOSA-N	0	3	316.445	2.382	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCC[C@@H](CC(=O)OC(C)C)C1	ZINC000361807931	403877528	/nfs/dbraw/zinc/87/75/28/403877528.db2.gz	LLZNNJMUKCQLQX-JKSUJKDBSA-N	0	3	324.465	2.441	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCC[C@@H]1C[C@@H](C)O	ZINC000305212497	403880166	/nfs/dbraw/zinc/88/01/66/403880166.db2.gz	GLPNAVOSOWUSCO-NVXWUHKLSA-N	0	3	304.434	2.270	10	0		DEAEHN
CCC[C@@H](O)CN1CC[C@H](Oc2cccnc2N2CCCC2)C1	ZINC000295948818	404024681	/nfs/dbraw/zinc/02/46/81/404024681.db2.gz	LQDKVSRUVDVUGG-CVEARBPZSA-N	0	3	319.449	2.296	10	0		DEAEHN
Cc1c(C(=O)N[C@H]2CC[C@H](N(C)C)C2)[nH]c2c1C(=O)CCC2	ZINC000337156997	403969958	/nfs/dbraw/zinc/96/99/58/403969958.db2.gz	PXYAKXSLBCMMEP-RYUDHWBXSA-N	0	3	303.406	2.055	10	0		DEAEHN
c1cc(-c2ccc(CN3CCS[C@H]4COCC[C@H]43)o2)n[nH]1	ZINC000369485710	404113434	/nfs/dbraw/zinc/11/34/34/404113434.db2.gz	RWQPBNVOUFJFOI-HIFRSBDPSA-N	0	3	305.403	2.376	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@H]1NCc1cccc(Br)c1F	ZINC000296862876	404347003	/nfs/dbraw/zinc/34/70/03/404347003.db2.gz	PCCVWDNHHQRZOU-LDYMZIIASA-N	0	3	315.186	2.345	10	0		DEAEHN
CO[C@H]1C[C@@H](CO)N(CCOc2ccccc2C(F)(F)F)C1	ZINC000344697773	404315454	/nfs/dbraw/zinc/31/54/54/404315454.db2.gz	CDBVQGXXUWCIRF-RYUDHWBXSA-N	0	3	319.323	2.166	10	0		DEAEHN
C(CCCN1C[C@H]2CC[C@@H](C1)O2)CCN1C[C@H]2CC[C@@H](C1)O2	ZINC000374077158	404686879	/nfs/dbraw/zinc/68/68/79/404686879.db2.gz	CGKOMKZMJKSLJY-USTZCAOPSA-N	0	3	308.466	2.273	10	0		DEAEHN
CN(CCCO)C(=O)NCCN1CCC2(CCCCC2)CC1	ZINC000374246116	404702257	/nfs/dbraw/zinc/70/22/57/404702257.db2.gz	VJUSAPOGTNONBW-UHFFFAOYSA-N	0	3	311.470	2.057	10	0		DEAEHN
C[C@H]1CCOCCN1CCCN1CCN(c2ccccc2)CC1	ZINC000375728088	404735523	/nfs/dbraw/zinc/73/55/23/404735523.db2.gz	XKNZSUZKCYDYMJ-SFHVURJKSA-N	0	3	317.477	2.310	10	0		DEAEHN
CC(C)[C@@H](O)C(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1	ZINC000375841345	404758178	/nfs/dbraw/zinc/75/81/78/404758178.db2.gz	RSDLYCPZJAWQOU-AEGPPILISA-N	0	3	310.463	2.264	10	0		DEAEHN
CCCc1occc1C(=O)N1CCN([C@@H]2CCCN(C)C2)CC1	ZINC000366946634	404878046	/nfs/dbraw/zinc/87/80/46/404878046.db2.gz	SKOACSOVEKHDJG-OAHLLOKOSA-N	0	3	319.449	2.084	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(CCc2ccc(C)cc2)CC12COC2	ZINC000451143006	404879125	/nfs/dbraw/zinc/87/91/25/404879125.db2.gz	WTISJXNYGGDKTG-INIZCTEOSA-N	0	3	303.402	2.049	10	0		DEAEHN
OCC[C@@H]1CSCCN1CCCc1ccc2c(c1)CCO2	ZINC000360967565	404864291	/nfs/dbraw/zinc/86/42/91/404864291.db2.gz	AVELLFBOHUXMIE-MRXNPFEDSA-N	0	3	307.459	2.354	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCc1nc2cc(F)ccc2[nH]1	ZINC000361128992	404933563	/nfs/dbraw/zinc/93/35/63/404933563.db2.gz	NUFPVUARVDGMDS-CQSZACIVSA-N	0	3	304.369	2.193	10	0		DEAEHN
CCn1ncnc1CNC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000398104607	405060671	/nfs/dbraw/zinc/06/06/71/405060671.db2.gz	OHQWVOPIPNVTJA-GOSISDBHSA-N	0	3	313.449	2.442	10	0		DEAEHN
COc1ccc(CNCC[C@@H]2COc3ccccc3O2)cn1	ZINC000436304011	405068273	/nfs/dbraw/zinc/06/82/73/405068273.db2.gz	DNHBPFNJJUCVES-CQSZACIVSA-N	0	3	300.358	2.410	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)[nH]1	ZINC000408021066	405092562	/nfs/dbraw/zinc/09/25/62/405092562.db2.gz	GJSSZGOUGKYBCF-KGLIPLIRSA-N	0	3	303.406	2.305	10	0		DEAEHN
C[C@H]1C[C@@H](NC(=O)NC[C@@H]2C[C@@H](C)O[C@@H](C)C2)CN1C1CC1	ZINC000408181480	405133151	/nfs/dbraw/zinc/13/31/51/405133151.db2.gz	CYDPOVDIXSAITC-SBJFKYEJSA-N	0	3	309.454	2.114	10	0		DEAEHN
CC(=O)c1ccccc1NC(=O)CCCN1CCC[C@H](O)[C@@H]1C	ZINC000568408740	292339192	/nfs/dbraw/zinc/33/91/92/292339192.db2.gz	XDNHUVUJQZXIJR-GUYCJALGSA-N	0	3	318.417	2.453	10	0		DEAEHN
Cc1nc(CC(C)C)c(C(=O)NCCNc2ccncc2)s1	ZINC000446736433	405391348	/nfs/dbraw/zinc/39/13/48/405391348.db2.gz	PCPUUZMTIWNTRW-UHFFFAOYSA-N	0	3	318.446	2.309	10	0		DEAEHN
c1ncn(-c2ccc(CNCc3cnc4n3CCCC4)cc2)n1	ZINC000556411333	405480623	/nfs/dbraw/zinc/48/06/23/405480623.db2.gz	BHWWQAVYHFPCSN-UHFFFAOYSA-N	0	3	308.389	2.090	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N2CCCC[C@@H]2CN(C)C)cc1	ZINC000577694922	405493569	/nfs/dbraw/zinc/49/35/69/405493569.db2.gz	POFUHCHUCCSOKJ-QGZVFWFLSA-N	0	3	317.433	2.226	10	0		DEAEHN
Cc1cc(CCNC(=O)NC[C@@H](C)N2CCCC[C@H]2C)on1	ZINC000557777809	405628090	/nfs/dbraw/zinc/62/80/90/405628090.db2.gz	UWZPVRKAUTYTFJ-ZIAGYGMSSA-N	0	3	308.426	2.088	10	0		DEAEHN
Cc1cc(CCNC(=O)NC[C@@H](C)N2CCCC[C@@H]2C)on1	ZINC000557777808	405628267	/nfs/dbraw/zinc/62/82/67/405628267.db2.gz	UWZPVRKAUTYTFJ-UONOGXRCSA-N	0	3	308.426	2.088	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)NC(C)(C)CN(C)C)cc2)c1	ZINC000457215196	405756461	/nfs/dbraw/zinc/75/64/61/405756461.db2.gz	YJBPFALOEKKCDG-UHFFFAOYSA-N	0	3	300.406	2.251	10	0		DEAEHN
Cn1nccc1CN[C@H]1CCO[C@@H]1c1ccnn1-c1ccccc1	ZINC000583616587	405774471	/nfs/dbraw/zinc/77/44/71/405774471.db2.gz	MONQLQVBIADTIS-WMZOPIPTSA-N	0	3	323.400	2.226	10	0		DEAEHN
COc1nsc(CN[C@H]2CCOC[C@H]2C)c1Br	ZINC000639121201	405898779	/nfs/dbraw/zinc/89/87/79/405898779.db2.gz	NFSPATDFIZBBLV-SFYZADRCSA-N	0	3	321.240	2.429	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N2CCCN(C(C)C)CC2)c1	ZINC000457523906	405881637	/nfs/dbraw/zinc/88/16/37/405881637.db2.gz	OKCFYJQWFNQANF-UHFFFAOYSA-N	0	3	318.417	2.338	10	0		DEAEHN
CO[C@H](CNC[C@@H]1CCCCS1(=O)=O)C1CCCCC1	ZINC000639035636	405833143	/nfs/dbraw/zinc/83/31/43/405833143.db2.gz	FUINKMUMGYHYLX-LSDHHAIUSA-N	0	3	303.468	2.139	10	0		DEAEHN
COc1ccc(-c2nc(CNC(C)(C)CN(C)C)no2)cc1	ZINC000459539805	405947068	/nfs/dbraw/zinc/94/70/68/405947068.db2.gz	QAARVSPGFFHXRI-UHFFFAOYSA-N	0	3	304.394	2.175	10	0		DEAEHN
O=C(NC1(CCO)CCCCC1)C1CN(C2CCCCC2)C1	ZINC000457699726	405957173	/nfs/dbraw/zinc/95/71/73/405957173.db2.gz	WWXHPLJCFUPDRR-UHFFFAOYSA-N	0	3	308.466	2.452	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c1	ZINC000457603764	405916578	/nfs/dbraw/zinc/91/65/78/405916578.db2.gz	POTBCPJKAWJTED-CVEARBPZSA-N	0	3	316.401	2.090	10	0		DEAEHN
CS[C@H]1CN(Cc2nnc(C(C)C)s2)C[C@H]1N(C)C	ZINC000450636353	405974999	/nfs/dbraw/zinc/97/49/99/405974999.db2.gz	MPKQHKBNTIKDGH-MNOVXSKESA-N	0	3	300.497	2.139	10	0		DEAEHN
c1cc(CNCCc2cnc(C3CC3)nc2)c2c(c1)OCCO2	ZINC000533742752	406160373	/nfs/dbraw/zinc/16/03/73/406160373.db2.gz	MERVDEWCBZWDGP-UHFFFAOYSA-N	0	3	311.385	2.458	10	0		DEAEHN
c1ncn(CC2CCN(Cc3cccc4c3CCOC4)CC2)n1	ZINC000639598183	406162515	/nfs/dbraw/zinc/16/25/15/406162515.db2.gz	JZPCIOKTACOQIG-UHFFFAOYSA-N	0	3	312.417	2.263	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@@H]1[C@@H]2CCO[C@H]2C1(C)C	ZINC000487280112	406221151	/nfs/dbraw/zinc/22/11/51/406221151.db2.gz	QULSNFIDJDJTOK-XXILOJSOSA-N	0	3	314.227	2.086	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@H]1CCCc2sccc21	ZINC000547361740	406402125	/nfs/dbraw/zinc/40/21/25/406402125.db2.gz	DAEXAMSTHGJIPE-AWEZNQCLSA-N	0	3	316.430	2.354	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCc1nc(C)c2ccccc2n1	ZINC000522545822	406407068	/nfs/dbraw/zinc/40/70/68/406407068.db2.gz	JYRBVFQRUDFWOE-MRXNPFEDSA-N	0	3	312.417	2.429	10	0		DEAEHN
COc1cccc2c1CCN(CCCc1nc(C)no1)CC2	ZINC000489524016	406415634	/nfs/dbraw/zinc/41/56/34/406415634.db2.gz	TZSIUVPHZLYRTR-UHFFFAOYSA-N	0	3	301.390	2.420	10	0		DEAEHN
c1cnc(N2CCC[C@H](NCc3ccc4nccnc4c3)C2)nc1	ZINC000634954125	406368045	/nfs/dbraw/zinc/36/80/45/406368045.db2.gz	ULQXHTBGTQFYPK-HNNXBMFYSA-N	0	3	320.400	2.178	10	0		DEAEHN
COc1ccc(Cl)cc1CN[C@@H]1CCCS(=O)(=O)CC1	ZINC000634956648	406370502	/nfs/dbraw/zinc/37/05/02/406370502.db2.gz	OGPRJOICRMUTPZ-CYBMUJFWSA-N	0	3	317.838	2.406	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NCCC1CCCC1	ZINC000637925124	406480000	/nfs/dbraw/zinc/48/00/00/406480000.db2.gz	IEHRQGJBAPMYBC-QGZVFWFLSA-N	0	3	303.450	2.142	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@H](C(=O)N(C)CCN1CCCC1)C2	ZINC000526001963	406530819	/nfs/dbraw/zinc/53/08/19/406530819.db2.gz	AIUQHGLFUBTYTC-AWEZNQCLSA-N	0	3	318.465	2.192	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@@H](C(=O)N(C)CCN1CCCC1)CC2	ZINC000526001963	406530824	/nfs/dbraw/zinc/53/08/24/406530824.db2.gz	AIUQHGLFUBTYTC-AWEZNQCLSA-N	0	3	318.465	2.192	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N[C@H]1CCCC1(C)C	ZINC000638004684	406519621	/nfs/dbraw/zinc/51/96/21/406519621.db2.gz	FBTJIQGOVODXMO-HOTGVXAUSA-N	0	3	303.450	2.141	10	0		DEAEHN
CC[C@H](NC[C@H]1CCC2(CCOCC2)[C@@H]1O)c1ccn(C)n1	ZINC000549625105	406589408	/nfs/dbraw/zinc/58/94/08/406589408.db2.gz	HKEFNZFSDBIYIZ-IJEWVQPXSA-N	0	3	307.438	2.029	10	0		DEAEHN
Cc1cc(C)n(CCN2CC[C@H](c3nc(C4CC4)no3)C2)n1	ZINC000551944837	406657618	/nfs/dbraw/zinc/65/76/18/406657618.db2.gz	BYUOEDBGDBFANZ-AWEZNQCLSA-N	0	3	301.394	2.250	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N[C@H]1CC12CCCCC2	ZINC000638290293	406675390	/nfs/dbraw/zinc/67/53/90/406675390.db2.gz	FDDCNAPECMOYGK-SJORKVTESA-N	0	3	315.461	2.285	10	0		DEAEHN
O=C(NCCNc1ccncc1)Nc1nc(C2CCC2)cs1	ZINC000551874461	406644343	/nfs/dbraw/zinc/64/43/43/406644343.db2.gz	WGSXIZWUHHYEEP-UHFFFAOYSA-N	0	3	317.418	2.461	10	0		DEAEHN
Cn1cc(CCN2CCC[C@@H](CC(=O)OC(C)(C)C)C2)cn1	ZINC000551899751	406646713	/nfs/dbraw/zinc/64/67/13/406646713.db2.gz	XFUDAYSRKGXHTN-AWEZNQCLSA-N	0	3	307.438	2.406	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CCC[C@H](CCF)C1	ZINC000638420931	406763095	/nfs/dbraw/zinc/76/30/95/406763095.db2.gz	WKNXTOQJYBBGJV-SJORKVTESA-N	0	3	321.440	2.044	10	0		DEAEHN
C[C@@H]1C[C@H](c2cccnc2)N(C[C@H](O)COC[C@H]2CCCO2)C1	ZINC000554264183	406789571	/nfs/dbraw/zinc/78/95/71/406789571.db2.gz	NGNAAIGUDLZANV-BZZMCLGOSA-N	0	3	320.433	2.021	10	0		DEAEHN
O=C(N[C@H]1CCN(C2CC2)C1)N1CCC(C2CCOCC2)CC1	ZINC000554591000	406815013	/nfs/dbraw/zinc/81/50/13/406815013.db2.gz	FNRXWYHTAJRXHT-INIZCTEOSA-N	0	3	321.465	2.071	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@@H]1NC(=O)c1cc(Cl)ncc1Cl	ZINC000129436422	196048460	/nfs/dbraw/zinc/04/84/60/196048460.db2.gz	KIYSAHKBTITVTD-KCJUWKMLSA-N	0	3	302.205	2.458	10	0		DEAEHN
NCc1cccc(S(=O)(=O)NCCCCC(F)(F)F)c1	ZINC000130554461	196090710	/nfs/dbraw/zinc/09/07/10/196090710.db2.gz	HSMNRDRTVCKTHD-UHFFFAOYSA-N	0	3	310.341	2.156	10	0		DEAEHN
CC(C)Cn1ncnc1C[C@@H](N)c1ccc(Br)cn1	ZINC000130779735	196109413	/nfs/dbraw/zinc/10/94/13/196109413.db2.gz	ZUEDIKSIGBGLBG-LLVKDONJSA-N	0	3	324.226	2.334	10	0		DEAEHN
CC(C)n1ncnc1C[C@H](N)c1ccc(Br)cn1	ZINC000130779083	196109733	/nfs/dbraw/zinc/10/97/33/196109733.db2.gz	XOHPYNVEFWQNRL-JTQLQIEISA-N	0	3	310.199	2.259	10	0		DEAEHN
CCN[C@H](Cc1ncnn1CC)c1ccc(Br)cn1	ZINC000130886735	196119605	/nfs/dbraw/zinc/11/96/05/196119605.db2.gz	IENSVWCFYGWASW-GFCCVEGCSA-N	0	3	324.226	2.349	10	0		DEAEHN
CC(C)(C)NCc1ccc(CS(=O)(=O)C2CCOCC2)o1	ZINC000130930908	196123656	/nfs/dbraw/zinc/12/36/56/196123656.db2.gz	NPDNPMBRRWHEGG-UHFFFAOYSA-N	0	3	315.435	2.262	10	0		DEAEHN
CCc1nn([C@@H]2CCS(=O)(=O)C2)c(CC)c1[C@H](CC)NC	ZINC000131084848	196138574	/nfs/dbraw/zinc/13/85/74/196138574.db2.gz	WOANRUYZTDRROE-NEPJUHHUSA-N	0	3	313.467	2.038	10	0		DEAEHN
COCCNC[C@@](C)(O)c1ccc(Br)cc1F	ZINC000131193516	196148928	/nfs/dbraw/zinc/14/89/28/196148928.db2.gz	WFZAFEWBSYTIGK-GFCCVEGCSA-N	0	3	306.175	2.032	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2cccc(C)c2Br)C1	ZINC000131399209	196164979	/nfs/dbraw/zinc/16/49/79/196164979.db2.gz	PISDLJWTGWKFTD-ONGXEEELSA-N	0	3	313.195	2.073	10	0		DEAEHN
CC[C@@H](C)[C@](C)(O)c1c(Br)cnn1CCN(C)C	ZINC000131446163	196170306	/nfs/dbraw/zinc/17/03/06/196170306.db2.gz	RELCFGLPXIVMTB-MFKMUULPSA-N	0	3	318.259	2.461	10	0		DEAEHN
Cc1cccc(NC(=O)C[C@@H]2CNCCO2)c1Br	ZINC000131460033	196170451	/nfs/dbraw/zinc/17/04/51/196170451.db2.gz	XUGGTJCBWDUNGD-SNVBAGLBSA-N	0	3	313.195	2.075	10	0		DEAEHN
C[C@H](CN(C)C)N1C(=O)C2(CCCC2)N[C@@H]1c1cccs1	ZINC000131649454	196187796	/nfs/dbraw/zinc/18/77/96/196187796.db2.gz	YPBRUAAYBFEXKP-OCCSQVGLSA-N	0	3	307.463	2.441	10	0		DEAEHN
CC[S@](=O)CCNCc1ccc(Br)c(F)c1	ZINC000131650059	196188118	/nfs/dbraw/zinc/18/81/18/196188118.db2.gz	JDXOQTWJSNDMCU-MRXNPFEDSA-N	0	3	308.216	2.446	10	0		DEAEHN
CCNCc1cc(Cl)cc(OC)c1O[C@@H]1CCN(C)C1=O	ZINC000132110644	196226487	/nfs/dbraw/zinc/22/64/87/196226487.db2.gz	YCBYWYTYARFYGS-GFCCVEGCSA-N	0	3	312.797	2.068	10	0		DEAEHN
NC1(C(=O)N2CCc3sccc3[C@H]2C2CC2)CCOCC1	ZINC000132166179	196232691	/nfs/dbraw/zinc/23/26/91/196232691.db2.gz	YKEZMXYYRQAKGX-CQSZACIVSA-N	0	3	306.431	2.092	10	0		DEAEHN
C[C@@H]1CNC[C@H](COc2ncc(Cl)cc2Br)O1	ZINC000133852655	196340432	/nfs/dbraw/zinc/34/04/32/196340432.db2.gz	NZYKSGPZYXQVJF-VXNVDRBHSA-N	0	3	321.602	2.253	10	0		DEAEHN
CCC(CC)(C(=O)c1c(Cl)cnn1CCN(C)C)N(C)C	ZINC000134125332	196363075	/nfs/dbraw/zinc/36/30/75/196363075.db2.gz	RAFZLJUBYZZKDQ-UHFFFAOYSA-N	0	3	314.861	2.401	10	0		DEAEHN
NCc1ccc(S(=O)(=O)NCCC2CCC2)cc1Cl	ZINC000134158925	196366842	/nfs/dbraw/zinc/36/68/42/196366842.db2.gz	NJTXGHIRPQBMRC-UHFFFAOYSA-N	0	3	302.827	2.267	10	0		DEAEHN
CCS(=O)(=O)C[C@@H](C)NCCc1cn(C)c2cc(C)ccc12	ZINC000188699161	225030694	/nfs/dbraw/zinc/03/06/94/225030694.db2.gz	CVJKLJXLGCDXEU-CQSZACIVSA-N	0	3	322.474	2.442	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N(CC1CCC1)C(C)C	ZINC000193653322	225164868	/nfs/dbraw/zinc/16/48/68/225164868.db2.gz	RHEFJQIRSBNCCM-INIZCTEOSA-N	0	3	311.470	2.317	10	0		DEAEHN
CN(C)[C@@H]1CCN(c2nnc(Cc3ccc(F)cc3)s2)C1	ZINC000302082053	230085351	/nfs/dbraw/zinc/08/53/51/230085351.db2.gz	CKUNDHFPNZXQSM-CYBMUJFWSA-N	0	3	306.410	2.408	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Nc1nccnc1N(C)C	ZINC000302211580	230168601	/nfs/dbraw/zinc/16/86/01/230168601.db2.gz	ZKKWSHOXQJGZOR-ZBFHGGJFSA-N	0	3	311.433	2.475	10	0		DEAEHN
c1ncn(C[C@H]2CCCN(Cc3cnn(-c4ccccc4)c3)C2)n1	ZINC000105883779	424849270	/nfs/dbraw/zinc/84/92/70/424849270.db2.gz	OKPHOSVWLXIWOG-INIZCTEOSA-N	0	3	322.416	2.376	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)c2cccc(NC(=O)C3CC3)c2)C1	ZINC000194628145	424877680	/nfs/dbraw/zinc/87/76/80/424877680.db2.gz	HJUCUPYKHPQMEU-MRXNPFEDSA-N	0	3	315.417	2.249	10	0		DEAEHN
CC(C)O[C@@H]1CCCN(C[C@@H](O)COCc2ccccc2)C1	ZINC000404487757	424928311	/nfs/dbraw/zinc/92/83/11/424928311.db2.gz	ODNDTBIJZYEMJO-QZTJIDSGSA-N	0	3	307.434	2.454	10	0		DEAEHN
O[C@@H]1C[C@H]2CN(Cc3cc(Cl)ccc3Cl)CCN2C1	ZINC000405305719	424931740	/nfs/dbraw/zinc/93/17/40/424931740.db2.gz	KPTCXOBZYKYURI-QWHCGFSZSA-N	0	3	301.217	2.244	10	0		DEAEHN
Nc1cc(CN2CCC[C@@H](C(=O)N3CCCCCC3)C2)ccn1	ZINC000373899118	424888588	/nfs/dbraw/zinc/88/85/88/424888588.db2.gz	UJXXXWMTTCDJLO-MRXNPFEDSA-N	0	3	316.449	2.278	10	0		DEAEHN
COc1ccc(O[C@@H](C)C(=O)NC2CCN(C3CC3)CC2)cc1	ZINC000029094699	267363683	/nfs/dbraw/zinc/36/36/83/267363683.db2.gz	FPMDWIHGMKTYNY-ZDUSSCGKSA-N	0	3	318.417	2.206	10	0		DEAEHN
CN(C(=O)COc1ccccc1Cl)[C@H](CN)C(F)(F)F	ZINC000662976712	425770268	/nfs/dbraw/zinc/77/02/68/425770268.db2.gz	PTHLMJBVKNGCQL-SNVBAGLBSA-N	0	3	310.703	2.067	10	0		DEAEHN
Cc1nc2c(cnn2C(C)C)cc1C(=O)NC[C@@H]1CCCN1C	ZINC000194714520	268555894	/nfs/dbraw/zinc/55/58/94/268555894.db2.gz	CTNJJBPJQPHDJE-AWEZNQCLSA-N	0	3	315.421	2.145	10	0		DEAEHN
CC[C@@H]1C[C@H]1C(=O)NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000397610834	269106868	/nfs/dbraw/zinc/10/68/68/269106868.db2.gz	ZMSQRMLZRKPTSL-IAGOWNOFSA-N	0	3	316.445	2.176	10	0		DEAEHN
C[C@H]1CN(C)CCN1C[C@@H](O)Cc1ccccc1C(F)(F)F	ZINC000443411973	269137249	/nfs/dbraw/zinc/13/72/49/269137249.db2.gz	HLFIVJDXOJNCCF-JSGCOSHPSA-N	0	3	316.367	2.245	10	0		DEAEHN
c1cc(CNCCOC[C@H]2CCCO2)n(-c2ccccc2)n1	ZINC000516390055	269362550	/nfs/dbraw/zinc/36/25/50/269362550.db2.gz	STVSHEUGWSDQHH-QGZVFWFLSA-N	0	3	301.390	2.158	10	0		DEAEHN
Cn1ncc2c1ncnc2NCCN1CC=C(C(C)(C)C)CC1	ZINC000516601974	269365097	/nfs/dbraw/zinc/36/50/97/269365097.db2.gz	SZXOJDFHNSHYNT-UHFFFAOYSA-N	0	3	314.437	2.453	10	0		DEAEHN
O=C(NCCc1cnccn1)c1cccc(CN2CCCC2)c1	ZINC000525942101	269496214	/nfs/dbraw/zinc/49/62/14/269496214.db2.gz	LTYNYUOEPVQIRM-UHFFFAOYSA-N	0	3	310.401	2.045	10	0		DEAEHN
CC(=O)N[C@@H](C)C1CCN(Cc2cccc3c2NCC3)CC1	ZINC000262038182	273492763	/nfs/dbraw/zinc/49/27/63/273492763.db2.gz	XXYDDVDAQCAWIS-ZDUSSCGKSA-N	0	3	301.434	2.391	10	0		DEAEHN
C[C@@H](CS(C)(=O)=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000182677484	274229250	/nfs/dbraw/zinc/22/92/50/274229250.db2.gz	UPDPIUOCTNXYBZ-DOTOQJQBSA-N	0	3	324.490	2.064	10	0		DEAEHN
O=C1NCCC[C@@H]1N[C@@H]1CCc2c1cccc2Br	ZINC000221798959	275022945	/nfs/dbraw/zinc/02/29/45/275022945.db2.gz	JPXMLTJMHFNHMK-OLZOCXBDSA-N	0	3	309.207	2.305	10	0		DEAEHN
CC1(C)OCc2cc(CN[C@@H]3CCc4ncnn4C3)ccc2O1	ZINC000187295737	275882655	/nfs/dbraw/zinc/88/26/55/275882655.db2.gz	TYBPDYHFPOKDCI-CQSZACIVSA-N	0	3	314.389	2.028	10	0		DEAEHN
CN(C)Cc1c[nH]c2nccc(I)c12	ZINC000095937253	276810036	/nfs/dbraw/zinc/81/00/36/276810036.db2.gz	VNCCFBZINVHERW-UHFFFAOYSA-N	0	3	301.131	2.229	10	0		DEAEHN
CN1CC[C@H](NC(=O)[C@H]2CCCc3n[nH]cc32)[C@@H]1c1ccccc1	ZINC000248045305	277168548	/nfs/dbraw/zinc/16/85/48/277168548.db2.gz	MVDGVHWKKSTESJ-WBAXXEDZSA-N	0	3	324.428	2.391	10	0		DEAEHN
CC(C)(CNC(=O)N1CCN2CCCC[C@@H]2C1)N1CCCCC1	ZINC000105081525	277300545	/nfs/dbraw/zinc/30/05/45/277300545.db2.gz	XRMNWEAPYVEAOK-MRXNPFEDSA-N	0	3	322.497	2.131	10	0		DEAEHN
C[C@H]1CC(C)(C)CC[C@@H]1NC(=O)NCCNc1ccncc1	ZINC000361915048	278323875	/nfs/dbraw/zinc/32/38/75/278323875.db2.gz	GZVZVUZOZDAWOM-ZFWWWQNUSA-N	0	3	304.438	2.429	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H](C)c1ccc2c(c1)CCC(=O)N2)N(C)C	ZINC000178657112	278856558	/nfs/dbraw/zinc/85/65/58/278856558.db2.gz	XIZUAXIDAKXSIX-WBMJQRKESA-N	0	3	317.433	2.479	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CC[C@@H]2OCCC[C@@H]2C1	ZINC000151274625	279125150	/nfs/dbraw/zinc/12/51/50/279125150.db2.gz	AGKHKUVDLRWLGU-OAGGEKHMSA-N	0	3	311.470	2.173	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ncccc1C(F)(F)F	ZINC000245628208	288313141	/nfs/dbraw/zinc/31/31/41/288313141.db2.gz	UIMRMDIAFKPLPS-MNOVXSKESA-N	0	3	313.323	2.409	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)N1CCc2ccccc2C1	ZINC000261649076	281461264	/nfs/dbraw/zinc/46/12/64/281461264.db2.gz	FOKYJRXTZMWYGT-GPMSIDNRSA-N	0	3	314.429	2.104	10	0		DEAEHN
Cc1ccc([C@H]2OCCC[C@H]2C(=O)N2CCCNCC2)cc1	ZINC000262484159	301842567	/nfs/dbraw/zinc/84/25/67/301842567.db2.gz	WGIJBHIWRUQAID-IAGOWNOFSA-N	0	3	302.418	2.285	10	0		DEAEHN
CN1CCN(CCCCNC(=O)[C@@H]2CCCCC2(C)C)CC1	ZINC000576799938	326319556	/nfs/dbraw/zinc/31/95/56/326319556.db2.gz	XINVFMPMEHTSSD-INIZCTEOSA-N	0	3	309.498	2.347	10	0		DEAEHN
COc1cc2c(cc1OC)[C@H](CC(=O)NCCC(C)C)NCC2	ZINC000584620027	337371719	/nfs/dbraw/zinc/37/17/19/337371719.db2.gz	VZWVYKMKFVQOTR-HNNXBMFYSA-N	0	3	320.433	2.443	10	0		DEAEHN
CCOC(=O)CCN[C@H](CCc1ccccc1)CC(=O)OCC	ZINC000584595890	337374132	/nfs/dbraw/zinc/37/41/32/337374132.db2.gz	IMZDPGDSIVIBAO-MRXNPFEDSA-N	0	3	321.417	2.484	10	0		DEAEHN
Cc1cc2cc([O-])c(-c3ccc(N4CC[NH2+]CC4)nn3)cc2cn1	ZINC000584639749	337379870	/nfs/dbraw/zinc/37/98/70/337379870.db2.gz	IZQLWNLOMDVYNM-UHFFFAOYSA-N	0	3	321.384	2.115	10	0		DEAEHN
Cc1cc(Cl)ccc1OCC(=O)N1CCN2CCC[C@@H]2C1	ZINC000195315646	533788358	/nfs/dbraw/zinc/78/83/58/533788358.db2.gz	GOYCWLMRHPDELB-CQSZACIVSA-N	0	3	308.809	2.334	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CC[C@@H](CNc2ccccn2)C1	ZINC000130552110	518830929	/nfs/dbraw/zinc/83/09/29/518830929.db2.gz	FKTOVUZRPDWYNV-AWEZNQCLSA-N	0	3	320.437	2.340	10	0		DEAEHN
CC(=O)CCN(C)C(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000372324274	519413864	/nfs/dbraw/zinc/41/38/64/519413864.db2.gz	JFFWFWORQUOEGT-QGZVFWFLSA-N	0	3	302.418	2.336	10	0		DEAEHN
c1[nH]c(CNCCCCN2CCOCC2)nc1-c1ccccc1	ZINC000194240528	534460989	/nfs/dbraw/zinc/46/09/89/534460989.db2.gz	ORYXGLAWUMKORN-UHFFFAOYSA-N	0	3	314.433	2.279	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N[C@H]2CCCN(CC)C2)C12CCC2	ZINC000246336279	520417671	/nfs/dbraw/zinc/41/76/71/520417671.db2.gz	OQVFNNCIKYPKNP-SOUVJXGZSA-N	0	3	309.454	2.118	10	0		DEAEHN
CCN(Cc1ccccn1)C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000132416893	521390906	/nfs/dbraw/zinc/39/09/06/521390906.db2.gz	ABFQFQUMBHISDN-GOEBONIOSA-N	0	3	304.438	2.342	10	0		DEAEHN
CCCn1nc(C)c(CN2CCC[C@@H](Cn3cncn3)C2)c1C	ZINC000128541003	521668422	/nfs/dbraw/zinc/66/84/22/521668422.db2.gz	LDGRFSKYRILDQV-MRXNPFEDSA-N	0	3	316.453	2.414	10	0		DEAEHN
CCCN(C[C@@H]1CCCCO1)C(=O)N[C@H]1CCCN(CC)C1	ZINC000106541554	521675742	/nfs/dbraw/zinc/67/57/42/521675742.db2.gz	DQCAGTNJVCIEPF-HOTGVXAUSA-N	0	3	311.470	2.461	10	0		DEAEHN
CCc1cccc(OCCN2CCN(C[C@@H](C)O)[C@H](CC)C2)c1	ZINC000105826300	521779544	/nfs/dbraw/zinc/77/95/44/521779544.db2.gz	SGUNKCIWXCFYLF-SJLPKXTDSA-N	0	3	320.477	2.405	10	0		DEAEHN
COC[C@H](C)C(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000163359619	522550611	/nfs/dbraw/zinc/55/06/11/522550611.db2.gz	RMSRAGYHVRZXAT-YJBOKZPZSA-N	0	3	304.434	2.440	10	0		DEAEHN
COCCN1CCN(CCCOc2ccc(OC)cc2)C[C@@H]1C	ZINC000105832590	523854384	/nfs/dbraw/zinc/85/43/84/523854384.db2.gz	OSPDNGPKBRFHDX-INIZCTEOSA-N	0	3	322.449	2.117	10	0		DEAEHN
C[C@H]1CCCN(CCNC(=O)N2CCC(c3cc[nH]n3)CC2)C1	ZINC000156335941	524089851	/nfs/dbraw/zinc/08/98/51/524089851.db2.gz	QZVFKTMGQRIBTG-AWEZNQCLSA-N	0	3	319.453	2.031	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000450661157	534789298	/nfs/dbraw/zinc/78/92/98/534789298.db2.gz	DEXSLPOAAOAXPV-GTNSWQLSSA-N	0	3	304.390	2.026	10	0		DEAEHN
Cc1cn[nH]c1CN1CCC[C@@H](C(=O)Nc2ncccc2C)C1	ZINC000365671037	526025674	/nfs/dbraw/zinc/02/56/74/526025674.db2.gz	XUDSDBGLCRNTHL-CQSZACIVSA-N	0	3	313.405	2.272	10	0		DEAEHN
COCCCN(C)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000248733734	536493348	/nfs/dbraw/zinc/49/33/48/536493348.db2.gz	DLFQDNJOBSXJRG-DOTOQJQBSA-N	0	3	319.449	2.185	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)N2C[C@H]3CCCN3C[C@H]2C)s1	ZINC000246493569	536503588	/nfs/dbraw/zinc/50/35/88/536503588.db2.gz	RJCJQXJTPRFDHE-RAIGVLPGSA-N	0	3	323.462	2.468	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@@H](C)C(=O)NC1CCCCC1	ZINC000154579401	527442053	/nfs/dbraw/zinc/44/20/53/527442053.db2.gz	NCRLMXZQAWQAQO-YOEHRIQHSA-N	0	3	318.465	2.493	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@H](C)NC(=O)C[C@@H](N)c1ccccc1	ZINC000119274872	527644108	/nfs/dbraw/zinc/64/41/08/527644108.db2.gz	CSQILHOZAOSYBT-YVEFUNNKSA-N	0	3	314.433	2.174	10	0		DEAEHN
CCC[C@H]1CN(C[C@H](O)C2CCCCC2)CCN1CCOC	ZINC000191028818	535742906	/nfs/dbraw/zinc/74/29/06/535742906.db2.gz	KHWBFZCBKJGSNT-ROUUACIJSA-N	0	3	312.498	2.360	10	0		DEAEHN
COCCC1(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CC1	ZINC000248145082	536850048	/nfs/dbraw/zinc/85/00/48/536850048.db2.gz	ZKYSDXMRLJYCGK-HZPDHXFCSA-N	0	3	302.418	2.365	10	0		DEAEHN
CN1CCN(S(=O)(=O)/C=C\c2ccccc2)c2cnccc21	ZINC000255050503	623150263	/nfs/dbraw/zinc/15/02/63/623150263.db2.gz	AZEYQCDLWUVODK-WQLSENKSSA-N	0	3	315.398	2.339	10	0		DEAEHN
COCC[C@H](N)C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000052792492	625103325	/nfs/dbraw/zinc/10/33/25/625103325.db2.gz	NYTNZRUVJSKOOH-SKDRFNHKSA-N	0	3	304.312	2.246	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN[C@H](CCO)c1cccs1	ZINC000740899635	637915783	/nfs/dbraw/zinc/91/57/83/637915783.db2.gz	BLQXCBZLMCWANO-LLVKDONJSA-N	0	3	300.424	2.286	10	0		DEAEHN
COC(=O)/C(C)=C/CNC1(c2ccc(OC)cc2)CCOCC1	ZINC000748817955	638595582	/nfs/dbraw/zinc/59/55/82/638595582.db2.gz	PZTBAQVFEUYBGD-RIYZIHGNSA-N	0	3	319.401	2.410	10	0		DEAEHN
COC(=O)c1ccc2c(cnn2CN2CCC[C@@H]2C[C@@H](C)O)c1	ZINC000752803321	639221811	/nfs/dbraw/zinc/22/18/11/639221811.db2.gz	IMSYUEJFKFMBHF-IUODEOHRSA-N	0	3	317.389	2.016	10	0		DEAEHN
CN(C)Cc1ccccc1NC(=O)[C@H]1CCCC12OCCO2	ZINC000806441207	645830886	/nfs/dbraw/zinc/83/08/86/645830886.db2.gz	MERMEBMOXNDTHP-CQSZACIVSA-N	0	3	304.390	2.230	10	0		DEAEHN
CC(C)(C)OC(=O)N(C[C@H]1CCCO1)c1ccc(CN)nc1	ZINC000757134215	645929219	/nfs/dbraw/zinc/92/92/19/645929219.db2.gz	LUEBGWWXPZTKJW-CQSZACIVSA-N	0	3	307.394	2.461	10	0		DEAEHN
CC[C@@H]1CCCC[C@@H]1OCC(=O)C(C#N)C(=O)N1CCCC1	ZINC000184280917	649252984	/nfs/dbraw/zinc/25/29/84/649252984.db2.gz	MHCFZXPEEXUQLV-FMKPAKJESA-N	0	3	306.406	2.303	10	0		DEAEHN
COc1cc(Cl)cc(C[N@@H+]2C[C@H](C(N)=O)CC[C@@H]2C)c1[O-]	ZINC000184680396	649344642	/nfs/dbraw/zinc/34/46/42/649344642.db2.gz	QLPIIUXKAMHEER-VHSXEESVSA-N	0	3	312.797	2.140	10	0		DEAEHN
COc1cc(Cl)cc(C[N@H+]2C[C@H](C(N)=O)CC[C@@H]2C)c1[O-]	ZINC000184680396	649344644	/nfs/dbraw/zinc/34/46/44/649344644.db2.gz	QLPIIUXKAMHEER-VHSXEESVSA-N	0	3	312.797	2.140	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1ccc(C)nc1Cl	ZINC000185471984	649530032	/nfs/dbraw/zinc/53/00/32/649530032.db2.gz	QDVKHCQORTWSGW-LLVKDONJSA-N	0	3	319.858	2.052	10	0		DEAEHN
C[C@](CO)(NC[C@@H]1CCCO1)c1cccc(Br)c1	ZINC000038114500	683887047	/nfs/dbraw/zinc/88/70/47/683887047.db2.gz	YIQPNODIINXMMA-UONOGXRCSA-N	0	3	314.223	2.425	10	0		DEAEHN
CCc1nn(C)cc1CN[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000381596686	685401010	/nfs/dbraw/zinc/40/10/10/685401010.db2.gz	KGEHXNYHRCNYQD-VXGBXAGGSA-N	0	3	310.442	2.374	10	0		DEAEHN
CCCCCCNC(=O)[C@H]1CCCN(C[C@H](O)C(F)(F)F)C1	ZINC000121133301	684105528	/nfs/dbraw/zinc/10/55/28/684105528.db2.gz	SBSPHRSZBLHPOV-STQMWFEESA-N	0	3	324.387	2.318	10	0		DEAEHN
CCOC(CN[C@H](C)c1ccc(-n2ccnn2)cc1)OCC	ZINC000125536098	684146345	/nfs/dbraw/zinc/14/63/45/684146345.db2.gz	CUPKKXIYHZSXBD-CYBMUJFWSA-N	0	3	304.394	2.317	10	0		DEAEHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@@H]1CCCO[C@H]1C	ZINC000192197978	684444032	/nfs/dbraw/zinc/44/40/32/684444032.db2.gz	JTIFEBOVROEBMC-YNEHKIRRSA-N	0	3	316.357	2.158	10	0		DEAEHN
CO[C@@]1(C)CCCN(C[C@@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724110697	777243051	/nfs/dbraw/zinc/24/30/51/777243051.db2.gz	ISVMYDBXWSGPSO-VHSXEESVSA-N	0	3	305.287	2.436	10	0		DEAEHN
C[C@H]1CC(CNCc2cn(C)nc2Br)C[C@H](C)O1	ZINC000724264455	777269087	/nfs/dbraw/zinc/26/90/87/777269087.db2.gz	JSPUOIVUZNBPQE-UWVGGRQHSA-N	0	3	316.243	2.476	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@@H]1CN[C@H]1CCCc2n[nH]cc21	ZINC000724915362	777519997	/nfs/dbraw/zinc/51/99/97/777519997.db2.gz	SUSCHUFEVRNYKP-YPMHNXCESA-N	0	3	306.410	2.386	10	0		DEAEHN
OCCN(Cc1ccccc1)C[C@@H]1CC2(CO1)CCOCC2	ZINC000712695314	792203121	/nfs/dbraw/zinc/20/31/21/792203121.db2.gz	OQYDKBYOJCXVIW-KRWDZBQOSA-N	0	3	305.418	2.067	10	0		DEAEHN
CC[C@@H](C)N1CCN(Cc2cn(C)nc2Br)CC1	ZINC000713826763	792261237	/nfs/dbraw/zinc/26/12/37/792261237.db2.gz	RBEBTOUXTNPREA-LLVKDONJSA-N	0	3	315.259	2.099	10	0		DEAEHN
CC(C)(C)OC(=O)NC1CC(CN[C@@H]2CCn3ccnc32)C1	ZINC000715086482	792380970	/nfs/dbraw/zinc/38/09/70/792380970.db2.gz	VKKUFHXXLZDKPE-WXRRBKDZSA-N	0	3	306.410	2.221	10	0		DEAEHN
C[C@H](CNCc1nc(Br)c[nH]1)CC1(C)OCCO1	ZINC000715997677	792560366	/nfs/dbraw/zinc/56/03/66/792560366.db2.gz	KJKVUNXIIDMJHN-VIFPVBQESA-N	0	3	318.215	2.051	10	0		DEAEHN
Cc1cc(CN[C@@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)n(C)n1	ZINC000401810911	801852174	/nfs/dbraw/zinc/85/21/74/801852174.db2.gz	UEYUAYUIBXVSSQ-GXTWGEPZSA-N	0	3	322.453	2.464	10	0		DEAEHN
C/C=C/C(=O)N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC000404242468	802013232	/nfs/dbraw/zinc/01/32/32/802013232.db2.gz	XZYSINQTXSNGRG-IZYLRLOCSA-N	0	3	300.402	2.064	10	0		DEAEHN
CCNc1ncc(C(=O)N[C@H]2CCCN(CC)C2)cc1Cl	ZINC000050777725	1078477787	/nfs/dbraw/zinc/47/77/87/1078477787.db2.gz	GYBOCRAXSLTQFP-LBPRGKRZSA-N	0	3	310.829	2.381	10	0		DEAEHN
COC1(OC)CC[C@@H]1N[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000710956733	1086691070	/nfs/dbraw/zinc/69/10/70/1086691070.db2.gz	CRMNFEOCFQDTLN-SRVKXCTJSA-N	0	3	302.415	2.029	10	0		DEAEHN
CC[C@@H](NCc1cn(C)nc1Br)[C@H]1CCOC1	ZINC000720644358	1085807694	/nfs/dbraw/zinc/80/76/94/1085807694.db2.gz	AHIJUOMQESSRFH-GXSJLCMTSA-N	0	3	302.216	2.087	10	0		DEAEHN
CN(C)C[C@H](N)C(=O)N(Cc1ccccc1)Cc1ccccc1	ZINC000702412144	1086432236	/nfs/dbraw/zinc/43/22/36/1086432236.db2.gz	ANRJJJNAMYWUSO-SFHVURJKSA-N	0	3	311.429	2.104	10	0		DEAEHN
CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@]2(NCc2cncnc2)C1	ZINC000711384712	1087083661	/nfs/dbraw/zinc/08/36/61/1087083661.db2.gz	NMLIDVBBDQTUQO-YOEHRIQHSA-N	0	3	318.421	2.356	10	0		DEAEHN
Cc1ccc(CN[C@]2(CO)CCOC2)c(C)c1Br	ZINC000719552306	1089289405	/nfs/dbraw/zinc/28/94/05/1089289405.db2.gz	DPROLHBVCDIDLB-AWEZNQCLSA-N	0	3	314.223	2.307	10	0		DEAEHN
C[C@@H](NC[C@](C)(O)C(F)(F)C(F)(F)F)c1cnn(C)c1	ZINC000724024387	1143896325	/nfs/dbraw/zinc/89/63/25/1143896325.db2.gz	PYIHBYINKRSOMZ-APPZFPTMSA-N	0	3	301.259	2.019	10	0		DEAEHN
CCc1ccc([C@H](CSCCS(C)(=O)=O)NC)cc1	ZINC000081769004	192323142	/nfs/dbraw/zinc/32/31/42/192323142.db2.gz	VXZXDIJQOPYJIG-AWEZNQCLSA-N	0	3	301.477	2.287	10	0		DEAEHN
Nc1ccnc(C(=O)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000076894799	185050419	/nfs/dbraw/zinc/05/04/19/185050419.db2.gz	AOPAEXQOJQSLAP-UHFFFAOYSA-N	0	3	310.401	2.058	10	0		DEAEHN
Cc1ccc(OC[C@H](O)CN(C)CCC(=O)OC(C)(C)C)cc1	ZINC000150871232	282107138	/nfs/dbraw/zinc/10/71/38/282107138.db2.gz	SFCVEYIPTNBHGP-OAHLLOKOSA-N	0	3	323.433	2.398	10	0		DEAEHN
CCN[C@@H]1c2ccccc2C[C@H]1Sc1nnnn1C1CC1	ZINC000081867478	192333484	/nfs/dbraw/zinc/33/34/84/192333484.db2.gz	LTVWNGOHKDGIMG-ZIAGYGMSSA-N	0	3	301.419	2.376	10	0		DEAEHN
COC(=O)C[C@@H](NC(=O)CC1CCN(C)CC1)c1cccs1	ZINC000612423276	361822228	/nfs/dbraw/zinc/82/22/28/361822228.db2.gz	AQZHRPMZYSJPFP-CYBMUJFWSA-N	0	3	324.446	2.200	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCCc3sccc32)CCO1	ZINC000136621837	282124049	/nfs/dbraw/zinc/12/40/49/282124049.db2.gz	HBUFQKFJUOQOCD-TZMCWYRMSA-N	0	3	323.462	2.098	10	0		DEAEHN
CC(C)N(CCN(C)C)C(=O)CCc1ccc2c(c1)OCCO2	ZINC000151928553	282130238	/nfs/dbraw/zinc/13/02/38/282130238.db2.gz	ORKRLSFSBONZFL-UHFFFAOYSA-N	0	3	320.433	2.189	10	0		DEAEHN
CN[C@H](C)[C@@H](C)S(=O)(=O)c1ccc(Br)cc1	ZINC000081933454	192341627	/nfs/dbraw/zinc/34/16/27/192341627.db2.gz	QMWDEENYHGCFGF-RKDXNWHRSA-N	0	3	306.225	2.219	10	0		DEAEHN
CC[C@H](CS(=O)(=O)c1ccccc1Br)NC	ZINC000081932034	192341984	/nfs/dbraw/zinc/34/19/84/192341984.db2.gz	BUDQRBFWGVTNBU-SECBINFHSA-N	0	3	306.225	2.221	10	0		DEAEHN
NC(=O)[C@@](CSc1ncccc1Cl)(NC1CC1)C1CC1	ZINC000079448605	185172338	/nfs/dbraw/zinc/17/23/38/185172338.db2.gz	FFTJBWHKFZIBKY-AWEZNQCLSA-N	0	3	311.838	2.213	10	0		DEAEHN
COc1cccc(Cl)c1CC(=O)NC[C@H]1CCCN(C)C1	ZINC000153499892	282172068	/nfs/dbraw/zinc/17/20/68/282172068.db2.gz	WNSQUKKOEGNXNF-GFCCVEGCSA-N	0	3	310.825	2.349	10	0		DEAEHN
CN[C@@H](c1ccc(Br)s1)[C@@H]1CCS(=O)(=O)C1	ZINC000082998700	185210759	/nfs/dbraw/zinc/21/07/59/185210759.db2.gz	UUDBVQDGSACLHK-GMSGAONNSA-N	0	3	324.265	2.206	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)N[C@@H]2CCCC[C@@H]2n2cccn2)C1	ZINC000072525953	282183970	/nfs/dbraw/zinc/18/39/70/282183970.db2.gz	VPJGTZBWWXDDIC-OAGGEKHMSA-N	0	3	319.453	2.102	10	0		DEAEHN
NC[C@H](NC[C@H]1CCCO1)c1cc(Br)ccc1F	ZINC000087928557	185237664	/nfs/dbraw/zinc/23/76/64/185237664.db2.gz	UVPYHUGRURNESN-MFKMUULPSA-N	0	3	317.202	2.357	10	0		DEAEHN
CN(C(=O)c1ccc2nc(N)sc2c1)[C@@H]1CCCN(C)C1	ZINC000087847631	185233257	/nfs/dbraw/zinc/23/32/57/185233257.db2.gz	PIBBJUULWZKQDL-LLVKDONJSA-N	0	3	304.419	2.045	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)s1)N1CCCNC(=O)C1	ZINC000087883138	185234406	/nfs/dbraw/zinc/23/44/06/185234406.db2.gz	XJHNHKNRUCPDPZ-ZANVPECISA-N	0	3	301.843	2.002	10	0		DEAEHN
CN1CCCC[C@@H]1COc1ncc(Br)cc1CO	ZINC000088165950	185240959	/nfs/dbraw/zinc/24/09/59/185240959.db2.gz	BVAHNZSMEGRGIB-GFCCVEGCSA-N	0	3	315.211	2.200	10	0		DEAEHN
CN[C@@H]1CCN(c2c3nsnc3c(Cl)cc2Cl)C1=O	ZINC000088120661	185240009	/nfs/dbraw/zinc/24/00/09/185240009.db2.gz	YHYQWJQQHLRPTK-SSDOTTSWSA-N	0	3	317.201	2.323	10	0		DEAEHN
C[NH2+][C@@](C)(CCCCN1CCC[C@H](C(F)(F)F)C1)C(=O)[O-]	ZINC000088435389	185250468	/nfs/dbraw/zinc/25/04/68/185250468.db2.gz	NGCZHSXXQGPRKT-AAEUAGOBSA-N	0	3	310.360	2.494	10	0		DEAEHN
CCCN[C@H]1CCOC[C@@H]1S(=O)(=O)Cc1ccccc1C	ZINC000081984807	192349024	/nfs/dbraw/zinc/34/90/24/192349024.db2.gz	ADBNXIQZGXONDS-HOTGVXAUSA-N	0	3	311.447	2.067	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2sc3ccc(F)cc3c2N)C1	ZINC000088643364	185261321	/nfs/dbraw/zinc/26/13/21/185261321.db2.gz	IEIWVRKVLOVGMI-SNVBAGLBSA-N	0	3	307.394	2.399	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@H]1S(=O)(=O)Cc1cccc(C)c1	ZINC000081984210	192349325	/nfs/dbraw/zinc/34/93/25/192349325.db2.gz	KQIAAIGUNMCLRT-HZPDHXFCSA-N	0	3	311.447	2.067	10	0		DEAEHN
CC[C@H](N)[C@@H](C)S(=O)(=O)c1cccc(Br)c1	ZINC000081982630	192349456	/nfs/dbraw/zinc/34/94/56/192349456.db2.gz	HVJBLQIAEUEZQY-KCJUWKMLSA-N	0	3	306.225	2.349	10	0		DEAEHN
C[C@@H](N[C@H]1CCCS(=O)(=O)C1)c1ccccc1-n1cccn1	ZINC000090016379	185278425	/nfs/dbraw/zinc/27/84/25/185278425.db2.gz	MHVQAAQSVPAWPQ-KGLIPLIRSA-N	0	3	319.430	2.100	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)Nc1ccccc1SC(F)F	ZINC000090431541	185295791	/nfs/dbraw/zinc/29/57/91/185295791.db2.gz	WDXFWDIPHDYRFZ-WPRPVWTQSA-N	0	3	302.346	2.174	10	0		DEAEHN
CN[C@@H]1COC[C@H]1C(=O)Nc1ccc(F)c(C(F)(F)F)c1	ZINC000090436283	185296169	/nfs/dbraw/zinc/29/61/69/185296169.db2.gz	OKJBJMYJHIBZES-LDYMZIIASA-N	0	3	306.259	2.017	10	0		DEAEHN
CN[C@H]1COC[C@H]1C(=O)Nc1ccc(SC(F)(F)F)cc1	ZINC000090433443	185296264	/nfs/dbraw/zinc/29/62/64/185296264.db2.gz	OELSYOSZDXZJAE-MNOVXSKESA-N	0	3	320.336	2.471	10	0		DEAEHN
CN[C@H]1COC[C@@H]1C(=O)N(C)Cc1ccc(Cl)cc1Cl	ZINC000090434846	185296344	/nfs/dbraw/zinc/29/63/44/185296344.db2.gz	UHKJUOKRHNJBBQ-AAEUAGOBSA-N	0	3	317.216	2.186	10	0		DEAEHN
C[C@@]1(C(=O)NCCc2ccc(Cl)cc2Cl)COC[C@H]1N	ZINC000090581434	185304884	/nfs/dbraw/zinc/30/48/84/185304884.db2.gz	NWVKHHIVDMNWJV-TZMCWYRMSA-N	0	3	317.216	2.016	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N[C@H]1CCCS(=O)(=O)C1)CCC2	ZINC000092384058	185315324	/nfs/dbraw/zinc/31/53/24/185315324.db2.gz	ZBYPNIFRJWBIJJ-XJKSGUPXSA-N	0	3	309.431	2.239	10	0		DEAEHN
Cc1nn(-c2ccccc2)cc1CN1C[C@@H](C(N)=O)CC[C@H]1C	ZINC000245538320	282244877	/nfs/dbraw/zinc/24/48/77/282244877.db2.gz	JULHMLITUBKBHF-HIFRSBDPSA-N	0	3	312.417	2.267	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(Br)c[nH]1	ZINC000092632248	185330231	/nfs/dbraw/zinc/33/02/31/185330231.db2.gz	PVHPFJYVKNJBAJ-NSHDSACASA-N	0	3	314.227	2.334	10	0		DEAEHN
COC(=O)CNC(=O)CCN[C@@H](C)c1ccc(CC(C)C)cc1	ZINC000181406762	199292269	/nfs/dbraw/zinc/29/22/69/199292269.db2.gz	TZPHJDHMUUUHIL-AWEZNQCLSA-N	0	3	320.433	2.215	10	0		DEAEHN
CCCNCc1c(C)oc(C)c1S(=O)(=O)NC1(C)CC1	ZINC000168534916	197724659	/nfs/dbraw/zinc/72/46/59/197724659.db2.gz	CUXVTCAAEAWCRD-UHFFFAOYSA-N	0	3	300.424	2.227	10	0		DEAEHN
O=C(CCN1CCC[C@@H](n2cncn2)C1)OCc1ccccc1	ZINC000181453327	199298634	/nfs/dbraw/zinc/29/86/34/199298634.db2.gz	AMHYKXDJSCXOAB-MRXNPFEDSA-N	0	3	314.389	2.049	10	0		DEAEHN
Cc1ccccc1[C@H](C)NCC(=O)N1CCC2(CC1)OCCO2	ZINC000181552042	199316315	/nfs/dbraw/zinc/31/63/15/199316315.db2.gz	ZOLMKVKXNMSTNU-HNNXBMFYSA-N	0	3	318.417	2.011	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@](C)(OC)c2ccccc2F)C1	ZINC000192067355	282337257	/nfs/dbraw/zinc/33/72/57/282337257.db2.gz	RUCKTAKWJJOCGI-CXAGYDPISA-N	0	3	308.397	2.288	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)NC[C@@H](C)N2CCC(C)CC2)n1	ZINC000195067428	282368225	/nfs/dbraw/zinc/36/82/25/282368225.db2.gz	GCJFJPZVFUQASY-HZPDHXFCSA-N	0	3	306.454	2.298	10	0		DEAEHN
Cc1ccc(C(F)(F)F)cc1NC(=O)COC1(C)CNC1	ZINC000098060748	539435965	/nfs/dbraw/zinc/43/59/65/539435965.db2.gz	YRUMWIDMDXJTCS-UHFFFAOYSA-N	0	3	302.296	2.331	10	0		DEAEHN
COC1(CNCc2cc3ccccc3[nH]c2=O)CCOCC1	ZINC000123090118	539464639	/nfs/dbraw/zinc/46/46/39/539464639.db2.gz	BFTSAOJHGCPUAA-UHFFFAOYSA-N	0	3	302.374	2.226	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)N1C[C@@H]2[C@H](C1)C2(C)C	ZINC000246109418	282419881	/nfs/dbraw/zinc/41/98/81/282419881.db2.gz	HRCZDFHUGQVHGV-ZACQAIPSSA-N	0	3	315.461	2.457	10	0		DEAEHN
Cc1ccc(OC[C@@H](O)CN(C)CCc2nccs2)cc1	ZINC000157965057	539575862	/nfs/dbraw/zinc/57/58/62/539575862.db2.gz	CWRLSHABXPNMIS-AWEZNQCLSA-N	0	3	306.431	2.366	10	0		DEAEHN
Cc1nc2n(n1)CCC[C@@H]2N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2	ZINC000182008128	199373876	/nfs/dbraw/zinc/37/38/76/199373876.db2.gz	ZZDWNYZLTYTCLZ-XQLPTFJDSA-N	0	3	302.422	2.359	10	0		DEAEHN
CCN1CCO[C@H](CNCc2cc(Cl)cc3c2OCC3)C1	ZINC000167387571	539610350	/nfs/dbraw/zinc/61/03/50/539610350.db2.gz	IICBFFNEAPNQEI-OAHLLOKOSA-N	0	3	310.825	2.085	10	0		DEAEHN
Cc1ccc(OC[C@@H](O)CN[C@@H](CO)c2ccccc2)cc1	ZINC000170846881	539615420	/nfs/dbraw/zinc/61/54/20/539615420.db2.gz	FVTQKPPOCMRLLC-WMZOPIPTSA-N	0	3	301.386	2.058	10	0		DEAEHN
CCOCCN1CCN(c2cc(CC)nc(C)n2)C[C@H]1CC	ZINC000180434972	539645030	/nfs/dbraw/zinc/64/50/30/539645030.db2.gz	SXDZOGQOONLEJW-MRXNPFEDSA-N	0	3	306.454	2.285	10	0		DEAEHN
CN[C@H](c1cc(Br)sc1C)[C@H]1COCCO1	ZINC000084006525	192395129	/nfs/dbraw/zinc/39/51/29/192395129.db2.gz	MGYPHJPEAQOCON-MWLCHTKSSA-N	0	3	306.225	2.495	10	0		DEAEHN
O=C(c1cccc2ccccc21)[C@H]1CCCN(C(CO)CO)C1	ZINC000071752687	191023423	/nfs/dbraw/zinc/02/34/23/191023423.db2.gz	BYOKXILOCQONRF-HNNXBMFYSA-N	0	3	313.397	2.088	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N2CCC[C@H](C)C2)c1	ZINC000138269376	186015584	/nfs/dbraw/zinc/01/55/84/186015584.db2.gz	NRQICHYNWQMDJF-JTQLQIEISA-N	0	3	318.389	2.105	10	0		DEAEHN
CCS(=O)(=O)CCCOc1cc(OC)ccc1[C@@H](C)NC	ZINC000138494305	186017292	/nfs/dbraw/zinc/01/72/92/186017292.db2.gz	HXYMNJRTNDGPSW-GFCCVEGCSA-N	0	3	315.435	2.179	10	0		DEAEHN
CCCN[C@H](C)c1ccc(OC)cc1OCCS(C)(=O)=O	ZINC000138547225	186017955	/nfs/dbraw/zinc/01/79/55/186017955.db2.gz	SKNAASQMRGMXEN-GFCCVEGCSA-N	0	3	315.435	2.179	10	0		DEAEHN
C[C@@H]1CCC[C@H](CN)N1[C@@H]1CCS(=O)(=O)c2ccccc21	ZINC000147723079	186041556	/nfs/dbraw/zinc/04/15/56/186041556.db2.gz	YQFPXOBVWQURQL-UMVBOHGHSA-N	0	3	308.447	2.107	10	0		DEAEHN
Cc1cnc(NN)nc1OCc1ccccc1Br	ZINC000147824332	186041723	/nfs/dbraw/zinc/04/17/23/186041723.db2.gz	LAVYWIGSMKQJFW-UHFFFAOYSA-N	0	3	309.167	2.412	10	0		DEAEHN
Cc1ccc(S(=O)(=O)NCC(F)F)cc1CNC(C)C	ZINC000148160282	186043326	/nfs/dbraw/zinc/04/33/26/186043326.db2.gz	JMQQOYSKPYJUNN-UHFFFAOYSA-N	0	3	306.378	2.036	10	0		DEAEHN
CN(c1ccccc1CN)S(=O)(=O)CCc1ccccc1	ZINC000149285457	186049020	/nfs/dbraw/zinc/04/90/20/186049020.db2.gz	DVTUUWSRKUHUHW-UHFFFAOYSA-N	0	3	304.415	2.154	10	0		DEAEHN
CNc1cc(N2CC[C@H](N3CCCCC3)C2)nc(SC)n1	ZINC000149963328	186053562	/nfs/dbraw/zinc/05/35/62/186053562.db2.gz	IXJPWNPXQDFTFH-LBPRGKRZSA-N	0	3	307.467	2.305	10	0		DEAEHN
N[C@H](c1cccc(OC(F)(F)F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000150019011	186054116	/nfs/dbraw/zinc/05/41/16/186054116.db2.gz	KMGXRNVLMFTQNZ-GXSJLCMTSA-N	0	3	309.309	2.020	10	0		DEAEHN
CN[C@@H](c1cccc(OC(F)(F)F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000150093480	186054709	/nfs/dbraw/zinc/05/47/09/186054709.db2.gz	GZPINDMAPOUQIS-JQWIXIFHSA-N	0	3	323.336	2.280	10	0		DEAEHN
CCN[C@@H](c1ccc2cccnc2c1)[C@H]1CCS(=O)(=O)C1	ZINC000150124292	186055003	/nfs/dbraw/zinc/05/50/03/186055003.db2.gz	LTWLFHXRGGNUNS-HOCLYGCPSA-N	0	3	304.415	2.320	10	0		DEAEHN
Cc1c(CN)cc(Cl)cc1S(=O)(=O)NC1CC(C)C1	ZINC000163998030	186145484	/nfs/dbraw/zinc/14/54/84/186145484.db2.gz	LTEHPBLYVMILMI-UHFFFAOYSA-N	0	3	302.827	2.184	10	0		DEAEHN
O=C(Nc1ccc(C(F)(F)F)cc1)OC[C@H]1CNCCO1	ZINC000164143692	186150047	/nfs/dbraw/zinc/15/00/47/186150047.db2.gz	PXRREYOVTWNMEE-LLVKDONJSA-N	0	3	304.268	2.242	10	0		DEAEHN
COC[C@H](NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)c1ccc(C)o1	ZINC000175689068	186188560	/nfs/dbraw/zinc/18/85/60/186188560.db2.gz	ADNWDVYYPZBUKN-SNPRPXQTSA-N	0	3	323.437	2.400	10	0		DEAEHN
c1ccc(CN2CCSC[C@H]2CNCc2cncnc2)cc1	ZINC000276957987	539806629	/nfs/dbraw/zinc/80/66/29/539806629.db2.gz	CUKPVIDNHLDKBM-QGZVFWFLSA-N	0	3	314.458	2.184	10	0		DEAEHN
COc1cc(NC(=O)N2CCN3CCC[C@@H]3C2)cc(OC)c1	ZINC000171886147	198001354	/nfs/dbraw/zinc/00/13/54/198001354.db2.gz	ZDUVMKHHQLPHAD-CYBMUJFWSA-N	0	3	305.378	2.016	10	0		DEAEHN
CCOc1cc(NC(=O)N2CCN3CCC[C@@H]3C2)ccc1OC	ZINC000171890357	198001746	/nfs/dbraw/zinc/00/17/46/198001746.db2.gz	SODQBIDQWZDDTM-CQSZACIVSA-N	0	3	319.405	2.406	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)Nc1ccc(C)cc1OC	ZINC000171908399	198006551	/nfs/dbraw/zinc/00/65/51/198006551.db2.gz	GSBDDNZQZUIRPS-CQSZACIVSA-N	0	3	321.421	2.236	10	0		DEAEHN
COCc1csc(NC(=O)C2Oc3ccccc3O[C@@H]2C)n1	ZINC000172152645	198048515	/nfs/dbraw/zinc/04/85/15/198048515.db2.gz	OZCURHAARLSBKI-RNCFNFMXSA-N	0	3	320.370	2.457	10	0		DEAEHN
c1cc(-c2noc(CN3CCN4CCCC[C@@H]4C3)n2)cs1	ZINC000172804841	198152566	/nfs/dbraw/zinc/15/25/66/198152566.db2.gz	XIHNKMGGSAGYQN-CYBMUJFWSA-N	0	3	304.419	2.468	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)c2ccc(C)cc2)[C@H](C)C1	ZINC000173261301	198202355	/nfs/dbraw/zinc/20/23/55/198202355.db2.gz	DQWVQNYQERZOGV-GDBMZVCRSA-N	0	3	310.463	2.346	10	0		DEAEHN
CC[C@@H](O)CN1CCN(CCc2c(F)cccc2Cl)CC1	ZINC000173455414	198216960	/nfs/dbraw/zinc/21/69/60/198216960.db2.gz	ZERSACXEARNLBE-CYBMUJFWSA-N	0	3	314.832	2.410	10	0		DEAEHN
C[C@H](Cc1ccccc1F)NC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000174252974	198311412	/nfs/dbraw/zinc/31/14/12/198311412.db2.gz	YVTUVGBKORIGOL-GDBMZVCRSA-N	0	3	317.408	2.412	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)[C@@H]2CCCCN2Cc2ccccc2)C1	ZINC000174583476	198354734	/nfs/dbraw/zinc/35/47/34/198354734.db2.gz	FCKXKICYNHJOEE-MSOLQXFVSA-N	0	3	315.461	2.204	10	0		DEAEHN
C[C@@H](CC(=O)N1CC[C@H](N(C)C)C1)C(=O)c1cccc(F)c1	ZINC000174584702	198355549	/nfs/dbraw/zinc/35/55/49/198355549.db2.gz	KJNVKYBEKMQTET-WFASDCNBSA-N	0	3	306.381	2.197	10	0		DEAEHN
Cc1cc(=O)[nH]cc1C(=O)NC[C@@H](N)c1ccc(C(C)C)cc1	ZINC000236773675	202002501	/nfs/dbraw/zinc/00/25/01/202002501.db2.gz	IRLQIQGGBUNZHW-MRXNPFEDSA-N	0	3	313.401	2.237	10	0		DEAEHN
Fc1ccc2c(c1)[C@H](N[C@H]1CCc3ncnn3C1)CCCO2	ZINC000180599549	283007624	/nfs/dbraw/zinc/00/76/24/283007624.db2.gz	AEJVPTIWHMSVNC-GXTWGEPZSA-N	0	3	302.353	2.236	10	0		DEAEHN
Cn1cc(CN[C@@H]2CCc3cc(Br)ccc3C2)nn1	ZINC000389830295	540132984	/nfs/dbraw/zinc/13/29/84/540132984.db2.gz	YCSCPQKLRPMYKH-CYBMUJFWSA-N	0	3	321.222	2.225	10	0		DEAEHN
CC1CCN(C(=O)CN[C@@]2(CO)C[C@H](C)CC(C)(C)C2)CC1	ZINC000080903327	355391306	/nfs/dbraw/zinc/39/13/06/355391306.db2.gz	CSUOSHIGYPTWOI-QAPCUYQASA-N	0	3	310.482	2.412	10	0		DEAEHN
Cc1ccc(NC(=O)CN(C)C(=O)CN[C@H](C)C(C)(C)C)cc1	ZINC000114473652	355763693	/nfs/dbraw/zinc/76/36/93/355763693.db2.gz	YOMLKJJPYWUZFQ-CQSZACIVSA-N	0	3	319.449	2.416	10	0		DEAEHN
C[C@@H](CCC(C)(C)C)NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000153841249	355938629	/nfs/dbraw/zinc/93/86/29/355938629.db2.gz	KUVRVJOWHVRCNK-LSDHHAIUSA-N	0	3	313.486	2.347	10	0		DEAEHN
CNC(=O)c1c2ncccc2nc([C@H](C)N)c1-c1ccccn1	ZINC000141589266	355891147	/nfs/dbraw/zinc/89/11/47/355891147.db2.gz	JAOBPUAAGFBZGR-JTQLQIEISA-N	0	3	307.357	2.071	10	0		DEAEHN
O=c1c2cccc(N3CCNCC3)c2ccn1Cc1ccccc1	ZINC000144179449	355901382	/nfs/dbraw/zinc/90/13/82/355901382.db2.gz	OTZZOEOOSHWOPU-UHFFFAOYSA-N	0	3	319.408	2.459	10	0		DEAEHN
CNC(=O)N1CCC([C@@H]2CCN(Cc3ccc(C)cn3)C2)CC1	ZINC000169781611	355982936	/nfs/dbraw/zinc/98/29/36/355982936.db2.gz	DPIMEWQBDBJRDD-MRXNPFEDSA-N	0	3	316.449	2.263	10	0		DEAEHN
CCOCc1ccc(CNC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170829427	355994525	/nfs/dbraw/zinc/99/45/25/355994525.db2.gz	PFNSEBKFDJRRAW-INIZCTEOSA-N	0	3	305.422	2.069	10	0		DEAEHN
C[C@@H](CNC(C)(C)c1ccc(F)c(F)c1)CS(C)(=O)=O	ZINC000180874456	356064744	/nfs/dbraw/zinc/06/47/44/356064744.db2.gz	CTTYMFGBSPBODM-JTQLQIEISA-N	0	3	305.390	2.470	10	0		DEAEHN
CC(C)Oc1cccc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)n1	ZINC000179085936	356013578	/nfs/dbraw/zinc/01/35/78/356013578.db2.gz	XMDKUOKXXWFTHS-ZIAGYGMSSA-N	0	3	303.406	2.178	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@@H](C)N[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000179205821	356017776	/nfs/dbraw/zinc/01/77/76/356017776.db2.gz	SJFLRVFKVQPPKO-MELADBBJSA-N	0	3	315.421	2.221	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)CN[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000182032209	356106209	/nfs/dbraw/zinc/10/62/09/356106209.db2.gz	ICCOIINIWKHVET-ZIAGYGMSSA-N	0	3	315.421	2.079	10	0		DEAEHN
CNCc1ccn(Cc2cc(Br)ccc2OC)n1	ZINC000080093817	192000302	/nfs/dbraw/zinc/00/03/02/192000302.db2.gz	RPOHGDXNYVKHQG-UHFFFAOYSA-N	0	3	310.195	2.422	10	0		DEAEHN
C[C@@H](NCCCn1ccnn1)c1cnn(Cc2ccccc2)c1	ZINC000184266132	356189516	/nfs/dbraw/zinc/18/95/16/356189516.db2.gz	VFWNQMHIMBEMJN-OAHLLOKOSA-N	0	3	310.405	2.264	10	0		DEAEHN
CC[C@@](C)(CO)NCc1cccc(NC(=O)C(F)(F)F)c1	ZINC000080886583	192199861	/nfs/dbraw/zinc/19/98/61/192199861.db2.gz	RDAZRZJIFIIZHF-ZDUSSCGKSA-N	0	3	304.312	2.438	10	0		DEAEHN
CCn1cnnc1CN[C@H](C)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000400469321	283157285	/nfs/dbraw/zinc/15/72/85/283157285.db2.gz	XEVPYIZFGXOIQA-OLZOCXBDSA-N	0	3	323.441	2.033	10	0		DEAEHN
NCc1ccc(C(F)(F)F)nc1I	ZINC000306491840	356403740	/nfs/dbraw/zinc/40/37/40/356403740.db2.gz	NAMFYGKICQMBOX-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
Clc1cccc(N2CCn3cnnc3C2)c1CNC1CC1	ZINC000081537731	192286496	/nfs/dbraw/zinc/28/64/96/192286496.db2.gz	ZWAGYRORQMJBAR-UHFFFAOYSA-N	0	3	303.797	2.204	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)Nc1nc(Cc2ccccc2)ns1	ZINC000236919116	202071632	/nfs/dbraw/zinc/07/16/32/202071632.db2.gz	HRQHXTRBXSEJID-GXFFZTMASA-N	0	3	304.419	2.441	10	0		DEAEHN
CCCCN(CC)S(=O)(=O)c1cc(CNC)n(CCC)c1	ZINC000088916293	192656872	/nfs/dbraw/zinc/65/68/72/192656872.db2.gz	HILGKMGKYXKJKP-UHFFFAOYSA-N	0	3	315.483	2.428	10	0		DEAEHN
CCNCc1ccc(OC)c(S(=O)(=O)N(C)CC(C)C)c1	ZINC000088948188	192664538	/nfs/dbraw/zinc/66/45/38/192664538.db2.gz	CVZHLUCCDQRGFU-UHFFFAOYSA-N	0	3	314.451	2.081	10	0		DEAEHN
COC(=O)c1coc(C(=O)N2CCCC[C@H](N3CCCC3)C2)c1	ZINC000184766719	199762130	/nfs/dbraw/zinc/76/21/30/199762130.db2.gz	DLROCZIIIXTHQV-AWEZNQCLSA-N	0	3	320.389	2.157	10	0		DEAEHN
COc1ccc(-c2nnc(CN3CCN4CCC[C@H]4C3)o2)cc1	ZINC000591923659	357798560	/nfs/dbraw/zinc/79/85/60/357798560.db2.gz	RSFAPYRDEHJULO-AWEZNQCLSA-N	0	3	314.389	2.025	10	0		DEAEHN
CN(C)CCN1CCC(Nc2nc3ccccc3n2C)CC1	ZINC000179282307	199009334	/nfs/dbraw/zinc/00/93/34/199009334.db2.gz	UZQHWQXWQCEKFU-UHFFFAOYSA-N	0	3	301.438	2.011	10	0		DEAEHN
CC(C)n1cc(CN(C)[C@H]2CCCN(c3cccnn3)C2)cn1	ZINC000179496548	199045738	/nfs/dbraw/zinc/04/57/38/199045738.db2.gz	APIPGKKIZDKMMP-INIZCTEOSA-N	0	3	314.437	2.355	10	0		DEAEHN
C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)NCc1ccc(Cl)cn1	ZINC000180828990	199215618	/nfs/dbraw/zinc/21/56/18/199215618.db2.gz	FTQPJPJIODYUCY-FZMZJTMJSA-N	0	3	310.829	2.217	10	0		DEAEHN
CCCC[C@@H](C)NS(=O)(=O)c1ccc(OC)c(CNC)c1	ZINC000089022402	192702286	/nfs/dbraw/zinc/70/22/86/192702286.db2.gz	AJBRSIVGCSYOEP-GFCCVEGCSA-N	0	3	314.451	2.272	10	0		DEAEHN
CNCc1sccc1S(=O)(=O)NCc1ccsc1	ZINC000089035683	192711103	/nfs/dbraw/zinc/71/11/03/192711103.db2.gz	QMZDNUUYXGTZTR-UHFFFAOYSA-N	0	3	302.446	2.008	10	0		DEAEHN
Cc1csc([C@@H](C)CNC(=O)N2CCN3CCC[C@@H]3C2)n1	ZINC000186806337	200014278	/nfs/dbraw/zinc/01/42/78/200014278.db2.gz	QNZJRGLHJUZICK-WCQYABFASA-N	0	3	308.451	2.045	10	0		DEAEHN
CC(C)CNC(=O)c1cccc(CN(C)CC2(CO)CC2)c1	ZINC000186820622	200016876	/nfs/dbraw/zinc/01/68/76/200016876.db2.gz	ZVMQLMBAVFHBHY-UHFFFAOYSA-N	0	3	304.434	2.277	10	0		DEAEHN
Cc1nc([C@@H]2CCCN2C(=O)NC2CCN(C)CC2)cs1	ZINC000187033790	200051111	/nfs/dbraw/zinc/05/11/11/200051111.db2.gz	OCYUNLHCDJOEMN-AWEZNQCLSA-N	0	3	308.451	2.392	10	0		DEAEHN
Cc1ccc([C@@H](CNC(=O)N(C)CC2(CO)CC2)N(C)C)cc1	ZINC000187046744	200052584	/nfs/dbraw/zinc/05/25/84/200052584.db2.gz	MNMMCOLBAFVIQV-MRXNPFEDSA-N	0	3	319.449	2.012	10	0		DEAEHN
CC[C@H](O)CN1CCN(Cc2ccc3nc(C)ccc3c2)CC1	ZINC000187248285	200083251	/nfs/dbraw/zinc/08/32/51/200083251.db2.gz	ZEPUHOXADHBUQF-SFHVURJKSA-N	0	3	313.445	2.432	10	0		DEAEHN
C[C@@H](NCc1ccc(Cl)cn1)C1CCS(=O)(=O)CC1	ZINC000187420778	200110209	/nfs/dbraw/zinc/11/02/09/200110209.db2.gz	JIPUJLPMWMUNAH-SNVBAGLBSA-N	0	3	302.827	2.038	10	0		DEAEHN
Cc1c(-c2cc(CN(C)[C@@]3(CO)CC[C@H](C)C3)on2)cnn1C	ZINC000187958056	200182790	/nfs/dbraw/zinc/18/27/90/200182790.db2.gz	ASBYZQPYSPAALC-SJCJKPOMSA-N	0	3	318.421	2.366	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000187889544	200172062	/nfs/dbraw/zinc/17/20/62/200172062.db2.gz	GAOGQMYHCVZMEZ-IUODEOHRSA-N	0	3	323.412	2.458	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N(C)C[C@@H]1CCCN(C)C1	ZINC000187909571	200174902	/nfs/dbraw/zinc/17/49/02/200174902.db2.gz	GTBFIGODVIGNAC-CYBMUJFWSA-N	0	3	323.412	2.318	10	0		DEAEHN
COCc1cccc(CC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000188226127	200211950	/nfs/dbraw/zinc/21/19/50/200211950.db2.gz	NRRDTXAQYSLPEC-RHSMWYFYSA-N	0	3	304.434	2.317	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)c1C	ZINC000188495755	200256182	/nfs/dbraw/zinc/25/61/82/200256182.db2.gz	DODHYHKVUOBSCZ-WFASDCNBSA-N	0	3	315.417	2.262	10	0		DEAEHN
CCSCC[C@H](C)NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000602457888	360382417	/nfs/dbraw/zinc/38/24/17/360382417.db2.gz	JIRGVGRCMSDVPQ-GOEBONIOSA-N	0	3	323.506	2.094	10	0		DEAEHN
CC[C@H](CN1CCCC1)NC(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000605523407	360976072	/nfs/dbraw/zinc/97/60/72/360976072.db2.gz	UTJMIJUSHFWNLH-QGZVFWFLSA-N	0	3	314.429	2.349	10	0		DEAEHN
CCOCCOCC(=O)N[C@H](CN)c1ccc2ccccc2c1	ZINC000193438869	201051969	/nfs/dbraw/zinc/05/19/69/201051969.db2.gz	NMAOTNYMHWRKCD-QGZVFWFLSA-N	0	3	316.401	2.009	10	0		DEAEHN
COC(=O)C(C)(C)[C@H](NC(=O)CN(C)C(C)C)c1ccccc1	ZINC000610824727	361472719	/nfs/dbraw/zinc/47/27/19/361472719.db2.gz	LDVKFWWOTOWQAC-MRXNPFEDSA-N	0	3	320.433	2.383	10	0		DEAEHN
CC(=O)N1CC[C@@H](NCCc2cncc(C)n2)c2ccccc21	ZINC000621764564	364539520	/nfs/dbraw/zinc/53/95/20/364539520.db2.gz	IIJSOHQCDRAITQ-QGZVFWFLSA-N	0	3	310.401	2.415	10	0		DEAEHN
COc1cc(C)c(NC(=O)C[C@@H]2CSCCN2)cc1OC	ZINC000091135044	193001052	/nfs/dbraw/zinc/00/10/52/193001052.db2.gz	QZMIGWBRAGDMNE-LLVKDONJSA-N	0	3	310.419	2.046	10	0		DEAEHN
CN1CCOC[C@H]1CNCc1cc(F)cc(Br)c1	ZINC000623712740	365141627	/nfs/dbraw/zinc/14/16/27/365141627.db2.gz	KGUVLUQTOAQJLW-CYBMUJFWSA-N	0	3	317.202	2.008	10	0		DEAEHN
CO[C@H]1C[C@@H](CNCc2c(Br)c(C)nn2C)C1	ZINC000623823817	365185887	/nfs/dbraw/zinc/18/58/87/365185887.db2.gz	LQXKRFYJIFAGGN-AOOOYVTPSA-N	0	3	302.216	2.006	10	0		DEAEHN
CSc1nc2ccc(NC(=O)C[C@@H]3CNCCO3)cc2s1	ZINC000091299828	193034464	/nfs/dbraw/zinc/03/44/64/193034464.db2.gz	NJOJHPARIORMJV-SNVBAGLBSA-N	0	3	323.443	2.335	10	0		DEAEHN
C[C@@H](NC[C@@H]1CSCCS1)c1ccc2[nH]c(=O)[nH]c2c1	ZINC000091368922	193047158	/nfs/dbraw/zinc/04/71/58/193047158.db2.gz	GTLHJSBPSZVHNC-MWLCHTKSSA-N	0	3	309.460	2.355	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)c2ccc3nc(N)sc3c2)C1	ZINC000091395545	193051134	/nfs/dbraw/zinc/05/11/34/193051134.db2.gz	DNJKSTRERIARQU-LLVKDONJSA-N	0	3	304.419	2.045	10	0		DEAEHN
CCS(=O)(=O)CCC[C@@H](O)C1(N(C)C)CCC(C)CC1	ZINC000091648628	193085364	/nfs/dbraw/zinc/08/53/64/193085364.db2.gz	JTAVOHWATPJGPL-SHARSMKWSA-N	0	3	305.484	2.073	10	0		DEAEHN
C[C@H](NC[C@@H]1CN(C)CCO1)c1ccc(Br)s1	ZINC000091667431	193088231	/nfs/dbraw/zinc/08/82/31/193088231.db2.gz	FZBXFOIFCQQZPV-VHSXEESVSA-N	0	3	319.268	2.492	10	0		DEAEHN
CN[C@@H](c1ccccc1OC(F)(F)F)[C@H]1CN(C)CCO1	ZINC000091717988	193097149	/nfs/dbraw/zinc/09/71/49/193097149.db2.gz	RSNWCVQPQSJPLX-OLZOCXBDSA-N	0	3	304.312	2.176	10	0		DEAEHN
CC[C@@H]1[NH2+]CC[C@H]1[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000624392497	365407455	/nfs/dbraw/zinc/40/74/55/365407455.db2.gz	SJKAUOYHDGABFO-WDEREUQCSA-N	0	3	323.245	2.412	10	0		DEAEHN
CC(C)C[C@@H](C)NC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000091889027	193122102	/nfs/dbraw/zinc/12/21/02/193122102.db2.gz	OSLUCVNOGMFLAW-SJORKVTESA-N	0	3	324.513	2.233	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccsc2Br)C1	ZINC000449839772	241151967	/nfs/dbraw/zinc/15/19/67/241151967.db2.gz	NLFHSSQGRWITNL-MRVPVSSYSA-N	0	3	303.225	2.287	10	0		DEAEHN
C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)c(CN)c2)C[C@H]1C	ZINC000092113601	193161038	/nfs/dbraw/zinc/16/10/38/193161038.db2.gz	SQDSGFFIWYIDDH-NXEZZACHSA-N	0	3	302.827	2.075	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)c(C)cc1C	ZINC000092113385	193161297	/nfs/dbraw/zinc/16/12/97/193161297.db2.gz	IYMDTPLVFLRMTM-OKILXGFUSA-N	0	3	310.463	2.299	10	0		DEAEHN
C[C@@H]1CCCN1S(=O)(=O)c1ccc(CNC2CC2)cc1F	ZINC000092115740	193162973	/nfs/dbraw/zinc/16/29/73/193162973.db2.gz	VKGGUFVZIKZCMY-LLVKDONJSA-N	0	3	312.410	2.251	10	0		DEAEHN
[NH3+]Cc1ccc(S(=O)(=O)[N-]C2CCCCCC2)c(F)c1	ZINC000092115757	193163429	/nfs/dbraw/zinc/16/34/29/193163429.db2.gz	CYIIZNOGPCHFMY-UHFFFAOYSA-N	0	3	300.399	2.286	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N(C)[C@@H](C)CC)c(F)c1	ZINC000092115628	193163552	/nfs/dbraw/zinc/16/35/52/193163552.db2.gz	LTHAZABOZVQBKM-NSHDSACASA-N	0	3	302.415	2.354	10	0		DEAEHN
C[C@@H]1[C@@H](C)CCCN1S(=O)(=O)c1ccc(CN)cc1F	ZINC000092116052	193164060	/nfs/dbraw/zinc/16/40/60/193164060.db2.gz	NENAIOFYQZCHBW-WDEREUQCSA-N	0	3	300.399	2.094	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N(S(=O)(=O)c2ccc(CN)cc2F)C1	ZINC000092116281	193164348	/nfs/dbraw/zinc/16/43/48/193164348.db2.gz	NKEBNOBKMIXTIR-GHMZBOCLSA-N	0	3	300.399	2.094	10	0		DEAEHN
CC(C)NCc1ccc(S(=O)(=O)N2CC[C@@H](C)C2)c(F)c1	ZINC000092115855	193164514	/nfs/dbraw/zinc/16/45/14/193164514.db2.gz	WVFURVKGCFYGHW-GFCCVEGCSA-N	0	3	314.426	2.354	10	0		DEAEHN
c1c(CNCC2(C3CCC3)CCC2)nnn1C[C@H]1CCOC1	ZINC000631155250	368048998	/nfs/dbraw/zinc/04/89/98/368048998.db2.gz	MJYGOXHUTVJYTA-CQSZACIVSA-N	0	3	304.438	2.375	10	0		DEAEHN
c1cc(CNCCc2cn3c(n2)SCC3)n(CC2CCC2)n1	ZINC000631113895	368023018	/nfs/dbraw/zinc/02/30/18/368023018.db2.gz	SHDXKQUHMCOLNT-UHFFFAOYSA-N	0	3	317.462	2.318	10	0		DEAEHN
CC(C)(O)CN1CCN(C[C@@H]2CSc3ccccc32)CC1	ZINC000092292763	193186361	/nfs/dbraw/zinc/18/63/61/193186361.db2.gz	XTNHOQPGXKEVKE-CQSZACIVSA-N	0	3	306.475	2.264	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000262580099	203338612	/nfs/dbraw/zinc/33/86/12/203338612.db2.gz	QEZNCKQEDGKFAH-HJIKLVIJSA-N	0	3	302.777	2.002	10	0		DEAEHN
CC[C@@H](C)CN(CC)S(=O)(=O)c1cc(CNC)n(CC)c1	ZINC000093265894	193222684	/nfs/dbraw/zinc/22/26/84/193222684.db2.gz	VOBPCHJJJCTNBK-CYBMUJFWSA-N	0	3	315.483	2.284	10	0		DEAEHN
CCC(CC)N(CC(C)C)S(=O)(=O)c1n[nH]c(C)c1CN	ZINC000093326617	193233756	/nfs/dbraw/zinc/23/37/56/193233756.db2.gz	DYOLGTHHIWTIHV-UHFFFAOYSA-N	0	3	316.471	2.012	10	0		DEAEHN
C[C@H](Cc1cccs1)N(C)S(=O)(=O)c1ccccc1CN	ZINC000093294592	193226016	/nfs/dbraw/zinc/22/60/16/193226016.db2.gz	BJKOBZJTQXRHFF-GFCCVEGCSA-N	0	3	324.471	2.459	10	0		DEAEHN
CN[C@H](Cc1ccc(F)c(Br)c1)C(OC)OC	ZINC000093304906	193227135	/nfs/dbraw/zinc/22/71/35/193227135.db2.gz	WTDNWMKIEXKMLH-LLVKDONJSA-N	0	3	306.175	2.338	10	0		DEAEHN
C[C@]1(c2nc3cc(F)c(Br)cc3[nH]2)COC[C@@H]1N	ZINC000093728889	193298370	/nfs/dbraw/zinc/29/83/70/193298370.db2.gz	GXPBDZPXMYQXRM-JQWIXIFHSA-N	0	3	314.158	2.080	10	0		DEAEHN
NC(=O)[C@@]1(N)CCC[C@@H](Sc2ccc(C(F)(F)F)cn2)C1	ZINC000093777632	193304469	/nfs/dbraw/zinc/30/44/69/193304469.db2.gz	XXJHPCPYGRAJQC-BXKDBHETSA-N	0	3	319.352	2.318	10	0		DEAEHN
NC(=O)[C@]1(NC2CC2)CC[C@@H](Sc2ccc(Cl)cn2)C1	ZINC000093854039	193320094	/nfs/dbraw/zinc/32/00/94/193320094.db2.gz	KIAYUTZGLCQHDU-RISCZKNCSA-N	0	3	311.838	2.356	10	0		DEAEHN
CN1CCO[C@@H](CNCc2cc(F)cc(Br)c2)C1	ZINC000093938964	193330741	/nfs/dbraw/zinc/33/07/41/193330741.db2.gz	WQWQTVJNLBBQAV-ZDUSSCGKSA-N	0	3	317.202	2.008	10	0		DEAEHN
N[C@H](Cc1nc2ccccc2s1)[C@H]1CN2CCC[C@@H]2CO1	ZINC000094251531	193355155	/nfs/dbraw/zinc/35/51/55/193355155.db2.gz	SNEWBGROWTUJNA-YRGRVCCFSA-N	0	3	303.431	2.029	10	0		DEAEHN
CCN1CCO[C@H]([C@@H](Cc2nc3ccccc3s2)NC)C1	ZINC000094251585	193355706	/nfs/dbraw/zinc/35/57/06/193355706.db2.gz	UOTUPFVNIXXWCO-KGLIPLIRSA-N	0	3	305.447	2.148	10	0		DEAEHN
CC[C@H]1CN(c2nc(C(F)(F)F)ccc2CN)CCN1C	ZINC000094334302	193360059	/nfs/dbraw/zinc/36/00/59/193360059.db2.gz	VZOPEUBIPDCGRL-NSHDSACASA-N	0	3	302.344	2.090	10	0		DEAEHN
CCC(N)(CC)C(=O)Nc1cc(S(C)(=O)=O)ccc1Cl	ZINC000094243893	193354250	/nfs/dbraw/zinc/35/42/50/193354250.db2.gz	QSBGEBBLXWDRBQ-UHFFFAOYSA-N	0	3	318.826	2.200	10	0		DEAEHN
[NH3+]C1(c2ncc(-c3nc([C@@H]4CSCCS4)no3)[n-]2)CCC1	ZINC000094496073	193373987	/nfs/dbraw/zinc/37/39/87/193373987.db2.gz	OBQHPYOGCWXYRU-VIFPVBQESA-N	0	3	323.447	2.319	10	0		DEAEHN
NC1(c2nc(-c3nc([C@@H]4CSCCS4)no3)c[nH]2)CCC1	ZINC000094496073	193373989	/nfs/dbraw/zinc/37/39/89/193373989.db2.gz	OBQHPYOGCWXYRU-VIFPVBQESA-N	0	3	323.447	2.319	10	0		DEAEHN
CNCc1sccc1S(=O)(=O)NCc1cscc1C	ZINC000094886990	193404759	/nfs/dbraw/zinc/40/47/59/193404759.db2.gz	LBZUXFIUPWRUOQ-UHFFFAOYSA-N	0	3	316.473	2.316	10	0		DEAEHN
CCC1(CC)CCN(S(=O)(=O)c2ccc(CNC)cn2)C1	ZINC000094815049	193399914	/nfs/dbraw/zinc/39/99/14/193399914.db2.gz	QMQDWECHMKEMCD-UHFFFAOYSA-N	0	3	311.451	2.002	10	0		DEAEHN
Cc1c(C(=O)N2C[C@H]3CCCN3C[C@H]2C)[nH]c2c1C(=O)CCC2	ZINC000265023400	204350262	/nfs/dbraw/zinc/35/02/62/204350262.db2.gz	YPSHLOVXMAENAE-DGCLKSJQSA-N	0	3	315.417	2.151	10	0		DEAEHN
CN(C)C(=O)C1CCN(Cc2ccc(-n3cccn3)cc2)CC1	ZINC000016339781	182040937	/nfs/dbraw/zinc/04/09/37/182040937.db2.gz	KTISGRCPKVUEGJ-UHFFFAOYSA-N	0	3	312.417	2.173	10	0		DEAEHN
C[C@@H]1CN([C@@H](CN)c2ccc(Br)s2)CCO1	ZINC000019266429	182112157	/nfs/dbraw/zinc/11/21/57/182112157.db2.gz	HAJWAOYPOPXXLT-BDAKNGLRSA-N	0	3	305.241	2.231	10	0		DEAEHN
Cc1cc(Br)cc(CNC2CC2)c1OCCO	ZINC000160745526	197435256	/nfs/dbraw/zinc/43/52/56/197435256.db2.gz	BISRVMLNGCMURI-UHFFFAOYSA-N	0	3	300.196	2.381	10	0		DEAEHN
COCCOCCOc1c(C)cc(Br)cc1CN	ZINC000160665998	197430097	/nfs/dbraw/zinc/43/00/97/197430097.db2.gz	OHBUPJCOUAFQTH-UHFFFAOYSA-N	0	3	318.211	2.258	10	0		DEAEHN
O=S1(=O)C[C@H](c2ccccc2)[C@H](NCc2ccccc2)C1	ZINC000019794337	182150003	/nfs/dbraw/zinc/15/00/03/182150003.db2.gz	VMIVEXMISUDXGH-IAGOWNOFSA-N	0	3	301.411	2.357	10	0		DEAEHN
COC[C@@H](C)[NH2+]Cc1cc(Br)c([O-])c(OC)c1	ZINC000019904363	182162540	/nfs/dbraw/zinc/16/25/40/182162540.db2.gz	GREDTCPOAAMQQR-MRVPVSSYSA-N	0	3	304.184	2.288	10	0		DEAEHN
O=S(=O)(Nc1ccc(C(F)(F)F)cc1)[C@@H]1CCCNC1	ZINC000021503464	182275707	/nfs/dbraw/zinc/27/57/07/182275707.db2.gz	MRJNJXKJLQJBRW-LLVKDONJSA-N	0	3	308.325	2.199	10	0		DEAEHN
Cc1cccc(N2C(=O)C[C@H](NC3Cc4ccccc4C3)C2=O)c1	ZINC000021344471	182272555	/nfs/dbraw/zinc/27/25/55/182272555.db2.gz	BCHBTQBRHOXZCD-SFHVURJKSA-N	0	3	320.392	2.384	10	0		DEAEHN
C[C@@H](CNC(=O)NCC1CCN(c2ccccc2)CC1)N(C)C	ZINC000454878795	246221421	/nfs/dbraw/zinc/22/14/21/246221421.db2.gz	XHFUQGIOBCJEII-HNNXBMFYSA-N	0	3	318.465	2.152	10	0		DEAEHN
CCc1nc(C(C)(C)NC(=O)C2CN(C3CCCCC3)C2)no1	ZINC000457782870	248009600	/nfs/dbraw/zinc/00/96/00/248009600.db2.gz	WAVFVNIRWLGBNO-UHFFFAOYSA-N	0	3	320.437	2.248	10	0		DEAEHN
Cc1cc(C)c(CN)c(Sc2nnnn2C2CCCC2)n1	ZINC000040509876	183086234	/nfs/dbraw/zinc/08/62/34/183086234.db2.gz	DHKKCNZBWJVUHJ-UHFFFAOYSA-N	0	3	304.423	2.410	10	0		DEAEHN
COC(=O)c1sc2ccccc2c1NC(=O)CNC1CC1	ZINC000040833339	183139673	/nfs/dbraw/zinc/13/96/73/183139673.db2.gz	OCGLANATSORVTC-UHFFFAOYSA-N	0	3	304.371	2.378	10	0		DEAEHN
CN1CCC(OC(=O)c2ccc(Br)cc2N)CC1	ZINC000041019164	183156342	/nfs/dbraw/zinc/15/63/42/183156342.db2.gz	RVJQYPTXHOMONC-UHFFFAOYSA-N	0	3	313.195	2.282	10	0		DEAEHN
CNCc1cccc(Br)c1O[C@H]1CCC[C@H]1O	ZINC000042411604	183266203	/nfs/dbraw/zinc/26/62/03/183266203.db2.gz	WSGHFGJYIXXDLR-NEPJUHHUSA-N	0	3	300.196	2.461	10	0		DEAEHN
CNCc1cccc(Br)c1OCc1cnn(C)c1	ZINC000042411581	183266253	/nfs/dbraw/zinc/26/62/53/183266253.db2.gz	LJMQEVATDRLCAB-UHFFFAOYSA-N	0	3	310.195	2.481	10	0		DEAEHN
COCCCN(CCOC)[C@@H](CN)c1cccc(Cl)c1	ZINC000042421022	183268054	/nfs/dbraw/zinc/26/80/54/183268054.db2.gz	ZEHGVUQXLUBFQR-HNNXBMFYSA-N	0	3	300.830	2.325	10	0		DEAEHN
COC[C@@H](C)N(C)[C@@H](CN)c1ccccc1Br	ZINC000042517704	183279370	/nfs/dbraw/zinc/27/93/70/183279370.db2.gz	ZTHJWGFQOWEULB-MFKMUULPSA-N	0	3	301.228	2.416	10	0		DEAEHN
C[C@H](N)[C@@H](c1ccc(Cl)cc1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000042945265	183319708	/nfs/dbraw/zinc/31/97/08/183319708.db2.gz	YVUFUAKSUZBBDL-GLQYFDAESA-N	0	3	309.841	2.281	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)cc1)N1CCC[C@@H]1C(=O)NC	ZINC000042946411	183320350	/nfs/dbraw/zinc/32/03/50/183320350.db2.gz	TYUACKBSMNSQOG-RRFJBIMHSA-N	0	3	309.841	2.329	10	0		DEAEHN
CC[C@H](N)[C@H](c1cccc(Cl)c1)N1CCCC[C@@H]1C(N)=O	ZINC000043015845	183327485	/nfs/dbraw/zinc/32/74/85/183327485.db2.gz	RVYCIOCETNYYOA-ZNMIVQPWSA-N	0	3	309.841	2.458	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccccc1Cl)N1CCC[C@@H]1C(=O)NC	ZINC000043052320	183332882	/nfs/dbraw/zinc/33/28/82/183332882.db2.gz	NJGGABSHIPYHST-RRFJBIMHSA-N	0	3	309.841	2.329	10	0		DEAEHN
CCN([C@@H](C)COC)S(=O)(=O)c1cccc([C@@H](C)NC)c1	ZINC000042782201	183308240	/nfs/dbraw/zinc/30/82/40/183308240.db2.gz	APTZPBPICNWBPC-QWHCGFSZSA-N	0	3	314.451	2.013	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(C)s1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043240628	183345692	/nfs/dbraw/zinc/34/56/92/183345692.db2.gz	NTLGGNCZQGRULR-GZBFAFLISA-N	0	3	309.479	2.388	10	0		DEAEHN
CCCN[C@H](c1ccc(F)c(F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000043301258	183352265	/nfs/dbraw/zinc/35/22/65/183352265.db2.gz	YJUSQFCHDBYYAJ-SMDDNHRTSA-N	0	3	303.374	2.440	10	0		DEAEHN
CC(C)c1ccc(CNS(=O)(=O)C[C@@H]2CCCCN2)cc1	ZINC000045047329	183477242	/nfs/dbraw/zinc/47/72/42/183477242.db2.gz	OXWNFABYDWJSAG-INIZCTEOSA-N	0	3	310.463	2.372	10	0		DEAEHN
CO[C@H]1C[C@@H](CN(C)c2cnc3cc(F)c(F)cc3n2)N(C)C1	ZINC000284495386	218050665	/nfs/dbraw/zinc/05/06/65/218050665.db2.gz	HQZPVLWHINAOQQ-QWRGUYRKSA-N	0	3	322.359	2.063	10	0		DEAEHN
Clc1ncccc1CN[C@H]1CCCN(c2cccnn2)C1	ZINC000105802442	194132490	/nfs/dbraw/zinc/13/24/90/194132490.db2.gz	VBCYKPGDCSGWCF-ZDUSSCGKSA-N	0	3	303.797	2.284	10	0		DEAEHN
Cc1ncc(CN(C)C2CCN(CCn3cccn3)CC2)s1	ZINC000105863541	194149350	/nfs/dbraw/zinc/14/93/50/194149350.db2.gz	YIKLWNGMPSHJKV-UHFFFAOYSA-N	0	3	319.478	2.244	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)N[C@@H](C)c2ccccc2)c1	ZINC000105881131	194155590	/nfs/dbraw/zinc/15/55/90/194155590.db2.gz	JEZRIUSDAUJFGW-GJZGRUSLSA-N	0	3	300.406	2.047	10	0		DEAEHN
COc1ccc(OC)c(CN2CCC[C@@H](Cn3cncn3)C2)c1	ZINC000105883546	194158021	/nfs/dbraw/zinc/15/80/21/194158021.db2.gz	HIXRQGTXFMJADT-CQSZACIVSA-N	0	3	316.405	2.208	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)Cc1coc(-c2cccs2)n1	ZINC000106284656	194193755	/nfs/dbraw/zinc/19/37/55/194193755.db2.gz	NNWVOJVMENSWIM-LBPRGKRZSA-N	0	3	305.403	2.156	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc(OC)c(F)c2)CCN1CCOC	ZINC000106115860	194188070	/nfs/dbraw/zinc/18/80/70/194188070.db2.gz	IICCGPICRIATEM-HNNXBMFYSA-N	0	3	310.413	2.377	10	0		DEAEHN
CCOc1ccc(CNC(=O)NC2CCN(C)CC2)cc1F	ZINC000106328260	194197383	/nfs/dbraw/zinc/19/73/83/194197383.db2.gz	NVXUXQOYSMWDLW-UHFFFAOYSA-N	0	3	309.385	2.118	10	0		DEAEHN
NC[C@@H](c1ccc2c(c1)OCCCO2)N1CCCSCC1	ZINC000048896015	183694633	/nfs/dbraw/zinc/69/46/33/183694633.db2.gz	BHIUUUCFWFKCFV-AWEZNQCLSA-N	0	3	308.447	2.287	10	0		DEAEHN
O=C(CN[C@@H]1CCCOC1)Nc1ccc(Br)cc1	ZINC000109546807	194272656	/nfs/dbraw/zinc/27/26/56/194272656.db2.gz	QNMGCPLMSTWSBF-GFCCVEGCSA-N	0	3	313.195	2.156	10	0		DEAEHN
CCOc1ccccc1NC(=O)NC[C@H]1CCCN1CCOC	ZINC000110085844	194309296	/nfs/dbraw/zinc/30/92/96/194309296.db2.gz	WQGOGNKUTPSNDT-CQSZACIVSA-N	0	3	321.421	2.318	10	0		DEAEHN
Brc1cnc(O[C@@H]2CCOC2)c(CNC2CC2)c1	ZINC000110532515	194336845	/nfs/dbraw/zinc/33/68/45/194336845.db2.gz	BXXYYWGPWQXOHH-GFCCVEGCSA-N	0	3	313.195	2.264	10	0		DEAEHN
CN[C@H](C)C(=O)Nc1c(C)cc(Br)cc1OC	ZINC000054074587	183923166	/nfs/dbraw/zinc/92/31/66/183923166.db2.gz	FJMWXWPEQZIVDS-MRVPVSSYSA-N	0	3	301.184	2.313	10	0		DEAEHN
CN(CC1CCCC1)S(=O)(=O)c1cccc2c1CCNC2	ZINC000110846081	194362900	/nfs/dbraw/zinc/36/29/00/194362900.db2.gz	XLNQZJPNPANTFB-UHFFFAOYSA-N	0	3	308.447	2.143	10	0		DEAEHN
CCCN[C@@H](c1cccc(F)c1F)[C@@H]1CCS(=O)(=O)C1	ZINC000111037643	194386065	/nfs/dbraw/zinc/38/60/65/194386065.db2.gz	GDJSXROCKVKNDR-QMTHXVAHSA-N	0	3	303.374	2.440	10	0		DEAEHN
COCCN(CCOC)Cc1ccc(Br)c(N)c1	ZINC000159322647	197344569	/nfs/dbraw/zinc/34/45/69/197344569.db2.gz	XYCPLSKDNVOCKM-UHFFFAOYSA-N	0	3	317.227	2.126	10	0		DEAEHN
Cc1ccc2[nH]c(SC[C@](C)(NC(C)C)C(N)=O)nc2c1	ZINC000061440843	184170892	/nfs/dbraw/zinc/17/08/92/184170892.db2.gz	AJPMYAWKZAYPOB-HNNXBMFYSA-N	0	3	306.435	2.205	10	0		DEAEHN
Cc1ccc2nc(SC[C@](C)(NC(C)C)C(N)=O)[nH]c2c1	ZINC000061440843	184170893	/nfs/dbraw/zinc/17/08/93/184170893.db2.gz	AJPMYAWKZAYPOB-HNNXBMFYSA-N	0	3	306.435	2.205	10	0		DEAEHN
CC(C)[C@H](CN(C)C)Nc1nc(Cl)nc(N2CCCC2)n1	ZINC000061539298	184173552	/nfs/dbraw/zinc/17/35/52/184173552.db2.gz	APRKESFXCMRWGN-NSHDSACASA-N	0	3	312.849	2.123	10	0		DEAEHN
Cc1ccc(F)cc1S(=O)(=O)N(C)c1cccc(CN)c1	ZINC000061950493	184198386	/nfs/dbraw/zinc/19/83/86/184198386.db2.gz	QADIFFOPOUKYGS-UHFFFAOYSA-N	0	3	308.378	2.418	10	0		DEAEHN
CCN[C@@H](C)c1ccc(F)cc1O[C@H]1CCS(=O)(=O)C1	ZINC000062746696	184251721	/nfs/dbraw/zinc/25/17/21/184251721.db2.gz	DUDKALOEFQQUFK-JQWIXIFHSA-N	0	3	301.383	2.062	10	0		DEAEHN
COCCNCc1ccc(Br)cc1-n1cccn1	ZINC000062738483	184252073	/nfs/dbraw/zinc/25/20/73/184252073.db2.gz	XPAURIGFTUOPIA-UHFFFAOYSA-N	0	3	310.195	2.371	10	0		DEAEHN
Brc1cccc(-c2cc(N3CCNCC3)n[nH]2)c1	ZINC000062669864	184247201	/nfs/dbraw/zinc/24/72/01/184247201.db2.gz	OSXRKMCHILIDMZ-UHFFFAOYSA-N	0	3	307.195	2.249	10	0		DEAEHN
CCN(CC)c1ccc(NS(=O)(=O)[C@@H]2CCCNC2)cc1	ZINC000062996936	184264988	/nfs/dbraw/zinc/26/49/88/184264988.db2.gz	MDACIYQEWJWTAC-OAHLLOKOSA-N	0	3	311.451	2.027	10	0		DEAEHN
COCCCN1CCCC[C@]12CC(=O)N(Cc1ccccn1)C2	ZINC000063527356	184284996	/nfs/dbraw/zinc/28/49/96/184284996.db2.gz	WQYCYTCUXMVREU-GOSISDBHSA-N	0	3	317.433	2.075	10	0		DEAEHN
CCOc1ccc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1OC	ZINC000113231833	194568745	/nfs/dbraw/zinc/56/87/45/194568745.db2.gz	WTOQTMDRQQRDIB-ZFWWWQNUSA-N	0	3	318.417	2.403	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)C(C)(C)c2ccccc2Cl)CCO1	ZINC000116783204	194768142	/nfs/dbraw/zinc/76/81/42/194768142.db2.gz	YBZOKLNZTIHQHX-ZDUSSCGKSA-N	0	3	324.852	2.407	10	0		DEAEHN
COc1cc(CN(C)C[C@@H]2CCCOC2)cc2c1OCCO2	ZINC000119738416	195028253	/nfs/dbraw/zinc/02/82/53/195028253.db2.gz	QNOWKRNFWCTYBV-ZDUSSCGKSA-N	0	3	307.390	2.325	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Cc2cccc(OC(F)(F)F)c2)C1	ZINC000119941984	195066999	/nfs/dbraw/zinc/06/69/99/195066999.db2.gz	IVOWSKUKSAEREW-GFCCVEGCSA-N	0	3	316.323	2.290	10	0		DEAEHN
COc1cc(C[NH2+][C@@]2(C)CCOC2)cc(Br)c1[O-]	ZINC000120145740	195105593	/nfs/dbraw/zinc/10/55/93/195105593.db2.gz	NRUHNCMFZMBRHF-ZDUSSCGKSA-N	0	3	316.195	2.432	10	0		DEAEHN
COc1cc(C[NH2+][C@]2(C)CCOC2)cc(Br)c1[O-]	ZINC000120145876	195105711	/nfs/dbraw/zinc/10/57/11/195105711.db2.gz	NRUHNCMFZMBRHF-CYBMUJFWSA-N	0	3	316.195	2.432	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)c2sc3cccnc3c2N)CCN1C	ZINC000159160446	197331741	/nfs/dbraw/zinc/33/17/41/197331741.db2.gz	XYIHBEQQYLHICU-VHSXEESVSA-N	0	3	304.419	2.091	10	0		DEAEHN
Cc1cc(S(=O)(=O)NC2CC2)cc(CNC(C)(C)C)c1F	ZINC000159083543	197325467	/nfs/dbraw/zinc/32/54/67/197325467.db2.gz	KOKPBUJJSLPMPA-UHFFFAOYSA-N	0	3	314.426	2.463	10	0		DEAEHN
Cc1cc(S(=O)(=O)NCc2cccs2)cc(CN)c1F	ZINC000159076567	197324492	/nfs/dbraw/zinc/32/44/92/197324492.db2.gz	XDEFTDGMVGQLME-UHFFFAOYSA-N	0	3	314.407	2.133	10	0		DEAEHN
CSCC[C@H](N)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	ZINC000158922311	197311828	/nfs/dbraw/zinc/31/18/28/197311828.db2.gz	KHKSGRUPZWPHLL-BYPYZUCNSA-N	0	3	314.279	2.401	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)c1ccccc1C)[C@@H]1CCOC1	ZINC000158829121	197304779	/nfs/dbraw/zinc/30/47/79/197304779.db2.gz	WCKVQINBLONLTJ-CABCVRRESA-N	0	3	311.447	2.173	10	0		DEAEHN
COc1c([C@@H](CN)N(C)[C@@H](C)c2cccs2)c(C)nn1C	ZINC000158387033	197268327	/nfs/dbraw/zinc/26/83/27/197268327.db2.gz	UHPLNKWRIZYIPP-NWDGAFQWSA-N	0	3	308.451	2.491	10	0		DEAEHN
C[C@H]1C[C@H](Nc2nc3c(Br)cccn3n2)CCN1C	ZINC000158439054	197272218	/nfs/dbraw/zinc/27/22/18/197272218.db2.gz	BZIBQFXSHZBHIF-VHSXEESVSA-N	0	3	324.226	2.386	10	0		DEAEHN
CSC(C)(C)CNS(=O)(=O)c1cccc([C@@H](C)N)c1	ZINC000156873759	197146570	/nfs/dbraw/zinc/14/65/70/197146570.db2.gz	UVFXZGUYNPPEDG-SNVBAGLBSA-N	0	3	302.465	2.126	10	0		DEAEHN
Cc1ccc([C@@H](C)NC(=O)N2CCO[C@H](CN(C)C)C2)cc1F	ZINC000156805513	197141938	/nfs/dbraw/zinc/14/19/38/197141938.db2.gz	QHOTWRVZYUSHBI-UKRRQHHQSA-N	0	3	323.412	2.167	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N1[C@@H](C)CC[C@@H]1C)c1nnc2n1CCCC2	ZINC000156347452	197106361	/nfs/dbraw/zinc/10/63/61/197106361.db2.gz	LOMZIGUVYAUMKE-XUXIUFHCSA-N	0	3	319.453	2.053	10	0		DEAEHN
Cc1cc(F)ccc1[C@@H]1C(=O)NCCN1CCN1CCCCC1	ZINC000184745078	291925209	/nfs/dbraw/zinc/92/52/09/291925209.db2.gz	ZHJWIVZISVURHD-QGZVFWFLSA-N	0	3	319.424	2.093	10	0		DEAEHN
Cc1ccc([C@@H](CNC(=O)c2cccc3ncnn32)N(C)C)cc1	ZINC000542938930	285264710	/nfs/dbraw/zinc/26/47/10/285264710.db2.gz	DNIIBDPELNKKMK-MRXNPFEDSA-N	0	3	323.400	2.070	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1	ZINC000120678312	195214436	/nfs/dbraw/zinc/21/44/36/195214436.db2.gz	FNITWOFKRXTLOX-CZUORRHYSA-N	0	3	317.433	2.129	10	0		DEAEHN
Cc1ccccc1CN1CC[C@@H]2C[C@@H](C(=O)N(C)C)O[C@H]2C1	ZINC000247999070	257111445	/nfs/dbraw/zinc/11/14/45/257111445.db2.gz	NEVOQVPCNHNNTH-PVAVHDDUSA-N	0	3	302.418	2.063	10	0		DEAEHN
COC[C@@H]1CNC(=O)[C@H]2CCN(Cc3ccc(F)cc3)CC[C@@H]12	ZINC000247816999	257117417	/nfs/dbraw/zinc/11/74/17/257117417.db2.gz	BSUSRBNTMXXWAU-XIRDDKMYSA-N	0	3	320.408	2.046	10	0		DEAEHN
CC1=C(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CCCO1	ZINC000121583934	195310071	/nfs/dbraw/zinc/31/00/71/195310071.db2.gz	IOUHFKDXXYUYPP-INIZCTEOSA-N	0	3	302.418	2.360	10	0		DEAEHN
Cc1cc(F)ccc1NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000121852228	195361502	/nfs/dbraw/zinc/36/15/02/195361502.db2.gz	WUIUCDNYPLREDX-CQSZACIVSA-N	0	3	323.412	2.165	10	0		DEAEHN
O=C(CCN1CCC(n2cncn2)CC1)c1ccc(F)cc1	ZINC000121959108	195382295	/nfs/dbraw/zinc/38/22/95/195382295.db2.gz	OABCVXWOTRNCOO-UHFFFAOYSA-N	0	3	302.353	2.327	10	0		DEAEHN
NCc1ccc(S(=O)(=O)NCC2CCCC2)cc1Cl	ZINC000126196194	195819056	/nfs/dbraw/zinc/81/90/56/195819056.db2.gz	OTRNJUOTBQLOLG-UHFFFAOYSA-N	0	3	302.827	2.267	10	0		DEAEHN
C[C@@H](NC(=O)c1cccc2ncnn21)[C@H](c1ccccc1)N(C)C	ZINC000545317733	285422336	/nfs/dbraw/zinc/42/23/36/285422336.db2.gz	UZZCRAATBLICTP-CXAGYDPISA-N	0	3	323.400	2.151	10	0		DEAEHN
c1c2c(nn1-c1ccccc1)CCC[C@H]2NC[C@H]1COCCO1	ZINC000358913792	285421381	/nfs/dbraw/zinc/42/13/81/285421381.db2.gz	JBXNIEKHUZYZIN-DOTOQJQBSA-N	0	3	313.401	2.255	10	0		DEAEHN
COC[C@@H](NC(=O)N1CC[C@H](N2CC=CC2)C1)c1ccccc1	ZINC000174625917	132510148	/nfs/dbraw/zinc/51/01/48/132510148.db2.gz	RWWDWHAGMJHUIG-DLBZAZTESA-N	0	3	315.417	2.030	10	0		DEAEHN
C[C@H]1C[C@]2(CCN1C(=O)OC(C)(C)C)NCCc1ncn(C)c12	ZINC000725242529	542770287	/nfs/dbraw/zinc/77/02/87/542770287.db2.gz	CCOAJLOSKMXREB-SJCJKPOMSA-N	0	3	320.437	2.181	10	0		DEAEHN
CC[NH+]1CCC(n2nccc2NC(=O)c2cccc([O-])c2)CC1	ZINC000357435077	133078032	/nfs/dbraw/zinc/07/80/32/133078032.db2.gz	SNYFZQCPAKOXTD-UHFFFAOYSA-N	0	3	314.389	2.498	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCC(C)(c2nc(C)no2)CC1	ZINC000357920910	133109650	/nfs/dbraw/zinc/10/96/50/133109650.db2.gz	FADBNRUNMOYUHU-AWEZNQCLSA-N	0	3	320.437	2.133	10	0		DEAEHN
Cc1cccc2c1CC[C@@H]2N[C@H]1CCN(C2CCOCC2)C1=O	ZINC000358191857	133127292	/nfs/dbraw/zinc/12/72/92/133127292.db2.gz	PDLHMOPHUMYSBQ-ROUUACIJSA-N	0	3	314.429	2.352	10	0		DEAEHN
C[C@H](NCc1ccn(C)n1)c1cccc(OCCN(C)C)c1	ZINC000358246757	133131401	/nfs/dbraw/zinc/13/14/01/133131401.db2.gz	KTHXQZFTTPMZST-AWEZNQCLSA-N	0	3	302.422	2.211	10	0		DEAEHN
C[C@@H]1CCOCCN1C[C@H](O)COCc1ccccc1Cl	ZINC000362232000	133218522	/nfs/dbraw/zinc/21/85/22/133218522.db2.gz	ANUOXYPMOYFCGU-HIFRSBDPSA-N	0	3	313.825	2.328	10	0		DEAEHN
Cc1ccccc1C1CC(N[C@@H]2CCN(c3ccn(C)n3)C2=O)C1	ZINC000368405704	133272095	/nfs/dbraw/zinc/27/20/95/133272095.db2.gz	UMTXRAWUYNISCV-VMBOVVBDSA-N	0	3	324.428	2.370	10	0		DEAEHN
C[C@H](N[C@@H]1CCC(=O)N[C@@H]1C)c1cncc(Br)c1	ZINC000563446687	292057861	/nfs/dbraw/zinc/05/78/61/292057861.db2.gz	XGCPCGTZNATJPS-YGOYTEALSA-N	0	3	312.211	2.162	10	0		DEAEHN
CO[C@@H](C)[C@@H](C)N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1	ZINC000564760382	292108947	/nfs/dbraw/zinc/10/89/47/292108947.db2.gz	HHVAIXXYCQXWND-AGIUHOORSA-N	0	3	314.451	2.011	10	0		DEAEHN
CCO[C@@H]1C[C@@H](O)C12CCN(Cc1ccc(O)c(OC)c1)CC2	ZINC000180086773	144883799	/nfs/dbraw/zinc/88/37/99/144883799.db2.gz	FQNKSMFTKZPHSV-IAGOWNOFSA-N	0	3	321.417	2.153	10	0		DEAEHN
CCCNC(=O)[C@H](C)N[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000180660373	144892781	/nfs/dbraw/zinc/89/27/81/144892781.db2.gz	UEGUCJOCKAJBNI-KGLIPLIRSA-N	0	3	300.406	2.438	10	0		DEAEHN
C[C@@H]1CC[C@@](CO)(N(C)Cc2ccc(-n3ccnc3)nc2)C1	ZINC000187908308	145004621	/nfs/dbraw/zinc/00/46/21/145004621.db2.gz	VSALUCWHQQWYTF-RHSMWYFYSA-N	0	3	300.406	2.250	10	0		DEAEHN
CC(C)=C(F)C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000188158517	145007507	/nfs/dbraw/zinc/00/75/07/145007507.db2.gz	OPHXTZGUYWJWDB-GOSISDBHSA-N	0	3	320.408	2.345	10	0		DEAEHN
CCCCOc1ccc(CCNC(=O)[C@H]2C[C@H](F)CN2)cc1	ZINC000188345091	145010664	/nfs/dbraw/zinc/01/06/64/145010664.db2.gz	MGMWUMXFJQFVKZ-GOEBONIOSA-N	0	3	308.397	2.224	10	0		DEAEHN
CCc1nn(C)c(CC)c1CC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000190135558	145038134	/nfs/dbraw/zinc/03/81/34/145038134.db2.gz	HUBGRKIJWOSMHU-AWEZNQCLSA-N	0	3	322.497	2.180	10	0		DEAEHN
C[C@@H]1CN(Cc2cccc(-c3ccccn3)c2)CCN1CCO	ZINC000190236111	145039452	/nfs/dbraw/zinc/03/94/52/145039452.db2.gz	PFVYODVGEPYAIC-MRXNPFEDSA-N	0	3	311.429	2.247	10	0		DEAEHN
Cc1nc(CC(C)C)oc1C(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000190427760	145042419	/nfs/dbraw/zinc/04/24/19/145042419.db2.gz	CVMFDUUSOUVZTA-GXTWGEPZSA-N	0	3	305.422	2.490	10	0		DEAEHN
CO[C@H](C)[C@H](C)NC(=O)N(CCN(C)C)Cc1cccs1	ZINC000190704593	145046379	/nfs/dbraw/zinc/04/63/79/145046379.db2.gz	YRQZHFPIVASJHX-QWHCGFSZSA-N	0	3	313.467	2.245	10	0		DEAEHN
CO[C@@H](C)[C@H](C)NC(=O)N(CCN(C)C)Cc1cccs1	ZINC000190704612	145046398	/nfs/dbraw/zinc/04/63/98/145046398.db2.gz	YRQZHFPIVASJHX-STQMWFEESA-N	0	3	313.467	2.245	10	0		DEAEHN
COC[C@H](Cc1ccccc1)N(C)C[C@H](O)COC(C)(C)C	ZINC000191496412	145059401	/nfs/dbraw/zinc/05/94/01/145059401.db2.gz	XKQKXPROJPTSAY-IRXDYDNUSA-N	0	3	309.450	2.352	10	0		DEAEHN
Cn1c2ccc(CNCc3cccc(CO)c3)cc2sc1=O	ZINC000192546293	145074833	/nfs/dbraw/zinc/07/48/33/145074833.db2.gz	LYNRYLVYNZNEBN-UHFFFAOYSA-N	0	3	314.410	2.382	10	0		DEAEHN
O=C(Nc1ccccc1)C1CCN([C@H]2CCCCNC2=O)CC1	ZINC000192651291	145076105	/nfs/dbraw/zinc/07/61/05/145076105.db2.gz	XPXDZFWFWZZGQT-INIZCTEOSA-N	0	3	315.417	2.006	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@@H](C)c1nc(C)cc(=O)[nH]1	ZINC000192613489	145076272	/nfs/dbraw/zinc/07/62/72/145076272.db2.gz	QHYMBOCNBBKZJC-GXTWGEPZSA-N	0	3	301.394	2.221	10	0		DEAEHN
Cn1ccnc1CC1CCN(CCO[C@@H]2CCCCO2)CC1	ZINC000193050787	145081619	/nfs/dbraw/zinc/08/16/19/145081619.db2.gz	RTAMHOABYJVSSZ-QGZVFWFLSA-N	0	3	307.438	2.218	10	0		DEAEHN
Cn1ccnc1CC1CCN(CCO[C@H]2CCCCO2)CC1	ZINC000193050802	145081678	/nfs/dbraw/zinc/08/16/78/145081678.db2.gz	RTAMHOABYJVSSZ-KRWDZBQOSA-N	0	3	307.438	2.218	10	0		DEAEHN
C[C@H](N[C@@H](C)[C@H]1CCCO1)C(=O)N(C)Cc1cccc(F)c1	ZINC000193128399	145083096	/nfs/dbraw/zinc/08/30/96/145083096.db2.gz	OMCOFKWIFSNNSK-HEHGZKQESA-N	0	3	308.397	2.330	10	0		DEAEHN
C[C@@H](NC(=O)CN1CCN2CCC[C@H]2C1)c1ccccc1Cl	ZINC000246290965	145097165	/nfs/dbraw/zinc/09/71/65/145097165.db2.gz	IJCVIDMMLJFRNL-KGLIPLIRSA-N	0	3	321.852	2.297	10	0		DEAEHN
CO[C@H](CNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1)c1ccccc1	ZINC000246368867	145100073	/nfs/dbraw/zinc/10/00/73/145100073.db2.gz	QEDYSBYAJLVVAA-USXIJHARSA-N	0	3	319.449	2.498	10	0		DEAEHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2ccc(F)c(F)c2)C1	ZINC000246491530	145104437	/nfs/dbraw/zinc/10/44/37/145104437.db2.gz	DRTAOLLTVKDCCT-BBRMVZONSA-N	0	3	308.372	2.450	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)Cc1ccccc1C	ZINC000246705693	145111631	/nfs/dbraw/zinc/11/16/31/145111631.db2.gz	ZOOGMQUBXBNMFJ-SJORKVTESA-N	0	3	322.474	2.383	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2cccnc2N2CCCC2)C1	ZINC000246807830	145115215	/nfs/dbraw/zinc/11/52/15/145115215.db2.gz	DGANPHWAUVBQID-GOEBONIOSA-N	0	3	316.449	2.140	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1CC(=O)N1[C@H](C)CCC[C@H]1C	ZINC000246881173	145118074	/nfs/dbraw/zinc/11/80/74/145118074.db2.gz	DPLLVNGNUNEISV-INMHGKMJSA-N	0	3	318.465	2.445	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCN2CCC[C@H]2C1)Cc1cccs1	ZINC000246893172	145118698	/nfs/dbraw/zinc/11/86/98/145118698.db2.gz	HGQSLFKSPBEKIY-KGLIPLIRSA-N	0	3	307.463	2.416	10	0		DEAEHN
Cc1c(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)cnn1C(C)(C)C	ZINC000246992825	145122623	/nfs/dbraw/zinc/12/26/23/145122623.db2.gz	FHVMOZDJMUTPOE-OCCSQVGLSA-N	0	3	304.438	2.255	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CCO[C@@H](c3ccco3)C2)C1	ZINC000247486741	145138879	/nfs/dbraw/zinc/13/88/79/145138879.db2.gz	WORZEVZXSQIWKZ-IJEWVQPXSA-N	0	3	321.421	2.091	10	0		DEAEHN
O=C1O[C@@H](CN2CCN3CCCC[C@H]3C2)CN1c1ccccc1	ZINC000248369485	145151716	/nfs/dbraw/zinc/15/17/16/145151716.db2.gz	WIBMHZSSINHHDO-IRXDYDNUSA-N	0	3	315.417	2.182	10	0		DEAEHN
Cc1ccccc1CCNC(=O)[C@H](C)N[C@@H](C)[C@H]1CCCO1	ZINC000248587397	145160410	/nfs/dbraw/zinc/16/04/10/145160410.db2.gz	KCWCXBOYYVMXRZ-YQQAZPJKSA-N	0	3	304.434	2.199	10	0		DEAEHN
COc1cc(CN2C[C@H](N3CCOCC3)[C@@H](C)C2)ccc1C	ZINC000248991746	145175318	/nfs/dbraw/zinc/17/53/18/145175318.db2.gz	NRTZRIPKAAOPHV-RDJZCZTQSA-N	0	3	304.434	2.156	10	0		DEAEHN
COC(=O)[C@H](C)Oc1ccc(CN2CC[C@H](C)[C@H](OC)C2)cc1	ZINC000249259656	145181333	/nfs/dbraw/zinc/18/13/33/145181333.db2.gz	YWDCRUAWZDHZHQ-GRDNDAEWSA-N	0	3	321.417	2.484	10	0		DEAEHN
CCn1cnnc1[C@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000249919065	145192389	/nfs/dbraw/zinc/19/23/89/145192389.db2.gz	YGRLZVJBJHJERW-IRXDYDNUSA-N	0	3	314.433	2.081	10	0		DEAEHN
C[C@@]1(c2ccccc2)CCCN(C(=O)C2(N)CCOCC2)C1	ZINC000261695720	145217989	/nfs/dbraw/zinc/21/79/89/145217989.db2.gz	DNFQWGOKPHQZQA-QGZVFWFLSA-N	0	3	302.418	2.075	10	0		DEAEHN
Cn1nc(C2CCCCC2)cc1NC(=O)[C@H](N)C1CCOCC1	ZINC000261777060	145224984	/nfs/dbraw/zinc/22/49/84/145224984.db2.gz	FYYJTPYWEDMCLR-MRXNPFEDSA-N	0	3	320.437	2.160	10	0		DEAEHN
c1c(CN2CCNC[C@@H]2c2cccnc2)[nH]nc1-c1cccnc1	ZINC000261778014	145225306	/nfs/dbraw/zinc/22/53/06/145225306.db2.gz	SYWZMMBCVCVCTO-GOSISDBHSA-N	0	3	320.400	2.013	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@@]1(N)C(=O)Nc1ccc2c[nH]nc2c1	ZINC000261823509	145230728	/nfs/dbraw/zinc/23/07/28/145230728.db2.gz	HOMYKGBMAMUOKU-SUYBPPKGSA-N	0	3	314.389	2.034	10	0		DEAEHN
N[C@@H]1CN(CC(=O)Nc2ccc(F)cc2)C[C@H]1c1ccccc1	ZINC000261852665	145233622	/nfs/dbraw/zinc/23/36/22/145233622.db2.gz	VMWJMCDOMJNXON-DLBZAZTESA-N	0	3	313.376	2.191	10	0		DEAEHN
Cc1ccc(NC(=O)C2(N)CCOCC2)cc1OCC(F)F	ZINC000261866289	145235707	/nfs/dbraw/zinc/23/57/07/145235707.db2.gz	NOTPXOKBHPBLNE-UHFFFAOYSA-N	0	3	314.332	2.085	10	0		DEAEHN
C[C@H](NC(=O)C1(N)CCOCC1)c1ccc(F)cc1Cl	ZINC000261894244	145238539	/nfs/dbraw/zinc/23/85/39/145238539.db2.gz	QVUKMBKQOBIYQK-VIFPVBQESA-N	0	3	300.761	2.164	10	0		DEAEHN
CCc1ccc([C@@H]2CNCCN2CC(=O)NC(C)(C)C)cc1	ZINC000262201771	145269782	/nfs/dbraw/zinc/26/97/82/145269782.db2.gz	KMVNMRIFUDMGAT-INIZCTEOSA-N	0	3	303.450	2.110	10	0		DEAEHN
Cc1ccc(N(C)C(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)cc1	ZINC000262549305	145292011	/nfs/dbraw/zinc/29/20/11/145292011.db2.gz	SCPCUPDXQQPULI-HDMKZQKVSA-N	0	3	302.418	2.490	10	0		DEAEHN
C[C@@H]1C[NH2+]CC[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1Cl	ZINC000262763317	145304016	/nfs/dbraw/zinc/30/40/16/145304016.db2.gz	JZOPUZFAYOMDRZ-KCJUWKMLSA-N	0	3	323.245	2.270	10	0		DEAEHN
C[C@@H]1C[NH2+]CC[C@@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000262790514	145305264	/nfs/dbraw/zinc/30/52/64/145305264.db2.gz	ROEAUSOFEHEFKH-KCJUWKMLSA-N	0	3	323.245	2.270	10	0		DEAEHN
COc1ccccc1[C@H](C)Cc1nc([C@H]2CNCCN2C)no1	ZINC000263134836	145328187	/nfs/dbraw/zinc/32/81/87/145328187.db2.gz	BYPHWRUWFIKEJZ-TZMCWYRMSA-N	0	3	316.405	2.001	10	0		DEAEHN
Cc1cc(Cl)ccc1OCc1nc([C@@H]2CNCCN2C)no1	ZINC000263228970	145338351	/nfs/dbraw/zinc/33/83/51/145338351.db2.gz	NDBLOUJATSJYMZ-LBPRGKRZSA-N	0	3	322.796	2.187	10	0		DEAEHN
CCOCc1nc([C@@H](C)NC(=O)[C@H](C)N2CCCCCC2)no1	ZINC000359490972	147336367	/nfs/dbraw/zinc/33/63/67/147336367.db2.gz	BYPBCICYEKRKBS-OLZOCXBDSA-N	0	3	324.425	2.048	10	0		DEAEHN
CCOCc1nc([C@H](C)NC(=O)[C@@H](C)N2CCCCCC2)no1	ZINC000359490974	147336402	/nfs/dbraw/zinc/33/64/02/147336402.db2.gz	BYPBCICYEKRKBS-QWHCGFSZSA-N	0	3	324.425	2.048	10	0		DEAEHN
c1nc(CN2CCC(CCN3CCOCC3)CC2)oc1C1CC1	ZINC000371186490	148070333	/nfs/dbraw/zinc/07/03/33/148070333.db2.gz	XZRSEYLDEVNADY-UHFFFAOYSA-N	0	3	319.449	2.486	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)N3CCSCC3)cc2)CC1	ZINC000074222622	401733702	/nfs/dbraw/zinc/73/37/02/401733702.db2.gz	INHDHBWVLMWZLM-UHFFFAOYSA-N	0	3	319.474	2.018	10	0		DEAEHN
COc1ccc(C)nc1NC(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000127449218	401735236	/nfs/dbraw/zinc/73/52/36/401735236.db2.gz	GSRAYOIPJDMMNK-WCQYABFASA-N	0	3	306.410	2.249	10	0		DEAEHN
COc1cc2nc(CN[C@H](C)C(C)(C)C)[nH]c(=O)c2cc1OC	ZINC000074317454	401735338	/nfs/dbraw/zinc/73/53/38/401735338.db2.gz	UVDDVICXNPTUCW-SNVBAGLBSA-N	0	3	319.405	2.465	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(N3CCCC3)nc2)CCN1C	ZINC000127558543	401739948	/nfs/dbraw/zinc/73/99/48/401739948.db2.gz	XVABXRAITXGDSW-ZBFHGGJFSA-N	0	3	316.449	2.237	10	0		DEAEHN
Cc1ccc(Br)cc1NC(=O)C1(N)CCOCC1	ZINC000127789817	401750572	/nfs/dbraw/zinc/75/05/72/401750572.db2.gz	CCZQUKUAJHORMU-UHFFFAOYSA-N	0	3	313.195	2.204	10	0		DEAEHN
OCCOCCNCc1ccccc1OCc1ccccc1	ZINC000010435638	401770534	/nfs/dbraw/zinc/77/05/34/401770534.db2.gz	YIGBQEIFXNLWJQ-UHFFFAOYSA-N	0	3	301.386	2.364	10	0		DEAEHN
COC(=O)Nc1cccc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000113229641	401771329	/nfs/dbraw/zinc/77/13/29/401771329.db2.gz	PTRFBGHOTHHAHQ-SWLSCSKDSA-N	0	3	317.389	2.174	10	0		DEAEHN
O=C1NCCCC[C@H]1N1CCC(OCc2ccccc2)CC1	ZINC000010988544	401772814	/nfs/dbraw/zinc/77/28/14/401772814.db2.gz	BTVYFUHDNKKEAV-QGZVFWFLSA-N	0	3	302.418	2.336	10	0		DEAEHN
CC[C@H](CO)N1CCN(CCCOCCc2ccccc2)CC1	ZINC000075963346	401775599	/nfs/dbraw/zinc/77/55/99/401775599.db2.gz	PYSADASKMPXJND-LJQANCHMSA-N	0	3	320.477	2.024	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N[C@H](CO)CC(C)(C)C	ZINC000128435530	401776423	/nfs/dbraw/zinc/77/64/23/401776423.db2.gz	IQMIJVCEZBNOGK-KGLIPLIRSA-N	0	3	301.475	2.059	10	0		DEAEHN
O=C(NCCN1CCCCCC1)[C@H]1CC(=O)Nc2ccccc21	ZINC000076249743	401788376	/nfs/dbraw/zinc/78/83/76/401788376.db2.gz	CXTOTYGGZZRMQZ-HNNXBMFYSA-N	0	3	315.417	2.105	10	0		DEAEHN
Cc1ccn2ncc(C(=O)N[C@H](CN(C)C)c3ccccc3)c2n1	ZINC000114227406	401794876	/nfs/dbraw/zinc/79/48/76/401794876.db2.gz	FIPTZUAKZWMTTQ-MRXNPFEDSA-N	0	3	323.400	2.070	10	0		DEAEHN
CN(C)Cc1c2ccccc2oc1C(=O)NCC1(C)COC1	ZINC000114277187	401795472	/nfs/dbraw/zinc/79/54/72/401795472.db2.gz	OYTXJQFWSKYASP-UHFFFAOYSA-N	0	3	302.374	2.261	10	0		DEAEHN
CCN1CCN([C@H](C)CNC(=O)C(C)(C)c2cccs2)CC1	ZINC000115383629	401825877	/nfs/dbraw/zinc/82/58/77/401825877.db2.gz	WPVMUOFUNJHURZ-CQSZACIVSA-N	0	3	323.506	2.168	10	0		DEAEHN
CC(C)N1CCCC[C@H]1C(=O)N1CCCN(CC(F)F)CC1	ZINC000130746743	401837793	/nfs/dbraw/zinc/83/77/93/401837793.db2.gz	ZZJIDQDEMBGNHO-AWEZNQCLSA-N	0	3	317.424	2.049	10	0		DEAEHN
Cc1cccnc1[C@H](NC(=O)N1CC[C@H](N(C)C)C1)C(C)C	ZINC000115840196	401838259	/nfs/dbraw/zinc/83/82/59/401838259.db2.gz	FGKIXAUOYXTWMB-LSDHHAIUSA-N	0	3	304.438	2.433	10	0		DEAEHN
C[C@@H]1CCc2c(C(=O)N3CCO[C@@H](CN(C)C)C3)csc2C1	ZINC000116791785	401859393	/nfs/dbraw/zinc/85/93/93/401859393.db2.gz	APGMEYVXJXDXMM-OLZOCXBDSA-N	0	3	322.474	2.276	10	0		DEAEHN
CCc1ccc([C@H](C)NC(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000117025576	401867143	/nfs/dbraw/zinc/86/71/43/401867143.db2.gz	GXFWSJBEJASHOC-YOEHRIQHSA-N	0	3	319.449	2.282	10	0		DEAEHN
Cc1cc(C)n2c(CN(C[C@@H]3CCOC3)C3CC3)cnc2n1	ZINC000129978571	401813922	/nfs/dbraw/zinc/81/39/22/401813922.db2.gz	VRHORQDWRCZTQN-AWEZNQCLSA-N	0	3	300.406	2.347	10	0		DEAEHN
CC(C)OC(=O)c1ccc(CN2C[C@H](C(N)=O)CC[C@@H]2C)cc1	ZINC000135041022	401925048	/nfs/dbraw/zinc/92/50/48/401925048.db2.gz	QAVLMHYCGDEWTL-XJKSGUPXSA-N	0	3	318.417	2.338	10	0		DEAEHN
COc1cc(C[NH2+]CC(C)(C)O)cc(Br)c1[O-]	ZINC000087010773	401925651	/nfs/dbraw/zinc/92/56/51/401925651.db2.gz	FRBHAJCUBCKQFR-UHFFFAOYSA-N	0	3	304.184	2.024	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccc(OC)c(OC)c1OC)N(C)C	ZINC000135118647	401927443	/nfs/dbraw/zinc/92/74/43/401927443.db2.gz	VDYURCSJFMMOSY-CYBMUJFWSA-N	0	3	324.421	2.059	10	0		DEAEHN
CCc1noc(CC)c1CC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000087192633	401928859	/nfs/dbraw/zinc/92/88/59/401928859.db2.gz	XMGPLOMPDARYCO-ZDUSSCGKSA-N	0	3	309.454	2.434	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)N1CC[C@H]2CC[C@@H](C1)N2C	ZINC000079545773	401875922	/nfs/dbraw/zinc/87/59/22/401875922.db2.gz	VBQSKAOIJDBATM-KGLIPLIRSA-N	0	3	303.406	2.178	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000034532558	401893133	/nfs/dbraw/zinc/89/31/33/401893133.db2.gz	YGBZVBILLZITTB-MSOLQXFVSA-N	0	3	315.461	2.252	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1cc(C)ccc1OC	ZINC000036076766	401901746	/nfs/dbraw/zinc/90/17/46/401901746.db2.gz	CGQOTOGEPUVGED-CYBMUJFWSA-N	0	3	314.451	2.012	10	0		DEAEHN
CC(C)N1CCCC[C@H]1C(=O)N1CCC(n2ccnc2)CC1	ZINC000118782715	401907320	/nfs/dbraw/zinc/90/73/20/401907320.db2.gz	WBIWUCGEKVRKKL-INIZCTEOSA-N	0	3	304.438	2.310	10	0		DEAEHN
Cn1c(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)nnc1C1CC1	ZINC000134881704	401918011	/nfs/dbraw/zinc/91/80/11/401918011.db2.gz	JMBZWOCHIFLMMB-GDBMZVCRSA-N	0	3	315.465	2.141	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccnc(OC2CCC2)c1	ZINC000089571948	401952347	/nfs/dbraw/zinc/95/23/47/401952347.db2.gz	RXIIDKWWGSBZOB-DZGCQCFKSA-N	0	3	315.417	2.322	10	0		DEAEHN
CCCN(CCC(=O)NC(C)C)C[C@H]1COc2ccccc2O1	ZINC000046781530	401973027	/nfs/dbraw/zinc/97/30/27/401973027.db2.gz	UNURFIRGCZYQJJ-HNNXBMFYSA-N	0	3	320.433	2.453	10	0		DEAEHN
CCc1cccc(CC(=O)Nc2ccn(CCN(C)C)n2)c1	ZINC000119999987	401973935	/nfs/dbraw/zinc/97/39/35/401973935.db2.gz	TZNWIVZHVUGAGL-UHFFFAOYSA-N	0	3	300.406	2.188	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1cccc2cnccc21	ZINC000047544039	401983277	/nfs/dbraw/zinc/98/32/77/401983277.db2.gz	NLPAAUPTWLGZEB-ZDUSSCGKSA-N	0	3	321.446	2.243	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)N(C)CC(=O)NC(C)(C)C)c1	ZINC000044277509	401941363	/nfs/dbraw/zinc/94/13/63/401941363.db2.gz	ACVVETIZGGOOGM-UHFFFAOYSA-N	0	3	320.437	2.127	10	0		DEAEHN
COc1cc(C[NH2+]C(C)(C)CCO)cc(Br)c1[O-]	ZINC000135562292	401945688	/nfs/dbraw/zinc/94/56/88/401945688.db2.gz	KWBGZURXWWNDGT-UHFFFAOYSA-N	0	3	318.211	2.414	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)Nc2nnc(C(F)F)s2)C1	ZINC000121245677	402023090	/nfs/dbraw/zinc/02/30/90/402023090.db2.gz	IMHBDZYACUAPNA-SFYZADRCSA-N	0	3	319.381	2.326	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCO[C@H](c3ccc(C)o3)C2)C1	ZINC000121261316	402023872	/nfs/dbraw/zinc/02/38/72/402023872.db2.gz	CNOPXZJWMCWFLH-HOCLYGCPSA-N	0	3	321.421	2.155	10	0		DEAEHN
CC(C)CCn1cc(C(=O)N[C@@H](CC(C)C)CN(C)C)nn1	ZINC000151343618	402030592	/nfs/dbraw/zinc/03/05/92/402030592.db2.gz	NKYHKHMKJWHFBU-AWEZNQCLSA-N	0	3	309.458	2.030	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2ccccc2OC)C1	ZINC000052500236	402043147	/nfs/dbraw/zinc/04/31/47/402043147.db2.gz	DJPIXLSDNGNJHR-OAHLLOKOSA-N	0	3	305.422	2.021	10	0		DEAEHN
O=C(CN1CCC[C@H]1CCCO)NCc1ccc(Cl)cc1	ZINC000052762890	402046437	/nfs/dbraw/zinc/04/64/37/402046437.db2.gz	QXYDKPQZOYJMTR-HNNXBMFYSA-N	0	3	310.825	2.193	10	0		DEAEHN
CCOC(=O)c1cnc2c(C)cc(C)cc2c1N1CCNCC1	ZINC000053994920	402061016	/nfs/dbraw/zinc/06/10/16/402061016.db2.gz	YAXPINDJZVXJEU-UHFFFAOYSA-N	0	3	313.401	2.438	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@H]1CCCCC1(C)C	ZINC000150887123	402003033	/nfs/dbraw/zinc/00/30/33/402003033.db2.gz	VSURTZWEGWKBMH-GJZGRUSLSA-N	0	3	311.470	2.365	10	0		DEAEHN
CN1CCC[C@@H]2CN(S(=O)(=O)/C=C/c3ccccc3)CC[C@@H]21	ZINC000122447512	402078733	/nfs/dbraw/zinc/07/87/33/402078733.db2.gz	GBXJDOQJZBZXAB-KWEXZYJESA-N	0	3	320.458	2.403	10	0		DEAEHN
CCc1noc(CC)c1CNC(=O)N[C@@H]1CCCN(CC)C1	ZINC000122650061	402088659	/nfs/dbraw/zinc/08/86/59/402088659.db2.gz	KWNAAWMGLAEZTR-GFCCVEGCSA-N	0	3	308.426	2.083	10	0		DEAEHN
Cc1nc(CCNC(=O)NCCN2CCCC[C@@H]2C)sc1C	ZINC000123002237	402105407	/nfs/dbraw/zinc/10/54/07/402105407.db2.gz	VTHZBJUZLMCBJO-LBPRGKRZSA-N	0	3	324.494	2.476	10	0		DEAEHN
CC1CCC(N(C)C(=O)CN2CCCN(C3CC3)CC2)CC1	ZINC000061041440	402106875	/nfs/dbraw/zinc/10/68/75/402106875.db2.gz	MPWDLFBZIFUMRZ-UHFFFAOYSA-N	0	3	307.482	2.194	10	0		DEAEHN
CCO[C@H]1C[C@H](N(C)C(=O)NC2CCN(C)CC2)C12CCCC2	ZINC000152899248	402115607	/nfs/dbraw/zinc/11/56/07/402115607.db2.gz	OMIKTXLUOZEKET-HOTGVXAUSA-N	0	3	323.481	2.460	10	0		DEAEHN
CCOc1cccc(CNC(=O)N2CCCN(C3CC3)CC2)c1	ZINC000064219627	402117880	/nfs/dbraw/zinc/11/78/80/402117880.db2.gz	JGIMJUBRHTZWMA-UHFFFAOYSA-N	0	3	317.433	2.465	10	0		DEAEHN
O=C(NCCCOC1CCCC1)N1CCCN(C2CC2)CC1	ZINC000064241176	402118471	/nfs/dbraw/zinc/11/84/71/402118471.db2.gz	MZJWWKOANXWGLK-UHFFFAOYSA-N	0	3	309.454	2.215	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCc3ccc(OC)cc3C2)C1	ZINC000066338823	402131323	/nfs/dbraw/zinc/13/13/23/402131323.db2.gz	YUYNTVCBBDZGEJ-INIZCTEOSA-N	0	3	317.433	2.247	10	0		DEAEHN
CC[C@H](O)CN1CCN(C/C=C/c2ccccc2OC)CC1	ZINC000123553477	402134235	/nfs/dbraw/zinc/13/42/35/402134235.db2.gz	FJOKTHNIZFOPJW-JKNJVXJCSA-N	0	3	304.434	2.097	10	0		DEAEHN
c1nc2cnccn2c1CNC[C@H]1CSc2ccccc2O1	ZINC000566217598	292218719	/nfs/dbraw/zinc/21/87/19/292218719.db2.gz	UGUUHYBFHNAZLD-ZDUSSCGKSA-N	0	3	312.398	2.372	10	0		DEAEHN
CC[C@@](C)(O)CN1CCCN(C(=O)c2cccc(C)c2)CC1	ZINC000123346185	402123497	/nfs/dbraw/zinc/12/34/97/402123497.db2.gz	AXZAZMJYBZMFTK-GOSISDBHSA-N	0	3	304.434	2.304	10	0		DEAEHN
CCC[C@@H](Cc1ccccc1)N(CCC)CC(=O)NC(N)=O	ZINC000066900129	402145491	/nfs/dbraw/zinc/14/54/91/402145491.db2.gz	UUSOLDCORQWUGW-HNNXBMFYSA-N	0	3	305.422	2.305	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1noc2c1CCCCC2	ZINC000153442702	402145544	/nfs/dbraw/zinc/14/55/44/402145544.db2.gz	VVFQXYLHSIDHBF-CHWSQXEVSA-N	0	3	303.406	2.252	10	0		DEAEHN
COC[C@H](C)C(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000103433019	402187945	/nfs/dbraw/zinc/18/79/45/402187945.db2.gz	YBRYMRXRNQGFER-UONOGXRCSA-N	0	3	310.463	2.359	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)CCN(C)C[C@H]2CCCO2)cc1	ZINC000103480606	402190756	/nfs/dbraw/zinc/19/07/56/402190756.db2.gz	ZYVLKCTVWLMZNG-MRXNPFEDSA-N	0	3	304.390	2.329	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)C(=O)c2ccc3c(c2)CCC3)CCN1C	ZINC000124082254	402163231	/nfs/dbraw/zinc/16/32/31/402163231.db2.gz	GDDLQCZIXPJGOA-CXAGYDPISA-N	0	3	314.429	2.299	10	0		DEAEHN
COC(=O)c1cccc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000124095403	402163803	/nfs/dbraw/zinc/16/38/03/402163803.db2.gz	PXWWMSXSSXOLRH-WFASDCNBSA-N	0	3	304.390	2.028	10	0		DEAEHN
COC(=O)c1cccc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000124094751	402163848	/nfs/dbraw/zinc/16/38/48/402163848.db2.gz	PXWWMSXSSXOLRH-IUODEOHRSA-N	0	3	304.390	2.028	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@](C)(c2ccccc2)C1)N(C)C	ZINC000154567370	402219089	/nfs/dbraw/zinc/21/90/89/402219089.db2.gz	VJABEEXVDGZRCS-AEFFLSMTSA-N	0	3	304.434	2.491	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)[C@H](Cc1ccccc1)N(C)C	ZINC000106905642	402221336	/nfs/dbraw/zinc/22/13/36/402221336.db2.gz	WIUKIYKPHOTIGD-AEFFLSMTSA-N	0	3	317.477	2.150	10	0		DEAEHN
CC[C@@H](C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1)N(C)C	ZINC000125258704	402222389	/nfs/dbraw/zinc/22/23/89/402222389.db2.gz	XILYEFQGIKVGNL-YOEHRIQHSA-N	0	3	319.449	2.120	10	0		DEAEHN
O[C@H](COc1ccccc1Cl)CN1CCN2CCCC[C@@H]2C1	ZINC000125281476	402223511	/nfs/dbraw/zinc/22/35/11/402223511.db2.gz	KDZSNJVMUTXLBD-CABCVRRESA-N	0	3	324.852	2.250	10	0		DEAEHN
COc1ncc(C)cc1NC(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000125301629	402224785	/nfs/dbraw/zinc/22/47/85/402224785.db2.gz	BUXLOERSONUQJP-JSGCOSHPSA-N	0	3	306.410	2.249	10	0		DEAEHN
CCc1nnsc1C(=O)N1CCCC[C@H](N2CCCC2)C1	ZINC000107525681	402234585	/nfs/dbraw/zinc/23/45/85/402234585.db2.gz	HCGQJSUKZRGNHZ-LBPRGKRZSA-N	0	3	308.451	2.191	10	0		DEAEHN
COC(=O)[C@H]1CCN(CCC(=O)Nc2ccccc2Cl)C1	ZINC000107823907	402241504	/nfs/dbraw/zinc/24/15/04/402241504.db2.gz	QSZZZKPERICRFC-NSHDSACASA-N	0	3	310.781	2.164	10	0		DEAEHN
CCOc1ccccc1CCNC(=O)N[C@H]1CCCN(CC)C1	ZINC000069779794	402244427	/nfs/dbraw/zinc/24/44/27/402244427.db2.gz	JXAXZLLWJNHYCZ-INIZCTEOSA-N	0	3	319.449	2.411	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2cc(-c3cccs3)on2)CCO1	ZINC000070016290	402254647	/nfs/dbraw/zinc/25/46/47/402254647.db2.gz	VSOVPYPEUQOPDP-CYBMUJFWSA-N	0	3	307.419	2.166	10	0		DEAEHN
Cc1c(Cl)cccc1S(=O)(=O)NCCN(C)C(C)C	ZINC000155581224	402261755	/nfs/dbraw/zinc/26/17/55/402261755.db2.gz	AAEDSMSKCVINLU-UHFFFAOYSA-N	0	3	304.843	2.267	10	0		DEAEHN
Cc1ccc(CN(C)C)cc1NC(=O)C(=O)NC[C@H](C)C(C)C	ZINC000176090701	402277819	/nfs/dbraw/zinc/27/78/19/402277819.db2.gz	JMPZKZLZNCOZSZ-AWEZNQCLSA-N	0	3	319.449	2.403	10	0		DEAEHN
ClC(Cl)(Cl)CCN1CC[C@@H](CN2CCOCC2)C1	ZINC000184576930	402278228	/nfs/dbraw/zinc/27/82/28/402278228.db2.gz	PSRVTJNHZXKRSM-LLVKDONJSA-N	0	3	315.672	2.401	10	0		DEAEHN
C[C@H](O)CC(C)(C)CNC(=O)c1ccccc1OCCN(C)C	ZINC000176128285	402282090	/nfs/dbraw/zinc/28/20/90/402282090.db2.gz	QBZRRSPSSBNSPU-AWEZNQCLSA-N	0	3	322.449	2.154	10	0		DEAEHN
COC(=O)[C@@H](C)CN(Cc1cnc2nc(C)cc(C)n12)C1CC1	ZINC000184719194	402294810	/nfs/dbraw/zinc/29/48/10/402294810.db2.gz	SHVPJEPIZQKDAS-NSHDSACASA-N	0	3	316.405	2.120	10	0		DEAEHN
COC(=O)[C@H](C)CN(Cc1cnc2nc(C)cc(C)n12)C1CC1	ZINC000184719170	402294837	/nfs/dbraw/zinc/29/48/37/402294837.db2.gz	SHVPJEPIZQKDAS-LLVKDONJSA-N	0	3	316.405	2.120	10	0		DEAEHN
Cc1ccn2c(c1)nnc2NC(=O)C1Oc2ccccc2O[C@@H]1C	ZINC000176307601	402298371	/nfs/dbraw/zinc/29/83/71/402298371.db2.gz	ZLQNNSRFTLKGER-IAQYHMDHSA-N	0	3	324.340	2.205	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1nnc(C(F)F)s1	ZINC000176326642	402300121	/nfs/dbraw/zinc/30/01/21/402300121.db2.gz	MROWYOMMZGMTRP-MRVPVSSYSA-N	0	3	319.381	2.424	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1ccc2c(c1)OCO2	ZINC000176367569	402303701	/nfs/dbraw/zinc/30/37/01/402303701.db2.gz	GFQGNWAJYBCTOT-AWEZNQCLSA-N	0	3	319.405	2.041	10	0		DEAEHN
C[C@H](CCn1cccn1)N[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000158845297	402313242	/nfs/dbraw/zinc/31/32/42/402313242.db2.gz	KIBGTIHIMPESIE-NVXWUHKLSA-N	0	3	312.417	2.447	10	0		DEAEHN
Brc1ccc(-c2nnc(CN[C@@H]3CCOC3)[nH]2)cc1	ZINC000176502830	402315179	/nfs/dbraw/zinc/31/51/79/402315179.db2.gz	GTSOZLNLLKSJEU-LLVKDONJSA-N	0	3	323.194	2.113	10	0		DEAEHN
COc1ccc(/C(C)=C/C(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000176520126	402316607	/nfs/dbraw/zinc/31/66/07/402316607.db2.gz	QIVAQLHMUDFZMZ-GRNBYLDVSA-N	0	3	300.402	2.405	10	0		DEAEHN
CC[C@H](O)[C@@H]1CCCCN1Cc1cc(-c2cnn(C)c2)no1	ZINC000185008001	402316925	/nfs/dbraw/zinc/31/69/25/402316925.db2.gz	LUOJZFPDHTXDSF-HOTGVXAUSA-N	0	3	304.394	2.201	10	0		DEAEHN
CC[C@H](CNC(=O)N1CC[C@@H](N(C)C)C1)Oc1ccccc1C	ZINC000176912162	402349374	/nfs/dbraw/zinc/34/93/74/402349374.db2.gz	BOIVJPTZFVGHIJ-HZPDHXFCSA-N	0	3	319.449	2.498	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)COc1ccccc1OC	ZINC000177026200	402360638	/nfs/dbraw/zinc/36/06/38/402360638.db2.gz	LLVAIVCOBKNOKX-AWEZNQCLSA-N	0	3	306.406	2.017	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2c(F)cccc2Br)C1	ZINC000226640051	402329747	/nfs/dbraw/zinc/32/97/47/402329747.db2.gz	RXEICLOAMXHOEI-SECBINFHSA-N	0	3	315.186	2.364	10	0		DEAEHN
COC[C@H](CNCc1ccc(Br)c(F)c1)OC	ZINC000227707898	402333248	/nfs/dbraw/zinc/33/32/48/402333248.db2.gz	MYKHJTJLZFQOLU-JTQLQIEISA-N	0	3	306.175	2.339	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1nc2cc(C)ccc2n1C)N(C)C	ZINC000186159671	402406792	/nfs/dbraw/zinc/40/67/92/402406792.db2.gz	WPVVULWNLJNVNC-HNNXBMFYSA-N	0	3	302.422	2.228	10	0		DEAEHN
CNC(=O)[C@H]1CCCN1C[C@@H](C)Cc1ccc(OC)c(F)c1	ZINC000186641614	402450961	/nfs/dbraw/zinc/45/09/61/402450961.db2.gz	GLBZHJCXDWGPKN-SWLSCSKDSA-N	0	3	308.397	2.223	10	0		DEAEHN
NC1(C(=O)N[C@H]2CCN(c3ncccc3Cl)C2)CCCCC1	ZINC000237949474	402427359	/nfs/dbraw/zinc/42/73/59/402427359.db2.gz	PSUDZZFKKNUHPP-LBPRGKRZSA-N	0	3	322.840	2.092	10	0		DEAEHN
COc1ccc(F)cc1CC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000186497971	402436407	/nfs/dbraw/zinc/43/64/07/402436407.db2.gz	JJPWDPDXMFUOQA-SWLSCSKDSA-N	0	3	308.397	2.318	10	0		DEAEHN
Cc1nc(CCNC(=O)N2CCCN(C3CC3)CC2)sc1C	ZINC000177890254	402442645	/nfs/dbraw/zinc/44/26/45/402442645.db2.gz	CEMOATSTUZXCIH-UHFFFAOYSA-N	0	3	322.478	2.182	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccc(N(CC)CC)nc1)N(C)C	ZINC000161612640	402393556	/nfs/dbraw/zinc/39/35/56/402393556.db2.gz	YFCPRPFVNDOXNE-OAHLLOKOSA-N	0	3	306.454	2.274	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1ccc(OC)c(F)c1	ZINC000177355402	402393935	/nfs/dbraw/zinc/39/39/35/402393935.db2.gz	ULNZRZZVMMZQNA-AWEZNQCLSA-N	0	3	323.412	2.460	10	0		DEAEHN
Cc1cc(OCCN2CCN(CCO)[C@H](C)C2)ccc1C(C)C	ZINC000187739747	402510226	/nfs/dbraw/zinc/51/02/26/402510226.db2.gz	KGOTWBZIWXGWCJ-QGZVFWFLSA-N	0	3	320.477	2.496	10	0		DEAEHN
CC(C(=O)N1CC[C@@H](C)[C@@H]1c1cccc(F)c1)S(C)(=O)=O	ZINC000245408756	402457481	/nfs/dbraw/zinc/45/74/81/402457481.db2.gz	ITNBQYGJNZRPES-UHIISALHSA-N	0	3	313.394	2.168	10	0		DEAEHN
COC[C@H](NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1)c1ccc(C)o1	ZINC000245422680	402459291	/nfs/dbraw/zinc/45/92/91/402459291.db2.gz	ADNWDVYYPZBUKN-QEJZJMRPSA-N	0	3	323.437	2.400	10	0		DEAEHN
Cc1nc(-c2ccccc2)ncc1C(=O)N1CCN2CCC[C@H]2C1	ZINC000178113175	402461838	/nfs/dbraw/zinc/46/18/38/402461838.db2.gz	RJEGYLCMDGUBAM-INIZCTEOSA-N	0	3	322.412	2.372	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N(C)C[C@H]2CCCN2CC)C12CCC2	ZINC000245464749	402463047	/nfs/dbraw/zinc/46/30/47/402463047.db2.gz	ICWCKAWQAAMEQD-OWCLPIDISA-N	0	3	323.481	2.460	10	0		DEAEHN
O=C1NCCCC[C@@H]1N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000245589668	402473333	/nfs/dbraw/zinc/47/33/33/402473333.db2.gz	FUUCURVIZGMLFX-YESZJQIVSA-N	0	3	302.418	2.243	10	0		DEAEHN
CC(C)(C)OC(=O)[C@@H]1CCN([C@H]2Cc3ccccc3[C@@H]2O)C1	ZINC000245610208	402473715	/nfs/dbraw/zinc/47/37/15/402473715.db2.gz	AVBKIMVEKOCUMN-KBMXLJTQSA-N	0	3	303.402	2.308	10	0		DEAEHN
CN(C[C@@H]1CCCO1)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000245626610	402475346	/nfs/dbraw/zinc/47/53/46/402475346.db2.gz	GRCOVSNOMGJPPH-GVDBMIGSSA-N	0	3	317.433	2.252	10	0		DEAEHN
COc1ccc(CNC(=O)N2CCN3CCC[C@H]3C2)cc1Cl	ZINC000178262176	402476948	/nfs/dbraw/zinc/47/69/48/402476948.db2.gz	BDGFBMWUFKOQAQ-ZDUSSCGKSA-N	0	3	323.824	2.338	10	0		DEAEHN
COC(C)(C)CNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000245654192	402477423	/nfs/dbraw/zinc/47/74/23/402477423.db2.gz	NRIQKEAFDRHESM-GJZGRUSLSA-N	0	3	305.422	2.156	10	0		DEAEHN
C[C@H](C(=O)N[C@@H]1Cc2ccccc2[C@@H]1O)N1CCCCCC1	ZINC000178298769	402481661	/nfs/dbraw/zinc/48/16/61/402481661.db2.gz	RGERTJXGYUXHEW-XYPHTWIQSA-N	0	3	302.418	2.025	10	0		DEAEHN
CO[C@@H]1CC[C@@H]2OCCN(C(=O)[C@@H](C)N3CCCCCC3)[C@@H]2C1	ZINC000245729222	402483658	/nfs/dbraw/zinc/48/36/58/402483658.db2.gz	RKMIYUISLDAMGC-VQHPVUNQSA-N	0	3	324.465	2.046	10	0		DEAEHN
CCCOc1cccc(CN2CCN(C[C@H](C)O)[C@@H](C)C2)c1	ZINC000245740513	402484574	/nfs/dbraw/zinc/48/45/74/402484574.db2.gz	LPMWLTDTOAIVAZ-HOTGVXAUSA-N	0	3	306.450	2.362	10	0		DEAEHN
CCCOc1cccc(CN2CCN(C[C@@H](C)O)[C@@H](C)C2)c1	ZINC000245740514	402484859	/nfs/dbraw/zinc/48/48/59/402484859.db2.gz	LPMWLTDTOAIVAZ-JKSUJKDBSA-N	0	3	306.450	2.362	10	0		DEAEHN
Cc1n[nH]c(C)c1[C@H](C)CC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000245764810	402486241	/nfs/dbraw/zinc/48/62/41/402486241.db2.gz	JDSGQZQWFSPEFM-TYNCELHUSA-N	0	3	306.454	2.461	10	0		DEAEHN
COCC[C@](C)(O)CNCc1ccc(Br)c(F)c1	ZINC000178386268	402492206	/nfs/dbraw/zinc/49/22/06/402492206.db2.gz	QHZKKVHNGFNBSC-ZDUSSCGKSA-N	0	3	320.202	2.465	10	0		DEAEHN
C[C@@H]1CC[C@@](CO)(N(C)CC(=O)NCCC2=CCCCC2)C1	ZINC000187967995	402514193	/nfs/dbraw/zinc/51/41/93/402514193.db2.gz	UXQKZTYOLMOLQO-CRAIPNDOSA-N	0	3	308.466	2.476	10	0		DEAEHN
CC[C@H](C)[C@H](C)NC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000246084800	402508406	/nfs/dbraw/zinc/50/84/06/402508406.db2.gz	IEROIGMXAGYVKG-YESZJQIVSA-N	0	3	324.513	2.233	10	0		DEAEHN
Cc1ccccc1OCCN1C[C@@H](C)[C@@H](N2CCOCC2)C1	ZINC000246095389	402509397	/nfs/dbraw/zinc/50/93/97/402509397.db2.gz	HPBUVYSSYQHUKU-SJORKVTESA-N	0	3	304.434	2.026	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cccc2c1OCO2	ZINC000247034413	402554214	/nfs/dbraw/zinc/55/42/14/402554214.db2.gz	UROCAYSMAGXILF-OLZOCXBDSA-N	0	3	302.374	2.114	10	0		DEAEHN
CCC(=O)Nc1cccc(C(=O)N2C[C@@H]3CCCN3C[C@H]2C)c1	ZINC000247130545	402558052	/nfs/dbraw/zinc/55/80/52/402558052.db2.gz	JIZWZPMIFIBIIH-CJNGLKHVSA-N	0	3	315.417	2.344	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)C2C[C@H]3CCC[C@@H](C2)C3=O)CCN1C	ZINC000247159582	402558795	/nfs/dbraw/zinc/55/87/95/402558795.db2.gz	AJTHJEZXIQBCKZ-WOFIAXNJSA-N	0	3	306.450	2.323	10	0		DEAEHN
COCCN(C)CCNC(=O)c1ccc2nc(Cl)ccc2c1	ZINC000171128133	402559699	/nfs/dbraw/zinc/55/96/99/402559699.db2.gz	XDHLASFIPILVAX-UHFFFAOYSA-N	0	3	321.808	2.196	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CC(=O)Nc3ccccc32)CCN1C	ZINC000247463462	402568184	/nfs/dbraw/zinc/56/81/84/402568184.db2.gz	RFLMJBWLBXUGKN-IPYPFGDCSA-N	0	3	315.417	2.054	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(-c2ccccc2)n[nH]1	ZINC000247475053	402568384	/nfs/dbraw/zinc/56/83/84/402568384.db2.gz	SAGRMXFEEAITBB-HIFRSBDPSA-N	0	3	310.401	2.385	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)[C@@H]1CCCC[C@@H]1C	ZINC000247479471	402568676	/nfs/dbraw/zinc/56/86/76/402568676.db2.gz	JDHFWXZXARDCBB-ARFHVFGLSA-N	0	3	311.470	2.317	10	0		DEAEHN
COc1cccc(OCCN2CCC[C@@H](n3cncn3)C2)c1	ZINC000178674454	402524799	/nfs/dbraw/zinc/52/47/99/402524799.db2.gz	BPGLUINCRIFAQU-CQSZACIVSA-N	0	3	302.378	2.003	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)N[C@H]1CCOc2ccccc21	ZINC000246324722	402525657	/nfs/dbraw/zinc/52/56/57/402525657.db2.gz	NEONIFQZFMDFSN-VNQPRFMTSA-N	0	3	317.433	2.492	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCc2cc(-c3ccccc3)on2)C1	ZINC000170836695	402531702	/nfs/dbraw/zinc/53/17/02/402531702.db2.gz	NUXZLCODKHEMMC-OAHLLOKOSA-N	0	3	314.389	2.187	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2c[nH]c(=S)n2-c2ccccc2)C1	ZINC000170855925	402533201	/nfs/dbraw/zinc/53/32/01/402533201.db2.gz	CDVPUTUHAZTJTF-CYBMUJFWSA-N	0	3	316.430	2.311	10	0		DEAEHN
Cc1c(C(=O)N2CC[C@@H](N(C)C)C2)[nH]c2c1C(=O)CC(C)(C)C2	ZINC000170858313	402533586	/nfs/dbraw/zinc/53/35/86/402533586.db2.gz	YBHVOEMYGPUCFD-GFCCVEGCSA-N	0	3	317.433	2.254	10	0		DEAEHN
C[C@@H]1CC[C@H](NC(=O)NC[C@@](C)(O)CN(C)C)c2ccccc21	ZINC000246527087	402535431	/nfs/dbraw/zinc/53/54/31/402535431.db2.gz	JJBAXKYOMMQCOV-RPVQJOFSSA-N	0	3	319.449	2.237	10	0		DEAEHN
Cc1sc(-c2ccco2)nc1C(=O)N1CC[C@H](N(C)C)C1	ZINC000170867856	402535696	/nfs/dbraw/zinc/53/56/96/402535696.db2.gz	NHCSICABEXVSFB-NSHDSACASA-N	0	3	305.403	2.488	10	0		DEAEHN
CC(C)[C@](C)(O)CNC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248087866	402582260	/nfs/dbraw/zinc/58/22/60/402582260.db2.gz	SYCWEBSCRHZHSK-XYJFISCASA-N	0	3	319.449	2.138	10	0		DEAEHN
C[C@H]1CN(C(=O)NC[C@@H](c2ccccc2)N(C)C)CCS1	ZINC000171412203	402585520	/nfs/dbraw/zinc/58/55/20/402585520.db2.gz	BJDMGORQBPAKJY-ZFWWWQNUSA-N	0	3	307.463	2.436	10	0		DEAEHN
C[C@@H]1CN(C2CCN(Cc3cnn4ccccc34)CC2)CCO1	ZINC000179345971	402586586	/nfs/dbraw/zinc/58/65/86/402586586.db2.gz	GFHFSRZLLGVQIW-OAHLLOKOSA-N	0	3	314.433	2.019	10	0		DEAEHN
C[C@H]1CN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CCS1	ZINC000171429947	402587097	/nfs/dbraw/zinc/58/70/97/402587097.db2.gz	RSFRYGRTVUCZAK-HOCLYGCPSA-N	0	3	321.490	2.306	10	0		DEAEHN
CCOCCN1CCN(Cc2ccc3c[nH]nc3c2)C[C@@H]1CC	ZINC000179513248	402593082	/nfs/dbraw/zinc/59/30/82/402593082.db2.gz	ARQWTYNMQDNXJW-KRWDZBQOSA-N	0	3	316.449	2.496	10	0		DEAEHN
CCOc1ccc(OCCN2CCC[C@@H](n3cncn3)C2)cc1	ZINC000171615629	402602160	/nfs/dbraw/zinc/60/21/60/402602160.db2.gz	UKOBFJBUMUSFLH-OAHLLOKOSA-N	0	3	316.405	2.393	10	0		DEAEHN
CC(C)(C)OC[C@@H](O)CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000248694116	402603846	/nfs/dbraw/zinc/60/38/46/402603846.db2.gz	JHBIISMITHGVKK-YJBOKZPZSA-N	0	3	305.418	2.294	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)[C@H]2CCCO[C@H]2C)o1	ZINC000190478469	402604097	/nfs/dbraw/zinc/60/40/97/402604097.db2.gz	JMGZKLQXVPJGRQ-HOCLYGCPSA-N	0	3	308.422	2.293	10	0		DEAEHN
Cc1cccc(NC(=O)[C@@H](C)N2CCN3CCC[C@@H]3C2)c1C	ZINC000171639333	402604534	/nfs/dbraw/zinc/60/45/34/402604534.db2.gz	SVTIBTMRZGRSNP-HZPDHXFCSA-N	0	3	301.434	2.410	10	0		DEAEHN
Cc1cc(C)n(CC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)n1	ZINC000180189900	402609752	/nfs/dbraw/zinc/60/97/52/402609752.db2.gz	UEFKTICFONUSDA-FUHWJXTLSA-N	0	3	312.417	2.062	10	0		DEAEHN
COc1ccnc(CN2CCC[C@H]2Cn2ccnc2C)c1OC	ZINC000190641245	402615475	/nfs/dbraw/zinc/61/54/75/402615475.db2.gz	BFKQNWVRMPFPGP-AWEZNQCLSA-N	0	3	316.405	2.268	10	0		DEAEHN
C[C@@H]1CCC[C@@H]1CC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000249054373	402618931	/nfs/dbraw/zinc/61/89/31/402618931.db2.gz	XHHNQBFTAHLQLT-KZNAEPCWSA-N	0	3	321.509	2.441	10	0		DEAEHN
COCc1cccc(CC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1	ZINC000249121782	402621361	/nfs/dbraw/zinc/62/13/61/402621361.db2.gz	AFUTYIRCJPNHCA-ZWKOTPCHSA-N	0	3	316.445	2.318	10	0		DEAEHN
Cc1ccccc1CCNC(=O)CN(C)[C@]1(CO)CC[C@@H](C)C1	ZINC000249529762	402633564	/nfs/dbraw/zinc/63/35/64/402633564.db2.gz	AQSAPHNTAXXWJR-DNVCBOLYSA-N	0	3	318.461	2.137	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC[C@@H]2c2c(C)n[nH]c2C)C1	ZINC000181073583	402634364	/nfs/dbraw/zinc/63/43/64/402634364.db2.gz	TVXANLIUNJKRRC-LSDHHAIUSA-N	0	3	319.453	2.357	10	0		DEAEHN
C[C@H](Cc1ccc(O)cc1)NC(=O)NCCN1CCCC[C@H]1C	ZINC000249789659	402641879	/nfs/dbraw/zinc/64/18/79/402641879.db2.gz	UCTZZJWVQTYUSB-HUUCEWRRSA-N	0	3	319.449	2.497	10	0		DEAEHN
COc1cc(C[NH2+]C[C@H](C)OC)cc(Br)c1[O-]	ZINC000191209010	402650855	/nfs/dbraw/zinc/65/08/55/402650855.db2.gz	AJSNSDGHYGGWAQ-QMMMGPOBSA-N	0	3	304.184	2.288	10	0		DEAEHN
O=C1[C@@H](N2CCCN(C3CC3)CC2)CCN1c1ccccc1F	ZINC000172347591	402651877	/nfs/dbraw/zinc/65/18/77/402651877.db2.gz	UEAZFCNQOKAGMZ-KRWDZBQOSA-N	0	3	317.408	2.101	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)CCC1CCOCC1	ZINC000173697034	402709165	/nfs/dbraw/zinc/70/91/65/402709165.db2.gz	VYNQAMRMEAXBRC-SFHVURJKSA-N	0	3	318.461	2.482	10	0		DEAEHN
CC[C@@H]1COCCN1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000252801369	402661162	/nfs/dbraw/zinc/66/11/62/402661162.db2.gz	CQDUFDVWRIWYTH-ZACQAIPSSA-N	0	3	317.433	2.252	10	0		DEAEHN
COc1ccccc1/C=C\CN1CCN(C[C@H](C)O)[C@H](C)C1	ZINC000254936213	402672165	/nfs/dbraw/zinc/67/21/65/402672165.db2.gz	IWKYTLZZFQYVAE-ICFKLAHKSA-N	0	3	304.434	2.095	10	0		DEAEHN
CC[C@@H]1CN(CCCOCc2ccccc2)CCN1C[C@@H](C)O	ZINC000182341280	402682482	/nfs/dbraw/zinc/68/24/82/402682482.db2.gz	VUZVYSALAWFXKY-IEBWSBKVSA-N	0	3	320.477	2.370	10	0		DEAEHN
Cc1cc(N2CC[C@H](N(C)CC3CCCCC3)C2=O)n(C)n1	ZINC000173183474	402687554	/nfs/dbraw/zinc/68/75/54/402687554.db2.gz	WCZOUUZFGZCSFU-HNNXBMFYSA-N	0	3	304.438	2.346	10	0		DEAEHN
Cc1cc(C)n(CCCNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)n1	ZINC000173338213	402693522	/nfs/dbraw/zinc/69/35/22/402693522.db2.gz	AMOPTIJKJPFUCE-GDBMZVCRSA-N	0	3	321.469	2.014	10	0		DEAEHN
Clc1cccc(OCCN2CC[C@H](N3CCOCC3)C2)c1	ZINC000173940504	402720755	/nfs/dbraw/zinc/72/07/55/402720755.db2.gz	UXDUMOJDMGMKPY-HNNXBMFYSA-N	0	3	310.825	2.125	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(Cc2cocn2)C1	ZINC000191980133	402701730	/nfs/dbraw/zinc/70/17/30/402701730.db2.gz	MPQWHOBJMRXFFA-ZDUSSCGKSA-N	0	3	306.435	2.393	10	0		DEAEHN
COc1cc(-c2noc([C@@H]3C[C@@H]4CCCC[C@@H]4N3)n2)ncn1	ZINC000262516578	402726657	/nfs/dbraw/zinc/72/66/57/402726657.db2.gz	NPWRDKKULXRKJY-NHCYSSNCSA-N	0	3	301.350	2.128	10	0		DEAEHN
COc1ccc(NC(=O)[C@H](C)N[C@@H](C)[C@@H]2CCCO2)c(OC)c1	ZINC000183134310	402741998	/nfs/dbraw/zinc/74/19/98/402741998.db2.gz	LTOUPDPTJYLVFW-HUBLWGQQSA-N	0	3	322.405	2.188	10	0		DEAEHN
C[C@@H](N[C@@H](C)C(=O)NC(=O)Nc1ccccc1F)[C@H]1CCCO1	ZINC000183142833	402742961	/nfs/dbraw/zinc/74/29/61/402742961.db2.gz	RUIPODJCICPMRU-UHIISALHSA-N	0	3	323.368	2.019	10	0		DEAEHN
COc1ccc(NC(=O)CN[C@H](C)[C@@H]2CCCO2)cc1Cl	ZINC000183222850	402748705	/nfs/dbraw/zinc/74/87/05/402748705.db2.gz	MOCWKKFZMJPRDK-MFKMUULPSA-N	0	3	312.797	2.444	10	0		DEAEHN
CC[C@H](Oc1cccc(C)c1)c1nc([C@H]2CNCCN2C)no1	ZINC000263298569	402755851	/nfs/dbraw/zinc/75/58/51/402755851.db2.gz	WTWGZLQLDDGYDN-CABCVRRESA-N	0	3	316.405	2.484	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(C(C)(C)c2ccccc2F)n1	ZINC000263312618	402757463	/nfs/dbraw/zinc/75/74/63/402757463.db2.gz	YZOWVTYAXHROMK-CYBMUJFWSA-N	0	3	304.369	2.111	10	0		DEAEHN
O=C(NC[C@H]1CCc2ccccc21)N1CC[C@H](N2CC=CC2)C1	ZINC000174836277	402759918	/nfs/dbraw/zinc/75/99/18/402759918.db2.gz	VLGFTNZNABXFLT-SJORKVTESA-N	0	3	311.429	2.372	10	0		DEAEHN
CSCCCC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000183414834	402765250	/nfs/dbraw/zinc/76/52/50/402765250.db2.gz	DYMVNRSYTXIYHO-MRXNPFEDSA-N	0	3	322.474	2.013	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)CSCc1ccncc1	ZINC000174972099	402767827	/nfs/dbraw/zinc/76/78/27/402767827.db2.gz	NLQXNEHEVKVIIQ-HZPDHXFCSA-N	0	3	319.474	2.400	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc3c(c2)OCCO3)C1	ZINC000194310666	402791314	/nfs/dbraw/zinc/79/13/14/402791314.db2.gz	KUDFKWCDUVCCLX-ZDUSSCGKSA-N	0	3	305.378	2.064	10	0		DEAEHN
COC(=O)c1coc(C(=O)NC[C@@H](c2ccccc2)N(C)C)c1	ZINC000183717768	402791352	/nfs/dbraw/zinc/79/13/52/402791352.db2.gz	URRZSONJRJVNCH-AWEZNQCLSA-N	0	3	316.357	2.099	10	0		DEAEHN
CCC[C@H](C(=O)N1CC[C@@](C(=O)OCC)(C(C)C)C1)N(C)C	ZINC000194325168	402792440	/nfs/dbraw/zinc/79/24/40/402792440.db2.gz	NGVRSSIEFYHYTH-PBHICJAKSA-N	0	3	312.454	2.155	10	0		DEAEHN
C[C@H]1COCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccccc1F	ZINC000194353556	402793641	/nfs/dbraw/zinc/79/36/41/402793641.db2.gz	MWBKSMVEJMAIKJ-HOCLYGCPSA-N	0	3	322.424	2.389	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2nnc(C(C)(C)C)s2)C1	ZINC000194354241	402793731	/nfs/dbraw/zinc/79/37/31/402793731.db2.gz	ZAMVGZZTTYDPTP-JTQLQIEISA-N	0	3	311.455	2.441	10	0		DEAEHN
COC[C@H](NC(=O)N[C@H](CC(C)C)CN(C)C)c1ccco1	ZINC000175315280	402796594	/nfs/dbraw/zinc/79/65/94/402796594.db2.gz	RHPHKZBFIXFMOA-KGLIPLIRSA-N	0	3	311.426	2.243	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@@H](COC)c2ccc(C)o2)C1	ZINC000175361579	402800098	/nfs/dbraw/zinc/80/00/98/402800098.db2.gz	GRMUDMKGIXDGEZ-KGLIPLIRSA-N	0	3	309.410	2.059	10	0		DEAEHN
C[C@H](NC(=O)CN1CCCN(C2CC2)CC1)c1ccccc1	ZINC000195337481	402842770	/nfs/dbraw/zinc/84/27/70/402842770.db2.gz	BLYBBDLDMQPFHO-HNNXBMFYSA-N	0	3	301.434	2.034	10	0		DEAEHN
Cc1cc(C(=O)NC[C@@H]2CCCN2C)c(C)n1-c1nccs1	ZINC000194697724	402810995	/nfs/dbraw/zinc/81/09/95/402810995.db2.gz	CRGKUDJENZQROU-ZDUSSCGKSA-N	0	3	318.446	2.375	10	0		DEAEHN
Cc1cccc(C)c1OCCN1C[C@H](C)[C@H](N2CCOCC2)C1	ZINC000175589922	402819977	/nfs/dbraw/zinc/81/99/77/402819977.db2.gz	KSZVYKQGEMDTEO-ZWKOTPCHSA-N	0	3	318.461	2.335	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ncc(-c2ccccc2)cn1)N(C)C	ZINC000184141442	402821350	/nfs/dbraw/zinc/82/13/50/402821350.db2.gz	OUEIBXQCARSVHX-INIZCTEOSA-N	0	3	312.417	2.490	10	0		DEAEHN
CCOC(=O)[C@@]1(C(C)C)CCN(Cc2c(C)nn(C)c2OC)C1	ZINC000195196259	402835812	/nfs/dbraw/zinc/83/58/12/402835812.db2.gz	GOQOAJNKMUFXMV-KRWDZBQOSA-N	0	3	323.437	2.148	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc(OC(F)F)c(OC)c1	ZINC000175850467	402837827	/nfs/dbraw/zinc/83/78/27/402837827.db2.gz	PKJWRNVXMQYCOW-HNNXBMFYSA-N	0	3	319.348	2.174	10	0		DEAEHN
COC[C@](C)(CCO)NCc1cnn(-c2ccc(Cl)cc2)c1	ZINC000175847934	402838097	/nfs/dbraw/zinc/83/80/97/402838097.db2.gz	UTJAUVFUVZVTJX-INIZCTEOSA-N	0	3	323.824	2.403	10	0		DEAEHN
CC(C)(Oc1ccc(F)cc1)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000195316975	402841596	/nfs/dbraw/zinc/84/15/96/402841596.db2.gz	FMCOCFBSAFSWDU-CQSZACIVSA-N	0	3	306.381	2.290	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)CC[N@@H+]1C	ZINC000175191590	402786394	/nfs/dbraw/zinc/78/63/94/402786394.db2.gz	YSWATNWQTYDCEG-AAEUAGOBSA-N	0	3	309.385	2.155	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)CC[N@H+]1C	ZINC000175191590	402786397	/nfs/dbraw/zinc/78/63/97/402786397.db2.gz	YSWATNWQTYDCEG-AAEUAGOBSA-N	0	3	309.385	2.155	10	0		DEAEHN
COc1ccc(NC(=O)CN2CCC(c3ccn[nH]3)CC2)cc1	ZINC000195506856	402848167	/nfs/dbraw/zinc/84/81/67/402848167.db2.gz	IRDJNAMOEVWQKQ-UHFFFAOYSA-N	0	3	314.389	2.236	10	0		DEAEHN
CCCNC(=O)[C@@H](C)N1CC[C@H](CNc2cccc(C)n2)C1	ZINC000195516199	402849762	/nfs/dbraw/zinc/84/97/62/402849762.db2.gz	OTRKVVRORDNKHV-HUUCEWRRSA-N	0	3	304.438	2.039	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N[C@@H](CC)c2nccn2C)C12CCOCC2	ZINC000248644359	286288823	/nfs/dbraw/zinc/28/88/23/286288823.db2.gz	PTQSWXLIUHLESN-RRFJBIMHSA-N	0	3	307.438	2.435	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)N[C@H]2CCc3c2cccc3O)CN1C1CC1	ZINC000267864336	403041174	/nfs/dbraw/zinc/04/11/74/403041174.db2.gz	JSJGRZNKNZHLMD-WQGACYEGSA-N	0	3	315.417	2.304	10	0		DEAEHN
Cc1nc(C(=O)NCC2(N3CCCC3)CCOCC2)c(C)s1	ZINC000269744671	403162841	/nfs/dbraw/zinc/16/28/41/403162841.db2.gz	MSQFBPTZJFRKDV-UHFFFAOYSA-N	0	3	323.462	2.135	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)NCCN2CCCC[C@@H]2C)cc1	ZINC000331181800	403347344	/nfs/dbraw/zinc/34/73/44/403347344.db2.gz	RMRCKBQXLVBOBQ-AWEZNQCLSA-N	0	3	317.433	2.274	10	0		DEAEHN
Cc1nocc1CNC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000293229482	403420638	/nfs/dbraw/zinc/42/06/38/403420638.db2.gz	KNRBBBLRAPFNIP-SFHVURJKSA-N	0	3	315.417	2.364	10	0		DEAEHN
CCC[C@@H](N)c1cn(CC(=O)N(CC)Cc2ccccc2)nn1	ZINC000304085214	403766351	/nfs/dbraw/zinc/76/63/51/403766351.db2.gz	LSXMFSJAULKGFE-OAHLLOKOSA-N	0	3	315.421	2.127	10	0		DEAEHN
CC(C)c1nc([C@@H](C)N[C@@H]2CCc3nnnn3CC2)cs1	ZINC000333714874	403830131	/nfs/dbraw/zinc/83/01/31/403830131.db2.gz	IWEWIGNBJLPQJU-GHMZBOCLSA-N	0	3	306.439	2.309	10	0		DEAEHN
NC(=O)CC1(NCc2cc(Br)cs2)CCC1	ZINC000336684866	403913200	/nfs/dbraw/zinc/91/32/00/403913200.db2.gz	ROQXEGJIESFIQX-UHFFFAOYSA-N	0	3	303.225	2.398	10	0		DEAEHN
COc1ccc2[nH]nc(NC(=O)CC3CCN(C)CC3)c2c1	ZINC000362996744	404037439	/nfs/dbraw/zinc/03/74/39/404037439.db2.gz	LTCSZBQIWZLZKX-UHFFFAOYSA-N	0	3	302.378	2.242	10	0		DEAEHN
COCCC1(C)CN(C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)C1	ZINC000358604982	292299465	/nfs/dbraw/zinc/29/94/65/292299465.db2.gz	MTGKRFHUYRZGQE-LSDHHAIUSA-N	0	3	311.470	2.317	10	0		DEAEHN
c1cn(CC2CCN(Cc3ccc(-c4cc[nH]n4)o3)CC2)nn1	ZINC000369475281	404106501	/nfs/dbraw/zinc/10/65/01/404106501.db2.gz	CVQXHISEOCKCNB-UHFFFAOYSA-N	0	3	312.377	2.173	10	0		DEAEHN
Cn1cncc1CNC[C@@H]1C[C@H](F)CN1Cc1cccs1	ZINC000328631800	404120605	/nfs/dbraw/zinc/12/06/05/404120605.db2.gz	KXINZJBYHUIYSS-STQMWFEESA-N	0	3	308.426	2.184	10	0		DEAEHN
c1nc2c(ncnc2N2CCC[C@H](c3ncc4n3CCCC4)C2)[nH]1	ZINC000369750989	404216570	/nfs/dbraw/zinc/21/65/70/404216570.db2.gz	SJALDUPBXBAQSY-LBPRGKRZSA-N	0	3	323.404	2.270	10	0		DEAEHN
Cc1cc(CN2C[C@@H](F)C[C@H]2CN(C)Cc2ccn(C)c2)on1	ZINC000355067412	404194613	/nfs/dbraw/zinc/19/46/13/404194613.db2.gz	KEZKCHMFEVYBPO-HOTGVXAUSA-N	0	3	320.412	2.366	10	0		DEAEHN
CO[C@H]1C[C@@H](CO)N(CCOc2cccc3ccccc32)C1	ZINC000344723084	404331993	/nfs/dbraw/zinc/33/19/93/404331993.db2.gz	ILCRAJHWDZCKHF-HOTGVXAUSA-N	0	3	301.386	2.300	10	0		DEAEHN
CO[C@H]1C[C@@H](CO)N(Cc2ccccc2OCC(F)(F)F)C1	ZINC000344668426	404295351	/nfs/dbraw/zinc/29/53/51/404295351.db2.gz	ANUYXMOXKQQAMD-STQMWFEESA-N	0	3	319.323	2.209	10	0		DEAEHN
COc1ccccc1N1CCC[C@@H](NCC2=CCCOC2)C1=O	ZINC000378188781	404887546	/nfs/dbraw/zinc/88/75/46/404887546.db2.gz	FMSVKCMVCQKMDA-OAHLLOKOSA-N	0	3	316.401	2.127	10	0		DEAEHN
c1cc(-c2ccc(CN[C@@H]3CCO[C@]4(CCOC4)C3)o2)n[nH]1	ZINC000366822980	404853330	/nfs/dbraw/zinc/85/33/30/404853330.db2.gz	HBSSDFSOSBMNRS-MLGOLLRUSA-N	0	3	303.362	2.097	10	0		DEAEHN
CC(=O)c1cc(NC(=O)N[C@H]2CNCCC2(F)F)ccc1F	ZINC000415719781	404923982	/nfs/dbraw/zinc/92/39/82/404923982.db2.gz	HPONSYRFSLEHIO-LBPRGKRZSA-N	0	3	315.295	2.147	10	0		DEAEHN
C[C@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21	ZINC000361124568	404932376	/nfs/dbraw/zinc/93/23/76/404932376.db2.gz	QFFNKMQPMXNTKR-KMFMINBZSA-N	0	3	317.433	2.059	10	0		DEAEHN
COC[C@@H](CNCc1ccc(C(=O)OC(C)(C)C)cc1)OC	ZINC000361272908	405002672	/nfs/dbraw/zinc/00/26/72/405002672.db2.gz	QLUFMRPVZFOYQE-OAHLLOKOSA-N	0	3	309.406	2.393	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)c2ncccc2N)CCN1Cc1ccccc1	ZINC000379661923	405027834	/nfs/dbraw/zinc/02/78/34/405027834.db2.gz	GTWMMXJMZUKTCP-GDBMZVCRSA-N	0	3	324.428	2.447	10	0		DEAEHN
Cn1cnnc1C1CCN(Cc2ccc(-c3cc[nH]n3)o2)CC1	ZINC000378512633	404989208	/nfs/dbraw/zinc/98/92/08/404989208.db2.gz	QGNCSUSQJOVXSE-UHFFFAOYSA-N	0	3	312.377	2.178	10	0		DEAEHN
C[C@@H](NCc1c(Br)cnn1C)[C@@H]1CCCOC1	ZINC000388948002	405036480	/nfs/dbraw/zinc/03/64/80/405036480.db2.gz	HLCPIVOHUCLCEA-NXEZZACHSA-N	0	3	302.216	2.087	10	0		DEAEHN
CCN1C[C@H](C)N(Cc2nc3oc(C)c(C)c3c(N)n2)C[C@@H]1C	ZINC000408048648	405098163	/nfs/dbraw/zinc/09/81/63/405098163.db2.gz	ZABMLCLISHIGME-QWRGUYRKSA-N	0	3	317.437	2.336	10	0		DEAEHN
C[C@]1(CNC(=O)CCCCO)CCCN1Cc1ccccc1	ZINC000397983319	405059862	/nfs/dbraw/zinc/05/98/62/405059862.db2.gz	NBJKANGIJJNHCL-GOSISDBHSA-N	0	3	304.434	2.320	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ncccc1N	ZINC000398032043	405060586	/nfs/dbraw/zinc/06/05/86/405060586.db2.gz	GYWMUSRNFALGGQ-RHSMWYFYSA-N	0	3	324.428	2.304	10	0		DEAEHN
CC(C)C(=O)N[C@@H]1CCCN(C(=O)[C@H](C)N2[C@H](C)CC[C@@H]2C)C1	ZINC000407979000	405082825	/nfs/dbraw/zinc/08/28/25/405082825.db2.gz	MTDQUMQSFXNXNU-XUWVNRHRSA-N	0	3	323.481	2.011	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)o1	ZINC000408097820	405111447	/nfs/dbraw/zinc/11/14/47/405111447.db2.gz	NYOVWBJERWLAPF-DZGCQCFKSA-N	0	3	324.446	2.225	10	0		DEAEHN
Cc1nc([C@H](C)N2CC[C@H](n3cnc4c3CCCC4)C2)n[nH]1	ZINC000408466852	405213154	/nfs/dbraw/zinc/21/31/54/405213154.db2.gz	MRAHYLFGMNWVFL-AAEUAGOBSA-N	0	3	300.410	2.196	10	0		DEAEHN
c1c[nH]c([C@H]2CCCN2CCc2nnnn2-c2ccccc2)c1	ZINC000438754546	405254226	/nfs/dbraw/zinc/25/42/26/405254226.db2.gz	PNIRNEANTKJTCS-MRXNPFEDSA-N	0	3	308.389	2.370	10	0		DEAEHN
COc1ccc(Cl)cc1CNC(=O)N1C[C@@H]2CCN(C)[C@@H]2C1	ZINC000454261328	405319764	/nfs/dbraw/zinc/31/97/64/405319764.db2.gz	BHVPGHOSBZTSIF-SMDDNHRTSA-N	0	3	323.824	2.194	10	0		DEAEHN
COC[C@H](NC(=O)NCC1(N(C)C)CCC1)c1ccc(F)cc1	ZINC000445863103	405359304	/nfs/dbraw/zinc/35/93/04/405359304.db2.gz	KPUGGAJQJWJWLK-HNNXBMFYSA-N	0	3	323.412	2.297	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCc2ccc(OC)cc2CC1	ZINC000440048553	405300417	/nfs/dbraw/zinc/30/04/17/405300417.db2.gz	DGNXILKUKCUVKW-GOSISDBHSA-N	0	3	316.445	2.497	10	0		DEAEHN
CN(C)CCn1nccc1NC(=O)N[C@H]1CCCC(F)(F)C1	ZINC000455659787	405441497	/nfs/dbraw/zinc/44/14/97/405441497.db2.gz	RGSRSROELUVFPX-NSHDSACASA-N	0	3	315.368	2.144	10	0		DEAEHN
CN(C)[C@]1(CNC(=O)N[C@@H]2CCCC(F)(F)C2)CCSC1	ZINC000494422289	405694589	/nfs/dbraw/zinc/69/45/89/405694589.db2.gz	BQTVPKOIVMMWOB-YPMHNXCESA-N	0	3	321.437	2.301	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN1CCN(Cc2ccccc2)[C@@H](C(C)C)C1	ZINC000528643043	405695270	/nfs/dbraw/zinc/69/52/70/405695270.db2.gz	ZAICCXDYYYSHSA-MOPGFXCFSA-N	0	3	318.461	2.169	10	0		DEAEHN
Cc1nc2scc(C3CC3)n2c1CNC[C@H]1CN(C)CCO1	ZINC000459422027	405896187	/nfs/dbraw/zinc/89/61/87/405896187.db2.gz	FLDVRJQRTVZNIE-ZDUSSCGKSA-N	0	3	320.462	2.002	10	0		DEAEHN
CCCN(C)CC(=O)N1CCC[C@@H](CC(=O)OC(C)(C)C)C1	ZINC000531615528	405984896	/nfs/dbraw/zinc/98/48/96/405984896.db2.gz	QXKQGFLWQZHUFY-AWEZNQCLSA-N	0	3	312.454	2.299	10	0		DEAEHN
C[C@H](c1ccccc1)[C@@H](O)CN1C[C@@]2(CCOC2)OC(C)(C)C1	ZINC000450897482	405985467	/nfs/dbraw/zinc/98/54/67/405985467.db2.gz	QALPZPQXIYAXCV-HHXXYDBFSA-N	0	3	319.445	2.421	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N1CCC([C@H](O)C(F)(F)F)CC1	ZINC000532533256	406083653	/nfs/dbraw/zinc/08/36/53/406083653.db2.gz	RPEQGJCPFDOXDL-OLZOCXBDSA-N	0	3	322.371	2.023	10	0		DEAEHN
CC1(C)CN(C[C@H](O)Cc2ccccc2C(F)(F)F)C[C@@H]1O	ZINC000562618003	406044883	/nfs/dbraw/zinc/04/48/83/406044883.db2.gz	ZDHOZNHVDSFHAP-OCCSQVGLSA-N	0	3	317.351	2.312	10	0		DEAEHN
CC(=O)c1cc(C(=O)N2CCC[C@H]2CN(C)C)c(C)nc1C	ZINC000487162494	406210208	/nfs/dbraw/zinc/21/02/08/406210208.db2.gz	QYZYVWCBJOFCMG-AWEZNQCLSA-N	0	3	303.406	2.067	10	0		DEAEHN
Cc1ccc2c(c1)CC[C@@H]2NC(=O)NCCNc1ccncc1	ZINC000535260786	406217081	/nfs/dbraw/zinc/21/70/81/406217081.db2.gz	KERLFVZHNGPDFZ-KRWDZBQOSA-N	0	3	310.401	2.211	10	0		DEAEHN
COc1ccnc2c(NC(=O)NC[C@@H]3CCCN3C)cccc12	ZINC000535770465	406236841	/nfs/dbraw/zinc/23/68/41/406236841.db2.gz	OETFQEYUCAOCKI-LBPRGKRZSA-N	0	3	314.389	2.459	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)c2cncnc2)[C@@H]1c1cccs1	ZINC000546891185	406386251	/nfs/dbraw/zinc/38/62/51/406386251.db2.gz	AJVIGKMBITYHLN-SWLSCSKDSA-N	0	3	316.430	2.351	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)NCCCC(C)(C)C	ZINC000638014501	406524026	/nfs/dbraw/zinc/52/40/26/406524026.db2.gz	FIFKNRWVRFXAAT-INIZCTEOSA-N	0	3	305.466	2.388	10	0		DEAEHN
CCc1cnc(CNC[C@@H]2CCC3(CCOCC3)[C@@H]2O)s1	ZINC000548992069	406571285	/nfs/dbraw/zinc/57/12/85/406571285.db2.gz	UKLSCIPZZYNPLK-SWLSCSKDSA-N	0	3	310.463	2.363	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNCC[C@H]1CCCOC1	ZINC000527741186	406735283	/nfs/dbraw/zinc/73/52/83/406735283.db2.gz	YJLIGMQRMBPOBY-MRXNPFEDSA-N	0	3	300.406	2.233	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2ccsc2)N(C[C@@H](C)N2CCCC2)C1=O	ZINC000130799868	196111526	/nfs/dbraw/zinc/11/15/26/196111526.db2.gz	NHQUMDKQSNVADT-VHDGCEQUSA-N	0	3	307.463	2.441	10	0		DEAEHN
CCCc1nnsc1C(=O)Nc1cccc2c1CCNC2	ZINC000131010762	196131340	/nfs/dbraw/zinc/13/13/40/196131340.db2.gz	PVQZEYCOTCYUFT-UHFFFAOYSA-N	0	3	302.403	2.389	10	0		DEAEHN
CN[C@@H](CCCS(C)(=O)=O)c1ccccc1OC(F)F	ZINC000131204091	196149084	/nfs/dbraw/zinc/14/90/84/196149084.db2.gz	SCGUCRHWBCHORY-NSHDSACASA-N	0	3	307.362	2.373	10	0		DEAEHN
CC(C)(C)[C@H]1CCN(S(=O)(=O)c2cc(CN)ccc2F)C1	ZINC000131362931	196162077	/nfs/dbraw/zinc/16/20/77/196162077.db2.gz	FNIPZHRQLQPEGP-LBPRGKRZSA-N	0	3	314.426	2.341	10	0		DEAEHN
CC(C)[C@](C)(O)c1c(Br)cnn1CCN(C)C	ZINC000131405060	196165637	/nfs/dbraw/zinc/16/56/37/196165637.db2.gz	BEMBNMAOKAFZLK-LBPRGKRZSA-N	0	3	304.232	2.071	10	0		DEAEHN
CCCN[C@@H](Cc1cccc(F)c1F)[C@H](C)S(C)(=O)=O	ZINC000131486029	196173756	/nfs/dbraw/zinc/17/37/56/196173756.db2.gz	JOQGTAAHTHTIHB-GWCFXTLKSA-N	0	3	305.390	2.309	10	0		DEAEHN
CNCc1csc(S(=O)(=O)N2CC[C@@H](C)[C@@H](C)C2)c1	ZINC000131787347	196199245	/nfs/dbraw/zinc/19/92/45/196199245.db2.gz	ASEMPQHPEUWAAL-MNOVXSKESA-N	0	3	302.465	2.134	10	0		DEAEHN
Cn1cc(CN)c(NC(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)n1	ZINC000131860332	196204535	/nfs/dbraw/zinc/20/45/35/196204535.db2.gz	FPJMBCLSXAJIQE-PSASIEDQSA-N	0	3	304.316	2.186	10	0		DEAEHN
COCCN(CCOC)[C@H](CN)c1cccc(C(F)F)c1	ZINC000131881126	196207427	/nfs/dbraw/zinc/20/74/27/196207427.db2.gz	PYDMNCZSRPFUOR-CQSZACIVSA-N	0	3	302.365	2.219	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1[C@@](C)(O)C1(C)CC1	ZINC000132838434	196289172	/nfs/dbraw/zinc/28/91/72/196289172.db2.gz	DZHWMKZWLNRTEP-CYBMUJFWSA-N	0	3	316.243	2.215	10	0		DEAEHN
CN(C)CCn1ncc(Br)c1[C@](C)(O)C(C)(C)C	ZINC000133028374	196306270	/nfs/dbraw/zinc/30/62/70/196306270.db2.gz	ZPBGJROPOZDING-ZDUSSCGKSA-N	0	3	318.259	2.461	10	0		DEAEHN
CCOCCCN(CC(F)(F)F)C(=O)[C@]1(C)CCCCN1	ZINC000133253424	196325046	/nfs/dbraw/zinc/32/50/46/196325046.db2.gz	FAXURQFBWQFGSK-ZDUSSCGKSA-N	0	3	310.360	2.336	10	0		DEAEHN
C[C@](CN)(Nc1ccccc1S(C)(=O)=O)c1ccccc1	ZINC000134474756	196394876	/nfs/dbraw/zinc/39/48/76/196394876.db2.gz	LQJKDPPKEZFYBX-MRXNPFEDSA-N	0	3	304.415	2.376	10	0		DEAEHN
CO[C@H](C)CCC(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190622863	225091311	/nfs/dbraw/zinc/09/13/11/225091311.db2.gz	DASGJGGZERTVOH-WBVHZDCISA-N	0	3	319.449	2.177	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CCOC[C@@H]1C	ZINC000194881171	225192135	/nfs/dbraw/zinc/19/21/35/225192135.db2.gz	NQUFVBNRHQSOBF-ATLSCFEFSA-N	0	3	316.445	2.296	10	0		DEAEHN
COc1ccc([C@@H]2CCCN2C(=O)[C@@]2(F)CCNC2)c(OC)c1	ZINC000408513564	227236121	/nfs/dbraw/zinc/23/61/21/227236121.db2.gz	QDDFDIWNRVQSPV-WMLDXEAASA-N	0	3	322.380	2.069	10	0		DEAEHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Nc1nccnc1N(C)C	ZINC000302211579	230168725	/nfs/dbraw/zinc/16/87/25/230168725.db2.gz	ZKKWSHOXQJGZOR-HOCLYGCPSA-N	0	3	311.433	2.475	10	0		DEAEHN
O[C@H](CN1CCC[C@H](Cn2cncn2)C1)c1ccc(Cl)cc1	ZINC000105883989	424849571	/nfs/dbraw/zinc/84/95/71/424849571.db2.gz	AFNDGCGAWAQBAO-XJKSGUPXSA-N	0	3	320.824	2.377	10	0		DEAEHN
Cn1ccnc1CC1CCN(CCOCC(F)(F)F)CC1	ZINC000105876674	424849592	/nfs/dbraw/zinc/84/95/92/424849592.db2.gz	JFUHBGKLNKVPQD-UHFFFAOYSA-N	0	3	305.344	2.254	10	0		DEAEHN
COC(=O)c1coc(CN2CCC(Cc3nccn3C)CC2)c1	ZINC000105876812	424849711	/nfs/dbraw/zinc/84/97/11/424849711.db2.gz	KVCYAMIYNUAFOL-UHFFFAOYSA-N	0	3	317.389	2.254	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@H]2COc3ccc(Cl)cc3C2)C1	ZINC000194641943	424877360	/nfs/dbraw/zinc/87/73/60/424877360.db2.gz	MGPZWGRDSJOJSQ-UKRRQHHQSA-N	0	3	322.836	2.492	10	0		DEAEHN
CC(C)C(=O)N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21	ZINC000404151853	424925552	/nfs/dbraw/zinc/92/55/52/424925552.db2.gz	QBZASLDSHIVVRU-DLBZAZTESA-N	0	3	302.418	2.144	10	0		DEAEHN
O[C@]1(CCNCc2ccc(F)c(Br)c2)CCOC1	ZINC000404197584	424925926	/nfs/dbraw/zinc/92/59/26/424925926.db2.gz	IITIVBCGKRXEIE-CYBMUJFWSA-N	0	3	318.186	2.219	10	0		DEAEHN
O[C@@]1(CCNCc2sccc2Br)CCOC1	ZINC000404219384	424926126	/nfs/dbraw/zinc/92/61/26/424926126.db2.gz	QYGHAXVLAHSNRP-NSHDSACASA-N	0	3	306.225	2.142	10	0		DEAEHN
C[C@H](O)CCCN1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC000404219064	424926140	/nfs/dbraw/zinc/92/61/40/424926140.db2.gz	WGUITJKECAIZRJ-QXAKKESOSA-N	0	3	318.461	2.123	10	0		DEAEHN
CCN(CCNC(=O)c1nscc1Br)C1CC1	ZINC000404871815	424930167	/nfs/dbraw/zinc/93/01/67/424930167.db2.gz	UUSHDHRQWLGWCP-UHFFFAOYSA-N	0	3	318.240	2.120	10	0		DEAEHN
COC[C@@H](C)n1ccc(NC(=O)NCCN2CCCC[C@H]2C)n1	ZINC000249576206	424887569	/nfs/dbraw/zinc/88/75/69/424887569.db2.gz	POWMZZGQLCBKTH-ZIAGYGMSSA-N	0	3	323.441	2.086	10	0		DEAEHN
CC(C)n1ncnc1CN[C@@H](C)CN(C)Cc1ccccc1	ZINC000309806255	424893694	/nfs/dbraw/zinc/89/36/94/424893694.db2.gz	LHHUNRFDXDKGOH-HNNXBMFYSA-N	0	3	301.438	2.469	10	0		DEAEHN
CC(C)CCC[C@@H](C)NC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000192804485	267745241	/nfs/dbraw/zinc/74/52/41/267745241.db2.gz	DMDZTLXABQCDJI-HZPDHXFCSA-N	0	3	313.486	2.347	10	0		DEAEHN
CC(C)C[C@@H]1C(=O)NCCCN1C(=O)[C@H](C)N1[C@H](C)CC[C@@H]1C	ZINC000334130746	269022884	/nfs/dbraw/zinc/02/28/84/269022884.db2.gz	UCLQSIAWSHUKOC-XUWVNRHRSA-N	0	3	323.481	2.011	10	0		DEAEHN
C[C@@H]1CCN[C@@H](C(=O)NCCCCOCc2ccccc2)C1	ZINC000390703814	269097754	/nfs/dbraw/zinc/09/77/54/269097754.db2.gz	AUQYBAKASZAXLN-NVXWUHKLSA-N	0	3	304.434	2.488	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)N[C@H]2CCCC[C@H]2n2cccn2)C1	ZINC000245441666	273805840	/nfs/dbraw/zinc/80/58/40/273805840.db2.gz	VPJGTZBWWXDDIC-OWCLPIDISA-N	0	3	319.453	2.102	10	0		DEAEHN
CN1CCO[C@H](CNCc2ccc(F)cc2C(F)(F)F)C1	ZINC000129456563	277127686	/nfs/dbraw/zinc/12/76/86/277127686.db2.gz	XHCAVYUEEDDDKV-GFCCVEGCSA-N	0	3	306.303	2.265	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCC2CCOCC2)[C@@H]1c1ccccc1	ZINC000179189634	277166747	/nfs/dbraw/zinc/16/67/47/277166747.db2.gz	OMPVQDHBBIBCHM-IRXDYDNUSA-N	0	3	317.433	2.158	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC[C@@H]1c1cnn(C)c1	ZINC000170896327	277435569	/nfs/dbraw/zinc/43/55/69/277435569.db2.gz	ZVTROSOTPRFTIW-JKSUJKDBSA-N	0	3	321.469	2.243	10	0		DEAEHN
CC(C)(C)OC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](N)C(C)(C)C	ZINC000118642035	278452331	/nfs/dbraw/zinc/45/23/31/278452331.db2.gz	NEYSFDRRVWYUNT-XDQVBPFNSA-N	0	3	324.465	2.329	10	0		DEAEHN
CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000186212422	279064072	/nfs/dbraw/zinc/06/40/72/279064072.db2.gz	ROHZLBCPHPRJGP-PMPSAXMXSA-N	0	3	309.454	2.070	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCS[C@@H](C)[C@@H]1C	ZINC000246448335	279124971	/nfs/dbraw/zinc/12/49/71/279124971.db2.gz	VFZVPXQOTQNPGA-MELADBBJSA-N	0	3	301.500	2.498	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)[C@H](C)COC)c1cccc(OC)c1	ZINC000103362479	279164260	/nfs/dbraw/zinc/16/42/60/279164260.db2.gz	ZCULCLSKBCROSI-RHSMWYFYSA-N	0	3	322.449	2.477	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)N1CCO[C@@H](c2ccccc2)C1	ZINC000262566849	280998166	/nfs/dbraw/zinc/99/81/66/280998166.db2.gz	WVPBLMNSMWUIEE-CVEARBPZSA-N	0	3	302.418	2.365	10	0		DEAEHN
Cc1nc([C@@H](C)N2CC[C@H](n3cnc4c3CCCC4)C2)n[nH]1	ZINC000408466858	293358398	/nfs/dbraw/zinc/35/83/98/293358398.db2.gz	MRAHYLFGMNWVFL-YPMHNXCESA-N	0	3	300.410	2.196	10	0		DEAEHN
C[C@@H](NC(=O)Nc1nncs1)[C@@H](c1ccccc1)N(C)C	ZINC000185941354	332275057	/nfs/dbraw/zinc/27/50/57/332275057.db2.gz	BNKOWGYJZCOASR-PWSUYJOCSA-N	0	3	305.407	2.351	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N(C)CC1(N(C)C)CCC1	ZINC000189913210	335119122	/nfs/dbraw/zinc/11/91/22/335119122.db2.gz	QXXWNRZSILAIMX-UHFFFAOYSA-N	0	3	321.469	2.165	10	0		DEAEHN
Cn1nccc1CCN1CCC[C@H](CC(=O)OC(C)(C)C)C1	ZINC000582229244	336035245	/nfs/dbraw/zinc/03/52/45/336035245.db2.gz	YGDMVIYTBLXYDW-CQSZACIVSA-N	0	3	307.438	2.406	10	0		DEAEHN
COc1ccccc1OCCNC[C@H](O)COC1CCCCC1	ZINC000584627910	337376252	/nfs/dbraw/zinc/37/62/52/337376252.db2.gz	QUDMZEGKJLBQBP-HNNXBMFYSA-N	0	3	323.433	2.374	10	0		DEAEHN
CCOC(=O)C(C(=O)OCC)[C@@H](c1ccccc1C)N(C)C	ZINC000584651340	337380914	/nfs/dbraw/zinc/38/09/14/337380914.db2.gz	YFSSLJBIVAGJME-OAHLLOKOSA-N	0	3	307.390	2.340	10	0		DEAEHN
CCC(CC)[C@H](O)CNCc1ccc2c(c1)sc(=O)n2C	ZINC000192583810	341876284	/nfs/dbraw/zinc/87/62/84/341876284.db2.gz	WERAABXAONREQK-CQSZACIVSA-N	0	3	308.447	2.487	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)C2(N)Cc3ccccc3C2)c1	ZINC000366324899	519452811	/nfs/dbraw/zinc/45/28/11/519452811.db2.gz	BUQLXUSPTYVATB-UHFFFAOYSA-N	0	3	323.396	2.104	10	0		DEAEHN
CC(C)CC[C@@H]1CCCCN1CC(=O)N1CCC[C@@H](C(N)=O)C1	ZINC000246878736	519685552	/nfs/dbraw/zinc/68/55/52/519685552.db2.gz	DNNVCHIXIIRZLT-CVEARBPZSA-N	0	3	323.481	2.001	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC(c2cc[nH]n2)CC1	ZINC000156762284	519775263	/nfs/dbraw/zinc/77/52/63/519775263.db2.gz	IZMQYWBKJGELRX-HNNXBMFYSA-N	0	3	321.469	2.275	10	0		DEAEHN
CC(C)c1ccccc1OC[C@@H](O)CN1CCC[C@](C)(O)C1	ZINC000245916784	519847255	/nfs/dbraw/zinc/84/72/55/519847255.db2.gz	NHBKRIFZIKKERN-YJBOKZPZSA-N	0	3	307.434	2.397	10	0		DEAEHN
CCCC(=O)NCC(=O)NCC(C)(C)N[C@@H](C)c1ccccc1	ZINC000103971601	519871591	/nfs/dbraw/zinc/87/15/91/519871591.db2.gz	VTUAJGRAICPJMP-AWEZNQCLSA-N	0	3	319.449	2.148	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@H](c2cccc(OC)c2)C1)N(C)C	ZINC000158071800	520974264	/nfs/dbraw/zinc/97/42/64/520974264.db2.gz	UPXIEPRTLRXMOS-SJORKVTESA-N	0	3	320.433	2.325	10	0		DEAEHN
CC[N@@H+]1CC[C@H](N(C)C(=O)c2ccc(OC)cc2[O-])[C@@H](C)C1	ZINC000247518616	521719014	/nfs/dbraw/zinc/71/90/14/521719014.db2.gz	WGMGSDFVNYETTN-WFASDCNBSA-N	0	3	306.406	2.203	10	0		DEAEHN
CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(OC)cc2[O-])[C@@H](C)C1	ZINC000247518616	521719015	/nfs/dbraw/zinc/71/90/15/521719015.db2.gz	WGMGSDFVNYETTN-WFASDCNBSA-N	0	3	306.406	2.203	10	0		DEAEHN
COc1cc(OC)c(CN[C@H](C)CCn2cccn2)c(OC)c1	ZINC000157613427	522795751	/nfs/dbraw/zinc/79/57/51/522795751.db2.gz	XBGZOMFGOLOXEJ-CYBMUJFWSA-N	0	3	319.405	2.477	10	0		DEAEHN
Cc1cccc(C)c1NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000247052454	524266765	/nfs/dbraw/zinc/26/67/65/524266765.db2.gz	OZPWEQMDPHXRSU-LSDHHAIUSA-N	0	3	317.433	2.183	10	0		DEAEHN
CC(=O)c1cccc(CN2CCCC[C@@H]2[C@H]2CNC(=O)C2)c1	ZINC000450640205	534888037	/nfs/dbraw/zinc/88/80/37/534888037.db2.gz	GAOJLZBKTNOLAV-IAGOWNOFSA-N	0	3	300.402	2.380	10	0		DEAEHN
CC(=O)c1cccc(OCC(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000247507189	534893770	/nfs/dbraw/zinc/89/37/70/534893770.db2.gz	YBUSDHHVQCZTEV-SUMWQHHRSA-N	0	3	318.417	2.113	10	0		DEAEHN
c1cc(-c2ccc(CN3CCC(Cn4cncn4)CC3)o2)n[nH]1	ZINC000366027278	526411612	/nfs/dbraw/zinc/41/16/12/526411612.db2.gz	QTGIZYXBOCUPKJ-UHFFFAOYSA-N	0	3	312.377	2.173	10	0		DEAEHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)c2ncoc2[C@@H]2CCCO2)C1	ZINC000164258329	536475195	/nfs/dbraw/zinc/47/51/95/536475195.db2.gz	MFUVEMVKJADMNE-MCIONIFRSA-N	0	3	319.405	2.082	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)CN(C)[C@H]2CCN(C)[C@H](C)C2)c1C	ZINC000299378124	527157257	/nfs/dbraw/zinc/15/72/57/527157257.db2.gz	SKSSJMTXRJXFNH-ABAIWWIYSA-N	0	3	319.449	2.431	10	0		DEAEHN
CC(C)C(=O)N1CCC(NC(=O)[C@H](C)N2[C@@H](C)CC[C@@H]2C)CC1	ZINC000195527022	527464901	/nfs/dbraw/zinc/46/49/01/527464901.db2.gz	RXWXCNNJTIAULX-KKUMJFAQSA-N	0	3	323.481	2.011	10	0		DEAEHN
CC(C)C(CNC(=O)NC[C@@H](O)CN1CCCCC1)C(C)C	ZINC000194356225	527583235	/nfs/dbraw/zinc/58/32/35/527583235.db2.gz	GHTNRXXFEASKHM-OAHLLOKOSA-N	0	3	313.486	2.061	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)C[C@H](N)c1ccccc1	ZINC000119274537	527640505	/nfs/dbraw/zinc/64/05/05/527640505.db2.gz	CSQILHOZAOSYBT-PXAZEXFGSA-N	0	3	314.433	2.174	10	0		DEAEHN
CCCCOC[C@@H](O)CN(CC)C[C@@H]1COc2ccccc2O1	ZINC000195095086	528615930	/nfs/dbraw/zinc/61/59/30/528615930.db2.gz	AIENHRJEQPEMLI-JKSUJKDBSA-N	0	3	323.433	2.326	10	0		DEAEHN
CC(C)Oc1ccc([C@@H](C)NC(=O)C2(N)CCOCC2)cc1	ZINC000262328565	535017387	/nfs/dbraw/zinc/01/73/87/535017387.db2.gz	SAKDKUJODMNXIA-CYBMUJFWSA-N	0	3	306.406	2.159	10	0		DEAEHN
CC1CCN(CC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CC1	ZINC000248132199	535275948	/nfs/dbraw/zinc/27/59/48/535275948.db2.gz	WSKJKHXLBXQSFU-HKUYNNGSSA-N	0	3	315.461	2.280	10	0		DEAEHN
CC1(C)CCCN[C@@H]1C(=O)Nc1ccc(-n2cncn2)c(F)c1	ZINC000261626168	535297019	/nfs/dbraw/zinc/29/70/19/535297019.db2.gz	COXLXOORYUGLIG-CQSZACIVSA-N	0	3	317.368	2.123	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCC[C@H]1CCCCO1	ZINC000248734116	535586383	/nfs/dbraw/zinc/58/63/83/535586383.db2.gz	OECUYCXWRVDNNN-JKSUJKDBSA-N	0	3	311.470	2.461	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@@H](C)N1CCC(c2n[nH]c(CC)n2)CC1	ZINC000190662740	535644521	/nfs/dbraw/zinc/64/45/21/535644521.db2.gz	PFJJJIRFRJEPHF-QWHCGFSZSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@@H](C)N1CCC(c2nc(CC)n[nH]2)CC1	ZINC000190662740	535644527	/nfs/dbraw/zinc/64/45/27/535644527.db2.gz	PFJJJIRFRJEPHF-QWHCGFSZSA-N	0	3	321.469	2.240	10	0		DEAEHN
CCC[C@H](C)NC(=O)[C@@H](C)N1CCC(c2nnc(CC)[nH]2)CC1	ZINC000190662740	535644531	/nfs/dbraw/zinc/64/45/31/535644531.db2.gz	PFJJJIRFRJEPHF-QWHCGFSZSA-N	0	3	321.469	2.240	10	0		DEAEHN
CN(C(=O)C[C@H]1CCOc2ccccc21)[C@@H]1CCCN(C)C1	ZINC000247441879	536005464	/nfs/dbraw/zinc/00/54/64/536005464.db2.gz	PNKOMVWPOYMXCU-HUUCEWRRSA-N	0	3	302.418	2.495	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)N[C@@H]1[C@H]2CCc3ccccc3[C@@H]12	ZINC000248570113	536365926	/nfs/dbraw/zinc/36/59/26/536365926.db2.gz	LREJGIBVCQIKCO-RCCFBDPRSA-N	0	3	313.445	2.450	10	0		DEAEHN
CC(C)(C)OC(=O)NC[C@@H]1CCC[C@@]2(C1)NCCc1nc[nH]c12	ZINC000724101883	563496298	/nfs/dbraw/zinc/49/62/98/563496298.db2.gz	RVRZWRHKXSIWJF-PXAZEXFGSA-N	0	3	320.437	2.466	10	0		DEAEHN
CC(C)(C)OC(=O)N[C@H]1CCC[C@]2(C1)NCCc1nc[nH]c12	ZINC000724104170	563496479	/nfs/dbraw/zinc/49/64/79/563496479.db2.gz	ZBVCGFKBIVDBRN-MEDUHNTESA-N	0	3	306.410	2.218	10	0		DEAEHN
CC(C)(C)OC(=O)NC[C@H]1CC[C@@]2(C1)NCCc1nc[nH]c12	ZINC000724109158	563496543	/nfs/dbraw/zinc/49/65/43/563496543.db2.gz	FNAOGCHUOUCNIP-ZBEGNZNMSA-N	0	3	306.410	2.076	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1cc2c(cc1OC)C[C@@H](C)O2)N(C)C	ZINC000162666401	625601557	/nfs/dbraw/zinc/60/15/57/625601557.db2.gz	DPIDHMHXLREZIR-DOMZBBRYSA-N	0	3	320.433	2.365	10	0		DEAEHN
Cc1cc(C)cc([C@@H](O)CN(C)CCN2C[C@@H](C)O[C@@H](C)C2)c1	ZINC000195303708	625786533	/nfs/dbraw/zinc/78/65/33/625786533.db2.gz	QWEBWZJYMXNMDZ-SCTDSRPQSA-N	0	3	320.477	2.378	10	0		DEAEHN
CC(=O)CCN(C)[C@H](C)c1cccc(N2CCCS2(=O)=O)c1	ZINC000186281968	634080521	/nfs/dbraw/zinc/08/05/21/634080521.db2.gz	LAQWUWGMXYCAPX-CQSZACIVSA-N	0	3	324.446	2.198	10	0		DEAEHN
Fc1ccc(/C=C\CN[C@H]2COC[C@H]2Oc2cn[nH]c2)c(F)c1	ZINC000888105427	635666814	/nfs/dbraw/zinc/66/68/14/635666814.db2.gz	HVMFZRUFOUFGGD-XOMPPTQVSA-N	0	3	321.327	2.137	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)N(C)c1cc(OC)c(OC)c(OC)c1	ZINC000237038374	636297208	/nfs/dbraw/zinc/29/72/08/636297208.db2.gz	LQGMRVUCOCVGMT-IINYFYTJSA-N	0	3	310.394	2.049	10	0		DEAEHN
C[C@H](CNCc1nc(Br)c[nH]1)N1CCCCC1	ZINC000310418735	637346066	/nfs/dbraw/zinc/34/60/66/637346066.db2.gz	KLJWUSWOBBTIEW-SNVBAGLBSA-N	0	3	301.232	2.136	10	0		DEAEHN
C[Si](C)(C)c1ccc(CN2CC[C@@H]3NC(=O)OC[C@H]3C2)cc1	ZINC000801953421	645469523	/nfs/dbraw/zinc/46/95/23/645469523.db2.gz	PESAUKRFPCEHFB-ZBFHGGJFSA-N	0	3	318.493	2.162	10	0		DEAEHN
CON(C)C(=O)CCN[C@@H](C)c1ccccc1OC(F)F	ZINC000806625664	645854940	/nfs/dbraw/zinc/85/49/40/645854940.db2.gz	JIADNDRYCJFHAZ-JTQLQIEISA-N	0	3	302.321	2.349	10	0		DEAEHN
CC(C)CN(CCN(C)C)C(=O)N[C@H]1COc2ccccc21	ZINC000060587471	646625031	/nfs/dbraw/zinc/62/50/31/646625031.db2.gz	ZEONFPKQASLLIR-HNNXBMFYSA-N	0	3	305.422	2.349	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)c1cc(Cl)nc(N(C)C)c1	ZINC000733154760	647892804	/nfs/dbraw/zinc/89/28/04/647892804.db2.gz	IHHNAHUFCBBIBI-ZDUSSCGKSA-N	0	3	324.856	2.405	10	0		DEAEHN
C[C@H](C[C@H]1CCC(=O)N1)NCc1ccn(Cc2ccccc2)n1	ZINC000389971815	685436983	/nfs/dbraw/zinc/43/69/83/685436983.db2.gz	VRIIAVIPWPGFIR-GDBMZVCRSA-N	0	3	312.417	2.078	10	0		DEAEHN
COc1ccc([C@@H](NC[C@H]2CCCS2(=O)=O)C2CC2)cc1	ZINC000126845046	684157904	/nfs/dbraw/zinc/15/79/04/684157904.db2.gz	JOCDWQPGYIVUEW-CVEARBPZSA-N	0	3	309.431	2.313	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCn2c(C(C)C)nnc2[C@@H]1C)N(C)C	ZINC000188800547	684364541	/nfs/dbraw/zinc/36/45/41/684364541.db2.gz	FMLZCWRRYQJAEN-STQMWFEESA-N	0	3	307.442	2.035	10	0		DEAEHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@@H]2CCOC[C@@H]2C)c1	ZINC000192510734	684451641	/nfs/dbraw/zinc/45/16/41/684451641.db2.gz	IJLVAIVLTKFKMO-NWANDNLSSA-N	0	3	300.358	2.315	10	0		DEAEHN
O[C@H](CN1CCC(OC[C@@H]2CCCCO2)CC1)c1cccnc1	ZINC000878173176	690335232	/nfs/dbraw/zinc/33/52/32/690335232.db2.gz	PUHFKSNOFDLRFT-ZWKOTPCHSA-N	0	3	320.433	2.165	10	0		DEAEHN
CN1C[C@@H](CCNCc2sccc2Br)CC1=O	ZINC000723553272	777121436	/nfs/dbraw/zinc/12/14/36/777121436.db2.gz	RQKBYGZBFOUGMZ-VIFPVBQESA-N	0	3	317.252	2.469	10	0		DEAEHN
C[C@@H]1C[C@@H](CNCc2nc(Br)c[nH]2)C[C@H](C)O1	ZINC000724286388	777271988	/nfs/dbraw/zinc/27/19/88/777271988.db2.gz	DPYLHVRHDONAFA-ILWJIGKKSA-N	0	3	302.216	2.465	10	0		DEAEHN
Cn1nc(Br)cc1CNC[C@H]1CC[C@H](C2CC2)O1	ZINC000722321073	778616132	/nfs/dbraw/zinc/61/61/32/778616132.db2.gz	PESMIMMTPMSNFH-VXGBXAGGSA-N	0	3	314.227	2.230	10	0		DEAEHN
C[C@H](CCNCc1cnn(C)c1Cl)NC(=O)OC(C)(C)C	ZINC000712414677	792186775	/nfs/dbraw/zinc/18/67/75/792186775.db2.gz	KZRYTTYUUPZREN-SNVBAGLBSA-N	0	3	316.833	2.466	10	0		DEAEHN
Cc1ccc([O-])c(C[NH2+]CC2CC(NC(=O)OC(C)(C)C)C2)n1	ZINC000715080651	792382043	/nfs/dbraw/zinc/38/20/43/792382043.db2.gz	LQJQBNLJXLIIIM-UHFFFAOYSA-N	0	3	321.421	2.489	10	0		DEAEHN
COc1ccc(CNC2CC(S(C)(=O)=O)C2)cc1Cl	ZINC000715220976	792405996	/nfs/dbraw/zinc/40/59/96/792405996.db2.gz	PTSZCXHSRATIMF-UHFFFAOYSA-N	0	3	303.811	2.014	10	0		DEAEHN
CCCN(CCN[C@@H]1CCC1(OC)OC)C(=O)OC(C)(C)C	ZINC000710946357	1081177697	/nfs/dbraw/zinc/17/76/97/1081177697.db2.gz	JGICLJAWSHSHPB-CYBMUJFWSA-N	0	3	316.442	2.375	10	0		DEAEHN
CN(C)C[C@H](N)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000702415937	1086432199	/nfs/dbraw/zinc/43/21/99/1086432199.db2.gz	DVACHMJTRGTCFK-JTQLQIEISA-N	0	3	309.719	2.186	10	0		DEAEHN
COC[C@H](C)OC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C	ZINC000704490097	1086582997	/nfs/dbraw/zinc/58/29/97/1086582997.db2.gz	QBYSEAFXEYRBCO-DZKIICNBSA-N	0	3	306.406	2.411	10	0		DEAEHN
Cn1ncc(Br)c1CNCC[C@H]1CCSC1	ZINC000704844503	1086593332	/nfs/dbraw/zinc/59/33/32/1086593332.db2.gz	JVWDWVGZEVQTTH-VIFPVBQESA-N	0	3	304.257	2.415	10	0		DEAEHN
COC(OC)C(=O)N[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000709631015	1086683783	/nfs/dbraw/zinc/68/37/83/1086683783.db2.gz	AJXKVHRXBQJOGN-MRXNPFEDSA-N	0	3	320.433	2.166	10	0		DEAEHN
COCC(C)(C)CCNCc1c(Br)cnn1C	ZINC000718686907	1088623845	/nfs/dbraw/zinc/62/38/45/1088623845.db2.gz	UKAIRIDBALIRNT-UHFFFAOYSA-N	0	3	304.232	2.335	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N(C)[C@H]2CCN(C)C[C@H]2C)cc1	ZINC000278250029	214047591	/nfs/dbraw/zinc/04/75/91/214047591.db2.gz	BWFBMGOPMYPALM-DYVFJYSZSA-N	0	3	317.433	2.082	10	0		DEAEHN
CC(C)(CCS(C)(=O)=O)NCc1cc(-c2ccccc2)n[nH]1	ZINC000136251337	282084865	/nfs/dbraw/zinc/08/48/65/282084865.db2.gz	KJWUMCRXEAADOQ-UHFFFAOYSA-N	0	3	321.446	2.380	10	0		DEAEHN
Cc1cc(C)c([C@@H](N)CSCCS(C)(=O)=O)c(C)c1	ZINC000081768844	192322412	/nfs/dbraw/zinc/32/24/12/192322412.db2.gz	QFVMDWHIHXTAGU-ZDUSSCGKSA-N	0	3	301.477	2.389	10	0		DEAEHN
CN[C@H](CSCCS(C)(=O)=O)c1ccc(C)c(C)c1	ZINC000081769001	192323342	/nfs/dbraw/zinc/32/33/42/192323342.db2.gz	BNYQDNUWXPXPPX-CQSZACIVSA-N	0	3	301.477	2.342	10	0		DEAEHN
Cn1ccnc1SC[C@H](N)c1ccc2c(c1)OCCCO2	ZINC000081840564	192331145	/nfs/dbraw/zinc/33/11/45/192331145.db2.gz	YENPFNPZGQCNPQ-LBPRGKRZSA-N	0	3	305.403	2.374	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2ccc3c(c2)COC(C)(C)O3)CCO1	ZINC000186248635	282127523	/nfs/dbraw/zinc/12/75/23/282127523.db2.gz	PQCUOZMETGTDJQ-MRXNPFEDSA-N	0	3	320.433	2.094	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cnn(CC(F)(F)F)c2)C1	ZINC000151920437	282130347	/nfs/dbraw/zinc/13/03/47/282130347.db2.gz	RCRSUQHQVQITCI-JTQLQIEISA-N	0	3	319.331	2.051	10	0		DEAEHN
CCN[C@H](C)CS(=O)(=O)c1ccccc1Br	ZINC000081931843	192340657	/nfs/dbraw/zinc/34/06/57/192340657.db2.gz	YAHGKPLDQJSXLR-SECBINFHSA-N	0	3	306.225	2.221	10	0		DEAEHN
CS(=O)(=O)CCSc1cc(Br)ccc1CN	ZINC000082619239	185191105	/nfs/dbraw/zinc/19/11/05/185191105.db2.gz	FMFHKOCICNCXIQ-UHFFFAOYSA-N	0	3	324.265	2.045	10	0		DEAEHN
CC[C@@H]1CNCCN1c1ccccc1I	ZINC000083086711	185213147	/nfs/dbraw/zinc/21/31/47/185213147.db2.gz	VBAGBOLHKSTBQQ-SNVBAGLBSA-N	0	3	316.186	2.479	10	0		DEAEHN
Cc1ccc(SCCNC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170826699	282180615	/nfs/dbraw/zinc/18/06/15/282180615.db2.gz	MVHSMTCQAYUHBT-CQSZACIVSA-N	0	3	307.463	2.433	10	0		DEAEHN
C[C@H]1CN(c2ccnc3cc(F)cnc32)CCN1CC(C)(C)O	ZINC000286575540	219063136	/nfs/dbraw/zinc/06/31/36/219063136.db2.gz	GMMIOFQFPGBQGY-LBPRGKRZSA-N	0	3	318.396	2.050	10	0		DEAEHN
COc1ccc(Br)cc1C[C@H](N)c1ccn(C)n1	ZINC000087424103	185224428	/nfs/dbraw/zinc/22/44/28/185224428.db2.gz	FEJXIMWWEAJEBQ-NSHDSACASA-N	0	3	310.195	2.434	10	0		DEAEHN
CC(C)[C@@H](N)CS(=O)(=O)c1ccc(Br)cc1	ZINC000087539926	185227875	/nfs/dbraw/zinc/22/78/75/185227875.db2.gz	UGVBRVXFKGVGEE-NSHDSACASA-N	0	3	306.225	2.206	10	0		DEAEHN
COc1cc(Cl)c([C@@H](N)CC(C)(C)C(N)=O)cc1OC	ZINC000087722289	185231012	/nfs/dbraw/zinc/23/10/12/185231012.db2.gz	IFLCUCHNIDNWGF-JTQLQIEISA-N	0	3	300.786	2.259	10	0		DEAEHN
Cc1ccc(CN)cc1S(=O)(=O)N1CCC[C@@H]2CCC[C@@H]21	ZINC000087768835	185231415	/nfs/dbraw/zinc/23/14/15/185231415.db2.gz	RENQPFZLNGDDAO-GJZGRUSLSA-N	0	3	308.447	2.407	10	0		DEAEHN
NN=c1nccc(NCc2sccc2Br)[nH]1	ZINC000087896052	185235736	/nfs/dbraw/zinc/23/57/36/185235736.db2.gz	VXABQMIAFJOWLG-UHFFFAOYSA-N	0	3	300.185	2.198	10	0		DEAEHN
COc1cc(C)c(Br)cc1[C@@H](N)CCC(N)=O	ZINC000088078819	185238997	/nfs/dbraw/zinc/23/89/97/185238997.db2.gz	UETLYMWEWOKOFB-JTQLQIEISA-N	0	3	301.184	2.031	10	0		DEAEHN
O=S1(=O)CC[C@H](N[C@H]2CCCc3c4ccccc4[nH]c32)C1	ZINC000087816050	185232461	/nfs/dbraw/zinc/23/24/61/185232461.db2.gz	TXTBAHVOFPRVIL-NHYWBVRUSA-N	0	3	304.415	2.322	10	0		DEAEHN
CNCc1ccn(Cc2cc(OC)ccc2Br)n1	ZINC000087799512	185232695	/nfs/dbraw/zinc/23/26/95/185232695.db2.gz	GKBVWNBBCUAFAI-UHFFFAOYSA-N	0	3	310.195	2.422	10	0		DEAEHN
COc1cc(CNC[C@@H](C)CO)cc(Br)c1OC	ZINC000088195354	185241456	/nfs/dbraw/zinc/24/14/56/185241456.db2.gz	ZZQBUWOBSZMBSP-SECBINFHSA-N	0	3	318.211	2.184	10	0		DEAEHN
C[C@@H](CNC(=O)NC[C@H]1CCCN1C)c1ccc(F)cc1F	ZINC000174351482	282193628	/nfs/dbraw/zinc/19/36/28/282193628.db2.gz	ASBINLYGQMCIRW-WCQYABFASA-N	0	3	311.376	2.462	10	0		DEAEHN
CN(C)C[C@H](O)CNc1cc(Cl)ccc1Br	ZINC000088123116	185239959	/nfs/dbraw/zinc/23/99/59/185239959.db2.gz	AVOYDAPTYYIAHF-SECBINFHSA-N	0	3	307.619	2.437	10	0		DEAEHN
CN(C)C[C@H](O)CNc1c2nsnc2c(Cl)cc1Cl	ZINC000088119936	185240052	/nfs/dbraw/zinc/24/00/52/185240052.db2.gz	FTFMWKOXRHIXFV-ZCFIWIBFSA-N	0	3	321.233	2.333	10	0		DEAEHN
CCN[C@H]1CCCN(c2c3nsnc3ccc2Cl)C1=O	ZINC000088128039	185240495	/nfs/dbraw/zinc/24/04/95/185240495.db2.gz	ACNZVPANARROAR-JTQLQIEISA-N	0	3	310.810	2.450	10	0		DEAEHN
CC[C@H](C)C[C@H](C)NS(=O)(=O)c1cccc(F)c1CN	ZINC000088299315	185245100	/nfs/dbraw/zinc/24/51/00/185245100.db2.gz	PVKGVPNXHCFMTN-QWRGUYRKSA-N	0	3	302.415	2.387	10	0		DEAEHN
COC(=O)CS(=O)(=O)[C@H]1CCCCCCCCCC[C@@H]1N	ZINC000081976049	192348596	/nfs/dbraw/zinc/34/85/96/192348596.db2.gz	OQMXAQCYJXOAEZ-KBPBESRZSA-N	0	3	319.467	2.185	10	0		DEAEHN
CN[C@@H](Cc1ccc2ccccc2n1)C(C)(C)S(C)(=O)=O	ZINC000088519225	185254659	/nfs/dbraw/zinc/25/46/59/185254659.db2.gz	MHJUPTWJNKSWKR-HNNXBMFYSA-N	0	3	306.431	2.189	10	0		DEAEHN
CCC(C)(C)[C@@H]1CC[C@@H](N)[C@H](S(=O)(=O)CCCOC)C1	ZINC000081986384	192349110	/nfs/dbraw/zinc/34/91/10/192349110.db2.gz	LRHZHTUOBBUMSL-MGPQQGTHSA-N	0	3	305.484	2.370	10	0		DEAEHN
CCc1noc(CC)c1CNC(=O)N1CCCN(C2CC2)CC1	ZINC000088631340	185260455	/nfs/dbraw/zinc/26/04/55/185260455.db2.gz	JTZFIHXYOXGFCR-UHFFFAOYSA-N	0	3	320.437	2.179	10	0		DEAEHN
CCN(C)CCNC(=O)c1sc2nc(C)cc(C)c2c1N	ZINC000088643131	185261410	/nfs/dbraw/zinc/26/14/10/185261410.db2.gz	CDUXSZYOEZQRLH-UHFFFAOYSA-N	0	3	306.435	2.177	10	0		DEAEHN
CCOC(=O)[C@@H]1CNCCN1[C@@H](C)c1ccc(SC)cc1	ZINC000088657994	185261846	/nfs/dbraw/zinc/26/18/46/185261846.db2.gz	OKMGSGSPFZUQDI-WFASDCNBSA-N	0	3	308.447	2.306	10	0		DEAEHN
CC[C@H](CS(=O)(=O)c1cccc(Br)c1)NC	ZINC000081982831	192349415	/nfs/dbraw/zinc/34/94/15/192349415.db2.gz	ULRBSCYOCUICFV-SNVBAGLBSA-N	0	3	306.225	2.221	10	0		DEAEHN
CN[C@H]1COC[C@@H]1c1nc(-c2cccc(Br)c2)no1	ZINC000090423181	185295391	/nfs/dbraw/zinc/29/53/91/185295391.db2.gz	NWEXMCLCTRTLLO-QWRGUYRKSA-N	0	3	324.178	2.201	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@]2(C)COC[C@H]2N)c(Br)c1	ZINC000090580190	185305016	/nfs/dbraw/zinc/30/50/16/185305016.db2.gz	KOLSQVAFSHXDLP-YPMHNXCESA-N	0	3	313.195	2.060	10	0		DEAEHN
C(CN1CCC[C@H](c2nnc(C3CC3)[nH]2)C1)OC1CCOCC1	ZINC000625277649	365710797	/nfs/dbraw/zinc/71/07/97/365710797.db2.gz	JPMJJUOXFSXPHU-AWEZNQCLSA-N	0	3	320.437	2.057	10	0		DEAEHN
C[C@]1(C(=O)Nc2nc3ccc(Cl)cc3s2)COC[C@@H]1N	ZINC000090580318	185304907	/nfs/dbraw/zinc/30/49/07/185304907.db2.gz	LFBCPXSGCSWRBI-GWCFXTLKSA-N	0	3	311.794	2.252	10	0		DEAEHN
CN(C)C[C@H]1CSCCCN1C(=O)c1cc(C2CC2)on1	ZINC000090700169	185310487	/nfs/dbraw/zinc/31/04/87/185310487.db2.gz	OZESDRCBGCOFQS-LBPRGKRZSA-N	0	3	309.435	2.061	10	0		DEAEHN
COc1cccc(CC(=O)N2CCCSC[C@@H]2CN(C)C)c1	ZINC000090700117	185310582	/nfs/dbraw/zinc/31/05/82/185310582.db2.gz	NTUWWGOJLCUAFI-HNNXBMFYSA-N	0	3	322.474	2.133	10	0		DEAEHN
Cc1cc(CN[C@]2(C)CCS(=O)(=O)C2)c2ccccc2n1	ZINC000092345559	185313564	/nfs/dbraw/zinc/31/35/64/185313564.db2.gz	WDDDCIIFNCXYEM-MRXNPFEDSA-N	0	3	304.415	2.210	10	0		DEAEHN
CCCN[C@@H]1c2cc(OC)ccc2CC[C@H]1S(=O)(=O)CC	ZINC000092388569	185315260	/nfs/dbraw/zinc/31/52/60/185315260.db2.gz	JDSMTJLKZFMYEB-HZPDHXFCSA-N	0	3	311.447	2.485	10	0		DEAEHN
Nc1nc2cc(Br)cnc2n1[C@H]1CCN(C2CC2)C1	ZINC000092575671	185326707	/nfs/dbraw/zinc/32/67/07/185326707.db2.gz	ZARLQIJDSZYXIJ-JTQLQIEISA-N	0	3	322.210	2.185	10	0		DEAEHN
CNc1nc(CN(C)C[C@H]2CCCN2C)nc2sccc21	ZINC000092669282	185333136	/nfs/dbraw/zinc/33/31/36/185333136.db2.gz	SNHWOBHWOIZUCH-LLVKDONJSA-N	0	3	305.451	2.259	10	0		DEAEHN
CN(C[C@@H]1CCCN1C)C(=O)C1(C(N)=S)CCCCCC1	ZINC000092631731	185330261	/nfs/dbraw/zinc/33/02/61/185330261.db2.gz	CUIXROXGDJBUFX-ZDUSSCGKSA-N	0	3	311.495	2.166	10	0		DEAEHN
COCCNC/C(=C\c1sc(N(C)C)nc1OC)C(C)C	ZINC000092728676	185336374	/nfs/dbraw/zinc/33/63/74/185336374.db2.gz	KAWPUEOGWBDYKB-FMIVXFBMSA-N	0	3	313.467	2.493	10	0		DEAEHN
Cc1sc(CN)cc1S(=O)(=O)NC1C(C)(C)C1(C)C	ZINC000092833333	185344962	/nfs/dbraw/zinc/34/49/62/185344962.db2.gz	KEJGSSBSMPSGCR-UHFFFAOYSA-N	0	3	302.465	2.228	10	0		DEAEHN
Cc1nn(C)cc1[C@@H](C)N[C@@H]1CCc2nnc(C(C)C)n2C1	ZINC000180500994	282299613	/nfs/dbraw/zinc/29/96/13/282299613.db2.gz	GUDSZHJXTBYUDY-DGCLKSJQSA-N	0	3	302.426	2.109	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)CCC1CCN(C(C)=O)CC1	ZINC000080203256	539377001	/nfs/dbraw/zinc/37/70/01/539377001.db2.gz	BQGMSMNEZINOJJ-QGZVFWFLSA-N	0	3	323.481	2.016	10	0		DEAEHN
CCN1CCN(Cc2ccc(CNCc3cocn3)cc2)CC1	ZINC000192287438	282341284	/nfs/dbraw/zinc/34/12/84/282341284.db2.gz	ZOMOEPROEGOLBH-UHFFFAOYSA-N	0	3	314.433	2.102	10	0		DEAEHN
C[C@@H](CCc1ccc(O)cc1)NC(=O)NC[C@@H]1CCCN1C	ZINC000195124540	282369354	/nfs/dbraw/zinc/36/93/54/282369354.db2.gz	LXGIIBZLDANGQE-ZFWWWQNUSA-N	0	3	305.422	2.107	10	0		DEAEHN
CC(C)N(Cc1cccc(Cl)c1)C(=O)COC1(C)CNC1	ZINC000098060953	539435805	/nfs/dbraw/zinc/43/58/05/539435805.db2.gz	QTOCWERAKLKRAH-UHFFFAOYSA-N	0	3	310.825	2.456	10	0		DEAEHN
CCc1nc(CNC(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)cs1	ZINC000125404898	539472778	/nfs/dbraw/zinc/47/27/78/539472778.db2.gz	CXPMJHAFKAEJBS-WDEREUQCSA-N	0	3	308.451	2.130	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NC(=O)N2CC[C@@H](N(C)C)C2)C12CCCCC2	ZINC000246553941	282450508	/nfs/dbraw/zinc/45/05/08/282450508.db2.gz	GWONHEWGXRSZRZ-BZUAXINKSA-N	0	3	323.481	2.460	10	0		DEAEHN
CO[C@@H]1CC[C@@H](NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000249028125	282544668	/nfs/dbraw/zinc/54/46/68/282544668.db2.gz	LGXHKOCNRJJQKB-IXDOHACOSA-N	0	3	319.449	2.026	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CC[C@H](c2ccccc2CO)C1	ZINC000616612688	362897968	/nfs/dbraw/zinc/89/79/68/362897968.db2.gz	QQJRRBLCCXOWRL-AWEZNQCLSA-N	0	3	320.433	2.493	10	0		DEAEHN
Fc1cc(F)cc(-c2cc3c(N4CCNCC4)nccn3n2)c1	ZINC000070459162	190897755	/nfs/dbraw/zinc/89/77/55/190897755.db2.gz	TWXMQKPHGHRQAH-UHFFFAOYSA-N	0	3	315.327	2.084	10	0		DEAEHN
CN(CC1CCN(C)CC1)C(=O)NCc1ccc(Cl)cn1	ZINC000181096649	539649730	/nfs/dbraw/zinc/64/97/30/539649730.db2.gz	GABYRGSOIPELGN-UHFFFAOYSA-N	0	3	310.829	2.218	10	0		DEAEHN
C[C@@H](OCC1CC1)C(=O)N[C@@H](C)CN(C)Cc1ccccc1	ZINC000182519901	539657339	/nfs/dbraw/zinc/65/73/39/539657339.db2.gz	QWUBRABEZVJFTI-LSDHHAIUSA-N	0	3	304.434	2.438	10	0		DEAEHN
COc1ccc([C@H](C)NCC2(CO)CCC2)cc1NC(C)=O	ZINC000184535996	539668392	/nfs/dbraw/zinc/66/83/92/539668392.db2.gz	JTHCJAWULZDOFX-LBPRGKRZSA-N	0	3	306.406	2.467	10	0		DEAEHN
COC(=O)COC[C@@H](N)c1sc(C)cc1Br	ZINC000083678643	192377669	/nfs/dbraw/zinc/37/76/69/192377669.db2.gz	WYXRMBQPWVXGCJ-MRVPVSSYSA-N	0	3	308.197	2.008	10	0		DEAEHN
Cc1c(C(=O)NCC2CCN(c3ccncc3)CC2)ccn1C	ZINC000192573495	539707855	/nfs/dbraw/zinc/70/78/55/539707855.db2.gz	GVWBMGJUGHERRK-UHFFFAOYSA-N	0	3	312.417	2.375	10	0		DEAEHN
CCOc1ccc([C@@H](C[S@](=O)C2CCOCC2)NC)cc1	ZINC000084054951	192398129	/nfs/dbraw/zinc/39/81/29/192398129.db2.gz	DHKPGLDBMXVFOK-IIBYNOLFSA-N	0	3	311.447	2.274	10	0		DEAEHN
CC[C@H](N)c1nc2cc(C)ccc2n1CCN1CCOCC1	ZINC000071666965	191001272	/nfs/dbraw/zinc/00/12/72/191001272.db2.gz	PINAJQXFHOWZHG-AWEZNQCLSA-N	0	3	302.422	2.087	10	0		DEAEHN
CNCc1cc(F)c(F)c(S(=O)(=O)N2CCC[C@@H](C)C2)c1	ZINC000138269255	186015535	/nfs/dbraw/zinc/01/55/35/186015535.db2.gz	NRQICHYNWQMDJF-SNVBAGLBSA-N	0	3	318.389	2.105	10	0		DEAEHN
CN[C@H](Cc1c(Br)c(C)nn1C)c1cncs1	ZINC000147637273	186040628	/nfs/dbraw/zinc/04/06/28/186040628.db2.gz	PFXFETRASOMMJD-MRVPVSSYSA-N	0	3	315.240	2.451	10	0		DEAEHN
NC[C@@]1(Nc2ccccc2)CCS(=O)(=O)c2ccccc21	ZINC000147658632	186040684	/nfs/dbraw/zinc/04/06/84/186040684.db2.gz	IHOGGQYFFLTDDG-INIZCTEOSA-N	0	3	302.399	2.130	10	0		DEAEHN
CC[C@@H]1N[C@@H](c2cccs2)N([C@@H]2CCCN(CC)C2)C1=O	ZINC000144296360	186034618	/nfs/dbraw/zinc/03/46/18/186034618.db2.gz	LRFGYZGKJOUNPU-VNHYZAJKSA-N	0	3	307.463	2.441	10	0		DEAEHN
O=C1C[C@@H](NC[C@@H]2CCCS2)C(=O)N1C1CCCCCC1	ZINC000149831575	186053065	/nfs/dbraw/zinc/05/30/65/186053065.db2.gz	OIRIPVGWANOYJL-UONOGXRCSA-N	0	3	310.463	2.322	10	0		DEAEHN
CN[C@H](c1cccc(OC(F)(F)F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000150093707	186054755	/nfs/dbraw/zinc/05/47/55/186054755.db2.gz	GZPINDMAPOUQIS-CMPLNLGQSA-N	0	3	323.336	2.280	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000150787995	186066059	/nfs/dbraw/zinc/06/60/59/186066059.db2.gz	YMKZLNWPQTYKJB-GOEBONIOSA-N	0	3	317.433	2.087	10	0		DEAEHN
CCc1cccc(NC(=O)C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000150795897	186066243	/nfs/dbraw/zinc/06/62/43/186066243.db2.gz	RXJJENMIXUQEPP-XJKSGUPXSA-N	0	3	317.433	2.032	10	0		DEAEHN
Fc1ccc(COC[C@H]2CNCCO2)c(Br)c1	ZINC000163979880	186144820	/nfs/dbraw/zinc/14/48/20/186144820.db2.gz	ZPKDEUGLNGYOEY-LLVKDONJSA-N	0	3	304.159	2.093	10	0		DEAEHN
CC1CC(NS(=O)(=O)c2cc(F)c(Cl)c(CN)c2)C1	ZINC000164000918	186145734	/nfs/dbraw/zinc/14/57/34/186145734.db2.gz	KBOHDQRCKNYPSN-UHFFFAOYSA-N	0	3	306.790	2.015	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1ccc(Br)cc1C	ZINC000159552471	186127031	/nfs/dbraw/zinc/12/70/31/186127031.db2.gz	QHPYZCSFWIXLKR-LLVKDONJSA-N	0	3	315.211	2.450	10	0		DEAEHN
CSc1cc2c(cc1CNC[C@H](C)[S@@](C)=O)OCCO2	ZINC000159651446	186133199	/nfs/dbraw/zinc/13/31/99/186133199.db2.gz	QNRHMCURVQSFLG-FVINQWEUSA-N	0	3	315.460	2.036	10	0		DEAEHN
C[C@H]1CN(c2ccc(C(F)(F)F)c(C(N)=S)c2)CCN1C	ZINC000164215957	186152917	/nfs/dbraw/zinc/15/29/17/186152917.db2.gz	FAZICUSYAFRYRN-VIFPVBQESA-N	0	3	317.380	2.480	10	0		DEAEHN
N[C@H](C[C@@H]1CCS(=O)(=O)C1)c1cscc1Br	ZINC000164381630	186158006	/nfs/dbraw/zinc/15/80/06/186158006.db2.gz	SWPVFICRSZIOFN-OIBJUYFYSA-N	0	3	324.265	2.335	10	0		DEAEHN
CN1CCN(CCNCc2c(Cl)oc3ccccc32)CC1	ZINC000164460763	186159212	/nfs/dbraw/zinc/15/92/12/186159212.db2.gz	CDAAOQMBIXNZNW-UHFFFAOYSA-N	0	3	307.825	2.423	10	0		DEAEHN
CNC(=O)[C@H](C)CN(C)Cc1ccc(Br)c(F)c1	ZINC000177845386	186192043	/nfs/dbraw/zinc/19/20/43/186192043.db2.gz	HLIVTRUTFNTKHM-SECBINFHSA-N	0	3	317.202	2.402	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)Cc2cc(-c3cnn(C)c3)no2)C1	ZINC000187992577	186240296	/nfs/dbraw/zinc/24/02/96/186240296.db2.gz	NUQJRBKEVQHXIF-WBMJQRKESA-N	0	3	304.394	2.058	10	0		DEAEHN
CCc1cnc(CNC(=O)NCCN2CCCC[C@@H]2C)s1	ZINC000080623298	192174440	/nfs/dbraw/zinc/17/44/40/192174440.db2.gz	KDTZDHGKDNFDME-LBPRGKRZSA-N	0	3	310.467	2.379	10	0		DEAEHN
Cc1cc(C)cc(CCNC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000172644072	198130608	/nfs/dbraw/zinc/13/06/08/198130608.db2.gz	RCFLYNCKCOFXKL-QGZVFWFLSA-N	0	3	301.434	2.336	10	0		DEAEHN
C[C@H]1[C@@H](NC(=O)c2ncccc2N)CCN1Cc1ccccc1	ZINC000309734762	539878601	/nfs/dbraw/zinc/87/86/01/539878601.db2.gz	QHNOROUYLYVCNP-BBRMVZONSA-N	0	3	310.401	2.057	10	0		DEAEHN
Cc1cc2cc(C(=O)N3CCO[C@H](CN(C)C)C3)oc2cc1C	ZINC000173521275	198223236	/nfs/dbraw/zinc/22/32/36/198223236.db2.gz	XEDKHOICLXWNJC-OAHLLOKOSA-N	0	3	316.401	2.452	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCCc2cccc(F)c2)CCN1C	ZINC000173541685	198225256	/nfs/dbraw/zinc/22/52/56/198225256.db2.gz	HOULPRGPKIUSMX-CZUORRHYSA-N	0	3	307.413	2.492	10	0		DEAEHN
Cc1ccccc1O[C@H](C)CNC(=O)N1CC[C@@H](N(C)C)C1	ZINC000173916930	198267901	/nfs/dbraw/zinc/26/79/01/198267901.db2.gz	OGYCRSFAPCDYGU-HUUCEWRRSA-N	0	3	305.422	2.108	10	0		DEAEHN
Cc1nc(C)c(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)o1	ZINC000073010018	191268706	/nfs/dbraw/zinc/26/87/06/191268706.db2.gz	ZPTXYKVYUFMTLL-HNNXBMFYSA-N	0	3	301.390	2.194	10	0		DEAEHN
COCc1cccc(CNC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000173813610	198256134	/nfs/dbraw/zinc/25/61/34/198256134.db2.gz	PJEGUFAZTABUIY-YOEHRIQHSA-N	0	3	319.449	2.457	10	0		DEAEHN
COc1ccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1F	ZINC000174004232	198279616	/nfs/dbraw/zinc/27/96/16/198279616.db2.gz	IVLVLRWPPFJEIT-GXTWGEPZSA-N	0	3	323.412	2.458	10	0		DEAEHN
C[C@H](CCOc1ccccc1)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000174295819	198316399	/nfs/dbraw/zinc/31/63/99/198316399.db2.gz	USMARJMDVIBHDT-HZPDHXFCSA-N	0	3	302.418	2.398	10	0		DEAEHN
Cc1cccc(O[C@H](C)CNC(=O)NC[C@@H]2CCCN2C)c1	ZINC000174351324	198323836	/nfs/dbraw/zinc/32/38/36/198323836.db2.gz	ISCNMCCSUJWQHQ-CABCVRRESA-N	0	3	305.422	2.156	10	0		DEAEHN
CCCC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000174853350	198393058	/nfs/dbraw/zinc/39/30/58/198393058.db2.gz	ZEAICRYKDCIWMS-KRWDZBQOSA-N	0	3	304.434	2.348	10	0		DEAEHN
COc1cccc(F)c1[C@H](C)NC(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000074267401	355018754	/nfs/dbraw/zinc/01/87/54/355018754.db2.gz	SYNDMDMBEQEKMD-NWDGAFQWSA-N	0	3	321.396	2.431	10	0		DEAEHN
CCC[C@@H](N)C(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1	ZINC000236819711	202025540	/nfs/dbraw/zinc/02/55/40/202025540.db2.gz	ZXHCJVJGAKFSGX-GFCCVEGCSA-N	0	3	307.785	2.046	10	0		DEAEHN
CNS(=O)(=O)CCCN1CCCCC[C@@H]1c1ccco1	ZINC000076804909	355168891	/nfs/dbraw/zinc/16/88/91/355168891.db2.gz	DLYBSDULKFKZMV-CYBMUJFWSA-N	0	3	300.424	2.136	10	0		DEAEHN
COC(C)(C)C[C@H](C)NC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000073722364	191346488	/nfs/dbraw/zinc/34/64/88/191346488.db2.gz	ZIBUHHXAMDBZRA-UONOGXRCSA-N	0	3	301.475	2.466	10	0		DEAEHN
O=C1CC[C@@H](CN[C@H]2CCc3sc(Br)cc32)N1	ZINC000384028233	540125419	/nfs/dbraw/zinc/12/54/19/540125419.db2.gz	KZDBJLOGBBSGKP-CBAPKCEASA-N	0	3	315.236	2.366	10	0		DEAEHN
CO[C@]1(C)C[C@@H](NC(=O)N2CCCN(C3CC3)CC2)C1(C)C	ZINC000074943818	191392644	/nfs/dbraw/zinc/39/26/44/191392644.db2.gz	SXRNRVGFCFCQLT-RHSMWYFYSA-N	0	3	309.454	2.070	10	0		DEAEHN
NC[C@@H](NC(=O)c1ccccc1Br)C(F)(F)F	ZINC000401872493	540143158	/nfs/dbraw/zinc/14/31/58/540143158.db2.gz	LPOIVXLDJAEBCD-MRVPVSSYSA-N	0	3	311.101	2.069	10	0		DEAEHN
NC[C@H](NC(=O)c1cccn1Cc1ccccc1)C(F)(F)F	ZINC000401765474	540142405	/nfs/dbraw/zinc/14/24/05/540142405.db2.gz	YBCQETZBOJPJFY-ZDUSSCGKSA-N	0	3	311.307	2.156	10	0		DEAEHN
NC[C@H](NC(=O)c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000401715592	540142632	/nfs/dbraw/zinc/14/26/32/540142632.db2.gz	KSWZZGRLAAHDSQ-QMMMGPOBSA-N	0	3	300.202	2.325	10	0		DEAEHN
C[C@H](CSC(C)(C)C)N[C@H]1CCN(C2CCOCC2)C1=O	ZINC000367413107	283113672	/nfs/dbraw/zinc/11/36/72/283113672.db2.gz	PEEJIZBAPQFKHO-OCCSQVGLSA-N	0	3	314.495	2.276	10	0		DEAEHN
Nc1nc2cc(N3CCOCC3)ccc2c(N2CCCCC2)n1	ZINC000118857339	355782225	/nfs/dbraw/zinc/78/22/25/355782225.db2.gz	JWHYYNGBCFLTOK-UHFFFAOYSA-N	0	3	313.405	2.039	10	0		DEAEHN
Cc1cccc(CNC(=O)N[C@@H](CN(C)C)c2ccccc2)n1	ZINC000123738394	355806109	/nfs/dbraw/zinc/80/61/09/355806109.db2.gz	VJLANFIAIKTBPT-KRWDZBQOSA-N	0	3	312.417	2.492	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCCOc1cccc(Cl)c1	ZINC000139674705	355878685	/nfs/dbraw/zinc/87/86/85/355878685.db2.gz	KDNGUPYKOAKQEZ-ZDUSSCGKSA-N	0	3	311.813	2.112	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@H](C)Cc2ccc(OC)cc2)C1	ZINC000179338962	356021917	/nfs/dbraw/zinc/02/19/17/356021917.db2.gz	OBDRMUXVRWXRMF-HOCLYGCPSA-N	0	3	304.434	2.474	10	0		DEAEHN
C[C@@H](NC[C@H](O)COC(C)(C)C)c1ccc(-n2ccnn2)cc1	ZINC000182051053	356106974	/nfs/dbraw/zinc/10/69/74/356106974.db2.gz	KWNDHCFXFFSNQL-CJNGLKHVSA-N	0	3	318.421	2.094	10	0		DEAEHN
C[C@@H](NC[C@@H](O)COC(C)(C)C)c1ccc(-n2ccnn2)cc1	ZINC000182051092	356107282	/nfs/dbraw/zinc/10/72/82/356107282.db2.gz	KWNDHCFXFFSNQL-CZUORRHYSA-N	0	3	318.421	2.094	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)NCC2(C)CCCCCC2)CCO1	ZINC000181715196	356091804	/nfs/dbraw/zinc/09/18/04/356091804.db2.gz	UOMQQNPNWYYFPZ-OAHLLOKOSA-N	0	3	311.470	2.319	10	0		DEAEHN
C[C@@H](NCC(=O)N(C)CC1CC1)c1ccccc1-n1cccn1	ZINC000183137235	356161293	/nfs/dbraw/zinc/16/12/93/356161293.db2.gz	XDBCMMQLLAZLEA-CQSZACIVSA-N	0	3	312.417	2.391	10	0		DEAEHN
Cc1cc(C)cc([C@@H]2CCN(CCN3C(=O)CCC3=O)C2)c1	ZINC000183467475	356173212	/nfs/dbraw/zinc/17/32/12/356173212.db2.gz	QJOJWSIFHQTOOB-OAHLLOKOSA-N	0	3	300.402	2.242	10	0		DEAEHN
NCc1ccnc(OC(F)(F)F)c1I	ZINC000238690697	356304957	/nfs/dbraw/zinc/30/49/57/356304957.db2.gz	AAONBBFQRMZZER-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
COC[C@@H](C)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000249784783	356331576	/nfs/dbraw/zinc/33/15/76/356331576.db2.gz	LXHHPXROKBOPSR-SWLSCSKDSA-N	0	3	309.385	2.304	10	0		DEAEHN
C[C@H](N[C@@H](C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1nncn1C	ZINC000400399505	283156625	/nfs/dbraw/zinc/15/66/25/283156625.db2.gz	KFICWALKDICHII-RWMBFGLXSA-N	0	3	323.441	2.111	10	0		DEAEHN
CCNC(CNC(=O)OC(C)(C)C)CNC(=O)OC(C)(C)C	ZINC000306619106	356405040	/nfs/dbraw/zinc/40/50/40/356405040.db2.gz	UGORPSKTCIVDCI-UHFFFAOYSA-N	0	3	317.430	2.014	10	0		DEAEHN
Brc1ccc(CN2CC[C@H]3OCCN[C@@H]3C2)s1	ZINC000404284205	283165126	/nfs/dbraw/zinc/16/51/26/283165126.db2.gz	WTHSUJONCCOBOP-GHMZBOCLSA-N	0	3	317.252	2.073	10	0		DEAEHN
NC[C@H](c1ccc(Cl)c(Cl)c1)N1CCn2cnnc2C1	ZINC000081532722	192284736	/nfs/dbraw/zinc/28/47/36/192284736.db2.gz	QESYZLFJFCEXCH-GFCCVEGCSA-N	0	3	312.204	2.101	10	0		DEAEHN
c1cn([C@@H]2CCCN(CCOCCOc3ccccc3)C2)nn1	ZINC000425497231	283209053	/nfs/dbraw/zinc/20/90/53/283209053.db2.gz	CDZFEYOIMIGMCJ-MRXNPFEDSA-N	0	3	316.405	2.011	10	0		DEAEHN
COc1cc(C[NH2+][C@H]2CO[C@@H](C)C2)cc(Br)c1[O-]	ZINC000402030761	356728554	/nfs/dbraw/zinc/72/85/54/356728554.db2.gz	YUWZIYSAOPZMRM-WCBMZHEXSA-N	0	3	316.195	2.430	10	0		DEAEHN
CC[C@@H](C)CN(C)S(=O)(=O)c1cc(CN)n(C(C)C)c1	ZINC000088952844	192667087	/nfs/dbraw/zinc/66/70/87/192667087.db2.gz	HZEOUETUTBOYNT-GFCCVEGCSA-N	0	3	301.456	2.194	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCc2ccncc2)[C@@H]1c1ccccc1	ZINC000179276704	199008690	/nfs/dbraw/zinc/00/86/90/199008690.db2.gz	HOWOPGGBRJKFEN-IRXDYDNUSA-N	0	3	310.401	2.326	10	0		DEAEHN
CCn1nncc1CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000459366614	283299543	/nfs/dbraw/zinc/29/95/43/283299543.db2.gz	BLCNNLYYCOWRGN-UHFFFAOYSA-N	0	3	313.449	2.394	10	0		DEAEHN
CN(Cc1cnn2ccccc12)[C@@H]1CCCN(c2cccnn2)C1	ZINC000179496720	199044876	/nfs/dbraw/zinc/04/48/76/199044876.db2.gz	GAIYROZJRKUBIB-MRXNPFEDSA-N	0	3	322.416	2.225	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc3c[nH]nc3c2)CCN1CCOC	ZINC000179512127	199048601	/nfs/dbraw/zinc/04/86/01/199048601.db2.gz	LNEFHTWQJMMNIB-MRXNPFEDSA-N	0	3	302.422	2.106	10	0		DEAEHN
COc1ccc([C@H](C)CN2CCN(C[C@@H](C)O)[C@@H](C)C2)cc1	ZINC000180084708	199115321	/nfs/dbraw/zinc/11/53/21/199115321.db2.gz	QRVXRWLDQARHTO-OWCLPIDISA-N	0	3	306.450	2.186	10	0		DEAEHN
COc1ccccc1/C=C/CN1C[C@H](N2CCOCC2)[C@@H](C)C1	ZINC000180230781	199134524	/nfs/dbraw/zinc/13/45/24/199134524.db2.gz	IBXSGTSOJOZRRD-LVPXMUDFSA-N	0	3	316.445	2.361	10	0		DEAEHN
CC[C@@H](N[C@@H]1CCc2nnc(C(C)C)n2C1)c1cnn(C)c1	ZINC000180508193	199168764	/nfs/dbraw/zinc/16/87/64/199168764.db2.gz	MLFOWRQBKFPXIR-ZIAGYGMSSA-N	0	3	302.426	2.191	10	0		DEAEHN
C[C@H](CNC(=O)N(C)[C@@H](C)c1cnn(C)c1)N1CCC(C)CC1	ZINC000180791000	199209469	/nfs/dbraw/zinc/20/94/69/199209469.db2.gz	HQUNUAGKNYZUBH-CABCVRRESA-N	0	3	321.469	2.243	10	0		DEAEHN
CN(C[C@@H]1CCCN(C)C1)C(=O)NCc1ccc(Cl)cn1	ZINC000180825799	199214091	/nfs/dbraw/zinc/21/40/91/199214091.db2.gz	HVDVGBMPDZDRKK-GFCCVEGCSA-N	0	3	310.829	2.218	10	0		DEAEHN
C[C@H](CNC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)c1nccs1	ZINC000187011181	200046940	/nfs/dbraw/zinc/04/69/40/200046940.db2.gz	OHWJPBAWRLPPEP-JHJVBQTASA-N	0	3	310.467	2.371	10	0		DEAEHN
CCSc1cc(CNC(=O)N[C@@H]2CCCN(CC)C2)ccn1	ZINC000187068156	200056114	/nfs/dbraw/zinc/05/61/14/200056114.db2.gz	SAGIFZXTLFUJEE-CQSZACIVSA-N	0	3	322.478	2.477	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N(C)[C@H]1CCN(C)C[C@H]1C	ZINC000187483142	200118264	/nfs/dbraw/zinc/11/82/64/200118264.db2.gz	HYWLNAKERHACBX-IPYPFGDCSA-N	0	3	320.437	2.133	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1ccnc(F)c1F)c1ccccc1	ZINC000187658824	200140703	/nfs/dbraw/zinc/14/07/03/200140703.db2.gz	HYWLDTQIMICMED-ZDUSSCGKSA-N	0	3	305.328	2.393	10	0		DEAEHN
COc1ccc([C@H](C)N[C@H]2C[C@H](O)C2(C)C)cc1NC(C)=O	ZINC000187682873	200143950	/nfs/dbraw/zinc/14/39/50/200143950.db2.gz	DUMPVKPRDJHWGM-HNHYXYPQSA-N	0	3	306.406	2.464	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N1CCC[C@@H](N(C)C)C1	ZINC000187922218	200176493	/nfs/dbraw/zinc/17/64/93/200176493.db2.gz	JWLJULVQJXYUPI-CQSZACIVSA-N	0	3	309.385	2.070	10	0		DEAEHN
Cc1nccnc1[C@H](C)NCCCNC(=O)c1cccs1	ZINC000188197210	200207241	/nfs/dbraw/zinc/20/72/41/200207241.db2.gz	QRJWKFIMWDPADR-NSHDSACASA-N	0	3	304.419	2.317	10	0		DEAEHN
CC(C)C[C@H](CO)N(C)C(=O)NCc1cccc(CN(C)C)c1	ZINC000188393097	200239534	/nfs/dbraw/zinc/23/95/34/200239534.db2.gz	SFYWNFYBWMKWQI-QGZVFWFLSA-N	0	3	321.465	2.297	10	0		DEAEHN
CN(C)CCn1cc(Nc2ncnc3cccc(F)c32)cn1	ZINC000601513260	360059936	/nfs/dbraw/zinc/05/99/36/360059936.db2.gz	FBKRCXJMOPTWIJ-UHFFFAOYSA-N	0	3	300.341	2.271	10	0		DEAEHN
CNS(=O)(=O)c1cccc(CN[C@H]2CC[C@H]2C2CCC2)c1	ZINC000516787300	283523827	/nfs/dbraw/zinc/52/38/27/283523827.db2.gz	JOEMMTZILFNPOI-HOTGVXAUSA-N	0	3	308.447	2.263	10	0		DEAEHN
CO[C@H]1CN(CCCN2C(=O)c3ccccc3C2=O)CC[C@H]1C	ZINC000189353363	200386398	/nfs/dbraw/zinc/38/63/98/200386398.db2.gz	RXOABZFIGBJNNS-CJNGLKHVSA-N	0	3	316.401	2.030	10	0		DEAEHN
C[C@H](NC(=O)N(C)CCN1CCCC1)c1ccc2c(c1)OCO2	ZINC000602986285	360657091	/nfs/dbraw/zinc/65/70/91/360657091.db2.gz	PIHBPIDFTDJANO-ZDUSSCGKSA-N	0	3	319.405	2.214	10	0		DEAEHN
CCCc1ncc(C(=O)Nc2cnn(CCN(C)C)c2)s1	ZINC000607821164	361113755	/nfs/dbraw/zinc/11/37/55/361113755.db2.gz	HMOHWDPUSKHEPG-UHFFFAOYSA-N	0	3	307.423	2.106	10	0		DEAEHN
CCc1ccc(S(=O)(=O)N[C@@H]2CNCC[C@H]2C)cc1CC	ZINC000193407097	201048720	/nfs/dbraw/zinc/04/87/20/201048720.db2.gz	FADNSVRRSKQYMP-MLGOLLRUSA-N	0	3	310.463	2.088	10	0		DEAEHN
O=C(NCc1cnn(-c2ccccc2)c1)C1CCN(C2CC2)CC1	ZINC000193990483	201157253	/nfs/dbraw/zinc/15/72/53/201157253.db2.gz	KPUZMUILYQEDCL-UHFFFAOYSA-N	0	3	324.428	2.363	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCC[C@@H](CCC(=O)OCC)C1	ZINC000611043609	361517796	/nfs/dbraw/zinc/51/77/96/361517796.db2.gz	RMAWHQZMZGPDFI-HOTGVXAUSA-N	0	3	324.465	2.443	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCC[C@H](C(C)(C)C(=O)OC)C1	ZINC000611311383	361578234	/nfs/dbraw/zinc/57/82/34/361578234.db2.gz	MBYAKEMCVACQFM-GJZGRUSLSA-N	0	3	324.465	2.299	10	0		DEAEHN
O=C1[C@H](NC[C@H]2CCC=CO2)CCN1Cc1ccc(F)cc1	ZINC000194885918	201305284	/nfs/dbraw/zinc/30/52/84/201305284.db2.gz	LYDMSNLWVFWHFY-HZPDHXFCSA-N	0	3	304.365	2.209	10	0		DEAEHN
c1cc(CNCCCOC[C@H]2CCOC2)n(-c2ccccc2)n1	ZINC000447933095	239178905	/nfs/dbraw/zinc/17/89/05/239178905.db2.gz	SGOOEUNWEQTDLA-MRXNPFEDSA-N	0	3	315.417	2.405	10	0		DEAEHN
C[C@@H](NC(=O)N1CCCC[C@H](N2CCN(C)CC2)C1)C(C)(C)C	ZINC000091855228	296061032	/nfs/dbraw/zinc/06/10/32/296061032.db2.gz	RHZKTHUFIWSLAK-CVEARBPZSA-N	0	3	324.513	2.233	10	0		DEAEHN
CCOC(=O)c1cc(CNC[C@@H](CO)c2ccccc2)[nH]c1C	ZINC000449176435	240155800	/nfs/dbraw/zinc/15/58/00/240155800.db2.gz	SUTGRXICECXOIO-HNNXBMFYSA-N	0	3	316.401	2.366	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2cc3ccccc3o2)CC12COC2	ZINC000449356687	240397013	/nfs/dbraw/zinc/39/70/13/240397013.db2.gz	CMMJXCGHAGJQGZ-HNNXBMFYSA-N	0	3	315.369	2.444	10	0		DEAEHN
c1cc(CNC[C@@H]2Cc3ccccc3CO2)n(-c2ccncc2)n1	ZINC000623603154	365096584	/nfs/dbraw/zinc/09/65/84/365096584.db2.gz	ONVIJGDUOOXWLC-IBGZPJMESA-N	0	3	320.396	2.498	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)Nc1cc2c(cc1Cl)OCO2	ZINC000091134861	193000528	/nfs/dbraw/zinc/00/05/28/193000528.db2.gz	PANRYCMDQDRHCZ-MRVPVSSYSA-N	0	3	314.794	2.102	10	0		DEAEHN
Cc1nn(-c2cncc(CNC3CC3)n2)c(C)c1Br	ZINC000091422255	193054338	/nfs/dbraw/zinc/05/43/38/193054338.db2.gz	QOLNMMLMRGRGJO-UHFFFAOYSA-N	0	3	322.210	2.294	10	0		DEAEHN
Cc1csc(C2CCN([C@H](C)CN3CCOCC3)CC2)n1	ZINC000091552711	193072928	/nfs/dbraw/zinc/07/29/28/193072928.db2.gz	HRVSDOFKSFEGSP-CQSZACIVSA-N	0	3	309.479	2.352	10	0		DEAEHN
CC[C@@](C)([C@@H](NC)c1cc(Cl)cnc1N)N1CCOCC1	ZINC000091612315	193079474	/nfs/dbraw/zinc/07/94/74/193079474.db2.gz	PYGMOOMRUARWFY-ZFWWWQNUSA-N	0	3	312.845	2.079	10	0		DEAEHN
C[C@@H](NC[C@@H]1CN(C)CCO1)c1cccc(OC(F)F)c1	ZINC000091667719	193088263	/nfs/dbraw/zinc/08/82/63/193088263.db2.gz	HCWLWBCBGTVJJH-BXUZGUMPSA-N	0	3	300.349	2.269	10	0		DEAEHN
CN[C@@H](c1ccccc1OC(F)(F)F)[C@@H]1CN(C)CCO1	ZINC000091717986	193096562	/nfs/dbraw/zinc/09/65/62/193096562.db2.gz	RSNWCVQPQSJPLX-STQMWFEESA-N	0	3	304.312	2.176	10	0		DEAEHN
C[NH2+]C1CCC([N-]S(=O)(=O)c2ccc(Cl)cc2F)CC1	ZINC000091872440	193121440	/nfs/dbraw/zinc/12/14/40/193121440.db2.gz	KMJMIYRSXZDTBD-UHFFFAOYSA-N	0	3	320.817	2.288	10	0		DEAEHN
C[C@H]1CC[C@@H]([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)C[NH2+]1	ZINC000624406935	365413096	/nfs/dbraw/zinc/41/30/96/365413096.db2.gz	PPVFKDIOMQKPJP-WCBMZHEXSA-N	0	3	323.245	2.412	10	0		DEAEHN
C[C@@H]1CC[C@H]([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)C[NH2+]1	ZINC000624406934	365413513	/nfs/dbraw/zinc/41/35/13/365413513.db2.gz	PPVFKDIOMQKPJP-SCZZXKLOSA-N	0	3	323.245	2.412	10	0		DEAEHN
CNc1ccc(Cl)c(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)n1	ZINC000092023872	193143218	/nfs/dbraw/zinc/14/32/18/193143218.db2.gz	XJYPALMRZQPWDC-MNOVXSKESA-N	0	3	308.813	2.085	10	0		DEAEHN
COc1c(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)c(C)nn1C	ZINC000092066730	193152269	/nfs/dbraw/zinc/15/22/69/193152269.db2.gz	IPBXHHZBYLBSBH-RHSMWYFYSA-N	0	3	318.465	2.186	10	0		DEAEHN
COCCNCc1c(N2C[C@@H](C)[C@H](C)C2)nc2sccn12	ZINC000092086543	193155056	/nfs/dbraw/zinc/15/50/56/193155056.db2.gz	HMDGVSVCJFYIRQ-VXGBXAGGSA-N	0	3	308.451	2.224	10	0		DEAEHN
CCNCc1ccc(C)c(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)c1	ZINC000092113571	193161263	/nfs/dbraw/zinc/16/12/63/193161263.db2.gz	ZJUKSJXEJSDAHX-KBPBESRZSA-N	0	3	310.463	2.381	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCCCCCC2)c(F)c1	ZINC000092115568	193163380	/nfs/dbraw/zinc/16/33/80/193163380.db2.gz	FUHAOKZZNIYQGD-UHFFFAOYSA-N	0	3	314.426	2.500	10	0		DEAEHN
CC[NH2+]Cc1ccc(S(=O)(=O)[N-]C2CCCC2)c(F)c1	ZINC000092115810	193163432	/nfs/dbraw/zinc/16/34/32/193163432.db2.gz	AQWNGMOJECMXTI-UHFFFAOYSA-N	0	3	300.399	2.156	10	0		DEAEHN
CC[NH2+]Cc1ccc(S(=O)(=O)[N-]C[C@@H](C)CC)c(F)c1	ZINC000092116108	193164002	/nfs/dbraw/zinc/16/40/02/193164002.db2.gz	HWXHEXJMFMZOGP-NSHDSACASA-N	0	3	302.415	2.260	10	0		DEAEHN
CC(C)[NH2+]Cc1ccc(S(=O)(=O)[N-]C2CCC2)c(F)c1	ZINC000092116065	193164093	/nfs/dbraw/zinc/16/40/93/193164093.db2.gz	IINNLGFBOSLNRL-UHFFFAOYSA-N	0	3	300.399	2.155	10	0		DEAEHN
C[C@@H](O)C1CCN(Cc2cn(C)nc2-c2ccncc2)CC1	ZINC000092970731	193190867	/nfs/dbraw/zinc/19/08/67/193190867.db2.gz	SOYLCSBBAPTYNM-CYBMUJFWSA-N	0	3	300.406	2.075	10	0		DEAEHN
CCC[C@@H](C(=O)NCCOCc1ccc(OC)cc1)N(C)C	ZINC000093003335	193192900	/nfs/dbraw/zinc/19/29/00/193192900.db2.gz	UIDZCUFUVIVUBV-INIZCTEOSA-N	0	3	308.422	2.058	10	0		DEAEHN
COCCN(c1nc(C(C)C)c(CN)s1)[C@H](C)COC	ZINC000093000061	193192916	/nfs/dbraw/zinc/19/29/16/193192916.db2.gz	ZTPLNJFEMLEXTJ-LLVKDONJSA-N	0	3	301.456	2.213	10	0		DEAEHN
O=C(CC/C=C/c1ccccc1)NC[C@@H]1CCCN1CCCO	ZINC000452362150	244196822	/nfs/dbraw/zinc/19/68/22/244196822.db2.gz	KNEVOTWQDYHFRL-MUFCHLESSA-N	0	3	316.445	2.443	10	0		DEAEHN
C[C@@H](N)C(=O)N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1	ZINC000262511017	203314839	/nfs/dbraw/zinc/31/48/39/203314839.db2.gz	BIQIBELNHRLDNI-ABAIWWIYSA-N	0	3	303.793	2.482	10	0		DEAEHN
Cc1ccc(NC(=O)[C@@H]2C[C@H](O)CN2)cc1OCCC(C)C	ZINC000262531314	203321908	/nfs/dbraw/zinc/32/19/08/203321908.db2.gz	PNYAPZSEOSDIAS-GJZGRUSLSA-N	0	3	306.406	2.081	10	0		DEAEHN
CCN[C@H](Cc1c(Cl)c(CC)nn1CC)C(OC)OC	ZINC000093305316	193228107	/nfs/dbraw/zinc/22/81/07/193228107.db2.gz	ZQZLUDNBUCQKSQ-LLVKDONJSA-N	0	3	303.834	2.258	10	0		DEAEHN
CC(C)CO[C@@H]1C[C@H](NCC(C)(C)S(C)(=O)=O)C1(C)C	ZINC000093523112	193262621	/nfs/dbraw/zinc/26/26/21/193262621.db2.gz	YBFZRASWHNNPRH-QWHCGFSZSA-N	0	3	305.484	2.239	10	0		DEAEHN
NC(=O)[C@]1(N)CC[C@@H](Sc2ccc(Br)cc2)C1	ZINC000093848879	193317772	/nfs/dbraw/zinc/31/77/72/193317772.db2.gz	YIKXJFQGDZORSE-PWSUYJOCSA-N	0	3	315.236	2.277	10	0		DEAEHN
NCc1ccc(C(F)(F)F)nc1N(CCO)C1CCCC1	ZINC000094334212	193360664	/nfs/dbraw/zinc/36/06/64/193360664.db2.gz	SPKJGALNFCSEPY-UHFFFAOYSA-N	0	3	303.328	2.300	10	0		DEAEHN
CCN(C)CCNc1nc(C(F)(F)F)ccc1C(N)=S	ZINC000094336157	193361027	/nfs/dbraw/zinc/36/10/27/193361027.db2.gz	NIBJEDIVXUVVPI-UHFFFAOYSA-N	0	3	306.357	2.098	10	0		DEAEHN
CCCNC(=O)COc1c(F)cc(CNC(C)C)cc1F	ZINC000094347387	193363445	/nfs/dbraw/zinc/36/34/45/193363445.db2.gz	LTMDJVTWAXZWRF-UHFFFAOYSA-N	0	3	300.349	2.368	10	0		DEAEHN
CCN[C@@H](C)c1cc(F)ccc1O[C@H]1CCS(=O)(=O)C1	ZINC000094618895	193385578	/nfs/dbraw/zinc/38/55/78/193385578.db2.gz	IHOJRYRMXQDDLJ-JQWIXIFHSA-N	0	3	301.383	2.062	10	0		DEAEHN
CCN(CC)C(C)(C)[C@H](O)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000094641322	193388704	/nfs/dbraw/zinc/38/87/04/193388704.db2.gz	HRONOBNUADJUIB-HZSPNIEDSA-N	0	3	305.484	2.071	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@@H]2CN1c1ncc(CNC2CC2)s1	ZINC000094444154	193370170	/nfs/dbraw/zinc/37/01/70/193370170.db2.gz	XMDTUACIBZLGAH-TZMCWYRMSA-N	0	3	306.479	2.458	10	0		DEAEHN
CCOC(=O)[C@]1(NCCN(CC)CC)CSCCC1(C)C	ZINC000094484677	193373033	/nfs/dbraw/zinc/37/30/33/193373033.db2.gz	UCYKSKMRXOZPOW-MRXNPFEDSA-N	0	3	316.511	2.383	10	0		DEAEHN
CN[C@H](c1ccc(Cl)c(Cl)c1)[C@@H]1CN2CCN1CC2	ZINC000094508962	193375728	/nfs/dbraw/zinc/37/57/28/193375728.db2.gz	VIBCIXLMDJZSSP-UONOGXRCSA-N	0	3	300.233	2.254	10	0		DEAEHN
CN[C@@H](Cc1c(Cl)cccc1Cl)[C@@H]1CN2CCN1CC2	ZINC000094509037	193376185	/nfs/dbraw/zinc/37/61/85/193376185.db2.gz	XFTYKRDXUVTDOK-GJZGRUSLSA-N	0	3	314.260	2.124	10	0		DEAEHN
C[C@H](C1CC1)n1nccc1NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000274917116	212031510	/nfs/dbraw/zinc/03/15/10/212031510.db2.gz	LHRQFMKSYKEXPP-TZMCWYRMSA-N	0	3	303.410	2.166	10	0		DEAEHN
Cn1ncc(Br)c1CNC[C@@H]1CCOC(C)(C)C1	ZINC000453577280	245192515	/nfs/dbraw/zinc/19/25/15/245192515.db2.gz	HIZYHSKWJVWUAB-SNVBAGLBSA-N	0	3	316.243	2.477	10	0		DEAEHN
C1CN(c2nnc(C3CCOCC3)s2)C[C@H]1N1CCCCC1	ZINC000338666492	404469995	/nfs/dbraw/zinc/46/99/95/404469995.db2.gz	UJPDNQHXCFQYJO-AWEZNQCLSA-N	0	3	322.478	2.497	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)CCN2CCC([C@H](C)O)CC2)cc1	ZINC000264714192	204095368	/nfs/dbraw/zinc/09/53/68/204095368.db2.gz	LNQBFRGRDIHTSY-AWEZNQCLSA-N	0	3	318.417	2.311	10	0		DEAEHN
O=C(Nc1cc(Cl)c(Cl)cc1Cl)[C@H]1C[C@@H](O)CN1	ZINC000020434011	182217032	/nfs/dbraw/zinc/21/70/32/182217032.db2.gz	RAUWLOXWBXFHFD-GPXNAGAYSA-N	0	3	309.580	2.308	10	0		DEAEHN
CO[C@@]1(CN[C@@H](C)c2ccc(Br)o2)CCOC1	ZINC000160086284	197384384	/nfs/dbraw/zinc/38/43/84/197384384.db2.gz	WZEPHUOBSUQNJI-JOYOIKCWSA-N	0	3	304.184	2.498	10	0		DEAEHN
C[C@@H](CCN1CCN(C)CC1)NC(=O)NCC1CCCCCC1	ZINC000454826834	246178048	/nfs/dbraw/zinc/17/80/48/246178048.db2.gz	ZFELOGJAQUNOSF-INIZCTEOSA-N	0	3	324.513	2.282	10	0		DEAEHN
CCc1cc(C(=O)NC[C@@H](C)N2CCN(CC)CC2)oc1CC	ZINC000158118032	291637951	/nfs/dbraw/zinc/63/79/51/291637951.db2.gz	DJEBMNPSNYVRTN-CQSZACIVSA-N	0	3	321.465	2.160	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2ccc(C)cc2Br)C1	ZINC000040629747	183110446	/nfs/dbraw/zinc/11/04/46/183110446.db2.gz	KLWSIRSZASJVAD-SKDRFNHKSA-N	0	3	313.195	2.073	10	0		DEAEHN
CN(c1ncnc(Oc2ccccc2)c1N)C1CCN(C)CC1	ZINC000040796119	183135363	/nfs/dbraw/zinc/13/53/63/183135363.db2.gz	SKYLCIPTONZAFW-UHFFFAOYSA-N	0	3	313.405	2.382	10	0		DEAEHN
OC[C@H](NC[C@H]1CCCO1)c1ccc(Br)s1	ZINC000041703006	183218521	/nfs/dbraw/zinc/21/85/21/183218521.db2.gz	WVBWCCWHGDATHO-BDAKNGLRSA-N	0	3	306.225	2.313	10	0		DEAEHN
OC[C@H](NC[C@H]1CCCO1)c1cc(Br)cs1	ZINC000041678626	183216138	/nfs/dbraw/zinc/21/61/38/183216138.db2.gz	PBOSYOJBHUIVMQ-ZJUUUORDSA-N	0	3	306.225	2.313	10	0		DEAEHN
CC(C)N(C)C(=O)COc1c(Br)cccc1CN	ZINC000042411392	183264949	/nfs/dbraw/zinc/26/49/49/183264949.db2.gz	JOSKIBPBGNDNBM-UHFFFAOYSA-N	0	3	315.211	2.153	10	0		DEAEHN
CC(C)N(CCCO)[C@H](C)C(=O)Nc1cc(Cl)ccc1N	ZINC000042482942	183275470	/nfs/dbraw/zinc/27/54/70/183275470.db2.gz	HHBOLOIKNCAKTC-LLVKDONJSA-N	0	3	313.829	2.342	10	0		DEAEHN
COCCN([C@H](C)COC)[C@@H](CN)c1c(F)cccc1Cl	ZINC000042603301	183290234	/nfs/dbraw/zinc/29/02/34/183290234.db2.gz	JJILAJRHQRQQFB-RISCZKNCSA-N	0	3	318.820	2.462	10	0		DEAEHN
CS(=O)(=O)c1cccc(O[C@H](CN)c2ccc(F)cc2)c1	ZINC000042942557	183319476	/nfs/dbraw/zinc/31/94/76/183319476.db2.gz	DDYNZLZCBBALMH-OAHLLOKOSA-N	0	3	309.362	2.308	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1ccc(Cl)s1)N(C)CC(=O)N(C)C	ZINC000043252473	183346362	/nfs/dbraw/zinc/34/63/62/183346362.db2.gz	PPLMIWKALMMJBZ-RNCFNFMXSA-N	0	3	303.859	2.200	10	0		DEAEHN
CC(C)N(CCO)[C@@H](CN)c1ccc(Br)s1	ZINC000043262721	183348978	/nfs/dbraw/zinc/34/89/78/183348978.db2.gz	DKNCBPTVKCCKBL-VIFPVBQESA-N	0	3	307.257	2.213	10	0		DEAEHN
C[C@H](N)[C@H](c1ccc(Br)s1)N(CCO)C1CC1	ZINC000043262753	183349166	/nfs/dbraw/zinc/34/91/66/183349166.db2.gz	HHBKVKQXDBDIJW-QPUJVOFHSA-N	0	3	319.268	2.356	10	0		DEAEHN
C[C@H](N)[C@@H](c1cc(Br)cs1)N1CCC[C@@H]1CO	ZINC000043286379	183350378	/nfs/dbraw/zinc/35/03/78/183350378.db2.gz	UIPKCNWWYZFGEY-XRNSZHNASA-N	0	3	319.268	2.356	10	0		DEAEHN
C[C@@H](N)[C@H](c1cc(Br)cs1)N1CCC(O)CC1	ZINC000043284554	183350802	/nfs/dbraw/zinc/35/08/02/183350802.db2.gz	MLEHQINHMFWOSH-PRHODGIISA-N	0	3	319.268	2.356	10	0		DEAEHN
C[C@@H](N)[C@@H](c1cc(Br)cs1)N1CCOCC1	ZINC000043284351	183350924	/nfs/dbraw/zinc/35/09/24/183350924.db2.gz	IVFYRNSAYKRKLU-KCJUWKMLSA-N	0	3	305.241	2.231	10	0		DEAEHN
CC[C@H](N)[C@H](Oc1ccc(S(C)(=O)=O)cc1)C(F)(F)F	ZINC000043385207	183358421	/nfs/dbraw/zinc/35/84/21/183358421.db2.gz	WJGSMWSWCUCONZ-QWRGUYRKSA-N	0	3	311.325	2.137	10	0		DEAEHN
CC(C)OC(=O)COc1c(Br)cccc1CN	ZINC000043446066	183364151	/nfs/dbraw/zinc/36/41/51/183364151.db2.gz	CJJKMNCLHIRZCY-UHFFFAOYSA-N	0	3	302.168	2.238	10	0		DEAEHN
CCCCCNC(=O)[C@H](C)N(CCC(N)=S)CC(C)C	ZINC000043418426	183361246	/nfs/dbraw/zinc/36/12/46/183361246.db2.gz	YRRBUYXDYYCTHS-ZDUSSCGKSA-N	0	3	301.500	2.316	10	0		DEAEHN
C[C@@H](O)CN1CCN(CCCOCCc2ccccc2)C[C@H]1C	ZINC000105824121	194138526	/nfs/dbraw/zinc/13/85/26/194138526.db2.gz	FGSJYOCPKLIZSB-QZTJIDSGSA-N	0	3	320.477	2.023	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc(OC)c(F)c2)CCN1C[C@@H](C)O	ZINC000106104137	194184957	/nfs/dbraw/zinc/18/49/57/194184957.db2.gz	AOZAPRVCUUATBY-HIFRSBDPSA-N	0	3	310.413	2.111	10	0		DEAEHN
CCc1cccc(OCCN2CCN(CCOC)[C@H](C)C2)c1	ZINC000106109135	194187984	/nfs/dbraw/zinc/18/79/84/194187984.db2.gz	SGEOZGLFZSVPBM-MRXNPFEDSA-N	0	3	306.450	2.280	10	0		DEAEHN
NCc1cc(Br)cnc1OC[C@@H]1CCCCO1	ZINC000051524361	183828682	/nfs/dbraw/zinc/82/86/82/183828682.db2.gz	KBBVXLKATPBORF-NSHDSACASA-N	0	3	301.184	2.251	10	0		DEAEHN
NC(=S)c1ccc(CN2CCN(C3CCCC3)CC2)cc1	ZINC000052061750	183849188	/nfs/dbraw/zinc/84/91/88/183849188.db2.gz	MTRRCQOWKHCPMI-UHFFFAOYSA-N	0	3	303.475	2.381	10	0		DEAEHN
CCCN([C@@H]1CCCNC1)S(=O)(=O)c1ccc(CC)s1	ZINC000110942233	194371952	/nfs/dbraw/zinc/37/19/52/194371952.db2.gz	KYBPJCRHDDSPNM-GFCCVEGCSA-N	0	3	316.492	2.463	10	0		DEAEHN
CCOCCN(CC)CCOc1ccc(CC(N)=S)cc1	ZINC000111119381	194392113	/nfs/dbraw/zinc/39/21/13/194392113.db2.gz	QAUWUGWPIMMCOO-UHFFFAOYSA-N	0	3	310.463	2.252	10	0		DEAEHN
c1ccc(CCc2nc3c(c(N4CCNCC4)n2)CCC3)cc1	ZINC000057328718	184033596	/nfs/dbraw/zinc/03/35/96/184033596.db2.gz	WIXILZIAICRLKJ-UHFFFAOYSA-N	0	3	308.429	2.160	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCC[C@@H]2c2cccn2C)C1	ZINC000057870672	184059836	/nfs/dbraw/zinc/05/98/36/184059836.db2.gz	SYXDYXDBBBWGAP-GDBMZVCRSA-N	0	3	304.438	2.356	10	0		DEAEHN
COc1ccc2c(c1)CCN2C(=O)NC1CCN(C2CC2)CC1	ZINC000060536019	184151451	/nfs/dbraw/zinc/15/14/51/184151451.db2.gz	RLCOTBYMZNNXRK-UHFFFAOYSA-N	0	3	315.417	2.394	10	0		DEAEHN
N=C(N)c1cc(Sc2nnc(C3CC3)n2C2CC2)ccn1	ZINC000061814680	184188452	/nfs/dbraw/zinc/18/84/52/184188452.db2.gz	UAFZQGYCRJSACE-UHFFFAOYSA-N	0	3	300.391	2.321	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccco1)N1CCN(CC(F)(F)F)CC1	ZINC000061940816	184197568	/nfs/dbraw/zinc/19/75/68/184197568.db2.gz	XIHDFPNLJCJDIR-DGCLKSJQSA-N	0	3	305.344	2.238	10	0		DEAEHN
C[C@@H](C(=O)N1CCNCC1)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000062014407	184200903	/nfs/dbraw/zinc/20/09/03/184200903.db2.gz	XTVQUJSDZUIXRZ-STQMWFEESA-N	0	3	309.841	2.153	10	0		DEAEHN
CCNCCS(=O)(=O)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000062010847	184200952	/nfs/dbraw/zinc/20/09/52/184200952.db2.gz	CABZJFFKJKNFMU-NSHDSACASA-N	0	3	304.843	2.272	10	0		DEAEHN
C[C@H](c1ccccc1F)N(C)S(=O)(=O)C[C@@H]1CCCCN1	ZINC000062027845	184202248	/nfs/dbraw/zinc/20/22/48/184202248.db2.gz	ZDEIQDNAOGFRLG-OLZOCXBDSA-N	0	3	314.426	2.290	10	0		DEAEHN
COCCNCc1cc(Cl)c(OCCOC)c(OC)c1	ZINC000062727862	184250821	/nfs/dbraw/zinc/25/08/21/184250821.db2.gz	RXPCEMVFPJTQSW-UHFFFAOYSA-N	0	3	303.786	2.110	10	0		DEAEHN
c1ccc(C[C@H]2CSC(N[C@@H]3CN4CCC3CC4)=N2)cc1	ZINC000063220249	184279530	/nfs/dbraw/zinc/27/95/30/184279530.db2.gz	KCLIKTGYUCMWBH-JKSUJKDBSA-N	0	3	301.459	2.384	10	0		DEAEHN
CNCc1c(OCCCS(C)(=O)=O)ccc2ccccc21	ZINC000063014405	184266398	/nfs/dbraw/zinc/26/63/98/184266398.db2.gz	ISTNVBTZFKMXBY-UHFFFAOYSA-N	0	3	307.415	2.373	10	0		DEAEHN
[NH3+][C@H]1CCC[C@@H]1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000063176013	184276850	/nfs/dbraw/zinc/27/68/50/184276850.db2.gz	OVHOBPUVVMNWEX-UWVGGRQHSA-N	0	3	309.218	2.152	10	0		DEAEHN
COC[C@H](C)CN1CCCN(C(=O)Cc2cccc(F)c2)CC1	ZINC000189807136	335045652	/nfs/dbraw/zinc/04/56/52/335045652.db2.gz	ZGMWGBCJVZLVJQ-OAHLLOKOSA-N	0	3	322.424	2.185	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccccc2NC(=O)C(C)(C)C)C1	ZINC000112897475	194533274	/nfs/dbraw/zinc/53/32/74/194533274.db2.gz	BIJJHXYLBCCFPE-CYBMUJFWSA-N	0	3	317.433	2.447	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)Nc2ccc(Cl)cc2F)CCO1	ZINC000118790858	194925734	/nfs/dbraw/zinc/92/57/34/194925734.db2.gz	SDWDHQDFLWKONY-LLVKDONJSA-N	0	3	315.776	2.273	10	0		DEAEHN
CN(C)CCn1ccc(NC(=O)c2cccc3ncccc32)n1	ZINC000120030703	195083474	/nfs/dbraw/zinc/08/34/74/195083474.db2.gz	AJELERZYIMKPTP-UHFFFAOYSA-N	0	3	309.373	2.245	10	0		DEAEHN
Cc1scc(C(=O)NCCCCN2CCN(C)CC2)c1C	ZINC000539111995	285069671	/nfs/dbraw/zinc/06/96/71/285069671.db2.gz	CPNMWQJJKOCVEY-UHFFFAOYSA-N	0	3	309.479	2.122	10	0		DEAEHN
c1nc(N2CCCC2)ncc1CN1CCC[C@@H]([C@@H]2CCOC2)C1	ZINC000539893986	285098704	/nfs/dbraw/zinc/09/87/04/285098704.db2.gz	FGHLSVQITHZTID-IAGOWNOFSA-N	0	3	316.449	2.325	10	0		DEAEHN
c1nc(N2CCCC2)ncc1CN1CCC[C@@H]([C@H]2CCOC2)C1	ZINC000539893989	285098882	/nfs/dbraw/zinc/09/88/82/285098882.db2.gz	FGHLSVQITHZTID-SJORKVTESA-N	0	3	316.449	2.325	10	0		DEAEHN
CCNC(=O)N1CC[C@@H](N[C@H](C)c2ccc(C)cc2OC)C1	ZINC000540157920	285111545	/nfs/dbraw/zinc/11/15/45/285111545.db2.gz	OPACUKRYSOMCEQ-ZIAGYGMSSA-N	0	3	305.422	2.458	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCC[C@@H](C)CC2)cc(CN)c1F	ZINC000159116406	197328666	/nfs/dbraw/zinc/32/86/66/197328666.db2.gz	VQDCVTDIJLVBLP-LLVKDONJSA-N	0	3	314.426	2.404	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1cc(Cl)c(OC)cc1OC	ZINC000159101061	197327731	/nfs/dbraw/zinc/32/77/31/197327731.db2.gz	OKWXLBGSDIHWBD-JTQLQIEISA-N	0	3	316.785	2.050	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCC[C@H](C)C2)cc(CN)c1F	ZINC000159052025	197322276	/nfs/dbraw/zinc/32/22/76/197322276.db2.gz	QDQJGKDKWRRIBR-JTQLQIEISA-N	0	3	300.399	2.013	10	0		DEAEHN
CCCN[C@@H]1CCN(c2c(F)c(F)c(F)c(F)c2F)C1=O	ZINC000158938312	197312827	/nfs/dbraw/zinc/31/28/27/197312827.db2.gz	ZWUKNDCGLPUEOS-ZCFIWIBFSA-N	0	3	308.250	2.487	10	0		DEAEHN
CCCNc1nc(SCCN(CC)CC)nc(N(C)C)n1	ZINC000159028343	197319898	/nfs/dbraw/zinc/31/98/98/197319898.db2.gz	BMXWKKAPJMYIDJ-UHFFFAOYSA-N	0	3	312.487	2.193	10	0		DEAEHN
COc1cnn(CCN(C)C)c1[C@H](O)c1cc(C)c(C)s1	ZINC000158754300	197299327	/nfs/dbraw/zinc/29/93/27/197299327.db2.gz	XEMORUDEGCXKFC-OAHLLOKOSA-N	0	3	309.435	2.213	10	0		DEAEHN
CC(C)Oc1cncc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000158446760	197273381	/nfs/dbraw/zinc/27/33/81/197273381.db2.gz	OFERCINPTFGVCE-ZFWWWQNUSA-N	0	3	305.422	2.424	10	0		DEAEHN
CC(C)(C)[C@@H](N)C(=O)N[C@H]1CCC[C@H](OCC(F)(F)F)C1	ZINC000158237981	197255682	/nfs/dbraw/zinc/25/56/82/197255682.db2.gz	XGBRDLBRKKFTNB-DCAQKATOSA-N	0	3	310.360	2.366	10	0		DEAEHN
Cc1nn(-c2cc(C)nc(C)c2C(N)=O)c(C)c1Br	ZINC000157619151	197202909	/nfs/dbraw/zinc/20/29/09/197202909.db2.gz	NBCPOELTGPEMCT-UHFFFAOYSA-N	0	3	323.194	2.362	10	0		DEAEHN
CSc1nsc(NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)n1	ZINC000157077968	197160109	/nfs/dbraw/zinc/16/01/09/197160109.db2.gz	ORFIRFDLPIEFLO-IUCAKERBSA-N	0	3	315.468	2.206	10	0		DEAEHN
C[C@](O)(Cc1cc(Br)cs1)C[C@@H]1COCCN1	ZINC000156923547	197150329	/nfs/dbraw/zinc/15/03/29/197150329.db2.gz	IHLYWHBCVRYCPL-ZYHUDNBSSA-N	0	3	320.252	2.183	10	0		DEAEHN
CSC(C)(C)CNCC(=O)Nc1ccc2c(c1)OCCO2	ZINC000156679516	197132940	/nfs/dbraw/zinc/13/29/40/197132940.db2.gz	SHSPSHPENIMJBP-UHFFFAOYSA-N	0	3	310.419	2.128	10	0		DEAEHN
CC(C)Cc1ccc([C@@H](C)C(=O)NC[C@](C)(O)CN(C)C)cc1	ZINC000156107324	197087191	/nfs/dbraw/zinc/08/71/91/197087191.db2.gz	MJOIYSDXRUCCIA-BEFAXECRSA-N	0	3	320.477	2.417	10	0		DEAEHN
COc1cccc(F)c1[C@H](N)[C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000156088892	197085961	/nfs/dbraw/zinc/08/59/61/197085961.db2.gz	YICFMRZECCGWGB-ZIBATOQPSA-N	0	3	315.410	2.438	10	0		DEAEHN
O=c1cc(N2CC[C@H]3[C@@H](CCCN3C3CC3)C2)nc2ccccn12	ZINC000246720676	285219369	/nfs/dbraw/zinc/21/93/69/285219369.db2.gz	VANDJNBHSXHEMF-HOCLYGCPSA-N	0	3	324.428	2.148	10	0		DEAEHN
CCC(=O)Nc1cccc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000155441488	197055441	/nfs/dbraw/zinc/05/54/41/197055441.db2.gz	LZZPOWSHMVFEIW-XJKSGUPXSA-N	0	3	317.433	2.494	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)C(=O)Nc2cccc(Cl)c2)CCN1C	ZINC000120623102	195204075	/nfs/dbraw/zinc/20/40/75/195204075.db2.gz	RKUQOEPSEALSLJ-BXUZGUMPSA-N	0	3	323.824	2.220	10	0		DEAEHN
Cc1cc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)ccc1F	ZINC000120701380	195219197	/nfs/dbraw/zinc/21/91/97/195219197.db2.gz	HTPIVFWXBATWPE-OCCSQVGLSA-N	0	3	321.396	2.014	10	0		DEAEHN
Cn1cncc1CN1CC[C@@]2(CCC[C@@H]2C(=O)N2CCCC2)C1	ZINC000248061405	257110699	/nfs/dbraw/zinc/11/06/99/257110699.db2.gz	USZPFIYGXKAXFQ-AEFFLSMTSA-N	0	3	316.449	2.035	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccccc2NC(C)=O)CCN1CCOC	ZINC000120968136	195272925	/nfs/dbraw/zinc/27/29/25/195272925.db2.gz	LQVUIAGWNRAXDL-QGZVFWFLSA-N	0	3	319.449	2.188	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)N1CCN(C2CCCC2)CC1	ZINC000121628773	195320141	/nfs/dbraw/zinc/32/01/41/195320141.db2.gz	ZNTBTEGBEREYJP-INIZCTEOSA-N	0	3	324.513	2.233	10	0		DEAEHN
CC[C@H]1N[C@@H](c2cccs2)N(CC2CCN(C)CC2)C1=O	ZINC000122004364	195389677	/nfs/dbraw/zinc/38/96/77/195389677.db2.gz	GKIRXBSJPFQTET-UKRRQHHQSA-N	0	3	307.463	2.299	10	0		DEAEHN
Cc1cccc2c1CC[C@H]2N[C@H]1CCN(C2CCOCC2)C1=O	ZINC000358191854	133127426	/nfs/dbraw/zinc/12/74/26/133127426.db2.gz	PDLHMOPHUMYSBQ-MSOLQXFVSA-N	0	3	314.429	2.352	10	0		DEAEHN
c1ccc(-c2nc(SCCN3C[C@H]4CC[C@@H](C3)O4)n[nH]2)cc1	ZINC000359786112	133144935	/nfs/dbraw/zinc/14/49/35/133144935.db2.gz	CKBWAUGQEQJVSB-OKILXGFUSA-N	0	3	316.430	2.427	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NC[C@H](C)Oc1ccccc1OC	ZINC000362039792	133206641	/nfs/dbraw/zinc/20/66/41/133206641.db2.gz	UJSAITKYYMPSHF-GJZGRUSLSA-N	0	3	320.433	2.453	10	0		DEAEHN
O[C@@H](COC1CCOCC1)CN1CCCC[C@@H]1c1ccco1	ZINC000368550404	133277960	/nfs/dbraw/zinc/27/79/60/133277960.db2.gz	ZKIQFSPLAXSXHV-GDBMZVCRSA-N	0	3	309.406	2.363	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CNCCCc1ccccn1	ZINC000291677714	404475702	/nfs/dbraw/zinc/47/57/02/404475702.db2.gz	HHWNQFIOBNFPKN-UHFFFAOYSA-N	0	3	307.401	2.444	10	0		DEAEHN
COC(=O)CN1CCC(N[C@H]2CCOc3c(C)cccc32)CC1	ZINC000188128153	145007307	/nfs/dbraw/zinc/00/73/07/145007307.db2.gz	OHBPTNDAMWRPGA-INIZCTEOSA-N	0	3	318.417	2.046	10	0		DEAEHN
Cc1ncc(-c2ccc(NC(=O)c3n[nH]c4c3CNCC4)cc2)o1	ZINC000188310800	145009794	/nfs/dbraw/zinc/00/97/94/145009794.db2.gz	VJOKODWMAMOBNG-UHFFFAOYSA-N	0	3	323.356	2.271	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1cc2ccccc2[nH]c1=O	ZINC000188688423	145015551	/nfs/dbraw/zinc/01/55/51/145015551.db2.gz	ATVDYQOCBZENAT-UHFFFAOYSA-N	0	3	319.364	2.061	10	0		DEAEHN
Cc1nc(CC(C)C)oc1C(=O)Nc1ccn(CCN(C)C)n1	ZINC000188713521	145016390	/nfs/dbraw/zinc/01/63/90/145016390.db2.gz	DGDNZQRRMFRWRR-UHFFFAOYSA-N	0	3	319.409	2.192	10	0		DEAEHN
O=C1CCCCN1C1CCN(C[C@@H](O)CC2CCCC2)CC1	ZINC000190717603	145047361	/nfs/dbraw/zinc/04/73/61/145047361.db2.gz	JWQYPUVIKQVSGI-KRWDZBQOSA-N	0	3	308.466	2.405	10	0		DEAEHN
c1cc(OCC2CC2)ccc1CNC[C@H]1CN(C2CC2)CCO1	ZINC000190978844	145051167	/nfs/dbraw/zinc/05/11/67/145051167.db2.gz	VPDMGDIQMSIESJ-IBGZPJMESA-N	0	3	316.445	2.428	10	0		DEAEHN
C[C@H](CCNC(=O)N1CCO[C@@H](CN(C)C)C1)CC(C)(C)C	ZINC000190991942	145051720	/nfs/dbraw/zinc/05/17/20/145051720.db2.gz	WLTDUIKYNNARTC-CABCVRRESA-N	0	3	313.486	2.421	10	0		DEAEHN
Nc1cc(CN2CCC(c3nnc4ccccn43)CC2)ccn1	ZINC000191492034	145059752	/nfs/dbraw/zinc/05/97/52/145059752.db2.gz	WAGNKLHGHFHMHR-UHFFFAOYSA-N	0	3	308.389	2.086	10	0		DEAEHN
O=C1O[C@H](CN2CCC(Cn3cccn3)CC2)CC12CCC2	ZINC000192007738	145068850	/nfs/dbraw/zinc/06/88/50/145068850.db2.gz	YGSYWNRHRRWATE-HNNXBMFYSA-N	0	3	303.406	2.081	10	0		DEAEHN
CCN1CCN(CCNc2ncnc3c(C)csc32)CC1	ZINC000192487999	145074693	/nfs/dbraw/zinc/07/46/93/145074693.db2.gz	WWHFNOJNFHKEFB-UHFFFAOYSA-N	0	3	305.451	2.049	10	0		DEAEHN
C[C@@H](N[C@@H](C)C(=O)NCCc1ccc(F)cc1)[C@@H]1CCCO1	ZINC000193128675	145083206	/nfs/dbraw/zinc/08/32/06/145083206.db2.gz	WMHQSRWFQYLASL-WWGRRREGSA-N	0	3	308.397	2.030	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)Cc2ccccc2C)[C@@H](C)C1	ZINC000246127819	145093175	/nfs/dbraw/zinc/09/31/75/145093175.db2.gz	JLANVHAWVSCBMP-DOTOQJQBSA-N	0	3	324.490	2.487	10	0		DEAEHN
C[C@H](CCc1cccn1C)NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000246399230	145101776	/nfs/dbraw/zinc/10/17/76/145101776.db2.gz	RKOKKDGDHZQEKN-INMHGKMJSA-N	0	3	320.481	2.470	10	0		DEAEHN
CC[C@@H]1CN(CCCc2cccc(OC)c2)CCN1C[C@H](C)O	ZINC000246514744	145105130	/nfs/dbraw/zinc/10/51/30/145105130.db2.gz	BNFIAMSOLBZVQA-FUHWJXTLSA-N	0	3	320.477	2.405	10	0		DEAEHN
C[C@H](CNC(=O)N1CCN2CCC[C@H]2C1)N(C)c1ccccc1	ZINC000246691746	145110460	/nfs/dbraw/zinc/11/04/60/145110460.db2.gz	AJBZHONDXWZRAQ-WBVHZDCISA-N	0	3	316.449	2.001	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@H](C)C(=O)N1CCCCCC1	ZINC000246848280	145116422	/nfs/dbraw/zinc/11/64/22/145116422.db2.gz	CAPPZVAAAJRPTF-NVXWUHKLSA-N	0	3	318.465	2.447	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN([C@H](C)C(=O)N(CC)CC)C1	ZINC000247082849	145126162	/nfs/dbraw/zinc/12/61/62/145126162.db2.gz	HCIABRFJAJXSDY-CABCVRRESA-N	0	3	306.454	2.339	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)CCC(=O)c1cccs1	ZINC000247108846	145126353	/nfs/dbraw/zinc/12/63/53/145126353.db2.gz	IQXBFBZVYKXFFZ-OLZOCXBDSA-N	0	3	306.431	2.406	10	0		DEAEHN
C[C@H](Oc1ccc(F)c(F)c1)C(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000247505090	145139645	/nfs/dbraw/zinc/13/96/45/145139645.db2.gz	VIOSZWKOAMFKLU-FRRDWIJNSA-N	0	3	324.371	2.427	10	0		DEAEHN
CCN1CC[C@H](N(C)C(=O)c2cc(C(C)=O)cn2C)[C@@H](C)C1	ZINC000247564910	145141595	/nfs/dbraw/zinc/14/15/95/145141595.db2.gz	ZWHMWZNEVWNQBI-WFASDCNBSA-N	0	3	305.422	2.030	10	0		DEAEHN
O=C(CCN1CCN2CCCC[C@H]2C1)NCC1CCCCC1	ZINC000248343291	145151006	/nfs/dbraw/zinc/15/10/06/145151006.db2.gz	KCFFMCIFRMKEPJ-KRWDZBQOSA-N	0	3	307.482	2.243	10	0		DEAEHN
Cc1ccc(C)c(OC[C@H](O)CN2CCN3CCCC[C@H]3C2)c1	ZINC000248343957	145151457	/nfs/dbraw/zinc/15/14/57/145151457.db2.gz	KYNUXFBYWDGHBB-ZWKOTPCHSA-N	0	3	318.461	2.213	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000248449980	145155620	/nfs/dbraw/zinc/15/56/20/145155620.db2.gz	OWVPIHHAWMTOKQ-RHSMWYFYSA-N	0	3	319.449	2.097	10	0		DEAEHN
C[C@H]1CN(CCC(Cl)(Cl)Cl)C[C@H]1N1CCOCC1	ZINC000248611072	145160934	/nfs/dbraw/zinc/16/09/34/145160934.db2.gz	ICKPPAZHWGFPCC-WDEREUQCSA-N	0	3	315.672	2.399	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC[C@H]1C[C@@H](O)c1ccco1	ZINC000248659117	145163228	/nfs/dbraw/zinc/16/32/28/145163228.db2.gz	UZMAAVFXEXYUEM-ARFHVFGLSA-N	0	3	311.422	2.345	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC[C@H]1C[C@H](O)c1ccco1	ZINC000248659122	145163268	/nfs/dbraw/zinc/16/32/68/145163268.db2.gz	UZMAAVFXEXYUEM-XHSDSOJGSA-N	0	3	311.422	2.345	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@H](O)c1ccccc1	ZINC000248798872	145167709	/nfs/dbraw/zinc/16/77/09/145167709.db2.gz	JLVSAYNDWNSUGE-ATZDWAIDSA-N	0	3	324.424	2.357	10	0		DEAEHN
Cc1cncc(CN2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)c1	ZINC000248885866	145172167	/nfs/dbraw/zinc/17/21/67/145172167.db2.gz	DYWGNFNQYOAXEK-JFIYKMOQSA-N	0	3	303.450	2.464	10	0		DEAEHN
Cn1cc(-c2cc(CN3CC[C@H]4OCCC[C@H]4C3)on2)cn1	ZINC000248906373	145173852	/nfs/dbraw/zinc/17/38/52/145173852.db2.gz	BHDNDNNIHATEFV-BLLLJJGKSA-N	0	3	302.378	2.076	10	0		DEAEHN
CC(C)N(C)C(=O)[C@@H](C)N1C[C@H](CO)[C@@H](c2ccsc2)C1	ZINC000249587615	145187268	/nfs/dbraw/zinc/18/72/68/145187268.db2.gz	UJFLQKKOOHDEGL-BPLDGKMQSA-N	0	3	310.463	2.011	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)[C@H](C)Oc1ccc(OC)cc1	ZINC000253383578	145202312	/nfs/dbraw/zinc/20/23/12/145202312.db2.gz	LYRHMVXCDUWQJF-KBPBESRZSA-N	0	3	306.406	2.063	10	0		DEAEHN
CC(C)OCCN1CCC(C(=O)NCc2ccccc2)CC1	ZINC000253372183	145202487	/nfs/dbraw/zinc/20/24/87/145202487.db2.gz	DPYJLBMMUYSFGZ-UHFFFAOYSA-N	0	3	304.434	2.440	10	0		DEAEHN
C[C@@H](CN1CCC[C@@H](C)C1)n1c(=O)[nH]c2ccccc2c1=O	ZINC000253612858	145203404	/nfs/dbraw/zinc/20/34/04/145203404.db2.gz	WIGIVMVTLMVVKQ-OLZOCXBDSA-N	0	3	301.390	2.395	10	0		DEAEHN
CN(C(=O)c1ccc(N)cn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000261546048	145207080	/nfs/dbraw/zinc/20/70/80/145207080.db2.gz	KQECRRJLQXXVQT-MRXNPFEDSA-N	0	3	310.401	2.010	10	0		DEAEHN
CN(Cc1cccc(F)c1)C(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C	ZINC000261613257	145210582	/nfs/dbraw/zinc/21/05/82/145210582.db2.gz	BGFZMOGVKSKMJW-IIDMSEBBSA-N	0	3	320.408	2.317	10	0		DEAEHN
Cc1cccc2ncc(CN3CCNC[C@@H]3c3cccnc3)n21	ZINC000261671328	145215653	/nfs/dbraw/zinc/21/56/53/145215653.db2.gz	GYAMGVUXZOKEMB-QGZVFWFLSA-N	0	3	307.401	2.184	10	0		DEAEHN
CC1CCN(c2cccc(NC(=O)C3(N)CCOCC3)c2)CC1	ZINC000261686888	145216729	/nfs/dbraw/zinc/21/67/29/145216729.db2.gz	CVSFDNCIZLTQGI-UHFFFAOYSA-N	0	3	317.433	2.369	10	0		DEAEHN
C[C@@H]1CN(C(=O)[C@H](N)C2CCOCC2)CC[C@H]1c1ccccc1	ZINC000261762040	145223260	/nfs/dbraw/zinc/22/32/60/145223260.db2.gz	LUGUTOBYTDINEZ-ZTFGCOKTSA-N	0	3	316.445	2.393	10	0		DEAEHN
NC1(C(=O)Nc2nc(-c3cccc(F)c3)cs2)CCOCC1	ZINC000261772684	145225126	/nfs/dbraw/zinc/22/51/26/145225126.db2.gz	GUAKONLHRMTSBM-UHFFFAOYSA-N	0	3	321.377	2.396	10	0		DEAEHN
Cc1ccc2ncc(CN3CCNC[C@@H]3c3cccnc3)n2c1	ZINC000261796314	145227363	/nfs/dbraw/zinc/22/73/63/145227363.db2.gz	VLXBZFDECXWROV-QGZVFWFLSA-N	0	3	307.401	2.184	10	0		DEAEHN
Cc1c(CNC(=O)C2(N)CCOCC2)oc2ccc(F)cc12	ZINC000261829293	145231077	/nfs/dbraw/zinc/23/10/77/145231077.db2.gz	KSRJYWYRCYMDHG-UHFFFAOYSA-N	0	3	306.337	2.004	10	0		DEAEHN
Cn1cnc2cc(CN3CCNC[C@@H]3c3cccnc3)ccc21	ZINC000261841500	145232387	/nfs/dbraw/zinc/23/23/87/145232387.db2.gz	ZTQIMFHJUXZNSB-GOSISDBHSA-N	0	3	307.401	2.115	10	0		DEAEHN
COc1ccccc1[C@@H]1CNCCN1Cc1noc(C2CC2)n1	ZINC000261874816	145236379	/nfs/dbraw/zinc/23/63/79/145236379.db2.gz	XWZMGEIYFNZUBW-AWEZNQCLSA-N	0	3	314.389	2.102	10	0		DEAEHN
N[C@H](C(=O)N1CCC[C@H](Cc2ccccc2)C1)C1CCOCC1	ZINC000262003285	145251923	/nfs/dbraw/zinc/25/19/23/145251923.db2.gz	NPUMZBNMUMJHHC-AEFFLSMTSA-N	0	3	316.445	2.222	10	0		DEAEHN
C[C@H](C[C@H]1COCCN1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000262101510	145261533	/nfs/dbraw/zinc/26/15/33/145261533.db2.gz	IUQPGCCULMRHDF-WBMJQRKESA-N	0	3	303.406	2.214	10	0		DEAEHN
NC1(C(=O)NC2CCC(c3ccccc3)CC2)CCOCC1	ZINC000262110821	145263059	/nfs/dbraw/zinc/26/30/59/145263059.db2.gz	JRSHNLLBBYKXCY-UHFFFAOYSA-N	0	3	302.418	2.337	10	0		DEAEHN
C[C@H](Cc1cccs1)NC(=O)[C@]1(N)[C@@H]2CCCO[C@H]2C1(C)C	ZINC000262399833	145281220	/nfs/dbraw/zinc/28/12/20/145281220.db2.gz	CDPBLEOHFMRECV-LSCFUAHRSA-N	0	3	322.474	2.328	10	0		DEAEHN
Cc1csc([C@H](C)NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)n1	ZINC000262430863	145283566	/nfs/dbraw/zinc/28/35/66/145283566.db2.gz	FVFSPKVCQPMUNZ-MEQWQQMJSA-N	0	3	323.462	2.161	10	0		DEAEHN
C[C@@H]1CCC[C@H](CNC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)C1	ZINC000262506828	145289144	/nfs/dbraw/zinc/28/91/44/145289144.db2.gz	MMTTVHVUSDMAKQ-FQRJBHLQSA-N	0	3	308.466	2.461	10	0		DEAEHN
CCc1nc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)sc1C	ZINC000262575856	145294404	/nfs/dbraw/zinc/29/44/04/145294404.db2.gz	YDGADXMJSPVYBM-NSODJVPESA-N	0	3	323.462	2.485	10	0		DEAEHN
C[C@@H](C(=O)NCc1cccnc1N(C)C)[C@@H](N)c1ccccc1	ZINC000262661904	145298631	/nfs/dbraw/zinc/29/86/31/145298631.db2.gz	GLVZWNJSKLBFAM-CZUORRHYSA-N	0	3	312.417	2.100	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)N(C)[C@H]1CCCN(c2ccccc2)C1	ZINC000262673631	145299172	/nfs/dbraw/zinc/29/91/72/145299172.db2.gz	QGXPNIVDNAOFEJ-BHYGNILZSA-N	0	3	303.450	2.487	10	0		DEAEHN
C[C@H]1NCCN(C(=O)c2cnn(-c3cccc(Cl)c3)c2)[C@@H]1C	ZINC000262787968	145304933	/nfs/dbraw/zinc/30/49/33/145304933.db2.gz	MSVSBQCRAOEAIW-VXGBXAGGSA-N	0	3	318.808	2.348	10	0		DEAEHN
CCc1ccc([C@H](C)c2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263189010	145334298	/nfs/dbraw/zinc/33/42/98/145334298.db2.gz	HQSNJSDHMLHHNR-SWLSCSKDSA-N	0	3	300.406	2.360	10	0		DEAEHN
COC(C)(C)C(=O)NC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000309638646	145349554	/nfs/dbraw/zinc/34/95/54/145349554.db2.gz	AYYCCPXRSCPLHN-SFHVURJKSA-N	0	3	304.434	2.440	10	0		DEAEHN
O=C(N[C@@H]1CCN(C2CC2)C1)[C@H]1C[C@@H]1c1cc(F)ccc1F	ZINC000357056627	147032120	/nfs/dbraw/zinc/03/21/20/147032120.db2.gz	SLBXDLLDUJIRKH-KYOSRNDESA-N	0	3	306.356	2.421	10	0		DEAEHN
COc1cccc(C2=CCN(C(=O)N[C@H](C)CN(C)C)CC2)c1	ZINC000358498091	147145983	/nfs/dbraw/zinc/14/59/83/147145983.db2.gz	KEGPUWPOGGXMBH-CQSZACIVSA-N	0	3	317.433	2.444	10	0		DEAEHN
COC1CCN(C(C)(C)CNC(=O)N2CCC23CCC3)CC1	ZINC000435489652	292168496	/nfs/dbraw/zinc/16/84/96/292168496.db2.gz	CMKNXTKVZBHQJS-UHFFFAOYSA-N	0	3	309.454	2.214	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc(C(=O)OC)cc2F)C1	ZINC000111763047	401723302	/nfs/dbraw/zinc/72/33/02/401723302.db2.gz	SPDZJXFXVCTYJK-GFCCVEGCSA-N	0	3	323.368	2.218	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)NCCCc1ccccc1	ZINC000111792660	401723942	/nfs/dbraw/zinc/72/39/42/401723942.db2.gz	UDIUZCOLPPXEGT-KRWDZBQOSA-N	0	3	319.449	2.029	10	0		DEAEHN
C[C@@H]1CN(C(=O)C2CCN(C)CC2)C[C@@H](c2ccc(F)cc2)O1	ZINC000073989776	401727341	/nfs/dbraw/zinc/72/73/41/401727341.db2.gz	DCBKIUDJFJTUIE-DYVFJYSZSA-N	0	3	320.408	2.456	10	0		DEAEHN
CN(C)Cc1ccc(N2CCN(C(=O)c3ccccc3)CC2)nc1	ZINC000114415662	401798650	/nfs/dbraw/zinc/79/86/50/401798650.db2.gz	FOEMMNBTIUTZPH-UHFFFAOYSA-N	0	3	324.428	2.106	10	0		DEAEHN
COC(=O)Nc1ccccc1C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000127814748	401751232	/nfs/dbraw/zinc/75/12/32/401751232.db2.gz	GSQRMDPLJHTKKF-CHWSQXEVSA-N	0	3	319.405	2.420	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)CCn2cnc3ccccc32)CCN1C	ZINC000127903857	401755134	/nfs/dbraw/zinc/75/51/34/401755134.db2.gz	FEXQLWLCEIQCEA-HUUCEWRRSA-N	0	3	314.433	2.368	10	0		DEAEHN
COC(=O)Nc1ccccc1C(=O)NCCN1CCCC[C@H]1C	ZINC000112869231	401760109	/nfs/dbraw/zinc/76/01/09/401760109.db2.gz	FGDDOPLBSFIEQO-CYBMUJFWSA-N	0	3	319.405	2.469	10	0		DEAEHN
COc1cc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc(OC)c1C	ZINC000113226770	401770879	/nfs/dbraw/zinc/77/08/79/401770879.db2.gz	ZXXLPMYFNMEIJJ-SWLSCSKDSA-N	0	3	318.417	2.321	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)C(=O)c1ccc(Cl)cc1	ZINC000113228285	401771788	/nfs/dbraw/zinc/77/17/88/401771788.db2.gz	HJHKSJOVUYHZJI-BXUZGUMPSA-N	0	3	306.793	2.218	10	0		DEAEHN
COC(=O)Nc1ccc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1	ZINC000113233184	401771966	/nfs/dbraw/zinc/77/19/66/401771966.db2.gz	LHOJYUILKSZIPA-SWLSCSKDSA-N	0	3	317.389	2.174	10	0		DEAEHN
CC[C@@H](C)CS(=O)(=O)N1CCCC[C@H](N2CCCC2)C1	ZINC000113291153	401775489	/nfs/dbraw/zinc/77/54/89/401775489.db2.gz	WGVOFXCCBUZTKS-CABCVRRESA-N	0	3	302.484	2.313	10	0		DEAEHN
CC1CCN(C(=O)CN[C@H]2CCCC[C@@H]2n2cccn2)CC1	ZINC000128421794	401776145	/nfs/dbraw/zinc/77/61/45/401776145.db2.gz	JIUDFLLNFBUAKA-HOTGVXAUSA-N	0	3	304.438	2.215	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)NCC[C@@H](C)O)c1ccccc1	ZINC000114819609	401811135	/nfs/dbraw/zinc/81/11/35/401811135.db2.gz	BGBDUHKSNDYFOZ-GDBMZVCRSA-N	0	3	307.438	2.140	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)C(C)(C)c1cccs1	ZINC000115370223	401826117	/nfs/dbraw/zinc/82/61/17/401826117.db2.gz	HTMCCDCOKJGKLX-ZDUSSCGKSA-N	0	3	310.463	2.253	10	0		DEAEHN
CC(C)CC[C@](C)(O)CNC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000077776960	401830835	/nfs/dbraw/zinc/83/08/35/401830835.db2.gz	NTAIVTVQHJLVRP-RDJZCZTQSA-N	0	3	315.502	2.449	10	0		DEAEHN
COc1ccccc1CC1CCN([C@@H]2CCN(C)C2=O)CC1	ZINC000116276149	401847658	/nfs/dbraw/zinc/84/76/58/401847658.db2.gz	LQZHOBMJHVAZEF-MRXNPFEDSA-N	0	3	302.418	2.180	10	0		DEAEHN
CNC(=O)NC(=O)[C@H](C)N[C@@H](C)c1ccc(CC(C)C)cc1	ZINC000028877670	401853504	/nfs/dbraw/zinc/85/35/04/401853504.db2.gz	COODCLLYQAJYIL-STQMWFEESA-N	0	3	305.422	2.380	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2cccc(C(F)(F)F)c2)CCO1	ZINC000116786522	401859463	/nfs/dbraw/zinc/85/94/63/401859463.db2.gz	LYSUFMOPAGDESO-CYBMUJFWSA-N	0	3	316.323	2.108	10	0		DEAEHN
CC(C)COc1cccc(C(=O)N2CCO[C@H](CN(C)C)C2)c1	ZINC000116798301	401859975	/nfs/dbraw/zinc/85/99/75/401859975.db2.gz	NMFJSVLLKSAMHR-QGZVFWFLSA-N	0	3	320.433	2.124	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)Nc1cnn(CC(F)F)c1	ZINC000116930380	401864534	/nfs/dbraw/zinc/86/45/34/401864534.db2.gz	GZZVCZMFVMDQAS-NSHDSACASA-N	0	3	315.368	2.144	10	0		DEAEHN
C[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1)[C@H]1CCCO1	ZINC000079487904	401874058	/nfs/dbraw/zinc/87/40/58/401874058.db2.gz	SGOCRGPKHOKVHK-DOTOQJQBSA-N	0	3	319.449	2.327	10	0		DEAEHN
CC(C)Oc1cccnc1C(=O)NCCN1CCC(C)CC1	ZINC000079531762	401875353	/nfs/dbraw/zinc/87/53/53/401875353.db2.gz	CJSFLTTVDKGTJH-UHFFFAOYSA-N	0	3	305.422	2.331	10	0		DEAEHN
COc1cccc(N2CCC[C@H](NCc3cncn3C)C2)c1	ZINC000117390224	401875637	/nfs/dbraw/zinc/87/56/37/401875637.db2.gz	ODSGPODYOBCROK-AWEZNQCLSA-N	0	3	300.406	2.187	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Cc2ccccc2OC(F)F)C1	ZINC000118333805	401895718	/nfs/dbraw/zinc/89/57/18/401895718.db2.gz	ZISUAJBZBPDSMU-CYBMUJFWSA-N	0	3	312.360	2.431	10	0		DEAEHN
O=C(CNC1CCOCC1)Nc1cccc(Br)c1	ZINC000036319680	401904339	/nfs/dbraw/zinc/90/43/39/401904339.db2.gz	NSEXYAOBRAPYDF-UHFFFAOYSA-N	0	3	313.195	2.156	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)Nc2ccc(F)cc2Cl)CCO1	ZINC000118789985	401907974	/nfs/dbraw/zinc/90/79/74/401907974.db2.gz	UXEVSXBZBWAQAD-LLVKDONJSA-N	0	3	315.776	2.273	10	0		DEAEHN
COCCc1nc(C)c([C@H](C)NCCc2nc(C)no2)s1	ZINC000089519006	401950921	/nfs/dbraw/zinc/95/09/21/401950921.db2.gz	KTSAIKXMHPICJE-VIFPVBQESA-N	0	3	310.423	2.225	10	0		DEAEHN
CC1CCN(CCN2CCC[C@@H]2C(=O)Nc2nccs2)CC1	ZINC000119511885	401955529	/nfs/dbraw/zinc/95/55/29/401955529.db2.gz	RIDNYXQFRCSOME-CQSZACIVSA-N	0	3	322.478	2.278	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccnc(N2CCCCC2)c1)N(C)C	ZINC000136515451	401969129	/nfs/dbraw/zinc/96/91/29/401969129.db2.gz	VNOWYOCVIRAYCZ-INIZCTEOSA-N	0	3	318.465	2.418	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)NC[C@H](C)N(C)C1CC1	ZINC000119867368	401969340	/nfs/dbraw/zinc/96/93/40/401969340.db2.gz	NAJLGMCLJVSYIT-LBPRGKRZSA-N	0	3	310.467	2.200	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)c2ccnc(OCCN(C)C)c2)CC1	ZINC000136718748	401972557	/nfs/dbraw/zinc/97/25/57/401972557.db2.gz	AJDVXSITOZKDAH-CQSZACIVSA-N	0	3	305.422	2.284	10	0		DEAEHN
C[C@H](CN1CC[C@H](Cc2ccc(F)cc2)C1)CS(C)(=O)=O	ZINC000119292988	401938649	/nfs/dbraw/zinc/93/86/49/401938649.db2.gz	OJDQNQVCWYIOIO-UKRRQHHQSA-N	0	3	313.438	2.371	10	0		DEAEHN
NC(=O)C[C@H](N)c1ccc(Br)c(Br)c1	ZINC000044256403	401940444	/nfs/dbraw/zinc/94/04/44/401940444.db2.gz	OWPQPEAWLWQYTP-QMMMGPOBSA-N	0	3	322.000	2.087	10	0		DEAEHN
NC(=O)C[C@@H](N)c1ccc(Br)c(Br)c1	ZINC000044256400	401940487	/nfs/dbraw/zinc/94/04/87/401940487.db2.gz	OWPQPEAWLWQYTP-MRVPVSSYSA-N	0	3	322.000	2.087	10	0		DEAEHN
O=C(NCCC1=CCCCC1)NC[C@@H](O)CN1CCCCC1	ZINC000049172385	402013808	/nfs/dbraw/zinc/01/38/08/402013808.db2.gz	NLOJRHKTGMCXMN-MRXNPFEDSA-N	0	3	309.454	2.023	10	0		DEAEHN
CC[C@@H]1CCCCCN1Cc1cnc(N2CCN(C)CC2)nc1	ZINC000093530202	402016742	/nfs/dbraw/zinc/01/67/42/402016742.db2.gz	VLLPPSCDUNGJAM-QGZVFWFLSA-N	0	3	317.481	2.383	10	0		DEAEHN
CCCOc1cccc(CN2CCN([C@@H](CC)CO)CC2)c1	ZINC000093740213	402019769	/nfs/dbraw/zinc/01/97/69/402019769.db2.gz	QOOVUUCDDDFHED-KRWDZBQOSA-N	0	3	306.450	2.364	10	0		DEAEHN
CCOc1ccnc(N2CCN(C[C@H]3CC=CCC3)CC2)n1	ZINC000121500299	402040337	/nfs/dbraw/zinc/04/03/37/402040337.db2.gz	LLNWWMOFVBDVLE-HNNXBMFYSA-N	0	3	302.422	2.354	10	0		DEAEHN
CCc1oc(C(=O)NC[C@@H](C)CN2CCN(CC)CC2)cc1C	ZINC000121886565	402056006	/nfs/dbraw/zinc/05/60/06/402056006.db2.gz	NLDPFHKJJXPNAI-CQSZACIVSA-N	0	3	321.465	2.154	10	0		DEAEHN
CC[C@](C)(O)CN1CCN(Cc2ccc(OC)c(F)c2)CC1	ZINC000123288919	402120056	/nfs/dbraw/zinc/12/00/56/402120056.db2.gz	DVZGCESWBZPERO-KRWDZBQOSA-N	0	3	310.413	2.113	10	0		DEAEHN
COc1cc(C)c([C@H](C)N[C@H]2CCC(=O)N(C)C2)cc1OC	ZINC000152362729	402092228	/nfs/dbraw/zinc/09/22/28/402092228.db2.gz	FRYQOOSXGBOZLD-STQMWFEESA-N	0	3	306.406	2.284	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1cncc(F)c1	ZINC000123176292	402114109	/nfs/dbraw/zinc/11/41/09/402114109.db2.gz	WFXWLGZVRAELDP-MRXNPFEDSA-N	0	3	301.365	2.123	10	0		DEAEHN
COc1ccc2c(c1)[C@H](NC[C@@H](C)N1CCOCC1)CCCO2	ZINC000123246791	402117446	/nfs/dbraw/zinc/11/74/46/402117446.db2.gz	NQMLQVLNQYBAMZ-RHSMWYFYSA-N	0	3	320.433	2.219	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC(c2nncn2C(C)C)CC1)N(C)C	ZINC000153412833	402143383	/nfs/dbraw/zinc/14/33/83/402143383.db2.gz	DXJBRGYDDIUQLN-HNNXBMFYSA-N	0	3	321.469	2.295	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cccc(-c3nc[nH]n3)c2)CCN1C	ZINC000154016654	402187208	/nfs/dbraw/zinc/18/72/08/402187208.db2.gz	DWRGAVAFALARLN-SWLSCSKDSA-N	0	3	313.405	2.026	10	0		DEAEHN
CC(=O)CCN1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000103480489	402190777	/nfs/dbraw/zinc/19/07/77/402190777.db2.gz	KJYXCAVTBNKFIX-UHFFFAOYSA-N	0	3	300.362	2.290	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2sccc2Br)C1	ZINC000104188507	402199999	/nfs/dbraw/zinc/19/99/99/402199999.db2.gz	RDCVXHIJGOWZGR-MRVPVSSYSA-N	0	3	303.225	2.287	10	0		DEAEHN
CC(C)c1ccccc1OC[C@@H](O)CN1CCC[C@@](C)(O)C1	ZINC000124838964	402200142	/nfs/dbraw/zinc/20/01/42/402200142.db2.gz	NHBKRIFZIKKERN-MAUKXSAKSA-N	0	3	307.434	2.397	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)CSCc2cccnc2)CCN1C	ZINC000124119944	402165183	/nfs/dbraw/zinc/16/51/83/402165183.db2.gz	AXYGFJVLXWFADC-ZFWWWQNUSA-N	0	3	307.463	2.256	10	0		DEAEHN
c1ccc(CNc2nc(-c3cccnc3)nc3c2CCNC3)nc1	ZINC000067674808	402167062	/nfs/dbraw/zinc/16/70/62/402167062.db2.gz	PDTTVOAUOVEDFX-UHFFFAOYSA-N	0	3	318.384	2.191	10	0		DEAEHN
O=C(CN1CCC[C@@H]1C1CCC1)N1CCO[C@H]2CCCC[C@@H]21	ZINC000102927458	402175060	/nfs/dbraw/zinc/17/50/60/402175060.db2.gz	WHZIJCHFYCOVSB-IKGGRYGDSA-N	0	3	306.450	2.421	10	0		DEAEHN
CCc1noc(CC)c1CC(=O)N(C)C[C@@H]1CCCN1CC	ZINC000154661575	402224629	/nfs/dbraw/zinc/22/46/29/402224629.db2.gz	VBCQJVHCCZDRRA-ZDUSSCGKSA-N	0	3	307.438	2.285	10	0		DEAEHN
O=C(Nc1ccsc1)C(=O)N1CCCC[C@@H](N2CCCC2)C1	ZINC000125319519	402226055	/nfs/dbraw/zinc/22/60/55/402226055.db2.gz	YQLLKOQKXRQTOA-CQSZACIVSA-N	0	3	321.446	2.164	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Cc1c(OC)cccc1OC	ZINC000125548884	402238581	/nfs/dbraw/zinc/23/85/81/402238581.db2.gz	JYMMWTGQKSKATK-AWEZNQCLSA-N	0	3	320.433	2.189	10	0		DEAEHN
Clc1ccccc1-c1cc2c(N3CCNCC3)nccn2n1	ZINC000070459157	402261442	/nfs/dbraw/zinc/26/14/42/402261442.db2.gz	YZQIFPUQHFBBGP-UHFFFAOYSA-N	0	3	313.792	2.459	10	0		DEAEHN
CNC(=O)[C@H](NCc1ccc(Br)s1)C(C)C	ZINC000125027980	402209719	/nfs/dbraw/zinc/20/97/19/402209719.db2.gz	JRQYHQCHTZDKAC-SNVBAGLBSA-N	0	3	305.241	2.371	10	0		DEAEHN
CC[C@H]1CN(Cc2ccc(C(=O)OC)cc2)CCN1CCOC	ZINC000106114480	402212807	/nfs/dbraw/zinc/21/28/07/402212807.db2.gz	XOFICAFHMVBWKA-KRWDZBQOSA-N	0	3	320.433	2.016	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCOC2)CN1Cc1ccccc1	ZINC000176597506	402321981	/nfs/dbraw/zinc/32/19/81/402321981.db2.gz	ABSXIIYWOSTPGI-DJIMGWMZSA-N	0	3	317.433	2.128	10	0		DEAEHN
CC(C)[C@@H](C)NC(=O)N(C)C1CCN(CCn2cccn2)CC1	ZINC000109391463	402271798	/nfs/dbraw/zinc/27/17/98/402271798.db2.gz	FKTRZPWCOXALFZ-OAHLLOKOSA-N	0	3	321.469	2.033	10	0		DEAEHN
CN1CCC(Oc2ccc(NC(=O)c3ccco3)cn2)CC1	ZINC000071564861	402275912	/nfs/dbraw/zinc/27/59/12/402275912.db2.gz	ZIQUAKZNLVXCGS-UHFFFAOYSA-N	0	3	301.346	2.400	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1csc(Br)c1	ZINC000221246151	402303632	/nfs/dbraw/zinc/30/36/32/402303632.db2.gz	DNCVQLJXQZPTDW-VIFPVBQESA-N	0	3	303.225	2.335	10	0		DEAEHN
CCOc1cccnc1C(=O)NCCN1CCCC[C@@H]1CC	ZINC000176386958	402304611	/nfs/dbraw/zinc/30/46/11/402304611.db2.gz	FSAOVYJHVTZKRH-AWEZNQCLSA-N	0	3	305.422	2.475	10	0		DEAEHN
CCO[C@@H](CCNC(=O)N1CC[C@@H](N(C)C)C1)C1CCCC1	ZINC000176504720	402315907	/nfs/dbraw/zinc/31/59/07/402315907.db2.gz	ORCFXENCBDKSLS-CVEARBPZSA-N	0	3	311.470	2.317	10	0		DEAEHN
Cc1c2ccccc2[nH]c(=O)c1C(=O)N1CCN2CCC[C@H]2C1	ZINC000176519958	402316767	/nfs/dbraw/zinc/31/67/67/402316767.db2.gz	CJAYAKPDPDHJGP-ZDUSSCGKSA-N	0	3	311.385	2.169	10	0		DEAEHN
CCc1ccccc1NC(=O)C(=O)N(C)C[C@H]1CCCN1CC	ZINC000176898427	402348122	/nfs/dbraw/zinc/34/81/22/402348122.db2.gz	RAJZCQMFZRLZLH-OAHLLOKOSA-N	0	3	317.433	2.130	10	0		DEAEHN
COC(=O)c1coc(C(=O)N[C@H](C)CN2CCCCCC2)c1	ZINC000185443701	402352622	/nfs/dbraw/zinc/35/26/22/402352622.db2.gz	ZYBFFNSBJYJDOI-GFCCVEGCSA-N	0	3	308.378	2.061	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc2ccccc2oc1=O	ZINC000176974409	402355856	/nfs/dbraw/zinc/35/58/56/402355856.db2.gz	LQQKLOGRYFFQSJ-AWEZNQCLSA-N	0	3	314.385	2.349	10	0		DEAEHN
CN(C)C[C@@H]1CCCN1C(=O)c1cccc(Br)n1	ZINC000234239730	402359533	/nfs/dbraw/zinc/35/95/33/402359533.db2.gz	VVSPSYVVABBNEH-JTQLQIEISA-N	0	3	312.211	2.010	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)c1ccc2c(c1)CCC2	ZINC000177031932	402361890	/nfs/dbraw/zinc/36/18/90/402361890.db2.gz	KMYZLTLGPWSVGI-QGZVFWFLSA-N	0	3	314.429	2.301	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1C(=O)c1[nH]nc2ccccc21	ZINC000177169570	402377807	/nfs/dbraw/zinc/37/78/07/402377807.db2.gz	WTLGITIRCJRVOR-CYBMUJFWSA-N	0	3	309.373	2.373	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCc1ccccc1F	ZINC000177298111	402388862	/nfs/dbraw/zinc/38/88/62/402388862.db2.gz	FVUBUWXIGTZMBH-HNNXBMFYSA-N	0	3	307.413	2.494	10	0		DEAEHN
CCC[C@H](C(=O)N1CCC(O)(c2ccccc2)CC1)N(C)C	ZINC000185862147	402383512	/nfs/dbraw/zinc/38/35/12/402383512.db2.gz	WWJNADMUDGSPRZ-MRXNPFEDSA-N	0	3	304.434	2.227	10	0		DEAEHN
C[C@@H](N(C)CC(=O)NCCN1CCc2ccccc21)C1(C)CC1	ZINC000177231093	402383994	/nfs/dbraw/zinc/38/39/94/402383994.db2.gz	DREZVMZXAWOBPK-OAHLLOKOSA-N	0	3	315.461	2.286	10	0		DEAEHN
COc1csc(C(=O)N2CCc3ccccc3[C@H]2CN)c1	ZINC000227720177	402333900	/nfs/dbraw/zinc/33/39/00/402333900.db2.gz	PLBJLDXYKDIDQC-CQSZACIVSA-N	0	3	302.399	2.455	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C)N(C)C	ZINC000161802695	402399649	/nfs/dbraw/zinc/39/96/49/402399649.db2.gz	SEGLHAHQSXSERL-SJORKVTESA-N	0	3	305.466	2.444	10	0		DEAEHN
CCC[C@@H]1CCCCN1C(=O)NC[C@@H]1CCCN1CCOC	ZINC000186139542	402404842	/nfs/dbraw/zinc/40/48/42/402404842.db2.gz	RBIXTBLTCQFEEY-CVEARBPZSA-N	0	3	311.470	2.461	10	0		DEAEHN
CCC[C@H]1CCCCN1C(=O)NC[C@H]1CCCN1CCOC	ZINC000186139592	402404878	/nfs/dbraw/zinc/40/48/78/402404878.db2.gz	RBIXTBLTCQFEEY-JKSUJKDBSA-N	0	3	311.470	2.461	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2cccc3c2OCO3)C12CCOCC2	ZINC000186265508	402415964	/nfs/dbraw/zinc/41/59/64/402415964.db2.gz	AZCDTJFPOBMSOD-HZPDHXFCSA-N	0	3	319.401	2.479	10	0		DEAEHN
CCOCCC1(CNC(=O)N2CCN3CCC[C@H]3C2)CCCC1	ZINC000177620791	402421161	/nfs/dbraw/zinc/42/11/61/402421161.db2.gz	VQHIBYWVFBGJSB-INIZCTEOSA-N	0	3	323.481	2.463	10	0		DEAEHN
CCO[C@H]1C[C@H](NCc2ccc(C(=O)OC)o2)C12CCOCC2	ZINC000186338605	402422661	/nfs/dbraw/zinc/42/26/61/402422661.db2.gz	JBIFKBXUNCTYBP-GJZGRUSLSA-N	0	3	323.389	2.130	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)COc2ccc3c(c2)CCCC3)C1	ZINC000162605136	402426042	/nfs/dbraw/zinc/42/60/42/402426042.db2.gz	LSIIJPZLKUHAES-INIZCTEOSA-N	0	3	302.418	2.107	10	0		DEAEHN
CCSCc1cc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)no1	ZINC000186374072	402426415	/nfs/dbraw/zinc/42/64/15/402426415.db2.gz	RSTJLCPHXMSPAG-SMDDNHRTSA-N	0	3	311.451	2.386	10	0		DEAEHN
O=C(Nc1cccc2ccccc21)C(=O)N1CCN2CCC[C@H]2C1	ZINC000177684445	402426858	/nfs/dbraw/zinc/42/68/58/402426858.db2.gz	CTBOAYHHQUKKDX-HNNXBMFYSA-N	0	3	323.396	2.085	10	0		DEAEHN
CC(C)N1CCC[C@@H](N2CC[C@H](CNc3ccccn3)C2)C1=O	ZINC000177698540	402427647	/nfs/dbraw/zinc/42/76/47/402427647.db2.gz	QYUYOEQUDYMLHW-HZPDHXFCSA-N	0	3	316.449	2.215	10	0		DEAEHN
Cc1cccc(C)c1OC[C@H](O)CN1CCN2CCCC[C@@H]2C1	ZINC000177754392	402432820	/nfs/dbraw/zinc/43/28/20/402432820.db2.gz	XILKERCIDTVUQE-QZTJIDSGSA-N	0	3	318.461	2.213	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(OC)c1O	ZINC000177763722	402433367	/nfs/dbraw/zinc/43/33/67/402433367.db2.gz	VYUXOTVRZRPALH-OLZOCXBDSA-N	0	3	304.390	2.100	10	0		DEAEHN
Cc1ccccc1NC(=O)CCN1CCN2CCCC[C@@H]2C1	ZINC000177774790	402434465	/nfs/dbraw/zinc/43/44/65/402434465.db2.gz	NFWKBLIAZZKDJJ-MRXNPFEDSA-N	0	3	301.434	2.494	10	0		DEAEHN
COC(=O)[C@@H](c1ccccc1C)N1CCN2CCCC[C@@H]2C1	ZINC000163165750	402443378	/nfs/dbraw/zinc/44/33/78/402443378.db2.gz	DXUIIMQOBCAUQK-NVXWUHKLSA-N	0	3	302.418	2.379	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2CC(=O)Nc1ccccc1OC	ZINC000177307695	402389535	/nfs/dbraw/zinc/38/95/35/402389535.db2.gz	GOWIFTOUWTVDLB-CABCVRRESA-N	0	3	317.433	2.192	10	0		DEAEHN
CCOc1ncccc1CNC(=O)N(C)C[C@@H]1CCCN1CC	ZINC000177348737	402393825	/nfs/dbraw/zinc/39/38/25/402393825.db2.gz	ILAJYKKSJVWJOV-HNNXBMFYSA-N	0	3	320.437	2.106	10	0		DEAEHN
CCc1cc(NC(=O)C(=O)N(C)CCN(C)C2CC2)ccc1C	ZINC000187729355	402509892	/nfs/dbraw/zinc/50/98/92/402509892.db2.gz	VHXBDLDGICDAHS-UHFFFAOYSA-N	0	3	317.433	2.049	10	0		DEAEHN
Cc1nc(C(=O)N(CCN(C)C)Cc2ccccn2)c(C)s1	ZINC000178547444	402510254	/nfs/dbraw/zinc/51/02/54/402510254.db2.gz	JJKHDAJSNQKRGL-UHFFFAOYSA-N	0	3	318.446	2.359	10	0		DEAEHN
CCN1CC[C@@H](N(C)CCS(=O)(=O)c2ccccc2)[C@@H](C)C1	ZINC000245415849	402458085	/nfs/dbraw/zinc/45/80/85/402458085.db2.gz	DPZJVEGEGMAYNE-DOTOQJQBSA-N	0	3	324.490	2.122	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@H]1Oc2ccccc2O[C@@H]1C	ZINC000245431826	402460487	/nfs/dbraw/zinc/46/04/87/402460487.db2.gz	NLQPXEOICMMPSY-CPUCHLNUSA-N	0	3	318.417	2.158	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@H](C)C(=O)Nc1ccnn1C(C)C	ZINC000245470046	402463830	/nfs/dbraw/zinc/46/38/30/402463830.db2.gz	MLFVPGKLZLREHC-CABCVRRESA-N	0	3	321.469	2.207	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000245470646	402463885	/nfs/dbraw/zinc/46/38/85/402463885.db2.gz	NCAMHGFEFYSKTJ-GDBMZVCRSA-N	0	3	319.449	2.449	10	0		DEAEHN
C[C@H](N[C@@H]1CCCN(c2ncccn2)C1)c1cncc(F)c1	ZINC000178194790	402470117	/nfs/dbraw/zinc/47/01/17/402470117.db2.gz	KZWFDTKBQYDWOG-SWLSCSKDSA-N	0	3	301.369	2.330	10	0		DEAEHN
CC(C)N1C[C@H](C)[C@H](NC(=O)c2cn(C)nc2C(C)(C)C)C1	ZINC000245554039	402471027	/nfs/dbraw/zinc/47/10/27/402471027.db2.gz	GLGJNVUVDVYAGL-GXTWGEPZSA-N	0	3	306.454	2.176	10	0		DEAEHN
CC[C@@H]1CN(C(=O)[C@H]2CCCCN2CC)CCN1CC(F)F	ZINC000245723288	402483593	/nfs/dbraw/zinc/48/35/93/402483593.db2.gz	HXDZGIODXWYFRV-ZIAGYGMSSA-N	0	3	317.424	2.049	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H](C)c1ccncc1OC	ZINC000187163720	402486020	/nfs/dbraw/zinc/48/60/20/402486020.db2.gz	ONCRASLXUBMDLI-UONOGXRCSA-N	0	3	320.437	2.277	10	0		DEAEHN
CN1C(=O)CCc2cc(CN[C@@H]3Cc4ccccc4[C@@H]3O)ccc21	ZINC000187245367	402489697	/nfs/dbraw/zinc/48/96/97/402489697.db2.gz	WJDFLMXKBVWKLB-XLIONFOSSA-N	0	3	322.408	2.344	10	0		DEAEHN
CN1CC[C@H](NC(=O)Cc2ccccc2O)[C@H]1c1ccccc1	ZINC000245847321	402491139	/nfs/dbraw/zinc/49/11/39/402491139.db2.gz	IRLIQGDVYKHYPY-QFBILLFUSA-N	0	3	310.397	2.496	10	0		DEAEHN
CC(C)(C)OC[C@@H](O)CN(CCc1ccccc1)[C@H]1CCOC1	ZINC000245873436	402493231	/nfs/dbraw/zinc/49/32/31/402493231.db2.gz	HKJSXDZZHVZCEK-ROUUACIJSA-N	0	3	321.461	2.496	10	0		DEAEHN
CC(=O)Nc1ccc(Cl)c(C(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000178576788	402513742	/nfs/dbraw/zinc/51/37/42/402513742.db2.gz	HHAFMTOSZSXHDI-CYBMUJFWSA-N	0	3	321.808	2.219	10	0		DEAEHN
CN1CC[C@H](NC(=O)Cc2cccc(O)c2)[C@H]1c1ccccc1	ZINC000245916376	402496906	/nfs/dbraw/zinc/49/69/06/402496906.db2.gz	RXOWNMHDBKNGEV-PKOBYXMFSA-N	0	3	310.397	2.496	10	0		DEAEHN
COc1cc([C@H](C)NC[C@@H]2CC[C@@H](C(=O)N(C)C)O2)ccc1F	ZINC000246049298	402505395	/nfs/dbraw/zinc/50/53/95/402505395.db2.gz	PINBEBPELUNHSZ-WHOFXGATSA-N	0	3	324.396	2.121	10	0		DEAEHN
Cc1cnc(CCN(C)C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)s1	ZINC000246709019	402541552	/nfs/dbraw/zinc/54/15/52/402541552.db2.gz	NHYYVDRUVFVHFZ-OCCSQVGLSA-N	0	3	324.494	2.364	10	0		DEAEHN
Cc1cc(C)n([C@H](C)C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)n1	ZINC000246720581	402541946	/nfs/dbraw/zinc/54/19/46/402541946.db2.gz	OEKAVKGKOISMCY-OWCLPIDISA-N	0	3	304.438	2.004	10	0		DEAEHN
CC[C@@H]1CCCCN1CCNC(=O)N1CCN2CCCC[C@H]2C1	ZINC000246771407	402544226	/nfs/dbraw/zinc/54/42/26/402544226.db2.gz	NUWNZLIYHIQAJI-SJORKVTESA-N	0	3	322.497	2.131	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)N1CCN2CCCC[C@H]2C1	ZINC000246771394	402544337	/nfs/dbraw/zinc/54/43/37/402544337.db2.gz	NUWNZLIYHIQAJI-IRXDYDNUSA-N	0	3	322.497	2.131	10	0		DEAEHN
CC(C)(C)OC(=O)[C@@H]1CCN(C[C@H](O)Cc2ccccc2)C1	ZINC000178837253	402545459	/nfs/dbraw/zinc/54/54/59/402545459.db2.gz	LPBYKWGZWYOLID-HZPDHXFCSA-N	0	3	305.418	2.254	10	0		DEAEHN
Cc1cccc(OCCNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000247695905	402574701	/nfs/dbraw/zinc/57/47/01/402574701.db2.gz	WRQPVGRPABDGLX-JKSUJKDBSA-N	0	3	319.449	2.498	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@H](c2ccccc2)N(C)C)C1	ZINC000247042679	402554676	/nfs/dbraw/zinc/55/46/76/402554676.db2.gz	ICNJZYRMSBLSEI-PVAVHDDUSA-N	0	3	303.450	2.134	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N2CC[C@@H](N(C)C)C2)C1(CC)CC	ZINC000247081605	402556254	/nfs/dbraw/zinc/55/62/54/402556254.db2.gz	PGJGJVWSSYBFJQ-QLFBSQMISA-N	0	3	311.470	2.316	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc(-c2cccs2)n[nH]1	ZINC000247221709	402560687	/nfs/dbraw/zinc/56/06/87/402560687.db2.gz	MJEJCBBFRSLERQ-RYUDHWBXSA-N	0	3	316.430	2.447	10	0		DEAEHN
COc1cccc(OC)c1C(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000247324990	402563554	/nfs/dbraw/zinc/56/35/54/402563554.db2.gz	OXGYDRANCFTGSF-STQMWFEESA-N	0	3	304.390	2.013	10	0		DEAEHN
Cc1cccc(C)c1OC[C@H](C)NC(=O)NC[C@@H]1CCCN1C	ZINC000171192880	402565516	/nfs/dbraw/zinc/56/55/16/402565516.db2.gz	OPWBLUPSIZIFOC-HOTGVXAUSA-N	0	3	319.449	2.464	10	0		DEAEHN
Cc1noc2nc(C)cc(C(=O)N3C[C@@H]4CCCN4C[C@H]3C)c12	ZINC000247403070	402566131	/nfs/dbraw/zinc/56/61/31/402566131.db2.gz	PNVQYXJGSBRLDI-YPMHNXCESA-N	0	3	314.389	2.148	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CC(C)(C)OC(C)(C)C2)C1	ZINC000188199193	402516825	/nfs/dbraw/zinc/51/68/25/402516825.db2.gz	XIMMHVPPPPOPTN-KGLIPLIRSA-N	0	3	311.470	2.314	10	0		DEAEHN
C[C@H](C(=O)Nc1cccc(Cl)c1)N1CCN2CCC[C@@H]2C1	ZINC000178623350	402518277	/nfs/dbraw/zinc/51/82/77/402518277.db2.gz	IDONSLSDIJYFQS-IUODEOHRSA-N	0	3	307.825	2.447	10	0		DEAEHN
CSc1ccc(NC(=O)CN2CCN3CCC[C@@H]3C2)cc1	ZINC000178636063	402520366	/nfs/dbraw/zinc/52/03/66/402520366.db2.gz	BMEHLDRYZVUGOO-CQSZACIVSA-N	0	3	305.447	2.127	10	0		DEAEHN
CN(C)CCN(C(=O)c1cn2ccnc2s1)C1CCCC1	ZINC000188625471	402522408	/nfs/dbraw/zinc/52/24/08/402522408.db2.gz	FENNCJPTFOAEPC-UHFFFAOYSA-N	0	3	306.435	2.342	10	0		DEAEHN
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170834789	402530934	/nfs/dbraw/zinc/53/09/34/402530934.db2.gz	FHCONRCONAHSDG-ZBFHGGJFSA-N	0	3	319.449	2.362	10	0		DEAEHN
COc1ccccc1N1CCC(NC(=O)C2(N)CCCC2)CC1	ZINC000178737694	402532404	/nfs/dbraw/zinc/53/24/04/402532404.db2.gz	DILMYWPFMTZOON-UHFFFAOYSA-N	0	3	317.433	2.052	10	0		DEAEHN
CC[C@@H](O)CN(Cc1ccccc1)C[C@@H](O)COC(C)(C)C	ZINC000246489987	402533016	/nfs/dbraw/zinc/53/30/16/402533016.db2.gz	HBOUQSJBGGFZSY-IAGOWNOFSA-N	0	3	309.450	2.436	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H](C)Oc2cccc(F)c2)C1	ZINC000246511090	402534648	/nfs/dbraw/zinc/53/46/48/402534648.db2.gz	WZUZOGPLPPIJDN-ZFWWWQNUSA-N	0	3	323.412	2.377	10	0		DEAEHN
COc1ccc(S[C@@H](C)C(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170865032	402534845	/nfs/dbraw/zinc/53/48/45/402534845.db2.gz	AVSHZTLZAIYBOT-STQMWFEESA-N	0	3	308.447	2.338	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cc(C3CC3)n(C(C)(C)C)n2)C1	ZINC000170865520	402534936	/nfs/dbraw/zinc/53/49/36/402534936.db2.gz	FHLIFUNMOWINSH-CYBMUJFWSA-N	0	3	304.438	2.292	10	0		DEAEHN
Cc1cc(CCNC(=O)NC[C@H](C)N(C)C2CC2)cc(C)c1O	ZINC000189361934	402535669	/nfs/dbraw/zinc/53/56/69/402535669.db2.gz	OOMPEIVRBVOZPV-AWEZNQCLSA-N	0	3	319.449	2.333	10	0		DEAEHN
CN1CC[C@H](NC(=O)NCc2cscn2)[C@@H]1c1ccccc1	ZINC000179142944	402575989	/nfs/dbraw/zinc/57/59/89/402575989.db2.gz	MFUGWOWUHVGXES-GJZGRUSLSA-N	0	3	316.430	2.388	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)C[C@H]2CCOc3ccccc32)C1	ZINC000246657831	402539759	/nfs/dbraw/zinc/53/97/59/402539759.db2.gz	GLFUBRKGYUXASX-HUUCEWRRSA-N	0	3	302.418	2.401	10	0		DEAEHN
CC[C@H](COC)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179175041	402578313	/nfs/dbraw/zinc/57/83/13/402578313.db2.gz	CTRVCRWVZHMKIO-BZUAXINKSA-N	0	3	305.422	2.156	10	0		DEAEHN
CN1CC[C@H](NC(=O)NC[C@]2(C)CCCO2)[C@H]1c1ccccc1	ZINC000179195040	402579900	/nfs/dbraw/zinc/57/99/00/402579900.db2.gz	KQCIQNMRZFBJSF-JZXOWHBKSA-N	0	3	317.433	2.300	10	0		DEAEHN
CN(Cc1ccccc1)C(=O)CN1CC[C@]2(O)CCCC[C@H]2C1	ZINC000248045576	402581395	/nfs/dbraw/zinc/58/13/95/402581395.db2.gz	UVXOYTYXLDMHJK-PKOBYXMFSA-N	0	3	316.445	2.272	10	0		DEAEHN
CCC[C@](C)(CO)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248067125	402581578	/nfs/dbraw/zinc/58/15/78/402581578.db2.gz	PWCVGEKHXHEHHK-XYJFISCASA-N	0	3	319.449	2.282	10	0		DEAEHN
CN(CCN1CCS[C@@H]2COCC[C@@H]21)Cc1ccc(F)cc1	ZINC000248558458	402595537	/nfs/dbraw/zinc/59/55/37/402595537.db2.gz	IUNSXQFDPWAQAB-DLBZAZTESA-N	0	3	324.465	2.464	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)N[C@@H]1CCCC[C@H]1n1cccn1	ZINC000248567640	402596015	/nfs/dbraw/zinc/59/60/15/402596015.db2.gz	JTVBVRPNBWHAGG-HZPDHXFCSA-N	0	3	319.453	2.102	10	0		DEAEHN
O=C(N1CCN2CCC[C@H]2C1)C1(c2ccccc2)CCOCC1	ZINC000171586470	402597776	/nfs/dbraw/zinc/59/77/76/402597776.db2.gz	CNUNUCJINWTLEB-KRWDZBQOSA-N	0	3	314.429	2.041	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N1CCN2CCC[C@@H]2C1)c1ccc(F)cc1	ZINC000171639529	402604274	/nfs/dbraw/zinc/60/42/74/402604274.db2.gz	XJZUBZQCNGFKLU-GRDNDAEWSA-N	0	3	319.424	2.171	10	0		DEAEHN
C[C@@H](C(=O)Nc1ccccc1Cl)N1CCN2CCC[C@@H]2C1	ZINC000171639456	402604634	/nfs/dbraw/zinc/60/46/34/402604634.db2.gz	WOLGXHRZCUUYCE-QWHCGFSZSA-N	0	3	307.825	2.447	10	0		DEAEHN
C[C@@H]1CN(C2CCN(C[C@](C)(O)c3ccccc3)CC2)CCO1	ZINC000171647839	402605747	/nfs/dbraw/zinc/60/57/47/402605747.db2.gz	IALSCYWQBDDHBA-APWZRJJASA-N	0	3	318.461	2.079	10	0		DEAEHN
COc1cc(CN2CCCC[C@@H]2CN2CCOCC2)ccc1O	ZINC000180075777	402607168	/nfs/dbraw/zinc/60/71/68/402607168.db2.gz	UDIDSEHFGDEEAN-MRXNPFEDSA-N	0	3	320.433	2.088	10	0		DEAEHN
C[C@@H]1C[C@@H](O)C[C@H](C)N1C[C@H](O)COc1ccccc1Cl	ZINC000248840457	402610699	/nfs/dbraw/zinc/61/06/99/402610699.db2.gz	PGOWTFVMUSSSET-CRWXNKLISA-N	0	3	313.825	2.313	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CCOC[C@H]1C	ZINC000248867532	402612254	/nfs/dbraw/zinc/61/22/54/402612254.db2.gz	NQUFVBNRHQSOBF-AHCXZYCDSA-N	0	3	316.445	2.296	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1csc(C(F)(F)F)n1	ZINC000248913291	402614020	/nfs/dbraw/zinc/61/40/20/402614020.db2.gz	NPAXTZPTXVADBU-BDAKNGLRSA-N	0	3	319.352	2.471	10	0		DEAEHN
CN(C[C@@H](O)CO[C@H]1CCCc2ccccc21)CC1(CO)CC1	ZINC000248955658	402616219	/nfs/dbraw/zinc/61/62/19/402616219.db2.gz	CQQWHJLLOODART-AEFFLSMTSA-N	0	3	319.445	2.146	10	0		DEAEHN
CCC(CC)n1nc(C(=O)N2CCN3CCC[C@H]3C2)cc1C	ZINC000180449159	402616838	/nfs/dbraw/zinc/61/68/38/402616838.db2.gz	HYHRWFUEICRHGC-HNNXBMFYSA-N	0	3	304.438	2.473	10	0		DEAEHN
CO[C@@H]1CC[C@@H](NC(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000249028123	402617672	/nfs/dbraw/zinc/61/76/72/402617672.db2.gz	LGXHKOCNRJJQKB-BRWVUGGUSA-N	0	3	319.449	2.026	10	0		DEAEHN
O=C(Nc1ccc2oc(=O)ccc2c1)N1CCN2CCC[C@@H]2C1	ZINC000171806835	402624120	/nfs/dbraw/zinc/62/41/20/402624120.db2.gz	MASYKSZVFPFYRQ-CQSZACIVSA-N	0	3	313.357	2.105	10	0		DEAEHN
CCc1ccccc1S(=O)(=O)N1C[C@H]2CCCN2C[C@H]1C	ZINC000249466935	402630291	/nfs/dbraw/zinc/63/02/91/402630291.db2.gz	QRBJFOOLPJEWEM-UKRRQHHQSA-N	0	3	308.447	2.106	10	0		DEAEHN
C[C@H](C1CC1)N(C(=O)CN(C)[C@]1(CO)CC[C@@H](C)C1)C1CC1	ZINC000249600171	402636344	/nfs/dbraw/zinc/63/63/44/402636344.db2.gz	XXUSTPCPXUGXMY-HBUWYVDXSA-N	0	3	308.466	2.259	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)c1ccc(F)cc1	ZINC000171908355	402632956	/nfs/dbraw/zinc/63/29/56/402632956.db2.gz	RVVGQZMYPKYYGT-OAHLLOKOSA-N	0	3	309.385	2.082	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)NC[C@H]1Cc2ccccc21	ZINC000249686424	402638169	/nfs/dbraw/zinc/63/81/69/402638169.db2.gz	IKBFJBSECKREKX-GDBMZVCRSA-N	0	3	301.434	2.500	10	0		DEAEHN
C[C@H]1OCCC[C@H]1C(=O)NCc1cccc(OCCN(C)C)c1	ZINC000191140179	402644727	/nfs/dbraw/zinc/64/47/27/402644727.db2.gz	DZNYVETZJSEGQG-RHSMWYFYSA-N	0	3	320.433	2.058	10	0		DEAEHN
Cc1cc(F)c2[nH]c(=O)cc(C(=O)NC[C@@H]3CCCN3C)c2c1	ZINC000181883965	402659505	/nfs/dbraw/zinc/65/95/05/402659505.db2.gz	ADARLDGNOFBLSG-NSHDSACASA-N	0	3	317.364	2.212	10	0		DEAEHN
COc1ccc(F)c(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1OC	ZINC000191160292	402647119	/nfs/dbraw/zinc/64/71/19/402647119.db2.gz	GBKCAAFWAFWNJV-RYUDHWBXSA-N	0	3	324.396	2.398	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Cc2c[nH]c3cccc(OC)c23)C1	ZINC000181606274	402651520	/nfs/dbraw/zinc/65/15/20/402651520.db2.gz	HUMNCYUKOOLMMB-AWEZNQCLSA-N	0	3	315.417	2.320	10	0		DEAEHN
CN(C)c1ccccc1CN1CCCN(c2cccnn2)CC1	ZINC000173670548	402707766	/nfs/dbraw/zinc/70/77/66/402707766.db2.gz	ILQJDTRORSPDCJ-UHFFFAOYSA-N	0	3	311.433	2.255	10	0		DEAEHN
CC[C@@H](O)CN1CCN(c2ccc3cc(OC)ccc3n2)CC1	ZINC000172761559	402674408	/nfs/dbraw/zinc/67/44/08/402674408.db2.gz	XCHVNTHNIXSGJX-OAHLLOKOSA-N	0	3	315.417	2.136	10	0		DEAEHN
Cc1cc(N2CC[C@H](N3CC=CC3)C2)nc(-c2ccncc2)n1	ZINC000172773106	402674836	/nfs/dbraw/zinc/67/48/36/402674836.db2.gz	HYWFUUKURYUNCE-INIZCTEOSA-N	0	3	307.401	2.298	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N[C@@H]1CCC(=O)N(C)C1)CCS2	ZINC000191516735	402675490	/nfs/dbraw/zinc/67/54/90/402675490.db2.gz	RMHVPVIZBNFHBM-BXUZGUMPSA-N	0	3	306.431	2.443	10	0		DEAEHN
Cc1ccc(N2CC[C@@H](N3CCCN(C4CC4)CC3)C2=O)cc1	ZINC000172811015	402677502	/nfs/dbraw/zinc/67/75/02/402677502.db2.gz	UQIWQNDPQYXZCT-GOSISDBHSA-N	0	3	313.445	2.270	10	0		DEAEHN
CSCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000182303723	402679567	/nfs/dbraw/zinc/67/95/67/402679567.db2.gz	VIYSCYUAUKIXPI-UHFFFAOYSA-N	0	3	322.474	2.183	10	0		DEAEHN
O=C(CCN1CCCC[C@H]1CN1CCOCC1)c1ccccc1	ZINC000182368836	402684753	/nfs/dbraw/zinc/68/47/53/402684753.db2.gz	NAKCYDNNHPXFNP-SFHVURJKSA-N	0	3	316.445	2.446	10	0		DEAEHN
CN(C)[C@@H]1CCCN(C(=O)c2cnn(CCC(F)(F)F)c2)C1	ZINC000182380867	402685049	/nfs/dbraw/zinc/68/50/49/402685049.db2.gz	TZRSJIQWRCYNMQ-GFCCVEGCSA-N	0	3	318.343	2.002	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@H](C)C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000173256660	402689695	/nfs/dbraw/zinc/68/96/95/402689695.db2.gz	IVHPBQWSNVWDKE-BBRMVZONSA-N	0	3	322.497	2.308	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccnc(F)c1	ZINC000182519060	402696293	/nfs/dbraw/zinc/69/62/93/402696293.db2.gz	KZSBTRLLLIYUPJ-ZDUSSCGKSA-N	0	3	301.365	2.471	10	0		DEAEHN
CC(C)Cn1ccnc1CNC(=O)N(C)CC1CCN(C)CC1	ZINC000173446926	402697720	/nfs/dbraw/zinc/69/77/20/402697720.db2.gz	XOYJZWCOFFRHJN-UHFFFAOYSA-N	0	3	321.469	2.022	10	0		DEAEHN
C[C@H](NCCN1C(=O)NC2(CCCC2)C1=O)c1cccs1	ZINC000182560099	402699760	/nfs/dbraw/zinc/69/97/60/402699760.db2.gz	FKQYUYZHCIFEHX-NSHDSACASA-N	0	3	307.419	2.263	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@H](C)NC(=O)[C@@H](C)N1CCCCCC1	ZINC000173490774	402700059	/nfs/dbraw/zinc/70/00/59/402700059.db2.gz	ADRYIRLHYNDJAT-XJKSGUPXSA-N	0	3	320.481	2.349	10	0		DEAEHN
C[C@H]1C[NH2+]CC[C@@H]1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000262765628	402730628	/nfs/dbraw/zinc/73/06/28/402730628.db2.gz	KRVKJDNMSNXDNF-UFBFGSQYSA-N	0	3	323.245	2.270	10	0		DEAEHN
CCc1cnc(CCNC(=O)N[C@@H]2CCCN(CC)C2)s1	ZINC000174232546	402732797	/nfs/dbraw/zinc/73/27/97/402732797.db2.gz	ZBVOWUHHELPVSF-GFCCVEGCSA-N	0	3	310.467	2.032	10	0		DEAEHN
CCCCNC(=O)[C@@H](C)N[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000192622379	402741070	/nfs/dbraw/zinc/74/10/70/402741070.db2.gz	OJFLHIJTDYFIIQ-ZIAGYGMSSA-N	0	3	315.421	2.223	10	0		DEAEHN
CCc1cnc(CCNC(=O)C2CCN(C3CC3)CC2)s1	ZINC000192632991	402741899	/nfs/dbraw/zinc/74/18/99/402741899.db2.gz	WDQFJGLVJKMOBJ-UHFFFAOYSA-N	0	3	307.463	2.239	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(C23CC4CC(CC(C4)C2)C3)n1	ZINC000263179819	402746504	/nfs/dbraw/zinc/74/65/04/402746504.db2.gz	GPFYDQHJRFGZRE-ZZTKBFGJSA-N	0	3	302.422	2.114	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2CCC[C@H](C(F)(F)F)C2)n1	ZINC000263169311	402746569	/nfs/dbraw/zinc/74/65/69/402746569.db2.gz	FOIVYOOQUYHTKR-OUAUKWLOSA-N	0	3	318.343	2.482	10	0		DEAEHN
C[C@H](Cc1nc([C@@H]2CNCCN2C)no1)c1cccc(F)c1	ZINC000263174521	402746607	/nfs/dbraw/zinc/74/66/07/402746607.db2.gz	GBQZGMCXKSRGAW-RISCZKNCSA-N	0	3	304.369	2.131	10	0		DEAEHN
C[C@H](NC1CCN(C(=O)c2ccccc2)CC1)c1ccnn1C	ZINC000192750825	402748165	/nfs/dbraw/zinc/74/81/65/402748165.db2.gz	YYALBOLHORBWST-AWEZNQCLSA-N	0	3	312.417	2.376	10	0		DEAEHN
C[C@H](Cc1nc([C@@H]2CNCCN2C)no1)c1ccccc1F	ZINC000263247485	402750100	/nfs/dbraw/zinc/75/01/00/402750100.db2.gz	PLSZMYOYGYYKIK-RISCZKNCSA-N	0	3	304.369	2.131	10	0		DEAEHN
CC[C@H](OC1CCCCC1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263249297	402750260	/nfs/dbraw/zinc/75/02/60/402750260.db2.gz	PPXCJQSHASLFEK-KBPBESRZSA-N	0	3	308.426	2.446	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@]2(C)CCCc3ccccc32)n1	ZINC000263250916	402750715	/nfs/dbraw/zinc/75/07/15/402750715.db2.gz	PWFNIGLJPVNYIY-QAPCUYQASA-N	0	3	312.417	2.288	10	0		DEAEHN
C/C(=C\c1ccc(F)cc1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263268832	402752592	/nfs/dbraw/zinc/75/25/92/402752592.db2.gz	RXFJCTMVLOZLHK-MARXPDLDSA-N	0	3	302.353	2.345	10	0		DEAEHN
COc1ccc2nc(N3CCN(C[C@@H](C)O)[C@@H](C)C3)ccc2c1	ZINC000174732396	402753742	/nfs/dbraw/zinc/75/37/42/402753742.db2.gz	GTQAVKKSTAHOFJ-UONOGXRCSA-N	0	3	315.417	2.135	10	0		DEAEHN
Cc1ccc(CSCc2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263283906	402754448	/nfs/dbraw/zinc/75/44/48/402754448.db2.gz	USIJVZXTMABJEP-AWEZNQCLSA-N	0	3	318.446	2.388	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1cc2ccccc2[nH]c1=O	ZINC000193268727	402769387	/nfs/dbraw/zinc/76/93/87/402769387.db2.gz	LIEWUQICZJVLCR-CQSZACIVSA-N	0	3	315.417	2.234	10	0		DEAEHN
CCNC(=O)CCN[C@@H](C)c1ccc(-n2ccnc2C)cc1	ZINC000183686364	402788786	/nfs/dbraw/zinc/78/87/86/402788786.db2.gz	FZJMWUAUOMTHKF-ZDUSSCGKSA-N	0	3	300.406	2.358	10	0		DEAEHN
CC1CCC(N2CCN(C(=O)[C@@H]3CCOC[C@H]3C)CC2)CC1	ZINC000194374738	402794764	/nfs/dbraw/zinc/79/47/64/402794764.db2.gz	FXDQHVKOZDJHNW-MNAZLIDISA-N	0	3	308.466	2.382	10	0		DEAEHN
COc1ccc(S[C@@H](C)C(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000195335543	402842593	/nfs/dbraw/zinc/84/25/93/402842593.db2.gz	UXBFYWDTHXEREU-UONOGXRCSA-N	0	3	320.458	2.482	10	0		DEAEHN
CC(C)OCCN[C@@H](CO)c1cccc(Br)c1	ZINC000183878304	402803079	/nfs/dbraw/zinc/80/30/79/402803079.db2.gz	MBIOAGRREYDXRQ-ZDUSSCGKSA-N	0	3	302.212	2.497	10	0		DEAEHN
C[C@H]1COCC[C@@H]1C(=O)N(CCN(C)C)Cc1cccs1	ZINC000194628044	402806153	/nfs/dbraw/zinc/80/61/53/402806153.db2.gz	MVYONTVEXGPDJH-ZFWWWQNUSA-N	0	3	310.463	2.311	10	0		DEAEHN
COc1ccc(S[C@H](C)C(=O)NC[C@@H]2CCCN2C)cc1	ZINC000194692160	402810640	/nfs/dbraw/zinc/81/06/40/402810640.db2.gz	SSTZJQUVLBQWGW-OLZOCXBDSA-N	0	3	308.447	2.386	10	0		DEAEHN
C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NC[C@@H]2CCCN2C)cc1	ZINC000194702209	402811295	/nfs/dbraw/zinc/81/12/95/402811295.db2.gz	IVDGPBVMQZXLJM-KCXAZCMYSA-N	0	3	315.417	2.105	10	0		DEAEHN
Cc1[nH]c(C(=O)NC[C@@H]2CCCN2C)c(C)c1C(=O)OC(C)C	ZINC000194730193	402813126	/nfs/dbraw/zinc/81/31/26/402813126.db2.gz	SBPQHNHZQGOKDE-ZDUSSCGKSA-N	0	3	321.421	2.021	10	0		DEAEHN
CCOc1ccccc1OCCCC(=O)NC[C@@H]1CCCN1C	ZINC000194735097	402813923	/nfs/dbraw/zinc/81/39/23/402813923.db2.gz	IIKCWUGOYUDVTP-HNNXBMFYSA-N	0	3	320.433	2.455	10	0		DEAEHN
C[C@H]1CN(CCC2CCN(C(=O)NC3CC3)CC2)C[C@H](C)O1	ZINC000175621140	402822150	/nfs/dbraw/zinc/82/21/50/402822150.db2.gz	UIBFNHLMRBVQFS-KBPBESRZSA-N	0	3	309.454	2.070	10	0		DEAEHN
COC[C@H](NC(=O)N1CCCN(C2CC2)CC1)c1ccc(C)o1	ZINC000175659207	402823954	/nfs/dbraw/zinc/82/39/54/402823954.db2.gz	HBCDMIHIWGZPFK-HNNXBMFYSA-N	0	3	321.421	2.155	10	0		DEAEHN
CN(Cc1ccc2c(c1)sc(=O)n2C)C[C@@H]1CCC[C@@H]1O	ZINC000195043110	402828131	/nfs/dbraw/zinc/82/81/31/402828131.db2.gz	GKAVVVXHXXNKOV-JSGCOSHPSA-N	0	3	306.431	2.193	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCC[C@@H](CC(=O)OC(C)C)C1)N(C)C	ZINC000184283633	402832540	/nfs/dbraw/zinc/83/25/40/402832540.db2.gz	DNUDAGWIHZYYLC-GJZGRUSLSA-N	0	3	312.454	2.297	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2ccc3c(c2)OC(F)(F)O3)C1	ZINC000264043292	402833904	/nfs/dbraw/zinc/83/39/04/402833904.db2.gz	SPOJTSCKMHQUBE-SNVBAGLBSA-N	0	3	313.304	2.176	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)CC[C@@H]1CCOC1	ZINC000175834661	402836735	/nfs/dbraw/zinc/83/67/35/402836735.db2.gz	CCHKUCRVYZONLZ-IAGOWNOFSA-N	0	3	304.434	2.092	10	0		DEAEHN
CCOC(=O)CNc1ccc(N(C)C2CCN(C)CC2)cc1	ZINC000194100965	402783959	/nfs/dbraw/zinc/78/39/59/402783959.db2.gz	IJKNQGGKJLAGGV-UHFFFAOYSA-N	0	3	305.422	2.192	10	0		DEAEHN
CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc([O-])c(F)c1	ZINC000175190516	402786557	/nfs/dbraw/zinc/78/65/57/402786557.db2.gz	ZFLRWQZYWCGJGV-UONOGXRCSA-N	0	3	321.396	2.300	10	0		DEAEHN
CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc([O-])c(F)c1	ZINC000175190516	402786558	/nfs/dbraw/zinc/78/65/58/402786558.db2.gz	ZFLRWQZYWCGJGV-UONOGXRCSA-N	0	3	321.396	2.300	10	0		DEAEHN
c1[nH]c(-c2ccccc2)nc1CNC[C@H]1CN(C2CC2)CCO1	ZINC000175993273	402846847	/nfs/dbraw/zinc/84/68/47/402846847.db2.gz	KFRVEGFDJMMLFX-KRWDZBQOSA-N	0	3	312.417	2.030	10	0		DEAEHN
c1nc(-c2ccccc2)[nH]c1CNC[C@H]1CN(C2CC2)CCO1	ZINC000175993273	402846849	/nfs/dbraw/zinc/84/68/49/402846849.db2.gz	KFRVEGFDJMMLFX-KRWDZBQOSA-N	0	3	312.417	2.030	10	0		DEAEHN
CCOc1cccnc1C(=O)NCc1cccc(CN(C)C)c1	ZINC000176000312	402847369	/nfs/dbraw/zinc/84/73/69/402847369.db2.gz	VQASNYIWRQRCMX-UHFFFAOYSA-N	0	3	313.401	2.472	10	0		DEAEHN
CCN(CCO)CCNCc1ccc(-c2ccncc2)cc1F	ZINC000184537047	402850008	/nfs/dbraw/zinc/85/00/08/402850008.db2.gz	BLNQVMMRDKVBEU-UHFFFAOYSA-N	0	3	317.408	2.292	10	0		DEAEHN
CCN1CCCN(C(=O)Nc2ccc3nc(C)cn3c2)CC1	ZINC000271485176	402875584	/nfs/dbraw/zinc/87/55/84/402875584.db2.gz	BKIUGNYAPSUABB-UHFFFAOYSA-N	0	3	301.394	2.202	10	0		DEAEHN
c1cc(CNCCN2CCSCC2)n(-c2ccccc2)n1	ZINC000279160295	402910736	/nfs/dbraw/zinc/91/07/36/402910736.db2.gz	PRLFOAHQBSSHJA-UHFFFAOYSA-N	0	3	302.447	2.011	10	0		DEAEHN
CC(C)c1nn(C)cc1NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000280823186	403040662	/nfs/dbraw/zinc/04/06/62/403040662.db2.gz	UGSDYQQQHOICNJ-CHWSQXEVSA-N	0	3	307.442	2.490	10	0		DEAEHN
COc1ccc(NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c(C)n1	ZINC000268344805	403075327	/nfs/dbraw/zinc/07/53/27/403075327.db2.gz	HISTYSPYGCULTO-AAEUAGOBSA-N	0	3	306.410	2.345	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)[C@H](C)N[C@@H]2CCOC[C@H]2C)cc1	ZINC000277890517	403268270	/nfs/dbraw/zinc/26/82/70/403268270.db2.gz	OMXNVHMATHCWJD-BFQNTYOBSA-N	0	3	304.390	2.231	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)N[C@H]2CCOC[C@H]2C)c1C	ZINC000277963944	403275315	/nfs/dbraw/zinc/27/53/15/403275315.db2.gz	SFLXYWJATIITPU-LQJRIPTKSA-N	0	3	306.406	2.420	10	0		DEAEHN
CC(=O)[C@](C)(O)CN(C)CCc1ccc(Br)cc1	ZINC000347739190	403835941	/nfs/dbraw/zinc/83/59/41/403835941.db2.gz	PIYYAVWNKJGGFH-CQSZACIVSA-N	0	3	314.223	2.263	10	0		DEAEHN
COc1ccc2c(c1)C(C)(C)C[C@@H]2N[C@H]1CCC(=O)N(C)C1=O	ZINC000333560682	403780376	/nfs/dbraw/zinc/78/03/76/403780376.db2.gz	KWLPZUMQBYMECA-GJZGRUSLSA-N	0	3	316.401	2.155	10	0		DEAEHN
C(CCN1CCO[C@@H](C2CC2)C1)CCN1CCO[C@@H](C2CC2)C1	ZINC000368793085	403860144	/nfs/dbraw/zinc/86/01/44/403860144.db2.gz	RUVBOJKTPNZLIZ-RTBURBONSA-N	0	3	322.493	2.378	10	0		DEAEHN
C[C@H](NC(=O)C1CCCCC1)C(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000337949335	404328813	/nfs/dbraw/zinc/32/88/13/404328813.db2.gz	IHIRISOZKKPQCS-IJEWVQPXSA-N	0	3	323.481	2.013	10	0		DEAEHN
C[C@H]1CN(Cc2ncc(C3CC3)o2)CC[C@@H]1N1CCN(C)CC1	ZINC000370149759	404349493	/nfs/dbraw/zinc/34/94/93/404349493.db2.gz	POUVJGJPQXWDOI-HOCLYGCPSA-N	0	3	318.465	2.010	10	0		DEAEHN
CC1(C)CCC(=CC(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)CC1	ZINC000370964553	404430737	/nfs/dbraw/zinc/43/07/37/404430737.db2.gz	DHZANKFZZZMZNT-HZPDHXFCSA-N	0	3	306.450	2.492	10	0		DEAEHN
CC[C@@H](C)Oc1cc(-c2nc([C@H]3CC(=O)N(C)C3)no2)ccn1	ZINC000329744120	404439105	/nfs/dbraw/zinc/43/91/05/404439105.db2.gz	XPZHFSFRTKQZLD-PWSUYJOCSA-N	0	3	316.361	2.255	10	0		DEAEHN
CN(Cc1cnccn1)C(=O)[C@@H]1CCCCN1C1CCCC1	ZINC000365442359	404661200	/nfs/dbraw/zinc/66/12/00/404661200.db2.gz	JOYQDTYBRXVSSC-INIZCTEOSA-N	0	3	302.422	2.232	10	0		DEAEHN
CCOC(=O)[C@H]1CN(CCCc2cccc(F)c2)CC12COC2	ZINC000451132993	404874516	/nfs/dbraw/zinc/87/45/16/404874516.db2.gz	JKOJTQYPAZNBBX-MRXNPFEDSA-N	0	3	321.392	2.270	10	0		DEAEHN
NC[C@H](NC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F)C(F)(F)F	ZINC000401707411	405064740	/nfs/dbraw/zinc/06/47/40/405064740.db2.gz	FOYJEYJFMUCMNB-CSMHCCOUSA-N	0	3	306.250	2.361	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N(C)C2CCN(C(C)C)CC2)o1	ZINC000408099641	405112883	/nfs/dbraw/zinc/11/28/83/405112883.db2.gz	XKKHSGYJPJOUPQ-UHFFFAOYSA-N	0	3	300.424	2.081	10	0		DEAEHN
CC[NH+](CC)CC1CCN(C(=O)c2c([O-])cccc2O)CC1	ZINC000436644684	405114620	/nfs/dbraw/zinc/11/46/20/405114620.db2.gz	BEBXDDKPIRYREI-UHFFFAOYSA-N	0	3	306.406	2.292	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N1CC(=O)N1CCO[C@H](c2cccc(O)c2)C1	ZINC000408351560	405183603	/nfs/dbraw/zinc/18/36/03/405183603.db2.gz	GFIPEQFUQJDQDM-VBQJREDUSA-N	0	3	318.417	2.165	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)CC[N@@H+]1C	ZINC000408410590	405200739	/nfs/dbraw/zinc/20/07/39/405200739.db2.gz	VCFIFIAMXSZUQM-YPMHNXCESA-N	0	3	318.417	2.318	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)CC[N@H+]1C	ZINC000408410590	405200745	/nfs/dbraw/zinc/20/07/45/405200745.db2.gz	VCFIFIAMXSZUQM-YPMHNXCESA-N	0	3	318.417	2.318	10	0		DEAEHN
C[C@@H](C(=O)NCCNc1ccncc1)c1ccc(F)c(F)c1	ZINC000439069963	405264265	/nfs/dbraw/zinc/26/42/65/405264265.db2.gz	VLMKLAAIASJBIK-LLVKDONJSA-N	0	3	305.328	2.114	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)[C@H](C)N2C[C@H]3CCC[C@@H](C2)N3)cc1	ZINC000420353166	405329165	/nfs/dbraw/zinc/32/91/65/405329165.db2.gz	ZZEYAWTZNGXWAC-AFAVFJNCSA-N	0	3	315.417	2.043	10	0		DEAEHN
c1nc2c(ncnc2NCCCNCc2cccnc2)n1C1CC1	ZINC000420179151	405291962	/nfs/dbraw/zinc/29/19/62/405291962.db2.gz	FSWILOZWNYZSCY-UHFFFAOYSA-N	0	3	323.404	2.148	10	0		DEAEHN
COC[C@H](NCc1nc2cc(C)ccc2[nH]1)C1CCOCC1	ZINC000446825189	405393191	/nfs/dbraw/zinc/39/31/91/405393191.db2.gz	BBHNJLSUZKUKKE-INIZCTEOSA-N	0	3	303.406	2.403	10	0		DEAEHN
COC[C@H](NCc1nc2ccc(C)cc2[nH]1)C1CCOCC1	ZINC000446825189	405393193	/nfs/dbraw/zinc/39/31/93/405393193.db2.gz	BBHNJLSUZKUKKE-INIZCTEOSA-N	0	3	303.406	2.403	10	0		DEAEHN
c1cc(CN2CCCSCC2)ccc1CN1CCOCC1	ZINC000420932465	405408670	/nfs/dbraw/zinc/40/86/70/405408670.db2.gz	HDUAHWOYNSACLQ-UHFFFAOYSA-N	0	3	306.475	2.458	10	0		DEAEHN
CC(C)[C@H](NC(=O)Nc1ccnn1CCN(C)C)C(F)(F)F	ZINC000455652916	405439986	/nfs/dbraw/zinc/43/99/86/405439986.db2.gz	CRDSQWHAMCZKFR-NSHDSACASA-N	0	3	321.347	2.153	10	0		DEAEHN
CCOC(=O)[C@H]1CN(Cc2cc(C)sc2C)CC12COC2	ZINC000449367471	405530015	/nfs/dbraw/zinc/53/00/15/405530015.db2.gz	WMVUBOHTOVVOJC-CQSZACIVSA-N	0	3	309.431	2.376	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN1CCN(Cc2ccccc2)[C@H](C(C)C)C1	ZINC000528643046	405694774	/nfs/dbraw/zinc/69/47/74/405694774.db2.gz	ZAICCXDYYYSHSA-OALUTQOASA-N	0	3	318.461	2.169	10	0		DEAEHN
C(c1nc(C2CCOCC2)no1)C1CCN([C@@H]2CCOC2)CC1	ZINC000528713546	405719143	/nfs/dbraw/zinc/71/91/43/405719143.db2.gz	CAGHXJFFBGWASS-OAHLLOKOSA-N	0	3	321.421	2.007	10	0		DEAEHN
COC1(C[C@H](C)N[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)CCC1	ZINC000583619498	405776614	/nfs/dbraw/zinc/77/66/14/405776614.db2.gz	SRXJTVGWCHHGTL-LXZKKBNFSA-N	0	3	317.433	2.291	10	0		DEAEHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)N[C@H]1CCCC(F)(F)C1	ZINC000495036681	405803502	/nfs/dbraw/zinc/80/35/02/405803502.db2.gz	NVDZSMQUWBZHAY-MDZLAQPJSA-N	0	3	301.381	2.346	10	0		DEAEHN
Cc1ccc(C[C@@H](CO)NC(=O)CC2CCN(C)CC2)cc1C	ZINC000457241890	405765366	/nfs/dbraw/zinc/76/53/66/405765366.db2.gz	FEIHKNWVJLLOIK-SFHVURJKSA-N	0	3	318.461	2.055	10	0		DEAEHN
CCn1nncc1CN1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000459362302	405871859	/nfs/dbraw/zinc/87/18/59/405871859.db2.gz	PXCMWCCTNYWSPW-MRXNPFEDSA-N	0	3	313.449	2.394	10	0		DEAEHN
CCC(=O)N[C@@H]1CCCN(C[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000450327883	405837474	/nfs/dbraw/zinc/83/74/74/405837474.db2.gz	NLIYBLPYZAGUKN-DJIMGWMZSA-N	0	3	304.434	2.142	10	0		DEAEHN
CCC(=O)N[C@@H]1CCCN(C[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000450327886	405837854	/nfs/dbraw/zinc/83/78/54/405837854.db2.gz	NLIYBLPYZAGUKN-USXIJHARSA-N	0	3	304.434	2.142	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)NCCN2CCC[C@@H](C)C2)c1	ZINC000457466796	405854914	/nfs/dbraw/zinc/85/49/14/405854914.db2.gz	WAFLRMIGWKQSEO-CYBMUJFWSA-N	0	3	318.417	2.243	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(c2ccnc3ccccc32)CC12COC2	ZINC000450573514	405960069	/nfs/dbraw/zinc/96/00/69/405960069.db2.gz	XHIQOPFLVRZEBL-AWEZNQCLSA-N	0	3	312.369	2.251	10	0		DEAEHN
CS(=O)(=O)NCC1CCN(CC2CCC(F)(F)CC2)CC1	ZINC000459465460	405915532	/nfs/dbraw/zinc/91/55/32/405915532.db2.gz	OMEODCXSUACBML-UHFFFAOYSA-N	0	3	324.437	2.073	10	0		DEAEHN
CCn1nnc(C)c1CN1CC[C@H](CNc2cccc(C)n2)C1	ZINC000562516173	406022040	/nfs/dbraw/zinc/02/20/40/406022040.db2.gz	IXBARULUKNZDDQ-OAHLLOKOSA-N	0	3	314.437	2.244	10	0		DEAEHN
Brc1cnc2c(CN[C@H]3[C@@H]4CCC[C@@H]43)cnn2c1	ZINC000639324826	406045762	/nfs/dbraw/zinc/04/57/62/406045762.db2.gz	MVMNIPOWZHVLSG-GDNZZTSVSA-N	0	3	307.195	2.380	10	0		DEAEHN
CC(C)OC[C@@H](O)CN1CCC[C@@H](CC(=O)OC(C)(C)C)C1	ZINC000532124857	406047892	/nfs/dbraw/zinc/04/78/92/406047892.db2.gz	JERDMMJYYAVQTB-GJZGRUSLSA-N	0	3	315.454	2.216	10	0		DEAEHN
c1nc2n(n1)[C@H](CN1CC(c3nc4ccccc4s3)C1)CC2	ZINC000639555697	406143780	/nfs/dbraw/zinc/14/37/80/406143780.db2.gz	REHCQEMXNUFYBZ-LBPRGKRZSA-N	0	3	311.414	2.475	10	0		DEAEHN
C[C@@H]1C[C@@H](CCNCc2c(Br)cnn2C)CCO1	ZINC000487567792	406248037	/nfs/dbraw/zinc/24/80/37/406248037.db2.gz	BFZBDXKKLWYRFI-MNOVXSKESA-N	0	3	316.243	2.477	10	0		DEAEHN
Cc1cc(CN(C)C)cc(NC(=O)c2cn3cccnc3n2)c1	ZINC000536217886	406252236	/nfs/dbraw/zinc/25/22/36/406252236.db2.gz	NLDMCBXHXXATMV-UHFFFAOYSA-N	0	3	309.373	2.352	10	0		DEAEHN
CCc1ccc([C@H](C)NC(=O)CN2CC[C@H](CO)[C@@H]2C)cc1	ZINC000488806587	406350129	/nfs/dbraw/zinc/35/01/29/406350129.db2.gz	VFEXURUWGSXIAX-GRDNDAEWSA-N	0	3	304.434	2.129	10	0		DEAEHN
CC(C)(C)N1CCCN(C(=O)Cn2ncc3ccccc32)CC1	ZINC000521927815	406376198	/nfs/dbraw/zinc/37/61/98/406376198.db2.gz	GAZAORJZGOAZPA-UHFFFAOYSA-N	0	3	314.433	2.369	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000637911156	406473449	/nfs/dbraw/zinc/47/34/49/406473449.db2.gz	YFWLJJQCMMNAQM-CEXWTWQISA-N	0	3	323.440	2.118	10	0		DEAEHN
COC[C@]1(C(=O)NCc2ccc(Cl)s2)CCCCN1	ZINC000637932265	406484227	/nfs/dbraw/zinc/48/42/27/406484227.db2.gz	ZKZHGEDAEALOFU-ZDUSSCGKSA-N	0	3	302.827	2.176	10	0		DEAEHN
COC[C@@]1(C(=O)NCCc2ccc(Cl)s2)CCCCN1	ZINC000637935363	406484994	/nfs/dbraw/zinc/48/49/94/406484994.db2.gz	GWLUXSHTSBIISO-CQSZACIVSA-N	0	3	316.854	2.219	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)c2ccncn2)[C@@H]1c1cccs1	ZINC000548289482	406497253	/nfs/dbraw/zinc/49/72/53/406497253.db2.gz	XNQZOHBKCMECRG-SWLSCSKDSA-N	0	3	316.430	2.351	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)c2ccncn2)[C@H]1c1cccs1	ZINC000548289479	406497499	/nfs/dbraw/zinc/49/74/99/406497499.db2.gz	XNQZOHBKCMECRG-DOMZBBRYSA-N	0	3	316.430	2.351	10	0		DEAEHN
CCN(C(=O)[C@@H](N)CN(C)Cc1ccccc1)c1ccccc1	ZINC000637867733	406454173	/nfs/dbraw/zinc/45/41/73/406454173.db2.gz	BDJOQRXITAXTCA-SFHVURJKSA-N	0	3	311.429	2.499	10	0		DEAEHN
Cc1ccc(CNC(=O)[C@@H](N)CN(C)Cc2ccccc2)cc1	ZINC000637875599	406458008	/nfs/dbraw/zinc/45/80/08/406458008.db2.gz	LKUZUCZNADFOPJ-SFHVURJKSA-N	0	3	311.429	2.071	10	0		DEAEHN
c1cc2c(ncnc2N2CCN(CCC[C@H]3CCO3)CC2)s1	ZINC000637890743	406464977	/nfs/dbraw/zinc/46/49/77/406464977.db2.gz	XCSSEQCYDTZVNC-ZDUSSCGKSA-N	0	3	318.446	2.382	10	0		DEAEHN
N[C@@H]1CCO[C@@H]1C(=O)N[C@@H]1CCSc2ccc(Cl)cc21	ZINC000637898459	406468186	/nfs/dbraw/zinc/46/81/86/406468186.db2.gz	RIEAWLJSZNLPNT-WZRBSPASSA-N	0	3	312.822	2.109	10	0		DEAEHN
CCN1CCCN(C(=O)[C@H]2CCc3nc(C(C)C)[nH]c3C2)CC1	ZINC000526003739	406531912	/nfs/dbraw/zinc/53/19/12/406531912.db2.gz	ZXYJCPBGPHECGO-AWEZNQCLSA-N	0	3	318.465	2.192	10	0		DEAEHN
CCN1CCCN(C(=O)[C@H]2CCc3[nH]c(C(C)C)nc3C2)CC1	ZINC000526003739	406531916	/nfs/dbraw/zinc/53/19/16/406531916.db2.gz	ZXYJCPBGPHECGO-AWEZNQCLSA-N	0	3	318.465	2.192	10	0		DEAEHN
CCC1(CNC(=O)[C@H](N)CN(C)Cc2ccccc2)CCC1	ZINC000637991815	406512321	/nfs/dbraw/zinc/51/23/21/406512321.db2.gz	SYHQKDWHMMLFIH-MRXNPFEDSA-N	0	3	303.450	2.142	10	0		DEAEHN
C[C@H](CNC(=O)NCCOCC1CCC1)N1CCC[C@@H](C)C1	ZINC000572452906	406669893	/nfs/dbraw/zinc/66/98/93/406669893.db2.gz	FUZFGYAGPKVLBT-HUUCEWRRSA-N	0	3	311.470	2.223	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N[C@H]1CC12CCCCC2	ZINC000638290291	406674806	/nfs/dbraw/zinc/67/48/06/406674806.db2.gz	FDDCNAPECMOYGK-IRXDYDNUSA-N	0	3	315.461	2.285	10	0		DEAEHN
c1cc(CNC[C@H](c2ccccc2)N2CCOCC2)sn1	ZINC000638329802	406704342	/nfs/dbraw/zinc/70/43/42/406704342.db2.gz	PHGQHYVIASASGF-MRXNPFEDSA-N	0	3	303.431	2.306	10	0		DEAEHN
c1csc([C@@H](CNCc2ccns2)N2CCOCC2)c1	ZINC000638292742	406676473	/nfs/dbraw/zinc/67/64/73/406676473.db2.gz	ILONFXMTXCNMNX-CYBMUJFWSA-N	0	3	309.460	2.368	10	0		DEAEHN
CN(Cc1ccccc1)C[C@H](N)C(=O)N1CCC2(CCC2)CC1	ZINC000638439723	406772845	/nfs/dbraw/zinc/77/28/45/406772845.db2.gz	WHEUURDMICZPTR-KRWDZBQOSA-N	0	3	315.461	2.238	10	0		DEAEHN
CC(=O)N1CCC(CN[C@@H](C)c2cn3ccccc3n2)CC1	ZINC000556235873	406866265	/nfs/dbraw/zinc/86/62/65/406866265.db2.gz	HMVAGPNPBXRXEO-ZDUSSCGKSA-N	0	3	300.406	2.243	10	0		DEAEHN
CC(C)[C@@H](NC(=O)C(C)(C)N1CCNCC1)c1cccs1	ZINC000129630698	196062993	/nfs/dbraw/zinc/06/29/93/196062993.db2.gz	MOBMOFNCWQVWEE-CQSZACIVSA-N	0	3	309.479	2.245	10	0		DEAEHN
CN(Cc1ccc(Cl)s1)C(=O)C(C)(C)N1CCNCC1	ZINC000129645755	196065166	/nfs/dbraw/zinc/06/51/66/196065166.db2.gz	OVHBRCQQHMKXHX-UHFFFAOYSA-N	0	3	315.870	2.044	10	0		DEAEHN
Cc1cc2c(=O)n(CCN[C@H](C)c3cccs3)ccn2n1	ZINC000130744126	196106325	/nfs/dbraw/zinc/10/63/25/196106325.db2.gz	AAAROERXAMTNJS-GFCCVEGCSA-N	0	3	302.403	2.217	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@H](C)C(=O)N2C[C@@H](C)N2CCCC2)s1	ZINC000130751382	196106569	/nfs/dbraw/zinc/10/65/69/196106569.db2.gz	XCKJOZOJPBMELF-UXIGCNINSA-N	0	3	307.463	2.360	10	0		DEAEHN
CN[C@H](CCCS(C)(=O)=O)c1ccc(Cl)cc1OC	ZINC000130987616	196130284	/nfs/dbraw/zinc/13/02/84/196130284.db2.gz	ZLUZVWKYSWWUCW-GFCCVEGCSA-N	0	3	305.827	2.434	10	0		DEAEHN
CC1(C)CC(NS(=O)(=O)[C@@H]2CCCNC2)CC(C)(C)C1	ZINC000131069026	196137148	/nfs/dbraw/zinc/13/71/48/196137148.db2.gz	ZHKZXMRPWHWKLI-CYBMUJFWSA-N	0	3	302.484	2.263	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2cccc(C)c2Br)C1	ZINC000131399424	196164990	/nfs/dbraw/zinc/16/49/90/196164990.db2.gz	PISDLJWTGWKFTD-GXSJLCMTSA-N	0	3	313.195	2.073	10	0		DEAEHN
Cc1cccc(NC(=O)C[C@H]2CNCCO2)c1Br	ZINC000131460220	196170853	/nfs/dbraw/zinc/17/08/53/196170853.db2.gz	XUGGTJCBWDUNGD-JTQLQIEISA-N	0	3	313.195	2.075	10	0		DEAEHN
CN[C@@H](Cc1ccc(C(F)(F)F)cc1)[C@H](C)S(C)(=O)=O	ZINC000131473679	196172387	/nfs/dbraw/zinc/17/23/87/196172387.db2.gz	GPTJHHKAOWSSEM-CABZTGNLSA-N	0	3	309.353	2.269	10	0		DEAEHN
CCNCc1c(N(C)[C@H]2CCCC[C@@H]2O)nc2sccn12	ZINC000132034509	196220559	/nfs/dbraw/zinc/22/05/59/196220559.db2.gz	JDUOGFOIAGEHSU-AAEUAGOBSA-N	0	3	308.451	2.245	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)CCOC)c1cc(C)cc(C)c1	ZINC000133959092	196349875	/nfs/dbraw/zinc/34/98/75/196349875.db2.gz	ZTUVQESJFRWVOM-INIZCTEOSA-N	0	3	313.463	2.405	10	0		DEAEHN
C[C@](CN)(NS(=O)(=O)CCCC(F)(F)F)c1ccccc1	ZINC000134472122	196393569	/nfs/dbraw/zinc/39/35/69/196393569.db2.gz	JAIHVBQBAVHLIS-GFCCVEGCSA-N	0	3	324.368	2.122	10	0		DEAEHN
C[C@H](CS(=O)(=O)c1ccccc1)NC[C@@H]1CCC(C)(C)O1	ZINC000187850061	225001538	/nfs/dbraw/zinc/00/15/38/225001538.db2.gz	CTGVROXYRCAQJW-KGLIPLIRSA-N	0	3	311.447	2.396	10	0		DEAEHN
CN1CCC(NC(=O)[C@@H]2CCCO[C@H]2c2ccccc2)CC1	ZINC000052982522	424837545	/nfs/dbraw/zinc/83/75/45/424837545.db2.gz	MDRHFNIOCBCZTJ-SJORKVTESA-N	0	3	302.418	2.365	10	0		DEAEHN
CCCCCNC(=O)[C@H](C)N1CCC(Cc2nccn2C)CC1	ZINC000105876242	424849483	/nfs/dbraw/zinc/84/94/83/424849483.db2.gz	SOCCHDTTWHZWFB-HNNXBMFYSA-N	0	3	320.481	2.370	10	0		DEAEHN
c1ccc(-c2nnc(NC3CC(N4CCCCC4)C3)s2)nc1	ZINC000369556904	424875864	/nfs/dbraw/zinc/87/58/64/424875864.db2.gz	QEQIKOQOPIUSCL-UHFFFAOYSA-N	0	3	315.446	3.029	10	0		DEAEHN
c1cc(CN[C@H]2CO[C@@H](C3CC3)C2)cc(N2CCSCC2)n1	ZINC000639386461	424857808	/nfs/dbraw/zinc/85/78/08/424857808.db2.gz	IVMHOZRRDYLZFP-HZPDHXFCSA-N	0	3	319.474	2.292	10	0		DEAEHN
CCc1ccc([C@H](C)N[C@@H](C)C(=O)N2CCN(CC)CC2)cc1	ZINC000192661997	424864899	/nfs/dbraw/zinc/86/48/99/424864899.db2.gz	DHFOZTCVDDHQHJ-HOTGVXAUSA-N	0	3	317.477	2.452	10	0		DEAEHN
O[C@]1(CCNCc2sccc2Br)CCOC1	ZINC000404219382	424926171	/nfs/dbraw/zinc/92/61/71/424926171.db2.gz	QYGHAXVLAHSNRP-LLVKDONJSA-N	0	3	306.225	2.142	10	0		DEAEHN
COc1ccc(C[C@@H](C)CN2CCCNC(=O)[C@@H]2C)cc1F	ZINC000249000652	424886856	/nfs/dbraw/zinc/88/68/56/424886856.db2.gz	HKRBMZARSZXTMN-OLZOCXBDSA-N	0	3	308.397	2.223	10	0		DEAEHN
CN1C[C@@H](CNCc2cccc(Br)c2F)CC1=O	ZINC000657696299	425386479	/nfs/dbraw/zinc/38/64/79/425386479.db2.gz	HAPPDCWQKPWLLA-SECBINFHSA-N	0	3	315.186	2.156	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)N2CCc3[nH]c4ccccc4c3C2)C1	ZINC000334121939	269021533	/nfs/dbraw/zinc/02/15/33/269021533.db2.gz	LZGMFKZKOIEVFS-CYBMUJFWSA-N	0	3	312.417	2.330	10	0		DEAEHN
Cc1oc(Br)cc1C(=O)NC[C@@H]1CCCN1C	ZINC000396666460	269103575	/nfs/dbraw/zinc/10/35/75/269103575.db2.gz	CUXFEELXLIRSOF-VIFPVBQESA-N	0	3	301.184	2.175	10	0		DEAEHN
O=C(NCC1(O)CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000397485953	269106981	/nfs/dbraw/zinc/10/69/81/269106981.db2.gz	BTAQIJWBCLOGSY-UHFFFAOYSA-N	0	3	324.424	2.444	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1C[C@@H]2CC[C@@H](O)C[C@H]2C1	ZINC000398865696	269109726	/nfs/dbraw/zinc/10/97/26/269109726.db2.gz	SLABJUUSPZSMOD-OKZBNKHCSA-N	0	3	316.445	2.128	10	0		DEAEHN
CCN1CC[C@H](NC(=O)c2cscc2Br)C1	ZINC000405031839	269113153	/nfs/dbraw/zinc/11/31/53/269113153.db2.gz	PHNYTSMEAVCHJG-QMMMGPOBSA-N	0	3	303.225	2.335	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN1CC[C@H]([C@@H]2CCOC2)C1	ZINC000430233211	269127637	/nfs/dbraw/zinc/12/76/37/269127637.db2.gz	KESQSMTUZVQUBS-DLBZAZTESA-N	0	3	312.417	2.185	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1N[C@@H]1CCCn2ncnc21	ZINC000164745254	274355436	/nfs/dbraw/zinc/35/54/36/274355436.db2.gz	RROUWWHHGHNCRJ-OIISXLGYSA-N	0	3	311.433	2.223	10	0		DEAEHN
O=C([C@H]1SCCc2sccc21)N1CCN2CCC[C@H]2C1	ZINC000246687801	275010321	/nfs/dbraw/zinc/01/03/21/275010321.db2.gz	BFVAWRJTKAVOAD-FZMZJTMJSA-N	0	3	308.472	2.385	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H]2CCOc3c(F)cccc32)C1	ZINC000188182852	276177937	/nfs/dbraw/zinc/17/79/37/276177937.db2.gz	UWOXQGUCVMLASE-WFASDCNBSA-N	0	3	321.396	2.433	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C)C(=O)Nc1cccnc1Cl	ZINC000177713780	276183349	/nfs/dbraw/zinc/18/33/49/276183349.db2.gz	LSHLXUBSZXGYGM-STQMWFEESA-N	0	3	324.856	2.478	10	0		DEAEHN
CCN1C[C@@H](C)N(Cc2nc3oc(C)c(C)c3c(N)n2)C[C@H]1C	ZINC000408048646	276242777	/nfs/dbraw/zinc/24/27/77/276242777.db2.gz	ZABMLCLISHIGME-GHMZBOCLSA-N	0	3	317.437	2.336	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)C1	ZINC000246898532	276375567	/nfs/dbraw/zinc/37/55/67/276375567.db2.gz	RKRRLUXILOPPRT-CAOSSQGBSA-N	0	3	321.465	2.118	10	0		DEAEHN
CN1CCNC[C@H]1c1noc([C@H]2CCSc3ccccc32)n1	ZINC000263298553	277117193	/nfs/dbraw/zinc/11/71/93/277117193.db2.gz	WSYQYZPVDRFMCU-STQMWFEESA-N	0	3	316.430	2.273	10	0		DEAEHN
CN1CCO[C@@H](CNCc2ccc(F)cc2C(F)(F)F)C1	ZINC000129456786	277119526	/nfs/dbraw/zinc/11/95/26/277119526.db2.gz	XHCAVYUEEDDDKV-LBPRGKRZSA-N	0	3	306.303	2.265	10	0		DEAEHN
CN1CC[C@H]2[C@H](CCCN2c2ncncc2Br)C1	ZINC000089375280	277183293	/nfs/dbraw/zinc/18/32/93/277183293.db2.gz	DEZMKRXJFWVXIL-PWSUYJOCSA-N	0	3	311.227	2.160	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@@H](C)c1nc2ccccc2n1C)N(C)C	ZINC000162208979	278856267	/nfs/dbraw/zinc/85/62/67/278856267.db2.gz	JUNHWPTWAUKUFK-WFASDCNBSA-N	0	3	302.422	2.481	10	0		DEAEHN
C[C@@H]1NC(=S)N(C[C@@]2(C)CCCN2Cc2ccccc2)C1=O	ZINC000189417941	279029376	/nfs/dbraw/zinc/02/93/76/279029376.db2.gz	WQQUWHKRHHQRBI-SUMWQHHRSA-N	0	3	317.458	2.146	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cccc(OC)c1OC	ZINC000177016418	279300801	/nfs/dbraw/zinc/30/08/01/279300801.db2.gz	WBZCHNYKJUXMJL-CYBMUJFWSA-N	0	3	306.406	2.260	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCC[C@@H]1c1cccn1C	ZINC000074491160	279309624	/nfs/dbraw/zinc/30/96/24/279309624.db2.gz	VZCSCHQXFNTMBC-GDBMZVCRSA-N	0	3	304.438	2.356	10	0		DEAEHN
C[C@H](N[C@H]1CCc2ncnn2C1)c1ccc(-n2ccnc2)cc1	ZINC000180590669	279550114	/nfs/dbraw/zinc/55/01/14/279550114.db2.gz	STLHUCOQJXIMOD-ZFWWWQNUSA-N	0	3	308.389	2.129	10	0		DEAEHN
C[C@H](C1CC1)N(C(=O)CN1CC[C@]2(O)CCCC[C@H]2C1)C1CC1	ZINC000248202581	289397874	/nfs/dbraw/zinc/39/78/74/289397874.db2.gz	ZEYFPVKPJRHOQZ-SIXWZSSISA-N	0	3	320.477	2.403	10	0		DEAEHN
CO[C@@H]1CC[C@@H]2OCCN(C(=O)[C@H](C)N3CCCCCC3)[C@@H]2C1	ZINC000245729218	293776846	/nfs/dbraw/zinc/77/68/46/293776846.db2.gz	RKMIYUISLDAMGC-HZMVEIRTSA-N	0	3	324.465	2.046	10	0		DEAEHN
C[C@H]1CN([C@H](CNCC2=CCCOC2)c2cccs2)CCO1	ZINC000245679227	300293571	/nfs/dbraw/zinc/29/35/71/300293571.db2.gz	JFYNOZHSMFBJKC-GOEBONIOSA-N	0	3	322.474	2.446	10	0		DEAEHN
COC[C@@H](C)CN[C@H](CO)c1cccc(Br)c1	ZINC000188104710	333031625	/nfs/dbraw/zinc/03/16/25/333031625.db2.gz	UQDATDOPQPJJDJ-GXFFZTMASA-N	0	3	302.212	2.355	10	0		DEAEHN
CNCC(=O)Nc1ccc2c(c1)N(C(=O)OC(C)(C)C)CC2	ZINC000584660592	337378257	/nfs/dbraw/zinc/37/82/57/337378257.db2.gz	PRIRVJFVPIMPAD-UHFFFAOYSA-N	0	3	305.378	2.142	10	0		DEAEHN
Cc1ccc2c(CCNC(=O)C3CCN(C)CC3)cn(C)c2c1	ZINC000188433762	534382894	/nfs/dbraw/zinc/38/28/94/534382894.db2.gz	OBEJWQBEZQBYGZ-UHFFFAOYSA-N	0	3	313.445	2.487	10	0		DEAEHN
O[C@@H](CNc1ncnc2c(F)cccc12)CN1CCCCC1	ZINC000302627670	534403324	/nfs/dbraw/zinc/40/33/24/534403324.db2.gz	BIGSUFCFHKNHJF-LBPRGKRZSA-N	0	3	304.369	2.028	10	0		DEAEHN
CCOC(=O)CCCN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000102398952	520636239	/nfs/dbraw/zinc/63/62/39/520636239.db2.gz	PDRGIODTMFQWBG-UHFFFAOYSA-N	0	3	324.465	2.491	10	0		DEAEHN
CC1CCN(CCNC(=O)N2CCC(c3cc[nH]n3)CC2)CC1	ZINC000156331864	521009660	/nfs/dbraw/zinc/00/96/60/521009660.db2.gz	HRPOBTXTZSMSMD-UHFFFAOYSA-N	0	3	319.453	2.031	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H]2CCOc3ccccc32)C1	ZINC000246255465	521646311	/nfs/dbraw/zinc/64/63/11/521646311.db2.gz	MOBDYGSZNUYEGJ-CABCVRRESA-N	0	3	317.433	2.336	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@](C)(O)[C@@H](C)c2ccccc2)C1	ZINC000245416736	521647411	/nfs/dbraw/zinc/64/74/11/521647411.db2.gz	IRTSBQYLCAWBGW-ZVZYQTTQSA-N	0	3	304.434	2.142	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@](C)(CO)C2CCCCC2)C1	ZINC000245848592	521647543	/nfs/dbraw/zinc/64/75/43/521647543.db2.gz	ANIVHSATGJOUDB-DOTOQJQBSA-N	0	3	311.470	2.101	10	0		DEAEHN
CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)[C@H](C)C1	ZINC000129505474	521718111	/nfs/dbraw/zinc/71/81/11/521718111.db2.gz	ATIOBQUTIDCWIC-DOMZBBRYSA-N	0	3	323.412	2.403	10	0		DEAEHN
CC[N@H+]1CC[C@H](N(C)C(=O)NCc2ccc([O-])c(F)c2)[C@H](C)C1	ZINC000129505474	521718112	/nfs/dbraw/zinc/71/81/12/521718112.db2.gz	ATIOBQUTIDCWIC-DOMZBBRYSA-N	0	3	323.412	2.403	10	0		DEAEHN
CCc1nn(C)c(CC)c1CN1CCC[C@H](Cn2cncn2)C1	ZINC000156677526	522651300	/nfs/dbraw/zinc/65/13/00/522651300.db2.gz	UFLYBMXXZYYTES-AWEZNQCLSA-N	0	3	316.453	2.049	10	0		DEAEHN
CC[C@H]1CN(CCN(C)c2ccccc2)CCN1CCOC	ZINC000131462111	523278644	/nfs/dbraw/zinc/27/86/44/523278644.db2.gz	JXXONJXYHSYHIH-KRWDZBQOSA-N	0	3	305.466	2.165	10	0		DEAEHN
CC[C@@H]1CN(CCCCCn2cccn2)CCN1CCOC	ZINC000105837412	523438662	/nfs/dbraw/zinc/43/86/62/523438662.db2.gz	XAJXEEUMWMQAPJ-QGZVFWFLSA-N	0	3	308.470	2.096	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)[C@@H](C)c1ccccc1	ZINC000111866016	523824884	/nfs/dbraw/zinc/82/48/84/523824884.db2.gz	BPTQFANMFQTAGB-DOTOQJQBSA-N	0	3	319.449	2.500	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N(C)[C@@H]1CCN(C)C[C@@H]1C	ZINC000249180542	524934191	/nfs/dbraw/zinc/93/41/91/524934191.db2.gz	HYWLNAKERHACBX-KCQAQPDRSA-N	0	3	320.437	2.133	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N(C)[C@H]2CC[N@H+](C)[C@H](C)C2)cc1[O-]	ZINC000331336365	527234950	/nfs/dbraw/zinc/23/49/50/527234950.db2.gz	IWXUBFUNSOUDGU-RISCZKNCSA-N	0	3	304.390	2.150	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1[O-]	ZINC000331336365	527234955	/nfs/dbraw/zinc/23/49/55/527234955.db2.gz	IWXUBFUNSOUDGU-RISCZKNCSA-N	0	3	304.390	2.150	10	0		DEAEHN
CC(C)=CCC[C@H](C)CCN1CC[C@H](NS(C)(=O)=O)C1	ZINC000192624738	527419562	/nfs/dbraw/zinc/41/95/62/527419562.db2.gz	JTTMHOXHQCGRHH-GJZGRUSLSA-N	0	3	302.484	2.383	10	0		DEAEHN
CC(C)OC(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000295821700	527823370	/nfs/dbraw/zinc/82/33/70/527823370.db2.gz	BXYVYFDSSUVYRN-MRXNPFEDSA-N	0	3	306.406	2.412	10	0		DEAEHN
CCCCOc1ccc(C(=O)N2CC[C@H]([NH+](C)C)C2)c([O-])c1	ZINC000190286880	528661120	/nfs/dbraw/zinc/66/11/20/528661120.db2.gz	PNCUOTVLFISXKM-ZDUSSCGKSA-N	0	3	306.406	2.347	10	0		DEAEHN
CCCOc1nc(C)ccc1C(=O)N1CCN2CCC[C@H]2C1	ZINC000191350637	535292504	/nfs/dbraw/zinc/29/25/04/535292504.db2.gz	VMDATBGDUDPMEP-AWEZNQCLSA-N	0	3	303.406	2.099	10	0		DEAEHN
CCO[C@H](CNC(=O)N1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000253354694	535614902	/nfs/dbraw/zinc/61/49/02/535614902.db2.gz	HYABEWLPQHMHAH-DLBZAZTESA-N	0	3	317.433	2.254	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)C2(C)COC2)[C@H]1c1cccs1	ZINC000372932060	536385907	/nfs/dbraw/zinc/38/59/07/536385907.db2.gz	VVFQZPZGTMWRFL-OCCSQVGLSA-N	0	3	308.447	2.284	10	0		DEAEHN
COCC[C@@H](N)C(=O)Nc1ccc(Br)c(C)c1	ZINC000052790825	625320304	/nfs/dbraw/zinc/32/03/04/625320304.db2.gz	MWMNWJPGNMDXGF-LLVKDONJSA-N	0	3	301.184	2.060	10	0		DEAEHN
C[C@@H](CCO)CN(C(=O)OC(C)(C)C)c1ccc(CN)nc1	ZINC000757134772	623073582	/nfs/dbraw/zinc/07/35/82/623073582.db2.gz	OSAHFMKZRVLHPO-LBPRGKRZSA-N	0	3	309.410	2.300	10	0		DEAEHN
CCC[C@H](C(=O)N1CCn2c(C(C)C)nnc2[C@@H]1C)N(C)C	ZINC000188800572	624168827	/nfs/dbraw/zinc/16/88/27/624168827.db2.gz	FMLZCWRRYQJAEN-QWHCGFSZSA-N	0	3	307.442	2.035	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccn(-c2ccccc2Cl)n1	ZINC000051383531	624799656	/nfs/dbraw/zinc/79/96/56/624799656.db2.gz	RJXOJADXTKBMIN-LBPRGKRZSA-N	0	3	318.808	2.350	10	0		DEAEHN
c1cn(-c2cc(CNCc3ccc4c(c3)OCCO4)ccn2)cn1	ZINC000236578042	625188761	/nfs/dbraw/zinc/18/87/61/625188761.db2.gz	VMYZFYQYFKVENG-UHFFFAOYSA-N	0	3	322.368	2.328	10	0		DEAEHN
CC(C)c1cnc(CN2CCN(CC3CCOCC3)CC2)o1	ZINC000736319161	633599369	/nfs/dbraw/zinc/59/93/69/633599369.db2.gz	VPXRQEYJDLHUNG-UHFFFAOYSA-N	0	3	307.438	2.342	10	0		DEAEHN
COC(=O)CCC(=O)N1c2ccc(C)cc2[C@@H]2CN(C)CC[C@H]21	ZINC000000525944	635648312	/nfs/dbraw/zinc/64/83/12/635648312.db2.gz	YFIHNSLWCHRTFQ-GOEBONIOSA-N	0	3	316.401	2.083	10	0		DEAEHN
COC(=O)/C(C)=C/CN(CCCO)[C@@H]1CCc2ccccc21	ZINC000748818219	638595052	/nfs/dbraw/zinc/59/50/52/638595052.db2.gz	SDLXKKGCSCYGNJ-IDKBZEPQSA-N	0	3	303.402	2.478	10	0		DEAEHN
COc1ccc([C@H](NC(C)C)C(=O)N2C[C@@H](O)CC[C@@H]2C)cc1	ZINC000897995609	640987256	/nfs/dbraw/zinc/98/72/56/640987256.db2.gz	GUUFGOUZNIGUMY-QRTARXTBSA-N	0	3	320.433	2.106	10	0		DEAEHN
Cn1ccnc1[C@]([O-])(C[NH2+][C@@H]1CC[C@H]1C1CCC1)C(F)(F)F	ZINC000800979594	645325984	/nfs/dbraw/zinc/32/59/84/645325984.db2.gz	SQGDDYJHEFMTLB-OUCADQQQSA-N	0	3	317.355	2.338	10	0		DEAEHN
CCn1ncnc1COC(=O)c1cccc(CN2CCCC2)c1	ZINC000801324393	645377707	/nfs/dbraw/zinc/37/77/07/645377707.db2.gz	URLPQMYNMVGRNY-UHFFFAOYSA-N	0	3	314.389	2.251	10	0		DEAEHN
CCOCCN1CCN(Cn2cccnc2=S)C[C@H]1CC	ZINC000172498086	646739382	/nfs/dbraw/zinc/73/93/82/646739382.db2.gz	FZCCSLOCRJSYPV-CQSZACIVSA-N	0	3	310.467	2.003	10	0		DEAEHN
CC1CCN(CCNC(=O)c2cc(Cl)nc(N(C)C)c2)CC1	ZINC000733131384	647889687	/nfs/dbraw/zinc/88/96/87/647889687.db2.gz	YXWRDJLNSHBIJT-UHFFFAOYSA-N	0	3	324.856	2.263	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccc(-n2ccnc2)cc1)N(C)C	ZINC000179649280	648404207	/nfs/dbraw/zinc/40/42/07/648404207.db2.gz	OOYQOILUNWSLFV-MRXNPFEDSA-N	0	3	300.406	2.219	10	0		DEAEHN
CC[C@@H]1CCCC[C@H]1OCC(=O)C(C#N)C(=O)N1CCCC1	ZINC000184280952	649252926	/nfs/dbraw/zinc/25/29/26/649252926.db2.gz	MHCFZXPEEXUQLV-IIAWOOMASA-N	0	3	306.406	2.303	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2ccc(C(C)(C)O)cc2)C1	ZINC000184678455	649344298	/nfs/dbraw/zinc/34/42/98/649344298.db2.gz	HUZLSLDEFCXZDO-INIZCTEOSA-N	0	3	319.449	2.198	10	0		DEAEHN
CON1CCC(NCc2ccn(Cc3ccccc3)n2)CC1	ZINC000389937881	685436770	/nfs/dbraw/zinc/43/67/70/685436770.db2.gz	KTDXIFPDYJIJEV-UHFFFAOYSA-N	0	3	300.406	2.047	10	0		DEAEHN
C[C@](CO)(NC[C@H]1CCCO1)c1cccc(Br)c1	ZINC000038114502	683886972	/nfs/dbraw/zinc/88/69/72/683886972.db2.gz	YIQPNODIINXMMA-ZIAGYGMSSA-N	0	3	314.223	2.425	10	0		DEAEHN
COc1ccc(NC(=O)NC(=O)CN2C[C@H](C)CC[C@H]2C)cc1	ZINC000072897504	683928653	/nfs/dbraw/zinc/92/86/53/683928653.db2.gz	SXWYWASIEDJDFI-CHWSQXEVSA-N	0	3	319.405	2.464	10	0		DEAEHN
O=[N+]([O-])c1cccc(N2CCN([C@H]3CCCC[C@H]3O)CC2)c1	ZINC000089885923	684027608	/nfs/dbraw/zinc/02/76/08/684027608.db2.gz	GWGZXOGMHFRPHM-JKSUJKDBSA-N	0	3	305.378	2.020	10	0		DEAEHN
O=C(CC1CCCC1)NC1CCN(CC[C@H]2CCOC2=O)CC1	ZINC000120537594	684097233	/nfs/dbraw/zinc/09/72/33/684097233.db2.gz	SCZUIHCNBJQHNO-HNNXBMFYSA-N	0	3	322.449	2.101	10	0		DEAEHN
CN(CC1CC1)C(=O)CN1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000247486022	685149159	/nfs/dbraw/zinc/14/91/59/685149159.db2.gz	KNSZRAHQYMHYKY-ZWKOTPCHSA-N	0	3	316.445	2.443	10	0		DEAEHN
COc1ccc(C[N@@H+]2CC[C@@H](c3cc(=O)[n-]c(N)n3)C2)cc1C	ZINC000931031727	694298106	/nfs/dbraw/zinc/29/81/06/694298106.db2.gz	DDFYMLZRANVMRC-CYBMUJFWSA-N	0	3	314.389	2.071	10	0		DEAEHN
COc1ccc(C[N@H+]2CC[C@@H](c3cc(=O)[n-]c(N)n3)C2)cc1C	ZINC000931031727	694298110	/nfs/dbraw/zinc/29/81/10/694298110.db2.gz	DDFYMLZRANVMRC-CYBMUJFWSA-N	0	3	314.389	2.071	10	0		DEAEHN
Brc1c[nH]c(CN[C@@H](C2CC2)[C@@H]2CCCOC2)n1	ZINC000723979502	777214104	/nfs/dbraw/zinc/21/41/04/777214104.db2.gz	XWVQVRLIILSDTD-MFKMUULPSA-N	0	3	314.227	2.467	10	0		DEAEHN
OCC[C@H](NCc1nc(Br)c[nH]1)C1CCCC1	ZINC000725090687	777582345	/nfs/dbraw/zinc/58/23/45/777582345.db2.gz	XFFQNGRFZFENDU-JTQLQIEISA-N	0	3	302.216	2.203	10	0		DEAEHN
CC(C)c1nnc2n1CCN(C(=O)CN1[C@H](C)CC[C@@H]1C)[C@@H]2C	ZINC000439776381	781809740	/nfs/dbraw/zinc/80/97/40/781809740.db2.gz	VUKFIFOTRNULKK-HZSPNIEDSA-N	0	3	319.453	2.178	10	0		DEAEHN
Cn1cncc1CN[C@H]1CN(C(=O)OC(C)(C)C)CC1(C)C	ZINC000721845488	787323970	/nfs/dbraw/zinc/32/39/70/787323970.db2.gz	GGORZXFDICPUMQ-ZDUSSCGKSA-N	0	3	308.426	2.155	10	0		DEAEHN
CS(=O)(=O)C1CC(NCc2ccc(C(F)(F)F)cc2)C1	ZINC000716137780	792563282	/nfs/dbraw/zinc/56/32/82/792563282.db2.gz	CJNJTZSFDVRSDT-UHFFFAOYSA-N	0	3	307.337	2.371	10	0		DEAEHN
CC(C)S(=O)(=O)CCNC1CC(OCc2ccccc2)C1	ZINC000716163109	792571813	/nfs/dbraw/zinc/57/18/13/792571813.db2.gz	ZTIIXLJJLWVVDO-UHFFFAOYSA-N	0	3	311.447	2.147	10	0		DEAEHN
C[C@H](C(=O)Nc1ccc2c(c1)OCO2)N1C[C@@H]2CCC[C@H]2C1	ZINC000247070341	798381356	/nfs/dbraw/zinc/38/13/56/798381356.db2.gz	IVFCKYTZODFMRS-AGIUHOORSA-N	0	3	302.374	2.474	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@H](N[C@H]2CCCc3n[nH]cc32)C1	ZINC000401684937	801841249	/nfs/dbraw/zinc/84/12/49/801841249.db2.gz	MUECVJLDTOIXQG-AAEUAGOBSA-N	0	3	306.410	2.386	10	0		DEAEHN
C[C@H](C[C@@H]1CCOC1)NCc1cn(C)nc1Br	ZINC000720668139	1085836429	/nfs/dbraw/zinc/83/64/29/1085836429.db2.gz	AGRNURYHRWGNPL-ZJUUUORDSA-N	0	3	302.216	2.087	10	0		DEAEHN
CN1CCC[C@@H]2[C@H]1CCN2C(=O)c1ccncc1Br	ZINC000720830671	1086186984	/nfs/dbraw/zinc/18/69/84/1086186984.db2.gz	SBQWAQIFNXHVIA-CHWSQXEVSA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@@H](N)c1cn(Cc2ccc(Br)c(F)c2F)nn1	ZINC000700999329	1086346613	/nfs/dbraw/zinc/34/66/13/1086346613.db2.gz	GKRQPJQDYDUTJY-ZCFIWIBFSA-N	0	3	317.137	2.387	10	0		DEAEHN
C[C@@H](Cc1ccccn1)N[C@@H]1CON(C(=O)OC(C)(C)C)C1	ZINC000703316064	1086493746	/nfs/dbraw/zinc/49/37/46/1086493746.db2.gz	XEPNHBOVQCESKS-JSGCOSHPSA-N	0	3	307.394	2.153	10	0		DEAEHN
Cc1cc(CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)ccn1	ZINC000703461869	1086499248	/nfs/dbraw/zinc/49/92/48/1086499248.db2.gz	IEXOSPHVGCJFBE-OAHLLOKOSA-N	0	3	321.421	2.116	10	0		DEAEHN
COC[C@@H](C)OC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000704448193	1086580601	/nfs/dbraw/zinc/58/06/01/1086580601.db2.gz	BVYKLBDYINBCJF-ZBFHGGJFSA-N	0	3	306.406	2.412	10	0		DEAEHN
COC(=O)c1cc(CNC[C@@]2(OC)CCSC2)cs1	ZINC000719266323	1088913864	/nfs/dbraw/zinc/91/38/64/1088913864.db2.gz	BATRIFIBSCJKHW-ZDUSSCGKSA-N	0	3	301.433	2.146	10	0		DEAEHN
O=C(NCc1ncc(Cl)s1)[C@@H]1CNCc2ccccc21	ZINC000719407182	1089131985	/nfs/dbraw/zinc/13/19/85/1089131985.db2.gz	ADOBVUWAASPQCA-LLVKDONJSA-N	0	3	307.806	2.300	10	0		DEAEHN
CCCOc1cccc(CCNC(=O)NC[C@@H]2CCCN2C)c1	ZINC000136520793	282087608	/nfs/dbraw/zinc/08/76/08/282087608.db2.gz	XXDOABTZBGLNJB-INIZCTEOSA-N	0	3	319.449	2.411	10	0		DEAEHN
CN[C@H]1c2ccccc2OC[C@H]1Sc1nnc(N(C)C)s1	ZINC000081769401	192322282	/nfs/dbraw/zinc/32/22/82/192322282.db2.gz	VQKDAHAGDUIFMJ-NEPJUHHUSA-N	0	3	322.459	2.418	10	0		DEAEHN
CN[C@H](CSCCC(=O)OC)c1ccc(OC)c(OC)c1	ZINC000081789991	192323649	/nfs/dbraw/zinc/32/36/49/192323649.db2.gz	SPVBNWVRPOTIAB-GFCCVEGCSA-N	0	3	313.419	2.261	10	0		DEAEHN
CCCN[C@@H]1CCOC[C@H]1S(=O)(=O)c1ccc(C)cc1C	ZINC000081922488	192338585	/nfs/dbraw/zinc/33/85/85/192338585.db2.gz	PCHSXTHLQDRATE-GDBMZVCRSA-N	0	3	311.447	2.234	10	0		DEAEHN
C[C@@H]1[C@@H](O)CC[C@@H]1c1c(Br)cnn1CCN(C)C	ZINC000163360955	197625396	/nfs/dbraw/zinc/62/53/96/197625396.db2.gz	PVLZJHRMRNDLCN-NHCYSSNCSA-N	0	3	316.243	2.082	10	0		DEAEHN
CN[C@H]1CCOC[C@@H]1S(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000081930533	192341862	/nfs/dbraw/zinc/34/18/62/192341862.db2.gz	NUHQKGZXGQECRY-GJZGRUSLSA-N	0	3	311.447	2.135	10	0		DEAEHN
CCN(CC)CCN[C@](C)(C(N)=O)c1ccc(F)cc1Cl	ZINC000078900698	185125179	/nfs/dbraw/zinc/12/51/79/185125179.db2.gz	KTVMZWZFOFJGIJ-HNNXBMFYSA-N	0	3	315.820	2.111	10	0		DEAEHN
CCCN[C@@H](CS(=O)(=O)CCOC)c1ccc(C)c(C)c1	ZINC000081943241	192343627	/nfs/dbraw/zinc/34/36/27/192343627.db2.gz	KJXXBKYCMIYKCL-INIZCTEOSA-N	0	3	313.463	2.405	10	0		DEAEHN
CCN[C@H](c1ccccc1)[C@H](C(C)C)S(=O)(=O)CCOC	ZINC000081943744	192344174	/nfs/dbraw/zinc/34/41/74/192344174.db2.gz	CYZHIPDCACRWEJ-CVEARBPZSA-N	0	3	313.463	2.423	10	0		DEAEHN
CC[C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(CN)c2)CC1	ZINC000079308579	185164279	/nfs/dbraw/zinc/16/42/79/185164279.db2.gz	JSLJBMARROGGLY-GFCCVEGCSA-N	0	3	314.426	2.485	10	0		DEAEHN
CCC(CC)CS(=O)(=O)N1C[C@@H]2CCCN2C[C@H]1CC	ZINC000246501656	282171688	/nfs/dbraw/zinc/17/16/88/282171688.db2.gz	XTHTVIMIFYHDNM-CABCVRRESA-N	0	3	302.484	2.311	10	0		DEAEHN
COc1ccc(F)cc1[C@H](C)NC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170830866	282180683	/nfs/dbraw/zinc/18/06/83/282180683.db2.gz	XNDHLKYVIIQQID-WCQYABFASA-N	0	3	309.385	2.241	10	0		DEAEHN
CC(C)[C@@H](C[NH3+])[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000087404507	185223821	/nfs/dbraw/zinc/22/38/21/185223821.db2.gz	FQNCPECYKHQABD-SNVBAGLBSA-N	0	3	311.234	2.255	10	0		DEAEHN
COc1ccc(Br)c(CC2(O)CCN(C)CC2)c1	ZINC000087790726	185232183	/nfs/dbraw/zinc/23/21/83/185232183.db2.gz	OQWMQUFADVTAHP-UHFFFAOYSA-N	0	3	314.223	2.457	10	0		DEAEHN
CN[C@@H](c1sccc1Br)[C@@H]1CCS(=O)(=O)C1	ZINC000087630644	185229454	/nfs/dbraw/zinc/22/94/54/185229454.db2.gz	QJQPSNIBVYANCE-VXNVDRBHSA-N	0	3	324.265	2.206	10	0		DEAEHN
CC(C)(C[C@@H](N)c1cc2c(cc1Cl)OCCCO2)C(N)=O	ZINC000087722262	185230985	/nfs/dbraw/zinc/23/09/85/185230985.db2.gz	XGUHNLYRRNYZTM-LLVKDONJSA-N	0	3	312.797	2.403	10	0		DEAEHN
O[C@@H]1CCOC[C@@H]1[C@H]1CCCN1Cc1nc2cccnc2s1	ZINC000328807388	231353956	/nfs/dbraw/zinc/35/39/56/231353956.db2.gz	MBYXOPPWDJBAMY-MRVWCRGKSA-N	0	3	319.430	2.053	10	0		DEAEHN
CCN(CC)CCSc1nc(N)ncc1Br	ZINC000087851761	185233636	/nfs/dbraw/zinc/23/36/36/185233636.db2.gz	KBAJRNQPXQXPLX-UHFFFAOYSA-N	0	3	305.245	2.255	10	0		DEAEHN
O=C(CN[C@H]1CCC(=O)N[C@H]1C1CC1)Nc1ccc(F)cc1	ZINC000328929023	231391171	/nfs/dbraw/zinc/39/11/71/231391171.db2.gz	YGVSQGAIJZBDDE-BBRMVZONSA-N	0	3	305.353	2.251	10	0		DEAEHN
CCOC(=O)[C@](C)(N)C[C@@H](C)N1CCC[C@H](C(F)(F)F)C1	ZINC000088435074	185250152	/nfs/dbraw/zinc/25/01/52/185250152.db2.gz	DSQSXZXKTGTEEA-NTZNESFSSA-N	0	3	310.360	2.320	10	0		DEAEHN
NC[C@@](O)(CN1CCC(C(F)(F)F)CC1)c1ccccc1	ZINC000088439788	185250870	/nfs/dbraw/zinc/25/08/70/185250870.db2.gz	LXRSRPLSAMJSJW-CQSZACIVSA-N	0	3	302.340	2.107	10	0		DEAEHN
CCCNCc1ccc(S(=O)(=O)N(C)CCC(C)C)o1	ZINC000088544419	185256780	/nfs/dbraw/zinc/25/67/80/185256780.db2.gz	QIYJNKRDEYRNBB-UHFFFAOYSA-N	0	3	302.440	2.446	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N[C@@H](C)C[C@@H](C)CC)o1	ZINC000088551586	185257613	/nfs/dbraw/zinc/25/76/13/185257613.db2.gz	LUXKMLPYWMSVCA-RYUDHWBXSA-N	0	3	302.440	2.492	10	0		DEAEHN
COCCNCCc1nnc([C@@H](OC)c2ccccc2)s1	ZINC000088824155	185266727	/nfs/dbraw/zinc/26/67/27/185266727.db2.gz	JJWQNULVKVUNLQ-AWEZNQCLSA-N	0	3	307.419	2.052	10	0		DEAEHN
CC[C@@H](N)[C@H](C)S(=O)(=O)c1cccc(Br)c1	ZINC000081982635	192349215	/nfs/dbraw/zinc/34/92/15/192349215.db2.gz	HVJBLQIAEUEZQY-GZMMTYOYSA-N	0	3	306.225	2.349	10	0		DEAEHN
CN[C@@H]1c2ccccc2CCC[C@H]1S(=O)(=O)CCCOC	ZINC000081985275	192349512	/nfs/dbraw/zinc/34/95/12/192349512.db2.gz	APWQVULISPAEGD-HZPDHXFCSA-N	0	3	311.447	2.103	10	0		DEAEHN
CC[C@H]([C@@H](NC)c1ccccc1)S(=O)(=O)C1CCOCC1	ZINC000081989828	192350464	/nfs/dbraw/zinc/35/04/64/192350464.db2.gz	WANRGNCJJDLSAD-CVEARBPZSA-N	0	3	311.447	2.320	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1ccc(C)cc1Cl	ZINC000090293302	185289959	/nfs/dbraw/zinc/28/99/59/185289959.db2.gz	AKTPMEZIJMGOAS-UHFFFAOYSA-N	0	3	302.827	2.021	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000090293259	185289973	/nfs/dbraw/zinc/28/99/73/185289973.db2.gz	STPNDIKOTWMHPO-UHFFFAOYSA-N	0	3	323.245	2.366	10	0		DEAEHN
CCCN(C1CNC1)S(=O)(=O)c1cccc(Cl)c1C	ZINC000090293359	185289991	/nfs/dbraw/zinc/28/99/91/185289991.db2.gz	DWPABRRVKGMPJF-UHFFFAOYSA-N	0	3	302.827	2.021	10	0		DEAEHN
N[C@@H]1COC[C@@H]1c1nc(-c2cc(Br)cs2)no1	ZINC000090364818	185292852	/nfs/dbraw/zinc/29/28/52/185292852.db2.gz	ZUDZIDCKPUASMF-NKWVEPMBSA-N	0	3	316.180	2.002	10	0		DEAEHN
CCCOc1ccc(Cl)cc1NC(=O)[C@@H]1COC[C@H]1NC	ZINC000090434238	185296070	/nfs/dbraw/zinc/29/60/70/185296070.db2.gz	OXBPVDPUTAQCON-DGCLKSJQSA-N	0	3	312.797	2.302	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)N1CCC[C@@H]1c1cccc(Cl)c1	ZINC000090435301	185296114	/nfs/dbraw/zinc/29/61/14/185296114.db2.gz	ORRWGMJJXKTEDT-RRFJBIMHSA-N	0	3	308.809	2.238	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1C(=O)N(Cc1cccc(Cl)c1)C(C)C	ZINC000090435004	185296328	/nfs/dbraw/zinc/29/63/28/185296328.db2.gz	QKZPMXMQCMRHLV-LSDHHAIUSA-N	0	3	310.825	2.311	10	0		DEAEHN
CCCOc1ccc(NC(=O)[C@H]2COC[C@H]2NC)cc1Cl	ZINC000090434329	185296360	/nfs/dbraw/zinc/29/63/60/185296360.db2.gz	JUZQDJNOOUZHKJ-WCQYABFASA-N	0	3	312.797	2.302	10	0		DEAEHN
C[C@@]1(C(=O)Nc2cc(Cl)cc3cccnc32)COC[C@H]1N	ZINC000090585369	185305202	/nfs/dbraw/zinc/30/52/02/185305202.db2.gz	BIBSTIDOIDKIJV-IUODEOHRSA-N	0	3	305.765	2.191	10	0		DEAEHN
C[C@@]1(C(=O)N(Cc2ccc(Cl)cc2)C2CC2)COC[C@H]1N	ZINC000090592017	185305814	/nfs/dbraw/zinc/30/58/14/185305814.db2.gz	KFPPDRUYVLNKPB-GDBMZVCRSA-N	0	3	308.809	2.195	10	0		DEAEHN
CN(Cc1cc(Cl)cc(Cl)c1)C(=O)[C@@]1(C)COC[C@H]1N	ZINC000090593640	185305951	/nfs/dbraw/zinc/30/59/51/185305951.db2.gz	MRBRZIVGYPMDGB-OCCSQVGLSA-N	0	3	317.216	2.316	10	0		DEAEHN
Nc1nc2cc(Br)cnc2n1[C@@H]1CCN(C2CC2)C1	ZINC000092575670	185326795	/nfs/dbraw/zinc/32/67/95/185326795.db2.gz	ZARLQIJDSZYXIJ-SNVBAGLBSA-N	0	3	322.210	2.185	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)C1(C(N)=S)CCCCC1	ZINC000092631814	185330315	/nfs/dbraw/zinc/33/03/15/185330315.db2.gz	NMSZJLKELRPOJF-ZDUSSCGKSA-N	0	3	311.495	2.166	10	0		DEAEHN
CN[C@@H]1c2cc(OC)ccc2C[C@H]1Sc1nnc(C)n1C	ZINC000092911770	185348592	/nfs/dbraw/zinc/34/85/92/185348592.db2.gz	UKEUKTBTKMRZCD-ZIAGYGMSSA-N	0	3	304.419	2.110	10	0		DEAEHN
C[C@@H](NC(=O)C[C@H]1CSCCN1)c1cc(F)ccc1F	ZINC000091134716	539418673	/nfs/dbraw/zinc/41/86/73/539418673.db2.gz	ULEOUNBQOVTTAC-KOLCDFICSA-N	0	3	300.374	2.237	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)[C@@H](C(=O)OC)c1ccccc1F	ZINC000245471987	282390574	/nfs/dbraw/zinc/39/05/74/282390574.db2.gz	OLWAIXBNVUZIIA-XJKSGUPXSA-N	0	3	308.397	2.456	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCc2ccccc2[C@H]1CN	ZINC000616680682	362908987	/nfs/dbraw/zinc/90/89/87/362908987.db2.gz	OHGMEMUMENXUOJ-OAHLLOKOSA-N	0	3	305.422	2.069	10	0		DEAEHN
CO[C@@H](C)c1nc(C)c(C(=O)NC[C@H]2CCN(C3CC3)C2)s1	ZINC000176103032	539625973	/nfs/dbraw/zinc/62/59/73/539625973.db2.gz	SMKLHNXTUYDEFL-NWDGAFQWSA-N	0	3	323.462	2.373	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)c2coc(Br)c2)CN1C1CC1	ZINC000177185238	539629307	/nfs/dbraw/zinc/62/93/07/539629307.db2.gz	PYCPSSTWRRXZDF-SCZZXKLOSA-N	0	3	313.195	2.397	10	0		DEAEHN
Cc1n[nH]cc1[C@H](C)N[C@@H](C)Cn1ncc2ccccc2c1=O	ZINC000181035342	539648242	/nfs/dbraw/zinc/64/82/42/539648242.db2.gz	RUJDYWBDYIHEDP-RYUDHWBXSA-N	0	3	311.389	2.167	10	0		DEAEHN
C[C@H](NCC(=O)N(C)c1nc2ccccc2s1)[C@@H]1CCCO1	ZINC000183098453	539659774	/nfs/dbraw/zinc/65/97/74/539659774.db2.gz	BEMZAKXPUTXDQM-AAEUAGOBSA-N	0	3	319.430	2.416	10	0		DEAEHN
Cc1cc(-n2cccn2)ccc1NC(=O)N1CC[C@H](N(C)C)C1	ZINC000190797991	539696766	/nfs/dbraw/zinc/69/67/66/539696766.db2.gz	BKIGYGRPQKODMO-HNNXBMFYSA-N	0	3	313.405	2.349	10	0		DEAEHN
CC[C@@H]1CN(Cc2cccc(OC)c2F)CCN1CCOC	ZINC000192950872	539710372	/nfs/dbraw/zinc/71/03/72/539710372.db2.gz	JYBIBWIJUYIOQR-OAHLLOKOSA-N	0	3	310.413	2.377	10	0		DEAEHN
Cc1c(C(=O)NCC2(N3CCSCC3)CCCC2)ccn1C	ZINC000195106746	539720064	/nfs/dbraw/zinc/72/00/64/539720064.db2.gz	IGTIUVYHSBQLSY-UHFFFAOYSA-N	0	3	321.490	2.425	10	0		DEAEHN
CN[C@@H](Cc1ncnn1C)c1ccc(Br)s1	ZINC000083974293	192393836	/nfs/dbraw/zinc/39/38/36/192393836.db2.gz	SDIBEMJWJOWICI-ZETCQYMHSA-N	0	3	301.213	2.142	10	0		DEAEHN
N[C@H](C[S@](=O)Cc1ccccc1)c1ccc2c(c1)OCO2	ZINC000084004308	192394956	/nfs/dbraw/zinc/39/49/56/192394956.db2.gz	TYEOPWRJOFTCEF-SZNDQCEHSA-N	0	3	303.383	2.364	10	0		DEAEHN
CC(C)N[C@@](C)(C[C@@H](C)Oc1cc(F)cc(F)c1)C(N)=O	ZINC000084397189	192428226	/nfs/dbraw/zinc/42/82/26/192428226.db2.gz	URTARKKRQJPCLI-BMIGLBTASA-N	0	3	300.349	2.364	10	0		DEAEHN
CCN(CC)CC(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000138596153	186017992	/nfs/dbraw/zinc/01/79/92/186017992.db2.gz	FEFRWGHQMCFWCZ-UHFFFAOYSA-N	0	3	319.449	2.122	10	0		DEAEHN
C[C@@H]1CC[C@@H](C)N(S(=O)(=O)c2cc(CN)cc(F)c2F)C1	ZINC000139158975	186019970	/nfs/dbraw/zinc/01/99/70/186019970.db2.gz	KFYMFLWHLAJQDP-NXEZZACHSA-N	0	3	318.389	2.233	10	0		DEAEHN
CCC(CC)N(C)[C@@]1(CN)CCS(=O)(=O)c2ccccc21	ZINC000147646506	186041009	/nfs/dbraw/zinc/04/10/09/186041009.db2.gz	APAZCQRZVFGQNG-MRXNPFEDSA-N	0	3	310.463	2.138	10	0		DEAEHN
C[C@H]1CCC[C@@H](CN)N1[C@@H]1CCS(=O)(=O)c2ccccc21	ZINC000147723665	186041508	/nfs/dbraw/zinc/04/15/08/186041508.db2.gz	YQFPXOBVWQURQL-KCQAQPDRSA-N	0	3	308.447	2.107	10	0		DEAEHN
CCCn1cc(S(=O)(=O)NCCCCC(C)C)cc1CN	ZINC000147913570	186042469	/nfs/dbraw/zinc/04/24/69/186042469.db2.gz	XLXRWRBBLZOSKA-UHFFFAOYSA-N	0	3	315.483	2.461	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@H](C)C(=O)N2CCN2CCCCC2)s1	ZINC000144039582	186034358	/nfs/dbraw/zinc/03/43/58/186034358.db2.gz	OAGDDYYCMQNGJC-UKRRQHHQSA-N	0	3	307.463	2.361	10	0		DEAEHN
C[C@H](c1ccc(Cl)cc1)N(C)c1nc(N)nc(N(C)C)n1	ZINC000149562702	186050834	/nfs/dbraw/zinc/05/08/34/186050834.db2.gz	IBHMUCTXUITRLT-SECBINFHSA-N	0	3	306.801	2.371	10	0		DEAEHN
Cc1sc(CN)cc1S(=O)(=O)NCCCC(F)(F)F	ZINC000149980186	186054327	/nfs/dbraw/zinc/05/43/27/186054327.db2.gz	UBGMMJPONWFISE-UHFFFAOYSA-N	0	3	316.370	2.136	10	0		DEAEHN
CN[C@@H](C)c1ccc(N2CCN(CC(F)(F)F)CC2)cn1	ZINC000148568159	186045072	/nfs/dbraw/zinc/04/50/72/186045072.db2.gz	LVPZCFVRAMQVSU-NSHDSACASA-N	0	3	302.344	2.046	10	0		DEAEHN
CCCN[C@@H]1CCCc2sc([C@H]3CCS(=O)(=O)C3)nc21	ZINC000150265685	186056348	/nfs/dbraw/zinc/05/63/48/186056348.db2.gz	XHTCTECJDOLXBK-WDEREUQCSA-N	0	3	314.476	2.422	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc1C	ZINC000150805417	186067692	/nfs/dbraw/zinc/06/76/92/186067692.db2.gz	LVDNGDBLRHXQQI-HOCLYGCPSA-N	0	3	317.433	2.087	10	0		DEAEHN
CCS(=O)(=O)C[C@@H](C)N[C@@H](C)Cc1c(F)cccc1F	ZINC000164006117	186145554	/nfs/dbraw/zinc/14/55/54/186145554.db2.gz	NIPMQKFKPVZVHW-WDEREUQCSA-N	0	3	305.390	2.309	10	0		DEAEHN
Cc1ccc([C@@H](CN)N2CCN(C)CC2)c(Br)c1	ZINC000164055275	186147116	/nfs/dbraw/zinc/14/71/16/186147116.db2.gz	RHQLLNGBTBEJPD-CQSZACIVSA-N	0	3	312.255	2.005	10	0		DEAEHN
Cc1ccc([S@@](=O)CC(=O)Nc2ccccc2CN)cc1	ZINC000155914078	186123202	/nfs/dbraw/zinc/12/32/02/186123202.db2.gz	AQHLMPGOJITCIH-OAQYLSRUSA-N	0	3	302.399	2.200	10	0		DEAEHN
CNCc1cc(Br)cnc1Oc1cc(C)nn1C	ZINC000159553947	186126739	/nfs/dbraw/zinc/12/67/39/186126739.db2.gz	UYFAUUNAVDHMGN-UHFFFAOYSA-N	0	3	311.183	2.398	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1ccc(F)cc1Br	ZINC000159595366	186129615	/nfs/dbraw/zinc/12/96/15/186129615.db2.gz	SQJOWCFWXZWRAM-JTQLQIEISA-N	0	3	319.174	2.281	10	0		DEAEHN
COc1ccc(Br)cc1CNC[C@@H](C)[S@@](C)=O	ZINC000159653815	186133068	/nfs/dbraw/zinc/13/30/68/186133068.db2.gz	JUNMBZMVIRUHGF-XLFHBGCDSA-N	0	3	320.252	2.314	10	0		DEAEHN
Cc1nn(-c2ccccc2)c(C)c1CNC[C@@H](C)[S@](C)=O	ZINC000159647287	186133250	/nfs/dbraw/zinc/13/32/50/186133250.db2.gz	ZPAQLNIESKNYDZ-XUSGNXJCSA-N	0	3	305.447	2.346	10	0		DEAEHN
COc1ccccc1[C@@H](C)CC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171480409	186166882	/nfs/dbraw/zinc/16/68/82/186166882.db2.gz	CROQHNYSOOWRNH-LSDHHAIUSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCCn1ncc(Br)c1C(=O)[C@]1(C)CCCN1	ZINC000164372140	186157393	/nfs/dbraw/zinc/15/73/93/186157393.db2.gz	MFMMHNNHVRTKFU-LBPRGKRZSA-N	0	3	300.200	2.380	10	0		DEAEHN
Cn1c2ccc(S(C)(=O)=O)cc2nc1C1(N)CCCCC1	ZINC000164377283	186157989	/nfs/dbraw/zinc/15/79/89/186157989.db2.gz	HRZXMOQTMOQAQS-UHFFFAOYSA-N	0	3	307.419	2.095	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1ccc(-c2cncnc2)cc1F	ZINC000186019195	186232149	/nfs/dbraw/zinc/23/21/49/186232149.db2.gz	RCSMMSXKLCEMTK-AWEZNQCLSA-N	0	3	314.364	2.107	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)C1=Cc2ccccc2OC1	ZINC000191880786	186269281	/nfs/dbraw/zinc/26/92/81/186269281.db2.gz	ZOUJZVZITWIWSV-ZDUSSCGKSA-N	0	3	324.446	2.070	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)NC[C@H]2CCN2C(C)(C)C)cc1	ZINC000617008723	362995179	/nfs/dbraw/zinc/99/51/79/362995179.db2.gz	KUNNQXGPMDICSL-MRXNPFEDSA-N	0	3	317.433	2.272	10	0		DEAEHN
Cc1csc(NC(=O)c2cnc([C@@H]3CCCN(C)C3)cn2)n1	ZINC000072365609	191134532	/nfs/dbraw/zinc/13/45/32/191134532.db2.gz	GLXDKTUSSBTAGA-LLVKDONJSA-N	0	3	317.418	2.303	10	0		DEAEHN
CC(=O)Nc1ccc(C)c(NC(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000171889823	198001901	/nfs/dbraw/zinc/00/19/01/198001901.db2.gz	LVLWLQXQLCKVGF-HNNXBMFYSA-N	0	3	316.405	2.265	10	0		DEAEHN
C[C@H](CCc1ccccc1)NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171897277	198004344	/nfs/dbraw/zinc/00/43/44/198004344.db2.gz	QKCIZOKMARHXRS-NVXWUHKLSA-N	0	3	301.434	2.497	10	0		DEAEHN
Cc1ccccc1-n1cc(C(=O)N2CCN3CCC[C@@H]3C2)cn1	ZINC000171954181	198014425	/nfs/dbraw/zinc/01/44/25/198014425.db2.gz	WFGHQGXIKYKYEF-MRXNPFEDSA-N	0	3	310.401	2.101	10	0		DEAEHN
O=C(Cc1c[nH]c2ccc(F)cc12)N1CCN2CCC[C@@H]2C1	ZINC000172217271	198059705	/nfs/dbraw/zinc/05/97/05/198059705.db2.gz	ZGQKDOMORFXLCM-CQSZACIVSA-N	0	3	301.365	2.156	10	0		DEAEHN
O=C(NCC1(c2cccc(F)c2)CC1)N1CCN2CCC[C@H]2C1	ZINC000172498061	198106443	/nfs/dbraw/zinc/10/64/43/198106443.db2.gz	SQBARSCZNISBPH-INIZCTEOSA-N	0	3	317.408	2.347	10	0		DEAEHN
CC(C)c1ccc([C@@H](C)NC(=O)N2CCOC3(CNC3)C2)cc1	ZINC000333425418	539959210	/nfs/dbraw/zinc/95/92/10/539959210.db2.gz	TWTPMAQTIWVUGL-CQSZACIVSA-N	0	3	317.433	2.255	10	0		DEAEHN
C[C@H](COCc1ccccc1)NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000173512349	198222247	/nfs/dbraw/zinc/22/22/47/198222247.db2.gz	HDGTUBKBADDKNS-NVXWUHKLSA-N	0	3	317.433	2.081	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)NCCN(C)c2ccccc2)CCN1C	ZINC000173598721	198231979	/nfs/dbraw/zinc/23/19/79/198231979.db2.gz	STADQYKOLOOYPE-NVXWUHKLSA-N	0	3	318.465	2.247	10	0		DEAEHN
O=C(NCC1(c2ccccc2)CC1)N1CC[C@@H](N2CC=CC2)C1	ZINC000173625691	198233247	/nfs/dbraw/zinc/23/32/47/198233247.db2.gz	MVWIUMNMPPXLCS-QGZVFWFLSA-N	0	3	311.429	2.374	10	0		DEAEHN
COCc1ccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1	ZINC000173810955	198254527	/nfs/dbraw/zinc/25/45/27/198254527.db2.gz	FULLKBGBODEYDT-RHSMWYFYSA-N	0	3	319.449	2.457	10	0		DEAEHN
c1c[nH]c([C@H](N[C@H]2CCc3nnnn3CC2)C2CCCCC2)n1	ZINC000333707444	539969463	/nfs/dbraw/zinc/96/94/63/539969463.db2.gz	HXNROJMACJLFRH-DZGCQCFKSA-N	0	3	315.425	2.012	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(N3CCCCC3)cc2)C1	ZINC000174182264	198302374	/nfs/dbraw/zinc/30/23/74/198302374.db2.gz	MCHVOJAVEQPPOU-QGZVFWFLSA-N	0	3	301.434	2.453	10	0		DEAEHN
COc1cc(CNC[C@@](C)(O)c2ccco2)cc2c1OCCO2	ZINC000174528581	198348266	/nfs/dbraw/zinc/34/82/66/198348266.db2.gz	SRPILNNXZOVLNB-QGZVFWFLSA-N	0	3	319.357	2.057	10	0		DEAEHN
C[C@@H](CC(=O)N1CCN2CCC[C@@H]2C1)C(=O)c1cccc(F)c1	ZINC000174663961	198367742	/nfs/dbraw/zinc/36/77/42/198367742.db2.gz	MRQQRRAUCAXLJD-XJKSGUPXSA-N	0	3	318.392	2.341	10	0		DEAEHN
CC[NH+](CC)C[C@H]1CCN(C(=O)c2cccc(OC)c2[O-])C1	ZINC000174757713	198380500	/nfs/dbraw/zinc/38/05/00/198380500.db2.gz	UVDYFMIMPDJCKM-CYBMUJFWSA-N	0	3	306.406	2.205	10	0		DEAEHN
C[C@H](CNC[C@H](O)c1ccccc1)NC(=O)Cc1ccccc1	ZINC000040504046	354169476	/nfs/dbraw/zinc/16/94/76/354169476.db2.gz	NMIXRSULZCHUEE-QAPCUYQASA-N	0	3	312.413	2.057	10	0		DEAEHN
CCC[C@H](N)C(=O)N(Cc1ccccc1)C[C@@H](O)c1ccco1	ZINC000236796176	202012892	/nfs/dbraw/zinc/01/28/92/202012892.db2.gz	JHEJZZWONBURBW-JKSUJKDBSA-N	0	3	316.401	2.469	10	0		DEAEHN
Cc1nn(C)cc1CN1CCC(c2nnc(C3CC3)[nH]2)CC1	ZINC000065287302	354681554	/nfs/dbraw/zinc/68/15/54/354681554.db2.gz	MAAFVFDCBDFKOY-UHFFFAOYSA-N	0	3	300.410	2.104	10	0		DEAEHN
Cc1nn(C)cc1CN1CCC(c2nc(C3CC3)n[nH]2)CC1	ZINC000065287302	354681555	/nfs/dbraw/zinc/68/15/55/354681555.db2.gz	MAAFVFDCBDFKOY-UHFFFAOYSA-N	0	3	300.410	2.104	10	0		DEAEHN
Cc1nn(C)cc1CN1CCC(c2n[nH]c(C3CC3)n2)CC1	ZINC000065287302	354681556	/nfs/dbraw/zinc/68/15/56/354681556.db2.gz	MAAFVFDCBDFKOY-UHFFFAOYSA-N	0	3	300.410	2.104	10	0		DEAEHN
CN(CCCNC(=O)C1CCC(=O)CC1)Cc1ccccc1	ZINC000073405380	354957341	/nfs/dbraw/zinc/95/73/41/354957341.db2.gz	ZWDSCJKUNIBTMA-UHFFFAOYSA-N	0	3	302.418	2.384	10	0		DEAEHN
COc1c(C)cc(CN2CCC[C@@H](N3CCNC3=O)C2)cc1C	ZINC000092188592	355619694	/nfs/dbraw/zinc/61/96/94/355619694.db2.gz	VKISIYSCKFWLRO-MRXNPFEDSA-N	0	3	317.433	2.302	10	0		DEAEHN
O=C1CCCN1C[C@H](O)CN(Cc1ccc(Cl)cc1)C1CC1	ZINC000111684182	355749668	/nfs/dbraw/zinc/74/96/68/355749668.db2.gz	JHGROFNMMSXGMC-INIZCTEOSA-N	0	3	322.836	2.288	10	0		DEAEHN
C[C@@H]1CN(c2ccc(CNCC3=CCCOC3)cn2)C[C@@H](C)O1	ZINC000126504295	355816912	/nfs/dbraw/zinc/81/69/12/355816912.db2.gz	UZEYMDNXEDSIBF-HUUCEWRRSA-N	0	3	317.433	2.132	10	0		DEAEHN
C[C@H](CCC(C)(C)C)NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000153841138	355938595	/nfs/dbraw/zinc/93/85/95/355938595.db2.gz	KUVRVJOWHVRCNK-CABCVRRESA-N	0	3	313.486	2.347	10	0		DEAEHN
C[C@@H](CN[C@@H](C)c1ccc(-n2cccn2)cc1)CS(C)(=O)=O	ZINC000180843935	356064046	/nfs/dbraw/zinc/06/40/46/356064046.db2.gz	NQOCZQJEYULOFD-KBPBESRZSA-N	0	3	321.446	2.204	10	0		DEAEHN
COCCN(CCOC)c1nc(CNC(C)(C)C)cs1	ZINC000079944294	191987164	/nfs/dbraw/zinc/98/71/64/191987164.db2.gz	GVQKVFFYNVPJCZ-UHFFFAOYSA-N	0	3	301.456	2.130	10	0		DEAEHN
CC[C@H](NCC(=O)N1CCC[C@H](C(F)(F)F)C1)[C@H]1CCCO1	ZINC000182385838	356124871	/nfs/dbraw/zinc/12/48/71/356124871.db2.gz	ICHISXGYVYVYRF-RWMBFGLXSA-N	0	3	322.371	2.335	10	0		DEAEHN
COc1cc(C[NH2+][C@@H](C)[C@@H](C)CO)cc(Br)c1[O-]	ZINC000080204304	192013052	/nfs/dbraw/zinc/01/30/52/192013052.db2.gz	MYNPJDWAZXTQGH-IUCAKERBSA-N	0	3	318.211	2.270	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ncn(C3CCCCC3)n2)C1	ZINC000184514555	356192825	/nfs/dbraw/zinc/19/28/25/356192825.db2.gz	YXVWEZXCBKBPKK-CYBMUJFWSA-N	0	3	320.441	2.389	10	0		DEAEHN
CN(C[C@@H]1CCN(C)C1)c1ncc(Br)cc1F	ZINC000234363789	356286680	/nfs/dbraw/zinc/28/66/80/356286680.db2.gz	XZQZVMZCKQMQSM-SECBINFHSA-N	0	3	302.191	2.371	10	0		DEAEHN
Brc1cc(CN2CC[C@@H]3OCCN[C@@H]3C2)cs1	ZINC000404261628	283164819	/nfs/dbraw/zinc/16/48/19/283164819.db2.gz	OLCPBIJSFNUCAK-MNOVXSKESA-N	0	3	317.252	2.073	10	0		DEAEHN
CC(=O)N(C[C@H]1CCCN1Cc1ccnc(N(C)C)c1)C1CC1	ZINC000328635968	356465190	/nfs/dbraw/zinc/46/51/90/356465190.db2.gz	NVGLHALMZMKWHA-QGZVFWFLSA-N	0	3	316.449	2.123	10	0		DEAEHN
C[C@@H](c1nc(C2CC2)no1)N(C)C[C@@H]1CCc2nccn2C1	ZINC000328655571	356466660	/nfs/dbraw/zinc/46/66/60/356466660.db2.gz	YMCDIKDSUWZHIH-RYUDHWBXSA-N	0	3	301.394	2.399	10	0		DEAEHN
CCCCN(c1ccccc1)[C@]1(CN)CCCS(=O)(=O)C1	ZINC000081580809	192296251	/nfs/dbraw/zinc/29/62/51/192296251.db2.gz	RVMBKKAKLKEERY-INIZCTEOSA-N	0	3	310.463	2.199	10	0		DEAEHN
OCCN1CCC[C@@H](NCc2cc(Br)cs2)C1	ZINC000384400399	356683359	/nfs/dbraw/zinc/68/33/59/356683359.db2.gz	UKMQCQQYLNOTBN-LLVKDONJSA-N	0	3	319.268	2.057	10	0		DEAEHN
CC[C@H]([NH2+]Cc1cc(Br)c([O-])c(OC)c1)[C@H](C)O	ZINC000386718957	356698334	/nfs/dbraw/zinc/69/83/34/356698334.db2.gz	RMXPUIUEVNTNPT-KWQFWETISA-N	0	3	318.211	2.412	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCc3ccccc3C2)s1	ZINC000088916506	192655715	/nfs/dbraw/zinc/65/57/15/192655715.db2.gz	VURPCRMXRGIIPL-UHFFFAOYSA-N	0	3	322.455	2.215	10	0		DEAEHN
CC(C)NCc1cc(S(=O)(=O)N2CCC[C@H]2C)cs1	ZINC000088972441	192675294	/nfs/dbraw/zinc/67/52/94/192675294.db2.gz	UCVWSLKBUHXXQA-LLVKDONJSA-N	0	3	302.465	2.419	10	0		DEAEHN
CCc1ccc(CN)cc1S(=O)(=O)N(C)Cc1ccoc1	ZINC000088990650	192684136	/nfs/dbraw/zinc/68/41/36/192684136.db2.gz	LTYVNOZWLGIQBM-UHFFFAOYSA-N	0	3	308.403	2.121	10	0		DEAEHN
CN(C)CCn1cc(NCc2cnn(Cc3ccccc3)c2)cn1	ZINC000589650952	357488410	/nfs/dbraw/zinc/48/84/10/357488410.db2.gz	NFWXTOMGRJBKMQ-UHFFFAOYSA-N	0	3	324.432	2.302	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H](C)Cc1ccc(OC)c(OC)c1)N(C)C	ZINC000179233808	199002156	/nfs/dbraw/zinc/00/21/56/199002156.db2.gz	YGIYTCWVKZBNAE-DZGCQCFKSA-N	0	3	322.449	2.481	10	0		DEAEHN
CCN(CC(C)(C)O)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179477390	199042609	/nfs/dbraw/zinc/04/26/09/199042609.db2.gz	ZOEFJBZHTBQPRM-HZPDHXFCSA-N	0	3	319.449	2.234	10	0		DEAEHN
CCC[C@H](C)CN1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000180132810	199121237	/nfs/dbraw/zinc/12/12/37/199121237.db2.gz	BZQNBZRZJUJSDW-ROUUACIJSA-N	0	3	320.477	2.480	10	0		DEAEHN
Cc1cc(Cl)c(C(=O)N2CCO[C@@H](CN(C)C)C2)cc1C	ZINC000180804400	199211473	/nfs/dbraw/zinc/21/14/73/199211473.db2.gz	UFRFVHZSSFUTIN-ZDUSSCGKSA-N	0	3	310.825	2.359	10	0		DEAEHN
CCc1nn(C)c(C[C@@H](N)c2ccccn2)c1Br	ZINC000089326720	192768756	/nfs/dbraw/zinc/76/87/56/192768756.db2.gz	HSHUUSPDMACMSW-SECBINFHSA-N	0	3	309.211	2.383	10	0		DEAEHN
CO[C@H]1CN(Cc2cn(C)nc2-c2ccncc2)CC[C@H]1C	ZINC000188313490	200226159	/nfs/dbraw/zinc/22/61/59/200226159.db2.gz	JULMTBPRWBIKRV-CJNGLKHVSA-N	0	3	300.406	2.339	10	0		DEAEHN
CC(C)N(CCN(C)C)C(=O)c1nc(Br)cs1	ZINC000188953325	200326923	/nfs/dbraw/zinc/32/69/23/200326923.db2.gz	WPOXCRDPSDBRGP-UHFFFAOYSA-N	0	3	320.256	2.318	10	0		DEAEHN
O[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3CN2Cc1cnc(-c2ccncc2)s1	ZINC000442967973	238095717	/nfs/dbraw/zinc/09/57/17/238095717.db2.gz	PXTQISDEEXZOBJ-RHMLRGBNSA-N	0	3	313.426	2.406	10	0		DEAEHN
C[C@H](NC[C@]1(CCO)CCOC1)c1ccc(F)cc1N(C)C	ZINC000125727405	299321820	/nfs/dbraw/zinc/32/18/20/299321820.db2.gz	UHFIPQMGNITJJX-GUYCJALGSA-N	0	3	310.413	2.331	10	0		DEAEHN
COCCN1CCN(CCCc2ccc3c(c2)CCO3)C[C@H]1C	ZINC000193247708	201012820	/nfs/dbraw/zinc/01/28/20/201012820.db2.gz	PVORJVYESXGONO-MRXNPFEDSA-N	0	3	318.461	2.207	10	0		DEAEHN
CCN1CC[C@@H](N(C)C(=O)c2nc3cccnc3s2)[C@H](C)C1	ZINC000193958962	201153189	/nfs/dbraw/zinc/15/31/89/201153189.db2.gz	OJKZUSUIXHAICE-DGCLKSJQSA-N	0	3	318.446	2.494	10	0		DEAEHN
COC(=O)C(C)(C)[C@H](NCCn1cccn1)c1ccccc1	ZINC000611406321	361593489	/nfs/dbraw/zinc/59/34/89/361593489.db2.gz	OXPYXLNZWDYUMN-OAHLLOKOSA-N	0	3	301.390	2.413	10	0		DEAEHN
CC(=O)[C@@H](C)CCCCC(=O)NC1CCN([C@H]2CCOC2)CC1	ZINC000620012287	363932478	/nfs/dbraw/zinc/93/24/78/363932478.db2.gz	YIZYDMLQVXTBDG-YOEHRIQHSA-N	0	3	324.465	2.141	10	0		DEAEHN
C[C@H]1c2ccccc2O[C@H]1C(=O)NCCN1CCC[C@@H](C)C1	ZINC000246640728	291322089	/nfs/dbraw/zinc/32/20/89/291322089.db2.gz	DUFYJAJRKFEBMF-JKIFEVAISA-N	0	3	302.418	2.399	10	0		DEAEHN
C[C@@H](C(=O)Nc1nc2ccccc2s1)N1CC[C@@H](N(C)C)C1	ZINC000623014929	364856026	/nfs/dbraw/zinc/85/60/26/364856026.db2.gz	AGLQTYVRXWXCHA-NWDGAFQWSA-N	0	3	318.446	2.259	10	0		DEAEHN
CN1CCOC[C@@H]1CNCc1cccc(F)c1Br	ZINC000623712739	365142125	/nfs/dbraw/zinc/14/21/25/365142125.db2.gz	KGDRLLIRSOHSNI-NSHDSACASA-N	0	3	317.202	2.008	10	0		DEAEHN
CN(Cc1cc(Br)cs1)c1cncc(CN)n1	ZINC000091420165	193053034	/nfs/dbraw/zinc/05/30/34/193053034.db2.gz	KVFSJLXPWCIADN-UHFFFAOYSA-N	0	3	313.224	2.396	10	0		DEAEHN
CCS(=O)(=O)CCC[C@@H](O)C1(N2CCCCC2)CCCC1	ZINC000091641753	193082279	/nfs/dbraw/zinc/08/22/79/193082279.db2.gz	BUPGAPCSZICALN-OAHLLOKOSA-N	0	3	317.495	2.361	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@@H]1O)c1ccc(F)c(Br)c1	ZINC000624235585	365345146	/nfs/dbraw/zinc/34/51/46/365345146.db2.gz	MSJPVTMUIQAQRS-HJIKLVIJSA-N	0	3	318.186	2.389	10	0		DEAEHN
CO[C@H](C)c1noc(CN2CCCN(CC(C)(C)C)CC2)n1	ZINC000091867627	193120312	/nfs/dbraw/zinc/12/03/12/193120312.db2.gz	GIGFQFMIGADINI-CYBMUJFWSA-N	0	3	310.442	2.331	10	0		DEAEHN
COc1cc(F)cc(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000091928390	193127724	/nfs/dbraw/zinc/12/77/24/193127724.db2.gz	FVKFDBPSLPHCHZ-SWLSCSKDSA-N	0	3	323.412	2.458	10	0		DEAEHN
Brc1cn2c(CNCCc3ccco3)cnc2cn1	ZINC000092049237	193148745	/nfs/dbraw/zinc/14/87/45/193148745.db2.gz	YMYUFXZAHADNJX-UHFFFAOYSA-N	0	3	321.178	2.417	10	0		DEAEHN
COC(=O)[C@@H](CC(C)C)NC(=O)CN[C@@H](C)c1ccccc1C	ZINC000155015901	283941580	/nfs/dbraw/zinc/94/15/80/283941580.db2.gz	KZTNYTPUQRMVHT-GOEBONIOSA-N	0	3	320.433	2.350	10	0		DEAEHN
CCOC(=O)CC[C@H]1CCCN(Cc2c(C)nn(C)c2OC)C1	ZINC000092093826	193156105	/nfs/dbraw/zinc/15/61/05/193156105.db2.gz	ZNBYCFMLISEQNF-CQSZACIVSA-N	0	3	323.437	2.292	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2C[C@@H](C)[C@H](C)C2)c(C)s1	ZINC000092113860	193161209	/nfs/dbraw/zinc/16/12/09/193161209.db2.gz	VPBZPRKJHFPIKJ-NXEZZACHSA-N	0	3	302.465	2.052	10	0		DEAEHN
CCN(C1CCCC1)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115671	193163171	/nfs/dbraw/zinc/16/31/71/193163171.db2.gz	MISNWHVMSDFFPH-UHFFFAOYSA-N	0	3	300.399	2.238	10	0		DEAEHN
CC(C)NCc1ccc(S(=O)(=O)N2CCCC2)c(F)c1	ZINC000092115456	193163182	/nfs/dbraw/zinc/16/31/82/193163182.db2.gz	LUWVDSXGIAUUEK-UHFFFAOYSA-N	0	3	300.399	2.108	10	0		DEAEHN
CC(C)NCc1ccc(S(=O)(=O)N2CCC[C@H]2C)c(F)c1	ZINC000092115732	193163282	/nfs/dbraw/zinc/16/32/82/193163282.db2.gz	MVYLPPIQHKLUPV-GFCCVEGCSA-N	0	3	314.426	2.497	10	0		DEAEHN
CCCC[N-]S(=O)(=O)c1ccc(C[NH2+]CCC)cc1F	ZINC000092115835	193163365	/nfs/dbraw/zinc/16/33/65/193163365.db2.gz	MGKSQTNJKAVBFG-UHFFFAOYSA-N	0	3	302.415	2.404	10	0		DEAEHN
CCN(CC(C)C)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115638	193163411	/nfs/dbraw/zinc/16/34/11/193163411.db2.gz	SPDHSJVGSCDWGG-UHFFFAOYSA-N	0	3	302.415	2.212	10	0		DEAEHN
CN(Cc1ccccc1)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115510	193163596	/nfs/dbraw/zinc/16/35/96/193163596.db2.gz	VLNOPXQLQRZTCO-UHFFFAOYSA-N	0	3	308.378	2.105	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCCC[C@H]2C)c(F)c1	ZINC000092115476	193163671	/nfs/dbraw/zinc/16/36/71/193163671.db2.gz	ARXFHHGTKKPINJ-LLVKDONJSA-N	0	3	300.399	2.108	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCC[C@@H](C)CC2)c(F)c1	ZINC000092116172	193164005	/nfs/dbraw/zinc/16/40/05/193164005.db2.gz	GAUJSIHINBAERF-GFCCVEGCSA-N	0	3	314.426	2.356	10	0		DEAEHN
Cc1c(C[S@](C)=O)cccc1NC(=O)C1(N)CCCCC1	ZINC000262491701	203307931	/nfs/dbraw/zinc/30/79/31/203307931.db2.gz	XKNYWPMFDXFEPW-NRFANRHFSA-N	0	3	308.447	2.474	10	0		DEAEHN
Cn1cc(CN2CC[C@H]3OCCC[C@@H]3C2)c(-c2cccnc2)n1	ZINC000093505835	193262575	/nfs/dbraw/zinc/26/25/75/193262575.db2.gz	JTUFDYLXCROURQ-NVXWUHKLSA-N	0	3	312.417	2.483	10	0		DEAEHN
COc1cccc(C2CC(NCC(C)(C)S(C)(=O)=O)C2)c1	ZINC000093520771	193263108	/nfs/dbraw/zinc/26/31/08/193263108.db2.gz	HEGATRDKJNQITL-UHFFFAOYSA-N	0	3	311.447	2.354	10	0		DEAEHN
C[C@@H]1CCC[C@]2(CSC(NCC(C)(C)S(C)(=O)=O)=N2)C1	ZINC000093524722	193264103	/nfs/dbraw/zinc/26/41/03/193264103.db2.gz	JXDAGCJMGNHJEI-BXUZGUMPSA-N	0	3	318.508	2.451	10	0		DEAEHN
O=C(N[C@H]1CCCC[C@H]1n1cccn1)C1CCN(C2CC2)CC1	ZINC000192670360	284170286	/nfs/dbraw/zinc/17/02/86/284170286.db2.gz	QILWRXGJPZGXQR-DLBZAZTESA-N	0	3	316.449	2.357	10	0		DEAEHN
CN[C@H](C[C@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1F	ZINC000093700276	193294027	/nfs/dbraw/zinc/29/40/27/193294027.db2.gz	ULEBUHQJMRRBLH-IUODEOHRSA-N	0	3	314.426	2.148	10	0		DEAEHN
CC[C@@H](CO)N1CCN(Cc2ccc(Cl)c(F)c2)CC1	ZINC000093740405	193298113	/nfs/dbraw/zinc/29/81/13/193298113.db2.gz	JWRASQPKOAJUCI-ZDUSSCGKSA-N	0	3	300.805	2.368	10	0		DEAEHN
COC(=O)[C@@]1(NC(C)C)CC[C@H](N(C)CCC(F)(F)F)C1	ZINC000093831808	193314515	/nfs/dbraw/zinc/31/45/15/193314515.db2.gz	JVGFNFGBFGPPJK-WCQYABFASA-N	0	3	310.360	2.333	10	0		DEAEHN
CCOC(=O)[C@@]1(N)CC[C@H](N2CCC(C(F)(F)F)CC2)C1	ZINC000093831933	193314989	/nfs/dbraw/zinc/31/49/89/193314989.db2.gz	FATSYPAJORRTNC-WCQYABFASA-N	0	3	308.344	2.074	10	0		DEAEHN
CC(C)([C@H](N)Cc1nc2ccccc2s1)N1CCOCC1	ZINC000094251474	193355275	/nfs/dbraw/zinc/35/52/75/193355275.db2.gz	DPQVZHFSOGYBMV-CQSZACIVSA-N	0	3	305.447	2.277	10	0		DEAEHN
CCN[C@H](Cc1nc2ccccc2s1)[C@H]1CN(C)CCO1	ZINC000094251521	193355402	/nfs/dbraw/zinc/35/54/02/193355402.db2.gz	YADFVFRLEPTRHX-ZIAGYGMSSA-N	0	3	305.447	2.148	10	0		DEAEHN
NC(=S)c1ccc(C(F)(F)F)nc1OCCN1CCCC1	ZINC000094336373	193361233	/nfs/dbraw/zinc/36/12/33/193361233.db2.gz	NIFDDWJOVKOLCP-UHFFFAOYSA-N	0	3	319.352	2.209	10	0		DEAEHN
CCNC(=O)CCOc1c(F)cc(CNC(C)C)cc1F	ZINC000094347365	193363580	/nfs/dbraw/zinc/36/35/80/193363580.db2.gz	UWNRFLYXHFIEMP-UHFFFAOYSA-N	0	3	300.349	2.368	10	0		DEAEHN
CCNCc1cc(F)c(OCC(=O)NCC(C)C)c(F)c1	ZINC000094347025	193363705	/nfs/dbraw/zinc/36/37/05/193363705.db2.gz	NVFKNBAJAFTGAL-UHFFFAOYSA-N	0	3	300.349	2.225	10	0		DEAEHN
CC[C@@H](C)NCC(=O)Nc1cc(C)c(Br)cn1	ZINC000094063552	193342544	/nfs/dbraw/zinc/34/25/44/193342544.db2.gz	IPLIYCURBKNQKP-SECBINFHSA-N	0	3	300.200	2.479	10	0		DEAEHN
CN[C@@H]1COC[C@@H]1c1nc(-c2ncc(Cl)cc2Cl)no1	ZINC000094199323	193348521	/nfs/dbraw/zinc/34/85/21/193348521.db2.gz	LVJLRYQEIPGZKS-IONNQARKSA-N	0	3	315.160	2.140	10	0		DEAEHN
C[C@@]1(c2nc(-c3ncc(Cl)cc3Cl)no2)COC[C@@H]1N	ZINC000094199328	193348670	/nfs/dbraw/zinc/34/86/70/193348670.db2.gz	HYMMURRUEZVWMM-QPUJVOFHSA-N	0	3	315.160	2.054	10	0		DEAEHN
CC[C@](C)(N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2	ZINC000094237027	193353425	/nfs/dbraw/zinc/35/34/25/193353425.db2.gz	YUDNWAZXDIKDAI-HNNXBMFYSA-N	0	3	310.419	2.479	10	0		DEAEHN
CCCN1CCC[C@](O)([C@@H]2CCC[C@H](S(C)(=O)=O)C2)CC1	ZINC000094639910	193387714	/nfs/dbraw/zinc/38/77/14/193387714.db2.gz	FLUJIJGUDLABJR-OWCLPIDISA-N	0	3	317.495	2.217	10	0		DEAEHN
[NH3+]C[C@H]1CCC[C@@H]1C(=O)Nc1cc(Br)ccc1[O-]	ZINC000094573700	193381994	/nfs/dbraw/zinc/38/19/94/193381994.db2.gz	GJFNEJDPIJYBLH-SCZZXKLOSA-N	0	3	313.195	2.468	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@@H]1NCc1ccc(Br)s1	ZINC000282449636	217003087	/nfs/dbraw/zinc/00/30/87/217003087.db2.gz	SJBURQKYJKTCJD-APPZFPTMSA-N	0	3	303.225	2.267	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@@H]1NCc1cc(Br)ccc1F	ZINC000282457138	217010214	/nfs/dbraw/zinc/01/02/14/217010214.db2.gz	STWUUPZVRRSFQH-PELKAZGASA-N	0	3	315.186	2.345	10	0		DEAEHN
NCc1cc(S(=O)(=O)NC2CCCCCC2)ccc1F	ZINC000020189192	182195450	/nfs/dbraw/zinc/19/54/50/182195450.db2.gz	VIAIDXKPTIKECF-UHFFFAOYSA-N	0	3	300.399	2.286	10	0		DEAEHN
CCN1CCN(C[C@H](N)c2cccc(C(F)(F)F)c2)CC1	ZINC000021518284	182278046	/nfs/dbraw/zinc/27/80/46/182278046.db2.gz	AUYSPNPUYSYYMX-AWEZNQCLSA-N	0	3	301.356	2.343	10	0		DEAEHN
C[C@H]1Cc2ccccc2N1S(=O)(=O)c1ccccc1CN	ZINC000022154144	182311072	/nfs/dbraw/zinc/31/10/72/182311072.db2.gz	PWRLOJQQHXCXRG-LBPRGKRZSA-N	0	3	302.399	2.285	10	0		DEAEHN
Cc1cc(CCNC(=O)N[C@@H](CC(C)C)CN2CCCC2)on1	ZINC000454971007	246296312	/nfs/dbraw/zinc/29/63/12/246296312.db2.gz	UTPPMJAKDJAQMJ-HNNXBMFYSA-N	0	3	322.453	2.335	10	0		DEAEHN
C[C@H](C(=O)N(CCN(C)C)Cc1ccco1)C1CCOCC1	ZINC000156049549	291614294	/nfs/dbraw/zinc/61/42/94/291614294.db2.gz	GKEWOQHUVXPQMF-AWEZNQCLSA-N	0	3	308.422	2.233	10	0		DEAEHN
Cc1ccc(-c2cccc(CNC[C@H](O)Cn3ccnn3)c2)cc1	ZINC000459700566	248663219	/nfs/dbraw/zinc/66/32/19/248663219.db2.gz	PUTIZCQVRWNBDU-IBGZPJMESA-N	0	3	322.412	2.404	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2cccc(-c3nccs3)c2)C1	ZINC000040634298	183111829	/nfs/dbraw/zinc/11/18/29/183111829.db2.gz	DKNVUZNPSABYCJ-OLZOCXBDSA-N	0	3	303.387	2.126	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2cc(Cl)cc3cccnc32)C1	ZINC000040632682	183112065	/nfs/dbraw/zinc/11/20/65/183112065.db2.gz	WLPWKEAWFCZMEH-WCQYABFASA-N	0	3	305.765	2.204	10	0		DEAEHN
CO[C@H]1CN[C@H](C(=O)Nc2ccc(Br)c(C)c2)C1	ZINC000040630128	183110693	/nfs/dbraw/zinc/11/06/93/183110693.db2.gz	RFYJZWZTFPZQRK-PWSUYJOCSA-N	0	3	313.195	2.073	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)Nc1sc2c(c1C(=O)OC)CCC2	ZINC000040858861	183143099	/nfs/dbraw/zinc/14/30/99/183143099.db2.gz	DUSJSOHXMZELNL-UFBFGSQYSA-N	0	3	310.419	2.335	10	0		DEAEHN
CC[NH+](CC)CCC[C@H](C)[N-]S(=O)(=O)c1cc(N)cs1	ZINC000041067812	183161481	/nfs/dbraw/zinc/16/14/81/183161481.db2.gz	ALHRGEYJAPXKEP-NSHDSACASA-N	0	3	319.496	2.119	10	0		DEAEHN
CNCc1c(N(CCOC)[C@@H](C)C2CC2)nc2sccn12	ZINC000042681019	183296106	/nfs/dbraw/zinc/29/61/06/183296106.db2.gz	CHTOREOBQLGEBJ-NSHDSACASA-N	0	3	308.451	2.367	10	0		DEAEHN
C[C@H](N)[C@H](c1ccc(Cl)cc1)N(C)CC(=O)N1CCCC1	ZINC000042946068	183319558	/nfs/dbraw/zinc/31/95/58/183319558.db2.gz	OTAFUFTYPPSWEX-BLLLJJGKSA-N	0	3	309.841	2.283	10	0		DEAEHN
CC[C@@H](N)[C@@H](c1cccc(Cl)c1)N(C)CC(=O)NC1CC1	ZINC000043014408	183327990	/nfs/dbraw/zinc/32/79/90/183327990.db2.gz	SYLSHAJZKYEIAD-GDBMZVCRSA-N	0	3	309.841	2.329	10	0		DEAEHN
NC[C@@H](c1cccc(Br)c1)N1CCC(CO)CC1	ZINC000043020263	183328834	/nfs/dbraw/zinc/32/88/34/183328834.db2.gz	LYUNMTGYWLEUJH-AWEZNQCLSA-N	0	3	313.239	2.153	10	0		DEAEHN
CS(=O)(=O)c1cccc(O[C@H](CN)c2ccccc2F)c1	ZINC000043048670	183331907	/nfs/dbraw/zinc/33/19/07/183331907.db2.gz	BUHKDYCRZGPWRY-OAHLLOKOSA-N	0	3	309.362	2.308	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)s1)N(CC)CC(=O)NC	ZINC000043252669	183346471	/nfs/dbraw/zinc/34/64/71/183346471.db2.gz	BIOURBQQMPPWSO-ZANVPECISA-N	0	3	303.859	2.248	10	0		DEAEHN
CCCN(CC(=O)NC)[C@@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043253698	183348388	/nfs/dbraw/zinc/34/83/88/183348388.db2.gz	BAEMEFXRILWVNB-NOZJJQNGSA-N	0	3	303.859	2.248	10	0		DEAEHN
C[C@H](N)[C@H](c1cc(Br)cs1)N1CCOCC1	ZINC000043284353	183350494	/nfs/dbraw/zinc/35/04/94/183350494.db2.gz	IVFYRNSAYKRKLU-GZMMTYOYSA-N	0	3	305.241	2.231	10	0		DEAEHN
Cc1ccc([C@@H](Oc2cccc(S(C)(=O)=O)c2)[C@@H](C)N)o1	ZINC000043366996	183357208	/nfs/dbraw/zinc/35/72/08/183357208.db2.gz	LTOFSEPSVKDLHS-ABAIWWIYSA-N	0	3	309.387	2.459	10	0		DEAEHN
COCCN(CCN(C)C)C(=O)Nc1cccc([C@H](C)OC)c1	ZINC000105032677	194065934	/nfs/dbraw/zinc/06/59/34/194065934.db2.gz	PIVRLKOFVWDAKC-AWEZNQCLSA-N	0	3	323.437	2.436	10	0		DEAEHN
COCCN1CCN(CCCOCCc2ccccc2)C[C@H]1C	ZINC000105833842	194143053	/nfs/dbraw/zinc/14/30/53/194143053.db2.gz	PRFRFTGTBOTERG-GOSISDBHSA-N	0	3	320.477	2.288	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)[C@H](C)NCCn2cc(C)cn2)c1	ZINC000105881256	194155530	/nfs/dbraw/zinc/15/55/30/194155530.db2.gz	VQNQYLVNUUVWKS-ZDUSSCGKSA-N	0	3	314.389	2.011	10	0		DEAEHN
COCCCCCN1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000105911668	194167655	/nfs/dbraw/zinc/16/76/55/194167655.db2.gz	RQPXFZBQBNIINB-GOSISDBHSA-N	0	3	306.450	2.154	10	0		DEAEHN
C[C@@H](NC[C@@H]1CN(C)CCO1)c1ccc(OC(F)F)cc1	ZINC000105932390	194172561	/nfs/dbraw/zinc/17/25/61/194172561.db2.gz	RCCTTWJFWLFVMT-BXUZGUMPSA-N	0	3	300.349	2.269	10	0		DEAEHN
CCC(CC)(C(N)=S)C(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000110272745	194319458	/nfs/dbraw/zinc/31/94/58/194319458.db2.gz	LUOILTRNHPZNJB-CYBMUJFWSA-N	0	3	311.495	2.166	10	0		DEAEHN
CCNCc1cc(Br)cnc1O[C@H]1CCOC1	ZINC000110532504	194337421	/nfs/dbraw/zinc/33/74/21/194337421.db2.gz	JTQGVMWYJFPEHM-NSHDSACASA-N	0	3	301.184	2.121	10	0		DEAEHN
CC(C)Cc1ccc(S(=O)(=O)N(C)[C@H]2CCCNC2)cc1	ZINC000110927748	194369885	/nfs/dbraw/zinc/36/98/85/194369885.db2.gz	FUKZDTIEEACAMD-HNNXBMFYSA-N	0	3	310.463	2.258	10	0		DEAEHN
Cc1cc(Cl)ccc1S(=O)(=O)N(C)[C@H]1CCCNC1	ZINC000110928071	194370573	/nfs/dbraw/zinc/37/05/73/194370573.db2.gz	HRYVVAHCYXZCCD-LBPRGKRZSA-N	0	3	302.827	2.021	10	0		DEAEHN
CCCN[C@H](c1cccc(F)c1F)[C@H]1CCS(=O)(=O)C1	ZINC000111037650	194386185	/nfs/dbraw/zinc/38/61/85/194386185.db2.gz	GDJSXROCKVKNDR-HZMBPMFUSA-N	0	3	303.374	2.440	10	0		DEAEHN
CCOCCN(CC)CC[C@](C)(NC(C)C)C(=O)OCC	ZINC000111122173	194392728	/nfs/dbraw/zinc/39/27/28/194392728.db2.gz	POJKAHUTLNMQIN-INIZCTEOSA-N	0	3	302.459	2.055	10	0		DEAEHN
CCCN[C@@](C)(C[C@@H](C)N(C)CCOCC)C(=O)OCC	ZINC000157474017	197190236	/nfs/dbraw/zinc/19/02/36/197190236.db2.gz	OWVMEWMTOGJCAC-ZBFHGGJFSA-N	0	3	302.459	2.055	10	0		DEAEHN
NNc1ccc(Cl)c(CSc2nnc3ccccn32)n1	ZINC000061640313	184180454	/nfs/dbraw/zinc/18/04/54/184180454.db2.gz	MHOQPAJDKJOCLO-UHFFFAOYSA-N	0	3	306.782	2.356	10	0		DEAEHN
Cc1ccc(S(=O)(=O)NCc2ccccc2CN)cc1F	ZINC000061841305	184189348	/nfs/dbraw/zinc/18/93/48/184189348.db2.gz	NIMRVOQZNVXNBS-UHFFFAOYSA-N	0	3	308.378	2.071	10	0		DEAEHN
NC[C@@H](c1ccc(F)c(Br)c1)N1CCCOCC1	ZINC000061916547	184195325	/nfs/dbraw/zinc/19/53/25/184195325.db2.gz	XZGWKGBGXAJZOS-ZDUSSCGKSA-N	0	3	317.202	2.310	10	0		DEAEHN
CC[C@H](O)COc1c(Cl)cc(CNCCOC)cc1OC	ZINC000062727882	184250474	/nfs/dbraw/zinc/25/04/74/184250474.db2.gz	QDXPKPQDTMRFRA-LBPRGKRZSA-N	0	3	317.813	2.234	10	0		DEAEHN
CC(C)(C)NCc1cccc(Br)c1OCC(N)=O	ZINC000062733482	184251023	/nfs/dbraw/zinc/25/10/23/184251023.db2.gz	HHMKZNQLALZQNR-UHFFFAOYSA-N	0	3	315.211	2.201	10	0		DEAEHN
CC(C)(C)NCc1c(N(CCO)C2CC2)nc2sccn12	ZINC000062737626	184252224	/nfs/dbraw/zinc/25/22/24/184252224.db2.gz	XXZQLHXONJXMKZ-UHFFFAOYSA-N	0	3	308.451	2.245	10	0		DEAEHN
N[C@@H](CNC(=O)c1cncc(Br)c1)c1ccccc1	ZINC000062837964	184255560	/nfs/dbraw/zinc/25/55/60/184255560.db2.gz	FLXAVEFJDMUDRA-ZDUSSCGKSA-N	0	3	320.190	2.274	10	0		DEAEHN
CN(CCN1CCCC1)C(=O)C1(C(N)=S)CCCCCC1	ZINC000063053385	184268462	/nfs/dbraw/zinc/26/84/62/184268462.db2.gz	QOQCRDTVKRXRTO-UHFFFAOYSA-N	0	3	311.495	2.167	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)C2CCCC2)cc(CN)c1F	ZINC000159062752	197323441	/nfs/dbraw/zinc/32/34/41/197323441.db2.gz	MBRYBFLIBCLAQQ-UHFFFAOYSA-N	0	3	300.399	2.156	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCC2(CCCC2)C1	ZINC000173175420	207360586	/nfs/dbraw/zinc/36/05/86/207360586.db2.gz	CZYNNBWVYGYILQ-OAHLLOKOSA-N	0	3	309.454	2.073	10	0		DEAEHN
Cc1cccnc1[C@@H](NC(=O)N1CC[C@@H](N(C)C)C1)C(C)C	ZINC000115840203	194704706	/nfs/dbraw/zinc/70/47/06/194704706.db2.gz	FGKIXAUOYXTWMB-CABCVRRESA-N	0	3	304.438	2.433	10	0		DEAEHN
CCc1ccc([C@@H](C)N[C@H](C)C(=O)NC(=O)NC2CC2)cc1	ZINC000119672764	195015063	/nfs/dbraw/zinc/01/50/63/195015063.db2.gz	RACQJEMCEBMHAU-VXGBXAGGSA-N	0	3	303.406	2.276	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(C(=O)[C@@H](N)C(C)C)C2)c1	ZINC000119794754	195037832	/nfs/dbraw/zinc/03/78/32/195037832.db2.gz	ICVGWTUCJIPVGW-WBMJQRKESA-N	0	3	306.406	2.003	10	0		DEAEHN
COCOc1ccc(OC)cc1CN[C@@H]1CCCC[C@@H]1CO	ZINC000120009768	195079346	/nfs/dbraw/zinc/07/93/46/195079346.db2.gz	NZNQCEZKNRSUMP-CZUORRHYSA-N	0	3	309.406	2.319	10	0		DEAEHN
N[C@@H](CS(=O)(=O)c1ccc(Cl)c(Cl)c1)[C@H]1CCOC1	ZINC000159121270	197329814	/nfs/dbraw/zinc/32/98/14/197329814.db2.gz	WRGAHRXXGAWHOL-UFBFGSQYSA-N	0	3	324.229	2.131	10	0		DEAEHN
CCC(C)(C)N(C)S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159118980	197328761	/nfs/dbraw/zinc/32/87/61/197328761.db2.gz	YLIMDIFEWFCZPG-UHFFFAOYSA-N	0	3	302.415	2.402	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCC(C)CC2)cc(CN)c1F	ZINC000159047236	197321392	/nfs/dbraw/zinc/32/13/92/197321392.db2.gz	RCQPAZTYBWADHH-UHFFFAOYSA-N	0	3	300.399	2.013	10	0		DEAEHN
CCNS(=O)(=O)c1cc(C)c(F)c(CNC(C)(C)C)c1	ZINC000159087496	197325528	/nfs/dbraw/zinc/32/55/28/197325528.db2.gz	RKRKQNDLNXROGK-UHFFFAOYSA-N	0	3	302.415	2.320	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)cs1	ZINC000158756044	197299483	/nfs/dbraw/zinc/29/94/83/197299483.db2.gz	MUULRSJBCGZXQN-VXGBXAGGSA-N	0	3	314.476	2.278	10	0		DEAEHN
CCN[C@@H](CS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CCOC1	ZINC000158714809	197296517	/nfs/dbraw/zinc/29/65/17/197296517.db2.gz	JXRAFVZOCSBSEL-FZMZJTMJSA-N	0	3	317.838	2.128	10	0		DEAEHN
CN[C@H](CS(=O)(=O)c1ccc(C(C)C)cc1)[C@H]1CCOC1	ZINC000158714394	197296336	/nfs/dbraw/zinc/29/63/36/197296336.db2.gz	DZPAAJDTTDVNRZ-GOEBONIOSA-N	0	3	311.447	2.208	10	0		DEAEHN
C[C@H]1C[C@@H](Nc2nc(Br)cn3ccnc23)CCN1C	ZINC000158595750	197286393	/nfs/dbraw/zinc/28/63/93/197286393.db2.gz	PQDWDXQEOCGNBS-UWVGGRQHSA-N	0	3	324.226	2.386	10	0		DEAEHN
C[C@@H]1C[C@H](Nc2nc3c(Br)cccn3n2)CCN1C	ZINC000158438890	197271918	/nfs/dbraw/zinc/27/19/18/197271918.db2.gz	BZIBQFXSHZBHIF-NXEZZACHSA-N	0	3	324.226	2.386	10	0		DEAEHN
COc1ccc([C@@H](C)NC[C@@]2(O)CCSC2)cc1NC(C)=O	ZINC000158247903	197257162	/nfs/dbraw/zinc/25/71/62/197257162.db2.gz	SBOOZNREZDOGCG-BZNIZROVSA-N	0	3	324.446	2.172	10	0		DEAEHN
COc1ccc(CC2CCN([C@H](C)C(=O)N(C)C)CC2)cc1	ZINC000157724394	197210765	/nfs/dbraw/zinc/21/07/65/197210765.db2.gz	PAHKXTQTRUPMNT-CQSZACIVSA-N	0	3	304.434	2.426	10	0		DEAEHN
CN[C@@H](Cc1cccc(C(F)(F)F)c1)[C@H](C)S(C)(=O)=O	ZINC000157711470	197210109	/nfs/dbraw/zinc/21/01/09/197210109.db2.gz	CITWIAHCFFXVBC-CABZTGNLSA-N	0	3	309.353	2.269	10	0		DEAEHN
Cc1cc2sc(C(=O)NC[C@H](C)N(C)C)c(N)c2c(C)n1	ZINC000157017739	197155547	/nfs/dbraw/zinc/15/55/47/197155547.db2.gz	SJCKODGVASOYQV-VIFPVBQESA-N	0	3	306.435	2.175	10	0		DEAEHN
CCO[C@@H]1C[C@](N)(C(=O)N(CC(F)(F)F)C(C)C)C1(C)C	ZINC000156952600	197153147	/nfs/dbraw/zinc/15/31/47/197153147.db2.gz	VHQOOYWREBVNMS-MFKMUULPSA-N	0	3	310.360	2.318	10	0		DEAEHN
CCNc1nc(Cl)nc(NC2C[C@H]3CCC[C@@H](C2)N3C)n1	ZINC000156563824	197123304	/nfs/dbraw/zinc/12/33/04/197123304.db2.gz	PTJBXOAETZLUJI-FGWVZKOKSA-N	0	3	310.833	2.384	10	0		DEAEHN
CNc1nc(N[C@@H](C)c2nccs2)nc(N2CCCC2)n1	ZINC000156153597	197091221	/nfs/dbraw/zinc/09/12/21/197091221.db2.gz	UHJCYHQSBSNFGY-VIFPVBQESA-N	0	3	305.411	2.143	10	0		DEAEHN
C[C@H](c1ccccc1)N1CCC(NC(=O)CC[S@@](C)=O)CC1	ZINC000156012658	197080871	/nfs/dbraw/zinc/08/08/71/197080871.db2.gz	XVGQGFQKONAVDN-PEBXRYMYSA-N	0	3	322.474	2.097	10	0		DEAEHN
NCc1cccc(NC(=O)C[S@@](=O)c2ccccc2F)c1	ZINC000155942873	197076124	/nfs/dbraw/zinc/07/61/24/197076124.db2.gz	ROXLRHVTLKEINS-NRFANRHFSA-N	0	3	306.362	2.031	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@H](C(=O)N(C)C)c1ccccc1	ZINC000177698714	285241355	/nfs/dbraw/zinc/24/13/55/285241355.db2.gz	WMUZFIHZVCKYIX-SJORKVTESA-N	0	3	303.450	2.232	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)C(=O)Nc2ccccc2Cl)CCN1C	ZINC000120621734	195203288	/nfs/dbraw/zinc/20/32/88/195203288.db2.gz	KTHPQZRUKXNRRM-VXGBXAGGSA-N	0	3	323.824	2.220	10	0		DEAEHN
Cc1nc(CN(C)C2CCN(CCn3cccn3)CC2)cs1	ZINC000120713412	195221684	/nfs/dbraw/zinc/22/16/84/195221684.db2.gz	DHUWUKXNXJNLBY-UHFFFAOYSA-N	0	3	319.478	2.244	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1C	ZINC000120721459	195224569	/nfs/dbraw/zinc/22/45/69/195224569.db2.gz	ZJMNGZFKOCQOBA-UKRRQHHQSA-N	0	3	317.433	2.183	10	0		DEAEHN
CN(C)CCO[C@@H]1CN(Cc2ccc(F)cc2)[C@@H]2CCCO[C@H]12	ZINC000503716206	257210161	/nfs/dbraw/zinc/21/01/61/257210161.db2.gz	FJCKEDGBPJKYGA-KURKYZTESA-N	0	3	322.424	2.136	10	0		DEAEHN
COC[C@H](C)C(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1	ZINC000186054283	285332542	/nfs/dbraw/zinc/33/25/42/285332542.db2.gz	OWYZNLRTLHPSKR-WMLDXEAASA-N	0	3	304.434	2.296	10	0		DEAEHN
CCCN1CCC(N2C(=O)[C@@H](C)N[C@H]2c2cccs2)CC1	ZINC000122392567	195444376	/nfs/dbraw/zinc/44/43/76/195444376.db2.gz	WKQFYBHJRFKRLT-IUODEOHRSA-N	0	3	307.463	2.441	10	0		DEAEHN
COc1cccc(NC(=O)CNC2(CCO)CCCCC2)c1	ZINC000440885407	533603877	/nfs/dbraw/zinc/60/38/77/533603877.db2.gz	JXNFKCIXMSIPAE-UHFFFAOYSA-N	0	3	306.406	2.309	10	0		DEAEHN
COc1cc(OC)c(OC)cc1CNCCN1CC=C(C)CC1	ZINC000358118632	133122112	/nfs/dbraw/zinc/12/21/12/133122112.db2.gz	NYRFSBQTLIVPNV-UHFFFAOYSA-N	0	3	320.433	2.454	10	0		DEAEHN
Cc1ccc2c(c1)[C@@H](N[C@H]1CCN(C3CCOCC3)C1=O)CC2	ZINC000358185238	133126939	/nfs/dbraw/zinc/12/69/39/133126939.db2.gz	XZPOZMJPOOOSNO-ROUUACIJSA-N	0	3	314.429	2.352	10	0		DEAEHN
C[C@@H]1C[C@@H]1CNC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000360430295	133181848	/nfs/dbraw/zinc/18/18/48/133181848.db2.gz	PGUDDGAWAZSUHW-WTTBNOFXSA-N	0	3	301.434	2.462	10	0		DEAEHN
CCS[C@H]1CCC[C@H](NC(=O)NCCNc2ccncc2)C1	ZINC000361917008	133199461	/nfs/dbraw/zinc/19/94/61/133199461.db2.gz	VRDDUNRYDZYBRD-GJZGRUSLSA-N	0	3	322.478	2.279	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)NCc1cc(COC(C)(C)C)on1	ZINC000362426348	133229485	/nfs/dbraw/zinc/22/94/85/133229485.db2.gz	CNDBKEPCHCDCQS-HNNXBMFYSA-N	0	3	323.437	2.480	10	0		DEAEHN
O[C@@H](COC1CCOCC1)CN1CCCC[C@H]1c1ccco1	ZINC000368550407	133277979	/nfs/dbraw/zinc/27/79/79/133277979.db2.gz	ZKIQFSPLAXSXHV-ZBFHGGJFSA-N	0	3	309.406	2.363	10	0		DEAEHN
COc1cc(CN2CCCC[C@@H](CO)C2)cc2c1OCCO2	ZINC000377236536	133323450	/nfs/dbraw/zinc/32/34/50/133323450.db2.gz	FUFDJYTYQAXKTN-CYBMUJFWSA-N	0	3	307.390	2.061	10	0		DEAEHN
CC/C=C(\C)C(=O)N1CCN(c2ccc(CN(C)C)cn2)CC1	ZINC000172223605	144816871	/nfs/dbraw/zinc/81/68/71/144816871.db2.gz	AXLAGRBSORAFFZ-GIDUJCDVSA-N	0	3	316.449	2.148	10	0		DEAEHN
Cc1nn(C)cc1[C@H](C)N[C@H]1CCc2nc(C(C)C)nn2C1	ZINC000180636794	144892152	/nfs/dbraw/zinc/89/21/52/144892152.db2.gz	LQJXCWCDELLZMY-AAEUAGOBSA-N	0	3	302.426	2.109	10	0		DEAEHN
Cc1nn(C)cc1[C@@H](C)N[C@H]1CCc2nc(C(C)C)nn2C1	ZINC000180636776	144892199	/nfs/dbraw/zinc/89/21/99/144892199.db2.gz	LQJXCWCDELLZMY-YPMHNXCESA-N	0	3	302.426	2.109	10	0		DEAEHN
CCC(C)(C)NC(=O)CN[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000181527843	144906585	/nfs/dbraw/zinc/90/65/85/144906585.db2.gz	XABJRVRLPRMTLY-CYBMUJFWSA-N	0	3	315.421	2.223	10	0		DEAEHN
Cc1ccc(C)c(OC[C@@H](O)CN(C)C[C@@H]2CCCO2)c1C	ZINC000187814699	145003967	/nfs/dbraw/zinc/00/39/67/145003967.db2.gz	GIEWGXRZTXDKOS-IRXDYDNUSA-N	0	3	307.434	2.462	10	0		DEAEHN
O=C(NCc1ccnc(OC2CCCCC2)c1)[C@H]1C[C@H](F)CN1	ZINC000188876711	145019121	/nfs/dbraw/zinc/01/91/21/145019121.db2.gz	XAVICIACGUWTNF-DZGCQCFKSA-N	0	3	321.396	2.109	10	0		DEAEHN
O=C(c1c[nH]nc1-c1ccsc1)N1CCCN(C2CC2)CC1	ZINC000189154894	145023436	/nfs/dbraw/zinc/02/34/36/145023436.db2.gz	KWMJIIMCORIKPQ-UHFFFAOYSA-N	0	3	316.430	2.449	10	0		DEAEHN
CN(Cc1ccc(F)nc1)[C@H]1CCCN(c2cccnn2)C1	ZINC000189336282	145026134	/nfs/dbraw/zinc/02/61/34/145026134.db2.gz	VRAZCKLULMIPIN-AWEZNQCLSA-N	0	3	301.369	2.112	10	0		DEAEHN
O=C(NCC1CCN(CCO)CC1)Nc1ccsc1Cl	ZINC000189408206	145027068	/nfs/dbraw/zinc/02/70/68/145027068.db2.gz	WIFCVGIYUQLPGW-UHFFFAOYSA-N	0	3	317.842	2.227	10	0		DEAEHN
CN(CC1CC(O)C1)[C@H]1CCCN(c2cccc(F)c2)C1=O	ZINC000190153367	145038846	/nfs/dbraw/zinc/03/88/46/145038846.db2.gz	PTYIJHUAQQXQJI-MOQPWLNLSA-N	0	3	306.381	2.024	10	0		DEAEHN
COc1ccnc(CN2CCC(c3ccn[nH]3)CC2)c1OC	ZINC000190497185	145043900	/nfs/dbraw/zinc/04/39/00/145043900.db2.gz	FHUUPYIYUVNSLK-UHFFFAOYSA-N	0	3	302.378	2.202	10	0		DEAEHN
CO[C@H](C)[C@H](C)NC(=O)N(CCN(C)C)Cc1cccc(C)c1	ZINC000190661251	145045735	/nfs/dbraw/zinc/04/57/35/145045735.db2.gz	BGUGHQORWOQIFS-JKSUJKDBSA-N	0	3	321.465	2.492	10	0		DEAEHN
Cc1nc(C[C@@H]2CCCN(C[C@@H]3CC4(CCC4)C(=O)O3)C2)no1	ZINC000191991434	145068833	/nfs/dbraw/zinc/06/88/33/145068833.db2.gz	ZNZSCOQCMJXUDK-KBPBESRZSA-N	0	3	319.405	2.118	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)CSCc1cscn1	ZINC000246127439	145093143	/nfs/dbraw/zinc/09/31/43/145093143.db2.gz	QARKUCMVERVMKB-YPMHNXCESA-N	0	3	311.476	2.071	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)Cc1cccc(C)c1	ZINC000246275718	145096680	/nfs/dbraw/zinc/09/66/80/145096680.db2.gz	VGNJBEXCDAMWCV-IRXDYDNUSA-N	0	3	322.474	2.383	10	0		DEAEHN
C[C@@H]1CN([C@H]2CCc3ccc(F)cc32)C[C@@H]1N1CCOCC1	ZINC000246308379	145097767	/nfs/dbraw/zinc/09/77/67/145097767.db2.gz	CHFDVNBGGVMPGG-BVGQSLNGSA-N	0	3	304.409	2.466	10	0		DEAEHN
COc1cccc([C@@H]2C[C@H]2C(=O)N2CCN3CCC[C@H]3C2)c1	ZINC000246357437	145100261	/nfs/dbraw/zinc/10/02/61/145100261.db2.gz	OPJKOFKZTWKJEY-BHYGNILZSA-N	0	3	300.402	2.105	10	0		DEAEHN
Cc1cc(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)ccc1F	ZINC000246494558	145104222	/nfs/dbraw/zinc/10/42/22/145104222.db2.gz	XJIJKOCGFHLKOG-IUODEOHRSA-N	0	3	314.426	2.141	10	0		DEAEHN
Cc1ccccc1CCNC(=O)CN1CC[C@H]2OCCC[C@H]2C1	ZINC000246515558	145105190	/nfs/dbraw/zinc/10/51/90/145105190.db2.gz	FPINEMFUQFCQGT-ZWKOTPCHSA-N	0	3	316.445	2.155	10	0		DEAEHN
Cc1c([O-])ccc2c(CN3CC[N@@H+]4CCC[C@H]4C3)cc(=O)oc12	ZINC000246590618	145107813	/nfs/dbraw/zinc/10/78/13/145107813.db2.gz	SUVCRSLRLLWOIH-AWEZNQCLSA-N	0	3	314.385	2.087	10	0		DEAEHN
Cc1c([O-])ccc2c(CN3CC[N@H+]4CCC[C@H]4C3)cc(=O)oc12	ZINC000246590618	145107814	/nfs/dbraw/zinc/10/78/14/145107814.db2.gz	SUVCRSLRLLWOIH-AWEZNQCLSA-N	0	3	314.385	2.087	10	0		DEAEHN
CC(C)c1ccc([C@@H]2C[C@H]2C(=O)NC[C@@](C)(O)CN(C)C)cc1	ZINC000246637495	145109352	/nfs/dbraw/zinc/10/93/52/145109352.db2.gz	RXNIXUDIDGNLGW-YQVWRLOYSA-N	0	3	318.461	2.342	10	0		DEAEHN
CCc1ccc([C@H]2CCCCN2C[C@@H](O)CN2CCOCC2)o1	ZINC000246781004	145113959	/nfs/dbraw/zinc/11/39/59/145113959.db2.gz	OOQOSPVGCJNSBD-DOTOQJQBSA-N	0	3	322.449	2.062	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)N[C@H](Cc1ccccc1)C1CC1	ZINC000246804074	145115033	/nfs/dbraw/zinc/11/50/33/145115033.db2.gz	RDQDGIOYIHJAML-DLBZAZTESA-N	0	3	301.434	2.401	10	0		DEAEHN
Cc1nn(C)c(C)c1C[C@H](C)C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000246904896	145119274	/nfs/dbraw/zinc/11/92/74/145119274.db2.gz	ZKDAUBPUQCVBSF-HEHGZKQESA-N	0	3	320.481	2.157	10	0		DEAEHN
Cc1nccn1C[C@H]1CCCN1[C@H](C)C(=O)NC1CCCC1	ZINC000247108451	145126443	/nfs/dbraw/zinc/12/64/43/145126443.db2.gz	QXSBISPIFKXHFK-CZUORRHYSA-N	0	3	304.438	2.103	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1C	ZINC000247126876	145127032	/nfs/dbraw/zinc/12/70/32/145127032.db2.gz	JFTYEHIXZOKDOJ-CABCVRRESA-N	0	3	308.447	2.161	10	0		DEAEHN
C[C@H](O)CN1CCN(CCOc2ccc(Cl)cc2)C[C@H]1C	ZINC000247387390	145135477	/nfs/dbraw/zinc/13/54/77/145135477.db2.gz	WSQMTBHAPRPDSU-KGLIPLIRSA-N	0	3	312.841	2.106	10	0		DEAEHN
Cc1ccc(C)c(OCCN2CCN(C[C@H](C)O)[C@H](C)C2)c1	ZINC000247400648	145135808	/nfs/dbraw/zinc/13/58/08/145135808.db2.gz	YJFGEKHPMFBFRK-SJORKVTESA-N	0	3	306.450	2.069	10	0		DEAEHN
C[C@H](Cc1ccccc1F)NC(=O)N1CCN2CCC[C@H]2C1	ZINC000247473938	145138382	/nfs/dbraw/zinc/13/83/82/145138382.db2.gz	HPYKJBXDKFBRCC-HIFRSBDPSA-N	0	3	305.397	2.246	10	0		DEAEHN
C[C@@H]1CC[C@H](C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)O1	ZINC000248226888	145150180	/nfs/dbraw/zinc/15/01/80/145150180.db2.gz	PTFGBKQSRPMNKL-TXCZRRACSA-N	0	3	302.418	2.333	10	0		DEAEHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCc1ccccn1	ZINC000248392295	145152454	/nfs/dbraw/zinc/15/24/54/145152454.db2.gz	KEFWERQRCYYIJA-CRAIPNDOSA-N	0	3	324.428	2.401	10	0		DEAEHN
C[C@@H]1CC[C@@H](NCC(=O)N2CC(=O)Nc3ccccc32)[C@@H](C)C1	ZINC000248552319	145158747	/nfs/dbraw/zinc/15/87/47/145158747.db2.gz	JCDMWLKXTSYNKO-HZSPNIEDSA-N	0	3	315.417	2.386	10	0		DEAEHN
O[C@H](CN1CC[C@@H](CNc2ccccn2)C1)CC(F)(F)F	ZINC000248865259	145170729	/nfs/dbraw/zinc/17/07/29/145170729.db2.gz	ATRQTRLDHZSMAM-RYUDHWBXSA-N	0	3	303.328	2.129	10	0		DEAEHN
COC(=O)[C@H](C)Oc1ccc(CN2CC[C@@H](C)[C@H](OC)C2)cc1	ZINC000249259658	145181317	/nfs/dbraw/zinc/18/13/17/145181317.db2.gz	YWDCRUAWZDHZHQ-JKIFEVAISA-N	0	3	321.417	2.484	10	0		DEAEHN
CC(C)CCNC(=O)[C@@H](C)N1CC[C@@H](CNc2ccccn2)C1	ZINC000249800598	145190190	/nfs/dbraw/zinc/19/01/90/145190190.db2.gz	AAUOTJHZEUEAMH-CVEARBPZSA-N	0	3	318.465	2.366	10	0		DEAEHN
CCn1cnnc1[C@@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000249919073	145191734	/nfs/dbraw/zinc/19/17/34/145191734.db2.gz	YGRLZVJBJHJERW-SJORKVTESA-N	0	3	314.433	2.081	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc32)CC[C@@H]1C	ZINC000251704495	145196187	/nfs/dbraw/zinc/19/61/87/145196187.db2.gz	KDLWMIYWDJLIIU-PMUMKWKESA-N	0	3	318.417	2.264	10	0		DEAEHN
CO[C@@H]1CN([C@H](C)C(=O)N(C)Cc2ccccc2)CC[C@@H]1C	ZINC000252059677	145198557	/nfs/dbraw/zinc/19/85/57/145198557.db2.gz	ZQLJPTHFNGKEGJ-ZMSDIMECSA-N	0	3	304.434	2.390	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N1CCc2ccccc2C1	ZINC000261649068	145213791	/nfs/dbraw/zinc/21/37/91/145213791.db2.gz	FOKYJRXTZMWYGT-FCEWJHQRSA-N	0	3	314.429	2.104	10	0		DEAEHN
NC1(C(=O)Nc2cccc(OC3CCCC3)c2)CCOCC1	ZINC000261782314	145226000	/nfs/dbraw/zinc/22/60/00/145226000.db2.gz	HNKOTINHUQMNJD-UHFFFAOYSA-N	0	3	304.390	2.454	10	0		DEAEHN
N[C@H](C(=O)NCCc1csc2ccccc12)C1CCOCC1	ZINC000261813645	145229344	/nfs/dbraw/zinc/22/93/44/145229344.db2.gz	OXUHVMQSZHNVDN-INIZCTEOSA-N	0	3	318.442	2.314	10	0		DEAEHN
N[C@H](CC1CCCCC1)C(=O)NC[C@H]1COc2ccccc2O1	ZINC000261882778	145236836	/nfs/dbraw/zinc/23/68/36/145236836.db2.gz	MUOPOGYMKPLSDC-LSDHHAIUSA-N	0	3	318.417	2.240	10	0		DEAEHN
Cc1cc(NC(=O)[C@@H](N)C2CCOCC2)ccc1OC(C)C	ZINC000262013422	145252678	/nfs/dbraw/zinc/25/26/78/145252678.db2.gz	OFLBVDZJBOUNOR-INIZCTEOSA-N	0	3	306.406	2.475	10	0		DEAEHN
CC(=O)Nc1cccc(CN2CCNC[C@H]2c2cccnc2)c1	ZINC000262265193	145272185	/nfs/dbraw/zinc/27/21/85/145272185.db2.gz	RTOLEXWKQZTCKK-SFHVURJKSA-N	0	3	310.401	2.187	10	0		DEAEHN
CC(=O)Nc1ccc(CNC(=O)[C@H]2NCCCC2(C)C)cc1	ZINC000262489529	145287449	/nfs/dbraw/zinc/28/74/49/145287449.db2.gz	KUMICOSLSNGHEO-OAHLLOKOSA-N	0	3	303.406	2.039	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(-c2csc(C(C)(C)C)n2)n1	ZINC000263198694	145335491	/nfs/dbraw/zinc/33/54/91/145335491.db2.gz	ISWWHTAKSNICQT-JTQLQIEISA-N	0	3	307.423	2.067	10	0		DEAEHN
Cc1ccc(C(C)(C)Cc2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263226147	145338516	/nfs/dbraw/zinc/33/85/16/145338516.db2.gz	MTVUZMHZDMLIRG-HNNXBMFYSA-N	0	3	314.433	2.474	10	0		DEAEHN
Cc1ccc(C(C)(C)Cc2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263226150	145338843	/nfs/dbraw/zinc/33/88/43/145338843.db2.gz	MTVUZMHZDMLIRG-OAHLLOKOSA-N	0	3	314.433	2.474	10	0		DEAEHN
C[C@@H](NCCCS(=O)(=O)N(C)C)c1ccc(Cl)s1	ZINC000348261442	146243920	/nfs/dbraw/zinc/24/39/20/146243920.db2.gz	MHRNORSZECMQKQ-SECBINFHSA-N	0	3	310.872	2.334	10	0		DEAEHN
CC1=CCN(CCN[C@@H](C)CS(=O)(=O)c2ccccc2)CC1	ZINC000358253348	147101476	/nfs/dbraw/zinc/10/14/76/147101476.db2.gz	OMXJNDVMRVFQAR-INIZCTEOSA-N	0	3	322.474	2.090	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NCCOc1ccc(F)c(F)c1	ZINC000358864241	147220973	/nfs/dbraw/zinc/22/09/73/147220973.db2.gz	VGVJZWAERMONDF-OAHLLOKOSA-N	0	3	312.360	2.334	10	0		DEAEHN
C[C@@H](NC1CC(O)(Cc2cccc(F)c2)C1)c1ccc(=O)[nH]n1	ZINC000367611267	147774128	/nfs/dbraw/zinc/77/41/28/147774128.db2.gz	BJCFTJPRCJXULL-ACCOQDJYSA-N	0	3	317.364	2.108	10	0		DEAEHN
O=C1[C@@H](NCc2cccc3[nH]ccc32)CCN1C1CCOCC1	ZINC000371820854	148144017	/nfs/dbraw/zinc/14/40/17/148144017.db2.gz	QPCIFWBDRDPIOR-KRWDZBQOSA-N	0	3	313.401	2.037	10	0		DEAEHN
O=C(NC1CCN([C@@H]2CCOC2)CC1)c1ccoc1C1CC1	ZINC000374230136	148221009	/nfs/dbraw/zinc/22/10/09/148221009.db2.gz	MORGAUGGVFHQNY-CQSZACIVSA-N	0	3	304.390	2.140	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCOc2cccc(F)c2C1	ZINC000374813218	148292210	/nfs/dbraw/zinc/29/22/10/148292210.db2.gz	YSNGMGSQQKBBCZ-CYBMUJFWSA-N	0	3	321.396	2.214	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N[C@@H](C)c1ccc(C)o1	ZINC000111804099	401724302	/nfs/dbraw/zinc/72/43/02/401724302.db2.gz	VGTQOOZKAFPRIM-KBPBESRZSA-N	0	3	309.410	2.059	10	0		DEAEHN
CN1CCC(C(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)CC1	ZINC000074187693	401732518	/nfs/dbraw/zinc/73/25/18/401732518.db2.gz	AAPDAVKHJDBDEU-ROUUACIJSA-N	0	3	316.445	2.443	10	0		DEAEHN
C[C@H]1C[C@@H]1NC(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000112217102	401733720	/nfs/dbraw/zinc/73/37/20/401733720.db2.gz	CCZGEOXNFGLLIF-KBPBESRZSA-N	0	3	311.495	2.446	10	0		DEAEHN
CC[C@H](C)C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000112256245	401734611	/nfs/dbraw/zinc/73/46/11/401734611.db2.gz	XPMFRKSNKBMRHV-AWEZNQCLSA-N	0	3	317.433	2.497	10	0		DEAEHN
O=C(CN[C@H]1CCCC[C@@H]1n1cccn1)NC(C1CC1)C1CC1	ZINC000129089868	401799022	/nfs/dbraw/zinc/79/90/22/401799022.db2.gz	UPIBLYFFJQQDPB-HOTGVXAUSA-N	0	3	316.449	2.261	10	0		DEAEHN
OC[C@H](NCC1=CCCOC1)c1cccc(Br)c1	ZINC000127972505	401757726	/nfs/dbraw/zinc/75/77/26/401757726.db2.gz	KNYGRTPQMHTXRP-AWEZNQCLSA-N	0	3	312.207	2.419	10	0		DEAEHN
C[C@@H](Oc1ccc(F)cc1Cl)C(=O)N1CC[C@H](N(C)C)C1	ZINC000112897501	401761198	/nfs/dbraw/zinc/76/11/98/401761198.db2.gz	IWMRFMHSUHPNRU-PWSUYJOCSA-N	0	3	314.788	2.409	10	0		DEAEHN
CCN(CC)C(=O)[C@H]1CCCN1CCc1ccc2c(c1)CCO2	ZINC000075673495	401766444	/nfs/dbraw/zinc/76/64/44/401766444.db2.gz	SKUXPALTLOPYDR-QGZVFWFLSA-N	0	3	316.445	2.497	10	0		DEAEHN
Cc1noc([C@@H]2CCCN(C[C@](C)(O)c3ccccc3)C2)n1	ZINC000075827426	401769773	/nfs/dbraw/zinc/76/97/73/401769773.db2.gz	BJZUDDIHMQQKIX-PBHICJAKSA-N	0	3	301.390	2.465	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)[C@@H]1CCOc2ccccc21	ZINC000113225590	401770611	/nfs/dbraw/zinc/77/06/11/401770611.db2.gz	YECHKHWNRWYYFC-IIAWOOMASA-N	0	3	300.402	2.248	10	0		DEAEHN
COc1cccc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1OC	ZINC000113229319	401771279	/nfs/dbraw/zinc/77/12/79/401771279.db2.gz	AYKGCWKLOQRWSC-CHWSQXEVSA-N	0	3	304.390	2.013	10	0		DEAEHN
COc1cccc(CN2CC[C@@H](c3cnn(C)c3)C2)c1OC	ZINC000128459644	401778050	/nfs/dbraw/zinc/77/80/50/401778050.db2.gz	GYJVRYFUXQVFHS-CYBMUJFWSA-N	0	3	301.390	2.427	10	0		DEAEHN
Cn1cc([C@H]2CCN(Cc3c[nH]nc3-c3cccnc3)C2)cn1	ZINC000128516207	401780941	/nfs/dbraw/zinc/78/09/41/401780941.db2.gz	AMIOPNNPADJNCC-AWEZNQCLSA-N	0	3	308.389	2.195	10	0		DEAEHN
O=C(NCc1ccccc1)C1CCN(C[C@H]2CCCO2)CC1	ZINC000013047774	401796077	/nfs/dbraw/zinc/79/60/77/401796077.db2.gz	HCOOZEHUCYSGST-QGZVFWFLSA-N	0	3	302.418	2.194	10	0		DEAEHN
CC[C@@H]1CCC[C@@H](NC(=O)NC[C@@H]2CCCN2CCOC)C1	ZINC000077581498	401820981	/nfs/dbraw/zinc/82/09/81/401820981.db2.gz	PBXQEAMIDZBNNR-OAGGEKHMSA-N	0	3	311.470	2.365	10	0		DEAEHN
OCCN(C[C@H](O)COc1c(Cl)cccc1Cl)C1CC1	ZINC000077761420	401829957	/nfs/dbraw/zinc/82/99/57/401829957.db2.gz	FIRSQUIXWPWYFJ-NSHDSACASA-N	0	3	320.216	2.190	10	0		DEAEHN
CCN1CCCC[C@H]1CNC(=O)NC[C@](C)(O)CCC(C)C	ZINC000077826001	401834021	/nfs/dbraw/zinc/83/40/21/401834021.db2.gz	DMZPSZGQIMHLKT-DOTOQJQBSA-N	0	3	313.486	2.347	10	0		DEAEHN
C[C@H]1CN(C2CCN(Cc3ccccc3N(C)C)CC2)CCO1	ZINC000078048197	401838799	/nfs/dbraw/zinc/83/87/99/401838799.db2.gz	PTINTTOQFMBBTQ-INIZCTEOSA-N	0	3	317.477	2.438	10	0		DEAEHN
CN1CC[C@H](N2CCC[C@H](c3nc(-c4ccccc4)c[nH]3)C2)C1=O	ZINC000116281039	401847488	/nfs/dbraw/zinc/84/74/88/401847488.db2.gz	QNXHJKYBSBOPML-RDJZCZTQSA-N	0	3	324.428	2.487	10	0		DEAEHN
CC(C)N(C(=O)[C@@H](C)N1CC[C@H](c2cnn(C)c2)C1)C(C)C	ZINC000116321609	401850175	/nfs/dbraw/zinc/85/01/75/401850175.db2.gz	FUJAWGSEMJCQHU-CABCVRRESA-N	0	3	306.454	2.243	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@@H](CN(C)C)C1)c1ccccc1	ZINC000116786498	401859328	/nfs/dbraw/zinc/85/93/28/401859328.db2.gz	YTHBFBSBSXNGAC-DLBZAZTESA-N	0	3	304.434	2.359	10	0		DEAEHN
CCCCc1ccc(CC(=O)N2CCO[C@@H](CN(C)C)C2)cc1	ZINC000116796273	401859917	/nfs/dbraw/zinc/85/99/17/401859917.db2.gz	AZPUUSAMOCIKJF-SFHVURJKSA-N	0	3	318.461	2.361	10	0		DEAEHN
Cc1cc(C)cc([C@H](C)NC(=O)N2CCO[C@@H](CN(C)C)C2)c1	ZINC000117047456	401867602	/nfs/dbraw/zinc/86/76/02/401867602.db2.gz	AKBIHHPZVSVTTM-RDJZCZTQSA-N	0	3	319.449	2.336	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)N2CCc3ccccc3C2)C1	ZINC000132472024	401867849	/nfs/dbraw/zinc/86/78/49/401867849.db2.gz	PXJDAQNNWVUWTP-PBHICJAKSA-N	0	3	301.434	2.483	10	0		DEAEHN
Cc1c2ncn(C(=O)OC(C)(C)C)c2ccc1NC1=NCCN1	ZINC000079020927	401868935	/nfs/dbraw/zinc/86/89/35/401868935.db2.gz	KATGOYGNGBUFJI-UHFFFAOYSA-N	0	3	315.377	2.499	10	0		DEAEHN
COc1cc(CN(C[C@@H]2CCOC2)C2CC2)cc2c1OCCO2	ZINC000129944801	401812644	/nfs/dbraw/zinc/81/26/44/401812644.db2.gz	WWJFVBWMBNJULA-ZDUSSCGKSA-N	0	3	319.401	2.467	10	0		DEAEHN
CC1CCN(CCNC(=O)Nc2ccc([S@](C)=O)cc2)CC1	ZINC000080127550	401888711	/nfs/dbraw/zinc/88/87/11/401888711.db2.gz	OAUMZMJBQVGLLI-JOCHJYFZSA-N	0	3	323.462	2.277	10	0		DEAEHN
CN(C)CCN(C)C(=O)c1ccn(-c2cccc(Cl)c2)n1	ZINC000080392987	401889699	/nfs/dbraw/zinc/88/96/99/401889699.db2.gz	JCTRMYSRBBLXEF-UHFFFAOYSA-N	0	3	306.797	2.159	10	0		DEAEHN
Cc1nccn1-c1ccc([C@H](C)NC(=O)NCCN(C)C)cc1	ZINC000133849054	401895306	/nfs/dbraw/zinc/89/53/06/401895306.db2.gz	VYSJQCKVDDIYIF-ZDUSSCGKSA-N	0	3	315.421	2.103	10	0		DEAEHN
Ic1ccc(CNC2CCOCC2)o1	ZINC000037269492	401911453	/nfs/dbraw/zinc/91/14/53/401911453.db2.gz	OWNVJWKNHRLSSC-UHFFFAOYSA-N	0	3	307.131	2.153	10	0		DEAEHN
CC[C@@H](C(=O)N1CCO[C@@H](c2ccc(F)c(C)c2)C1)N(C)C	ZINC000134798561	401914888	/nfs/dbraw/zinc/91/48/88/401914888.db2.gz	OMGTUYVNUBIPHF-JKSUJKDBSA-N	0	3	308.397	2.374	10	0		DEAEHN
Cc1cc([C@H]2CN(C(=O)C3CCN(C)CC3)CCO2)ccc1F	ZINC000134862207	401917317	/nfs/dbraw/zinc/91/73/17/401917317.db2.gz	HOGRYDHINYVKII-QGZVFWFLSA-N	0	3	320.408	2.376	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)N([C@H](C)C(C)C)C1CC1	ZINC000086396077	401922731	/nfs/dbraw/zinc/92/27/31/401922731.db2.gz	RDMYTKXFIQAPBY-ZBFHGGJFSA-N	0	3	311.470	2.316	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)CSc1nncs1)c1ccccc1	ZINC000048274669	401997235	/nfs/dbraw/zinc/99/72/35/401997235.db2.gz	OPJWCRJIKSHFRS-GFCCVEGCSA-N	0	3	322.459	2.049	10	0		DEAEHN
CC(C)COc1ccc([C@H](C)NCCCS(N)(=O)=O)cc1	ZINC000045067863	401953464	/nfs/dbraw/zinc/95/34/64/401953464.db2.gz	YDWISKRZWPPLHU-ZDUSSCGKSA-N	0	3	314.451	2.051	10	0		DEAEHN
CC1CCN(CCN2CCC[C@H]2C(=O)Nc2nccs2)CC1	ZINC000119512023	401955590	/nfs/dbraw/zinc/95/55/90/401955590.db2.gz	RIDNYXQFRCSOME-AWEZNQCLSA-N	0	3	322.478	2.278	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1cccc(N2CCCC2=O)c1)N(C)C	ZINC000135959947	401956096	/nfs/dbraw/zinc/95/60/96/401956096.db2.gz	NZWDQUBAAZJUDQ-INIZCTEOSA-N	0	3	317.433	2.160	10	0		DEAEHN
C[C@H](O)CCNC(=O)NC[C@]1(C)CCCN1Cc1ccccc1	ZINC000119626542	401962180	/nfs/dbraw/zinc/96/21/80/401962180.db2.gz	STHKCUBNMCDROV-YJBOKZPZSA-N	0	3	319.449	2.111	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCc1ccccc1OCC1CC1	ZINC000119738335	401965017	/nfs/dbraw/zinc/96/50/17/401965017.db2.gz	FUHBTLJMMJKZRI-INIZCTEOSA-N	0	3	317.433	2.369	10	0		DEAEHN
CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1scnc1C1CC1	ZINC000089832601	401966907	/nfs/dbraw/zinc/96/69/07/401966907.db2.gz	VBZJOUVXTIYTGM-ZDUSSCGKSA-N	0	3	323.462	2.203	10	0		DEAEHN
CN(CCCN1CCN(C)CC1)C(=O)[C@H]1C[C@@H]1C1CCCCC1	ZINC000119900125	401970692	/nfs/dbraw/zinc/97/06/92/401970692.db2.gz	YJDZKTNGSVZAFI-MSOLQXFVSA-N	0	3	321.509	2.299	10	0		DEAEHN
C[C@H](NC(=O)N[C@@H](CN(C)C)c1ccccc1)[C@H]1CCCO1	ZINC000048216767	401996007	/nfs/dbraw/zinc/99/60/07/401996007.db2.gz	RULWYCXZOKAJQD-CWRNSKLLSA-N	0	3	305.422	2.156	10	0		DEAEHN
CSc1ccccc1NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000043317524	401938578	/nfs/dbraw/zinc/93/85/78/401938578.db2.gz	MDKIRHUIHDYNIU-ZDUSSCGKSA-N	0	3	323.462	2.377	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H](C)N1CCc2ccccc2C1)N(C)C	ZINC000135516319	401943236	/nfs/dbraw/zinc/94/32/36/401943236.db2.gz	HXFJGDITFWWHQD-CRAIPNDOSA-N	0	3	317.477	2.280	10	0		DEAEHN
CCn1nc(C)c(NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1C	ZINC000089480798	401949637	/nfs/dbraw/zinc/94/96/37/401949637.db2.gz	NLWUJOVRPIDZFI-RISCZKNCSA-N	0	3	307.442	2.466	10	0		DEAEHN
C[C@H](C(=O)NC1CCCC1)N1CCN(C[C@H]2CC=CCC2)CC1	ZINC000093077594	402011255	/nfs/dbraw/zinc/01/12/55/402011255.db2.gz	MHOPZASNJAVUJV-SJORKVTESA-N	0	3	319.493	2.408	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@@H](C)NCCCN1CCOCC1	ZINC000151172384	402021583	/nfs/dbraw/zinc/02/15/83/402021583.db2.gz	RNMNFYGMTPRPPJ-CQSZACIVSA-N	0	3	308.470	2.319	10	0		DEAEHN
CC(C)C1CCC(NC(=O)N2CCO[C@@H](CN(C)C)C2)CC1	ZINC000121290288	402026099	/nfs/dbraw/zinc/02/60/99/402026099.db2.gz	ZQJTZCHZQPJSNF-GPANFISMSA-N	0	3	311.470	2.173	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CC[C@H]2OCCC[C@@H]2C1	ZINC000151274501	402027600	/nfs/dbraw/zinc/02/76/00/402027600.db2.gz	AGKHKUVDLRWLGU-BZUAXINKSA-N	0	3	311.470	2.173	10	0		DEAEHN
CC(C)[C@@H](CO)N(Cc1ccccc1)C[C@H](O)C(F)(F)F	ZINC000121435793	402035453	/nfs/dbraw/zinc/03/54/53/402035453.db2.gz	WVMOPILJSDRPME-KGLIPLIRSA-N	0	3	305.340	2.429	10	0		DEAEHN
CCOc1cccc(CNC(=O)N[C@@H]2CCCN(CC)C2)c1	ZINC000052523999	402043791	/nfs/dbraw/zinc/04/37/91/402043791.db2.gz	ZYTAJJKEYRAROS-OAHLLOKOSA-N	0	3	305.422	2.369	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H](C)Oc1ccc(OC)cc1)N(C)C	ZINC000121666846	402048388	/nfs/dbraw/zinc/04/83/88/402048388.db2.gz	KYRYSWCOWFSUGR-CZUORRHYSA-N	0	3	308.422	2.309	10	0		DEAEHN
Fc1ccc2oc(CN3CC[C@H](CN4CCOCC4)C3)nc2c1	ZINC000151686757	402050902	/nfs/dbraw/zinc/05/09/02/402050902.db2.gz	VCJUYKJPRSBQLP-CYBMUJFWSA-N	0	3	319.380	2.121	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCC2(c3ccc(F)cc3F)CC2)C1	ZINC000120860099	402004442	/nfs/dbraw/zinc/00/44/42/402004442.db2.gz	WVXZYUBLWQLZRU-CYBMUJFWSA-N	0	3	323.387	2.342	10	0		DEAEHN
COc1ccc([C@@H](NCc2cnnn2C)C2CCOCC2)cc1	ZINC000092852790	402009672	/nfs/dbraw/zinc/00/96/72/402009672.db2.gz	WAWXTDOEGSPAAF-QGZVFWFLSA-N	0	3	316.405	2.081	10	0		DEAEHN
C[C@@H]1CCCC[C@@H]1OCCNC(=O)N1CCCN(C2CC2)CC1	ZINC000057777159	402096883	/nfs/dbraw/zinc/09/68/83/402096883.db2.gz	CIPCDMIVPLZEFE-WBVHZDCISA-N	0	3	323.481	2.461	10	0		DEAEHN
Cc1ccc(OC[C@H](O)CN2CCCN(C3CC3)CC2)c(C)c1	ZINC000061041168	402106992	/nfs/dbraw/zinc/10/69/92/402106992.db2.gz	LUSXVXIENSNWDS-GOSISDBHSA-N	0	3	318.461	2.213	10	0		DEAEHN
CCOC(=O)c1cnc2cc(C)cc(C)c2c1N1CCNCC1	ZINC000053994921	402061243	/nfs/dbraw/zinc/06/12/43/402061243.db2.gz	GCNVOGOQIIKMCX-UHFFFAOYSA-N	0	3	313.401	2.438	10	0		DEAEHN
COc1ccc(O)c(C(=O)N[C@@H](CN(C)C)c2ccccc2)c1	ZINC000123460407	402129148	/nfs/dbraw/zinc/12/91/48/402129148.db2.gz	MFGZPGSGSXOPIW-INIZCTEOSA-N	0	3	314.385	2.434	10	0		DEAEHN
C[C@H](C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1)c1cccnc1	ZINC000123527630	402132322	/nfs/dbraw/zinc/13/23/22/402132322.db2.gz	QSCQBFFWPFXDNB-OAGGEKHMSA-N	0	3	319.449	2.191	10	0		DEAEHN
CC[C@](C)(O)CN1CCCN(C(=O)CCc2ccccc2)CC1	ZINC000123641546	402139802	/nfs/dbraw/zinc/13/98/02/402139802.db2.gz	ZDBJDCLTBMPLQC-IBGZPJMESA-N	0	3	318.461	2.315	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)CCOCc2ccccc2)C1	ZINC000123352755	402123483	/nfs/dbraw/zinc/12/34/83/402123483.db2.gz	POZZTNKIOVMHNJ-KRWDZBQOSA-N	0	3	319.449	2.329	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)CSC[C@@H]2CCCCO2)CCN1C	ZINC000123764771	402145140	/nfs/dbraw/zinc/14/51/40/402145140.db2.gz	PNPONEWIJXXZAI-KFWWJZLASA-N	0	3	314.495	2.230	10	0		DEAEHN
CCC(O)(CC)CNC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000124908673	402203149	/nfs/dbraw/zinc/20/31/49/402203149.db2.gz	XPZALJFJVDFPIG-INIZCTEOSA-N	0	3	321.465	2.010	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCCNc2ccccc2)C1	ZINC000067631997	402165987	/nfs/dbraw/zinc/16/59/87/402165987.db2.gz	VUAIZFAMTMFWHO-MRXNPFEDSA-N	0	3	304.438	2.272	10	0		DEAEHN
COc1cc(OC)cc(N2CC[C@H](CNCc3ncc[nH]3)C2)c1	ZINC000153781077	402170524	/nfs/dbraw/zinc/17/05/24/402170524.db2.gz	GZQJTTDFJKYYAY-CYBMUJFWSA-N	0	3	316.405	2.043	10	0		DEAEHN
COc1ccc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c(OC)c1	ZINC000124277503	402172687	/nfs/dbraw/zinc/17/26/87/402172687.db2.gz	WGGMXOFHDBGNDW-OLZOCXBDSA-N	0	3	306.406	2.259	10	0		DEAEHN
CCOC(CN1CCC[C@@H](c2nncn2C2CC2)C1)OCC	ZINC000125118579	402213775	/nfs/dbraw/zinc/21/37/75/402213775.db2.gz	AVVNBANIQTZOGE-CYBMUJFWSA-N	0	3	308.426	2.192	10	0		DEAEHN
COc1ccc(CNC(=O)CN(CCCO)CC(C)(C)C)cc1	ZINC000106934627	402223385	/nfs/dbraw/zinc/22/33/85/402223385.db2.gz	KCBRUOFUHZZJNW-UHFFFAOYSA-N	0	3	322.449	2.042	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1ccc(-c2ncon2)cc1	ZINC000107230756	402228072	/nfs/dbraw/zinc/22/80/72/402228072.db2.gz	QQKUDVYYEKKLHJ-OAHLLOKOSA-N	0	3	316.405	2.443	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC[C@@]2(CCO)CCOC2)c1	ZINC000125480805	402235050	/nfs/dbraw/zinc/23/50/50/402235050.db2.gz	LRWXQPSYGHFMOI-SUMWQHHRSA-N	0	3	309.406	2.144	10	0		DEAEHN
CN(C)C[C@H]1CN(c2nc(-c3cccc(Cl)c3)no2)CCO1	ZINC000108952108	402265091	/nfs/dbraw/zinc/26/50/91/402265091.db2.gz	GOHRJMMSULMVSA-ZDUSSCGKSA-N	0	3	322.796	2.157	10	0		DEAEHN
COc1cccc([C@@H]2C[C@H](O)CN2Cc2ccc(CO)cc2)c1	ZINC000225731105	402322789	/nfs/dbraw/zinc/32/27/89/402322789.db2.gz	QZCKZBWTPSLQBI-HKUYNNGSSA-N	0	3	313.397	2.495	10	0		DEAEHN
CC[C@H](C)Oc1ccc(C(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000176608602	402323143	/nfs/dbraw/zinc/32/31/43/402323143.db2.gz	DCHKTQHQSKUVHE-WMLDXEAASA-N	0	3	320.433	2.267	10	0		DEAEHN
COc1ccc([C@@H](C)CC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000176282038	402296867	/nfs/dbraw/zinc/29/68/67/402296867.db2.gz	BRGQQHPIHYECBT-GOEBONIOSA-N	0	3	302.418	2.495	10	0		DEAEHN
Cc1nc([C@H](N[C@H](C)CCn2cccn2)c2ccccc2)n[nH]1	ZINC000158809487	402312561	/nfs/dbraw/zinc/31/25/61/402312561.db2.gz	YDUVCUQLUWUEJV-CZUORRHYSA-N	0	3	310.405	2.467	10	0		DEAEHN
CC(C)[C@@H]1OCCC[C@H]1CNC(=O)N1CCCN(C2CC2)CC1	ZINC000176826255	402341077	/nfs/dbraw/zinc/34/10/77/402341077.db2.gz	KGDDPTIHJGWYQV-RDJZCZTQSA-N	0	3	323.481	2.317	10	0		DEAEHN
CNC(=O)CCN(C)Cc1ccc(SC(=O)N(C)C)cc1	ZINC000176913483	402349970	/nfs/dbraw/zinc/34/99/70/402349970.db2.gz	ULFGJEVOIWTPFN-UHFFFAOYSA-N	0	3	309.435	2.028	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cc2ccccc2[nH]c1=O	ZINC000177008194	402358769	/nfs/dbraw/zinc/35/87/69/402358769.db2.gz	BSPSILRITDWPQH-CQSZACIVSA-N	0	3	313.401	2.084	10	0		DEAEHN
CC(C)[C@H](C)CC(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000176674924	402327778	/nfs/dbraw/zinc/32/77/78/402327778.db2.gz	SEWWSQUYAUVKTR-IAGOWNOFSA-N	0	3	309.498	2.297	10	0		DEAEHN
COc1ccc(C[C@@H](C)CN2CCO[C@H](CN(C)C)C2)cc1F	ZINC000185233042	402337208	/nfs/dbraw/zinc/33/72/08/402337208.db2.gz	LAWNXUJGOYIKTD-GDBMZVCRSA-N	0	3	324.440	2.275	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)Nc1cccn(Cc2ccccc2)c1=O	ZINC000161870112	402401748	/nfs/dbraw/zinc/40/17/48/402401748.db2.gz	KUXGOBDKODEUBE-XJKSGUPXSA-N	0	3	313.401	2.209	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)Nc1ccc([S@](C)=O)cc1	ZINC000177457790	402404488	/nfs/dbraw/zinc/40/44/88/402404488.db2.gz	XAUMTIOJEMULBY-DMZKTXOQSA-N	0	3	323.462	2.420	10	0		DEAEHN
COc1cccc2c1CC[C@@H]2NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000177625561	402421365	/nfs/dbraw/zinc/42/13/65/402421365.db2.gz	PPERMVUMPGLNKC-CJNGLKHVSA-N	0	3	315.417	2.172	10	0		DEAEHN
CCSCc1cc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)no1	ZINC000186374095	402426137	/nfs/dbraw/zinc/42/61/37/402426137.db2.gz	RSTJLCPHXMSPAG-FZMZJTMJSA-N	0	3	311.451	2.386	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)[C@@H]1CCN(c2ccccc2F)C1=O	ZINC000177714899	402429416	/nfs/dbraw/zinc/42/94/16/402429416.db2.gz	XMXXABFTCUFXGN-RHSMWYFYSA-N	0	3	319.424	2.347	10	0		DEAEHN
Cc1ccc(OC[C@H](O)CN2CCN3CCCC[C@@H]3C2)c(C)c1	ZINC000177765715	402434242	/nfs/dbraw/zinc/43/42/42/402434242.db2.gz	DSNCTBSWERTCTO-QZTJIDSGSA-N	0	3	318.461	2.213	10	0		DEAEHN
COC(=O)[C@@H](c1ccccc1F)N1CCN2CCCC[C@@H]2C1	ZINC000177778632	402435279	/nfs/dbraw/zinc/43/52/79/402435279.db2.gz	MHKDBKKQTNZPRR-CZUORRHYSA-N	0	3	306.381	2.210	10	0		DEAEHN
CC(C)[C@H](C)NC(=O)CN[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000163078151	402440772	/nfs/dbraw/zinc/44/07/72/402440772.db2.gz	ZRQQVLOYMKNNNE-UONOGXRCSA-N	0	3	315.421	2.079	10	0		DEAEHN
C[C@H](NC(=O)N1CCC[C@H](N(C)C)C1)[C@@H]1COc2ccccc21	ZINC000163569385	402452741	/nfs/dbraw/zinc/45/27/41/402452741.db2.gz	VZOHDIOPKZXRMI-DZKIICNBSA-N	0	3	317.433	2.287	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)CSC[C@H]1CCCCO1	ZINC000245398801	402455713	/nfs/dbraw/zinc/45/57/13/402455713.db2.gz	UOMGNKXACANRCN-LSDHHAIUSA-N	0	3	314.495	2.279	10	0		DEAEHN
CCO[C@H]1C[C@@](N)(C(=O)N(C)Cc2ccc(F)cc2)C1(C)C	ZINC000186706560	402457886	/nfs/dbraw/zinc/45/78/86/402457886.db2.gz	YAGZTUKXVIVYJX-WMLDXEAASA-N	0	3	308.397	2.317	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)N[C@H](COC)c1ccccc1	ZINC000245468313	402464074	/nfs/dbraw/zinc/46/40/74/402464074.db2.gz	KOQKWWQUYONUTH-DLBZAZTESA-N	0	3	319.449	2.500	10	0		DEAEHN
CCCN(CCC)C(=O)CN1CCC[C@H]1Cn1ccnc1C	ZINC000178293463	402481206	/nfs/dbraw/zinc/48/12/06/402481206.db2.gz	QPPOUEVLFHNFPO-INIZCTEOSA-N	0	3	306.454	2.305	10	0		DEAEHN
CC[C@@H](N[C@H](C)C1CCS(=O)(=O)CC1)c1nccs1	ZINC000187228189	402488962	/nfs/dbraw/zinc/48/89/62/402488962.db2.gz	LJORHNJYCVMYRD-ZYHUDNBSSA-N	0	3	302.465	2.397	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cc(C)oc1C	ZINC000245850985	402490945	/nfs/dbraw/zinc/49/09/45/402490945.db2.gz	GJEXGOOFYCHSHW-KBPBESRZSA-N	0	3	312.435	2.144	10	0		DEAEHN
CCN(C)[C@H](C(=O)N[C@H]1CCCN(CC)C1)c1ccccc1	ZINC000245852679	402491084	/nfs/dbraw/zinc/49/10/84/402491084.db2.gz	MVWKJANQQVDEEC-IRXDYDNUSA-N	0	3	303.450	2.280	10	0		DEAEHN
Cc1cccc(S(=O)(=O)CCCN2CCC(N(C)C)CC2)c1	ZINC000167756253	402493632	/nfs/dbraw/zinc/49/36/32/402493632.db2.gz	ZCHFCYVZLQCSJF-UHFFFAOYSA-N	0	3	324.490	2.185	10	0		DEAEHN
COc1ccc(C(F)(F)C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1	ZINC000245930433	402498147	/nfs/dbraw/zinc/49/81/47/402498147.db2.gz	QKJMRCPBVZVWIB-JSGCOSHPSA-N	0	3	324.371	2.482	10	0		DEAEHN
O=C(NCC1(Cc2ccccc2)CC1)N1CCN2CCC[C@H]2C1	ZINC000178455092	402500781	/nfs/dbraw/zinc/50/07/81/402500781.db2.gz	ANYGRORQCRJJAQ-KRWDZBQOSA-N	0	3	313.445	2.499	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCCC[C@H]1c1cn[nH]c1	ZINC000245977327	402501476	/nfs/dbraw/zinc/50/14/76/402501476.db2.gz	OVMZPZMHYYVUNH-GJZGRUSLSA-N	0	3	305.426	2.131	10	0		DEAEHN
C[C@@H]1CC[C@](CO)(N(C)CC(=O)NCCC2=CCCCC2)C1	ZINC000187968050	402514115	/nfs/dbraw/zinc/51/41/15/402514115.db2.gz	UXQKZTYOLMOLQO-QAPCUYQASA-N	0	3	308.466	2.476	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1	ZINC000187501532	402503248	/nfs/dbraw/zinc/50/32/48/402503248.db2.gz	FZHQXEPTKDSTFH-IHRRRGAJSA-N	0	3	320.437	2.275	10	0		DEAEHN
C[C@H](C(=O)NC(=O)NCC(F)(F)F)N1CC[C@@H](C)C[C@H](C)C1	ZINC000246884923	402548356	/nfs/dbraw/zinc/54/83/56/402548356.db2.gz	WZGPLDQVBXXPAN-OUAUKWLOSA-N	0	3	323.359	2.131	10	0		DEAEHN
COCCOc1cc(C)ccc1NC(=O)N1CC[C@H](N(C)C)C1	ZINC000171079143	402555114	/nfs/dbraw/zinc/55/51/14/402555114.db2.gz	DIAVUQHDFNSMSL-AWEZNQCLSA-N	0	3	321.421	2.188	10	0		DEAEHN
COc1ccc(CC[C@H](C)NC(=O)NC[C@@H]2CCCN2C)cc1	ZINC000171193558	402566049	/nfs/dbraw/zinc/56/60/49/402566049.db2.gz	FFKGWIBRQRROFT-HOCLYGCPSA-N	0	3	319.449	2.410	10	0		DEAEHN
CCN(CCNC(=O)N1CCC[C@H](C(F)(F)F)C1)C1CC1	ZINC000171252344	402571789	/nfs/dbraw/zinc/57/17/89/402571789.db2.gz	KOCLWZDIVLWMNR-NSHDSACASA-N	0	3	307.360	2.455	10	0		DEAEHN
CC(C)c1ccccc1OC[C@@H](O)CN(C)CC1(CO)CC1	ZINC000190041685	402572696	/nfs/dbraw/zinc/57/26/96/402572696.db2.gz	HTVQDDJPGQVHPR-HNNXBMFYSA-N	0	3	307.434	2.254	10	0		DEAEHN
COc1ccc(COC[C@H](O)CN2CCS[C@@H](C)C2)cc1	ZINC000246182107	402515932	/nfs/dbraw/zinc/51/59/32/402515932.db2.gz	UWYOYXAAIUNXAL-DZGCQCFKSA-N	0	3	311.447	2.010	10	0		DEAEHN
COc1ccc(C)cc1NC(=O)[C@@H](C)N1CCN2CCC[C@@H]2C1	ZINC000178630069	402519840	/nfs/dbraw/zinc/51/98/40/402519840.db2.gz	IMVKDRDQPRAORX-HUUCEWRRSA-N	0	3	317.433	2.111	10	0		DEAEHN
C[C@@H](NCC1(O)CCOCC1)c1cccc(N2CCCC2=O)c1	ZINC000178636862	402520082	/nfs/dbraw/zinc/52/00/82/402520082.db2.gz	YGHGTXWDPFZCDG-CQSZACIVSA-N	0	3	318.417	2.006	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](N[C@H](C(=O)N(C)C)c2ccccc2)C1	ZINC000246264549	402522010	/nfs/dbraw/zinc/52/20/10/402522010.db2.gz	RJFAEWQZLQIZMM-OIISXLGYSA-N	0	3	303.450	2.134	10	0		DEAEHN
CCC[C@H](C(=O)N1CCO[C@H](c2cccc(F)c2)C1)N(C)C	ZINC000178656512	402522405	/nfs/dbraw/zinc/52/24/05/402522405.db2.gz	GKNTWTZXFFDZPK-CVEARBPZSA-N	0	3	308.397	2.456	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@H]1[C@H](C)CCC[C@@H]1C	ZINC000246277778	402522974	/nfs/dbraw/zinc/52/29/74/402522974.db2.gz	WNUXLICGJAWUCJ-QXSJWSMHSA-N	0	3	311.470	2.221	10	0		DEAEHN
C[C@@H](OCCCNC(=O)N1CC[C@H](N(C)C)C1)c1ccccc1	ZINC000170826971	402529987	/nfs/dbraw/zinc/52/99/87/402529987.db2.gz	DLXLAZCPOOLRNG-WBVHZDCISA-N	0	3	319.449	2.500	10	0		DEAEHN
CCCCc1ccc(NC(=O)C(=O)N2CC[C@H](N(C)C)C2)cc1	ZINC000170845303	402531913	/nfs/dbraw/zinc/53/19/13/402531913.db2.gz	KLLOPUFUYTWXFI-INIZCTEOSA-N	0	3	317.433	2.130	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NC[C@H](O)C1CCCCC1	ZINC000170840177	402532009	/nfs/dbraw/zinc/53/20/09/402532009.db2.gz	YQUJCJSZPDCVBY-CVEARBPZSA-N	0	3	313.486	2.203	10	0		DEAEHN
Cc1oc(-c2ccccc2)nc1CC(=O)N1CC[C@H](N(C)C)C1	ZINC000170856472	402533376	/nfs/dbraw/zinc/53/33/76/402533376.db2.gz	MFANESJLWKTPMZ-HNNXBMFYSA-N	0	3	313.401	2.355	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2nn(-c3ccccc3)c3c2CCC3)C1	ZINC000170856902	402533719	/nfs/dbraw/zinc/53/37/19/402533719.db2.gz	BPTQBQDKXBAZSL-OAHLLOKOSA-N	0	3	324.428	2.137	10	0		DEAEHN
Cc1nn(CC(C)C)c(C)c1CCC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170858601	402533756	/nfs/dbraw/zinc/53/37/56/402533756.db2.gz	ZRVMUHCMQBSYLH-MRXNPFEDSA-N	0	3	320.481	2.251	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1[C@H](C)NCCN1CCO[C@H](C)C1	ZINC000178767787	402537115	/nfs/dbraw/zinc/53/71/15/402537115.db2.gz	QMFLXJPXGXEYLN-KGLIPLIRSA-N	0	3	308.470	2.318	10	0		DEAEHN
CCN(C)[C@@H](C(=O)N[C@@H]1CCCN(CC)C1)c1ccccc1	ZINC000171479453	402589301	/nfs/dbraw/zinc/58/93/01/402589301.db2.gz	MVWKJANQQVDEEC-IAGOWNOFSA-N	0	3	303.450	2.280	10	0		DEAEHN
Cc1ccc(-c2cc(C(=O)N3CCN4CCC[C@H]4C3)[nH]n2)cc1	ZINC000171585635	402597714	/nfs/dbraw/zinc/59/77/14/402597714.db2.gz	LEDMWPXBHYCMAD-HNNXBMFYSA-N	0	3	310.401	2.305	10	0		DEAEHN
COCCOc1ccccc1CN1CCCN(C2CC2)CC1	ZINC000179732311	402598921	/nfs/dbraw/zinc/59/89/21/402598921.db2.gz	MARHOWBPJBMRPQ-UHFFFAOYSA-N	0	3	304.434	2.382	10	0		DEAEHN
Cc1csc2c1ncnc2N1CCN(CC(C)(C)O)C[C@H]1C	ZINC000248670939	402602995	/nfs/dbraw/zinc/60/29/95/402602995.db2.gz	SQJQQFJCHHZWOL-GFCCVEGCSA-N	0	3	320.462	2.281	10	0		DEAEHN
COC(=O)c1ccccc1OCCN1[C@H](C)C[C@@H](O)C[C@@H]1C	ZINC000248735863	402606044	/nfs/dbraw/zinc/60/60/44/402606044.db2.gz	BUYZTFIBOCJVIZ-BTTYYORXSA-N	0	3	307.390	2.086	10	0		DEAEHN
COc1ccccc1CN(CCO)C[C@H](O)CC1CCCC1	ZINC000190511851	402606882	/nfs/dbraw/zinc/60/68/82/402606882.db2.gz	QMSPKPIUNKPUEN-QGZVFWFLSA-N	0	3	307.434	2.431	10	0		DEAEHN
CCN(CC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)C1CC1	ZINC000180169061	402608794	/nfs/dbraw/zinc/60/87/94/402608794.db2.gz	XQQYFKKXCTWFTE-FUHWJXTLSA-N	0	3	301.434	2.032	10	0		DEAEHN
Cc1ccc([C@H](CNC(=O)[C@H]2CCOC[C@H]2C)N(C)C)cc1	ZINC000248838944	402610631	/nfs/dbraw/zinc/61/06/31/402610631.db2.gz	PMUROGIIBRWQBQ-PVAVHDDUSA-N	0	3	304.434	2.387	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@H]2CCCc3c(O)cccc32)C1	ZINC000248920589	402614808	/nfs/dbraw/zinc/61/48/08/402614808.db2.gz	WDFJXZZMEPHUPL-CJNGLKHVSA-N	0	3	302.418	2.413	10	0		DEAEHN
CCCCOCC(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190632310	402614910	/nfs/dbraw/zinc/61/49/10/402614910.db2.gz	WDKGULIXRKUACJ-KRWDZBQOSA-N	0	3	319.449	2.179	10	0		DEAEHN
COc1cccc(Cl)c1CNC(=O)N1CC[C@@H](N(C)C)C1	ZINC000190746003	402621154	/nfs/dbraw/zinc/62/11/54/402621154.db2.gz	UITZQYYUELFQOK-LLVKDONJSA-N	0	3	311.813	2.194	10	0		DEAEHN
CCCNC(=O)[C@@H](C)N[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000180660318	402622799	/nfs/dbraw/zinc/62/27/99/402622799.db2.gz	UEGUCJOCKAJBNI-UONOGXRCSA-N	0	3	300.406	2.438	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cnc(C(C)(C)C)nc2)C1	ZINC000171318450	402577565	/nfs/dbraw/zinc/57/75/65/402577565.db2.gz	OMNMBDSWOMQSBY-LBPRGKRZSA-N	0	3	305.426	2.380	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCN2CCC[C@@H]2C1)N(C)c1ccccc1	ZINC000171900888	402632568	/nfs/dbraw/zinc/63/25/68/402632568.db2.gz	AJBZHONDXWZRAQ-DOTOQJQBSA-N	0	3	316.449	2.001	10	0		DEAEHN
Cc1cc(C)cc(OCCCN2CCN(CCO)[C@@H](C)C2)c1	ZINC000249588764	402635550	/nfs/dbraw/zinc/63/55/50/402635550.db2.gz	UTBWTPQFEXRLSV-KRWDZBQOSA-N	0	3	306.450	2.071	10	0		DEAEHN
Cc1cccc(CNC(=O)NC[C@H](C)N2CCC[C@@H](C)C2)n1	ZINC000249614026	402636917	/nfs/dbraw/zinc/63/69/17/402636917.db2.gz	WXBNGGKUEUFGFS-HIFRSBDPSA-N	0	3	304.438	2.310	10	0		DEAEHN
Cc1ccccc1OCCCNC(=O)N1CCN2CCC[C@H]2C1	ZINC000171907391	402633020	/nfs/dbraw/zinc/63/30/20/402633020.db2.gz	QUOLAXMRSBVSFQ-INIZCTEOSA-N	0	3	317.433	2.254	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc2c(c1)OCCCO2	ZINC000172060405	402638760	/nfs/dbraw/zinc/63/87/60/402638760.db2.gz	IWEPYBRWNZDQID-DZGCQCFKSA-N	0	3	316.401	2.157	10	0		DEAEHN
CCc1ccc(NC(=O)N2CCO[C@H](CN(C)C)C2)cc1F	ZINC000181281713	402639499	/nfs/dbraw/zinc/63/94/99/402639499.db2.gz	HLSSERUMLWSKGT-CQSZACIVSA-N	0	3	309.385	2.182	10	0		DEAEHN
CCN1CCN(C(=O)[C@@H](C)N[C@H](C)c2ccc(C)c(F)c2)CC1	ZINC000181347107	402642150	/nfs/dbraw/zinc/64/21/50/402642150.db2.gz	OMLQWGLJYLYHIN-HUUCEWRRSA-N	0	3	321.440	2.337	10	0		DEAEHN
CCc1oc2ccccc2c1CN1CCN(CCO)[C@@H](C)C1	ZINC000250115677	402644773	/nfs/dbraw/zinc/64/47/73/402644773.db2.gz	ULAPTOPPOYRFOK-AWEZNQCLSA-N	0	3	302.418	2.494	10	0		DEAEHN
C[C@H]1CC(O)C[C@H](C)N1CCOCC(F)(F)C(F)(F)F	ZINC000191168371	402647475	/nfs/dbraw/zinc/64/74/75/402647475.db2.gz	UGIXCLCSVUCCNH-IUCAKERBSA-N	0	3	305.287	2.434	10	0		DEAEHN
CCOc1c(Cl)cccc1CC(=O)N1CC[C@@H](N(C)C)C1	ZINC000191183995	402649247	/nfs/dbraw/zinc/64/92/47/402649247.db2.gz	DIZYZAMCZANJEM-CYBMUJFWSA-N	0	3	310.825	2.444	10	0		DEAEHN
Cc1ccc(OC2CCN(C[C@H](O)COC(C)(C)C)CC2)nc1	ZINC000181554475	402649769	/nfs/dbraw/zinc/64/97/69/402649769.db2.gz	LBURTFFXNFDRLF-HNNXBMFYSA-N	0	3	322.449	2.409	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1ccn([C@H](C)COC)n1	ZINC000251847628	402649949	/nfs/dbraw/zinc/64/99/49/402649949.db2.gz	PJKKODIEZAMPIG-KGLIPLIRSA-N	0	3	323.441	2.039	10	0		DEAEHN
COCCCN(C)CCNC(=O)N1CCC(C(C)(C)C)CC1	ZINC000173585873	402704131	/nfs/dbraw/zinc/70/41/31/402704131.db2.gz	KXDGQJDEUUOEFK-UHFFFAOYSA-N	0	3	313.486	2.422	10	0		DEAEHN
CCCC[C@@H](COC)N[C@@H]1CCCN(c2cc(C)nn2C)C1=O	ZINC000182352473	402682963	/nfs/dbraw/zinc/68/29/63/402682963.db2.gz	YFPDIUCHTSEGOU-LSDHHAIUSA-N	0	3	322.453	2.019	10	0		DEAEHN
COCc1ccsc1C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000182553791	402698970	/nfs/dbraw/zinc/69/89/70/402698970.db2.gz	PPJOAXBEKLHMKG-TZMCWYRMSA-N	0	3	308.447	2.451	10	0		DEAEHN
C[C@H](N[C@H]1CCN(Cc2ccccn2)C[C@H]1C)c1nccn1C	ZINC000182982545	402730853	/nfs/dbraw/zinc/73/08/53/402730853.db2.gz	UQEYEYZFTTVHQV-VYDXJSESSA-N	0	3	313.449	2.376	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@@H](C)Oc2cccc(F)c2)C1	ZINC000174233982	402732635	/nfs/dbraw/zinc/73/26/35/402732635.db2.gz	WZUZOGPLPPIJDN-UKRRQHHQSA-N	0	3	323.412	2.377	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@@H](C)Oc2cccc(F)c2)C1	ZINC000174233962	402732889	/nfs/dbraw/zinc/73/28/89/402732889.db2.gz	WZUZOGPLPPIJDN-HIFRSBDPSA-N	0	3	323.412	2.377	10	0		DEAEHN
CN(C)CCOc1cc(C(=O)NCCc2ccsc2)ccn1	ZINC000183111338	402739342	/nfs/dbraw/zinc/73/93/42/402739342.db2.gz	PVJQQUOBFZTOTE-UHFFFAOYSA-N	0	3	319.430	2.056	10	0		DEAEHN
CCCNc1ccc(CNC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000192604358	402739849	/nfs/dbraw/zinc/73/98/49/402739849.db2.gz	LKZKETNRDGWFQH-KRWDZBQOSA-N	0	3	316.449	2.498	10	0		DEAEHN
C[C@H](NCC(=O)N(Cc1ccccc1)C1CC1)[C@H]1CCCO1	ZINC000183174766	402744263	/nfs/dbraw/zinc/74/42/63/402744263.db2.gz	IUTBZZXTCBNGIT-WMLDXEAASA-N	0	3	302.418	2.335	10	0		DEAEHN
C[C@@H](C(=O)OC(C)(C)C)N(C)C(=O)C1CCN(C2CC2)CC1	ZINC000192715764	402745825	/nfs/dbraw/zinc/74/58/25/402745825.db2.gz	MMEPCXNATLOULO-LBPRGKRZSA-N	0	3	310.438	2.049	10	0		DEAEHN
Cc1cc(-c2nc([C@@H]3CNCCN3C)no2)c(C)n1C1CC1	ZINC000263236964	402749126	/nfs/dbraw/zinc/74/91/26/402749126.db2.gz	OEIOFAFHWMRNOX-AWEZNQCLSA-N	0	3	301.394	2.066	10	0		DEAEHN
C[C@H](c1nc([C@H]2CNCCN2C)no1)c1cccc(Cl)c1	ZINC000263303493	402756493	/nfs/dbraw/zinc/75/64/93/402756493.db2.gz	XLNLRHZZWFEXQJ-GXFFZTMASA-N	0	3	306.797	2.451	10	0		DEAEHN
CCOc1ncccc1NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000175071779	402776287	/nfs/dbraw/zinc/77/62/87/402776287.db2.gz	BSEHYMNDTZAWBN-CHWSQXEVSA-N	0	3	306.410	2.427	10	0		DEAEHN
CN(C(=O)c1cnn(CCC(F)(F)F)c1)[C@@H]1CCCN(C)C1	ZINC000182870450	402723144	/nfs/dbraw/zinc/72/31/44/402723144.db2.gz	KBZRVVYBFVRFIT-GFCCVEGCSA-N	0	3	318.343	2.002	10	0		DEAEHN
CC(C)C(=O)Nc1ccc(C(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000195330017	402842076	/nfs/dbraw/zinc/84/20/76/402842076.db2.gz	LAYIJAFGQPOBLE-INIZCTEOSA-N	0	3	315.417	2.201	10	0		DEAEHN
O=C(CCCOc1ccccc1F)N1CCN2CCC[C@H]2C1	ZINC000195336860	402842488	/nfs/dbraw/zinc/84/24/88/402842488.db2.gz	OTZHUGCFSBYELO-AWEZNQCLSA-N	0	3	306.381	2.291	10	0		DEAEHN
CCCCOC(=O)CCN1CCCN(c2ccccn2)CC1	ZINC000183818510	402800368	/nfs/dbraw/zinc/80/03/68/402800368.db2.gz	WMSVCDTYPWDGAP-UHFFFAOYSA-N	0	3	305.422	2.327	10	0		DEAEHN
COc1nc(C(=O)N2CCN3CCC[C@@H]3C2)cc2ccccc21	ZINC000195338520	402842939	/nfs/dbraw/zinc/84/29/39/402842939.db2.gz	FTHBRRBFGHVVBZ-CQSZACIVSA-N	0	3	311.385	2.164	10	0		DEAEHN
Cc1nc2ccccc2n1CC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000194919879	402822951	/nfs/dbraw/zinc/82/29/51/402822951.db2.gz	GNPPUDAKYPXRDV-OAHLLOKOSA-N	0	3	316.449	2.437	10	0		DEAEHN
O=C(c1cc(-c2cccs2)[nH]n1)N1CCN2CCCC[C@H]2C1	ZINC000195056382	402830034	/nfs/dbraw/zinc/83/00/34/402830034.db2.gz	FQFMNBAWRLNCAU-LBPRGKRZSA-N	0	3	316.430	2.449	10	0		DEAEHN
O=C(NC[C@@H](O)CN1CCCCC1)Nc1cccc2[nH]ccc21	ZINC000195161062	402834692	/nfs/dbraw/zinc/83/46/92/402834692.db2.gz	FWALCWZTYGYPDM-CYBMUJFWSA-N	0	3	316.405	2.136	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N[C@@H]1COc2ccccc21	ZINC000195196805	402835725	/nfs/dbraw/zinc/83/57/25/402835725.db2.gz	NHBLXJNNXHHRDE-UKRRQHHQSA-N	0	3	305.422	2.396	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc(OC[C@H]2CCCO2)cc1	ZINC000175852637	402838091	/nfs/dbraw/zinc/83/80/91/402838091.db2.gz	NJGAKXHEZQGWSM-MSOLQXFVSA-N	0	3	323.433	2.122	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc(OCC(F)F)cc1	ZINC000175851526	402838144	/nfs/dbraw/zinc/83/81/44/402838144.db2.gz	LRVGGVQTJXHEJD-OAHLLOKOSA-N	0	3	303.349	2.208	10	0		DEAEHN
CC(C)[C@H](CNC(=O)N1CC[C@H](N(C)C)C1)c1cccnc1	ZINC000175897813	402840924	/nfs/dbraw/zinc/84/09/24/402840924.db2.gz	MYPWHGKTWLTAAT-HOTGVXAUSA-N	0	3	304.438	2.167	10	0		DEAEHN
CC(C)Oc1ccccc1CC(=O)N1CCN2CCC[C@H]2C1	ZINC000195450796	402845930	/nfs/dbraw/zinc/84/59/30/402845930.db2.gz	HPLQRFZMUPIFQL-INIZCTEOSA-N	0	3	302.418	2.323	10	0		DEAEHN
CC(C)Oc1ccccc1CC(=O)N1CCN2CCC[C@@H]2C1	ZINC000195450788	402846150	/nfs/dbraw/zinc/84/61/50/402846150.db2.gz	HPLQRFZMUPIFQL-MRXNPFEDSA-N	0	3	302.418	2.323	10	0		DEAEHN
Cc1ccsc1CNC(=O)CN1CCC(c2ccn[nH]2)CC1	ZINC000195507476	402848376	/nfs/dbraw/zinc/84/83/76/402848376.db2.gz	KLZXBUPPVAYGST-UHFFFAOYSA-N	0	3	318.446	2.275	10	0		DEAEHN
CC[C@H](C)NC(=O)CN1CC[C@H](CNc2cccc(C)n2)C1	ZINC000195516105	402849359	/nfs/dbraw/zinc/84/93/59/402849359.db2.gz	IZNZTKDCPARKBS-DZGCQCFKSA-N	0	3	304.438	2.039	10	0		DEAEHN
Cc1cccc(NC[C@H]2CCN(CC(=O)N[C@@H](C)C(C)C)C2)n1	ZINC000195516158	402849666	/nfs/dbraw/zinc/84/96/66/402849666.db2.gz	OKPHYCQVBYOKCX-JKSUJKDBSA-N	0	3	318.465	2.285	10	0		DEAEHN
CCn1ccnc(N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1=O	ZINC000274173679	403032063	/nfs/dbraw/zinc/03/20/63/403032063.db2.gz	NKVKBQYCEMZABK-GDBMZVCRSA-N	0	3	312.417	2.196	10	0		DEAEHN
Cn1cc(-c2cc(CN3CC[C@H](N4CCCCC4)C3)on2)cn1	ZINC000274418935	403053750	/nfs/dbraw/zinc/05/37/50/403053750.db2.gz	NTWQCHPYFJXYED-HNNXBMFYSA-N	0	3	315.421	2.135	10	0		DEAEHN
CC(C)c1cnc(NC(=O)NCCNc2ccncc2)s1	ZINC000566634631	292257856	/nfs/dbraw/zinc/25/78/56/292257856.db2.gz	PPBFVQYNJRQZPM-UHFFFAOYSA-N	0	3	305.407	2.317	10	0		DEAEHN
COCCN1CC[C@@H](NCc2ccsc2Br)C1	ZINC000282316325	403143076	/nfs/dbraw/zinc/14/30/76/403143076.db2.gz	SYEXCFITZTUMPS-LLVKDONJSA-N	0	3	319.268	2.321	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1C(=O)C(=O)Nc1cscc1C	ZINC000276093146	403145226	/nfs/dbraw/zinc/14/52/26/403145226.db2.gz	FJTVQRADAKPABD-QWHCGFSZSA-N	0	3	321.446	2.080	10	0		DEAEHN
c1ccc(COCCCN2CCO[C@]3(CCCOC3)C2)cc1	ZINC000285440096	403296759	/nfs/dbraw/zinc/29/67/59/403296759.db2.gz	XLWBMDISMXEHNL-GOSISDBHSA-N	0	3	305.418	2.475	10	0		DEAEHN
CCn1cc(CCN2C[C@H](O)C[C@H]2c2cccc(OC)c2)cn1	ZINC000286213533	403473923	/nfs/dbraw/zinc/47/39/23/403473923.db2.gz	QPWPLLSIJUXERO-AEFFLSMTSA-N	0	3	315.417	2.262	10	0		DEAEHN
CC(=O)CCc1ccc(OC[C@H](O)CN2C[C@H](C)[C@@H]2C)cc1	ZINC000293532189	403497499	/nfs/dbraw/zinc/49/74/99/403497499.db2.gz	XEIWVAPEKSOPSX-JLJPHGGASA-N	0	3	305.418	2.288	10	0		DEAEHN
Brc1cc2c(s1)CC[C@H]2NCCn1cncn1	ZINC000293893733	403592240	/nfs/dbraw/zinc/59/22/40/403592240.db2.gz	WBSPAKXEQLEGOU-SECBINFHSA-N	0	3	313.224	2.379	10	0		DEAEHN
NCc1cccnc1NC(=O)N1CCO[C@@H](C2CCCCC2)C1	ZINC000333390109	403741185	/nfs/dbraw/zinc/74/11/85/403741185.db2.gz	XHWPCJJYDBTSLG-OAHLLOKOSA-N	0	3	318.421	2.353	10	0		DEAEHN
C(CCN1CCO[C@H](C2CC2)C1)CCN1CCO[C@@H](C2CC2)C1	ZINC000368793083	403861403	/nfs/dbraw/zinc/86/14/03/403861403.db2.gz	RUVBOJKTPNZLIZ-KDURUIRLSA-N	0	3	322.493	2.378	10	0		DEAEHN
c1nn2ccccc2c1CN1CCC(OC[C@H]2CCOC2)CC1	ZINC000369963407	404285367	/nfs/dbraw/zinc/28/53/67/404285367.db2.gz	FIUSUSLTAACUCU-HNNXBMFYSA-N	0	3	315.417	2.352	10	0		DEAEHN
C([C@H]1CCOC1)N1CCN(C[C@H]2CCOC2)C2(CCCCC2)C1	ZINC000370086045	404329482	/nfs/dbraw/zinc/32/94/82/404329482.db2.gz	CXYJHCJMJCPBLD-QZTJIDSGSA-N	0	3	322.493	2.380	10	0		DEAEHN
COCCCCN(C)C[C@H](c1cccs1)N1CCOCC1	ZINC000117880444	292319614	/nfs/dbraw/zinc/31/96/14/292319614.db2.gz	LLOWEIHGWWLSOF-OAHLLOKOSA-N	0	3	312.479	2.480	10	0		DEAEHN
C/C(=C\c1ccccc1)CNC[C@@H]1CCCCN1S(C)(=O)=O	ZINC000353089473	404740333	/nfs/dbraw/zinc/74/03/33/404740333.db2.gz	MRRSPJSEVINTPA-VMEIHUARSA-N	0	3	322.474	2.494	10	0		DEAEHN
C/C=C/CNC[C@H](O)COc1ccc(Br)cc1	ZINC000385081483	405034346	/nfs/dbraw/zinc/03/43/46/405034346.db2.gz	WULSDYBXFVLIOZ-JDGPPOGSSA-N	0	3	300.196	2.355	10	0		DEAEHN
CC(C)C[C@H](C)C(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000361209613	404974013	/nfs/dbraw/zinc/97/40/13/404974013.db2.gz	HFLCSJJNTAWFNY-QFBILLFUSA-N	0	3	318.461	2.422	10	0		DEAEHN
Cc1cc([C@@H](C)NC(=O)NCCNc2ccncc2)ccc1F	ZINC000435519761	404987630	/nfs/dbraw/zinc/98/76/30/404987630.db2.gz	OETRZCZGMWXXNO-CYBMUJFWSA-N	0	3	316.380	2.423	10	0		DEAEHN
CCOC(=O)COc1ccc(CN(CC)[C@H]2CCOC2)cc1	ZINC000361254583	404994902	/nfs/dbraw/zinc/99/49/02/404994902.db2.gz	ZPMAJRSRDRSGRM-HNNXBMFYSA-N	0	3	307.390	2.239	10	0		DEAEHN
CCN1CC[C@H](NC(=O)c2cccc(F)c2Br)C1	ZINC000389872986	405041058	/nfs/dbraw/zinc/04/10/58/405041058.db2.gz	AZEZETMCMMGMHC-VIFPVBQESA-N	0	3	315.186	2.412	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)c2csc(Br)c2)C1	ZINC000389866502	405041293	/nfs/dbraw/zinc/04/12/93/405041293.db2.gz	YUCSLTRKLBZSAW-SECBINFHSA-N	0	3	303.225	2.335	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)CCN2CC[C@@H](O)C2(C)C)cc1	ZINC000361426067	405070321	/nfs/dbraw/zinc/07/03/21/405070321.db2.gz	LBOCXZVXSDJELO-OAHLLOKOSA-N	0	3	304.390	2.063	10	0		DEAEHN
Cc1cc(-c2nnc(CN3CCN4CCC[C@H]4C3)o2)c(C)o1	ZINC000407950852	405074145	/nfs/dbraw/zinc/07/41/45/405074145.db2.gz	IOMJCYGHUTYKQJ-ZDUSSCGKSA-N	0	3	302.378	2.226	10	0		DEAEHN
c1cc(-c2noc(CN3CCNC[C@@H]3c3ccccc3)n2)co1	ZINC000420415262	405347485	/nfs/dbraw/zinc/34/74/85/405347485.db2.gz	UYLXRVGRMBGAQR-OAHLLOKOSA-N	0	3	310.357	2.476	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N(CCN(C)C)CC(C)C)cc1	ZINC000426494577	405363808	/nfs/dbraw/zinc/36/38/08/405363808.db2.gz	GJXYUUAWFUYAGA-UHFFFAOYSA-N	0	3	319.449	2.329	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NCC[C@@H]1CC=CCC1	ZINC000638597809	405564354	/nfs/dbraw/zinc/56/43/54/405564354.db2.gz	BEQWZQHHQQPHPL-SJLPKXTDSA-N	0	3	315.461	2.308	10	0		DEAEHN
O=C(NCCNc1ccncc1)NC[C@@H](c1ccccc1)C1CC1	ZINC000458792688	405596126	/nfs/dbraw/zinc/59/61/26/405596126.db2.gz	LXFHYXFCBPMYNI-SFHVURJKSA-N	0	3	324.428	2.408	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)NC[C@@H]1CCCC12CC2	ZINC000638794583	405674157	/nfs/dbraw/zinc/67/41/57/405674157.db2.gz	FBDWWKFWEGLGTC-DLBZAZTESA-N	0	3	315.461	2.142	10	0		DEAEHN
Cc1cc(N2CC[C@H](N[C@@H]3CC[C@@H]3C3CCC3)C2=O)n(C)n1	ZINC000560941455	405879521	/nfs/dbraw/zinc/87/95/21/405879521.db2.gz	BBENSZJCDAGMEL-KFWWJZLASA-N	0	3	302.422	2.002	10	0		DEAEHN
COC1CCC(NCc2c(Br)cnn2C)CC1	ZINC000459672879	406001750	/nfs/dbraw/zinc/00/17/50/406001750.db2.gz	HAHIFICFAIZNLZ-UHFFFAOYSA-N	0	3	302.216	2.230	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCC([C@@H](O)C(F)(F)F)CC1	ZINC000532533257	406083313	/nfs/dbraw/zinc/08/33/13/406083313.db2.gz	RPEQGJCPFDOXDL-QWHCGFSZSA-N	0	3	322.371	2.023	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N[C@H](COC)Cc1ccccc1	ZINC000471696713	406110202	/nfs/dbraw/zinc/11/02/02/406110202.db2.gz	JJLYFOCVPICICW-IRXDYDNUSA-N	0	3	304.434	2.235	10	0		DEAEHN
C/C(=C/c1ccccc1)CN(C)C[C@H](O)CC1(O)CCOCC1	ZINC000639633662	406180056	/nfs/dbraw/zinc/18/00/56/406180056.db2.gz	OORLCSYAEXHSPK-XSVZSIDJSA-N	0	3	319.445	2.314	10	0		DEAEHN
Cn1ncc(Br)c1CN[C@H]1CCO[C@@H](C2CC2)C1	ZINC000487533372	406242237	/nfs/dbraw/zinc/24/22/37/406242237.db2.gz	DRCSWRCARUTESH-GXFFZTMASA-N	0	3	314.227	2.230	10	0		DEAEHN
COc1cc([C@@H]2[C@@H](N)CCN2C(=O)OC(C)(C)C)ccc1O	ZINC000536952611	406281181	/nfs/dbraw/zinc/28/11/81/406281181.db2.gz	DLNXXEBQTYULFU-SMDDNHRTSA-N	0	3	308.378	2.410	10	0		DEAEHN
CC1=CCN(CCNc2cc(C(C)C)nc3ncnn32)CC1	ZINC000547285415	406395037	/nfs/dbraw/zinc/39/50/37/406395037.db2.gz	UKNSXNRIGYNOAV-UHFFFAOYSA-N	0	3	300.410	2.312	10	0		DEAEHN
CC(C)[C@@H]1CCCN1C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637920613	406478248	/nfs/dbraw/zinc/47/82/48/406478248.db2.gz	OGQWLDKVGBVGHR-IRXDYDNUSA-N	0	3	303.450	2.093	10	0		DEAEHN
C[C@@H]1CCCN(C(=O)[C@H](N)CN(C)Cc2ccccc2)CC1	ZINC000637957177	406494661	/nfs/dbraw/zinc/49/46/61/406494661.db2.gz	DKPDPDWLZIXCNE-NVXWUHKLSA-N	0	3	303.450	2.094	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@H]2CCC(=O)NC2(C)C)c2ccccc21	ZINC000571261065	406497717	/nfs/dbraw/zinc/49/77/17/406497717.db2.gz	SQKNCFRALDRFJE-HOCLYGCPSA-N	0	3	315.417	2.131	10	0		DEAEHN
CC(C)CC[C@@H](C)NC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637873534	406456771	/nfs/dbraw/zinc/45/67/71/406456771.db2.gz	PCMHLDDPPSNJNF-WBVHZDCISA-N	0	3	305.466	2.387	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N1CCC(C)(C)CC1	ZINC000637980190	406507582	/nfs/dbraw/zinc/50/75/82/406507582.db2.gz	WEXFOQAVZACMNX-MRXNPFEDSA-N	0	3	303.450	2.094	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)NCc1nc2cc(C)ccc2[nH]1	ZINC000525821260	406507771	/nfs/dbraw/zinc/50/77/71/406507771.db2.gz	XJKIFKZOCPTKTN-ZDUSSCGKSA-N	0	3	315.421	2.155	10	0		DEAEHN
O[C@H](COC[C@@H]1CCCO1)CN1CC[C@@H](c2cccc(F)c2)C1	ZINC000552254108	406699635	/nfs/dbraw/zinc/69/96/35/406699635.db2.gz	MHIKUCADSPTKAX-NJAFHUGGSA-N	0	3	323.408	2.172	10	0		DEAEHN
C[C@@H](NC(=O)[C@H]1CNCCOC1)c1ccc(Cl)c(Cl)c1	ZINC000643619839	407017969	/nfs/dbraw/zinc/01/79/69/407017969.db2.gz	HRXVOBKNXBSCSB-KOLCDFICSA-N	0	3	317.216	2.407	10	0		DEAEHN
C[C@H](NC(=O)[C@H]1CNCCOC1)c1ccc(Cl)cc1Cl	ZINC000643619216	407018300	/nfs/dbraw/zinc/01/83/00/407018300.db2.gz	PTOZSDXONZXTQU-UWVGGRQHSA-N	0	3	317.216	2.407	10	0		DEAEHN
COc1ccc(Oc2ccnc(NN)n2)c(Br)c1	ZINC000129683975	196067772	/nfs/dbraw/zinc/06/77/72/196067772.db2.gz	ZAQAOMXAJZTUJK-UHFFFAOYSA-N	0	3	311.139	2.326	10	0		DEAEHN
NCc1ccccc1S(=O)(=O)NCCCCC(F)(F)F	ZINC000130553979	196090463	/nfs/dbraw/zinc/09/04/63/196090463.db2.gz	GBPQTOKEPYEUOY-UHFFFAOYSA-N	0	3	310.341	2.156	10	0		DEAEHN
CCN[C@@H](Cc1cnn(C)c1)c1ccc(Br)cn1	ZINC000130864392	196117634	/nfs/dbraw/zinc/11/76/34/196117634.db2.gz	CJGFKDRHMIKYTD-ZDUSSCGKSA-N	0	3	309.211	2.471	10	0		DEAEHN
CCc1nn([C@H]2CCS(=O)(=O)C2)c(CC)c1[C@H](CC)NC	ZINC000131085033	196138541	/nfs/dbraw/zinc/13/85/41/196138541.db2.gz	WOANRUYZTDRROE-RYUDHWBXSA-N	0	3	313.467	2.038	10	0		DEAEHN
CCN[C@H](c1ncccc1F)[C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000131662274	196188585	/nfs/dbraw/zinc/18/85/85/196188585.db2.gz	WDINFXUSUMSTHA-DYEKYZERSA-N	0	3	314.426	2.475	10	0		DEAEHN
CNCc1ccc(F)c(S(=O)(=O)N2CC[C@H](C)[C@@H](C)C2)c1	ZINC000131765383	196197493	/nfs/dbraw/zinc/19/74/93/196197493.db2.gz	ZIXGVJXDEZBOEQ-RYUDHWBXSA-N	0	3	314.426	2.212	10	0		DEAEHN
C[C@@H](c1cccs1)N(C)c1nc(N)nc(N2CCCC2)n1	ZINC000131835412	196203018	/nfs/dbraw/zinc/20/30/18/196203018.db2.gz	WJHUQNIJQGTDLW-JTQLQIEISA-N	0	3	304.423	2.313	10	0		DEAEHN
C[C@H]1CC[C@@](O)(c2c(Br)cnn2CCN(C)C)C1	ZINC000132360627	196248614	/nfs/dbraw/zinc/24/86/14/196248614.db2.gz	ZKBOTSOLAFIEMT-GWCFXTLKSA-N	0	3	316.243	2.215	10	0		DEAEHN
CCN[C@H](C[C@H]1CCCN(S(C)(=O)=O)C1)c1ccoc1C	ZINC000132754617	196281027	/nfs/dbraw/zinc/28/10/27/196281027.db2.gz	JUOKRHYEFQHLPI-UKRRQHHQSA-N	0	3	314.451	2.300	10	0		DEAEHN
C[C@@H]1CNC[C@@H](COCc2ccc(F)cc2Br)O1	ZINC000132805719	196284670	/nfs/dbraw/zinc/28/46/70/196284670.db2.gz	BVTQDPFCPNCNHB-SKDRFNHKSA-N	0	3	318.186	2.482	10	0		DEAEHN
C[C@]1(C(=O)Nc2cc3c(cc2Cl)NC(=O)C3)CCCCN1	ZINC000133145527	196314979	/nfs/dbraw/zinc/31/49/79/196314979.db2.gz	GWLUZFJROCDQSX-OAHLLOKOSA-N	0	3	307.781	2.305	10	0		DEAEHN
CSCC[C@H](C)[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000133218967	196321372	/nfs/dbraw/zinc/32/13/72/196321372.db2.gz	QWAWBJXBADVNJD-NSHDSACASA-N	0	3	320.480	2.198	10	0		DEAEHN
CSCC[C@H](C)NS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000133218967	196321374	/nfs/dbraw/zinc/32/13/74/196321374.db2.gz	QWAWBJXBADVNJD-NSHDSACASA-N	0	3	320.480	2.198	10	0		DEAEHN
CC[C@H](CSC)NS(=O)(=O)c1cccc([C@H](C)NC)c1	ZINC000133238138	196323688	/nfs/dbraw/zinc/32/36/88/196323688.db2.gz	RPFJBBXTCRJYIU-WCQYABFASA-N	0	3	316.492	2.387	10	0		DEAEHN
COc1ccc2c(c1)[C@H](NC[C@H]1CCCS1(=O)=O)CCC2	ZINC000133952401	196349018	/nfs/dbraw/zinc/34/90/18/196349018.db2.gz	ARLAHZJULHCRIZ-GDBMZVCRSA-N	0	3	309.431	2.239	10	0		DEAEHN
CC[C@H](CSC)[N-]S(=O)(=O)c1ccc(C[NH2+]C(C)C)o1	ZINC000134258275	196375037	/nfs/dbraw/zinc/37/50/37/196375037.db2.gz	VJZXMEAADPFYAW-LLVKDONJSA-N	0	3	320.480	2.198	10	0		DEAEHN
CC[C@H](CSC)NS(=O)(=O)c1ccc(CNC(C)C)o1	ZINC000134258275	196375039	/nfs/dbraw/zinc/37/50/39/196375039.db2.gz	VJZXMEAADPFYAW-LLVKDONJSA-N	0	3	320.480	2.198	10	0		DEAEHN
CC[C@H]1CCCCN1CCNC(=O)[C@@H]1CCCc2n[nH]cc21	ZINC000134349227	196380530	/nfs/dbraw/zinc/38/05/30/196380530.db2.gz	LNVCQLVPEJREGI-UONOGXRCSA-N	0	3	304.438	2.210	10	0		DEAEHN
CCC[C@H]1CN=C(NCc2ccc(S(C)(=O)=O)cc2)S1	ZINC000134481286	196396090	/nfs/dbraw/zinc/39/60/90/196396090.db2.gz	UEFFMBCEOSRQSW-LBPRGKRZSA-N	0	3	312.460	2.451	10	0		DEAEHN
C[C@@H](O)CCNC(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000136064633	196518224	/nfs/dbraw/zinc/51/82/24/196518224.db2.gz	HRNKPWHQAAPEQE-CVEARBPZSA-N	0	3	318.461	2.217	10	0		DEAEHN
C[C@@H]1CN(CCCCCOc2ccccc2)CCN1CCO	ZINC000188587870	225025932	/nfs/dbraw/zinc/02/59/32/225025932.db2.gz	IPMFZFXKVAVDCF-QGZVFWFLSA-N	0	3	306.450	2.234	10	0		DEAEHN
Cn1ccnc1CC1CCN(CC(=O)NCCC(C)(C)C)CC1	ZINC000105876646	424849297	/nfs/dbraw/zinc/84/92/97/424849297.db2.gz	KPDJROHYDQGAIJ-UHFFFAOYSA-N	0	3	320.481	2.227	10	0		DEAEHN
Cc1cnn(CCN[C@H](C)C(=O)Nc2ccc(Cl)cc2)c1	ZINC000105881162	424849519	/nfs/dbraw/zinc/84/95/19/424849519.db2.gz	UZTBJQLSEZCOBG-GFCCVEGCSA-N	0	3	306.797	2.462	10	0		DEAEHN
O=C(CSc1nc2ccccc2o1)N1CCN2CCC[C@H]2C1	ZINC000195327050	424881982	/nfs/dbraw/zinc/88/19/82/424881982.db2.gz	YZNHXBQRNZCMHZ-LBPRGKRZSA-N	0	3	317.414	2.227	10	0		DEAEHN
C[C@]1(CNC(=O)c2ccnnc2)CCCN1Cc1ccccc1	ZINC000153807419	424860320	/nfs/dbraw/zinc/86/03/20/424860320.db2.gz	XOCXIJMTFCHUMA-GOSISDBHSA-N	0	3	310.401	2.261	10	0		DEAEHN
C[C@H](C(=O)Nc1ccc(C(N)=O)cc1)N1C[C@H]2CCCC[C@@H]2C1	ZINC000177561238	424863658	/nfs/dbraw/zinc/86/36/58/424863658.db2.gz	STXKJBDXMWYIQW-BPLDGKMQSA-N	0	3	315.417	2.235	10	0		DEAEHN
Cc1ccc(CNC(=O)CN(C)[C@@]2(CO)CC[C@@H](C)C2)cc1F	ZINC000249567154	424887680	/nfs/dbraw/zinc/88/76/80/424887680.db2.gz	NHHANRDWSKQPMP-ACJLOTCBSA-N	0	3	322.424	2.233	10	0		DEAEHN
C1CC(N2CCC(Nc3nnc(C4CCOCC4)s3)CC2)C1	ZINC000562705465	424894541	/nfs/dbraw/zinc/89/45/41/424894541.db2.gz	YUXLNSNXBVDMAD-UHFFFAOYSA-N	0	3	322.478	2.861	10	0		DEAEHN
C[C@H](N[C@@H]1CCC(=O)N(C)C1=O)c1cc2c(s1)CCCC2	ZINC000129521109	267432432	/nfs/dbraw/zinc/43/24/32/267432432.db2.gz	QQOLLIHLEPCOTJ-CMPLNLGQSA-N	0	3	306.431	2.425	10	0		DEAEHN
CN(C(=O)Cc1c(F)cccc1Cl)[C@@H](CN)C(F)(F)F	ZINC000662975066	425768991	/nfs/dbraw/zinc/76/89/91/425768991.db2.gz	FHUJTDSWUAJUPP-JTQLQIEISA-N	0	3	312.694	2.370	10	0		DEAEHN
CN(C(=O)[C@H]1Cc2ccccc2S1)[C@H](CN)C(F)(F)F	ZINC000662979238	425770298	/nfs/dbraw/zinc/77/02/98/425770298.db2.gz	UUBXHFWZWKBDED-GHMZBOCLSA-N	0	3	304.337	2.051	10	0		DEAEHN
CCn1cnnc1CN[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000228791340	268578531	/nfs/dbraw/zinc/57/85/31/268578531.db2.gz	RYFATFXINFZVJO-CYBMUJFWSA-N	0	3	323.441	2.177	10	0		DEAEHN
CCO[C@@H]1CCCC[C@H]1NCC(=O)N1CCO[C@H]2CCCC[C@H]21	ZINC000333065857	268878792	/nfs/dbraw/zinc/87/87/92/268878792.db2.gz	JCIWRDIOKJJSNQ-VQHPVUNQSA-N	0	3	324.465	2.094	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1cc(C(N)=O)ccc1C	ZINC000176330053	276168620	/nfs/dbraw/zinc/16/86/20/276168620.db2.gz	LQTUPCBYZAUAEW-CQSZACIVSA-N	0	3	318.421	2.042	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)N(C)C	ZINC000247855786	276282255	/nfs/dbraw/zinc/28/22/55/276282255.db2.gz	XZKPBOPYTUYKHC-ZACQAIPSSA-N	0	3	303.450	2.278	10	0		DEAEHN
CCC[C@H](C(=O)N[C@H](C)c1cn(-c2ccccc2)nn1)N(C)C	ZINC000155134357	276282511	/nfs/dbraw/zinc/28/25/11/276282511.db2.gz	ZHQQRNLRZKZYFG-CZUORRHYSA-N	0	3	315.421	2.175	10	0		DEAEHN
CCOc1ccc(CN2C[C@H](N3CCOCC3)[C@@H](C)C2)cc1	ZINC000246097131	276373528	/nfs/dbraw/zinc/37/35/28/276373528.db2.gz	HWTLZPIRDKAXNH-YJBOKZPZSA-N	0	3	304.434	2.238	10	0		DEAEHN
CN(C(=O)CN[C@H]1CCCC[C@H]1n1cccn1)c1nccs1	ZINC000127963986	276726197	/nfs/dbraw/zinc/72/61/97/276726197.db2.gz	SHINZWWXXKGVLU-QWHCGFSZSA-N	0	3	319.434	2.076	10	0		DEAEHN
COC1(CNC(=O)N[C@H](Cc2ccccc2)CN(C)C)CCC1	ZINC000181501473	277186857	/nfs/dbraw/zinc/18/68/57/277186857.db2.gz	FIMOJDPLWLTMPT-MRXNPFEDSA-N	0	3	319.449	2.028	10	0		DEAEHN
C[C@@H](CN1CCCCC1)NC(=O)NCCCc1ccccn1	ZINC000179171125	277572954	/nfs/dbraw/zinc/57/29/54/277572954.db2.gz	VDWNXQRQJUXRBY-HNNXBMFYSA-N	0	3	304.438	2.188	10	0		DEAEHN
COc1cccc2c(N3C[C@@H]4[C@H](C3)OCCN4C)cc(C)nc12	ZINC000301700994	278025146	/nfs/dbraw/zinc/02/51/46/278025146.db2.gz	FQZVJYRGVPTLFD-WBVHZDCISA-N	0	3	313.401	2.071	10	0		DEAEHN
COc1ccccc1/C=C/CN1CCN(CC(C)(C)O)[C@@H](C)C1	ZINC000188890366	278045476	/nfs/dbraw/zinc/04/54/76/278045476.db2.gz	OHKHDECTMDJAAP-DYLHUKMJSA-N	0	3	318.461	2.485	10	0		DEAEHN
COc1ncc(C)cc1NC(=O)NCCN1CCCC[C@H]1C	ZINC000174973264	278088356	/nfs/dbraw/zinc/08/83/56/278088356.db2.gz	IYNXIAIXZHKDJD-CYBMUJFWSA-N	0	3	306.410	2.395	10	0		DEAEHN
CC(C)(CNC(=O)N1CC[C@@H]2OCCC[C@@H]2C1)N1CCCCC1	ZINC000132807760	278615700	/nfs/dbraw/zinc/61/57/00/278615700.db2.gz	RVHVAIIUTSRLRR-CVEARBPZSA-N	0	3	323.481	2.461	10	0		DEAEHN
CCC[C@H](C)CS(=O)(=O)N1CCC(N2CCCC2)CC1	ZINC000113280024	278927179	/nfs/dbraw/zinc/92/71/79/278927179.db2.gz	NSFTWVDBAFWDPZ-AWEZNQCLSA-N	0	3	302.484	2.313	10	0		DEAEHN
Cc1cc(C)n([C@@H](C)C(=O)N[C@@H](CN(C)C)c2ccccc2)n1	ZINC000120256966	301245946	/nfs/dbraw/zinc/24/59/46/301245946.db2.gz	MBRKGYSREXVDFV-RDJZCZTQSA-N	0	3	314.433	2.480	10	0		DEAEHN
Cc1ccc(N(C)C(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)cc1	ZINC000262549306	301619639	/nfs/dbraw/zinc/61/96/39/301619639.db2.gz	SCPCUPDXQQPULI-IIDMSEBBSA-N	0	3	302.418	2.490	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)C23CCC(C(=O)OC)(CC2)CC3)C1	ZINC000574469000	326157669	/nfs/dbraw/zinc/15/76/69/326157669.db2.gz	OFWROJZOINJHOI-RWBZWWBESA-N	0	3	322.449	2.101	10	0		DEAEHN
COC[C@@H](C)CN1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000189639920	333190450	/nfs/dbraw/zinc/19/04/50/333190450.db2.gz	MTDZEKGAEDVSRW-AWEZNQCLSA-N	0	3	308.397	2.256	10	0		DEAEHN
CN(C)[C@@H](CNC(=O)NCCOCC1CCC1)c1ccccc1	ZINC000583786585	337332826	/nfs/dbraw/zinc/33/28/26/337332826.db2.gz	RLSPGCWQECFLRH-KRWDZBQOSA-N	0	3	319.449	2.405	10	0		DEAEHN
CCOC(=O)C(C(=O)OCC)[C@H](c1ccccc1C)N(C)C	ZINC000584651339	337380873	/nfs/dbraw/zinc/38/08/73/337380873.db2.gz	YFSSLJBIVAGJME-HNNXBMFYSA-N	0	3	307.390	2.340	10	0		DEAEHN
c1cncc(O[C@H]2CCCc3ccc(N4CCNCC4)nc32)c1	ZINC000584651825	337380981	/nfs/dbraw/zinc/38/09/81/337380981.db2.gz	VMJXPZMMHVIMSE-INIZCTEOSA-N	0	3	310.401	2.343	10	0		DEAEHN
CCCOc1nc(C)ccc1C(=O)N1CC[C@H](N2CCCC2)C1	ZINC000191090181	337399558	/nfs/dbraw/zinc/39/95/58/337399558.db2.gz	YBYDWFZWOKIYOP-HNNXBMFYSA-N	0	3	317.433	2.489	10	0		DEAEHN
CCCCCCN1CCN(C[C@@H]2CN(C(C)C)CCO2)CC1	ZINC000157958112	520080871	/nfs/dbraw/zinc/08/08/71/520080871.db2.gz	MKOHKXPUHADIPL-GOSISDBHSA-N	0	3	311.514	2.294	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C)N(C)C	ZINC000156613838	520983510	/nfs/dbraw/zinc/98/35/10/520983510.db2.gz	JCWCFFMQAVWUII-CGTJXYLNSA-N	0	3	317.477	2.353	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)CCN(C)c2ccccc2)C1	ZINC000107838146	521619388	/nfs/dbraw/zinc/61/93/88/521619388.db2.gz	CCCYYUHOHWUKPR-MRXNPFEDSA-N	0	3	318.465	2.249	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](C)Cc2c(C)noc2C)C1	ZINC000157384675	521646424	/nfs/dbraw/zinc/64/64/24/521646424.db2.gz	ZNJKXQOPSYAUFR-FZMZJTMJSA-N	0	3	308.426	2.006	10	0		DEAEHN
CN(C)Cc1cccc(C(=O)N2CCC[C@@H]2c2cnn(C)c2)c1	ZINC000156219556	521912883	/nfs/dbraw/zinc/91/28/83/521912883.db2.gz	AKQBXXDLYDNBIX-QGZVFWFLSA-N	0	3	312.417	2.459	10	0		DEAEHN
CC[C@H](Sc1ccccc1)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000116783274	522920868	/nfs/dbraw/zinc/92/08/68/522920868.db2.gz	RMOSUZFDSWDAAJ-ZBFHGGJFSA-N	0	3	322.474	2.346	10	0		DEAEHN
COc1ccc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1OC	ZINC000246748215	523728197	/nfs/dbraw/zinc/72/81/97/523728197.db2.gz	BHCHYLOVBJDDOB-GXTWGEPZSA-N	0	3	306.406	2.162	10	0		DEAEHN
CC(=O)Nc1ccc(N[C@@H]2CCC[C@H]2[C@H]2COCCN2)cc1	ZINC000262031912	534746194	/nfs/dbraw/zinc/74/61/94/534746194.db2.gz	XQHOROMUEHSZAW-BRWVUGGUSA-N	0	3	303.406	2.214	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)CSCc2ccccn2)CCN1C	ZINC000124342936	525416091	/nfs/dbraw/zinc/41/60/91/525416091.db2.gz	BREVCELNMNTIMK-UKRRQHHQSA-N	0	3	307.463	2.256	10	0		DEAEHN
O=C(c1cccs1)N1CCCN(CCN2CCCCC2)CC1	ZINC000158119531	526835921	/nfs/dbraw/zinc/83/59/21/526835921.db2.gz	ZJMXWVNMNAGKKP-UHFFFAOYSA-N	0	3	321.490	2.382	10	0		DEAEHN
CC(C)(C)OC(=O)c1ccc(CNC[C@]2(C)CCC(=O)N2)cc1	ZINC000453585517	534953682	/nfs/dbraw/zinc/95/36/82/534953682.db2.gz	GQJMXTIHTIEYJT-SFHVURJKSA-N	0	3	318.417	2.400	10	0		DEAEHN
CC(C)(C)OC(=O)c1cccc(C(=O)NCCN2CCCC2)c1	ZINC000180342033	534956158	/nfs/dbraw/zinc/95/61/58/534956158.db2.gz	YGNBSVIYVQOMJK-UHFFFAOYSA-N	0	3	318.417	2.468	10	0		DEAEHN
CCCCN(C)CCNC(=O)NC[C@](C)(O)C1CCCCC1	ZINC000358445465	535220827	/nfs/dbraw/zinc/22/08/27/535220827.db2.gz	NKABZJDMZLLANZ-KRWDZBQOSA-N	0	3	313.486	2.349	10	0		DEAEHN
CCc1noc(C)c1CNC(=O)N[C@@H](C)CN1CCC[C@H](C)C1	ZINC000454651519	535882124	/nfs/dbraw/zinc/88/21/24/535882124.db2.gz	VKQKSPJHIIYJBS-STQMWFEESA-N	0	3	322.453	2.465	10	0		DEAEHN
CCc1noc2ncc(C(=O)N(C)[C@@H]3CCN(C)[C@@H](C)C3)cc12	ZINC000247382112	535902374	/nfs/dbraw/zinc/90/23/74/535902374.db2.gz	LLWNWRPQFYWKIG-WCQYABFASA-N	0	3	316.405	2.340	10	0		DEAEHN
CCc1cccc(OCCN2CCN(C[C@@H](C)O)[C@@H](C)C2)c1	ZINC000247120733	535906965	/nfs/dbraw/zinc/90/69/65/535906965.db2.gz	JRGFVHMHPYBXOR-JKSUJKDBSA-N	0	3	306.450	2.015	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)NCCCCC2CCCC2)CCO1	ZINC000173460779	535946458	/nfs/dbraw/zinc/94/64/58/535946458.db2.gz	GAXYIAJCNBKHIE-MRXNPFEDSA-N	0	3	311.470	2.319	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)C[C@H](O)c2ccccc2)C1	ZINC000246524933	536469981	/nfs/dbraw/zinc/46/99/81/536469981.db2.gz	UYMRFSFPIRDUNI-BBWFWOEESA-N	0	3	302.418	2.053	10	0		DEAEHN
COCCOc1cccc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000246806488	536694304	/nfs/dbraw/zinc/69/43/04/536694304.db2.gz	DETZVSIYMGCELB-WMLDXEAASA-N	0	3	320.433	2.170	10	0		DEAEHN
COc1ccc(C(=O)NC[C@@H]2CCCN2C)c(OC(C)C)c1	ZINC000191414116	536743267	/nfs/dbraw/zinc/74/32/67/536743267.db2.gz	AYSXMHXFGGAEKJ-ZDUSSCGKSA-N	0	3	306.406	2.306	10	0		DEAEHN
COc1cccc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1OC	ZINC000247126458	537081074	/nfs/dbraw/zinc/08/10/74/537081074.db2.gz	NDTHPWJKCOIYJT-ZFWWWQNUSA-N	0	3	318.417	2.260	10	0		DEAEHN
CC(C)[C@@H](NCc1ccc(F)c(Br)c1)C(N)=O	ZINC000107322882	563316305	/nfs/dbraw/zinc/31/63/05/563316305.db2.gz	COXCDXJJAWOWNS-LLVKDONJSA-N	0	3	303.175	2.188	10	0		DEAEHN
COCCO[C@H]1CCCN(C[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000179359094	625617820	/nfs/dbraw/zinc/61/78/20/625617820.db2.gz	KJOXDFDXTODPQH-ZWKOTPCHSA-N	0	3	307.434	2.464	10	0		DEAEHN
COc1ccccc1OCCN(C)C[C@@H](O)COC(C)(C)C	ZINC000052452021	625179457	/nfs/dbraw/zinc/17/94/57/625179457.db2.gz	WXJMWIVTFUXBBA-CQSZACIVSA-N	0	3	311.422	2.182	10	0		DEAEHN
CC[C@@H]1CCCC[C@H]1OCC(=O)C(C#N)C(=O)N1CCCC1	ZINC000248622393	634450771	/nfs/dbraw/zinc/45/07/71/634450771.db2.gz	MHCFZXPEEXUQLV-IJEWVQPXSA-N	0	3	306.406	2.303	10	0		DEAEHN
COC(=O)/C(C)=C/CN1CCN(Cc2ccccc2C)CC1	ZINC000746494700	638349336	/nfs/dbraw/zinc/34/93/36/638349336.db2.gz	SAYIJNWAWRLUQN-LZYBPNLTSA-N	0	3	302.418	2.232	10	0		DEAEHN
C[C@@H]1CN(C[C@H](O)Cc2ccccc2C(F)(F)F)CCN1C	ZINC000751572821	639439430	/nfs/dbraw/zinc/43/94/30/639439430.db2.gz	CKSSGMAJVQOFHP-TZMCWYRMSA-N	0	3	316.367	2.245	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)c1csc(-c2ccccn2)n1	ZINC000150084887	645275699	/nfs/dbraw/zinc/27/56/99/645275699.db2.gz	YRJPYEMXHWATCI-NSHDSACASA-N	0	3	302.403	2.029	10	0		DEAEHN
O=C(c1cccc(CN2CCCC2)c1)N1CCO[C@@H](C(F)F)C1	ZINC000801423426	645394615	/nfs/dbraw/zinc/39/46/15/645394615.db2.gz	JACQPAGUIPHFKG-OAHLLOKOSA-N	0	3	324.371	2.389	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NC[C@@H](O)c1cc(C)cc(C)c1	ZINC000801532693	645409974	/nfs/dbraw/zinc/40/99/74/645409974.db2.gz	CWKXPPKVKJZSTG-IAGOWNOFSA-N	0	3	304.434	2.327	10	0		DEAEHN
CCNC(=O)N1CC[C@@H](N[C@@H]2CCc3nc(Cl)ccc32)C1	ZINC000806148928	645803139	/nfs/dbraw/zinc/80/31/39/645803139.db2.gz	ZPAYBDGIERNDBD-ZYHUDNBSSA-N	0	3	308.813	2.116	10	0		DEAEHN
C[C@@H](CCCO)N(C(=O)OC(C)(C)C)c1ccc(CN)nc1	ZINC000757131857	645928205	/nfs/dbraw/zinc/92/82/05/645928205.db2.gz	ABTGHPWHHGUJDI-LBPRGKRZSA-N	0	3	309.410	2.443	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)[C@@H]1CC(c2ccccc2)=NO1	ZINC000044533214	646393642	/nfs/dbraw/zinc/39/36/42/646393642.db2.gz	FFTSBWJPDLNWMD-YOEHRIQHSA-N	0	3	315.417	2.170	10	0		DEAEHN
Cc1nc(N)sc1C(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000055175120	646416718	/nfs/dbraw/zinc/41/67/18/646416718.db2.gz	RVBUUEXHMBLCLJ-GFCCVEGCSA-N	0	3	304.419	2.066	10	0		DEAEHN
CN(C)C[C@H]1CN(Cn2c3ccccc3oc2=S)CCO1	ZINC000152968756	647305809	/nfs/dbraw/zinc/30/58/09/647305809.db2.gz	SVXIAOUINYRPAB-LBPRGKRZSA-N	0	3	307.419	2.184	10	0		DEAEHN
Cc1ccc(-c2cnn(CN3CCO[C@@H](CN(C)C)C3)c2)cc1	ZINC000153000548	647336835	/nfs/dbraw/zinc/33/68/35/647336835.db2.gz	PKMIXLOBBNWPDE-SFHVURJKSA-N	0	3	314.433	2.078	10	0		DEAEHN
CN(C)CCN(CCc1ccccc1)C(=O)C1=COCCC1	ZINC000730745998	647392938	/nfs/dbraw/zinc/39/29/38/647392938.db2.gz	JXLGEHWNTKGSAL-UHFFFAOYSA-N	0	3	302.418	2.314	10	0		DEAEHN
CCN(CC(=O)NCc1ccc(F)cc1)CC1(O)CCCCC1	ZINC000131995797	684204525	/nfs/dbraw/zinc/20/45/25/684204525.db2.gz	OKJIUKKTPRAVKU-UHFFFAOYSA-N	0	3	322.424	2.459	10	0		DEAEHN
Cn1c(=O)sc2cc(CNC[C@](C)(O)c3ccco3)ccc21	ZINC000192631379	684454377	/nfs/dbraw/zinc/45/43/77/684454377.db2.gz	KWBYTJLBOHFLOL-INIZCTEOSA-N	0	3	318.398	2.190	10	0		DEAEHN
COCCN1CC[C@H](Nc2cncc(Br)c2C)C1	ZINC000722736124	776715160	/nfs/dbraw/zinc/71/51/60/776715160.db2.gz	QFFYJRRJOOHVNN-NSHDSACASA-N	0	3	314.227	2.285	10	0		DEAEHN
COc1ccc(Br)cc1CN[C@H]1CC12CC(O)C2	ZINC000724948529	777532375	/nfs/dbraw/zinc/53/23/75/777532375.db2.gz	YFMLZTKVEBSTTC-QRMWWUJWSA-N	0	3	312.207	2.461	10	0		DEAEHN
Cn1nc(Br)cc1CNC[C@@H]1CC[C@H](C2CC2)O1	ZINC000722321071	778616293	/nfs/dbraw/zinc/61/62/93/778616293.db2.gz	PESMIMMTPMSNFH-NWDGAFQWSA-N	0	3	314.227	2.230	10	0		DEAEHN
COC(=O)c1ccc(CNCC2CN(C(=O)OC(C)(C)C)C2)o1	ZINC000397780047	790219149	/nfs/dbraw/zinc/21/91/49/790219149.db2.gz	YRCPFTLJVWHUNV-UHFFFAOYSA-N	0	3	324.377	2.023	10	0		DEAEHN
Cn1cc(CNCCCc2nccs2)c(Br)n1	ZINC000712496289	792190343	/nfs/dbraw/zinc/19/03/43/792190343.db2.gz	MRZVOKFHIKERPH-UHFFFAOYSA-N	0	3	315.240	2.362	10	0		DEAEHN
CC(C)COCCCNCc1cn(C)nc1Br	ZINC000712492496	792190585	/nfs/dbraw/zinc/19/05/85/792190585.db2.gz	XVVDEXWAUDVWCH-UHFFFAOYSA-N	0	3	304.232	2.335	10	0		DEAEHN
C[C@]1(c2cccc(CNCc3cccs3)c2)NC(=O)NC1=O	ZINC000171130951	793712338	/nfs/dbraw/zinc/71/23/38/793712338.db2.gz	GVVFFQVQWYHSAY-MRXNPFEDSA-N	0	3	315.398	2.093	10	0		DEAEHN
CCNc1ncc(C(=O)NCCN2CCCCC2)cc1Cl	ZINC000050777291	1078477849	/nfs/dbraw/zinc/47/78/49/1078477849.db2.gz	RHHZCAGRASTPNH-UHFFFAOYSA-N	0	3	310.829	2.383	10	0		DEAEHN
Cc1nn(C)c(CN[C@@H]2CCCN3CCSC[C@@H]23)c1Cl	ZINC000720510354	1085268417	/nfs/dbraw/zinc/26/84/17/1085268417.db2.gz	KGLZVZNSZIWCMA-YPMHNXCESA-N	0	3	314.886	2.051	10	0		DEAEHN
C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CCNCc1cnccn1	ZINC000721041553	1085630386	/nfs/dbraw/zinc/63/03/86/1085630386.db2.gz	LVBJXRNVSYINLK-ZIAGYGMSSA-N	0	3	320.437	2.459	10	0		DEAEHN
C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CCNCc1cn(C)cn1	ZINC000721043279	1085632779	/nfs/dbraw/zinc/63/27/79/1085632779.db2.gz	XWPGJZAHVBEWFL-ZIAGYGMSSA-N	0	3	322.453	2.403	10	0		DEAEHN
COc1cncc(CNC[C@@H](C)N(C)C(=O)OC(C)(C)C)c1	ZINC000704209353	1086574966	/nfs/dbraw/zinc/57/49/66/1086574966.db2.gz	UQNLOXKMJTWJPS-GFCCVEGCSA-N	0	3	309.410	2.435	10	0		DEAEHN
COC1(OC)CC[C@@H]1N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C	ZINC000710988331	1086692722	/nfs/dbraw/zinc/69/27/22/1086692722.db2.gz	LHBPPNMMPBLDMA-XQQFMLRXSA-N	0	3	314.426	2.125	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@]2(NCc3cncnc3)CCC[C@@H]12	ZINC000711639360	1087175770	/nfs/dbraw/zinc/17/57/70/1087175770.db2.gz	KOGQPVRYQRJKSB-RHSMWYFYSA-N	0	3	318.421	2.498	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@]2(NCc3c[nH]cn3)CCC[C@@H]12	ZINC000711623334	1087177669	/nfs/dbraw/zinc/17/76/69/1087177669.db2.gz	LFPQGIXHSPHABV-CZUORRHYSA-N	0	3	306.410	2.431	10	0		DEAEHN
C[C@@H](NC(=O)OC(C)(C)C)[C@H](C)NCc1cnc2n1CCC2	ZINC000719117130	1088842042	/nfs/dbraw/zinc/84/20/42/1088842042.db2.gz	QKLAKAUMWAYCHG-NWDGAFQWSA-N	0	3	308.426	2.221	10	0		DEAEHN
C[C@@H]1[C@H](NC(=O)c2cc(Br)ccc2F)CCN1C	ZINC000719388441	1089070938	/nfs/dbraw/zinc/07/09/38/1089070938.db2.gz	QGTQGMDXEAHDMH-PRHODGIISA-N	0	3	315.186	2.411	10	0		DEAEHN
CC(=O)Nc1cccc([C@H](C)NC(=O)NC[C@@H]2CCCN2C)c1	ZINC000139524765	282101066	/nfs/dbraw/zinc/10/10/66/282101066.db2.gz	QTRVJFCATYNEFG-LRDDRELGSA-N	0	3	318.421	2.099	10	0		DEAEHN
CN[C@@H](CSCC(=O)OC)c1ccc2c(c1)OCCCO2	ZINC000081792114	192324126	/nfs/dbraw/zinc/32/41/26/192324126.db2.gz	FNUKEVUBFWISGP-LBPRGKRZSA-N	0	3	311.403	2.015	10	0		DEAEHN
Cn1ccnc1SC[C@@H](N)c1ccc2c(c1)OCCCO2	ZINC000081840586	192329970	/nfs/dbraw/zinc/32/99/70/192329970.db2.gz	YENPFNPZGQCNPQ-GFCCVEGCSA-N	0	3	305.403	2.374	10	0		DEAEHN
CC(C)N(CCN(C)C)C(=O)CCc1nc(C(C)(C)C)no1	ZINC000151971865	282131161	/nfs/dbraw/zinc/13/11/61/282131161.db2.gz	UVQLYMNLEZUWDW-UHFFFAOYSA-N	0	3	310.442	2.098	10	0		DEAEHN
CCC[C@@H]1CCN(S(=O)(=O)c2cc(CNC)cs2)C1	ZINC000163613121	197641554	/nfs/dbraw/zinc/64/15/54/197641554.db2.gz	RVUPQSUJVHZUBY-LLVKDONJSA-N	0	3	302.465	2.278	10	0		DEAEHN
COc1ccc(Br)c(CN[C@@H]2CN(C)C[C@@H]2C)c1	ZINC000358086099	536628185	/nfs/dbraw/zinc/62/81/85/536628185.db2.gz	WLFDAGVAEUNFBM-IINYFYTJSA-N	0	3	313.239	2.497	10	0		DEAEHN
C[C@H]1CNCCN1c1cccc(I)c1	ZINC000083086704	185213105	/nfs/dbraw/zinc/21/31/05/185213105.db2.gz	WYUWVAIXTDPNRQ-VIFPVBQESA-N	0	3	302.159	2.089	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1[C@H](N[C@@H]2CCC23CCC3)CC(=O)N1C	ZINC000328655871	231292306	/nfs/dbraw/zinc/29/23/06/231292306.db2.gz	NFKHCTICBOOHJF-CKEIUWERSA-N	0	3	316.449	2.231	10	0		DEAEHN
CC[C@@H]1CN(C(=O)c2snnc2C(C)(C)C)[C@H](CC)CN1	ZINC000087456113	185225660	/nfs/dbraw/zinc/22/56/60/185225660.db2.gz	AHDDKWVWFOFXLL-GHMZBOCLSA-N	0	3	310.467	2.438	10	0		DEAEHN
COc1ccc(Br)c(C[C@H](N)c2ccn(C)n2)c1	ZINC000087795868	185232033	/nfs/dbraw/zinc/23/20/33/185232033.db2.gz	HFUDJKYDDFXLSW-LBPRGKRZSA-N	0	3	310.195	2.434	10	0		DEAEHN
Cc1ccc(CN)cc1S(=O)(=O)N1CCC[C@H]2CCC[C@@H]21	ZINC000087768833	185231508	/nfs/dbraw/zinc/23/15/08/185231508.db2.gz	RENQPFZLNGDDAO-CABCVRRESA-N	0	3	308.447	2.407	10	0		DEAEHN
CCN[C@H]1CCN(c2ccc(OC)c(Br)c2)C1=O	ZINC000088320464	185245571	/nfs/dbraw/zinc/24/55/71/185245571.db2.gz	SEZLRPJXVSKSDT-NSHDSACASA-N	0	3	313.195	2.173	10	0		DEAEHN
COC(=O)CS(=O)(=O)[C@@H]1CCCCCCCCCC[C@H]1N	ZINC000081976052	192348427	/nfs/dbraw/zinc/34/84/27/192348427.db2.gz	OQMXAQCYJXOAEZ-ZIAGYGMSSA-N	0	3	319.467	2.185	10	0		DEAEHN
CC[C@@H](CN)S(=O)(=O)N[C@@H](C)C12CC3CC(CC(C3)C1)C2	ZINC000088471904	185251870	/nfs/dbraw/zinc/25/18/70/185251870.db2.gz	ASVDHEULBKBTQO-KORRQRHVSA-N	0	3	314.495	2.248	10	0		DEAEHN
CC[C@H](C)N(C)S(=O)(=O)c1ccc(CNCC(C)C)o1	ZINC000088543717	185256653	/nfs/dbraw/zinc/25/66/53/185256653.db2.gz	YRPNWLTWNVPCAE-LBPRGKRZSA-N	0	3	302.440	2.444	10	0		DEAEHN
Cc1cc(C)c2c(N)c(C(=O)N(C)CCN(C)C)sc2n1	ZINC000088643707	185261552	/nfs/dbraw/zinc/26/15/52/185261552.db2.gz	GJIOQMJOHWGAGT-UHFFFAOYSA-N	0	3	306.435	2.129	10	0		DEAEHN
CCC[C@H](C(=O)NCCc1nc2c(s1)CCCC2)N(C)C	ZINC000179158737	282216655	/nfs/dbraw/zinc/21/66/55/282216655.db2.gz	JFTPTCHJBYCUER-CYBMUJFWSA-N	0	3	309.479	2.411	10	0		DEAEHN
COC[C@](C)(CO)NCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000613238246	362053000	/nfs/dbraw/zinc/05/30/00/362053000.db2.gz	FWNXPUSBCACCGV-KRWDZBQOSA-N	0	3	309.406	2.129	10	0		DEAEHN
C[C@H](NC(=O)[C@@H]1COC[C@@H]1N)c1ccc(Cl)cc1Cl	ZINC000090379048	185293567	/nfs/dbraw/zinc/29/35/67/185293567.db2.gz	WEQLBFFFCJLTBF-KOLSJAJHSA-N	0	3	303.189	2.144	10	0		DEAEHN
Cc1nc(-c2cccc(NC(=O)[C@H]3COC[C@H]3N)c2)cs1	ZINC000090380493	185293776	/nfs/dbraw/zinc/29/37/76/185293776.db2.gz	IUUZJELFJBDGMK-QWHCGFSZSA-N	0	3	303.387	2.031	10	0		DEAEHN
Cc1nc(-c2ccc(NC(=O)[C@H]3COC[C@H]3N)cc2)cs1	ZINC000090383769	185293846	/nfs/dbraw/zinc/29/38/46/185293846.db2.gz	XRQXSSPUZHSRHB-QWHCGFSZSA-N	0	3	303.387	2.031	10	0		DEAEHN
C[C@]1(C(=O)Nc2ccccc2SC(F)F)COC[C@@H]1N	ZINC000090580449	185304749	/nfs/dbraw/zinc/30/47/49/185304749.db2.gz	MLDGCCXMDSONKD-GWCFXTLKSA-N	0	3	302.346	2.304	10	0		DEAEHN
Cc1cc(NC(=O)[C@]2(C)COC[C@@H]2N)ccc1Br	ZINC000090580520	185304788	/nfs/dbraw/zinc/30/47/88/185304788.db2.gz	BVDHVVBTSSHWMF-WCQYABFASA-N	0	3	313.195	2.060	10	0		DEAEHN
C[NH2+][C@@H](C)c1cccc(S(=O)(=O)[N-]c2ccnc(C)c2)c1	ZINC000092364745	185313938	/nfs/dbraw/zinc/31/39/38/185313938.db2.gz	RKOVUYISWGCUFX-LBPRGKRZSA-N	0	3	305.403	2.471	10	0		DEAEHN
CNc1nc(CN(C)C[C@@H]2CCCN2C)nc2sccc21	ZINC000092669279	185332894	/nfs/dbraw/zinc/33/28/94/185332894.db2.gz	SNHWOBHWOIZUCH-NSHDSACASA-N	0	3	305.451	2.259	10	0		DEAEHN
Cc1cc(CN)cc(S(=O)(=O)NC2C(C)(C)C2(C)C)c1C	ZINC000092833233	185344968	/nfs/dbraw/zinc/34/49/68/185344968.db2.gz	LYLVENFEEKEKCE-UHFFFAOYSA-N	0	3	310.463	2.475	10	0		DEAEHN
CC(C)[NH2+]Cc1ccc(F)c(S(=O)(=O)[N-]C2(C)CC2)c1	ZINC000168534486	197725169	/nfs/dbraw/zinc/72/51/69/197725169.db2.gz	WTPNIFDKBXAQPL-UHFFFAOYSA-N	0	3	300.399	2.155	10	0		DEAEHN
COc1ccc2c(c1)CCCN2C(=O)CN[C@H](C)[C@H]1CCCO1	ZINC000183119988	199540970	/nfs/dbraw/zinc/54/09/70/199540970.db2.gz	MCNVJFMSOAALKV-CXAGYDPISA-N	0	3	318.417	2.132	10	0		DEAEHN
CNC(=O)c1cccnc1N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000302163228	529951890	/nfs/dbraw/zinc/95/18/90/529951890.db2.gz	ILSVKWXOTFSTCM-RHSMWYFYSA-N	0	3	324.428	2.374	10	0		DEAEHN
CN(C)CCNC(=O)c1ccn2cc(-c3ccccc3)nc2c1	ZINC000170559291	197779659	/nfs/dbraw/zinc/77/96/59/197779659.db2.gz	HXKPFQCWZMWSCY-UHFFFAOYSA-N	0	3	308.385	2.293	10	0		DEAEHN
O=C(Nc1ccccc1)c1ccc(=O)n(CCN2CCCC2)c1	ZINC000064760530	190704845	/nfs/dbraw/zinc/70/48/45/190704845.db2.gz	JWLZMUPUJXRXNI-UHFFFAOYSA-N	0	3	311.385	2.196	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)c2ccccc2OCCN(C)C)C[C@H](C)O1	ZINC000245501006	282392611	/nfs/dbraw/zinc/39/26/11/282392611.db2.gz	BNDYGGWRJBTLBC-QDMKHBRRSA-N	0	3	320.433	2.313	10	0		DEAEHN
CN1CC[C@H]2[C@H](CCCN2C(=O)NCCCc2ccccn2)C1	ZINC000183344718	199579153	/nfs/dbraw/zinc/57/91/53/199579153.db2.gz	KFYSFLFNEFFYIH-WBVHZDCISA-N	0	3	316.449	2.140	10	0		DEAEHN
N[C@@H]1CC(=O)N(C2CC2)[C@@H]1c1ccc(F)c(Br)c1	ZINC000070293901	190878577	/nfs/dbraw/zinc/87/85/77/190878577.db2.gz	PPUHJZNRQPEYGZ-DGCLKSJQSA-N	0	3	313.170	2.351	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1cnn(CC2CC2)c1	ZINC000176382509	539626987	/nfs/dbraw/zinc/62/69/87/539626987.db2.gz	NIRJEOFMCWQKFN-HNNXBMFYSA-N	0	3	305.426	2.241	10	0		DEAEHN
CN[C@@H](c1cccc2c1OC(C)(C)C2)[C@@H]1CCS(=O)(=O)C1	ZINC000080507481	192164006	/nfs/dbraw/zinc/16/40/06/192164006.db2.gz	YZLNFPCBGVIACZ-TZMCWYRMSA-N	0	3	309.431	2.095	10	0		DEAEHN
C[C@H](NCC(=O)N(C)c1nc2ccccc2s1)[C@H]1CCCO1	ZINC000183098496	539659916	/nfs/dbraw/zinc/65/99/16/539659916.db2.gz	BEMZAKXPUTXDQM-WCQYABFASA-N	0	3	319.430	2.416	10	0		DEAEHN
Cc1cc(Br)c([C@H](N)[C@H]2CCS(=O)(=O)C2)s1	ZINC000083677987	192377659	/nfs/dbraw/zinc/37/76/59/192377659.db2.gz	NZEVHZNIEHTOPZ-IONNQARKSA-N	0	3	324.265	2.254	10	0		DEAEHN
CCN[C@@H](C[S@](=O)C1CCOCC1)c1ccc(OC)cc1	ZINC000084055315	192397658	/nfs/dbraw/zinc/39/76/58/192397658.db2.gz	BOJBRCCLLLIWDR-HRAATJIYSA-N	0	3	311.447	2.274	10	0		DEAEHN
CN[C@H](Cc1ncnn1C)c1cc(Br)cs1	ZINC000083974307	192393349	/nfs/dbraw/zinc/39/33/49/192393349.db2.gz	RVFVZHWQCASWED-MRVPVSSYSA-N	0	3	301.213	2.142	10	0		DEAEHN
Cc1nn(C)c(C)c1CCN1Cc2cc(F)cc(F)c2[C@@H]1CN	ZINC000071683260	191007424	/nfs/dbraw/zinc/00/74/24/191007424.db2.gz	RWKRWWOLPZVIPM-INIZCTEOSA-N	0	3	320.387	2.373	10	0		DEAEHN
COc1ccc(Cl)c2c1CN(Cc1nccn1C)[C@@H]2CN	ZINC000071684013	191008998	/nfs/dbraw/zinc/00/89/98/191008998.db2.gz	WYPPPKLATAKBAI-GFCCVEGCSA-N	0	3	306.797	2.098	10	0		DEAEHN
CN(C[C@H](c1cccs1)N1CCOCC1)[C@@H]1CCCC[C@H]1O	ZINC000245697803	539757859	/nfs/dbraw/zinc/75/78/59/539757859.db2.gz	XBJQEJMYUHEKBZ-BZUAXINKSA-N	0	3	324.490	2.357	10	0		DEAEHN
Cn1c(CNC2CCCC2)nc2c1cccc2S(C)(=O)=O	ZINC000138241065	186014702	/nfs/dbraw/zinc/01/47/02/186014702.db2.gz	WDZWISUCAIWFAU-UHFFFAOYSA-N	0	3	307.419	2.009	10	0		DEAEHN
CN(C1CCCCC1)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138331932	186015812	/nfs/dbraw/zinc/01/58/12/186015812.db2.gz	PNJGJGRTCSCJRG-UHFFFAOYSA-N	0	3	318.389	2.377	10	0		DEAEHN
CCC[C@@H](C(=O)NCc1ccc(C(=O)OCC)cc1)N(C)C	ZINC000138406350	186016698	/nfs/dbraw/zinc/01/66/98/186016698.db2.gz	XGBCZDDMOPWHEU-HNNXBMFYSA-N	0	3	306.406	2.210	10	0		DEAEHN
CCN(C)S(=O)(=O)c1cc(CNC(C)C)cc(F)c1F	ZINC000138430573	186017175	/nfs/dbraw/zinc/01/71/75/186017175.db2.gz	WIXOJYSCJRFNIA-UHFFFAOYSA-N	0	3	306.378	2.103	10	0		DEAEHN
CC(C)[C@@H](C)N(C)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138523105	186017969	/nfs/dbraw/zinc/01/79/69/186017969.db2.gz	RXDWVDUVWQHKQC-SECBINFHSA-N	0	3	306.378	2.089	10	0		DEAEHN
Cc1ccc(CNC(C)C)cc1S(=O)(=O)NCC(F)F	ZINC000148171005	186042865	/nfs/dbraw/zinc/04/28/65/186042865.db2.gz	IVLZYGMDBUHFKZ-UHFFFAOYSA-N	0	3	306.378	2.036	10	0		DEAEHN
CCc1ccc(S(=O)(=O)NCC(F)F)cc1CNC1CC1	ZINC000148191742	186043811	/nfs/dbraw/zinc/04/38/11/186043811.db2.gz	CDNOXTYEWKGMOW-UHFFFAOYSA-N	0	3	318.389	2.044	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@H](C)C(=O)N2C[C@@H]2CCCN(C)C2)s1	ZINC000144209917	186035331	/nfs/dbraw/zinc/03/53/31/186035331.db2.gz	ZKWNESKGACEZGO-UMVBOHGHSA-N	0	3	307.463	2.217	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N(C)C2CCC2)ccc1F	ZINC000144664969	186035572	/nfs/dbraw/zinc/03/55/72/186035572.db2.gz	SMIVLTQNLYOHAW-UHFFFAOYSA-N	0	3	300.399	2.108	10	0		DEAEHN
Cc1ccc([C@@H]2NCC(=O)N2C[C@H](C)N2CCCCC2)s1	ZINC000145700441	186038074	/nfs/dbraw/zinc/03/80/74/186038074.db2.gz	OYPVRGSOEGRIGV-BLLLJJGKSA-N	0	3	307.463	2.361	10	0		DEAEHN
CN[C@H](C[C@@H]1CN(C)CCN1C)c1ccc(F)c(F)c1F	ZINC000149554652	186051081	/nfs/dbraw/zinc/05/10/81/186051081.db2.gz	LIIFYOHZVFKSHB-ZWNOBZJWSA-N	0	3	301.356	2.000	10	0		DEAEHN
COc1ccc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c(OC)c1	ZINC000155824491	186115864	/nfs/dbraw/zinc/11/58/64/186115864.db2.gz	JZXSSNUQUJDGGR-DOMZBBRYSA-N	0	3	306.406	2.162	10	0		DEAEHN
COCCn1ncc(Br)c1[C@@](F)(CN)C(C)C	ZINC000164027085	186146433	/nfs/dbraw/zinc/14/64/33/186146433.db2.gz	GENXEHBUSQQVAZ-LLVKDONJSA-N	0	3	308.195	2.072	10	0		DEAEHN
CCn1ncc(Br)c1[C@@](C)(F)C[C@H]1COCCN1	ZINC000164056131	186147128	/nfs/dbraw/zinc/14/71/28/186147128.db2.gz	SJWIZJQLLMYXHX-CABZTGNLSA-N	0	3	320.206	2.229	10	0		DEAEHN
CCNCCS(=O)(=O)Nc1cc(C)ccc1Br	ZINC000164071072	186147629	/nfs/dbraw/zinc/14/76/29/186147629.db2.gz	AAFQRUOXTSABMY-UHFFFAOYSA-N	0	3	321.240	2.109	10	0		DEAEHN
CC(C)Cn1ncc(C(=O)N2CC[C@H](N(C)C)C2)c1C1CC1	ZINC000155870896	186119692	/nfs/dbraw/zinc/11/96/92/186119692.db2.gz	CSVUBHBMIKUVTP-AWEZNQCLSA-N	0	3	304.438	2.193	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1ccc(Br)c(C)c1	ZINC000159556506	186127094	/nfs/dbraw/zinc/12/70/94/186127094.db2.gz	UIWUDOXZBWUXFI-LBPRGKRZSA-N	0	3	315.211	2.450	10	0		DEAEHN
COCCC[C@@H](N)C(=O)Nc1ccc(F)cc1Br	ZINC000159595495	186129468	/nfs/dbraw/zinc/12/94/68/186129468.db2.gz	SQJOWCFWXZWRAM-SNVBAGLBSA-N	0	3	319.174	2.281	10	0		DEAEHN
O=C(Nc1ccccc1C(F)(F)F)OC[C@@H]1CNCCO1	ZINC000164142138	186150054	/nfs/dbraw/zinc/15/00/54/186150054.db2.gz	FWPKZTKNKUQCLL-VIFPVBQESA-N	0	3	304.268	2.242	10	0		DEAEHN
COCCC[C@H](N)C(=O)Nc1cc(Br)ccc1C	ZINC000159691012	186135548	/nfs/dbraw/zinc/13/55/48/186135548.db2.gz	FRNFFOAQUMTDEL-NSHDSACASA-N	0	3	315.211	2.450	10	0		DEAEHN
CCOC(=O)NCCNCc1csc(Br)c1	ZINC000163928952	186143063	/nfs/dbraw/zinc/14/30/63/186143063.db2.gz	WRWBDDVJMAEDDL-UHFFFAOYSA-N	0	3	307.213	2.346	10	0		DEAEHN
COc1ccc(CCNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1	ZINC000173285094	186172299	/nfs/dbraw/zinc/17/22/99/186172299.db2.gz	KNGPVWPRSCSODL-GOEBONIOSA-N	0	3	319.449	2.362	10	0		DEAEHN
C[C@@H](C[S@](C)=O)NCc1ccc(Br)c(F)c1	ZINC000164321707	186155717	/nfs/dbraw/zinc/15/57/17/186155717.db2.gz	RLCZBHHEYUVWKA-ZKANADHPSA-N	0	3	308.216	2.445	10	0		DEAEHN
Cc1ccc(Br)c(-n2nnnc2CNCC(C)C)c1	ZINC000164341918	186157165	/nfs/dbraw/zinc/15/71/65/186157165.db2.gz	HCQCZXVKZQNOFI-UHFFFAOYSA-N	0	3	324.226	2.479	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)Nc1cccc(N(C)C)n1	ZINC000181931303	186220340	/nfs/dbraw/zinc/22/03/40/186220340.db2.gz	HVFNRSOJYZLYRW-CYBMUJFWSA-N	0	3	305.426	2.144	10	0		DEAEHN
COC(=O)c1ccc(NC(=O)N2CCN3CCC[C@H]3C2)cc1C	ZINC000171893957	198003117	/nfs/dbraw/zinc/00/31/17/198003117.db2.gz	UFGIOOJMFUESCY-AWEZNQCLSA-N	0	3	317.389	2.094	10	0		DEAEHN
O=C(NCCc1ccc(Cl)s1)N1CCN2CCC[C@@H]2C1	ZINC000171902593	198005415	/nfs/dbraw/zinc/00/54/15/198005415.db2.gz	XORXYLFQFJLKPS-LLVKDONJSA-N	0	3	313.854	2.434	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)COc1ccc(F)cc1F	ZINC000172060048	198032681	/nfs/dbraw/zinc/03/26/81/198032681.db2.gz	HZNWHOACKRLUGN-WCQYABFASA-N	0	3	310.344	2.039	10	0		DEAEHN
CN1CC[C@H](N[C@H]2CCc3c2cccc3Br)C1=O	ZINC000172087577	198037283	/nfs/dbraw/zinc/03/72/83/198037283.db2.gz	BJJPUHXRDYITGS-STQMWFEESA-N	0	3	309.207	2.257	10	0		DEAEHN
COCCOc1ccc(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1	ZINC000172617187	198125057	/nfs/dbraw/zinc/12/50/57/198125057.db2.gz	QNVHCVQVBHYKLC-GDBMZVCRSA-N	0	3	320.433	2.267	10	0		DEAEHN
Cc1cc(CNC(=O)N2CC[C@H](N3CC=CC3)C2)ccc1F	ZINC000173615516	198232882	/nfs/dbraw/zinc/23/28/82/198232882.db2.gz	METMXFCVDPKTSR-HNNXBMFYSA-N	0	3	303.381	2.290	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NCc2ccc(Cl)nc2)CCN1C	ZINC000174120550	198294202	/nfs/dbraw/zinc/29/42/02/198294202.db2.gz	MBXQVSJGYKVPKG-YPMHNXCESA-N	0	3	310.829	2.359	10	0		DEAEHN
CCc1c(Cl)nc(C)nc1NC[C@H](O)CN1CCCCC1	ZINC000174684280	198370378	/nfs/dbraw/zinc/37/03/78/198370378.db2.gz	ULUBCIUIPYVUSL-LBPRGKRZSA-N	0	3	312.845	2.260	10	0		DEAEHN
O=C(CN1CCC[C@H]2CCCC[C@@H]21)NC(=O)NCC(F)(F)F	ZINC000007588425	354003830	/nfs/dbraw/zinc/00/38/30/354003830.db2.gz	PLJKDJJXFLRQDB-MNOVXSKESA-N	0	3	321.343	2.029	10	0		DEAEHN
CCCCCC(=O)NC[C@@H](C)NC[C@H](O)COc1ccccc1	ZINC000028264345	354100088	/nfs/dbraw/zinc/10/00/88/354100088.db2.gz	SSJXDSZSOGYJMJ-CVEARBPZSA-N	0	3	322.449	2.101	10	0		DEAEHN
CCCCNC(=O)C[C@H]1NCCc2cc(OC)c(OC)cc21	ZINC000041536457	354175344	/nfs/dbraw/zinc/17/53/44/354175344.db2.gz	AWXYJLLVZZVKAK-CQSZACIVSA-N	0	3	306.406	2.197	10	0		DEAEHN
c1ccc2c(c1)Cc1ccccc1-n1c-2nnc1N1CCNCC1	ZINC000004654917	181132834	/nfs/dbraw/zinc/13/28/34/181132834.db2.gz	GXFWOMYQHNODFA-UHFFFAOYSA-N	0	3	317.396	2.248	10	0	in-vivo	DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCCC[C@@H]1CCO	ZINC000070950223	354892712	/nfs/dbraw/zinc/89/27/12/354892712.db2.gz	LWEOOCFULVHZEM-QGZVFWFLSA-N	0	3	304.434	2.272	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N(C)CCc1ccccc1OC	ZINC000074498754	355033641	/nfs/dbraw/zinc/03/36/41/355033641.db2.gz	WBUUVPQIJVNNFH-INIZCTEOSA-N	0	3	319.449	2.363	10	0		DEAEHN
NCc1ccnc(I)c1C(F)(F)F	ZINC000306937386	356406056	/nfs/dbraw/zinc/40/60/56/356406056.db2.gz	LBQHALCKKJREGA-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
NCc1cnc(I)c(C(F)(F)F)c1	ZINC000306916659	356406555	/nfs/dbraw/zinc/40/65/55/356406555.db2.gz	XQEAVXRYMTUHFY-UHFFFAOYSA-N	0	3	302.037	2.164	10	0		DEAEHN
C[C@@H]1CN[C@@H](C(=O)N(Cc2ccccc2)Cc2ccccc2)CN1	ZINC000307733904	356409321	/nfs/dbraw/zinc/40/93/21/356409321.db2.gz	UCAGOTDVYANPQO-VQIMIIECSA-N	0	3	323.440	2.165	10	0		DEAEHN
CCC[C@H](N)C(=O)Nc1ccc(Cl)c(C[S@](C)=O)c1	ZINC000236936261	202080342	/nfs/dbraw/zinc/08/03/42/202080342.db2.gz	BBIUYQABKCXAKX-BUXKBTBVSA-N	0	3	302.827	2.284	10	0		DEAEHN
Brc1cccc(CN2CC[C@H]3OCCN[C@@H]3C2)c1	ZINC000404040304	356730886	/nfs/dbraw/zinc/73/08/86/356730886.db2.gz	AUGHSUDASURWLE-ZIAGYGMSSA-N	0	3	311.223	2.012	10	0		DEAEHN
Brc1ccc(CN2CC[C@H]3OCCN[C@@H]3C2)cc1	ZINC000404064907	356731806	/nfs/dbraw/zinc/73/18/06/356731806.db2.gz	JKBOJESEVASRLX-ZIAGYGMSSA-N	0	3	311.223	2.012	10	0		DEAEHN
CC[C@@](C)(N)C(=O)Nc1ccccc1I	ZINC000086801631	192600079	/nfs/dbraw/zinc/60/00/79/192600079.db2.gz	MPMSIHKAVRDACE-LLVKDONJSA-N	0	3	318.158	2.357	10	0		DEAEHN
CNCc1cc(S(=O)(=O)N2CCCC[C@@H]2C)cn1C1CC1	ZINC000088906841	192651095	/nfs/dbraw/zinc/65/10/95/192651095.db2.gz	FJSVZMDDRVIFRT-LBPRGKRZSA-N	0	3	311.451	2.106	10	0		DEAEHN
CN(C)C[C@@H]1CCCCN1C(=O)CN(C)c1ccc(Cl)cn1	ZINC000591202428	357689573	/nfs/dbraw/zinc/68/95/73/357689573.db2.gz	PEKOYRSYUNUROE-AWEZNQCLSA-N	0	3	324.856	2.114	10	0		DEAEHN
COc1ccc(C[C@H](C)C(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000179342986	199018814	/nfs/dbraw/zinc/01/88/14/199018814.db2.gz	YVUOMNVHYPYFHC-GOEBONIOSA-N	0	3	302.418	2.180	10	0		DEAEHN
CC(C)(C)NC(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C1CC1	ZINC000179750522	199076213	/nfs/dbraw/zinc/07/62/13/199076213.db2.gz	RNFGJBUQJZILEM-QGZVFWFLSA-N	0	3	318.417	2.413	10	0		DEAEHN
Cc1cccc(NC(=O)NC[C@H](O)CN2CCCCC2)c1F	ZINC000180001163	199105039	/nfs/dbraw/zinc/10/50/39/199105039.db2.gz	IDWXXJGPHWITPM-ZDUSSCGKSA-N	0	3	309.385	2.102	10	0		DEAEHN
CC1(CNC(=O)N2CCN3CCC[C@H]3C2)Cc2ccccc2C1	ZINC000180580993	199180071	/nfs/dbraw/zinc/18/00/71/199180071.db2.gz	WELXFSWXNYNGIP-KRWDZBQOSA-N	0	3	313.445	2.281	10	0		DEAEHN
CC[C@@H](CSC)NC(=O)c1ccccc1OCCN(C)C	ZINC000180555609	199175309	/nfs/dbraw/zinc/17/53/09/199175309.db2.gz	XXQNVHQKRFWUBO-ZDUSSCGKSA-N	0	3	310.463	2.498	10	0		DEAEHN
CC(C)C[C@H](CO)NC(=O)N[C@@H](C)CN(C)Cc1ccccc1	ZINC000181068210	199247687	/nfs/dbraw/zinc/24/76/87/199247687.db2.gz	BNLPGOOHCDGDSB-DOTOQJQBSA-N	0	3	321.465	2.213	10	0		DEAEHN
CN(Cc1ccc(OCc2nccn2C)cc1)CC1(CO)CC1	ZINC000186784857	200010753	/nfs/dbraw/zinc/01/07/53/200010753.db2.gz	GOUSZFYPYPXWPT-UHFFFAOYSA-N	0	3	315.417	2.203	10	0		DEAEHN
Cc1nccnc1[C@H](C)NC1CCN(CC(F)(F)F)CC1	ZINC000187915168	200175952	/nfs/dbraw/zinc/17/59/52/200175952.db2.gz	WZMTWHNGESGSRI-NSHDSACASA-N	0	3	302.344	2.462	10	0		DEAEHN
CCOC(C)(C)CNC(=O)c1ccccc1OCCN(C)C	ZINC000188391974	200239099	/nfs/dbraw/zinc/23/90/99/200239099.db2.gz	LFRVFPWSJIHNBW-UHFFFAOYSA-N	0	3	308.422	2.172	10	0		DEAEHN
CC(=O)CCC(C)(C)C(=O)N1CCC(N2CCCOCC2)CC1	ZINC000627740121	366606934	/nfs/dbraw/zinc/60/69/34/366606934.db2.gz	CKGYDBQRKCURQJ-UHFFFAOYSA-N	0	3	324.465	2.095	10	0		DEAEHN
COC[C@@H](N[C@H]1CCN(Cc2ccc(F)cc2)C1=O)C(C)C	ZINC000189049599	200341579	/nfs/dbraw/zinc/34/15/79/200341579.db2.gz	BOCQSVCFEHJZCS-JKSUJKDBSA-N	0	3	308.397	2.187	10	0		DEAEHN
CNS(=O)(=O)c1cccc(CN[C@H]2CC[C@@H]2C2CCC2)c1	ZINC000516787299	283523736	/nfs/dbraw/zinc/52/37/36/283523736.db2.gz	JOEMMTZILFNPOI-CVEARBPZSA-N	0	3	308.447	2.263	10	0		DEAEHN
CC[C@@H](CN1CCCC1)NC(=O)Cn1ncc2ccccc21	ZINC000605516812	360974869	/nfs/dbraw/zinc/97/48/69/360974869.db2.gz	GFCHOBWZMKRNRF-HNNXBMFYSA-N	0	3	300.406	2.027	10	0		DEAEHN
O=C(NCCNc1ccncc1)c1ccccc1OC1CCC1	ZINC000605331902	360961460	/nfs/dbraw/zinc/96/14/60/360961460.db2.gz	OIUSZTQRPRBVMI-UHFFFAOYSA-N	0	3	311.385	2.277	10	0		DEAEHN
COc1ccc(C(=O)Nc2cnn(CCN(C)C)c2)c(C)c1	ZINC000607821102	361114123	/nfs/dbraw/zinc/11/41/23/361114123.db2.gz	CFUCLVMUEXJHOD-UHFFFAOYSA-N	0	3	302.378	2.014	10	0		DEAEHN
CC(C)N(C)CC(=O)N[C@H](Cc1nccn1C)c1ccccc1	ZINC000608206565	361184405	/nfs/dbraw/zinc/18/44/05/361184405.db2.gz	YEFDHELIYRISDR-MRXNPFEDSA-N	0	3	314.433	2.160	10	0		DEAEHN
COCCNCc1cccc(SC[C@H](O)C(F)(F)F)c1	ZINC000090873170	192940338	/nfs/dbraw/zinc/94/03/38/192940338.db2.gz	JYTWPPWFABUCLK-LBPRGKRZSA-N	0	3	309.353	2.438	10	0		DEAEHN
CN[C@@H](Cc1ncnn1C)c1cc(F)cc(Br)c1	ZINC000091331021	193042690	/nfs/dbraw/zinc/04/26/90/193042690.db2.gz	FCGUNJBMDVBDIB-NSHDSACASA-N	0	3	313.174	2.220	10	0		DEAEHN
CO[C@H](CN[C@H](C)c1ccc(S(N)(=O)=O)cc1)C(C)(C)C	ZINC000091350125	193044727	/nfs/dbraw/zinc/04/47/27/193044727.db2.gz	OGBJXBGYILJCKG-BXUZGUMPSA-N	0	3	314.451	2.046	10	0		DEAEHN
NC(=O)c1ccsc1NC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2N1	ZINC000091360566	193045992	/nfs/dbraw/zinc/04/59/92/193045992.db2.gz	DWYXFQZWRYIACT-DLOVCJGASA-N	0	3	307.419	2.096	10	0		DEAEHN
CC[C@H](C)[C@H](N)C(=O)Nc1ccc(Br)c(C)n1	ZINC000091507090	193065964	/nfs/dbraw/zinc/06/59/64/193065964.db2.gz	AIFHSVBGHPKRAB-CPCISQLKSA-N	0	3	300.200	2.464	10	0		DEAEHN
O=c1cc(CNC[C@@H](O)c2ccccc2)[nH]c2ccc(F)cc12	ZINC000091738553	193100175	/nfs/dbraw/zinc/10/01/75/193100175.db2.gz	MGZGZPCJEFBYAB-GOSISDBHSA-N	0	3	312.344	2.490	10	0		DEAEHN
C[C@H]1CN(C2CCN(Cc3cnn(C(C)(C)C)c3)CC2)CCO1	ZINC000092091162	193156122	/nfs/dbraw/zinc/15/61/22/193156122.db2.gz	YFGIJBGRCRLAER-HNNXBMFYSA-N	0	3	320.481	2.323	10	0		DEAEHN
CCNCc1sc(S(=O)(=O)N2C[C@H](C)[C@H](C)C2)cc1C	ZINC000092113397	193161074	/nfs/dbraw/zinc/16/10/74/193161074.db2.gz	HKTMERJABUGVOL-TXEJJXNPSA-N	0	3	316.492	2.443	10	0		DEAEHN
CCCN(C(C)C)S(=O)(=O)c1ccc(CNC)cc1F	ZINC000092115608	193163010	/nfs/dbraw/zinc/16/30/10/193163010.db2.gz	IFIDIMIZCJTALU-UHFFFAOYSA-N	0	3	302.415	2.354	10	0		DEAEHN
Cc1ccccc1N(C)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092116034	193163964	/nfs/dbraw/zinc/16/39/64/193163964.db2.gz	KKZMIXNZOXCGTP-UHFFFAOYSA-N	0	3	308.378	2.418	10	0		DEAEHN
COc1ccc(CNCC[C@@H](O)C(F)F)c(Cl)c1OC	ZINC000631217945	368084844	/nfs/dbraw/zinc/08/48/44/368084844.db2.gz	YJLSKQZBVUZILO-SECBINFHSA-N	0	3	309.740	2.463	10	0		DEAEHN
c1nc2c(ncnc2N2CC(N3CCCC3)C2)n1-c1ccccc1	ZINC000631354117	368170245	/nfs/dbraw/zinc/17/02/45/368170245.db2.gz	WIQILFRSWJPNQM-UHFFFAOYSA-N	0	3	320.400	2.100	10	0		DEAEHN
c1c(CN2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)nnn1CC1CC1	ZINC000451626426	243222607	/nfs/dbraw/zinc/22/26/07/243222607.db2.gz	KRDCBIQTSXUSHR-SJORKVTESA-N	0	3	316.449	2.469	10	0		DEAEHN
C[C@H](C(N)=S)N1CCN(C[C@H]2CSc3ccccc32)CC1	ZINC000092275972	193184005	/nfs/dbraw/zinc/18/40/05/193184005.db2.gz	PGDWAQYGVHFONO-OLZOCXBDSA-N	0	3	321.515	2.168	10	0		DEAEHN
C[C@H](O)C1CCN(Cc2cn(C)nc2-c2ccncc2)CC1	ZINC000092970729	193190345	/nfs/dbraw/zinc/19/03/45/193190345.db2.gz	SOYLCSBBAPTYNM-ZDUSSCGKSA-N	0	3	300.406	2.075	10	0		DEAEHN
CCCNCc1c(N(CC)CC(C)(C)O)nc2sccn12	ZINC000092971226	193190919	/nfs/dbraw/zinc/19/09/19/193190919.db2.gz	TZCMJAQXVJBYCC-UHFFFAOYSA-N	0	3	310.467	2.493	10	0		DEAEHN
O=C(CC/C=C\c1ccccc1)NC[C@H]1CCCN1CCCO	ZINC000452362147	244193941	/nfs/dbraw/zinc/19/39/41/244193941.db2.gz	KNEVOTWQDYHFRL-BQTUVJDFSA-N	0	3	316.445	2.443	10	0		DEAEHN
CCC[C@](C)(N)C(=O)NC[C@H](c1ccco1)N1CCCCC1	ZINC000262297141	203253994	/nfs/dbraw/zinc/25/39/94/203253994.db2.gz	JIBCGCKFPRPJEM-PBHICJAKSA-N	0	3	307.438	2.440	10	0		DEAEHN
C[S@@](=O)Cc1cc(NC(=O)[C@H]2CCCCN2)ccc1Cl	ZINC000262483916	203305032	/nfs/dbraw/zinc/30/50/32/203305032.db2.gz	SYSKLFROWSSISX-ZUOKHONESA-N	0	3	314.838	2.299	10	0		DEAEHN
CCOC(=O)[C@]1(N)CCC[C@H]1CCN(C)CCC(F)(F)F	ZINC000093596064	193270912	/nfs/dbraw/zinc/27/09/12/193270912.db2.gz	VMZJFWRMDLBBBD-AAEUAGOBSA-N	0	3	310.360	2.321	10	0		DEAEHN
COc1c(C)cc(CN2CCN(C[C@H]3CCOC3)CC2)cc1C	ZINC000093817568	193312465	/nfs/dbraw/zinc/31/24/65/193312465.db2.gz	UUPINJNZIMLDON-QGZVFWFLSA-N	0	3	318.461	2.466	10	0		DEAEHN
CCCN[C@@]1(C(=O)OC)CC[C@H](N(C)CCC(F)(F)F)C1	ZINC000093831863	193315073	/nfs/dbraw/zinc/31/50/73/193315073.db2.gz	GOLDLXKAIDQKKJ-AAEUAGOBSA-N	0	3	310.360	2.335	10	0		DEAEHN
COc1ccc(S[C@@H]2CC[C@@](NC3CC3)(C(N)=O)C2)cc1	ZINC000093850427	193317688	/nfs/dbraw/zinc/31/76/88/193317688.db2.gz	WCPPGQJVGDICTO-ZBFHGGJFSA-N	0	3	306.431	2.316	10	0		DEAEHN
CN[C@H](c1cccc(C(F)(F)F)c1)[C@H]1CN(C)CCN1C	ZINC000093894383	193325166	/nfs/dbraw/zinc/32/51/66/193325166.db2.gz	TUTNGVHBTVLJPB-ZIAGYGMSSA-N	0	3	301.356	2.212	10	0		DEAEHN
CCNCc1cc(F)c(OCC(=O)N[C@H](C)CC)c(F)c1	ZINC000094347054	193363699	/nfs/dbraw/zinc/36/36/99/193363699.db2.gz	FQJQOKSXMMLMPI-SNVBAGLBSA-N	0	3	300.349	2.368	10	0		DEAEHN
CNCc1cc(F)c(OCC(=O)N[C@H](C)C(C)C)c(F)c1	ZINC000094346654	193363827	/nfs/dbraw/zinc/36/38/27/193363827.db2.gz	JGYGGVLRVLXGAW-SNVBAGLBSA-N	0	3	300.349	2.224	10	0		DEAEHN
CC(C)(C)NCc1cc(F)c(OCCS(C)(=O)=O)c(F)c1	ZINC000094347751	193363832	/nfs/dbraw/zinc/36/38/32/193363832.db2.gz	CTPWCGWXKWZZCV-UHFFFAOYSA-N	0	3	321.389	2.276	10	0		DEAEHN
Nc1cc(Br)ccc1CN[C@H]1CCN(C2CC2)C1	ZINC000094047799	193341623	/nfs/dbraw/zinc/34/16/23/193341623.db2.gz	ADXBPJZDXMPGDG-LBPRGKRZSA-N	0	3	310.239	2.358	10	0		DEAEHN
Cc1cc(NC(=O)c2cc[nH]c(=NN)c2)ncc1Br	ZINC000094064448	193343597	/nfs/dbraw/zinc/34/35/97/193343597.db2.gz	HOAMBTREEAUTGH-UHFFFAOYSA-N	0	3	322.166	2.085	10	0		DEAEHN
CC[C@](C)(N)C(=O)N1CCN(Cc2ccc(Cl)s2)CC1	ZINC000094234378	193352871	/nfs/dbraw/zinc/35/28/71/193352871.db2.gz	MBEIIGMILSZGRP-AWEZNQCLSA-N	0	3	315.870	2.173	10	0		DEAEHN
CC(C)CNCc1ncnn1[C@@H]1CCO[C@]2(CCSC2)C1	ZINC000094412856	193368716	/nfs/dbraw/zinc/36/87/16/193368716.db2.gz	UKNGFLRGWCTHFT-UKRRQHHQSA-N	0	3	310.467	2.251	10	0		DEAEHN
CCNCc1nc(CN2C[C@H]3CCCCN3C[C@@H]2C)cs1	ZINC000094443696	193369572	/nfs/dbraw/zinc/36/95/72/193369572.db2.gz	PQGRKPDQERIYDG-DZGCQCFKSA-N	0	3	308.495	2.311	10	0		DEAEHN
CN(c1nc(Br)cn2ccnc12)[C@@H]1CCCN(C)C1	ZINC000094490483	193373807	/nfs/dbraw/zinc/37/38/07/193373807.db2.gz	CKFSIXFSNOAFCJ-SNVBAGLBSA-N	0	3	324.226	2.022	10	0		DEAEHN
CNc1c(C(=O)NC[C@@H](C)N(C)C)cccc1C(F)(F)F	ZINC000094598814	193382988	/nfs/dbraw/zinc/38/29/88/193382988.db2.gz	WDJINNISRNSVPN-SECBINFHSA-N	0	3	303.328	2.427	10	0		DEAEHN
CN[C@H](Cc1ncnn1C)c1cccc(C(F)(F)F)c1F	ZINC000094601263	193384103	/nfs/dbraw/zinc/38/41/03/193384103.db2.gz	QADMYQATSKAMCE-SNVBAGLBSA-N	0	3	302.275	2.476	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@H](C(=O)N1CCN(C)[C@H](C)[C@@H]1C)CC2	ZINC000530289636	284396568	/nfs/dbraw/zinc/39/65/68/284396568.db2.gz	FKVROCGMKNQUAX-HZSPNIEDSA-N	0	3	318.465	2.189	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N1CCN(C)[C@H](C)[C@@H]1C)C2	ZINC000530289636	284396571	/nfs/dbraw/zinc/39/65/71/284396571.db2.gz	FKVROCGMKNQUAX-HZSPNIEDSA-N	0	3	318.465	2.189	10	0		DEAEHN
O=S1(=O)C[C@H](NCc2ccccc2)[C@H](c2ccccc2)C1	ZINC000019794340	182150189	/nfs/dbraw/zinc/15/01/89/182150189.db2.gz	VMIVEXMISUDXGH-IRXDYDNUSA-N	0	3	301.411	2.357	10	0		DEAEHN
NC[C@@H](c1ccccc1Br)N1CCSCC1	ZINC000020257147	182200867	/nfs/dbraw/zinc/20/08/67/182200867.db2.gz	FUGNRIBCGBSZSE-LBPRGKRZSA-N	0	3	301.253	2.498	10	0		DEAEHN
Nc1cc(Cl)ccc1NC(=O)CCCN1CCC(O)CC1	ZINC000021508786	182276863	/nfs/dbraw/zinc/27/68/63/182276863.db2.gz	SCLWYVHPJXNGOM-UHFFFAOYSA-N	0	3	311.813	2.098	10	0		DEAEHN
COCCN(Cc1ccc(C)cc1)C[C@H](O)COCC(C)C	ZINC000036094962	182798377	/nfs/dbraw/zinc/79/83/77/182798377.db2.gz	DMEJAOCBCZGTKF-SFHVURJKSA-N	0	3	309.450	2.477	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N(C)C[C@H](C)C(=O)OC(C)(C)C	ZINC000458369640	248278554	/nfs/dbraw/zinc/27/85/54/248278554.db2.gz	WCYHREOBHFJHQF-UONOGXRCSA-N	0	3	312.454	2.297	10	0		DEAEHN
O=C(NCCNc1ccncc1)C1(c2cccc(F)c2)CCC1	ZINC000488535576	248801384	/nfs/dbraw/zinc/80/13/84/248801384.db2.gz	UKUVIRLNIITXII-UHFFFAOYSA-N	0	3	313.376	2.293	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2c3ncsc3ccc2Cl)C1	ZINC000040632734	183111854	/nfs/dbraw/zinc/11/18/54/183111854.db2.gz	JEDIJPLIOFRBRF-IONNQARKSA-N	0	3	311.794	2.265	10	0		DEAEHN
CCN(CC)[C@H](CNC(=O)N1CCOCC1)c1ccc(C)cc1	ZINC000040615398	183109898	/nfs/dbraw/zinc/10/98/98/183109898.db2.gz	QHTMDMVDHAJDBY-QGZVFWFLSA-N	0	3	319.449	2.420	10	0		DEAEHN
CCCC[C@@H](N)C(=O)NCCc1ccc(OC(F)F)cc1	ZINC000040832840	183139217	/nfs/dbraw/zinc/13/92/17/183139217.db2.gz	ZVLLWAXGAWWVFQ-CYBMUJFWSA-N	0	3	300.349	2.464	10	0		DEAEHN
CC(C)[C@@H](N)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000040834187	183140187	/nfs/dbraw/zinc/14/01/87/183140187.db2.gz	XPGGGUQJGQUPRL-CQSZACIVSA-N	0	3	309.797	2.389	10	0		DEAEHN
COc1ccc([C@H](NC(=O)[C@@H](N)CCSC)C2CC2)cc1	ZINC000040856193	183143246	/nfs/dbraw/zinc/14/32/46/183143246.db2.gz	VVKSKKZSXYSVIZ-LSDHHAIUSA-N	0	3	308.447	2.343	10	0		DEAEHN
COc1ccc2c(c1)nc(C)cc2N(C)[C@H]1CCS(=O)(=O)C1	ZINC000041478769	183193999	/nfs/dbraw/zinc/19/39/99/183193999.db2.gz	CAZZPXPNCTYIBD-LBPRGKRZSA-N	0	3	320.414	2.175	10	0		DEAEHN
CCCNCc1c(N(CCCO)C(C)C)nc2sccn12	ZINC000042511545	183278498	/nfs/dbraw/zinc/27/84/98/183278498.db2.gz	LXGXJZMINBMOKU-UHFFFAOYSA-N	0	3	310.467	2.493	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)c2cncc(Br)c2)C1	ZINC000042356372	183257659	/nfs/dbraw/zinc/25/76/59/183257659.db2.gz	SENMOIQAXBCBPE-LBPRGKRZSA-N	0	3	312.211	2.058	10	0		DEAEHN
COCCN([C@@H](CN)c1ccc(SC)cc1)[C@@H](C)COC	ZINC000042606649	183290248	/nfs/dbraw/zinc/29/02/48/183290248.db2.gz	UQSAHDDHOBYCGA-BBRMVZONSA-N	0	3	312.479	2.392	10	0		DEAEHN
CCN([C@H](C)COC)[C@@H](CN)c1ccc(Br)o1	ZINC000042743816	183304441	/nfs/dbraw/zinc/30/44/41/183304441.db2.gz	ICYSANVVVWMMST-ZJUUUORDSA-N	0	3	305.216	2.399	10	0		DEAEHN
CC[C@H](N)[C@H](c1ccc(Cl)cc1)N1CCC[C@@H]1C(=O)NC	ZINC000042946417	183320966	/nfs/dbraw/zinc/32/09/66/183320966.db2.gz	TYUACKBSMNSQOG-ZNMIVQPWSA-N	0	3	309.841	2.329	10	0		DEAEHN
CS(=O)(=O)c1cccc(O[C@H](CN)c2cccc(F)c2)c1	ZINC000042974200	183325562	/nfs/dbraw/zinc/32/55/62/183325562.db2.gz	UPNBBFBQMXKLCG-OAHLLOKOSA-N	0	3	309.362	2.308	10	0		DEAEHN
C[C@@H](N(C)S(=O)(=O)c1cccc2c1CCNC2)C(C)(C)C	ZINC000042781276	183308445	/nfs/dbraw/zinc/30/84/45/183308445.db2.gz	UFODMXJJSUARDU-GFCCVEGCSA-N	0	3	310.463	2.387	10	0		DEAEHN
Cn1cc([C@H](CN)Oc2c(F)c(F)c(F)c(F)c2F)cn1	ZINC000043236404	183345842	/nfs/dbraw/zinc/34/58/42/183345842.db2.gz	KUZRAMZOBQLWKP-LURJTMIESA-N	0	3	307.222	2.194	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccc(Br)s1)N1CCC(O)CC1	ZINC000043258820	183348954	/nfs/dbraw/zinc/34/89/54/183348954.db2.gz	ALEXZEHWKQXYFY-PRHODGIISA-N	0	3	319.268	2.356	10	0		DEAEHN
NC[C@@H](c1ccccc1Br)N1CCC[C@H](CO)C1	ZINC000043092158	183335762	/nfs/dbraw/zinc/33/57/62/183335762.db2.gz	MHWJPZDSPYCLJU-FZMZJTMJSA-N	0	3	313.239	2.153	10	0		DEAEHN
O=c1nc(C(F)(F)F)c2c([nH]1)C(=Cc1ccccc1)CNC2	ZINC000043464099	183364852	/nfs/dbraw/zinc/36/48/52/183364852.db2.gz	LZHRVXHXXSFNLV-UXBLZVDNSA-N	0	3	307.275	2.433	10	0		DEAEHN
C[C@@H]1CC(=O)N(C[C@H](N)c2cccc(C(F)(F)F)c2)C1=O	ZINC000043513043	183369129	/nfs/dbraw/zinc/36/91/29/183369129.db2.gz	AYWWYLZGZHJAAV-KCJUWKMLSA-N	0	3	300.280	2.100	10	0		DEAEHN
O=C(NCc1cscn1)N1CCC[C@H]1CN1CCCCC1	ZINC000105210115	194085286	/nfs/dbraw/zinc/08/52/86/194085286.db2.gz	IWAAIMFJWSOJRD-AWEZNQCLSA-N	0	3	308.451	2.303	10	0		DEAEHN
CCCCCNC(=O)[C@@H](C)N[C@H]1CCc2nc(C(C)C)nn2C1	ZINC000105874076	194153211	/nfs/dbraw/zinc/15/32/11/194153211.db2.gz	HSMDZXWWQVRMAQ-KGLIPLIRSA-N	0	3	321.469	2.001	10	0		DEAEHN
CC(C)Oc1cccc(CN2CCN(C[C@@H](C)O)[C@@H](C)C2)c1	ZINC000106098380	194185539	/nfs/dbraw/zinc/18/55/39/194185539.db2.gz	IMYDHTZKPBOAEC-JKSUJKDBSA-N	0	3	306.450	2.361	10	0		DEAEHN
CCOC(=O)[C@H](C)Oc1c(Br)cccc1CNC	ZINC000049954930	183765263	/nfs/dbraw/zinc/76/52/63/183765263.db2.gz	DAXJRTPWVGQGPN-VIFPVBQESA-N	0	3	316.195	2.499	10	0		DEAEHN
CNc1ccc(C(=O)NC[C@H](C)N(C)C)cc1C(F)(F)F	ZINC000050779931	183803747	/nfs/dbraw/zinc/80/37/47/183803747.db2.gz	LJLNIDFWFXQBOD-VIFPVBQESA-N	0	3	303.328	2.427	10	0		DEAEHN
Cc1cc(C)c(CN2CCN([C@H](C)C(N)=S)CC2)c(C)c1	ZINC000109468478	194267181	/nfs/dbraw/zinc/26/71/81/194267181.db2.gz	RBNCWIVTHHAVCF-OAHLLOKOSA-N	0	3	305.491	2.404	10	0		DEAEHN
COC[C@H](N)Cc1nc(-c2ccccc2Br)no1	ZINC000109518132	194271165	/nfs/dbraw/zinc/27/11/65/194271165.db2.gz	JWWIROWBYLPMJG-MRVPVSSYSA-N	0	3	312.167	2.015	10	0		DEAEHN
CNCc1cc(Br)cnc1OC[C@H]1CCCO1	ZINC000051526479	183828669	/nfs/dbraw/zinc/82/86/69/183828669.db2.gz	BUJPBWLPVAHNQC-LLVKDONJSA-N	0	3	301.184	2.121	10	0		DEAEHN
CCCN([C@H]1CCCNC1)S(=O)(=O)c1ccc(CC)s1	ZINC000110942238	194372254	/nfs/dbraw/zinc/37/22/54/194372254.db2.gz	KYBPJCRHDDSPNM-LBPRGKRZSA-N	0	3	316.492	2.463	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)CSCc1ccncc1	ZINC000058887139	184130620	/nfs/dbraw/zinc/13/06/20/184130620.db2.gz	QYMFCEXZULSGLH-AWEZNQCLSA-N	0	3	307.463	2.305	10	0		DEAEHN
O=S(=O)(CCC1CC[NH2+]CC1)[N-]c1cc(F)cc(F)c1F	ZINC000061120351	184162761	/nfs/dbraw/zinc/16/27/61/184162761.db2.gz	OSONQHSMGHMNDC-UHFFFAOYSA-N	0	3	322.352	2.235	10	0		DEAEHN
CC(C)c1ncc(Cl)c(C(=O)N2CCC[C@@H]2CN(C)C)n1	ZINC000061644508	184180612	/nfs/dbraw/zinc/18/06/12/184180612.db2.gz	LLRXAPBRXITJNX-LLVKDONJSA-N	0	3	310.829	2.420	10	0		DEAEHN
COc1ccc(C[C@]2(O)CCN(C)C2)cc1Br	ZINC000061986843	184199704	/nfs/dbraw/zinc/19/97/04/184199704.db2.gz	KBVQELNQVPKKFH-CYBMUJFWSA-N	0	3	300.196	2.067	10	0		DEAEHN
CCCNc1ccc(Cl)c(C(=O)NCCN(C)C2CC2)n1	ZINC000062011895	184201176	/nfs/dbraw/zinc/20/11/76/184201176.db2.gz	HUKNQFNQXDATDY-UHFFFAOYSA-N	0	3	310.829	2.381	10	0		DEAEHN
C[C@@H](c1ccccc1F)N(C)S(=O)(=O)C[C@@H]1CCCCN1	ZINC000062027844	184202387	/nfs/dbraw/zinc/20/23/87/184202387.db2.gz	ZDEIQDNAOGFRLG-STQMWFEESA-N	0	3	314.426	2.290	10	0		DEAEHN
C[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccccc1CN	ZINC000062187548	184216724	/nfs/dbraw/zinc/21/67/24/184216724.db2.gz	RECPYSSPBMHQFX-ZDUSSCGKSA-N	0	3	304.415	2.055	10	0		DEAEHN
Cc1ccc([C@@H](CNC(=O)Nc2nncs2)N(C)C)cc1	ZINC000062428379	184235722	/nfs/dbraw/zinc/23/57/22/184235722.db2.gz	HPNOLABPIXPRLF-GFCCVEGCSA-N	0	3	305.407	2.271	10	0		DEAEHN
CCCN[C@@H](C)c1ccc(F)cc1OCCS(C)(=O)=O	ZINC000062747224	184252096	/nfs/dbraw/zinc/25/20/96/184252096.db2.gz	VBZOSMCKNHUSLK-NSHDSACASA-N	0	3	303.399	2.310	10	0		DEAEHN
CNc1ccc(Cl)c(C(=O)N2CC[C@H](N3CCCC3)C2)n1	ZINC000062984930	184264993	/nfs/dbraw/zinc/26/49/93/184264993.db2.gz	SAYHTKHELVOFAD-NSHDSACASA-N	0	3	308.813	2.087	10	0		DEAEHN
Cc1ccc(CN)c(Sc2ccc(S(C)(=O)=O)cc2)n1	ZINC000063131490	184272410	/nfs/dbraw/zinc/27/24/10/184272410.db2.gz	IUNJERAQRVUHGM-UHFFFAOYSA-N	0	3	308.428	2.403	10	0		DEAEHN
CC[NH2+][C@@H](C)c1ccccc1[N-]S(=O)(=O)C[C@H]1CCCO1	ZINC000063155745	184274546	/nfs/dbraw/zinc/27/45/46/184274546.db2.gz	COQQGIATUQZSGD-QWHCGFSZSA-N	0	3	312.435	2.278	10	0		DEAEHN
[NH3+][C@H]1CCC[C@H]1[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000063175821	184276656	/nfs/dbraw/zinc/27/66/56/184276656.db2.gz	GGEREEBUWAXNRJ-VHSXEESVSA-N	0	3	309.218	2.152	10	0		DEAEHN
Cc1nc(-c2cccc(NC(=O)NC3CCN(C)CC3)c2)no1	ZINC000064545540	184299282	/nfs/dbraw/zinc/29/92/82/184299282.db2.gz	GZXJQAZZLFMYMT-UHFFFAOYSA-N	0	3	315.377	2.261	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)CCc1nc(C(C)C)no1	ZINC000120206731	195118739	/nfs/dbraw/zinc/11/87/39/195118739.db2.gz	QYTDTVQIXZXHSA-ZDUSSCGKSA-N	0	3	310.442	2.218	10	0		DEAEHN
Cc1cc(S(=O)(=O)NCC2(C)CCCC2)cc(CN)c1F	ZINC000159117322	197328562	/nfs/dbraw/zinc/32/85/62/197328562.db2.gz	WOZVTRJECDHOSI-UHFFFAOYSA-N	0	3	314.426	2.451	10	0		DEAEHN
CN1CCN(Nc2cc(Cl)nc(-c3ccccc3)n2)CC1	ZINC000159099567	197327617	/nfs/dbraw/zinc/32/76/17/197327617.db2.gz	XEDXZZILNCGJMS-UHFFFAOYSA-N	0	3	303.797	2.371	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2CCC[C@@H]2C)cc(C)c1F	ZINC000159074911	197324561	/nfs/dbraw/zinc/32/45/61/197324561.db2.gz	RNPPAAPCFGNNSY-LBPRGKRZSA-N	0	3	314.426	2.417	10	0		DEAEHN
Cc1cc(S(=O)(=O)N(C)[C@@H](C)C2CC2)cc(CN)c1F	ZINC000159071135	197324587	/nfs/dbraw/zinc/32/45/87/197324587.db2.gz	CUFPRBNDMWUHDG-JTQLQIEISA-N	0	3	300.399	2.012	10	0		DEAEHN
COCCn1ncc(Br)c1[C@H](N)CC(F)(F)F	ZINC000158903282	197309970	/nfs/dbraw/zinc/30/99/70/197309970.db2.gz	HQUJMHACKKFGDA-SSDOTTSWSA-N	0	3	316.121	2.244	10	0		DEAEHN
CN([C@@H](CN)c1ccc(Br)cc1F)[C@@H]1CCOC1	ZINC000158679874	197294068	/nfs/dbraw/zinc/29/40/68/197294068.db2.gz	IAYXMCBHVFMWJO-MFKMUULPSA-N	0	3	317.202	2.309	10	0		DEAEHN
COCCSCCCN1C[C@@]2(CCOC2)OC(C)(C)C1	ZINC000376136611	285126478	/nfs/dbraw/zinc/12/64/78/285126478.db2.gz	VFJCOXIEKHQRCH-OAHLLOKOSA-N	0	3	303.468	2.026	10	0		DEAEHN
CNCc1cnc(Oc2ccc(S(C)(=O)=O)cc2)c(C)c1	ZINC000158413725	197269798	/nfs/dbraw/zinc/26/97/98/197269798.db2.gz	VWWXTCOHEZUAOW-UHFFFAOYSA-N	0	3	306.387	2.305	10	0		DEAEHN
CC(C)[C@H](O)CC(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000158301433	197260450	/nfs/dbraw/zinc/26/04/50/197260450.db2.gz	RCYASUZMHNWXOT-GDBMZVCRSA-N	0	3	324.490	2.483	10	0		DEAEHN
CCOCCN(C)c1nc(C(C)C)c(CNCCOC)s1	ZINC000157724907	197210695	/nfs/dbraw/zinc/21/06/95/197210695.db2.gz	MCVLPQDLWPVFAM-UHFFFAOYSA-N	0	3	315.483	2.475	10	0		DEAEHN
CC(C)(C)[C@@H](N)C(=O)Nc1ccc(OCC(F)(F)F)nc1	ZINC000157634756	197203917	/nfs/dbraw/zinc/20/39/17/197203917.db2.gz	FUPKFJPRIIRNLN-JTQLQIEISA-N	0	3	305.300	2.335	10	0		DEAEHN
CN(C)[C@H](CNC(=O)c1nnc(Cl)s1)c1ccccc1	ZINC000157245088	197172661	/nfs/dbraw/zinc/17/26/61/197172661.db2.gz	RCNQRZLWZJMSTL-SNVBAGLBSA-N	0	3	310.810	2.224	10	0		DEAEHN
Cn1nc(-c2ccccc2)c(CN2CC[C@H](C(N)=O)C2)c1Cl	ZINC000157203613	197169660	/nfs/dbraw/zinc/16/96/60/197169660.db2.gz	FGACYCLNYFMOAU-LBPRGKRZSA-N	0	3	318.808	2.048	10	0		DEAEHN
COc1ccc([S@@](=O)Cc2ccc(OC)c(CN)c2)cc1	ZINC000155948075	197076630	/nfs/dbraw/zinc/07/66/30/197076630.db2.gz	HSCCMQAJJOEQOO-OAQYLSRUSA-N	0	3	305.399	2.470	10	0		DEAEHN
CCC(=O)Nc1cccc(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000155441566	197055960	/nfs/dbraw/zinc/05/59/60/197055960.db2.gz	LZZPOWSHMVFEIW-BBRMVZONSA-N	0	3	317.433	2.494	10	0		DEAEHN
COc1cc2c(cc1F)ncnc2N1CC[C@@H](N2CC=CC2)C1	ZINC000302551353	533165330	/nfs/dbraw/zinc/16/53/30/533165330.db2.gz	IIXSSAMGFZYQEV-GFCCVEGCSA-N	0	3	314.364	2.228	10	0		DEAEHN
Cc1nnc(CN2CCN(CCC(C)(C)C)CC2)n1C1CC1	ZINC000154948474	197006818	/nfs/dbraw/zinc/00/68/18/197006818.db2.gz	GGEVNQLYDIMGJC-UHFFFAOYSA-N	0	3	305.470	2.475	10	0		DEAEHN
C[C@@H](O)CN1CCN(Cc2ccc(Cl)c(F)c2)C[C@@H]1C	ZINC000120666082	195212168	/nfs/dbraw/zinc/21/21/68/195212168.db2.gz	ANWFWOUESWAPAI-NWDGAFQWSA-N	0	3	300.805	2.366	10	0		DEAEHN
CC[C@@H]1CN(C/C=C/c2ccccc2OC)CCN1C[C@@H](C)O	ZINC000120727725	195225129	/nfs/dbraw/zinc/22/51/29/195225129.db2.gz	BBAASKIBXDFEQK-XPAKDJPHSA-N	0	3	318.461	2.485	10	0		DEAEHN
Cc1ccc(CN2C[C@H]3COC[C@@]3(c3nnc(C4CC4)o3)C2)o1	ZINC000248087985	257109509	/nfs/dbraw/zinc/10/95/09/257109509.db2.gz	KTSCTXWLVDKGQN-GUYCJALGSA-N	0	3	315.373	2.248	10	0		DEAEHN
Cc1cccc(CN2CC[C@@H]3C[C@H](C(=O)NC4CC4)O[C@H]3C2)c1	ZINC000247894251	257115313	/nfs/dbraw/zinc/11/53/13/257115313.db2.gz	GOMWXRTUDCGHKE-NXHRZFHOSA-N	0	3	314.429	2.253	10	0		DEAEHN
CO[C@@H]1CCN(CC2CC2)[C@H]2CN(Cc3cccnc3)C[C@H]21	ZINC000247859830	257116639	/nfs/dbraw/zinc/11/66/39/257116639.db2.gz	VWYJKYSQMGTZKH-FGTMMUONSA-N	0	3	301.434	2.013	10	0		DEAEHN
O=C(C1CCCCC1)N1C[C@H]2CN(CC3CC3)CCO[C@H]2C1	ZINC000247803895	257117872	/nfs/dbraw/zinc/11/78/72/257117872.db2.gz	HNCFWKUSPQNWQO-SJORKVTESA-N	0	3	306.450	2.136	10	0		DEAEHN
CC1(C)Cc2cccc(CN3CC[C@H](N4CCOCC4)C3)c2O1	ZINC000121001180	195277785	/nfs/dbraw/zinc/27/77/85/195277785.db2.gz	HTOQETJFNONAKD-KRWDZBQOSA-N	0	3	316.445	2.307	10	0		DEAEHN
C[C@H](NC[C@H](O)Cn1cccn1)c1cccc(Br)c1	ZINC000038012399	132478538	/nfs/dbraw/zinc/47/85/38/132478538.db2.gz	OMWDVJFAIGZDIZ-FZMZJTMJSA-N	0	3	324.222	2.357	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc([C@@H]2C[C@@H]2c2cccc(F)c2F)n1	ZINC000263251784	132579423	/nfs/dbraw/zinc/57/94/23/132579423.db2.gz	PZJIHOBXWBZNLR-NQBHXWOUSA-N	0	3	320.343	2.195	10	0		DEAEHN
C[C@H](Cc1cccc(F)c1)c1nc([C@@H]2CNCCN2C)no1	ZINC000263283223	132580602	/nfs/dbraw/zinc/58/06/02/132580602.db2.gz	UPNFPPNUTDZQHV-RISCZKNCSA-N	0	3	304.369	2.131	10	0		DEAEHN
COCCN(Cc1cccs1)C(=O)CC1CCN(C)CC1	ZINC000362508555	133234501	/nfs/dbraw/zinc/23/45/01/133234501.db2.gz	YPYZKPIPWDPJPF-UHFFFAOYSA-N	0	3	310.463	2.455	10	0		DEAEHN
Cc1cnn(CCN2CCC(COc3ccccn3)CC2)c1	ZINC000362867731	133256215	/nfs/dbraw/zinc/25/62/15/133256215.db2.gz	YZCAPGSCTNOTDJ-UHFFFAOYSA-N	0	3	300.406	2.378	10	0		DEAEHN
O=S1(=O)CC[C@H](N[C@@H]2CCO[C@H](C3CC3)C2)c2ccccc21	ZINC000186415094	144982154	/nfs/dbraw/zinc/98/21/54/144982154.db2.gz	GAOOTMWSRJDSKK-KBMXLJTQSA-N	0	3	321.442	2.452	10	0		DEAEHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)c1cn2ccnc2s1	ZINC000188361848	145011052	/nfs/dbraw/zinc/01/10/52/145011052.db2.gz	OAEDKGXEYGXAQJ-NWDGAFQWSA-N	0	3	306.435	2.246	10	0		DEAEHN
O=C(Cc1c[nH]c2ncccc12)NCc1ccc2c(c1)CNC2	ZINC000188656938	145015223	/nfs/dbraw/zinc/01/52/23/145015223.db2.gz	AIFPALMWFQBZOR-UHFFFAOYSA-N	0	3	306.369	2.025	10	0		DEAEHN
Cc1cc2c(cc1C)[C@H](C(=O)N1CCN3CCC1CC3)CO2	ZINC000188628731	145015277	/nfs/dbraw/zinc/01/52/77/145015277.db2.gz	PYERPRFNESWVBZ-MRXNPFEDSA-N	0	3	300.402	2.086	10	0		DEAEHN
COCc1cccc(CC(=O)N2CCCN(C3CC3)CC2)c1	ZINC000188814240	145017995	/nfs/dbraw/zinc/01/79/95/145017995.db2.gz	RKADLPIZIODVTO-UHFFFAOYSA-N	0	3	302.418	2.072	10	0		DEAEHN
CCN(C)c1ccc(CNCCNC(=O)c2ccccc2)cn1	ZINC000190892449	145049809	/nfs/dbraw/zinc/04/98/09/145049809.db2.gz	OVOMTUKYWAUIRE-UHFFFAOYSA-N	0	3	312.417	2.057	10	0		DEAEHN
CC[C@H](O)CN1CCN(Cc2ccc(OCC3CC3)cc2)CC1	ZINC000191346367	145056349	/nfs/dbraw/zinc/05/63/49/145056349.db2.gz	DLSZYBJFTIBWBJ-SFHVURJKSA-N	0	3	318.461	2.364	10	0		DEAEHN
CCOC1CC(CCNC(=O)N2CCCN(C3CC3)CC2)C1	ZINC000191684169	145062517	/nfs/dbraw/zinc/06/25/17/145062517.db2.gz	HDORWBYHVGPOAP-UHFFFAOYSA-N	0	3	309.454	2.071	10	0		DEAEHN
C[C@H]1COCCN1CCN1CCC(Nc2ccccc2F)CC1	ZINC000192760765	145078422	/nfs/dbraw/zinc/07/84/22/145078422.db2.gz	PKNLWQARGDOKPY-HNNXBMFYSA-N	0	3	321.440	2.423	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1ccc(N(C)C)cc1F	ZINC000246605052	145108109	/nfs/dbraw/zinc/10/81/09/145108109.db2.gz	HMBMYJQFTILHQX-OCCSQVGLSA-N	0	3	305.397	2.200	10	0		DEAEHN
C[C@H](CNC(=O)N1CC[C@@H]2OCCC[C@H]2C1)N1CCC[C@@H](C)C1	ZINC000246695391	145110992	/nfs/dbraw/zinc/11/09/92/145110992.db2.gz	NBDQDRDSMDRZEY-NCOADZHNSA-N	0	3	323.481	2.317	10	0		DEAEHN
Cc1ccc(N2CCC[C@H](N(C)C[C@H]3CCOC3)C2=O)cc1	ZINC000247098400	145126457	/nfs/dbraw/zinc/12/64/57/145126457.db2.gz	QFNPADQGXMTZQH-WBVHZDCISA-N	0	3	302.418	2.459	10	0		DEAEHN
C[C@H](C(=O)N1CCC(c2ccnn2C)CC1)N1[C@H](C)CC[C@H]1C	ZINC000247366304	145134463	/nfs/dbraw/zinc/13/44/63/145134463.db2.gz	NANCEZGPUHNKRT-RBSFLKMASA-N	0	3	318.465	2.387	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)[C@H](C)Oc2cccc(F)c2)[C@@H](C)C1	ZINC000247354494	145134910	/nfs/dbraw/zinc/13/49/10/145134910.db2.gz	OFDDEQXXQHRSPG-XEZPLFJOSA-N	0	3	308.397	2.438	10	0		DEAEHN
C[C@H](C(=O)N1CCC(Cn2cccn2)CC1)N1[C@H](C)CC[C@H]1C	ZINC000247371600	145135508	/nfs/dbraw/zinc/13/55/08/145135508.db2.gz	NVFPWTRHOYJCFV-BZUAXINKSA-N	0	3	318.465	2.383	10	0		DEAEHN
Cc1ccc(C[C@@H](C)NC(=O)N2CCN3CCC[C@H]3C2)s1	ZINC000247401707	145136287	/nfs/dbraw/zinc/13/62/87/145136287.db2.gz	RLHXTRJEVSPBGO-OCCSQVGLSA-N	0	3	307.463	2.477	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)CSC[C@H]2CCCCO2)CCN1C	ZINC000247442010	145137350	/nfs/dbraw/zinc/13/73/50/145137350.db2.gz	PNPONEWIJXXZAI-QLFBSQMISA-N	0	3	314.495	2.230	10	0		DEAEHN
COc1ccc([C@@H](C)NC(=O)N2CCN3CCC[C@H]3C2)cc1F	ZINC000247474133	145138530	/nfs/dbraw/zinc/13/85/30/145138530.db2.gz	HSCLJJJCEPYQBM-OCCSQVGLSA-N	0	3	321.396	2.385	10	0		DEAEHN
CN(CCN1CCC[C@@H](CCC(N)=O)C1)Cc1ccc(F)cc1	ZINC000248541975	145157864	/nfs/dbraw/zinc/15/78/64/145157864.db2.gz	CFBUQIWGQXBCFK-HNNXBMFYSA-N	0	3	321.440	2.235	10	0		DEAEHN
CN(CCN1CCS[C@@H]2COCC[C@H]21)Cc1ccc(F)cc1	ZINC000248558462	145158699	/nfs/dbraw/zinc/15/86/99/145158699.db2.gz	IUNSXQFDPWAQAB-IAGOWNOFSA-N	0	3	324.465	2.464	10	0		DEAEHN
CCCCn1cc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c(C)n1	ZINC000248571895	145159502	/nfs/dbraw/zinc/15/95/02/145159502.db2.gz	MPKLHNZKYIKBON-UKRRQHHQSA-N	0	3	304.438	2.300	10	0		DEAEHN
COC1(CNC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)CCC1	ZINC000248600264	145161074	/nfs/dbraw/zinc/16/10/74/145161074.db2.gz	UILKUJBDLKPGMQ-HZPDHXFCSA-N	0	3	317.433	2.300	10	0		DEAEHN
Cc1ccc(Cl)c(OC[C@@H](O)CN(C)C[C@H]2CCCO2)c1	ZINC000248616302	145161486	/nfs/dbraw/zinc/16/14/86/145161486.db2.gz	ZBAPCJWVYHNCLV-UONOGXRCSA-N	0	3	313.825	2.499	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCO[C@@H](C3CC3)C2)CCN1C	ZINC000248867924	145170885	/nfs/dbraw/zinc/17/08/85/145170885.db2.gz	QHOVEKRRWUUVIQ-SLBVQIDZSA-N	0	3	309.454	2.068	10	0		DEAEHN
NC(=O)[C@H](Cc1ccc(Cl)cc1)N1CC[C@@H]2OCCC[C@H]2C1	ZINC000248879055	145171735	/nfs/dbraw/zinc/17/17/35/145171735.db2.gz	NPDOBMPNFGCWJD-BPUTZDHNSA-N	0	3	322.836	2.237	10	0		DEAEHN
Cc1nsc(N2CCCN(C[C@@H](O)CC3CCCC3)CC2)n1	ZINC000248971873	145174591	/nfs/dbraw/zinc/17/45/91/145174591.db2.gz	SJEJEIMQVATEND-HNNXBMFYSA-N	0	3	324.494	2.300	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCO[C@@H](c3ccccc3)C2)C1	ZINC000249772042	145189867	/nfs/dbraw/zinc/18/98/67/145189867.db2.gz	SXDRHRNSAINFNJ-IAGOWNOFSA-N	0	3	317.433	2.254	10	0		DEAEHN
CC1(C)CCCN[C@H]1C(=O)Nc1ccc(C(=O)NC2CC2)cc1	ZINC000261619001	145211105	/nfs/dbraw/zinc/21/11/05/145211105.db2.gz	BZIAIYQEIXAZRJ-HNNXBMFYSA-N	0	3	315.417	2.296	10	0		DEAEHN
Cc1cccc2nc(CN3CCNC[C@H]3c3cccnc3)cn21	ZINC000261663644	145215043	/nfs/dbraw/zinc/21/50/43/145215043.db2.gz	HAZMNTCRQZHWCI-KRWDZBQOSA-N	0	3	307.401	2.184	10	0		DEAEHN
CCCC(=O)Nc1cccc(NC(=O)C2(N)CCOCC2)c1C	ZINC000261755831	145223251	/nfs/dbraw/zinc/22/32/51/145223251.db2.gz	FMUXKDFADYKFPP-UHFFFAOYSA-N	0	3	319.405	2.180	10	0		DEAEHN
Cc1cccc(C2(CNC(=O)C3(N)CCOCC3)CCCC2)c1	ZINC000261933107	145244028	/nfs/dbraw/zinc/24/40/28/145244028.db2.gz	WLQCTANGEYNCOF-UHFFFAOYSA-N	0	3	316.445	2.431	10	0		DEAEHN
C[C@@H]1CN2CCCC[C@H]2CN1C(=O)C[C@H](N)c1ccccc1	ZINC000262041474	145256024	/nfs/dbraw/zinc/25/60/24/145256024.db2.gz	BYHLWYRMMOBOMR-PVAVHDDUSA-N	0	3	301.434	2.162	10	0		DEAEHN
COc1ccc(OC)c([C@H](C)NC(=O)[C@H]2C[C@@H](C)CCN2)c1	ZINC000262490919	145287518	/nfs/dbraw/zinc/28/75/18/145287518.db2.gz	LAQFSFXDILFOAN-SLEUVZQESA-N	0	3	306.406	2.269	10	0		DEAEHN
CN(C)C(=O)c1ccc(NC(=O)[C@@H]2NCCCC2(C)C)cc1	ZINC000262543790	145291613	/nfs/dbraw/zinc/29/16/13/145291613.db2.gz	RLSRFRLDEXUHRE-AWEZNQCLSA-N	0	3	303.406	2.105	10	0		DEAEHN
CCc1nc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)sc1C	ZINC000262575857	145294402	/nfs/dbraw/zinc/29/44/02/145294402.db2.gz	YDGADXMJSPVYBM-RSAASHCRSA-N	0	3	323.462	2.485	10	0		DEAEHN
COCCNCCNC(=O)[C@H](Sc1ccccc1)C(C)C	ZINC000262665267	145299135	/nfs/dbraw/zinc/29/91/35/145299135.db2.gz	OJFGTTYSCIYONG-OAHLLOKOSA-N	0	3	310.463	2.156	10	0		DEAEHN
Cc1cccc2[nH]c(CCC(=O)N3CCN[C@@H](C)[C@@H]3C)nc21	ZINC000262772909	145304514	/nfs/dbraw/zinc/30/45/14/145304514.db2.gz	LNIIDQFUSGBRBZ-STQMWFEESA-N	0	3	300.406	2.013	10	0		DEAEHN
Cc1cccc2nc(CCC(=O)N3CCN[C@@H](C)[C@@H]3C)[nH]c21	ZINC000262772909	145304519	/nfs/dbraw/zinc/30/45/19/145304519.db2.gz	LNIIDQFUSGBRBZ-STQMWFEESA-N	0	3	300.406	2.013	10	0		DEAEHN
C[C@@H]1NCCN(C(=O)c2ccn(-c3cccc(Cl)c3)n2)[C@H]1C	ZINC000262787910	145304694	/nfs/dbraw/zinc/30/46/94/145304694.db2.gz	MQABGMXTYMLVOK-RYUDHWBXSA-N	0	3	318.808	2.348	10	0		DEAEHN
CCc1ccc([C@@H](C)c2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263189005	145334220	/nfs/dbraw/zinc/33/42/20/145334220.db2.gz	HQSNJSDHMLHHNR-DOMZBBRYSA-N	0	3	300.406	2.360	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(/C=C/c2ccc3ccccc3n2)n1	ZINC000263214272	145337540	/nfs/dbraw/zinc/33/75/40/145337540.db2.gz	KPAHBLILTIRSNR-ROJDOSBLSA-N	0	3	321.384	2.364	10	0		DEAEHN
CC(=O)N(C)C1CCN(Cc2cc(-n3ccnc3)cs2)CC1	ZINC000346172277	146030735	/nfs/dbraw/zinc/03/07/35/146030735.db2.gz	LJOIMBTXAJZIOJ-UHFFFAOYSA-N	0	3	318.446	2.377	10	0		DEAEHN
CN(C[C@@H]1CCCN(C)C1)C(=O)NCc1ccc2cc[nH]c2n1	ZINC000360711871	147372650	/nfs/dbraw/zinc/37/26/50/147372650.db2.gz	GQPGQQPTDBDDOM-CYBMUJFWSA-N	0	3	315.421	2.046	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)[C@H]1CCc2nc(C(C)C)[nH]c2C1	ZINC000372392135	148203366	/nfs/dbraw/zinc/20/33/66/148203366.db2.gz	ACEUEJVKIHUMDQ-KBPBESRZSA-N	0	3	318.465	2.239	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)[C@H]1CCc2[nH]c(C(C)C)nc2C1	ZINC000372392135	148203368	/nfs/dbraw/zinc/20/33/68/148203368.db2.gz	ACEUEJVKIHUMDQ-KBPBESRZSA-N	0	3	318.465	2.239	10	0		DEAEHN
CC(C)c1nc2c([nH]1)CC[C@H](C(=O)N(C)[C@H]1CCCN(C)C1)C2	ZINC000375264357	148349419	/nfs/dbraw/zinc/34/94/19/148349419.db2.gz	YUBIGSIMESJPDJ-KBPBESRZSA-N	0	3	318.465	2.191	10	0		DEAEHN
CC(C)c1nc2c([nH]1)C[C@@H](C(=O)N(C)[C@H]1CCCN(C)C1)CC2	ZINC000375264357	148349421	/nfs/dbraw/zinc/34/94/21/148349421.db2.gz	YUBIGSIMESJPDJ-KBPBESRZSA-N	0	3	318.465	2.191	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H](C)c1ccccc1	ZINC000111790453	401723744	/nfs/dbraw/zinc/72/37/44/401723744.db2.gz	DPPUEZBSODKENM-GOEBONIOSA-N	0	3	305.422	2.158	10	0		DEAEHN
COCCN(C)CCNC(=O)N[C@H]1CCCc2cc(F)ccc21	ZINC000127198368	401724111	/nfs/dbraw/zinc/72/41/11/401724111.db2.gz	KHHPCHINUNMGBE-INIZCTEOSA-N	0	3	323.412	2.081	10	0		DEAEHN
C[C@H]1CN(C(=O)C2CCN(C)CC2)C[C@@H](c2ccc(F)cc2)O1	ZINC000073989780	401727084	/nfs/dbraw/zinc/72/70/84/401727084.db2.gz	DCBKIUDJFJTUIE-GUYCJALGSA-N	0	3	320.408	2.456	10	0		DEAEHN
COC(=O)[C@H](C)[C@H](NC[C@H](O)COC(C)(C)C)c1ccccc1	ZINC000127378903	401732099	/nfs/dbraw/zinc/73/20/99/401732099.db2.gz	REIBRJGIBFJSBH-KBMXLJTQSA-N	0	3	323.433	2.302	10	0		DEAEHN
CCc1ccc(NC(=O)C(=O)NCCN2CCCC[C@H]2C)cc1	ZINC000071917788	401697372	/nfs/dbraw/zinc/69/73/72/401697372.db2.gz	GSQVXTSMWMZELI-CQSZACIVSA-N	0	3	317.433	2.178	10	0		DEAEHN
Cc1cnn(CCC(=O)N[C@@H](CN(C)C)c2ccccc2)c1	ZINC000126555553	401699121	/nfs/dbraw/zinc/69/91/21/401699121.db2.gz	YVDIYHWEVATTMJ-INIZCTEOSA-N	0	3	300.406	2.001	10	0		DEAEHN
COc1ccc(C)nc1NC(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000127067633	401719096	/nfs/dbraw/zinc/71/90/96/401719096.db2.gz	MUWJUESTESNEMO-QWHCGFSZSA-N	0	3	304.394	2.099	10	0		DEAEHN
C[C@@H](CCNCc1cc(Cl)c2c(c1)OCCO2)[S@@](C)=O	ZINC000129384679	401803532	/nfs/dbraw/zinc/80/35/32/401803532.db2.gz	AEPYPICSRUVAPJ-FVINQWEUSA-N	0	3	317.838	2.358	10	0		DEAEHN
CCOc1c(CNCCCN2CCCC2=O)cccc1OC	ZINC000013727713	401804066	/nfs/dbraw/zinc/80/40/66/401804066.db2.gz	FZCLLALSTMXRFM-UHFFFAOYSA-N	0	3	306.406	2.196	10	0		DEAEHN
COc1ccc(C)nc1NC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1	ZINC000128063356	401761429	/nfs/dbraw/zinc/76/14/29/401761429.db2.gz	GZNZCHMZZRSZFT-CHWSQXEVSA-N	0	3	306.410	2.345	10	0		DEAEHN
Cc1c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cnn1-c1ccccc1	ZINC000113224757	401770600	/nfs/dbraw/zinc/77/06/00/401770600.db2.gz	SUECECRERBXQJL-YOEHRIQHSA-N	0	3	324.428	2.489	10	0		DEAEHN
CC[C@H](CO)N1CCN(CCCOc2ccccc2C)CC1	ZINC000075961615	401775168	/nfs/dbraw/zinc/77/51/68/401775168.db2.gz	YKHSEZZZZUKJFP-QGZVFWFLSA-N	0	3	306.450	2.152	10	0		DEAEHN
COC(=O)[C@@H](C)CN(Cc1ccccc1)C(=O)CN(C)C(C)C	ZINC000128531913	401781644	/nfs/dbraw/zinc/78/16/44/401781644.db2.gz	OVLLPUNULCHSBC-HNNXBMFYSA-N	0	3	320.433	2.165	10	0		DEAEHN
COc1cccc(CN2CCC[C@H](Cn3cncn3)C2)c1OC	ZINC000128562492	401783054	/nfs/dbraw/zinc/78/30/54/401783054.db2.gz	BZLOVCRIYUBGLO-AWEZNQCLSA-N	0	3	316.405	2.208	10	0		DEAEHN
Cc1cccn2c(CN3CCC[C@@H](Cn4cncn4)C3)cnc12	ZINC000128604080	401784761	/nfs/dbraw/zinc/78/47/61/401784761.db2.gz	HJHBFKLQBWNXLG-OAHLLOKOSA-N	0	3	310.405	2.146	10	0		DEAEHN
CC(C)CC[C@@](C)(O)CNC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000077776961	401830669	/nfs/dbraw/zinc/83/06/69/401830669.db2.gz	NTAIVTVQHJLVRP-DOTOQJQBSA-N	0	3	315.502	2.449	10	0		DEAEHN
CS(=O)(=O)N1CCC[C@H](CN2CCC[C@@H]2c2ccco2)C1	ZINC000131732415	401855610	/nfs/dbraw/zinc/85/56/10/401855610.db2.gz	ZGECPXWPRQDHTE-ZIAGYGMSSA-N	0	3	312.435	2.088	10	0		DEAEHN
CN(C)C[C@@H]1CN(C(=O)c2ccc(C(C)(C)C)cc2)CCO1	ZINC000116788422	401859211	/nfs/dbraw/zinc/85/92/11/401859211.db2.gz	SSLAINNTISKSGD-MRXNPFEDSA-N	0	3	304.434	2.387	10	0		DEAEHN
CCCn1cc(CN[C@@H](CO)Cc2c[nH]c3ccccc23)cn1	ZINC000116918095	401864392	/nfs/dbraw/zinc/86/43/92/401864392.db2.gz	XGDOZUNRKDQQMF-MRXNPFEDSA-N	0	3	312.417	2.468	10	0		DEAEHN
CC(C)COc1ccc(NC(=O)N2CC[C@@H](N(C)C)C2)cn1	ZINC000117009392	401867038	/nfs/dbraw/zinc/86/70/38/401867038.db2.gz	XCTWNEWTJWJNSY-CQSZACIVSA-N	0	3	306.410	2.284	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)N1CCO[C@H](c2cccc(O)c2)C1	ZINC000135229660	401931424	/nfs/dbraw/zinc/93/14/24/401931424.db2.gz	KSEMINFWWXTQOP-IRXDYDNUSA-N	0	3	318.417	2.167	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1ccc(F)cc1C	ZINC000032073045	401876247	/nfs/dbraw/zinc/87/62/47/401876247.db2.gz	QNJCMBOLEHPASS-GFCCVEGCSA-N	0	3	302.415	2.143	10	0		DEAEHN
O=C(C[C@@H]1CSCCN1)NCc1ccccc1OC1CCC1	ZINC000133014934	401878058	/nfs/dbraw/zinc/87/80/58/401878058.db2.gz	VMJCHQJWGYFLTN-CQSZACIVSA-N	0	3	320.458	2.329	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCc2ccccc2OC2CCC2)C1	ZINC000118586788	401901162	/nfs/dbraw/zinc/90/11/62/401901162.db2.gz	VZGFMBIQKJPMMR-HNNXBMFYSA-N	0	3	317.433	2.463	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)Nc2cc(Cl)ccc2F)CCO1	ZINC000118795358	401907904	/nfs/dbraw/zinc/90/79/04/401907904.db2.gz	KYBQODXKJTVRRY-NSHDSACASA-N	0	3	315.776	2.273	10	0		DEAEHN
CCC[C@@H](C(=O)NCCCN1CCc2ccccc21)N(C)C	ZINC000135008146	401923678	/nfs/dbraw/zinc/92/36/78/401923678.db2.gz	KTEUAVQQSIZRLL-KRWDZBQOSA-N	0	3	303.450	2.286	10	0		DEAEHN
O=S(=O)([C@@H]1CCN(CC2CCCCC2)C1)N1CCCC1	ZINC000135750314	401952465	/nfs/dbraw/zinc/95/24/65/401952465.db2.gz	ZBKRQXCTRCDBCZ-OAHLLOKOSA-N	0	3	300.468	2.067	10	0		DEAEHN
CCN(CC)C(=O)[C@@H]1CCCN1CCCCn1ccnc1C	ZINC000119574781	401959246	/nfs/dbraw/zinc/95/92/46/401959246.db2.gz	LWSPUDVNDWKHJD-INIZCTEOSA-N	0	3	306.454	2.305	10	0		DEAEHN
CCOc1ccccc1NC(=O)CCN1CCN(C2CC2)CC1	ZINC000136766942	401973475	/nfs/dbraw/zinc/97/34/75/401973475.db2.gz	JSYYVZNRIXIJOZ-UHFFFAOYSA-N	0	3	317.433	2.194	10	0		DEAEHN
COc1cc(C)cc(C(=O)N[C@@H](CC(C)C)CN(C)C)c1O	ZINC000137106831	401979098	/nfs/dbraw/zinc/97/90/98/401979098.db2.gz	XLPIWWAAJCHOCF-ZDUSSCGKSA-N	0	3	308.422	2.415	10	0		DEAEHN
COc1ccc([C@H](C)NC(=O)C[C@H]2CSCCN2)cc1F	ZINC000091135122	401994398	/nfs/dbraw/zinc/99/43/98/401994398.db2.gz	UUFOJWBBFDJNJM-JQWIXIFHSA-N	0	3	312.410	2.107	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)C(=O)Nc2ccccc2Cl)[C@@H](C)C1	ZINC000150778754	401995543	/nfs/dbraw/zinc/99/55/43/401995543.db2.gz	LTKDGQBBOFVCKP-FZMZJTMJSA-N	0	3	323.824	2.123	10	0		DEAEHN
CCc1ccccc1NC(=O)C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000150792027	401996165	/nfs/dbraw/zinc/99/61/65/401996165.db2.gz	HFZVNUPRDXTYTJ-XJKSGUPXSA-N	0	3	317.433	2.032	10	0		DEAEHN
NN=c1[nH]cc(Br)cc1C(=O)NCc1ccccc1	ZINC000051092342	402031263	/nfs/dbraw/zinc/03/12/63/402031263.db2.gz	XEBGCDLHBNQGBF-UHFFFAOYSA-N	0	3	321.178	2.060	10	0		DEAEHN
COCCN(C)CCCNC(=O)Nc1ccc2oc(C)nc2c1	ZINC000121423732	402035117	/nfs/dbraw/zinc/03/51/17/402035117.db2.gz	ODPOFXQIBRRXNC-UHFFFAOYSA-N	0	3	320.393	2.226	10	0		DEAEHN
CC1(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000150865272	402001446	/nfs/dbraw/zinc/00/14/46/402001446.db2.gz	RPIQGEIEVAUPIQ-KRWDZBQOSA-N	0	3	316.445	2.348	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cc(-c3ccncc3)on2)CCN1C	ZINC000123283924	402119967	/nfs/dbraw/zinc/11/99/67/402119967.db2.gz	KNYIGTODTSMFSY-OCCSQVGLSA-N	0	3	314.389	2.291	10	0		DEAEHN
Cc1nc(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)no1	ZINC000122417943	402077427	/nfs/dbraw/zinc/07/74/27/402077427.db2.gz	RGVBRKICGJYDHC-QGZVFWFLSA-N	0	3	314.389	2.163	10	0		DEAEHN
CCN1CCN(C[C@@H](C)CNC(=O)NCCC2=CCCC2)CC1	ZINC000122476398	402080320	/nfs/dbraw/zinc/08/03/20/402080320.db2.gz	VSBCVBZOEWHHQB-INIZCTEOSA-N	0	3	322.497	2.060	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)COCCOc2ccccc2)CCN1C	ZINC000122776965	402093808	/nfs/dbraw/zinc/09/38/08/402093808.db2.gz	JBXGSOTVKASOLO-CVEARBPZSA-N	0	3	320.433	2.023	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)COCCOc2ccccc2)CCN1C	ZINC000122777163	402093820	/nfs/dbraw/zinc/09/38/20/402093820.db2.gz	JBXGSOTVKASOLO-HOTGVXAUSA-N	0	3	320.433	2.023	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2ccc(OC)c(F)c2)C1	ZINC000057825368	402097077	/nfs/dbraw/zinc/09/70/77/402097077.db2.gz	NQEYABLZZDRSEF-ZDUSSCGKSA-N	0	3	309.385	2.118	10	0		DEAEHN
COc1ccc(CCCC(=O)N2CC[C@H](N(C)C)C2)c(OC)c1	ZINC000152571307	402100639	/nfs/dbraw/zinc/10/06/39/402100639.db2.gz	PRCUHHZJBNFFEP-HNNXBMFYSA-N	0	3	320.433	2.189	10	0		DEAEHN
CC(C)COC[C@H](NC1CCN(C(N)=O)CC1)c1ccco1	ZINC000152570802	402101092	/nfs/dbraw/zinc/10/10/92/402101092.db2.gz	UMAQGUWSBUJCHV-AWEZNQCLSA-N	0	3	309.410	2.126	10	0		DEAEHN
COc1ccc(OC)c(CC(=O)NCCN2CCCC[C@H]2C)c1	ZINC000097327098	402121544	/nfs/dbraw/zinc/12/15/44/402121544.db2.gz	GTNJHPWFCNDQQD-CQSZACIVSA-N	0	3	320.433	2.237	10	0		DEAEHN
CN1CC[C@H]2[C@H](CCCN2C(=O)NCc2ccc(Cl)cn2)C1	ZINC000097049623	402102770	/nfs/dbraw/zinc/10/27/70/402102770.db2.gz	ORURRGCYUBTQKT-DOMZBBRYSA-N	0	3	322.840	2.361	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CCOc3ccccc32)CCN1C	ZINC000122962246	402103559	/nfs/dbraw/zinc/10/35/59/402103559.db2.gz	GRZSSJKJGHBQSE-IIAWOOMASA-N	0	3	302.418	2.494	10	0		DEAEHN
COc1cccc(OCC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000123008800	402105428	/nfs/dbraw/zinc/10/54/28/402105428.db2.gz	GIPDBMSVHPKOEJ-KBPBESRZSA-N	0	3	306.406	2.015	10	0		DEAEHN
CC(=O)c1cccc(OCC(=O)NCCN2CCCC[C@@H]2C)c1	ZINC000060524114	402105459	/nfs/dbraw/zinc/10/54/59/402105459.db2.gz	QMIKHXCNALEBID-AWEZNQCLSA-N	0	3	318.417	2.259	10	0		DEAEHN
COCc1ccc(CNC(=O)N2CCCN(C3CC3)CC2)cc1	ZINC000061862379	402108894	/nfs/dbraw/zinc/10/88/94/402108894.db2.gz	UJYUFMCKGJTHMX-UHFFFAOYSA-N	0	3	317.433	2.213	10	0		DEAEHN
CCCNC(=O)COc1ccc(OCCN2CCCCC2)cc1	ZINC000063457391	402112560	/nfs/dbraw/zinc/11/25/60/402112560.db2.gz	LZAQWKIYRHGHQP-UHFFFAOYSA-N	0	3	320.433	2.456	10	0		DEAEHN
COc1ccc(NC(=O)N2CC[C@@H](N(C)C)C2)c2cccnc12	ZINC000123229985	402116974	/nfs/dbraw/zinc/11/69/74/402116974.db2.gz	NYSFHZKSBWTSFB-GFCCVEGCSA-N	0	3	314.389	2.411	10	0		DEAEHN
CCc1ccc([C@H](CNC(=O)NC[C@@H](O)C(C)C)N(C)C)cc1	ZINC000152948002	402118538	/nfs/dbraw/zinc/11/85/38/402118538.db2.gz	OMHCKGZPKJSZSG-DLBZAZTESA-N	0	3	321.465	2.168	10	0		DEAEHN
CN1CCO[C@H]2CN(c3ccnc4cc(Cl)ccc43)C[C@@H]21	ZINC000153183997	402131426	/nfs/dbraw/zinc/13/14/26/402131426.db2.gz	MSAYLTYGPLSKAJ-HOTGVXAUSA-N	0	3	303.793	2.407	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCc1ccc2c(c1)OCO2	ZINC000123341117	402122647	/nfs/dbraw/zinc/12/26/47/402122647.db2.gz	DDIKKLAAYFDRLZ-CQSZACIVSA-N	0	3	321.421	2.191	10	0		DEAEHN
Cc1cc(NC(=O)C(=O)NCCN2CCCC[C@@H]2C)ccc1F	ZINC000103322929	402185332	/nfs/dbraw/zinc/18/53/32/402185332.db2.gz	KEBIGWYCGMPQKI-ZDUSSCGKSA-N	0	3	321.396	2.063	10	0		DEAEHN
CC(=O)c1ccc(NC(=O)CCN(C)C[C@@H]2CCCO2)cc1	ZINC000103480604	402190648	/nfs/dbraw/zinc/19/06/48/402190648.db2.gz	ZYVLKCTVWLMZNG-INIZCTEOSA-N	0	3	304.390	2.329	10	0		DEAEHN
Cc1nccn1C[C@@H](C)CNC(=O)NCCN1CCCC[C@@H]1C	ZINC000124114482	402164136	/nfs/dbraw/zinc/16/41/36/402164136.db2.gz	UMFBKHNMZYDPEX-GJZGRUSLSA-N	0	3	321.469	2.001	10	0		DEAEHN
C[C@H](NC(=O)N1CCN(CC2CCCCC2)CC1)[C@@H]1CCCO1	ZINC000067699394	402168494	/nfs/dbraw/zinc/16/84/94/402168494.db2.gz	WLUMEXBQPPPWBS-RDJZCZTQSA-N	0	3	323.481	2.461	10	0		DEAEHN
CCOCCNC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000067734296	402170598	/nfs/dbraw/zinc/17/05/98/402170598.db2.gz	LPKKJOWFLCHGOF-KRWDZBQOSA-N	0	3	319.449	2.377	10	0		DEAEHN
CC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1	ZINC000124273944	402172056	/nfs/dbraw/zinc/17/20/56/402172056.db2.gz	GAMRRTRACOJABQ-WBMJQRKESA-N	0	3	303.406	2.200	10	0		DEAEHN
CC[C@H](C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1)N(C)C	ZINC000125258893	402222330	/nfs/dbraw/zinc/22/23/30/402222330.db2.gz	XILYEFQGIKVGNL-WMLDXEAASA-N	0	3	319.449	2.120	10	0		DEAEHN
COc1cc(F)c(NC(=O)N2CC[C@H](N(C)C)C2)cc1OC	ZINC000107379674	402232011	/nfs/dbraw/zinc/23/20/11/402232011.db2.gz	VFGMKCYUFPLBMX-JTQLQIEISA-N	0	3	311.357	2.011	10	0		DEAEHN
CCC[C@H](C(=O)NC[C@@H](C)N(C)Cc1ccccc1)N(C)C	ZINC000154878211	402237317	/nfs/dbraw/zinc/23/73/17/402237317.db2.gz	CRTALKUFTSYMPK-NVXWUHKLSA-N	0	3	305.466	2.353	10	0		DEAEHN
CCCC[C@@H](NC(=O)CN(C)C(C)C)C(=O)OC(C)(C)C	ZINC000155224632	402249746	/nfs/dbraw/zinc/24/97/46/402249746.db2.gz	MJNPTKCCLDVINS-CYBMUJFWSA-N	0	3	300.443	2.343	10	0		DEAEHN
CC(C)(O)CNC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000108566855	402257142	/nfs/dbraw/zinc/25/71/42/402257142.db2.gz	GYJLIJFNXJNWSU-INIZCTEOSA-N	0	3	319.449	2.111	10	0		DEAEHN
C[C@H](CNC(=O)N1CCO[C@@H](c2ccsc2)C1)N(C)C1CC1	ZINC000124968655	402206267	/nfs/dbraw/zinc/20/62/67/402206267.db2.gz	HNDRSOXAQKMQIB-IUODEOHRSA-N	0	3	323.462	2.314	10	0		DEAEHN
NC(=O)NC(=O)CN1CCCC[C@@H]1CCCc1ccccc1	ZINC000125074886	402211898	/nfs/dbraw/zinc/21/18/98/402211898.db2.gz	VDQMKQDOQJHMHP-OAHLLOKOSA-N	0	3	303.406	2.059	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)N[C@@H]2CCCOC2)CN1Cc1ccccc1	ZINC000176597473	402322070	/nfs/dbraw/zinc/32/20/70/402322070.db2.gz	ABSXIIYWOSTPGI-OIISXLGYSA-N	0	3	317.433	2.128	10	0		DEAEHN
C[C@H](C(=O)N1CCO[C@H](CN(C)C)C1)c1ccc(Cl)s1	ZINC000176608363	402323263	/nfs/dbraw/zinc/32/32/63/402323263.db2.gz	SWBLKZJGPLRCAN-WDEREUQCSA-N	0	3	316.854	2.294	10	0		DEAEHN
CCCNC(=O)[C@H]1CCCN(Cc2ncc(C)c(OC)c2C)C1	ZINC000110030747	402279877	/nfs/dbraw/zinc/27/98/77/402279877.db2.gz	WPCRHBRCGNPMJU-HNNXBMFYSA-N	0	3	319.449	2.445	10	0		DEAEHN
COCCN1CCC[C@H]1CNC(=O)Nc1ccc(C)c(F)c1	ZINC000110085524	402281002	/nfs/dbraw/zinc/28/10/02/402281002.db2.gz	RSQNCFWXLZAYES-AWEZNQCLSA-N	0	3	309.385	2.366	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)NCCCn1nc(C)cc1C	ZINC000176140745	402282847	/nfs/dbraw/zinc/28/28/47/402282847.db2.gz	HDGVEVJTSQSXQS-MRXNPFEDSA-N	0	3	321.469	2.016	10	0		DEAEHN
CC(C)N1CCCC[C@@H]1C(=O)N1CCC(c2ccnn2C)CC1	ZINC000156674164	402286576	/nfs/dbraw/zinc/28/65/76/402286576.db2.gz	WBVQSIIJVZZWLJ-QGZVFWFLSA-N	0	3	318.465	2.389	10	0		DEAEHN
Cc1ccc(C[C@H](C)N(C)CCN2C(=O)NC(C)(C)C2=O)cc1	ZINC000156879424	402289422	/nfs/dbraw/zinc/28/94/22/402289422.db2.gz	WBQURTNBSUOWGR-AWEZNQCLSA-N	0	3	317.433	2.188	10	0		DEAEHN
Cc1cccc2[nH]c(CCC(=O)N3CCN4CCC[C@@H]4C3)nc21	ZINC000176281883	402296988	/nfs/dbraw/zinc/29/69/88/402296988.db2.gz	PCIPYQVOQKYWJY-CQSZACIVSA-N	0	3	312.417	2.111	10	0		DEAEHN
O=C(c1ncncc1Cl)N1CCCC[C@@H](N2CCCC2)C1	ZINC000176315002	402298887	/nfs/dbraw/zinc/29/88/87/402298887.db2.gz	MDVOQBDMUGFCPG-GFCCVEGCSA-N	0	3	308.813	2.221	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)N2CC[C@H](N3CCCC3)C2)s1	ZINC000176399454	402305925	/nfs/dbraw/zinc/30/59/25/402305925.db2.gz	RVQLLBSVIKZWCX-OLZOCXBDSA-N	0	3	323.462	2.469	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)Nc2nc3c(s2)COCC3)C1	ZINC000176465666	402312050	/nfs/dbraw/zinc/31/20/50/402312050.db2.gz	BNCREFQBBWVKRM-PWSUYJOCSA-N	0	3	324.450	2.066	10	0		DEAEHN
CC(C)(C)C(=O)N1CCC(CN2CCN(C3CC3)CC2)CC1	ZINC000158936683	402314027	/nfs/dbraw/zinc/31/40/27/402314027.db2.gz	SFTUVVQBKTUJOF-UHFFFAOYSA-N	0	3	307.482	2.051	10	0		DEAEHN
CCc1nsc(N2CCCN(C[C@](C)(O)C(C)C)CC2)n1	ZINC000185016161	402317282	/nfs/dbraw/zinc/31/72/82/402317282.db2.gz	MXPBXYQZWLGZOL-HNNXBMFYSA-N	0	3	312.483	2.020	10	0		DEAEHN
CC[C@H](CNC(=O)N1CC[C@@H](N(C)C)C1)Oc1cccc(C)c1	ZINC000176841432	402342008	/nfs/dbraw/zinc/34/20/08/402342008.db2.gz	DMJRWWCCRCLJGH-HZPDHXFCSA-N	0	3	319.449	2.498	10	0		DEAEHN
CCc1ccccc1NC(=O)C(=O)N(C)C[C@@H]1CCCN1CC	ZINC000176898413	402348052	/nfs/dbraw/zinc/34/80/52/402348052.db2.gz	RAJZCQMFZRLZLH-HNNXBMFYSA-N	0	3	317.433	2.130	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@H]2CCCC[NH2+]C2)sc1Cl	ZINC000231810352	402356937	/nfs/dbraw/zinc/35/69/37/402356937.db2.gz	YATSVZRTNISCEG-SECBINFHSA-N	0	3	308.856	2.130	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc(C(=O)OC)cc1	ZINC000176995367	402357735	/nfs/dbraw/zinc/35/77/35/402357735.db2.gz	QRACNOCZJNWVQD-HNNXBMFYSA-N	0	3	304.390	2.030	10	0		DEAEHN
COC[C@H](C)OC[C@@H](O)CN[C@@H](C)c1cccc(Cl)c1	ZINC000234750296	402360636	/nfs/dbraw/zinc/36/06/36/402360636.db2.gz	YMGLCSLLSWCIRV-HUBLWGQQSA-N	0	3	301.814	2.403	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cccc(-n2cccn2)c1	ZINC000177032779	402361300	/nfs/dbraw/zinc/36/13/00/402361300.db2.gz	XRFWQPAOMKQDGV-KRWDZBQOSA-N	0	3	312.417	2.429	10	0		DEAEHN
COCCOC[C@H](O)CN(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000234866286	402361537	/nfs/dbraw/zinc/36/15/37/402361537.db2.gz	JJLRXMUMAJFMTL-SWLSCSKDSA-N	0	3	301.814	2.357	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)[C@H]2Oc3ccccc3[C@H]2C)CN1C1CC1	ZINC000177169870	402377575	/nfs/dbraw/zinc/37/75/75/402377575.db2.gz	GDSVKPBFHRSSQV-ZFRZLUBXSA-N	0	3	300.402	2.293	10	0		DEAEHN
COc1c(C)cc(CN(C)C(=O)C[C@@H]2CSCCN2)cc1C	ZINC000237127136	402395865	/nfs/dbraw/zinc/39/58/65/402395865.db2.gz	TYTVKRVYLHWBFC-OAHLLOKOSA-N	0	3	322.474	2.366	10	0		DEAEHN
CCO[C@H]1C[C@H](NCc2cn3ccccc3n2)C12CCOCC2	ZINC000186211632	402410760	/nfs/dbraw/zinc/41/07/60/402410760.db2.gz	CISRECOJWMKYJY-HOTGVXAUSA-N	0	3	315.417	2.398	10	0		DEAEHN
NC1(C(=O)NCCc2csc(N3CCCC3)n2)CCCCC1	ZINC000237919574	402425858	/nfs/dbraw/zinc/42/58/58/402425858.db2.gz	POFZQUDDMKNAEO-UHFFFAOYSA-N	0	3	322.478	2.064	10	0		DEAEHN
Cc1c(CNC[C@H](NC(=O)OC(C)(C)C)C(C)C)cnn1C	ZINC000162615781	402426322	/nfs/dbraw/zinc/42/63/22/402426322.db2.gz	OPDFNECQZWLFJU-AWEZNQCLSA-N	0	3	310.442	2.367	10	0		DEAEHN
C[C@@H](NCC(=O)NC(C)(C)C)c1ccc(-n2cccn2)cc1	ZINC000177765704	402433877	/nfs/dbraw/zinc/43/38/77/402433877.db2.gz	CBBNCMSCDBBGTC-CYBMUJFWSA-N	0	3	300.406	2.438	10	0		DEAEHN
C[C@H](NCC[C@H]1CCCO1)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000177844895	402440864	/nfs/dbraw/zinc/44/08/64/402440864.db2.gz	CJMNYDADEDEDCV-WCQYABFASA-N	0	3	315.410	2.449	10	0		DEAEHN
COc1cc(OC)cc([C@H]2CCN(CCn3ccnc3)C2)c1	ZINC000163237758	402445331	/nfs/dbraw/zinc/44/53/31/402445331.db2.gz	VKUAAJIJMIPVKP-AWEZNQCLSA-N	0	3	301.390	2.390	10	0		DEAEHN
COC(=O)c1ccc(CNC(=O)[C@@H](C)N2[C@H](C)CC[C@@H]2C)cc1	ZINC000245203795	402452528	/nfs/dbraw/zinc/45/25/28/402452528.db2.gz	WKFIOSVJKAYODN-HZSPNIEDSA-N	0	3	318.417	2.351	10	0		DEAEHN
C[C@H](C(=O)Nc1ccc2c(c1)OCC(=O)N2)N1[C@H](C)CC[C@H]1C	ZINC000245202049	402452533	/nfs/dbraw/zinc/45/25/33/402452533.db2.gz	PBDVYQLFCHTPTP-IJLUTSLNSA-N	0	3	317.389	2.217	10	0		DEAEHN
COc1cccc(CNC(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)n1	ZINC000245389719	402454666	/nfs/dbraw/zinc/45/46/66/402454666.db2.gz	JETUSIHNEWLTMG-KGLIPLIRSA-N	0	3	320.437	2.010	10	0		DEAEHN
O=C(c1cc(-c2ccc(F)cc2)on1)N1CCN2CCC[C@H]2C1	ZINC000178061271	402456848	/nfs/dbraw/zinc/45/68/48/402456848.db2.gz	RQOTWBJFEXHLTE-AWEZNQCLSA-N	0	3	315.348	2.401	10	0		DEAEHN
Cc1ccc(O[C@H](C)CNC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000245500301	402466620	/nfs/dbraw/zinc/46/66/20/402466620.db2.gz	ZVTCJZOXYAQPAT-CVEARBPZSA-N	0	3	317.433	2.252	10	0		DEAEHN
O=C1[C@@H](N2CCN3CCC[C@H]3C2)CCN1c1ccc(Cl)cc1	ZINC000246141910	402512660	/nfs/dbraw/zinc/51/26/60/402512660.db2.gz	DGXSIQRGOXQRIR-HOTGVXAUSA-N	0	3	319.836	2.225	10	0		DEAEHN
CN1CC[C@@H](NC(=O)N2CCOC(C)(C)C2)[C@@H]1c1ccccc1	ZINC000245672393	402477773	/nfs/dbraw/zinc/47/77/73/402477773.db2.gz	SJPDDIOABZMFNI-CVEARBPZSA-N	0	3	317.433	2.252	10	0		DEAEHN
Cc1ccc2[nH]c([C@@H]3CCCN([C@H]4CCN(C)C4=O)C3)nc2c1	ZINC000245704981	402481502	/nfs/dbraw/zinc/48/15/02/402481502.db2.gz	OAJFMFSOOJBLQG-CJNGLKHVSA-N	0	3	312.417	2.281	10	0		DEAEHN
Cc1ccc2nc([C@@H]3CCCN([C@H]4CCN(C)C4=O)C3)[nH]c2c1	ZINC000245704981	402481503	/nfs/dbraw/zinc/48/15/03/402481503.db2.gz	OAJFMFSOOJBLQG-CJNGLKHVSA-N	0	3	312.417	2.281	10	0		DEAEHN
C[C@@H](CNC(=O)NC[C@H]1CCC(C)(C)O1)N1CCC(C)CC1	ZINC000187077009	402481871	/nfs/dbraw/zinc/48/18/71/402481871.db2.gz	QJYPABCUEMTJAR-LSDHHAIUSA-N	0	3	311.470	2.364	10	0		DEAEHN
CC(C)Cc1nnc(NC(=O)N2C[C@@H]3CCCN3C[C@H]2C)s1	ZINC000245731556	402484248	/nfs/dbraw/zinc/48/42/48/402484248.db2.gz	FFKRTAHUSXWYKN-NEPJUHHUSA-N	0	3	323.466	2.437	10	0		DEAEHN
C[C@H](O)CN1CCN(Cc2cccc3c2OC(C)(C)C3)C[C@H]1C	ZINC000245754969	402485505	/nfs/dbraw/zinc/48/55/05/402485505.db2.gz	OMNOOIAXVPTYOB-CABCVRRESA-N	0	3	318.461	2.287	10	0		DEAEHN
COc1ccc(O)cc1C(=O)NCC(C)(C)N1CCCCC1	ZINC000187203261	402487722	/nfs/dbraw/zinc/48/77/22/402487722.db2.gz	ZFCLCMVXGCQEPK-UHFFFAOYSA-N	0	3	306.406	2.395	10	0		DEAEHN
C[C@H](NC(=O)[C@H](C)N1CCC[C@@H](N(C)C)C1)c1ccccc1	ZINC000245793826	402488316	/nfs/dbraw/zinc/48/83/16/402488316.db2.gz	DPTSQMFSZHHHBW-YQQAZPJKSA-N	0	3	303.450	2.278	10	0		DEAEHN
COc1ccccc1COC[C@H](O)CN1CCS[C@@H](C)C1	ZINC000245814812	402489813	/nfs/dbraw/zinc/48/98/13/402489813.db2.gz	ILZFTFLVTXKHIX-DZGCQCFKSA-N	0	3	311.447	2.010	10	0		DEAEHN
C[C@]1(c2ccccc2)CC[C@H](N2CC[C@H](NS(C)(=O)=O)C2)C1	ZINC000187333967	402494664	/nfs/dbraw/zinc/49/46/64/402494664.db2.gz	TUGBNZNCHYEFJB-ULQDDVLXSA-N	0	3	322.474	2.120	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCCCc2ccccn2)CCN1C	ZINC000178417646	402496701	/nfs/dbraw/zinc/49/67/01/402496701.db2.gz	VGIBJRXYOPJDQU-HOCLYGCPSA-N	0	3	304.438	2.138	10	0		DEAEHN
O=C(NCCCc1ccccn1)N1CCN(C2CCCC2)CC1	ZINC000178427713	402496886	/nfs/dbraw/zinc/49/68/86/402496886.db2.gz	LHHOCBHQXLJEJZ-UHFFFAOYSA-N	0	3	316.449	2.284	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@H](C)C(=O)NC1CCCCC1	ZINC000245943876	402499488	/nfs/dbraw/zinc/49/94/88/402499488.db2.gz	NCRLMXZQAWQAQO-PBHICJAKSA-N	0	3	318.465	2.493	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@H]2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000246001859	402503120	/nfs/dbraw/zinc/50/31/20/402503120.db2.gz	FOIDJCONTGAUDG-GRYCIOLGSA-N	0	3	307.360	2.453	10	0		DEAEHN
CCC(CC)[C@@H]1C[C@@H](NC(=O)N2CCN3CCC[C@H]3C2)CCO1	ZINC000246040655	402505261	/nfs/dbraw/zinc/50/52/61/402505261.db2.gz	XAWPCHHSLIJACJ-ULQDDVLXSA-N	0	3	323.481	2.460	10	0		DEAEHN
CC(C)OC1CC(N[C@H](Cc2ccccc2)C(=O)N(C)C)C1	ZINC000189531456	402543410	/nfs/dbraw/zinc/54/34/10/402543410.db2.gz	VUGNHKODQJYILE-OFLPRAFFSA-N	0	3	304.434	2.232	10	0		DEAEHN
CC(=O)c1c(C)[nH]c(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1C	ZINC000246758720	402543909	/nfs/dbraw/zinc/54/39/09/402543909.db2.gz	ALTVEQVMPLTLHN-QMTHXVAHSA-N	0	3	303.406	2.143	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cnc2ccccc2n1	ZINC000246826152	402546458	/nfs/dbraw/zinc/54/64/58/402546458.db2.gz	AKVKWUYAVHLWGQ-KBPBESRZSA-N	0	3	310.401	2.329	10	0		DEAEHN
Cc1ccc(C(=O)N2CCN3CCC[C@@H]3C2)c(Br)n1	ZINC000178886938	402550771	/nfs/dbraw/zinc/55/07/71/402550771.db2.gz	XWIASVUBWMLEHT-LLVKDONJSA-N	0	3	324.222	2.073	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)N[C@H]2CCOc3ccccc32)CN1C1CC1	ZINC000246972031	402551813	/nfs/dbraw/zinc/55/18/13/402551813.db2.gz	PGZDBZXFYFXRKM-IOASZLSFSA-N	0	3	315.417	2.435	10	0		DEAEHN
CC(=O)Nc1cc(NC(=O)N2CC[C@@H](N(C)C)C2)ccc1C	ZINC000171077609	402555307	/nfs/dbraw/zinc/55/53/07/402555307.db2.gz	LOENAXMVJWCBCN-CQSZACIVSA-N	0	3	304.394	2.121	10	0		DEAEHN
CC(C)C[C@@H]1COCCN1C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000247367944	402565044	/nfs/dbraw/zinc/56/50/44/402565044.db2.gz	OYRBBKGFMXCLMH-ARFHVFGLSA-N	0	3	311.470	2.172	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCC(C)(C)c1ccccc1F	ZINC000171190232	402565368	/nfs/dbraw/zinc/56/53/68/402565368.db2.gz	WRKFAOSWPHEKPS-ZDUSSCGKSA-N	0	3	307.413	2.497	10	0		DEAEHN
CCCCOc1ncccc1CNC(=O)NC[C@@H]1CCCN1C	ZINC000171191764	402565497	/nfs/dbraw/zinc/56/54/97/402565497.db2.gz	ZMVNHBKFGCGLCM-HNNXBMFYSA-N	0	3	320.437	2.154	10	0		DEAEHN
O=C1[C@H](N2CCN3CCC[C@H]3C2)CCN1c1ccccc1Cl	ZINC000247484549	402568582	/nfs/dbraw/zinc/56/85/82/402568582.db2.gz	GBTWDLDCAIEKIH-XJKSGUPXSA-N	0	3	319.836	2.225	10	0		DEAEHN
C[C@H]1CN2CCC[C@H]2CN1C(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000247496104	402569562	/nfs/dbraw/zinc/56/95/62/402569562.db2.gz	UQNYMMQLXAHDFE-DRFQVBMSSA-N	0	3	304.434	2.077	10	0		DEAEHN
CN1CC[C@@H](NC(=O)NCc2cccnc2)[C@@H]1c1ccccc1	ZINC000179072319	402570361	/nfs/dbraw/zinc/57/03/61/402570361.db2.gz	PNGDXVXJMDTSOP-SJORKVTESA-N	0	3	310.401	2.326	10	0		DEAEHN
COCC[C@H](C)NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179144917	402575845	/nfs/dbraw/zinc/57/58/45/402575845.db2.gz	XZDPQHLIPFIURC-NUEKZKHPSA-N	0	3	305.422	2.156	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(C[C@H](O)COC(C)C)C2)c1	ZINC000246191147	402517424	/nfs/dbraw/zinc/51/74/24/402517424.db2.gz	VJZXZTSRQZXGQO-ZBFHGGJFSA-N	0	3	323.433	2.279	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccc(N2CCCC2=O)cc1)N(C)C	ZINC000178646344	402521221	/nfs/dbraw/zinc/52/12/21/402521221.db2.gz	IKIBZYTXKKRVHX-MRXNPFEDSA-N	0	3	317.433	2.160	10	0		DEAEHN
Cc1nc2cc(NC(=O)N3CCN4CCC[C@H]4C3)ccc2o1	ZINC000178644357	402521252	/nfs/dbraw/zinc/52/12/52/402521252.db2.gz	XMMIYEYFJGGYMA-ZDUSSCGKSA-N	0	3	300.362	2.448	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)C(=O)NC[C@H]2Cc3ccccc32)CCN1C	ZINC000246328178	402525344	/nfs/dbraw/zinc/52/53/44/402525344.db2.gz	OIIFNZYIOPEEDZ-BMFZPTHFSA-N	0	3	301.434	2.450	10	0		DEAEHN
C[C@@H]1CN(C(=O)CN2CCC[C@]3(CC=CCC3)C2)C[C@H](C)O1	ZINC000246403534	402529324	/nfs/dbraw/zinc/52/93/24/402529324.db2.gz	QYYTWTDYFOYGKQ-SOLBZPMBSA-N	0	3	306.450	2.445	10	0		DEAEHN
CC(=O)Nc1cccc([C@@H](C)NC(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000170828594	402530401	/nfs/dbraw/zinc/53/04/01/402530401.db2.gz	SZODTJVXMFHNGM-MLGOLLRUSA-N	0	3	318.421	2.052	10	0		DEAEHN
CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)N1CCN2CCC[C@H]2C1	ZINC000246420071	402530558	/nfs/dbraw/zinc/53/05/58/402530558.db2.gz	RUGIDPFRDVUZGY-HRCADAONSA-N	0	3	323.481	2.317	10	0		DEAEHN
CCCCOc1ncccc1CNC(=O)N1CC[C@H](N(C)C)C1	ZINC000170834416	402530781	/nfs/dbraw/zinc/53/07/81/402530781.db2.gz	SHYBRRMXXFGUIX-HNNXBMFYSA-N	0	3	320.437	2.106	10	0		DEAEHN
Cc1cccc(OC[C@@H](C)NC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000170833307	402531019	/nfs/dbraw/zinc/53/10/19/402531019.db2.gz	BHCWOQQNURXXAT-CABCVRRESA-N	0	3	305.422	2.108	10	0		DEAEHN
NC1(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)CCCC1	ZINC000178726805	402531576	/nfs/dbraw/zinc/53/15/76/402531576.db2.gz	QCMCLYIAADAKQN-KRWDZBQOSA-N	0	3	315.461	2.429	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)NC[C@H](C)N(C)C3CC3)cc2c1	ZINC000189236352	402532297	/nfs/dbraw/zinc/53/22/97/402532297.db2.gz	BMKJWUBRHMCILH-NSHDSACASA-N	0	3	301.390	2.389	10	0		DEAEHN
Cc1oc(-c2ccccc2)nc1CC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170856477	402533111	/nfs/dbraw/zinc/53/31/11/402533111.db2.gz	MFANESJLWKTPMZ-OAHLLOKOSA-N	0	3	313.401	2.355	10	0		DEAEHN
Cc1ccc(C)c(C(=O)CCC(=O)N2CC[C@H](N(C)C)C2)c1	ZINC000170862170	402534281	/nfs/dbraw/zinc/53/42/81/402534281.db2.gz	SQIUGMAFWGAIMW-HNNXBMFYSA-N	0	3	302.418	2.429	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2cc(F)cc3[nH]c(=S)[nH]c32)C1	ZINC000170864921	402535057	/nfs/dbraw/zinc/53/50/57/402535057.db2.gz	MKUNJTPWVKDYCE-VIFPVBQESA-N	0	3	308.382	2.141	10	0		DEAEHN
CN(Cc1ccccc1)C(=O)CN1CC[C@@]2(O)CCCC[C@H]2C1	ZINC000248045572	402581257	/nfs/dbraw/zinc/58/12/57/402581257.db2.gz	UVXOYTYXLDMHJK-HKUYNNGSSA-N	0	3	316.445	2.272	10	0		DEAEHN
CC[C@@H]1CN(Cc2cccc(COC)c2)CCN1CCOC	ZINC000179212989	402581621	/nfs/dbraw/zinc/58/16/21/402581621.db2.gz	DBVKGQMWGCRFPV-GOSISDBHSA-N	0	3	306.450	2.376	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCC(C)(C)c2ccc(F)cc2)C1	ZINC000171373358	402582144	/nfs/dbraw/zinc/58/21/44/402582144.db2.gz	LBXBZRRWIVSQRE-OAHLLOKOSA-N	0	3	307.413	2.449	10	0		DEAEHN
C[C@]1(O)CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000248370874	402588070	/nfs/dbraw/zinc/58/80/70/402588070.db2.gz	YAXJUEFJVQIWKL-YGRLFVJLSA-N	0	3	320.216	2.190	10	0		DEAEHN
c1cc(N2CCCC2)ncc1CN1CCCN(C2CC2)CC1	ZINC000179729941	402598842	/nfs/dbraw/zinc/59/88/42/402598842.db2.gz	QKHRRKUWUAJQEK-UHFFFAOYSA-N	0	3	300.450	2.352	10	0		DEAEHN
C[C@H](Nc1ccc(OC2CCN(C)CC2)nc1)[C@@H]1CCOC1	ZINC000179743315	402599779	/nfs/dbraw/zinc/59/97/79/402599779.db2.gz	PMTGHRHQSFDFQN-UONOGXRCSA-N	0	3	305.422	2.392	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@@H]1CCCN1C[C@H](O)COCC(C)C	ZINC000171625358	402602680	/nfs/dbraw/zinc/60/26/80/402602680.db2.gz	QHBSCIUALVPUOR-HOTGVXAUSA-N	0	3	309.454	2.207	10	0		DEAEHN
Cc1ccc(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)s1	ZINC000179891901	402602839	/nfs/dbraw/zinc/60/28/39/402602839.db2.gz	GXUXNWWZPOLKKB-CQSZACIVSA-N	0	3	308.447	2.127	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1nc2cccnc2s1	ZINC000248687352	402603348	/nfs/dbraw/zinc/60/33/48/402603348.db2.gz	AQXOCBKOCQDECB-NEPJUHHUSA-N	0	3	316.430	2.390	10	0		DEAEHN
CCCCn1cc(C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c(C)n1	ZINC000248683462	402603553	/nfs/dbraw/zinc/60/35/53/402603553.db2.gz	GKONYVBMKDYZLT-CJNGLKHVSA-N	0	3	306.454	2.450	10	0		DEAEHN
Cc1ccc(NC(=O)[C@H](C)N2CCN3CCC[C@@H]3C2)c(F)c1	ZINC000171640420	402604918	/nfs/dbraw/zinc/60/49/18/402604918.db2.gz	GBJVUHJTBMQMSG-UONOGXRCSA-N	0	3	305.397	2.241	10	0		DEAEHN
Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)NCC2CC2)C1	ZINC000190689364	402618233	/nfs/dbraw/zinc/61/82/33/402618233.db2.gz	KVHXIYALHYFYBI-AWEZNQCLSA-N	0	3	322.478	2.325	10	0		DEAEHN
CC[C@H](N[C@H]1CCc2ncnn2C1)c1ccc2c(c1)OCCO2	ZINC000180595779	402620749	/nfs/dbraw/zinc/62/07/49/402620749.db2.gz	JDFNGGCAKQIOGL-KBPBESRZSA-N	0	3	314.389	2.105	10	0		DEAEHN
COCc1cc([C@@H](C)N[C@@H]2CCc3ncnn3C2)ccc1OC	ZINC000180599857	402621242	/nfs/dbraw/zinc/62/12/42/402621242.db2.gz	FBAIULXCXUBTDO-IUODEOHRSA-N	0	3	316.405	2.099	10	0		DEAEHN
Cc1c(F)cccc1NC(=O)C(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000249152706	402622339	/nfs/dbraw/zinc/62/23/39/402622339.db2.gz	HQKXYUISLIYBRX-WCQYABFASA-N	0	3	321.396	2.014	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c(F)c1	ZINC000249153362	402622575	/nfs/dbraw/zinc/62/25/75/402622575.db2.gz	HSYKRWWVGPVSNM-STQMWFEESA-N	0	3	321.396	2.014	10	0		DEAEHN
C[C@H](CNC(=O)Nc1nncs1)N(C)Cc1ccccc1	ZINC000171810083	402624838	/nfs/dbraw/zinc/62/48/38/402624838.db2.gz	GIKXOLSBPZSRNI-LLVKDONJSA-N	0	3	305.407	2.180	10	0		DEAEHN
OC[C@@H]1CN(C[C@H](O)CC(F)(F)F)C[C@H]1c1ccsc1	ZINC000249292028	402625024	/nfs/dbraw/zinc/62/50/24/402625024.db2.gz	MLBHCSRYNGZJRI-TUAOUCFPSA-N	0	3	309.353	2.069	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@H](C)OCc2cccc(OC)c2)C1	ZINC000249611360	402636924	/nfs/dbraw/zinc/63/69/24/402636924.db2.gz	LHJOURDINSRPDE-HOCLYGCPSA-N	0	3	320.433	2.201	10	0		DEAEHN
Cc1cccc(CN(CCN(C)C)C(=O)N[C@H]2CCCOC2)c1	ZINC000172029656	402637606	/nfs/dbraw/zinc/63/76/06/402637606.db2.gz	LKHGJPJCYAQJOV-KRWDZBQOSA-N	0	3	319.449	2.247	10	0		DEAEHN
O=C(CN1C[C@@H]2CCCC[C@@H]2C1)N1CCO[C@@H]2CCCC[C@@H]21	ZINC000252643226	402659504	/nfs/dbraw/zinc/65/95/04/402659504.db2.gz	JNVRRYVTVVYKAP-VVLHAWIVSA-N	0	3	306.450	2.278	10	0		DEAEHN
C(c1nnc(C2CC2)n1C1CC1)N1CCN2CCCC[C@H]2C1	ZINC000181466475	402646829	/nfs/dbraw/zinc/64/68/29/402646829.db2.gz	GWFGWONOYDVDRT-HNNXBMFYSA-N	0	3	301.438	2.161	10	0		DEAEHN
CO[C@@H]1CN([C@H](C)C(=O)N2CCc3ccccc3C2)CC[C@@H]1C	ZINC000251525373	402648361	/nfs/dbraw/zinc/64/83/61/402648361.db2.gz	CXPRUWLDSXWYMT-HDMKZQKVSA-N	0	3	316.445	2.317	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](CCO)C2CCCCC2)C1	ZINC000252653260	402659951	/nfs/dbraw/zinc/65/99/51/402659951.db2.gz	RMSFBNJZWHOOLP-JKSUJKDBSA-N	0	3	311.470	2.101	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCCC[C@H]1c1cn[nH]c1)N(C)C1CC1	ZINC000182701841	402710128	/nfs/dbraw/zinc/71/01/28/402710128.db2.gz	ZFHQGEMRDGXMDI-WFASDCNBSA-N	0	3	305.426	2.129	10	0		DEAEHN
CCN1CCN(c2ccc(C(=O)N[C@H](C)CSC)cc2)CC1	ZINC000173830295	402714649	/nfs/dbraw/zinc/71/46/49/402714649.db2.gz	XVSSYLSRJMABQX-CQSZACIVSA-N	0	3	321.490	2.310	10	0		DEAEHN
Cc1ccc(C)c(S(=O)(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000173884342	402717114	/nfs/dbraw/zinc/71/71/14/402717114.db2.gz	GHXZRRHBLGDMSA-GJZGRUSLSA-N	0	3	310.463	2.310	10	0		DEAEHN
Cc1ccc(CN(C)C(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)cc1	ZINC000261885626	402718510	/nfs/dbraw/zinc/71/85/10/402718510.db2.gz	NCMAADOLZHEIQV-JTDSTZFVSA-N	0	3	316.445	2.486	10	0		DEAEHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@H](C)[C@H]1CCCO1	ZINC000252733961	402660766	/nfs/dbraw/zinc/66/07/66/402660766.db2.gz	XPVSIBIWWVCYEY-BFYDXBDKSA-N	0	3	319.449	2.374	10	0		DEAEHN
COCCCOc1cccc(CNCC2(C)OCCCO2)c1	ZINC000192248844	402719072	/nfs/dbraw/zinc/71/90/72/402719072.db2.gz	DAGXRCXYGYUKDU-UHFFFAOYSA-N	0	3	309.406	2.345	10	0		DEAEHN
O=C([C@@H]1C[C@@H]1c1cc(F)ccc1F)N1CCN2CCC[C@@H]2C1	ZINC000172907705	402679524	/nfs/dbraw/zinc/67/95/24/402679524.db2.gz	WFEUCGRNPOLRHD-UMVBOHGHSA-N	0	3	306.356	2.375	10	0		DEAEHN
CCCC[C@H](COC)N[C@H]1CCCN(c2cc(C)nn2C)C1=O	ZINC000182352523	402682743	/nfs/dbraw/zinc/68/27/43/402682743.db2.gz	YFPDIUCHTSEGOU-CABCVRRESA-N	0	3	322.453	2.019	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)Cc2cc(=O)oc3cc([O-])ccc23)CC[N@@H+]1C	ZINC000182396936	402686841	/nfs/dbraw/zinc/68/68/41/402686841.db2.gz	XLXWPRMSTACNLM-OCCSQVGLSA-N	0	3	316.401	2.413	10	0		DEAEHN
C[C@@H]1C[C@@H](N(C)Cc2cc(=O)oc3cc([O-])ccc23)CC[N@H+]1C	ZINC000182396936	402686842	/nfs/dbraw/zinc/68/68/42/402686842.db2.gz	XLXWPRMSTACNLM-OCCSQVGLSA-N	0	3	316.401	2.413	10	0		DEAEHN
C[C@@H]1C[C@@H]([N@H+](C)Cc2cc(=O)oc3cc([O-])ccc23)CCN1C	ZINC000182396936	402686844	/nfs/dbraw/zinc/68/68/44/402686844.db2.gz	XLXWPRMSTACNLM-OCCSQVGLSA-N	0	3	316.401	2.413	10	0		DEAEHN
C[C@@H]1C[C@@H]([N@@H+](C)Cc2cc(=O)oc3cc([O-])ccc23)CCN1C	ZINC000182396936	402686845	/nfs/dbraw/zinc/68/68/45/402686845.db2.gz	XLXWPRMSTACNLM-OCCSQVGLSA-N	0	3	316.401	2.413	10	0		DEAEHN
CN1CCC(C(=O)NC[C@@H]2CCN(C)c3ccccc32)CC1	ZINC000174189612	402731207	/nfs/dbraw/zinc/73/12/07/402731207.db2.gz	VWEXMCCRQCYGBY-HNNXBMFYSA-N	0	3	301.434	2.068	10	0		DEAEHN
C[C@H]1CCCC[C@@H]1CN1CCN(c2ccc3nncn3n2)CC1	ZINC000183054571	402735308	/nfs/dbraw/zinc/73/53/08/402735308.db2.gz	UIQXKNZYPZUDAV-LSDHHAIUSA-N	0	3	314.437	2.073	10	0		DEAEHN
COc1cccc(F)c1[C@@H](C)NC(=O)NC[C@@H]1CCCN1C	ZINC000174355565	402737864	/nfs/dbraw/zinc/73/78/64/402737864.db2.gz	DZUNFBSJBVBVJM-NEPJUHHUSA-N	0	3	309.385	2.289	10	0		DEAEHN
CCN(Cc1cccc(F)c1)C(=O)CN[C@@H](C)[C@@H]1CCCO1	ZINC000183119157	402740682	/nfs/dbraw/zinc/74/06/82/402740682.db2.gz	RQERBJKFJVHETE-BBRMVZONSA-N	0	3	308.397	2.331	10	0		DEAEHN
CC(C)OC[C@H](O)CN[C@@H](C)c1ccccc1-n1cccn1	ZINC000183143721	402742788	/nfs/dbraw/zinc/74/27/88/402742788.db2.gz	XNXLOJTVXLMKPQ-LSDHHAIUSA-N	0	3	303.406	2.309	10	0		DEAEHN
Cc1ccc(SCCc2nc([C@@H]3CNCCN3C)no2)cc1	ZINC000263245754	402749515	/nfs/dbraw/zinc/74/95/15/402749515.db2.gz	PGHJUNJIZZFAKE-AWEZNQCLSA-N	0	3	318.446	2.289	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(COc2ccc3ccccc3c2)n1	ZINC000263249383	402750092	/nfs/dbraw/zinc/75/00/92/402750092.db2.gz	PQZLHWVDNRLKJP-MRXNPFEDSA-N	0	3	324.384	2.378	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(Cc2csc3ccccc23)n1	ZINC000263254415	402751366	/nfs/dbraw/zinc/75/13/66/402751366.db2.gz	QJOTYNSTXBMQJZ-CYBMUJFWSA-N	0	3	314.414	2.451	10	0		DEAEHN
Cc1nc(CC(C)C)c(-c2nc([C@H]3CNCCN3C)no2)s1	ZINC000263276813	402753141	/nfs/dbraw/zinc/75/31/41/402753141.db2.gz	SYACWVIQZUELRI-GFCCVEGCSA-N	0	3	321.450	2.276	10	0		DEAEHN
CN1CCNC[C@@H]1c1noc(-c2csc3c2CCCC3)n1	ZINC000263282426	402753626	/nfs/dbraw/zinc/75/36/26/402753626.db2.gz	UMWGUSVPYACQIT-GFCCVEGCSA-N	0	3	304.419	2.253	10	0		DEAEHN
CCc1nc(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cs1	ZINC000174796424	402758086	/nfs/dbraw/zinc/75/80/86/402758086.db2.gz	IHKDLHQGEZWOKY-YPMHNXCESA-N	0	3	310.467	2.330	10	0		DEAEHN
CCN1CCCC[C@H]1C(=O)N1CC[C@H](C(=O)OC(C)(C)C)C1	ZINC000174890978	402761716	/nfs/dbraw/zinc/76/17/16/402761716.db2.gz	JCVUYYBCDNCWEC-KBPBESRZSA-N	0	3	310.438	2.051	10	0		DEAEHN
CCc1nc(Cl)c(C)c(NC[C@H](O)CN2CCCCC2)n1	ZINC000175037705	402773501	/nfs/dbraw/zinc/77/35/01/402773501.db2.gz	CCHUZXRPJHULEQ-LBPRGKRZSA-N	0	3	312.845	2.260	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)Nc2ccc(C)c(C(=O)OC)c2)C1	ZINC000175037781	402773702	/nfs/dbraw/zinc/77/37/02/402773702.db2.gz	ARRAREZGRSKSPL-CQSZACIVSA-N	0	3	319.405	2.387	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CCC(=O)NC1CCCC1	ZINC000193753959	402776272	/nfs/dbraw/zinc/77/62/72/402776272.db2.gz	TXEFUCWUQRGZCC-BPUTZDHNSA-N	0	3	322.449	2.241	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc3c(c2)N(C)CCO3)C1	ZINC000175094976	402778406	/nfs/dbraw/zinc/77/84/06/402778406.db2.gz	FJZNFCIVLBPBFY-AWEZNQCLSA-N	0	3	318.421	2.121	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1cc(C)cc(F)c1	ZINC000175218006	402789525	/nfs/dbraw/zinc/78/95/25/402789525.db2.gz	OOYDRPVTTXOIKA-LBPRGKRZSA-N	0	3	302.415	2.143	10	0		DEAEHN
CCCCc1nnc(NC(=O)N[C@@H]2CCCN(CC)C2)s1	ZINC000194320765	402792094	/nfs/dbraw/zinc/79/20/94/402792094.db2.gz	WXFSMTOPZZSFNY-LLVKDONJSA-N	0	3	311.455	2.487	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)N[C@@H](C)c1cccs1	ZINC000175337374	402798402	/nfs/dbraw/zinc/79/84/02/402798402.db2.gz	KALIUFOVRIZWSM-UONOGXRCSA-N	0	3	309.479	2.341	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)Nc1cccc(OC)c1	ZINC000175348181	402798946	/nfs/dbraw/zinc/79/89/46/402798946.db2.gz	SMQMMKKHSQOTBH-HNNXBMFYSA-N	0	3	305.422	2.050	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCC(OCC(C)C)CC1	ZINC000175372516	402800758	/nfs/dbraw/zinc/80/07/58/402800758.db2.gz	ITSATUBVPVSCRN-OAHLLOKOSA-N	0	3	311.470	2.317	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N1CCC[C@H](C(F)(F)F)C1	ZINC000175365634	402800837	/nfs/dbraw/zinc/80/08/37/402800837.db2.gz	BZSNJWFGPVOXJU-NWDGAFQWSA-N	0	3	307.360	2.455	10	0		DEAEHN
CN1CC[C@H](NC(=O)C2CCC(O)CC2)[C@@H]1c1ccccc1	ZINC000194526518	402801509	/nfs/dbraw/zinc/80/15/09/402801509.db2.gz	NOZBTFZSKBFZNQ-GQGLESIBSA-N	0	3	302.418	2.099	10	0		DEAEHN
CCN1CCC[C@@H]1CNC(=O)N(C)CCc1ccc(F)cc1	ZINC000175387320	402801748	/nfs/dbraw/zinc/80/17/48/402801748.db2.gz	WHCHDQQJQQVXDE-MRXNPFEDSA-N	0	3	307.413	2.494	10	0		DEAEHN
CN(C)Cc1ccc(C(=O)N2CCN3CCCC[C@H]3C2)cc1	ZINC000194601936	402805001	/nfs/dbraw/zinc/80/50/01/402805001.db2.gz	DMKVAYBVJBXACH-KRWDZBQOSA-N	0	3	301.434	2.059	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Cc2c[nH]c3ccc(OC)cc23)C1	ZINC000194659488	402808730	/nfs/dbraw/zinc/80/87/30/402808730.db2.gz	KKICPEGIGCMUQC-AWEZNQCLSA-N	0	3	315.417	2.320	10	0		DEAEHN
CC(=O)c1ccccc1OCCN1CCCN(C2CC2)CC1	ZINC000195341472	402842986	/nfs/dbraw/zinc/84/29/86/402842986.db2.gz	SGLWLKZNIQCOSB-UHFFFAOYSA-N	0	3	302.418	2.438	10	0		DEAEHN
O=C(CCCOc1ccc(F)cc1F)N1CCN2CCC[C@H]2C1	ZINC000195338893	402843071	/nfs/dbraw/zinc/84/30/71/402843071.db2.gz	GXGXTKHWUBXQOU-AWEZNQCLSA-N	0	3	324.371	2.430	10	0		DEAEHN
CN1CCC[C@@H]1CNC(=O)Cc1ccc(OC(F)(F)F)cc1	ZINC000194697650	402811098	/nfs/dbraw/zinc/81/10/98/402811098.db2.gz	KMIIDEKFLMZYCE-GFCCVEGCSA-N	0	3	316.323	2.338	10	0		DEAEHN
[O-]c1cc(F)cc(C[NH2+]C2CCN(c3ncccn3)CC2)c1	ZINC000184136120	402820996	/nfs/dbraw/zinc/82/09/96/402820996.db2.gz	UBLIMHYJMHAANR-UHFFFAOYSA-N	0	3	302.353	2.080	10	0		DEAEHN
CCc1noc2ncc(C(=O)N[C@@H](CC(C)C)CN(C)C)cc12	ZINC000194920184	402822886	/nfs/dbraw/zinc/82/28/86/402822886.db2.gz	RSYQQRNXFWMNDO-ZDUSSCGKSA-N	0	3	318.421	2.491	10	0		DEAEHN
CCc1oc(C(=O)NC(C)(C)CCN2CCN(C)CC2)cc1C	ZINC000184225456	402828139	/nfs/dbraw/zinc/82/81/39/402828139.db2.gz	XWHBOHOAHYJLDQ-UHFFFAOYSA-N	0	3	321.465	2.296	10	0		DEAEHN
CCc1nnc(CN2CCN(CC3CCCCC3)CC2)n1C	ZINC000195114354	402832368	/nfs/dbraw/zinc/83/23/68/402832368.db2.gz	KKJQYYXSVBTPIQ-UHFFFAOYSA-N	0	3	305.470	2.075	10	0		DEAEHN
CCCCOC[C@@H](O)CN1CCC(Oc2ccc(C)cn2)CC1	ZINC000195210503	402837218	/nfs/dbraw/zinc/83/72/18/402837218.db2.gz	NSMRLVHJNPIEKL-INIZCTEOSA-N	0	3	322.449	2.411	10	0		DEAEHN
COC[C@](C)(CCO)NCc1cccc(OC(F)(F)F)c1	ZINC000175853531	402838123	/nfs/dbraw/zinc/83/81/23/402838123.db2.gz	LRDIZFXCIGVRPE-ZDUSSCGKSA-N	0	3	307.312	2.462	10	0		DEAEHN
CC[C@@H](NC(=O)N1CC[C@@H](N2CC=CC2)C1)c1nccs1	ZINC000175157853	402783989	/nfs/dbraw/zinc/78/39/89/402783989.db2.gz	DLCVEFYBCBWMGF-CHWSQXEVSA-N	0	3	306.435	2.250	10	0		DEAEHN
CC[C@@H](CNC(=O)N1CC[C@H](N(C)C)C1)Oc1ccccc1F	ZINC000175956983	402844753	/nfs/dbraw/zinc/84/47/53/402844753.db2.gz	AUTWEHLJCQEPFX-KBPBESRZSA-N	0	3	323.412	2.329	10	0		DEAEHN
Cc1cccc(F)c1NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000184474828	402845879	/nfs/dbraw/zinc/84/58/79/402845879.db2.gz	NUKOYVYVACKERK-ZDUSSCGKSA-N	0	3	309.385	2.102	10	0		DEAEHN
Cc1c(C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)[nH]c2c1C(=O)CCC2	ZINC000268430697	403082360	/nfs/dbraw/zinc/08/23/60/403082360.db2.gz	YCXLESJEGWOVPU-BXUZGUMPSA-N	0	3	317.433	2.301	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1ccncc1Br	ZINC000268569977	403095457	/nfs/dbraw/zinc/09/54/57/403095457.db2.gz	BMOXRVOENKZQCV-SNVBAGLBSA-N	0	3	312.211	2.010	10	0		DEAEHN
CN1CC[C@@]2(CCN(C(=O)c3coc(Br)c3)C2)C1	ZINC000292261612	403337278	/nfs/dbraw/zinc/33/72/78/403337278.db2.gz	POPCDDBSKMGQQV-CYBMUJFWSA-N	0	3	313.195	2.210	10	0		DEAEHN
C[C@@H](C(=O)N(C)C1CCCCC1)N1CCC[C@H](c2nc[nH]n2)C1	ZINC000333116542	403668829	/nfs/dbraw/zinc/66/88/29/403668829.db2.gz	YVKHXOOUHCCTNR-KBPBESRZSA-N	0	3	319.453	2.164	10	0		DEAEHN
CC(=O)N[C@H](C(=O)NCCN1[C@@H](C)CCC[C@@H]1C)C1CCCC1	ZINC000341062676	403756313	/nfs/dbraw/zinc/75/63/13/403756313.db2.gz	CLBINWFCUSZENL-ZQIUZPCESA-N	0	3	323.481	2.060	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN1CCC(Oc2cc(C)ccc2C)CC1	ZINC000347748719	403842880	/nfs/dbraw/zinc/84/28/80/403842880.db2.gz	MLLLVOATPGXZRV-SFHVURJKSA-N	0	3	305.418	2.487	10	0		DEAEHN
c1nc(CN2CCCC3(CCCN(Cc4c[nH]cn4)C3)C2)c[nH]1	ZINC000289426353	403959387	/nfs/dbraw/zinc/95/93/87/403959387.db2.gz	IMOJUHVDTQCARU-UHFFFAOYSA-N	0	3	314.437	2.011	10	0		DEAEHN
c1ncc(CN2CCCC3(CCCN(Cc4c[nH]cn4)C3)C2)[nH]1	ZINC000289426353	403959416	/nfs/dbraw/zinc/95/94/16/403959416.db2.gz	IMOJUHVDTQCARU-UHFFFAOYSA-N	0	3	314.437	2.011	10	0		DEAEHN
c1ccc(CN2CC[C@@H](N3CCO[C@]4(CCCOC4)C3)C2)cc1	ZINC000297285864	404536777	/nfs/dbraw/zinc/53/67/77/404536777.db2.gz	ACTSGTHRVZVUGL-RTBURBONSA-N	0	3	316.445	2.142	10	0		DEAEHN
Cc1nccc(N2CCN(C[C@H]3CCOc4ccccc43)CC2)n1	ZINC000373411510	404542040	/nfs/dbraw/zinc/54/20/40/404542040.db2.gz	FROOOXPVLLHWRF-MRXNPFEDSA-N	0	3	324.428	2.473	10	0		DEAEHN
Brc1ccc(CN[C@@H]2CCO[C@@]3(CCOC3)C2)o1	ZINC000365154439	404563519	/nfs/dbraw/zinc/56/35/19/404563519.db2.gz	GLXUEYHRFAYHPD-MFKMUULPSA-N	0	3	316.195	2.470	10	0		DEAEHN
Cc1nn(C)c(C)c1[C@H]1[C@H](NCc2ccsc2)CC(=O)N1C	ZINC000330293341	404616529	/nfs/dbraw/zinc/61/65/29/404616529.db2.gz	HSHZFPBVQBWGFF-CZUORRHYSA-N	0	3	318.446	2.160	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2cn(C)nc2C2CC2)CCN1C	ZINC000292018773	404629261	/nfs/dbraw/zinc/62/92/61/404629261.db2.gz	JMJRKMYSSBWNSP-DGCLKSJQSA-N	0	3	305.426	2.244	10	0		DEAEHN
Cc1nccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)n1	ZINC000374034367	404674001	/nfs/dbraw/zinc/67/40/01/404674001.db2.gz	HDPIFWWHCTVEKW-HNNXBMFYSA-N	0	3	310.401	2.270	10	0		DEAEHN
OCCN[C@H](Cc1ccc(F)cc1)[C@@H]1COc2ccccc2O1	ZINC000366444584	404792070	/nfs/dbraw/zinc/79/20/70/404792070.db2.gz	RVLITGUENMARMJ-QAPCUYQASA-N	0	3	317.360	2.159	10	0		DEAEHN
c1cc(-c2ccc(CNC[C@H]3COC4(CCCC4)O3)o2)n[nH]1	ZINC000366836484	404855623	/nfs/dbraw/zinc/85/56/23/404855623.db2.gz	NFXASKNXEYYGIX-ZDUSSCGKSA-N	0	3	303.362	2.445	10	0		DEAEHN
NC(=O)CCC1CCN(Cc2ccc(-c3cc[nH]n3)o2)CC1	ZINC000435131753	404957544	/nfs/dbraw/zinc/95/75/44/404957544.db2.gz	FLZIDHIRCNUCFD-UHFFFAOYSA-N	0	3	302.378	2.147	10	0		DEAEHN
CNC(=O)CC1CCN(Cc2ccc(-c3cc[nH]n3)o2)CC1	ZINC000435133001	404957938	/nfs/dbraw/zinc/95/79/38/404957938.db2.gz	NWIKAAAHTBFMJO-UHFFFAOYSA-N	0	3	302.378	2.018	10	0		DEAEHN
CC(=O)c1cccc(CN2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)c1	ZINC000451304285	404948403	/nfs/dbraw/zinc/94/84/03/404948403.db2.gz	ODWNJHKNECWAIX-KURKYZTESA-N	0	3	303.402	2.251	10	0		DEAEHN
C[C@@H]1OCC[C@@]1(O)CNCc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000435034429	404951373	/nfs/dbraw/zinc/95/13/73/404951373.db2.gz	NEXNOEWKGWVNPT-SCLBCKFNSA-N	0	3	321.417	2.271	10	0		DEAEHN
C[C@@H]1CCOCCN1C(=O)NC[C@@H](c1ccccc1)N(C)C	ZINC000378496472	404982814	/nfs/dbraw/zinc/98/28/14/404982814.db2.gz	KATPIPGZXMTNAP-ZBFHGGJFSA-N	0	3	305.422	2.110	10	0		DEAEHN
COC(=O)C(C)(C)N1CCN(C[C@@H]2C[C@@H]2c2ccccc2)CC1	ZINC000361394038	405053943	/nfs/dbraw/zinc/05/39/43/405053943.db2.gz	CRYIGOSETWFWLJ-DLBZAZTESA-N	0	3	316.445	2.359	10	0		DEAEHN
C[C@@]1(NC(=O)c2ncccc2N)CCN(Cc2ccccc2)C1	ZINC000405980871	405072910	/nfs/dbraw/zinc/07/29/10/405072910.db2.gz	DLRVAPPCNDNWSK-GOSISDBHSA-N	0	3	310.401	2.058	10	0		DEAEHN
Cn1nnc2cc(CN3CC[C@@]4(O)CCCC[C@H]4C3)ccc21	ZINC000408073309	405105735	/nfs/dbraw/zinc/10/57/35/405105735.db2.gz	PZHKLUHRJLMVHY-YOEHRIQHSA-N	0	3	300.406	2.095	10	0		DEAEHN
CCO[C@@H]1CCCC[C@H]1NCC(=O)Nc1ccc2c(c1)OCO2	ZINC000452036584	405134814	/nfs/dbraw/zinc/13/48/14/405134814.db2.gz	RDDJUXIXSGYLQQ-ZIAGYGMSSA-N	0	3	320.389	2.291	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)c2ccc3c(c2[O-])CCCC3)CC[N@@H+]1C	ZINC000408414989	405202405	/nfs/dbraw/zinc/20/24/05/405202405.db2.gz	MTBHLELBONOMSI-GXTWGEPZSA-N	0	3	302.418	2.484	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)c2ccc3c(c2[O-])CCCC3)CC[N@H+]1C	ZINC000408414989	405202412	/nfs/dbraw/zinc/20/24/12/405202412.db2.gz	MTBHLELBONOMSI-GXTWGEPZSA-N	0	3	302.418	2.484	10	0		DEAEHN
CN(C[C@@H]1CCCN1C)C(=O)c1ccc2c(c1O)OC(C)(C)C2	ZINC000408470831	405214922	/nfs/dbraw/zinc/21/49/22/405214922.db2.gz	RFWUFJLTVVRTBH-ZDUSSCGKSA-N	0	3	318.417	2.272	10	0		DEAEHN
C[C@H](CCc1ccccc1F)C(=O)NCCNc1ccncc1	ZINC000439036901	405263107	/nfs/dbraw/zinc/26/31/07/405263107.db2.gz	CJNGMGAYMAHRFF-CQSZACIVSA-N	0	3	315.392	2.440	10	0		DEAEHN
O=C(NCCNc1ccncc1)c1ccc(OC2CCC2)cc1	ZINC000439039422	405263787	/nfs/dbraw/zinc/26/37/87/405263787.db2.gz	LWDPLVPKXFMLGA-UHFFFAOYSA-N	0	3	311.385	2.277	10	0		DEAEHN
CN1CC[C@@H]2CN(C(=O)c3csc(Br)c3)C[C@@H]21	ZINC000453033606	405277398	/nfs/dbraw/zinc/27/73/98/405277398.db2.gz	KHUMGKRNTORMRQ-SCZZXKLOSA-N	0	3	315.236	2.287	10	0		DEAEHN
CN1CC[C@@H]2CN(C(=O)[C@H]3C[C@H]3c3cc(F)ccc3F)C[C@@H]21	ZINC000453036295	405277421	/nfs/dbraw/zinc/27/74/21/405277421.db2.gz	NVZBGRJYHRCQSV-TYRIBLQHSA-N	0	3	306.356	2.231	10	0		DEAEHN
Cc1cc(CCNC(=O)NC[C@H](C)N2CCCC[C@@H]2C)on1	ZINC000557777806	405627767	/nfs/dbraw/zinc/62/77/67/405627767.db2.gz	UWZPVRKAUTYTFJ-KBPBESRZSA-N	0	3	308.426	2.088	10	0		DEAEHN
CC(C)n1cc(CN2CCC[C@@H]2[C@H]2COCC[C@@]2(C)O)cn1	ZINC000583618799	405776061	/nfs/dbraw/zinc/77/60/61/405776061.db2.gz	NRHGXMNLSYMAAH-BRWVUGGUSA-N	0	3	307.438	2.216	10	0		DEAEHN
O=C([C@@H]1CNCCC1(F)F)N1CCC[C@@H](C(F)(F)F)C1	ZINC000638992454	405805168	/nfs/dbraw/zinc/80/51/68/405805168.db2.gz	DUZHTVMCHIGYRG-BDAKNGLRSA-N	0	3	300.271	2.032	10	0		DEAEHN
CN(Cc1cccc(Br)c1)C[C@H]1COCCO1	ZINC000450280999	405814543	/nfs/dbraw/zinc/81/45/43/405814543.db2.gz	AFKVYDGVVUZXDE-ZDUSSCGKSA-N	0	3	300.196	2.296	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)c1	ZINC000457639966	405930989	/nfs/dbraw/zinc/93/09/89/405930989.db2.gz	YXWZMOXIGSNNKF-DOMZBBRYSA-N	0	3	316.401	2.137	10	0		DEAEHN
COC(=O)c1cc(C)cc(C(=O)N[C@H](C)C2=CCN(C)CC2)c1	ZINC000457686526	405950997	/nfs/dbraw/zinc/95/09/97/405950997.db2.gz	AGFLGSDZTQZOSW-CYBMUJFWSA-N	0	3	316.401	2.162	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN1CC[C@@H](OCCCc2ccccc2)C1	ZINC000450477063	405918925	/nfs/dbraw/zinc/91/89/25/405918925.db2.gz	UMSBMELCRXGHNY-MSOLQXFVSA-N	0	3	305.418	2.050	10	0		DEAEHN
Cc1nnc([C@@H](C)NC(=O)c2cccc(CN3CCCC3)c2)o1	ZINC000531846166	406015541	/nfs/dbraw/zinc/01/55/41/406015541.db2.gz	UKGUSCGRRIPVPT-GFCCVEGCSA-N	0	3	314.389	2.465	10	0		DEAEHN
CC(C)(C)OC(=O)C[C@H]1CCCN(CCN2CCCC2=O)C1	ZINC000532125041	406048084	/nfs/dbraw/zinc/04/80/84/406048084.db2.gz	SSRXGWJMZHANGS-CQSZACIVSA-N	0	3	310.438	2.053	10	0		DEAEHN
CC(C)(C)OC(=O)C[C@@H]1CCCN(CCCN2CCCC2=O)C1	ZINC000532125038	406048173	/nfs/dbraw/zinc/04/81/73/406048173.db2.gz	RZZSBXXAQMOWCG-HNNXBMFYSA-N	0	3	324.465	2.443	10	0		DEAEHN
Cc1nn(C)cc1CC(=O)N1C[C@H]2CCCN2Cc2ccccc21	ZINC000460021352	406073980	/nfs/dbraw/zinc/07/39/80/406073980.db2.gz	JRQBYTBXGZKGND-QGZVFWFLSA-N	0	3	324.428	2.282	10	0		DEAEHN
C[C@@H]1C[C@H]1CNC(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000471668755	406106928	/nfs/dbraw/zinc/10/69/28/406106928.db2.gz	LYJQIACMXRWRLK-PVAVHDDUSA-N	0	3	301.434	2.464	10	0		DEAEHN
c1nc2n(n1)[C@H](CN1CCC3(CC1)OCc1ccccc13)CC2	ZINC000639517364	406125045	/nfs/dbraw/zinc/12/50/45/406125045.db2.gz	IFXKLMAVOAFMDZ-HNNXBMFYSA-N	0	3	310.401	2.287	10	0		DEAEHN
C(c1noc(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)n1)C1CC1	ZINC000639543745	406138667	/nfs/dbraw/zinc/13/86/67/406138667.db2.gz	OUOFUCJGWRDUKS-HOCLYGCPSA-N	0	3	316.449	2.471	10	0		DEAEHN
CC[C@@H](C[C@@H](C)CO)NCc1c(Br)cnn1C	ZINC000487302735	406222547	/nfs/dbraw/zinc/22/25/47/406222547.db2.gz	RFJQCTQAPDGNFK-ZJUUUORDSA-N	0	3	304.232	2.069	10	0		DEAEHN
c1ccc(CN2CC[C@@H](N3CCO[C@@]4(CCSC4)C3)C2)cc1	ZINC000569238713	406226296	/nfs/dbraw/zinc/22/62/96/406226296.db2.gz	PUMWHBWYWBGTOE-MSOLQXFVSA-N	0	3	318.486	2.469	10	0		DEAEHN
C[C@@H]1[C@@H](CO)CCN1CC(=O)N(C)[C@H]1CCCc2ccccc21	ZINC000488731364	406341728	/nfs/dbraw/zinc/34/17/28/406341728.db2.gz	JKKOTMDAEWWFQU-KYJSFNMBSA-N	0	3	316.445	2.225	10	0		DEAEHN
CN1CCC[C@H](CNC(=O)c2cncnc2)[C@H]1c1cccs1	ZINC000546891183	406385636	/nfs/dbraw/zinc/38/56/36/406385636.db2.gz	AJVIGKMBITYHLN-DOMZBBRYSA-N	0	3	316.430	2.351	10	0		DEAEHN
c1ccc(N2CC[C@@H](CN3CCN(c4cnccn4)CC3)C2)cc1	ZINC000637920238	406478132	/nfs/dbraw/zinc/47/81/32/406478132.db2.gz	QZRDNVSQZGTPBU-KRWDZBQOSA-N	0	3	323.444	2.125	10	0		DEAEHN
CC(C)N(CC1CC1)C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637936736	406486003	/nfs/dbraw/zinc/48/60/03/406486003.db2.gz	ZIFDRCFDGWYKLK-QGZVFWFLSA-N	0	3	303.450	2.093	10	0		DEAEHN
COc1ccc(NC(=O)[C@H](N)CN(C)Cc2ccccc2)cc1	ZINC000637868713	406454707	/nfs/dbraw/zinc/45/47/07/406454707.db2.gz	ITOWFDPXXUDKLE-QGZVFWFLSA-N	0	3	313.401	2.093	10	0		DEAEHN
Cc1ccccc1CNC(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000637887863	406463175	/nfs/dbraw/zinc/46/31/75/406463175.db2.gz	ZRAUMCHFIDWHHX-SFHVURJKSA-N	0	3	311.429	2.071	10	0		DEAEHN
CC(C)[C@H]1CCCCN1C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000638001147	406518273	/nfs/dbraw/zinc/51/82/73/406518273.db2.gz	OXSKPSRMIGVPCT-QZTJIDSGSA-N	0	3	317.477	2.483	10	0		DEAEHN
CCc1ncc(CNC[C@@H]2CCC3(CCOCC3)[C@@H]2O)s1	ZINC000554936450	406829694	/nfs/dbraw/zinc/82/96/94/406829694.db2.gz	QRODCIMKHDZVMR-SWLSCSKDSA-N	0	3	310.463	2.363	10	0		DEAEHN
O=C([C@@H]1CNCCOC1)N(Cc1ccccc1)c1ccccc1	ZINC000643618478	407018117	/nfs/dbraw/zinc/01/81/17/407018117.db2.gz	PTMAEKAUFJWPDL-QGZVFWFLSA-N	0	3	310.397	2.456	10	0		DEAEHN
CN(Cc1ccc(Cl)cc1Cl)C(=O)[C@H]1CNCCOC1	ZINC000643618094	407018136	/nfs/dbraw/zinc/01/81/36/407018136.db2.gz	CAXHMLFIDDCROM-NSHDSACASA-N	0	3	317.216	2.188	10	0		DEAEHN
C[C@@H](CSc1nnc(COc2ccccc2)n1C)N(C)C	ZINC000358776299	286891240	/nfs/dbraw/zinc/89/12/40/286891240.db2.gz	BTGLVKXVPGAKJP-LBPRGKRZSA-N	0	3	306.435	2.436	10	0		DEAEHN
C[C@@H](NCC(=O)NC(C)(C)C)c1ccccc1-n1cccn1	ZINC000177200797	287015654	/nfs/dbraw/zinc/01/56/54/287015654.db2.gz	KTKJDLXYVCOVHW-CYBMUJFWSA-N	0	3	300.406	2.438	10	0		DEAEHN
COc1ccc(Oc2cncc(CN)n2)c(Br)c1	ZINC000129624981	196063610	/nfs/dbraw/zinc/06/36/10/196063610.db2.gz	QECXBLSLECRRCK-UHFFFAOYSA-N	0	3	310.151	2.499	10	0		DEAEHN
C[C@H](NC(=O)C(C)(C)N1CCNCC1)c1ccc(Cl)s1	ZINC000129624428	196063649	/nfs/dbraw/zinc/06/36/49/196063649.db2.gz	DLZFRRRBYITZDB-JTQLQIEISA-N	0	3	315.870	2.263	10	0		DEAEHN
CCC[C@@H](NC(=O)C(C)(C)N1CCNCC1)c1cccs1	ZINC000129708563	196069027	/nfs/dbraw/zinc/06/90/27/196069027.db2.gz	SGAWYGMMOJZPLT-CYBMUJFWSA-N	0	3	309.479	2.389	10	0		DEAEHN
CC(C)[C@](C)(C[NH3+])[N-]S(=O)(=O)c1ccc(Cl)cc1F	ZINC000131179435	196147682	/nfs/dbraw/zinc/14/76/82/196147682.db2.gz	WOUAFAJHYKPZRY-LBPRGKRZSA-N	0	3	308.806	2.131	10	0		DEAEHN
CNCc1ccccc1S(=O)(=O)NCCCC(F)(F)F	ZINC000131235867	196151891	/nfs/dbraw/zinc/15/18/91/196151891.db2.gz	SLVXJLBZIOOWBB-UHFFFAOYSA-N	0	3	310.341	2.027	10	0		DEAEHN
CC(C)[C@@](C)(O)c1c(Br)cnn1CCN(C)C	ZINC000131405264	196165913	/nfs/dbraw/zinc/16/59/13/196165913.db2.gz	BEMBNMAOKAFZLK-GFCCVEGCSA-N	0	3	304.232	2.071	10	0		DEAEHN
CO[C@H]1CN[C@@H](C(=O)Nc2cccc(C)c2Br)C1	ZINC000131399831	196165416	/nfs/dbraw/zinc/16/54/16/196165416.db2.gz	PISDLJWTGWKFTD-MWLCHTKSSA-N	0	3	313.195	2.073	10	0		DEAEHN
CC(C)CN1CCC[C@@H]1CNc1ncc(C(N)=O)cc1Cl	ZINC000131437632	196168777	/nfs/dbraw/zinc/16/87/77/196168777.db2.gz	QLCZQBABFBJGSP-GFCCVEGCSA-N	0	3	310.829	2.366	10	0		DEAEHN
[NH3+]CC1(C[N-]S(=O)(=O)c2ccccc2F)CCCCC1	ZINC000131567039	196179968	/nfs/dbraw/zinc/17/99/68/196179968.db2.gz	PJSVFWJCQBODGM-UHFFFAOYSA-N	0	3	300.399	2.013	10	0		DEAEHN
C[C@H](CN(C)C)N1C(=O)C2(CCCC2)N[C@H]1c1ccsc1	ZINC000131648233	196187432	/nfs/dbraw/zinc/18/74/32/196187432.db2.gz	PNPLKTGRLAMIMQ-TZMCWYRMSA-N	0	3	307.463	2.441	10	0		DEAEHN
Cc1nc(-c2cncc(Br)c2)nc2c1CCNC2	ZINC000132139615	196229410	/nfs/dbraw/zinc/22/94/10/196229410.db2.gz	VGWGHDJRLYQZFA-UHFFFAOYSA-N	0	3	305.179	2.255	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)c1sc2cccnc2c1N	ZINC000132146626	196230243	/nfs/dbraw/zinc/23/02/43/196230243.db2.gz	HQDLRNDMWHNQKE-JTQLQIEISA-N	0	3	304.419	2.093	10	0		DEAEHN
Cc1cccc2c(NC[C@H](O)CN3CCCCC3)ncnc12	ZINC000132617771	196270642	/nfs/dbraw/zinc/27/06/42/196270642.db2.gz	JSHVJGUYODLBKI-AWEZNQCLSA-N	0	3	300.406	2.197	10	0		DEAEHN
CN[C@@H](CSCCS(C)(=O)=O)c1cc(C)cc(C)c1	ZINC000134081741	196359604	/nfs/dbraw/zinc/35/96/04/196359604.db2.gz	ZJKRBLXHVUTOFG-AWEZNQCLSA-N	0	3	301.477	2.342	10	0		DEAEHN
CCS(=O)(=O)C[C@H](C)NCCc1cn(C)c2cc(C)ccc12	ZINC000188699184	225030367	/nfs/dbraw/zinc/03/03/67/225030367.db2.gz	CVJKLJXLGCDXEU-AWEZNQCLSA-N	0	3	322.474	2.442	10	0		DEAEHN
C[C@H](NCCO[C@@H]1CCCCO1)c1ccc(-n2ccnn2)cc1	ZINC000193092367	225150984	/nfs/dbraw/zinc/15/09/84/225150984.db2.gz	JGASNIBBUVLYOB-WMLDXEAASA-N	0	3	316.405	2.461	10	0		DEAEHN
C[C@@H]1COCC[C@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000195418458	225205688	/nfs/dbraw/zinc/20/56/88/225205688.db2.gz	CNMQMUXIIDIKCN-KBAYOESNSA-N	0	3	316.445	2.440	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)c1cc(Br)c[nH]1	ZINC000037505976	424807971	/nfs/dbraw/zinc/80/79/71/424807971.db2.gz	ORFOTBSJGLKVQT-LLVKDONJSA-N	0	3	316.243	2.483	10	0		DEAEHN
Cc1ccc(NC(=O)Cn2cc(C(C)(C)N)nn2)c(Cl)c1	ZINC000070118448	424842136	/nfs/dbraw/zinc/84/21/36/424842136.db2.gz	BHRJAOFKTKXHAL-UHFFFAOYSA-N	0	3	307.785	2.072	10	0		DEAEHN
CC1(C)CN(C[C@@H](O)CCc2ccccc2)C[C@@]2(CCOC2)O1	ZINC000361528223	424845176	/nfs/dbraw/zinc/84/51/76/424845176.db2.gz	VKTPGIFCQMORPF-PKOBYXMFSA-N	0	3	319.445	2.250	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)Nc2ccc(C)cc2C)c1	ZINC000105881401	424849476	/nfs/dbraw/zinc/84/94/76/424849476.db2.gz	HUKVTTQPZKIBLQ-HNNXBMFYSA-N	0	3	300.406	2.425	10	0		DEAEHN
O[C@@]1(CCNCc2cccc(F)c2Br)CCOC1	ZINC000404197246	424925795	/nfs/dbraw/zinc/92/57/95/424925795.db2.gz	PSFUTDIEEXTMLC-ZDUSSCGKSA-N	0	3	318.186	2.219	10	0		DEAEHN
O[C@@]1(CCNCc2ccccc2Br)CCOC1	ZINC000404196267	424925853	/nfs/dbraw/zinc/92/58/53/424925853.db2.gz	INNHSOLTTKPMDM-ZDUSSCGKSA-N	0	3	300.196	2.080	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC2(C1)CN(Cc1ccccc1)C[C@H]2N	ZINC000409434038	424934828	/nfs/dbraw/zinc/93/48/28/424934828.db2.gz	VDGCJDWEKTVRMG-OAHLLOKOSA-N	0	3	317.433	2.067	10	0		DEAEHN
CN1CCC[C@@H](CNC(=O)Nc2cc(C3(C)CCCC3)on2)C1	ZINC000559502199	424887612	/nfs/dbraw/zinc/88/76/12/424887612.db2.gz	OFTDLJFEBRHPID-ZDUSSCGKSA-N	0	3	320.437	2.970	10	0		DEAEHN
CCn1cc([C@@H]2OCCC[C@H]2CNCc2conc2C)cn1	ZINC000657589149	425371012	/nfs/dbraw/zinc/37/10/12/425371012.db2.gz	GBJYNCVERMNJFV-XJKSGUPXSA-N	0	3	304.394	2.457	10	0		DEAEHN
c1ncn(-c2ccc(CNC[C@@H]3COC4(CCCC4)O3)cc2)n1	ZINC000360059864	269047679	/nfs/dbraw/zinc/04/76/79/269047679.db2.gz	QSHAHSCJWGQPNJ-MRXNPFEDSA-N	0	3	314.389	2.043	10	0		DEAEHN
CN(C)C1(CNC(=O)c2ncsc2Br)CCC1	ZINC000517347401	269383979	/nfs/dbraw/zinc/38/39/79/269383979.db2.gz	RPNQYJRQLRMAEI-UHFFFAOYSA-N	0	3	318.240	2.120	10	0		DEAEHN
C[C@@H](CC(N)=O)N[C@H]1CCOc2ccc(Br)cc21	ZINC000135720446	274207848	/nfs/dbraw/zinc/20/78/48/274207848.db2.gz	NRCUUTALIDQMPU-KWQFWETISA-N	0	3	313.195	2.126	10	0		DEAEHN
O=C([C@@H]1SCCc2sccc21)N1CCN2CCC[C@H]2C1	ZINC000246687835	275007263	/nfs/dbraw/zinc/00/72/63/275007263.db2.gz	BFVAWRJTKAVOAD-SMDDNHRTSA-N	0	3	308.472	2.385	10	0		DEAEHN
Brc1ccc2c(c1)[C@@H](NCCn1cncn1)CC2	ZINC000282793735	275371754	/nfs/dbraw/zinc/37/17/54/275371754.db2.gz	QTAKQNHCCJRKDE-ZDUSSCGKSA-N	0	3	307.195	2.318	10	0		DEAEHN
CC(C)(C)c1nnsc1C(=O)NC1CCN(C2CC2)CC1	ZINC000188957082	275541919	/nfs/dbraw/zinc/54/19/19/275541919.db2.gz	MNOAMBPDNFHNFK-UHFFFAOYSA-N	0	3	308.451	2.192	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@@H]1CCCN1c1nccs1	ZINC000156685395	275912641	/nfs/dbraw/zinc/91/26/41/275912641.db2.gz	WGXHWOAFBQFIMN-KGLIPLIRSA-N	0	3	324.494	2.204	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@@H]1CCO[C@@]2(CCSC2)C1	ZINC000495135827	276007040	/nfs/dbraw/zinc/00/70/40/276007040.db2.gz	BSOYWKLNAMEAFK-FMKPAKJESA-N	0	3	312.479	2.032	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc2ccccc2[nH]c1=O	ZINC000177008210	276181564	/nfs/dbraw/zinc/18/15/64/276181564.db2.gz	BSPSILRITDWPQH-AWEZNQCLSA-N	0	3	313.401	2.084	10	0		DEAEHN
CCC[C@H](N)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1	ZINC000236927491	276285639	/nfs/dbraw/zinc/28/56/39/276285639.db2.gz	AFFXPNUJFXILTI-SOUVJXGZSA-N	0	3	309.841	2.329	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2cc3ccc(Cl)cc3[nH]2)CCO1	ZINC000116791515	276769577	/nfs/dbraw/zinc/76/95/77/276769577.db2.gz	HBQXNALZORKIHA-ZDUSSCGKSA-N	0	3	321.808	2.224	10	0		DEAEHN
CC(=O)Nc1cccc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1	ZINC000157122805	277084881	/nfs/dbraw/zinc/08/48/81/277084881.db2.gz	GPWUXMORYVIOIU-DOTOQJQBSA-N	0	3	315.417	2.201	10	0		DEAEHN
C[C@@H](O)CCCN[C@H](Cn1ccccc1=O)c1ccccc1	ZINC000450921698	277636224	/nfs/dbraw/zinc/63/62/24/277636224.db2.gz	JPIIWGXYMXPNGU-NVXWUHKLSA-N	0	3	300.402	2.340	10	0		DEAEHN
C[C@H](C(=O)N1CCCC[C@@H]1c1nc[nH]n1)[C@H](N)c1ccccc1	ZINC000183002986	278138379	/nfs/dbraw/zinc/13/83/79/278138379.db2.gz	YFYSXOINBMRISR-CFVMTHIKSA-N	0	3	313.405	2.194	10	0		DEAEHN
C[C@H]1CCCC[C@@H]1NC(=O)NC(=O)CN1CCCC12CCC2	ZINC000444787711	278335904	/nfs/dbraw/zinc/33/59/04/278335904.db2.gz	YOFUTTBWGWBWLQ-KBPBESRZSA-N	0	3	307.438	2.409	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)NCC1(O)CCCCCC1	ZINC000118061672	279127429	/nfs/dbraw/zinc/12/74/29/279127429.db2.gz	LEGRSDCMVMCGEB-OAHLLOKOSA-N	0	3	313.486	2.347	10	0		DEAEHN
C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)N1CCCN(C2CC2)CC1	ZINC000178869401	279212889	/nfs/dbraw/zinc/21/28/89/279212889.db2.gz	LKFABFQJNBZNID-BZUAXINKSA-N	0	3	307.482	2.335	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCCC[C@H]2c2ncc[nH]2)C1	ZINC000247608151	279293449	/nfs/dbraw/zinc/29/34/49/279293449.db2.gz	LYZGZCZJTQQDPV-KGLIPLIRSA-N	0	3	305.426	2.131	10	0		DEAEHN
O=C(C[C@H]1C(=O)Nc2ccccc21)NCCN1CCCCCC1	ZINC000132550371	279793844	/nfs/dbraw/zinc/79/38/44/279793844.db2.gz	CYYGAFKSEKJCIQ-OAHLLOKOSA-N	0	3	315.417	2.105	10	0		DEAEHN
Cc1ccc(S(=O)(=O)C[C@H](C)N[C@@H]2CCOC[C@H]2C)cc1	ZINC000249320880	280927361	/nfs/dbraw/zinc/92/73/61/280927361.db2.gz	QQPCNQPARFYVHI-IJEWVQPXSA-N	0	3	311.447	2.172	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)c1cc(-c2cccnc2)on1	ZINC000068224087	281522993	/nfs/dbraw/zinc/52/29/93/281522993.db2.gz	UKERBOQSUNEIPK-AWEZNQCLSA-N	0	3	316.405	2.443	10	0		DEAEHN
CC[C@](C)(CCO)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179482834	288389626	/nfs/dbraw/zinc/38/96/26/288389626.db2.gz	MGLVBVYXUSSTMC-LZLYRXPVSA-N	0	3	319.449	2.282	10	0		DEAEHN
NC(=O)N1CCC(N[C@H]2CCCOc3c(F)cccc32)CC1	ZINC000181088829	295061294	/nfs/dbraw/zinc/06/12/94/295061294.db2.gz	WMUNMCIMFMDHMG-AWEZNQCLSA-N	0	3	307.369	2.172	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N[C@@H]1CCc3ncnn3C1)CCCO2	ZINC000180604028	295275717	/nfs/dbraw/zinc/27/57/17/295275717.db2.gz	WRUZMHUAFYMUIX-IUODEOHRSA-N	0	3	314.389	2.105	10	0		DEAEHN
C[C@H](C(=O)N[C@H]1CCCC[C@H]1C)N1C[C@H]2CCC[C@@H](C1)C2O	ZINC000246955799	298187422	/nfs/dbraw/zinc/18/74/22/298187422.db2.gz	JLKUOAVMYAFSCO-VOYDFQSCSA-N	0	3	308.466	2.163	10	0		DEAEHN
CN(CCNC(=O)NCCOCC1CCC1)Cc1ccccc1	ZINC000573772159	326089419	/nfs/dbraw/zinc/08/94/19/326089419.db2.gz	LDFVIEIWGFYEJD-UHFFFAOYSA-N	0	3	319.449	2.234	10	0		DEAEHN
Brc1ccc(CN[C@H]2CCc3nc[nH]c3C2)nc1	ZINC000574005610	326113445	/nfs/dbraw/zinc/11/34/45/326113445.db2.gz	VIWDMRYBHGCEIJ-JTQLQIEISA-N	0	3	307.195	2.214	10	0		DEAEHN
Brc1ccc(CN[C@H]2CCc3[nH]cnc3C2)nc1	ZINC000574005610	326113447	/nfs/dbraw/zinc/11/34/47/326113447.db2.gz	VIWDMRYBHGCEIJ-JTQLQIEISA-N	0	3	307.195	2.214	10	0		DEAEHN
C[C@@H](CNC(=O)NCCOCC1CCC1)N1CCCC[C@H]1C	ZINC000575037635	326211974	/nfs/dbraw/zinc/21/19/74/326211974.db2.gz	RHTKMBAEHSUQEO-CABCVRRESA-N	0	3	311.470	2.365	10	0		DEAEHN
CC(=O)c1cnc(NC(=O)[C@@H]2CNCc3ccccc32)s1	ZINC000583260241	337291114	/nfs/dbraw/zinc/29/11/14/337291114.db2.gz	LGSCRTYXUQUFRH-GFCCVEGCSA-N	0	3	301.371	2.171	10	0		DEAEHN
Cc1c(N2CCNCC2)c(F)cc2ccc(=O)n(C3CC3)c12	ZINC000584622147	337375067	/nfs/dbraw/zinc/37/50/67/337375067.db2.gz	XMWBIDZJYPDKGT-UHFFFAOYSA-N	0	3	301.365	2.194	10	0		DEAEHN
CC(C)Oc1cccc(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)n1	ZINC000247076457	519782460	/nfs/dbraw/zinc/78/24/60/519782460.db2.gz	VVFQTULOPBQTMC-DZGCQCFKSA-N	0	3	305.422	2.327	10	0		DEAEHN
CCCCNC(=O)[C@H](C)N1CCC[C@H](n2ccnc2CC)C1	ZINC000105897270	520667213	/nfs/dbraw/zinc/66/72/13/520667213.db2.gz	LCJLKVIEKQWQAT-GJZGRUSLSA-N	0	3	306.454	2.387	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccc(OCC2CC2)nc1)N(C)C	ZINC000161880613	520982928	/nfs/dbraw/zinc/98/29/28/520982928.db2.gz	OLMPDMXZVTUTJV-OAHLLOKOSA-N	0	3	305.422	2.217	10	0		DEAEHN
CCC[C@H](C(=O)N[C@@H]1CCN(C(=O)C2CCCCC2)C1)N(C)C	ZINC000154897003	520984683	/nfs/dbraw/zinc/98/46/83/520984683.db2.gz	LDPDUXWIUCGEGW-HZPDHXFCSA-N	0	3	323.481	2.014	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cc2ccc(CSC(F)F)o2)CCO1	ZINC000128076839	521851170	/nfs/dbraw/zinc/85/11/70/521851170.db2.gz	IRVAFKQDAAFHTR-CYBMUJFWSA-N	0	3	320.405	2.498	10	0		DEAEHN
COc1ccccc1CCN(C)C(=O)NC[C@H](C)N(C)C1CC1	ZINC000105263138	524406563	/nfs/dbraw/zinc/40/65/63/524406563.db2.gz	FCWFEUVJASEFMG-AWEZNQCLSA-N	0	3	319.449	2.362	10	0		DEAEHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)N(C)[C@@H](C)c1cnn(C)c1	ZINC000245927214	524611734	/nfs/dbraw/zinc/61/17/34/524611734.db2.gz	SXXGBAFEYIACAK-ILXRZTDVSA-N	0	3	321.469	2.243	10	0		DEAEHN
COc1ccc(OC)c(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1	ZINC000246814010	524808912	/nfs/dbraw/zinc/80/89/12/524808912.db2.gz	DIECCKWIPJUJDJ-SWLSCSKDSA-N	0	3	306.406	2.162	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)CSCc2ccccn2)CCN1C	ZINC000124343175	524899228	/nfs/dbraw/zinc/89/92/28/524899228.db2.gz	BREVCELNMNTIMK-DZGCQCFKSA-N	0	3	307.463	2.256	10	0		DEAEHN
CCCN1CCC[C@H]1CNC(=O)c1cc(C)cc(C(=O)OC)c1	ZINC000457841656	534908555	/nfs/dbraw/zinc/90/85/55/534908555.db2.gz	XJCZCNCUKXBWTG-INIZCTEOSA-N	0	3	318.417	2.386	10	0		DEAEHN
CCCCOC[C@@H](O)CN[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000195215076	528619949	/nfs/dbraw/zinc/61/99/49/528619949.db2.gz	CDMJTCKSAIBZIU-YOEHRIQHSA-N	0	3	318.421	2.096	10	0		DEAEHN
CC(=O)c1ccccc1OCCN1C[C@@H]2CCCN2C[C@H]1C	ZINC000247059050	534927464	/nfs/dbraw/zinc/92/74/64/534927464.db2.gz	HGDGBSHEGUKFJG-ZBFHGGJFSA-N	0	3	302.418	2.437	10	0		DEAEHN
CC(C)n1ncc2ccc(NC(=O)C3(N)CCOCC3)cc21	ZINC000261886063	535141138	/nfs/dbraw/zinc/14/11/38/535141138.db2.gz	PYXRZRKRVOFKQB-UHFFFAOYSA-N	0	3	302.378	2.064	10	0		DEAEHN
CCC[C@H](C(=O)N1C[C@H](CO)[C@H](c2ccsc2)C1)N(C)C	ZINC000187690231	535580387	/nfs/dbraw/zinc/58/03/87/535580387.db2.gz	ZEQBVCSXCAYLPD-QLFBSQMISA-N	0	3	310.463	2.013	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)S(=O)(=O)CCc1cccs1	ZINC000189685177	535593391	/nfs/dbraw/zinc/59/33/91/535593391.db2.gz	XBXLGOSBFVLEKE-ZDUSSCGKSA-N	0	3	316.492	2.037	10	0		DEAEHN
CC[C@H](NC[C@H]1CCC2(CCOCC2)[C@H]1O)c1nccn1C	ZINC000374791859	535911145	/nfs/dbraw/zinc/91/11/45/535911145.db2.gz	HZQCWLPTZLIJSX-ILXRZTDVSA-N	0	3	307.438	2.029	10	0		DEAEHN
CCc1ccccc1NC(=O)CN1CCNC[C@H]1c1cccnc1	ZINC000261864836	535949409	/nfs/dbraw/zinc/94/94/09/535949409.db2.gz	WUZICXJRNUWQEA-SFHVURJKSA-N	0	3	324.428	2.229	10	0		DEAEHN
CN(C)C[C@H](NC(=O)N[C@@H]1C[C@@H]2OCCC[C@H]12)c1ccccc1	ZINC000251586900	535951791	/nfs/dbraw/zinc/95/17/91/535951791.db2.gz	FIYZYVNOGWBOLP-NCOADZHNSA-N	0	3	317.433	2.156	10	0		DEAEHN
CN(C)C[C@H](NC(=O)N[C@H]1CCO[C@@H]1C1CC1)c1ccccc1	ZINC000332751833	535951982	/nfs/dbraw/zinc/95/19/82/535951982.db2.gz	BTVRXJIHERMIAV-YESZJQIVSA-N	0	3	317.433	2.156	10	0		DEAEHN
CN(C(=O)C1(N)CCOCC1)c1cccc(OC(F)(F)F)c1	ZINC000261698547	535961640	/nfs/dbraw/zinc/96/16/40/535961640.db2.gz	DSAMEEZPXTXUCI-UHFFFAOYSA-N	0	3	318.295	2.056	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(C[C@H](O)CC(F)(F)F)C1	ZINC000189218391	536174410	/nfs/dbraw/zinc/17/44/10/536174410.db2.gz	BCIAMICAYRAERD-VXGBXAGGSA-N	0	3	305.344	2.396	10	0		DEAEHN
CCc1ccc(OCC(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1	ZINC000247383707	536191430	/nfs/dbraw/zinc/19/14/30/536191430.db2.gz	PYVOIPRJEGPQIN-PBHICJAKSA-N	0	3	304.434	2.473	10	0		DEAEHN
CN1CCC[C@@H]2CN(C(=O)C(=O)c3ccc(Cl)cc3)CC[C@H]21	ZINC000247114355	536376499	/nfs/dbraw/zinc/37/64/99/536376499.db2.gz	QTSSRJFHYMAKBI-UKRRQHHQSA-N	0	3	320.820	2.465	10	0		DEAEHN
COc1c(O)cc2c(c1OC)CN1CC[C@]23C=C[C@H](OC)C[C@@H]13	ZINC000004097637	560194882	/nfs/dbraw/zinc/19/48/82/560194882.db2.gz	FADGQBPUPGSTJB-BKGUAONASA-N	0	3	317.385	2.210	10	0	in-vitro	DEAEHN
COCC[C@@H](N)C(=O)Nc1ccc(OC(C)C)c(Cl)c1	ZINC000052792659	625321182	/nfs/dbraw/zinc/32/11/82/625321182.db2.gz	QTJUVWBWHYOTDE-GFCCVEGCSA-N	0	3	300.786	2.430	10	0		DEAEHN
C[C@@H]1CC[C@H](C(N)=O)CN1C[C@H](O)c1ccc(F)cc1Cl	ZINC000186949335	625411866	/nfs/dbraw/zinc/41/18/66/625411866.db2.gz	ZDDXCSDIRRMEOC-BFVZDQMLSA-N	0	3	314.788	2.098	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@@H]1N(C)S(=O)(=O)/C=C\c1ccccc1	ZINC000255557839	625058335	/nfs/dbraw/zinc/05/83/35/625058335.db2.gz	OPCZEWDUSTZLTC-VGMOZLQASA-N	0	3	308.447	2.259	10	0		DEAEHN
CC(C)OC[C@H](O)CNCc1csc(Br)c1	ZINC000309342063	625135512	/nfs/dbraw/zinc/13/55/12/625135512.db2.gz	KPNOOZPTXHYKAE-SNVBAGLBSA-N	0	3	308.241	2.386	10	0		DEAEHN
CNc1ncc(C(=O)N[C@H](CN(C)C)c2ccccc2)s1	ZINC000159196664	634749084	/nfs/dbraw/zinc/74/90/84/634749084.db2.gz	DTJDTHRICYNDFY-GFCCVEGCSA-N	0	3	304.419	2.218	10	0		DEAEHN
O=C(Nc1ccc2nccn2c1)c1nnc2ccccc2c1O	ZINC000735660779	633527127	/nfs/dbraw/zinc/52/71/27/633527127.db2.gz	DDWNVEZRWHIROR-UHFFFAOYSA-N	0	3	305.297	2.235	10	0		DEAEHN
Cc1cc(C)n(CCN2C[C@@H]3CCC[C@]3(c3nc(C)no3)C2)n1	ZINC000888098677	635544870	/nfs/dbraw/zinc/54/48/70/635544870.db2.gz	JYANSIQQJPKAAA-RDJZCZTQSA-N	0	3	315.421	2.245	10	0		DEAEHN
CC[C@H](C)[C@@H](N)C(=O)Nc1cccc(-c2nncn2CC)c1	ZINC000236917771	636117509	/nfs/dbraw/zinc/11/75/09/636117509.db2.gz	IFHRPYDNAIFKRQ-SMDDNHRTSA-N	0	3	301.394	2.277	10	0		DEAEHN
CCN(CC)[C@@H]1CCN(S(=O)(=O)/C=C\c2ccccc2)C1	ZINC000299735375	637006784	/nfs/dbraw/zinc/00/67/84/637006784.db2.gz	UZMWUJCAUBTPOA-DVFVSVACSA-N	0	3	308.447	2.403	10	0		DEAEHN
CC(C)(C)n1cc(CN2CCN(CC[C@@H]3CCCO3)CC2)cn1	ZINC000189191374	637353476	/nfs/dbraw/zinc/35/34/76/637353476.db2.gz	UKILIRBYDVVXSH-KRWDZBQOSA-N	0	3	320.481	2.325	10	0		DEAEHN
CN1CCN(CCCNC(=O)C=C2CCC(C)(C)CC2)CC1	ZINC000751560121	639093977	/nfs/dbraw/zinc/09/39/77/639093977.db2.gz	HOZUKEKNEBSXKN-UHFFFAOYSA-N	0	3	307.482	2.267	10	0		DEAEHN
CCC[C@@H](C(=O)N[C@H](C)CC(=O)OCc1ccccc1)N(C)C	ZINC000121528244	650909525	/nfs/dbraw/zinc/90/95/25/650909525.db2.gz	GTKCIPUAUAQYRH-ZBFHGGJFSA-N	0	3	320.433	2.355	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NC[C@H](O)c1cc(C)cc(C)c1	ZINC000801532695	645410297	/nfs/dbraw/zinc/41/02/97/645410297.db2.gz	CWKXPPKVKJZSTG-SJORKVTESA-N	0	3	304.434	2.327	10	0		DEAEHN
Cc1cc(C)cc([C@H](O)CN2CCC(N3CCCC3=O)CC2)c1	ZINC000173668226	646776675	/nfs/dbraw/zinc/77/66/75/646776675.db2.gz	CVQKMDOBXSRGAB-GOSISDBHSA-N	0	3	316.445	2.424	10	0		DEAEHN
COC(=O)[C@H]1CCCN(Cn2cnc3cc(C)c(C)cc32)C1	ZINC000151641484	646989926	/nfs/dbraw/zinc/98/99/26/646989926.db2.gz	RPIHIYXUOQVKTH-AWEZNQCLSA-N	0	3	301.390	2.496	10	0		DEAEHN
C/C(=C/C(=O)NC[C@@H]1CN2CCC[C@@H]2CO1)c1cccc(F)c1	ZINC000732064803	647537372	/nfs/dbraw/zinc/53/73/72/647537372.db2.gz	FSZKSUUWFXVWGL-QIXZXHIJSA-N	0	3	318.392	2.208	10	0		DEAEHN
O[C@@H]1CCC[C@H]1NCc1ccccc1I	ZINC000379999271	685393990	/nfs/dbraw/zinc/39/39/90/685393990.db2.gz	LQMVTKGPSHFPTM-VXGBXAGGSA-N	0	3	317.170	2.294	10	0		DEAEHN
Cc1c([O-])ccc2c(CN3CCC([NH+](C)C)CC3)cc(=O)oc12	ZINC000127894549	684166952	/nfs/dbraw/zinc/16/69/52/684166952.db2.gz	XJHCGHHOBONTHP-UHFFFAOYSA-N	0	3	316.401	2.333	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1ccn(CC(F)F)n1)c1ccccc1	ZINC000193718149	685047526	/nfs/dbraw/zinc/04/75/26/685047526.db2.gz	KNJDNZCBONJEMX-CQSZACIVSA-N	0	3	322.359	2.181	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@H](C)C[C@H](O)c2ccccc2)C1	ZINC000246818004	685137181	/nfs/dbraw/zinc/13/71/81/685137181.db2.gz	YXWQRFDHEHWJDV-PVAVHDDUSA-N	0	3	319.449	2.282	10	0		DEAEHN
O=C(C[C@@H]1COC(=O)C1)O[C@H]1CCCN(Cc2ccccc2)C1	ZINC000248383568	685157293	/nfs/dbraw/zinc/15/72/93/685157293.db2.gz	ANPWNIZDCKQKBH-CVEARBPZSA-N	0	3	317.385	2.147	10	0		DEAEHN
C[C@H](NCc1cn[nH]n1)[C@H]1CCCCN1C(=O)OC(C)(C)C	ZINC000398397539	790270213	/nfs/dbraw/zinc/27/02/13/790270213.db2.gz	AOIOIJKUNZONGD-WCQYABFASA-N	0	3	309.414	2.072	10	0		DEAEHN
C[C@H](NCc1c[nH]nn1)[C@H]1CCCCN1C(=O)OC(C)(C)C	ZINC000398397539	790270215	/nfs/dbraw/zinc/27/02/15/790270215.db2.gz	AOIOIJKUNZONGD-WCQYABFASA-N	0	3	309.414	2.072	10	0		DEAEHN
CC[C@H](NCc1c(Br)cnn1C)[C@@H]1CCCOC1	ZINC000724007671	777219746	/nfs/dbraw/zinc/21/97/46/777219746.db2.gz	KAMASRYQHHXXRP-PWSUYJOCSA-N	0	3	316.243	2.477	10	0		DEAEHN
CO[C@@]1(C)CCCN(C[C@](C)(O)C(F)(F)C(F)(F)F)C1	ZINC000724110696	777242442	/nfs/dbraw/zinc/24/24/42/777242442.db2.gz	ISVMYDBXWSGPSO-UWVGGRQHSA-N	0	3	305.287	2.436	10	0		DEAEHN
Cc1nn(C)c(C)c1CN[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000721891688	781578197	/nfs/dbraw/zinc/57/81/97/781578197.db2.gz	WOIYOWRXYWZMKU-IAQYHMDHSA-N	0	3	322.453	2.382	10	0		DEAEHN
Cc1ncc(CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)n1C	ZINC000721864249	787323785	/nfs/dbraw/zinc/32/37/85/787323785.db2.gz	WXVNFHUPHQGBEN-BXUZGUMPSA-N	0	3	308.426	2.074	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCNCCC2(C)C)sc1Cl	ZINC000712505034	792190439	/nfs/dbraw/zinc/19/04/39/792190439.db2.gz	AOXAWVRTOWSRDP-UHFFFAOYSA-N	0	3	322.883	2.473	10	0		DEAEHN
CCn1cc(CNC[C@@H]2CCCCN2Cc2ccccc2)nn1	ZINC000714904622	792357872	/nfs/dbraw/zinc/35/78/72/792357872.db2.gz	DEHIOEFNXNKNSR-SFHVURJKSA-N	0	3	313.449	2.442	10	0		DEAEHN
C[C@H]([N-]S(=O)(=O)c1cccc(Cl)c1F)C1CC[NH2+]CC1	ZINC000716564545	792974282	/nfs/dbraw/zinc/97/42/82/792974282.db2.gz	HGTMUUIUTSHGMQ-VIFPVBQESA-N	0	3	320.817	2.146	10	0		DEAEHN
C/C=C\C(=O)N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21	ZINC000404242474	802012886	/nfs/dbraw/zinc/01/28/86/802012886.db2.gz	XZYSINQTXSNGRG-RELMXNIOSA-N	0	3	300.402	2.064	10	0		DEAEHN
CCn1cc(CN[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2C)nn1	ZINC000404432530	802020054	/nfs/dbraw/zinc/02/00/54/802020054.db2.gz	OECXKLZYSASEBW-OCCSQVGLSA-N	0	3	323.441	2.033	10	0		DEAEHN
COC(C)(C)C[C@H](C)NCc1cn(C)nc1Br	ZINC000720644464	1085807942	/nfs/dbraw/zinc/80/79/42/1085807942.db2.gz	CGMXMGSURZWBQB-VIFPVBQESA-N	0	3	304.232	2.476	10	0		DEAEHN
C[C@@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C)c1ccnn1C	ZINC000700736610	1086331878	/nfs/dbraw/zinc/33/18/78/1086331878.db2.gz	ARVXEOFYPNJVGV-FRRDWIJNSA-N	0	3	308.426	2.469	10	0		DEAEHN
Cc1cnn(C)c1CN[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C	ZINC000700755839	1086332311	/nfs/dbraw/zinc/33/23/11/1086332311.db2.gz	DGHWQCKFWKYIQC-OLZOCXBDSA-N	0	3	308.426	2.216	10	0		DEAEHN
C[C@H](Cc1ccccn1)N[C@@H]1CON(C(=O)OC(C)(C)C)C1	ZINC000703316066	1086494295	/nfs/dbraw/zinc/49/42/95/1086494295.db2.gz	XEPNHBOVQCESKS-OCCSQVGLSA-N	0	3	307.394	2.153	10	0		DEAEHN
CCn1cncc1CNCC12CC(C1)CN2C(=O)OC(C)(C)C	ZINC000706424464	1086638446	/nfs/dbraw/zinc/63/84/46/1086638446.db2.gz	IXCGHNDIGDKDGS-UHFFFAOYSA-N	0	3	320.437	2.392	10	0		DEAEHN
CC[C@H](CN[C@@H]1CCC1(OC)OC)NC(=O)OC(C)(C)C	ZINC000710959140	1086691174	/nfs/dbraw/zinc/69/11/74/1086691174.db2.gz	KXFVLOGWJKXYDQ-VXGBXAGGSA-N	0	3	302.415	2.031	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@]23CCC[C@H]2C[NH2+]C3)sc1Cl	ZINC000711357066	1087072728	/nfs/dbraw/zinc/07/27/28/1087072728.db2.gz	JXPSFSIPFUEZQV-CABZTGNLSA-N	0	3	320.867	2.130	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-][C@@]23CCC[C@@H]2[NH2+]CC3)sc1Cl	ZINC000711622334	1087176901	/nfs/dbraw/zinc/17/69/01/1087176901.db2.gz	JANKZIWKBKQUSZ-JOYOIKCWSA-N	0	3	320.867	2.273	10	0		DEAEHN
CO[C@@]1(CNCc2ccc(Br)cn2)CCSC1	ZINC000719316264	1088935945	/nfs/dbraw/zinc/93/59/45/1088935945.db2.gz	MWMQMSGDHQMWSK-GFCCVEGCSA-N	0	3	317.252	2.456	10	0		DEAEHN
C[C@@H]1[C@H](NC(=O)c2ccc(Br)c(F)c2)CCN1C	ZINC000719384704	1089053246	/nfs/dbraw/zinc/05/32/46/1089053246.db2.gz	DPOGMKSDGOXIRW-PRHODGIISA-N	0	3	315.186	2.411	10	0		DEAEHN
C(N[C@H]1CCCN2CCSC[C@H]12)c1nc2c(s1)CCC2	ZINC000719530665	1089287085	/nfs/dbraw/zinc/28/70/85/1089287085.db2.gz	NVCJRGXDFOQQNP-WCQYABFASA-N	0	3	309.504	2.301	10	0		DEAEHN
C[C@H](NC[C@@](C)(O)C(F)(F)C(F)(F)F)c1cnn(C)c1	ZINC000724024390	1143896409	/nfs/dbraw/zinc/89/64/09/1143896409.db2.gz	PYIHBYINKRSOMZ-IONNQARKSA-N	0	3	301.259	2.019	10	0		DEAEHN
CN[C@@H](CSCCS(C)(=O)=O)c1cc(C)ccc1OC	ZINC000081768992	192322300	/nfs/dbraw/zinc/32/23/00/192322300.db2.gz	GOOAWVTZWYPIDD-ZDUSSCGKSA-N	0	3	317.476	2.042	10	0		DEAEHN
COc1ccccc1[C@@H](N)CSc1nnc(N(C)C)s1	ZINC000081769296	192323128	/nfs/dbraw/zinc/32/31/28/192323128.db2.gz	HXUGOVYMODVZHR-JTQLQIEISA-N	0	3	310.448	2.405	10	0		DEAEHN
CCN[C@@H]1CCOC[C@H]1S(=O)(=O)c1ccc(C(C)C)cc1	ZINC000081919963	192338851	/nfs/dbraw/zinc/33/88/51/192338851.db2.gz	ORKXAXYGJMLHSC-HZPDHXFCSA-N	0	3	311.447	2.351	10	0		DEAEHN
CCCN[C@H]1CCOC[C@H]1S(=O)(=O)c1ccc(C)c(C)c1	ZINC000081921891	192339297	/nfs/dbraw/zinc/33/92/97/192339297.db2.gz	YHSCOZLAEXEZIV-JKSUJKDBSA-N	0	3	311.447	2.234	10	0		DEAEHN
CCN[C@@H]1CCN(c2ccc(F)c(Br)c2)C1=O	ZINC000164196595	197652427	/nfs/dbraw/zinc/65/24/27/197652427.db2.gz	CCPZKBXBEVDAIF-LLVKDONJSA-N	0	3	301.159	2.303	10	0		DEAEHN
Cc1noc(C)c1CNC[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000328644014	231282983	/nfs/dbraw/zinc/28/29/83/231282983.db2.gz	RNHRURMTQPPIHH-RDJZCZTQSA-N	0	3	300.406	2.469	10	0		DEAEHN
COc1cc(C(=O)[C@@H]2CCCN2)c(OC)cc1Br	ZINC000083255764	185221564	/nfs/dbraw/zinc/22/15/64/185221564.db2.gz	WFZRFCSIRNCCIG-JTQLQIEISA-N	0	3	314.179	2.401	10	0		DEAEHN
CC[C@@H](N)[C@H](c1ccc(Cl)s1)N1CCCNC(=O)C1	ZINC000087883144	185234536	/nfs/dbraw/zinc/23/45/36/185234536.db2.gz	XJHNHKNRUCPDPZ-NOZJJQNGSA-N	0	3	301.843	2.002	10	0		DEAEHN
O[C@@H]1CCOC[C@H]1[C@@H]1CCCN1Cc1nc2cccnc2s1	ZINC000328806960	231353641	/nfs/dbraw/zinc/35/36/41/231353641.db2.gz	MBYXOPPWDJBAMY-FPMFFAJLSA-N	0	3	319.430	2.053	10	0		DEAEHN
CN(Cc1csc(Br)c1)c1ccnc(=NN)[nH]1	ZINC000087866194	185233925	/nfs/dbraw/zinc/23/39/25/185233925.db2.gz	PCJCEAUENCJACM-UHFFFAOYSA-N	0	3	314.212	2.223	10	0		DEAEHN
CN[C@H]1CCCN(c2ccc(OC)c(Br)c2)C1=O	ZINC000088330729	185245887	/nfs/dbraw/zinc/24/58/87/185245887.db2.gz	VRTQEEZAPCLQHR-NSHDSACASA-N	0	3	313.195	2.173	10	0		DEAEHN
CN[C@@](C)(C[C@H](C)N1CCC(C(F)(F)F)CC1)C(=O)OC	ZINC000088435529	185250421	/nfs/dbraw/zinc/25/04/21/185250421.db2.gz	YUYXQXOFVMFROW-GWCFXTLKSA-N	0	3	310.360	2.190	10	0		DEAEHN
C[N-]S(=O)(=O)c1ccc(C[NH2+]C2CCCCCCC2)o1	ZINC000088539764	185255254	/nfs/dbraw/zinc/25/52/54/185255254.db2.gz	GNMDYHBFLNPODU-UHFFFAOYSA-N	0	3	300.424	2.390	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N[C@H]2CCCC[C@@H]2C)o1	ZINC000088542083	185256289	/nfs/dbraw/zinc/25/62/89/185256289.db2.gz	HTKTWBBMLBGTTA-AAEUAGOBSA-N	0	3	300.424	2.246	10	0		DEAEHN
CCCNCc1ccc(S(=O)(=O)N(C)CC(C)(C)C)o1	ZINC000088544340	185256647	/nfs/dbraw/zinc/25/66/47/185256647.db2.gz	VAVSBWUVWFTUCE-UHFFFAOYSA-N	0	3	302.440	2.446	10	0		DEAEHN
N[C@H]1COC[C@@H]1C(=O)Nc1c(Cl)cccc1C(F)(F)F	ZINC000090379133	185293750	/nfs/dbraw/zinc/29/37/50/185293750.db2.gz	VIFNGSBSLBGZCI-RCOVLWMOSA-N	0	3	308.687	2.271	10	0		DEAEHN
C[C@]1(c2nc(-c3ccccc3Br)no2)COC[C@H]1N	ZINC000090573562	185304451	/nfs/dbraw/zinc/30/44/51/185304451.db2.gz	OJEOYUVIUKZKHG-MFKMUULPSA-N	0	3	324.178	2.114	10	0		DEAEHN
CN(C)C[C@@H]1CSCCCN1C(=O)NCCc1ccccc1	ZINC000090700228	185310604	/nfs/dbraw/zinc/31/06/04/185310604.db2.gz	TXUIZKIGDKYKLW-MRXNPFEDSA-N	0	3	321.490	2.308	10	0		DEAEHN
COCCN(CCC(N)=S)Cc1ccnc2ccccc12	ZINC000092347820	185313594	/nfs/dbraw/zinc/31/35/94/185313594.db2.gz	VAQPHNCCRLWFAR-UHFFFAOYSA-N	0	3	303.431	2.359	10	0		DEAEHN
CN(C)CCN1CCN(C[C@@H]2CSc3ccccc32)CC1	ZINC000092663042	185332505	/nfs/dbraw/zinc/33/25/05/185332505.db2.gz	XGOFIAUBTHPPFT-OAHLLOKOSA-N	0	3	305.491	2.055	10	0		DEAEHN
CNCc1cc(S(=O)(=O)NC2C(C)(C)C2(C)C)c(C)s1	ZINC000092833290	185345043	/nfs/dbraw/zinc/34/50/43/185345043.db2.gz	FCBABRWTYINDJT-UHFFFAOYSA-N	0	3	316.492	2.489	10	0		DEAEHN
COc1cc(Br)ccc1[C@@H](C)NCCOCCO	ZINC000190440473	282320870	/nfs/dbraw/zinc/32/08/70/282320870.db2.gz	HHHLJPQDMPGFTO-SNVBAGLBSA-N	0	3	318.211	2.117	10	0		DEAEHN
CC(C)(C)N1CCC(n2c(=O)[nH]c3ccccc3c2=O)CC1	ZINC000193441181	282351454	/nfs/dbraw/zinc/35/14/54/282351454.db2.gz	JQCXIWOIUHGPHM-UHFFFAOYSA-N	0	3	301.390	2.125	10	0		DEAEHN
CN(Cc1cc(Cl)cc(Cl)c1)C(=O)COC1(C)CNC1	ZINC000098061131	539435981	/nfs/dbraw/zinc/43/59/81/539435981.db2.gz	STMCUZKRRFXLFL-UHFFFAOYSA-N	0	3	317.216	2.330	10	0		DEAEHN
COC(=O)[C@@H]1CCC[C@H](C(=O)N[C@H](CC(C)C)CN(C)C)C1	ZINC000245452577	282389541	/nfs/dbraw/zinc/38/95/41/282389541.db2.gz	DRBPXTJZDFDKSM-RRFJBIMHSA-N	0	3	312.454	2.058	10	0		DEAEHN
c1ccc(NC[C@@H]2CCN(CCO[C@@H]3CCCCO3)C2)nc1	ZINC000181712662	199343077	/nfs/dbraw/zinc/34/30/77/199343077.db2.gz	ASCRIVCOWMTXMB-DOTOQJQBSA-N	0	3	305.422	2.359	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NC(=O)N2CCN3CCC[C@H]3C2)C12CCCC2	ZINC000245485157	282391485	/nfs/dbraw/zinc/39/14/85/282391485.db2.gz	IVZXMJORLQNAQA-ARFHVFGLSA-N	0	3	321.465	2.214	10	0		DEAEHN
COC1(CNCc2cnc3c(cnn3C(C)C)c2)CCOCC1	ZINC000123064954	539463705	/nfs/dbraw/zinc/46/37/05/539463705.db2.gz	LPOVCNMZRXXNBX-UHFFFAOYSA-N	0	3	318.421	2.297	10	0		DEAEHN
CCO[C@@H]1C[C@H](NC(=O)N2CC[C@@H](N(C)C)C2)C12CCCCC2	ZINC000246553974	282450610	/nfs/dbraw/zinc/45/06/10/282450610.db2.gz	GWONHEWGXRSZRZ-OWCLPIDISA-N	0	3	323.481	2.460	10	0		DEAEHN
CN[C@H](C[S@](=O)C1CCOCC1)c1cc(C)ccc1OC	ZINC000084054741	192397534	/nfs/dbraw/zinc/39/75/34/192397534.db2.gz	IVBDMLGNCIRDSG-QVKFZJNVSA-N	0	3	311.447	2.192	10	0		DEAEHN
CC(C)C[C@H](N)C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1	ZINC000236731167	201985585	/nfs/dbraw/zinc/98/55/85/201985585.db2.gz	SAYILPXTOMTZKK-FZMZJTMJSA-N	0	3	311.376	2.033	10	0		DEAEHN
CS(=O)(=O)c1cccc2[nH]c(C3(CN)CCCCC3)nc21	ZINC000138159569	186014638	/nfs/dbraw/zinc/01/46/38/186014638.db2.gz	RXDYLHQWZBVSFP-UHFFFAOYSA-N	0	3	307.419	2.127	10	0		DEAEHN
CCCN(CCC)S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000138280969	186015963	/nfs/dbraw/zinc/01/59/63/186015963.db2.gz	XPVWAJOVJJNRQM-UHFFFAOYSA-N	0	3	306.378	2.234	10	0		DEAEHN
CN(C)CCn1ncc(Cl)c1[C@H](O)c1ccncc1Cl	ZINC000140156443	186025426	/nfs/dbraw/zinc/02/54/26/186025426.db2.gz	QECKNZXJFFRBJA-CYBMUJFWSA-N	0	3	315.204	2.228	10	0		DEAEHN
CCN1CCC[C@H]1CN1C(=O)C2(CC2)N[C@H]1c1cccs1	ZINC000140309405	186026115	/nfs/dbraw/zinc/02/61/15/186026115.db2.gz	APWOKNWNNWPVEB-GXTWGEPZSA-N	0	3	305.447	2.195	10	0		DEAEHN
CC1(C)CCSC(NCc2ccc(S(C)(=O)=O)cc2)=N1	ZINC000142327807	186031735	/nfs/dbraw/zinc/03/17/35/186031735.db2.gz	OHISMWUHXPGXNM-UHFFFAOYSA-N	0	3	312.460	2.451	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)NCCCCC(C)C)c[nH]1	ZINC000147921969	186042269	/nfs/dbraw/zinc/04/22/69/186042269.db2.gz	ZHQMUTSDXSLWQV-UHFFFAOYSA-N	0	3	301.456	2.229	10	0		DEAEHN
CC(C)[C@@H]1N[C@H](c2ccsc2)N([C@@H]2CCCN(C)C2)C1=O	ZINC000142876362	186032587	/nfs/dbraw/zinc/03/25/87/186032587.db2.gz	UXAJHZXFXXWHHN-ILXRZTDVSA-N	0	3	307.463	2.297	10	0		DEAEHN
CCCC[C@@H]1N[C@@H](c2ccsc2)N([C@@H]2CCN(C)C2)C1=O	ZINC000145240688	186036503	/nfs/dbraw/zinc/03/65/03/186036503.db2.gz	WOWDNUAKNVJYNO-QLFBSQMISA-N	0	3	307.463	2.441	10	0		DEAEHN
Cc1ccc([C@@H]2N[C@H](C)C(=O)N2[C@@H](C)CN2CCCC2)s1	ZINC000145805000	186037905	/nfs/dbraw/zinc/03/79/05/186037905.db2.gz	NOJTZRQTHZJCAX-NJZAAPMLSA-N	0	3	307.463	2.360	10	0		DEAEHN
c1cc(CN[C@H]2CCCSC2)c(OC[C@H]2CCOC2)cn1	ZINC000287134007	219336064	/nfs/dbraw/zinc/33/60/64/219336064.db2.gz	AICOBCSAGXPZFK-ZFWWWQNUSA-N	0	3	308.447	2.482	10	0		DEAEHN
O=C(c1coc(Br)c1)N1CC[C@H](N2CCCC2)C1	ZINC000171442164	186160997	/nfs/dbraw/zinc/16/09/97/186160997.db2.gz	BMRKFEDVYUWDOV-NSHDSACASA-N	0	3	313.195	2.352	10	0		DEAEHN
COC[C@H](C)C(=O)Nc1ccc(N2CCCN(C)CC2)cc1	ZINC000171453336	186162204	/nfs/dbraw/zinc/16/22/04/186162204.db2.gz	OVKMSCHUSNLSME-AWEZNQCLSA-N	0	3	305.422	2.050	10	0		DEAEHN
CCOCc1ccccc1CNC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171900751	198004418	/nfs/dbraw/zinc/00/44/18/198004418.db2.gz	DPVRCAQIHVCVHV-QGZVFWFLSA-N	0	3	317.433	2.213	10	0		DEAEHN
CSc1ccc(CNC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000171904362	198005462	/nfs/dbraw/zinc/00/54/62/198005462.db2.gz	KXDSEESCPLOETI-AWEZNQCLSA-N	0	3	305.447	2.398	10	0		DEAEHN
CC(C)c1ccc([C@H](C)NC(=O)N2CCOC3(CNC3)C2)cc1	ZINC000333425417	539959127	/nfs/dbraw/zinc/95/91/27/539959127.db2.gz	TWTPMAQTIWVUGL-AWEZNQCLSA-N	0	3	317.433	2.255	10	0		DEAEHN
Cc1cc(CNC(=O)N2CC[C@@H](N3CC=CC3)C2)ccc1F	ZINC000173615525	198232257	/nfs/dbraw/zinc/23/22/57/198232257.db2.gz	METMXFCVDPKTSR-OAHLLOKOSA-N	0	3	303.381	2.290	10	0		DEAEHN
Cc1cc(N2CCC[C@H](NCc3sccc3C)C2=O)n(C)n1	ZINC000173852256	198259854	/nfs/dbraw/zinc/25/98/54/198259854.db2.gz	LCPXJRDRZQCQET-ZDUSSCGKSA-N	0	3	318.446	2.384	10	0		DEAEHN
C[C@@H](Cc1cccs1)NC(=O)N1CC[C@@H](N2CC=CC2)C1	ZINC000173899469	198266027	/nfs/dbraw/zinc/26/60/27/198266027.db2.gz	KOAJDLLGRDEKEN-UONOGXRCSA-N	0	3	305.447	2.335	10	0		DEAEHN
C[C@H](Cc1cccs1)NC(=O)N1CC[C@H](N2CC=CC2)C1	ZINC000173899456	198266530	/nfs/dbraw/zinc/26/65/30/198266530.db2.gz	KOAJDLLGRDEKEN-KGLIPLIRSA-N	0	3	305.447	2.335	10	0		DEAEHN
COCc1cccc(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000173813583	198255866	/nfs/dbraw/zinc/25/58/66/198255866.db2.gz	PJEGUFAZTABUIY-WMLDXEAASA-N	0	3	319.449	2.457	10	0		DEAEHN
CC[C@@H](O)CN1CCN(Cc2cccc(OC(F)F)c2)CC1	ZINC000174082984	198288932	/nfs/dbraw/zinc/28/89/32/198288932.db2.gz	SEPGJBNXHMPWRD-CQSZACIVSA-N	0	3	314.376	2.177	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2COc3ccccc32)CCN1C	ZINC000174441271	198335955	/nfs/dbraw/zinc/33/59/55/198335955.db2.gz	MXIHQTMFAKKIKS-UMVBOHGHSA-N	0	3	303.406	2.244	10	0		DEAEHN
O[C@@H](CN1CCC[C@H](Cn2cncn2)C1)c1cccc(Cl)c1	ZINC000174788160	198385175	/nfs/dbraw/zinc/38/51/75/198385175.db2.gz	OKPZJCNAAJDYBS-BBRMVZONSA-N	0	3	320.824	2.377	10	0		DEAEHN
COc1ccc([C@H](CNc2ncnc3nc[nH]c32)N(C)C)cc1	ZINC000032828993	354154698	/nfs/dbraw/zinc/15/46/98/354154698.db2.gz	AOMMPYRHUYRAHQ-ZDUSSCGKSA-N	0	3	312.377	2.076	10	0		DEAEHN
CCOc1ccccc1NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000043332386	354219717	/nfs/dbraw/zinc/21/97/17/354219717.db2.gz	ABUUTOOHNDAWEB-AWEZNQCLSA-N	0	3	321.421	2.054	10	0		DEAEHN
CN(C)C[C@H](Cc1ccccc1)NC(=O)NCc1cscn1	ZINC000051751610	354389028	/nfs/dbraw/zinc/38/90/28/354389028.db2.gz	CGCBVSXICMPMLE-AWEZNQCLSA-N	0	3	318.446	2.115	10	0		DEAEHN
C[C@H](NCCN1CCCS1(=O)=O)c1cccc(Cl)c1	ZINC000089519694	355535795	/nfs/dbraw/zinc/53/57/95/355535795.db2.gz	UFUGILDQFYSDRK-NSHDSACASA-N	0	3	302.827	2.026	10	0		DEAEHN
CSC[C@@H](C)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000077572371	191740009	/nfs/dbraw/zinc/74/00/09/191740009.db2.gz	ZPUSYXICWFKHGQ-HIFRSBDPSA-N	0	3	309.479	2.210	10	0		DEAEHN
Cc1cccc(C(=O)NCc2ccccc2N2CCNCC2)c1	ZINC000114593610	355764261	/nfs/dbraw/zinc/76/42/61/355764261.db2.gz	FVHGUJTYHHDUBG-UHFFFAOYSA-N	0	3	309.413	2.335	10	0		DEAEHN
Cc1cccc(CNC(=O)NCC(C)(C)N2CCCCC2)n1	ZINC000123797981	355806607	/nfs/dbraw/zinc/80/66/07/355806607.db2.gz	MQBKUEAHNJRVSR-UHFFFAOYSA-N	0	3	304.438	2.454	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)CSC[C@@H]1CCCCO1	ZINC000171378014	356001817	/nfs/dbraw/zinc/00/18/17/356001817.db2.gz	UOMGNKXACANRCN-GJZGRUSLSA-N	0	3	314.495	2.279	10	0		DEAEHN
C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)NC1(CO)CC1	ZINC000180053344	356040331	/nfs/dbraw/zinc/04/03/31/356040331.db2.gz	CPZIILJCPFZUJJ-LBPRGKRZSA-N	0	3	310.825	2.192	10	0		DEAEHN
CC(C)Oc1cccc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)n1	ZINC000179116473	356014584	/nfs/dbraw/zinc/01/45/84/356014584.db2.gz	QLIQHWXWZLEMJR-KBPBESRZSA-N	0	3	305.422	2.424	10	0		DEAEHN
COC[C@@H](NCc1cccc2c1OCCCO2)C1CCOCC1	ZINC000188248761	356214564	/nfs/dbraw/zinc/21/45/64/356214564.db2.gz	LATDXGLEMGCROJ-MRXNPFEDSA-N	0	3	321.417	2.379	10	0		DEAEHN
NCc1cc(I)c(OC(F)(F)F)cn1	ZINC000238664437	356304905	/nfs/dbraw/zinc/30/49/05/356304905.db2.gz	MUXUDXUOBIGJQD-UHFFFAOYSA-N	0	3	318.036	2.044	10	0		DEAEHN
CCCNCc1c(N2CC[C@H](COC)C2)nc2sccn12	ZINC000081072424	192222940	/nfs/dbraw/zinc/22/29/40/192222940.db2.gz	FQPOEIQCCLSEQE-LBPRGKRZSA-N	0	3	308.451	2.368	10	0		DEAEHN
Cc1cc(F)ccc1C(=O)N1CCO[C@@H](CN(C)CC2CC2)C1	ZINC000328622361	356461658	/nfs/dbraw/zinc/46/16/58/356461658.db2.gz	BFAKYFXFSBUNQQ-INIZCTEOSA-N	0	3	320.408	2.317	10	0		DEAEHN
CN(CC1CC1)C[C@@H]1CN(C(=O)c2cccn2C2CC2)CCO1	ZINC000328647599	356466046	/nfs/dbraw/zinc/46/60/46/356466046.db2.gz	UCHGFVSJPWGZQO-MRXNPFEDSA-N	0	3	317.433	2.006	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)NCc1ccnc(OC2CCCC2)c1	ZINC000236991793	202113280	/nfs/dbraw/zinc/11/32/80/202113280.db2.gz	YMFVWEKZMGXZQR-MLGOLLRUSA-N	0	3	305.422	2.393	10	0		DEAEHN
O[C@@]1(CCNCc2ccsc2Br)CCOC1	ZINC000404206754	356732629	/nfs/dbraw/zinc/73/26/29/356732629.db2.gz	QVOWQJMVDOKTGP-NSHDSACASA-N	0	3	306.225	2.142	10	0		DEAEHN
CC1(C)CCCN(CCNC(=O)NCCOCC2CCC2)C1	ZINC000578145518	356769338	/nfs/dbraw/zinc/76/93/38/356769338.db2.gz	XLUUGWBOMHZFFV-UHFFFAOYSA-N	0	3	311.470	2.224	10	0		DEAEHN
CCOC(=O)C1(CNCc2ccc(-c3cc[nH]n3)o2)CCC1	ZINC000578829689	356876750	/nfs/dbraw/zinc/87/67/50/356876750.db2.gz	DETWBXOUCULFHC-UHFFFAOYSA-N	0	3	303.362	2.493	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCCCCC2)s1	ZINC000088913390	192655153	/nfs/dbraw/zinc/65/51/53/192655153.db2.gz	KZESAWAPWFTGOC-UHFFFAOYSA-N	0	3	302.465	2.422	10	0		DEAEHN
CCCCN(CC)S(=O)(=O)c1ccc(CNC2CC2)cn1	ZINC000088916301	192656960	/nfs/dbraw/zinc/65/69/60/192656960.db2.gz	UBXSHJPKODUCSF-UHFFFAOYSA-N	0	3	311.451	2.144	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)NCc2ccc(Cl)cn2)C1	ZINC000180544969	199173738	/nfs/dbraw/zinc/17/37/38/199173738.db2.gz	OGTLHUAYYLNJJJ-GFCCVEGCSA-N	0	3	310.829	2.266	10	0		DEAEHN
CC[C@@H](C)Oc1cc(CNC(=O)N2CC[C@@H](N(C)C)C2)ccn1	ZINC000180668273	199193398	/nfs/dbraw/zinc/19/33/98/199193398.db2.gz	ANORSKXMOMAEAU-UKRRQHHQSA-N	0	3	320.437	2.104	10	0		DEAEHN
C[C@H]([NH2+]CCCOC([O-])=NC(N)=O)c1ccc(F)c(Cl)c1	ZINC000180741292	199203819	/nfs/dbraw/zinc/20/38/19/199203819.db2.gz	ZPSPNFOPTNKZEB-QMMMGPOBSA-N	0	3	317.748	2.325	10	0		DEAEHN
C[C@H]([NH2+]CCCOC(=O)N=C(N)[O-])c1ccc(F)c(Cl)c1	ZINC000180741292	199203821	/nfs/dbraw/zinc/20/38/21/199203821.db2.gz	ZPSPNFOPTNKZEB-QMMMGPOBSA-N	0	3	317.748	2.325	10	0		DEAEHN
NC1(C(=O)N2CC[C@H](c3ccc(Cl)cc3)C2)CCOCC1	ZINC000261797106	283398933	/nfs/dbraw/zinc/39/89/33/283398933.db2.gz	INSXOQALLPZCSG-ZDUSSCGKSA-N	0	3	308.809	2.164	10	0		DEAEHN
CCN(CC)CCNCc1c(Br)c(C)nn1CC	ZINC000089276044	192757017	/nfs/dbraw/zinc/75/70/17/192757017.db2.gz	JLTVRLWXJGIMFB-UHFFFAOYSA-N	0	3	317.275	2.405	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2cccc(N(C)C)n2)C12CCOCC2	ZINC000186433376	199956422	/nfs/dbraw/zinc/95/64/22/199956422.db2.gz	JNRQUBGFSDYKGQ-JKSUJKDBSA-N	0	3	319.449	2.211	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)c1cnn(CCC(F)(F)F)c1	ZINC000186748876	200003491	/nfs/dbraw/zinc/00/34/91/200003491.db2.gz	QMFSFDZVOFCREB-UHFFFAOYSA-N	0	3	318.343	2.002	10	0		DEAEHN
Cc1c([O-])ccc2c(C[N@@H+](C)CC3(CO)CC3)cc(=O)oc12	ZINC000186762057	200006598	/nfs/dbraw/zinc/00/65/98/200006598.db2.gz	ZCAHTDLKUJCNFP-UHFFFAOYSA-N	0	3	303.358	2.011	10	0		DEAEHN
Cc1c([O-])ccc2c(C[N@H+](C)CC3(CO)CC3)cc(=O)oc12	ZINC000186762057	200006600	/nfs/dbraw/zinc/00/66/00/200006600.db2.gz	ZCAHTDLKUJCNFP-UHFFFAOYSA-N	0	3	303.358	2.011	10	0		DEAEHN
CCN(CCO)CCNC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000187033492	200050999	/nfs/dbraw/zinc/05/09/99/200050999.db2.gz	REAUHMFNXHMDEL-UHFFFAOYSA-N	0	3	315.364	2.234	10	0		DEAEHN
O=C(NCc1ccc(Cl)cc1F)N1CCN2CCC[C@@H]2C1	ZINC000187858970	200167074	/nfs/dbraw/zinc/16/70/74/200167074.db2.gz	MTGWOZAHGDACNO-CYBMUJFWSA-N	0	3	311.788	2.469	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N(CCN(C)C)C(C)C	ZINC000187915793	200175865	/nfs/dbraw/zinc/17/58/65/200175865.db2.gz	SQDYLOYQZVIUAQ-UHFFFAOYSA-N	0	3	311.401	2.316	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1cncc(Cl)n1)c1ccccc1	ZINC000188897071	200318729	/nfs/dbraw/zinc/31/87/29/200318729.db2.gz	DOULZKLRTDXKFQ-CYBMUJFWSA-N	0	3	304.781	2.163	10	0		DEAEHN
COc1ccc(-c2n[nH]cc2CN(C)CC2(CO)CC2)cc1	ZINC000188956486	200327136	/nfs/dbraw/zinc/32/71/36/200327136.db2.gz	RAGAXNMLBLASAW-UHFFFAOYSA-N	0	3	301.390	2.290	10	0		DEAEHN
COC[C@H](N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O)C(C)C	ZINC000189049577	200341452	/nfs/dbraw/zinc/34/14/52/200341452.db2.gz	BOCQSVCFEHJZCS-CVEARBPZSA-N	0	3	308.397	2.187	10	0		DEAEHN
COc1ccc2[nH]c(C(=O)N3CCC[C@@H](N(C)C)C3)cc2c1	ZINC000189231066	200367260	/nfs/dbraw/zinc/36/72/60/200367260.db2.gz	FMIUJJFJKBZFJG-CYBMUJFWSA-N	0	3	301.390	2.343	10	0		DEAEHN
O=C(NCCNc1ccncc1)NC[C@H]1CCc2ccccc2C1	ZINC000605059671	360953196	/nfs/dbraw/zinc/95/31/96/360953196.db2.gz	YWABDHBARIFMEZ-HNNXBMFYSA-N	0	3	324.428	2.020	10	0		DEAEHN
Cn1ccc(C(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)n1	ZINC000607538319	361094987	/nfs/dbraw/zinc/09/49/87/361094987.db2.gz	PDJGMXTVTHPEHN-SWLSCSKDSA-N	0	3	318.446	2.295	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000193707089	201108494	/nfs/dbraw/zinc/10/84/94/201108494.db2.gz	YLDYNTCSGPOCDP-ZFWWWQNUSA-N	0	3	305.422	2.107	10	0		DEAEHN
COC(=O)C(C)(C)[C@H](NC[C@H](O)COC(C)C)c1ccccc1	ZINC000611406871	361593570	/nfs/dbraw/zinc/59/35/70/361593570.db2.gz	ZCRNODXUMDRGQQ-JKSUJKDBSA-N	0	3	323.433	2.302	10	0		DEAEHN
CCO[C@@H](CNC(=O)N1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000195187342	201357039	/nfs/dbraw/zinc/35/70/39/201357039.db2.gz	HYABEWLPQHMHAH-SJORKVTESA-N	0	3	317.433	2.254	10	0		DEAEHN
CC1(C)[C@H](NCc2cccc(S(C)(=O)=O)c2)[C@H]2CCCO[C@@H]21	ZINC000449177920	240156733	/nfs/dbraw/zinc/15/67/33/240156733.db2.gz	WPJPELVLYWGYLF-OAGGEKHMSA-N	0	3	323.458	2.383	10	0		DEAEHN
CCOC(=O)[C@@H]1CN(Cc2ccc(SC)cc2)CC12COC2	ZINC000449357576	240396365	/nfs/dbraw/zinc/39/63/65/240396365.db2.gz	DUWLVMUMXLPHEV-HNNXBMFYSA-N	0	3	321.442	2.420	10	0		DEAEHN
O[C@@H]1COCC[C@@H]1NCc1ccc(Br)c(Cl)c1	ZINC000623767228	365167730	/nfs/dbraw/zinc/16/77/30/365167730.db2.gz	SHTHVXJDZYQGFQ-NWDGAFQWSA-N	0	3	320.614	2.342	10	0		DEAEHN
C[C@H](NC[C@H]1CSCCS1)c1ccc2[nH]c(=O)[nH]c2c1	ZINC000091368925	193047001	/nfs/dbraw/zinc/04/70/01/193047001.db2.gz	GTLHJSBPSZVHNC-ONGXEEELSA-N	0	3	309.460	2.355	10	0		DEAEHN
O=C(CNCC1CC(O)C1)Nc1c(Cl)cccc1Cl	ZINC000091525174	193068752	/nfs/dbraw/zinc/06/87/52/193068752.db2.gz	BKHBFQXFGXACND-UHFFFAOYSA-N	0	3	303.189	2.292	10	0		DEAEHN
C[C@H](NC[C@H]1COCCN1C)c1sccc1Br	ZINC000624173043	365318702	/nfs/dbraw/zinc/31/87/02/365318702.db2.gz	ZKMZRSUHAUYSKW-UWVGGRQHSA-N	0	3	319.268	2.492	10	0		DEAEHN
C[C@H](N[C@@H]1CCOC[C@@H]1O)c1cccc(Br)c1	ZINC000624235799	365344908	/nfs/dbraw/zinc/34/49/08/365344908.db2.gz	POCIWNXGSDDMBH-BIMULSAOSA-N	0	3	300.196	2.250	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccsc2Br)C1	ZINC000449839773	241151441	/nfs/dbraw/zinc/15/14/41/241151441.db2.gz	NLFHSSQGRWITNL-QMMMGPOBSA-N	0	3	303.225	2.287	10	0		DEAEHN
Cc1ccccc1[C@H](C)N(C)C[C@@H](O)CC1(O)CCOCC1	ZINC000630039921	367449316	/nfs/dbraw/zinc/44/93/16/367449316.db2.gz	ZKKCRMHUADQDMR-HOTGVXAUSA-N	0	3	307.434	2.280	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2C[C@H](C)[C@@H](C)C2)c(C)s1	ZINC000092113751	193161909	/nfs/dbraw/zinc/16/19/09/193161909.db2.gz	MHSTZVIYQVEZGK-QWRGUYRKSA-N	0	3	316.492	2.443	10	0		DEAEHN
CC[C@H]1CCCN(S(=O)(=O)c2ccc(CN)cc2F)C1	ZINC000092115715	193163081	/nfs/dbraw/zinc/16/30/81/193163081.db2.gz	WWWPCKPNNGDSDZ-NSHDSACASA-N	0	3	300.399	2.095	10	0		DEAEHN
CN(Cc1ccsc1)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115669	193163289	/nfs/dbraw/zinc/16/32/89/193163289.db2.gz	GAKILXJHFRYNJE-UHFFFAOYSA-N	0	3	314.407	2.167	10	0		DEAEHN
CN(Cc1cccs1)S(=O)(=O)c1ccc(CN)cc1F	ZINC000092115667	193163308	/nfs/dbraw/zinc/16/33/08/193163308.db2.gz	DJOJRQIRIBLKKO-UHFFFAOYSA-N	0	3	314.407	2.167	10	0		DEAEHN
CC1(C[N-]S(=O)(=O)c2ccc(C[NH3+])cc2F)CCCC1	ZINC000092116189	193164442	/nfs/dbraw/zinc/16/44/42/193164442.db2.gz	OFZIXHLLFOPGBH-UHFFFAOYSA-N	0	3	300.399	2.143	10	0		DEAEHN
C1=CCN([C@@H]2CCN(c3nccn4nc(C5CCC5)cc34)C2)C1	ZINC000631130200	368034085	/nfs/dbraw/zinc/03/40/85/368034085.db2.gz	GQBSUQFKVICGRO-OAHLLOKOSA-N	0	3	309.417	2.447	10	0		DEAEHN
CC(C)(O)CN1CCN(C[C@H]2CSc3ccccc32)CC1	ZINC000092292765	193185981	/nfs/dbraw/zinc/18/59/81/193185981.db2.gz	XTNHOQPGXKEVKE-AWEZNQCLSA-N	0	3	306.475	2.264	10	0		DEAEHN
CCN[C@@H](Cc1c(Cl)c(C)nn1C)C(OCC)OCC	ZINC000093307131	193227701	/nfs/dbraw/zinc/22/77/01/193227701.db2.gz	SEWJBVZHUFRGHW-NSHDSACASA-N	0	3	303.834	2.302	10	0		DEAEHN
CN[C@H](Cc1ccc(Br)cc1F)C(OC)OC	ZINC000093304830	193227855	/nfs/dbraw/zinc/22/78/55/193227855.db2.gz	ORPUUIYYYYKCBF-LLVKDONJSA-N	0	3	306.175	2.338	10	0		DEAEHN
Cn1cc(CN2CC[C@@H]3OCCC[C@@H]3C2)c(-c2cccnc2)n1	ZINC000093505838	193260937	/nfs/dbraw/zinc/26/09/37/193260937.db2.gz	JTUFDYLXCROURQ-WBVHZDCISA-N	0	3	312.417	2.483	10	0		DEAEHN
COc1ccc(S[C@H]2CC[C@@](NC3CC3)(C(N)=O)C2)cc1	ZINC000093850428	193317523	/nfs/dbraw/zinc/31/75/23/193317523.db2.gz	WCPPGQJVGDICTO-HOCLYGCPSA-N	0	3	306.431	2.316	10	0		DEAEHN
CN[C@@H](c1cccc(C(F)(F)F)c1)[C@@H]1CN(C)CCN1C	ZINC000093894380	193324725	/nfs/dbraw/zinc/32/47/25/193324725.db2.gz	TUTNGVHBTVLJPB-KBPBESRZSA-N	0	3	301.356	2.212	10	0		DEAEHN
CC(C)NCc1cc2ccccc2nc1SC[C@H](O)CO	ZINC000093960616	193332034	/nfs/dbraw/zinc/33/20/34/193332034.db2.gz	VDIZBUIWZCVTAN-CQSZACIVSA-N	0	3	306.431	2.178	10	0		DEAEHN
CC1(C)CCC[C@H]1NS(=O)(=O)c1ccc(F)c(CN)c1	ZINC000094326154	193359496	/nfs/dbraw/zinc/35/94/96/193359496.db2.gz	FAZCRAIAMDEISE-CYBMUJFWSA-N	0	3	300.399	2.141	10	0		DEAEHN
CCS(=O)(=O)CCC[C@@H](NC(C)C)c1ccc(F)cn1	ZINC000094047511	193341741	/nfs/dbraw/zinc/34/17/41/193341741.db2.gz	XQMRUKXKQOLQMZ-CQSZACIVSA-N	0	3	302.415	2.475	10	0		DEAEHN
CCC(N)(CC)C(=O)Nc1cc(Cl)ccc1-n1cncn1	ZINC000094243879	193354610	/nfs/dbraw/zinc/35/46/10/193354610.db2.gz	PTBICJSWVYQELE-UHFFFAOYSA-N	0	3	307.785	2.377	10	0		DEAEHN
N[C@H](C[S@](=O)c1cccc(F)c1)c1ccc2c(c1)OCO2	ZINC000094625459	193385553	/nfs/dbraw/zinc/38/55/53/193385553.db2.gz	UDABKWFYAVNIHB-LRTDBIEQSA-N	0	3	307.346	2.362	10	0		DEAEHN
O=S1(=O)CC[C@@H](NCCn2ccc3c2cccc3Cl)C1	ZINC000094613129	193384510	/nfs/dbraw/zinc/38/45/10/193384510.db2.gz	CMZHZVPVFIPNDW-LLVKDONJSA-N	0	3	312.822	2.071	10	0		DEAEHN
Cc1cscc1CNS(=O)(=O)c1cc(CN)cs1	ZINC000094887026	193404963	/nfs/dbraw/zinc/40/49/63/193404963.db2.gz	ZFVBHGGBJWWNFL-UHFFFAOYSA-N	0	3	302.446	2.055	10	0		DEAEHN
CNCc1cc(F)c(C)c(S(=O)(=O)N2CCC(C)(C)C2)c1	ZINC000094814969	193399980	/nfs/dbraw/zinc/39/99/80/193399980.db2.gz	APOXGRDRTLIIQD-UHFFFAOYSA-N	0	3	314.426	2.274	10	0		DEAEHN
c1[nH]nc(-c2ccc3c(c2)OCO3)c1CN[C@@H]1CCCOC1	ZINC000288494670	220178756	/nfs/dbraw/zinc/17/87/56/220178756.db2.gz	HLVOURWOIPYCCN-CYBMUJFWSA-N	0	3	301.346	2.074	10	0		DEAEHN
CN[C@H](c1c(Br)cnn1CCOC)[C@H]1C[C@@H]1C	ZINC000160660651	197429701	/nfs/dbraw/zinc/42/97/01/197429701.db2.gz	JBCSQJHWNXVLJW-QXEWZRGKSA-N	0	3	302.216	2.209	10	0		DEAEHN
NC[C@H](c1ccccc1Br)N1CCSCC1	ZINC000020257146	182201305	/nfs/dbraw/zinc/20/13/05/182201305.db2.gz	FUGNRIBCGBSZSE-GFCCVEGCSA-N	0	3	301.253	2.498	10	0		DEAEHN
COc1cc(CN2CCC([NH3+])CC2)cc(Br)c1[O-]	ZINC000020521652	182226400	/nfs/dbraw/zinc/22/64/00/182226400.db2.gz	BXKBBNGPBPUIGA-UHFFFAOYSA-N	0	3	315.211	2.086	10	0		DEAEHN
CN(C)CCN(C)c1ncnc2ccc(Br)cc21	ZINC000530857575	284476198	/nfs/dbraw/zinc/47/61/98/284476198.db2.gz	MFVBLFLRCKZOOJ-UHFFFAOYSA-N	0	3	309.211	2.390	10	0		DEAEHN
COC[C@@H](NC(=O)NC(C)(C)CN(C)C)c1ccc(F)cc1	ZINC000458466935	248325029	/nfs/dbraw/zinc/32/50/29/248325029.db2.gz	MRRNOFNUPKBBCX-CQSZACIVSA-N	0	3	311.401	2.153	10	0		DEAEHN
CC[C@H](C)NC(=O)CCNCc1cc2c(c(Cl)c1)OCO2	ZINC000038013950	182964508	/nfs/dbraw/zinc/96/45/08/182964508.db2.gz	XNNMALSAPIKDHB-JTQLQIEISA-N	0	3	312.797	2.463	10	0		DEAEHN
CCN1CCC[C@H](N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000040502327	183084313	/nfs/dbraw/zinc/08/43/13/183084313.db2.gz	QCVZVKVBYADPJQ-ZFWWWQNUSA-N	0	3	310.463	2.225	10	0		DEAEHN
CCOC(=O)C(=O)NC[C@H](c1ccc(C)cc1)N(CC)CC	ZINC000040615390	183109801	/nfs/dbraw/zinc/10/98/01/183109801.db2.gz	FOUVBHKQRJVOAY-OAHLLOKOSA-N	0	3	306.406	2.057	10	0		DEAEHN
COC(=O)Cc1c(C)nc2ccccc2c1NCC(OC)OC	ZINC000041473235	183193183	/nfs/dbraw/zinc/19/31/83/183193183.db2.gz	CNXWOQNIRUEUNS-UHFFFAOYSA-N	0	3	318.373	2.290	10	0		DEAEHN
C[C@H](O)COc1c(Br)cccc1CNC1CC1	ZINC000042411976	183265821	/nfs/dbraw/zinc/26/58/21/183265821.db2.gz	JZBYJZVBZOGQEZ-VIFPVBQESA-N	0	3	300.196	2.461	10	0		DEAEHN
COC(=O)COc1c(Br)cccc1CNC1CC1	ZINC000042411988	183265931	/nfs/dbraw/zinc/26/59/31/183265931.db2.gz	WQDWUELFHOEXRA-UHFFFAOYSA-N	0	3	314.179	2.253	10	0		DEAEHN
CC(C)NCc1c(N(CCCO)C(C)C)nc2sccn12	ZINC000042511548	183278607	/nfs/dbraw/zinc/27/86/07/183278607.db2.gz	CCQWZUFQDAPRIY-UHFFFAOYSA-N	0	3	310.467	2.491	10	0		DEAEHN
Cc1cccc([C@@H](CN)Oc2ccc(S(C)(=O)=O)cc2)c1	ZINC000042969277	183324522	/nfs/dbraw/zinc/32/45/22/183324522.db2.gz	XIVNYIAMYJYXRM-MRXNPFEDSA-N	0	3	305.399	2.477	10	0		DEAEHN
CC[C@@H](N)[C@H](c1sccc1C)N1CCCC[C@@H]1C(=O)NC	ZINC000043248711	183346451	/nfs/dbraw/zinc/34/64/51/183346451.db2.gz	XKHAEGZQYTWBNT-MGPQQGTHSA-N	0	3	309.479	2.435	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(C)s1)N1CCCC[C@@H]1C(=O)NC	ZINC000043242685	183346730	/nfs/dbraw/zinc/34/67/30/183346730.db2.gz	GJTYHUXKLARJDE-GUTXKFCHSA-N	0	3	309.479	2.435	10	0		DEAEHN
CNC(=O)C1CCN([C@H](c2ccc(Cl)s2)[C@H](C)N)CC1	ZINC000043252798	183348343	/nfs/dbraw/zinc/34/83/43/183348343.db2.gz	FQBZSZRZTBMZRO-ZANVPECISA-N	0	3	315.870	2.248	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccc(Br)s1)N1CCC[C@@H]1CO	ZINC000043261347	183348700	/nfs/dbraw/zinc/34/87/00/183348700.db2.gz	XNMCCSBEQTVXFP-LNLATYFQSA-N	0	3	319.268	2.356	10	0		DEAEHN
NC[C@@H](c1cc(Br)cs1)N1CCCC[C@@H]1CO	ZINC000043286348	183350502	/nfs/dbraw/zinc/35/05/02/183350502.db2.gz	DFWJFEFQIIVRJO-MNOVXSKESA-N	0	3	319.268	2.357	10	0		DEAEHN
COc1ccc(Cl)c([N-]S(=O)(=O)CC[NH2+]C(C)C)c1	ZINC000043318867	183354133	/nfs/dbraw/zinc/35/41/33/183354133.db2.gz	LMZOYKTZIRWHKJ-UHFFFAOYSA-N	0	3	306.815	2.088	10	0		DEAEHN
COc1ccc2cc(CN3C[C@H](OC)C[C@H]3CO)ccc2c1	ZINC000284667100	218123775	/nfs/dbraw/zinc/12/37/75/218123775.db2.gz	WTNITFKCSCMNBV-FUHWJXTLSA-N	0	3	301.386	2.430	10	0		DEAEHN
COc1ccc(CN[C@H]2CCO[C@@H]2c2ccnn2C)cc1OC	ZINC000284791127	218179415	/nfs/dbraw/zinc/17/94/15/218179415.db2.gz	RIOYWOYULIMFBH-GUYCJALGSA-N	0	3	317.389	2.057	10	0		DEAEHN
Cc1nc(CN2CCCN(CCc3ccccc3)CC2)no1	ZINC000105866747	194149739	/nfs/dbraw/zinc/14/97/39/194149739.db2.gz	CKTYLGJEJUNLSU-UHFFFAOYSA-N	0	3	300.406	2.128	10	0		DEAEHN
CC[C@@H]1CN(Cc2cccc(NC(C)=O)c2)CCN1CCOC	ZINC000105837394	194143797	/nfs/dbraw/zinc/14/37/97/194143797.db2.gz	NYLJAFDZPNKRGH-GOSISDBHSA-N	0	3	319.449	2.188	10	0		DEAEHN
CCN(C(=O)[C@@H](C)NCCn1cc(C)cn1)c1ccccc1	ZINC000105881366	194156222	/nfs/dbraw/zinc/15/62/22/194156222.db2.gz	CPJQKQFFIBMNFB-OAHLLOKOSA-N	0	3	300.406	2.223	10	0		DEAEHN
Cc1ccc(N2CCCN(CCC(=O)OC(C)(C)C)CC2)nn1	ZINC000105909376	194165982	/nfs/dbraw/zinc/16/59/82/194165982.db2.gz	WLPNZZXJJOUEBY-UHFFFAOYSA-N	0	3	320.437	2.029	10	0		DEAEHN
CC[C@@H]1CN(Cc2ccc(OC)c(F)c2)CCN1CCOC	ZINC000106115859	194188208	/nfs/dbraw/zinc/18/82/08/194188208.db2.gz	IICCGPICRIATEM-OAHLLOKOSA-N	0	3	310.413	2.377	10	0		DEAEHN
CC(C)(C(N)=S)N1CCN(Cc2cccc(F)c2F)CC1	ZINC000109470808	194267011	/nfs/dbraw/zinc/26/70/11/194267011.db2.gz	RQGRFUHIZGZYTP-UHFFFAOYSA-N	0	3	313.417	2.147	10	0		DEAEHN
CN1CC[C@@H](CNC(=O)c2ccn(-c3cccc(Cl)c3)n2)C1	ZINC000109849162	194292370	/nfs/dbraw/zinc/29/23/70/194292370.db2.gz	HYXBOKRMLWHACD-LBPRGKRZSA-N	0	3	318.808	2.207	10	0		DEAEHN
CN1CCC(OC(=O)c2cccc(N)c2Br)CC1	ZINC000156244449	197097676	/nfs/dbraw/zinc/09/76/76/197097676.db2.gz	XOEOEWIWQPKQJI-UHFFFAOYSA-N	0	3	313.195	2.282	10	0		DEAEHN
C[C@H](c1cccc(F)c1)N1CCC[C@H](C(=O)N2CCOCC2)C1	ZINC000056492094	184013525	/nfs/dbraw/zinc/01/35/25/184013525.db2.gz	CTEFURTWYWHNGK-ZBFHGGJFSA-N	0	3	320.408	2.458	10	0		DEAEHN
O=c1cc(C(F)(F)F)nc(NCCC[NH+]2CCCCC2)[n-]1	ZINC000057342493	184034285	/nfs/dbraw/zinc/03/42/85/184034285.db2.gz	QIXUAFSXEYYIQY-UHFFFAOYSA-N	0	3	304.316	2.077	10	0		DEAEHN
CCc1nc(N(C)CCOC(C)C)sc1CNCCOC	ZINC000157738389	197211374	/nfs/dbraw/zinc/21/13/74/197211374.db2.gz	XJYWELZRBXVHDS-UHFFFAOYSA-N	0	3	315.483	2.303	10	0		DEAEHN
O=C(CN1CCCN(C2CC2)CC1)N1CCCc2ccccc21	ZINC000061041377	184160728	/nfs/dbraw/zinc/16/07/28/184160728.db2.gz	XIBOFIPTHDVGJJ-UHFFFAOYSA-N	0	3	313.445	2.136	10	0		DEAEHN
CCNC(C)(C)C(=O)Nc1sc2c(c1C(=O)OC)CCC2	ZINC000061298910	184167494	/nfs/dbraw/zinc/16/74/94/184167494.db2.gz	LJMYCVYXBGWMMS-UHFFFAOYSA-N	0	3	310.419	2.350	10	0		DEAEHN
CO[C@@H](CNC(=O)N1CCCN(C2CC2)CC1)c1ccccc1	ZINC000061859800	184190128	/nfs/dbraw/zinc/19/01/28/184190128.db2.gz	MAXAYZKCCGDHTA-KRWDZBQOSA-N	0	3	317.433	2.254	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(N[C@H]2CCN(C3CC3)C2)n1	ZINC000061540942	184174211	/nfs/dbraw/zinc/17/42/11/184174211.db2.gz	NYOMLZDTDBLBKR-JTQLQIEISA-N	0	3	310.833	2.020	10	0		DEAEHN
CN(C)C[C@H]1CCCN1C(=O)c1ccc(Br)o1	ZINC000061652040	184181214	/nfs/dbraw/zinc/18/12/14/184181214.db2.gz	RKOULDOXVCVWCR-SECBINFHSA-N	0	3	301.184	2.208	10	0		DEAEHN
C[C@@H]1CN(CCC(=O)Nc2cc(Cl)ccc2N)CCCO1	ZINC000061912876	184195104	/nfs/dbraw/zinc/19/51/04/184195104.db2.gz	QHCJWALTPKARGY-LLVKDONJSA-N	0	3	311.813	2.362	10	0		DEAEHN
Cc1ccc([C@H]([C@H](C)N)N2CCN(CC(F)(F)F)CC2)o1	ZINC000061940775	184197213	/nfs/dbraw/zinc/19/72/13/184197213.db2.gz	QMQORBULLIBWOP-AAEUAGOBSA-N	0	3	305.344	2.156	10	0		DEAEHN
C[C@H](N)[C@@H](c1cccs1)N1CCN(CC(F)(F)F)CC1	ZINC000061940826	184197230	/nfs/dbraw/zinc/19/72/30/184197230.db2.gz	PXQFQVPOAMDEKF-JQWIXIFHSA-N	0	3	307.385	2.316	10	0		DEAEHN
CN(c1cccc(CN)c1)S(=O)(=O)c1ccc(F)cc1F	ZINC000061950489	184198373	/nfs/dbraw/zinc/19/83/73/184198373.db2.gz	WJOZGQSYDBMQMX-UHFFFAOYSA-N	0	3	312.341	2.249	10	0		DEAEHN
CN(C)[C@@H](C(=O)NCCc1ncc2ccccn21)c1ccccc1	ZINC000062509292	184240696	/nfs/dbraw/zinc/24/06/96/184240696.db2.gz	NKHMBSBEVJWRIZ-GOSISDBHSA-N	0	3	322.412	2.296	10	0		DEAEHN
O=S(=O)(C[C@@H]1CCCCN1)N1CCC2(CCCC2)CC1	ZINC000062960093	184262339	/nfs/dbraw/zinc/26/23/39/184262339.db2.gz	GSHOUTOIKZVQFF-AWEZNQCLSA-N	0	3	300.468	2.115	10	0		DEAEHN
CC(C)NC(=O)COc1ccc(OCCN2CCCCC2)cc1	ZINC000063457414	184282364	/nfs/dbraw/zinc/28/23/64/184282364.db2.gz	QVUKKFZCNREFPN-UHFFFAOYSA-N	0	3	320.433	2.455	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cc(N)c(Cl)c(Cl)c2)C1	ZINC000062964319	184263122	/nfs/dbraw/zinc/26/31/22/184263122.db2.gz	GZIQRKLLAWSWEI-SECBINFHSA-N	0	3	302.205	2.352	10	0		DEAEHN
CN(C)[C@@H]1CCN(CC(=O)c2ccc(Br)cc2)C1	ZINC000062966536	184263142	/nfs/dbraw/zinc/26/31/42/184263142.db2.gz	ZYBPCTBFWCMCKJ-CYBMUJFWSA-N	0	3	311.223	2.268	10	0		DEAEHN
Clc1ccc(NCCN2CC[C@H](N3CCOCC3)C2)cc1	ZINC000062974831	184263518	/nfs/dbraw/zinc/26/35/18/184263518.db2.gz	JXQMLKHAJVNZRA-INIZCTEOSA-N	0	3	309.841	2.158	10	0		DEAEHN
[NH3+][C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000063174858	184276063	/nfs/dbraw/zinc/27/60/63/184276063.db2.gz	YFYQHLPXPVNWFL-GHMZBOCLSA-N	0	3	309.218	2.152	10	0		DEAEHN
[NH3+][C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000063174860	184276160	/nfs/dbraw/zinc/27/61/60/184276160.db2.gz	YFYQHLPXPVNWFL-MNOVXSKESA-N	0	3	309.218	2.152	10	0		DEAEHN
CCCN(CCC)CC(=O)Nc1ccc(C(=O)NCC)cc1	ZINC000066216460	184397120	/nfs/dbraw/zinc/39/71/20/184397120.db2.gz	MQQDXKBSHZZOMR-UHFFFAOYSA-N	0	3	305.422	2.497	10	0		DEAEHN
CC[C@@H]1CN(c2ccccc2)CCN1C[C@H](O)COC(C)C	ZINC000184015501	207363825	/nfs/dbraw/zinc/36/38/25/207363825.db2.gz	XVBPLXSFVSFFMF-AEFFLSMTSA-N	0	3	306.450	2.373	10	0		DEAEHN
C[C@H]1CC[C@H](NS(=O)(=O)Cc2ccccc2CN)C[C@@H]1C	ZINC000068583052	184492771	/nfs/dbraw/zinc/49/27/71/184492771.db2.gz	CTIRVBCWLDBZDM-XEZPLFJOSA-N	0	3	310.463	2.389	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)c2cc3ccccc3s2)CCO1	ZINC000116784443	194769697	/nfs/dbraw/zinc/76/96/97/194769697.db2.gz	QPQQRARXSWAKJT-ZDUSSCGKSA-N	0	3	304.415	2.304	10	0		DEAEHN
CCC[C@@H](C(=O)NCCc1nc2cc(F)ccc2n1C)N(C)C	ZINC000162050681	197540556	/nfs/dbraw/zinc/54/05/56/197540556.db2.gz	YAFWMIHHQAGNES-HNNXBMFYSA-N	0	3	320.412	2.101	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCO[C@H](c3cccs3)C2)C1	ZINC000119960277	195070573	/nfs/dbraw/zinc/07/05/73/195070573.db2.gz	BMPNIOUUHAHZMO-KGLIPLIRSA-N	0	3	323.462	2.315	10	0		DEAEHN
CNC(=O)NC(=O)CN[C@H](C)c1ccc(-c2ccccc2)cc1	ZINC000120052126	195087482	/nfs/dbraw/zinc/08/74/82/195087482.db2.gz	HCXCHDVFIZAHTM-CYBMUJFWSA-N	0	3	311.385	2.460	10	0		DEAEHN
CC[C@@H]1CN[C@H](c2ccccc2)CN1C1CCS(=O)CC1	ZINC000159195405	197335547	/nfs/dbraw/zinc/33/55/47/197335547.db2.gz	RWFRRTJKZAFQBW-BAQZJKQNSA-N	0	3	306.475	2.323	10	0		DEAEHN
Cc1cc(S(=O)(=O)N[C@H]2C[C@H]2C)cc(CNC(C)C)c1F	ZINC000159110464	197328573	/nfs/dbraw/zinc/32/85/73/197328573.db2.gz	SLRIBBTYAVBLIC-YGRLFVJLSA-N	0	3	314.426	2.319	10	0		DEAEHN
Cc1cc(S(=O)(=O)NCc2ccccc2)cc(CN)c1F	ZINC000159089343	197326695	/nfs/dbraw/zinc/32/66/95/197326695.db2.gz	CRYRZSANJGOMOR-UHFFFAOYSA-N	0	3	308.378	2.071	10	0		DEAEHN
CC[C@@H]1CCCN1S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159075497	197324672	/nfs/dbraw/zinc/32/46/72/197324672.db2.gz	VZQMZDIAXSZRIF-GFCCVEGCSA-N	0	3	300.399	2.156	10	0		DEAEHN
COCCn1ncc(Br)c1[C@@H](N)C1CCCC1	ZINC000158834099	197305722	/nfs/dbraw/zinc/30/57/22/197305722.db2.gz	NNZOEAFDRDVNGF-NSHDSACASA-N	0	3	302.216	2.482	10	0		DEAEHN
C[C@@H]1OCC[C@H]1N(C)[C@@H](CN)c1ccc(Br)o1	ZINC000158628037	197289335	/nfs/dbraw/zinc/28/93/35/197289335.db2.gz	KJCNMNAPCAYISQ-AEJSXWLSSA-N	0	3	303.200	2.151	10	0		DEAEHN
C[C@H]1C[C@H](Nc2nc3ccc(Br)cn3n2)CCN1C	ZINC000158443786	197273388	/nfs/dbraw/zinc/27/33/88/197273388.db2.gz	YEEBLHYKBGULJI-GXSJLCMTSA-N	0	3	324.226	2.386	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)C2(C(N)=S)CCCCCC2)CCN1C	ZINC000157998814	197234115	/nfs/dbraw/zinc/23/41/15/197234115.db2.gz	RANYRRVJPMRLML-QWHCGFSZSA-N	0	3	311.495	2.212	10	0		DEAEHN
CCN[C@](C)(C[C@H](C)N(C)CCOC(C)C)C(=O)OCC	ZINC000157527936	197194569	/nfs/dbraw/zinc/19/45/69/197194569.db2.gz	JSCLCPAMERVPPO-GOEBONIOSA-N	0	3	302.459	2.053	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)N1CCC(c2cc[nH]n2)CC1	ZINC000156762406	197138891	/nfs/dbraw/zinc/13/88/91/197138891.db2.gz	IZMQYWBKJGELRX-OAHLLOKOSA-N	0	3	321.469	2.275	10	0		DEAEHN
NCc1cccc(NC(=O)C[S@](=O)c2cccc(F)c2)c1	ZINC000156085393	197085789	/nfs/dbraw/zinc/08/57/89/197085789.db2.gz	GYGOHVZNEYAHBB-OAQYLSRUSA-N	0	3	306.362	2.031	10	0		DEAEHN
Cc1ccc(C)c(NC(=O)C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1	ZINC000120755735	195231561	/nfs/dbraw/zinc/23/15/61/195231561.db2.gz	LQBXBTSGKVXHRK-CABCVRRESA-N	0	3	317.433	2.183	10	0		DEAEHN
CC1=N[C@]2(CC[C@H]3CN(Cc4ccccc4F)C[C@H]32)C(=O)N1C	ZINC000248021146	257111796	/nfs/dbraw/zinc/11/17/96/257111796.db2.gz	HZWBJICZUHIVIB-JOQOYGCGSA-N	0	3	315.392	2.297	10	0		DEAEHN
CC1=C(C(=O)N[C@H](Cc2ccccc2)CN(C)C)CCCO1	ZINC000121584083	195309713	/nfs/dbraw/zinc/30/97/13/195309713.db2.gz	IOUHFKDXXYUYPP-MRXNPFEDSA-N	0	3	302.418	2.360	10	0		DEAEHN
CN(C[C@@H]1CCN(C)C1)C(=O)c1cc(Cl)ncc1Cl	ZINC000121822941	195354948	/nfs/dbraw/zinc/35/49/48/195354948.db2.gz	LXRYGFOAKIWNMX-SECBINFHSA-N	0	3	302.205	2.412	10	0		DEAEHN
CN(C[C@H]1CCN(C)C1)C(=O)c1cc(Cl)ncc1Cl	ZINC000121822772	195355286	/nfs/dbraw/zinc/35/52/86/195355286.db2.gz	LXRYGFOAKIWNMX-VIFPVBQESA-N	0	3	302.205	2.412	10	0		DEAEHN
CC[C@@H]1N[C@H](c2cccs2)N(CC2CCN(C)CC2)C1=O	ZINC000122005046	195389843	/nfs/dbraw/zinc/38/98/43/195389843.db2.gz	GKIRXBSJPFQTET-ZFWWWQNUSA-N	0	3	307.463	2.299	10	0		DEAEHN
CC(C)[C@@H]1CN=C(NCc2ccc(S(C)(=O)=O)cc2)S1	ZINC000125434304	195749565	/nfs/dbraw/zinc/74/95/65/195749565.db2.gz	LGZACTOSOIPCHO-ZDUSSCGKSA-N	0	3	312.460	2.307	10	0		DEAEHN
COc1ccc2ccccc2c1CN1CCN(CCO)[C@H](C)C1	ZINC000190249828	533338757	/nfs/dbraw/zinc/33/87/57/533338757.db2.gz	TZKHSZSAIWJWCQ-OAHLLOKOSA-N	0	3	314.429	2.347	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)NC[C@H](C)Oc1cccc(OC)c1	ZINC000359606300	133134381	/nfs/dbraw/zinc/13/43/81/133134381.db2.gz	WFZHUJFFUJERRM-WMLDXEAASA-N	0	3	320.433	2.453	10	0		DEAEHN
COC[C@@H](Nc1ccc(OC2CCN(C)CC2)nc1)C1CC1	ZINC000179745066	144880512	/nfs/dbraw/zinc/88/05/12/144880512.db2.gz	ORKJNGLOOUZEBK-MRXNPFEDSA-N	0	3	305.422	2.392	10	0		DEAEHN
FC(F)(F)C(F)(F)COCCN1CCCN(C2CC2)CC1	ZINC000188953376	145019852	/nfs/dbraw/zinc/01/98/52/145019852.db2.gz	LOLMMYACEQSISH-UHFFFAOYSA-N	0	3	316.314	2.371	10	0		DEAEHN
CC(C)COc1ccc(CCNC(=O)[C@H]2C[C@H](F)CN2)cc1	ZINC000188534698	145013460	/nfs/dbraw/zinc/01/34/60/145013460.db2.gz	OGKOZYVNTCXUQR-GOEBONIOSA-N	0	3	308.397	2.080	10	0		DEAEHN
COc1ccc(O)cc1C(=O)N[C@H](C)CN1CCC[C@@H](C)C1	ZINC000188744028	145016992	/nfs/dbraw/zinc/01/69/92/145016992.db2.gz	PVXMWTJWPFACOG-CHWSQXEVSA-N	0	3	306.406	2.251	10	0		DEAEHN
Cc1cccc2nc(C3CCN(CCOCCO)CC3)oc21	ZINC000189805275	145034467	/nfs/dbraw/zinc/03/44/67/145034467.db2.gz	NRLIZPURHMAXGF-UHFFFAOYSA-N	0	3	304.390	2.325	10	0		DEAEHN
CCN1CCCC[C@@H]1C(=O)N1CCC(Nc2nccs2)CC1	ZINC000190432820	145042974	/nfs/dbraw/zinc/04/29/74/145042974.db2.gz	MWBCOLDOKJDCRZ-CQSZACIVSA-N	0	3	322.478	2.420	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)N2CCc3cc(C(C)(C)C)ccc32)C1	ZINC000191917922	145067255	/nfs/dbraw/zinc/06/72/55/145067255.db2.gz	NAMFQLFLKPLYLQ-LSDHHAIUSA-N	0	3	302.418	2.250	10	0		DEAEHN
Cc1cc(-n2ccnc2)ccc1CN1CCC(CC(N)=O)CC1	ZINC000191944850	145067963	/nfs/dbraw/zinc/06/79/63/145067963.db2.gz	BNAJIPLPVHTANL-UHFFFAOYSA-N	0	3	312.417	2.268	10	0		DEAEHN
O=C(N[C@@H]1CCCC[C@H]1n1cccn1)C1CCN(C2CC2)CC1	ZINC000192670386	145077219	/nfs/dbraw/zinc/07/72/19/145077219.db2.gz	QILWRXGJPZGXQR-IAGOWNOFSA-N	0	3	316.449	2.357	10	0		DEAEHN
CCOc1ccc(C(C)=O)cc1CN1C[C@H]2CN(C)C[C@H]2C1	ZINC000193644199	145088739	/nfs/dbraw/zinc/08/87/39/145088739.db2.gz	AHQSTRQJKWQOBZ-CALCHBBNSA-N	0	3	302.418	2.281	10	0		DEAEHN
O=C(CCN1CCN2CCCC[C@H]2C1)Nc1ccccc1F	ZINC000246200620	145094901	/nfs/dbraw/zinc/09/49/01/145094901.db2.gz	NMOGBCHZTBCCJE-AWEZNQCLSA-N	0	3	305.397	2.324	10	0		DEAEHN
Cc1csc(=O)n1CCN1CCC[C@H]1C[C@@H](O)c1ccco1	ZINC000246488777	145103896	/nfs/dbraw/zinc/10/38/96/145103896.db2.gz	HAAOSWFDKFLUMG-UONOGXRCSA-N	0	3	322.430	2.399	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)c1C	ZINC000246591102	145107756	/nfs/dbraw/zinc/10/77/56/145107756.db2.gz	YWPFYJWYMDAAGJ-CJNGLKHVSA-N	0	3	317.433	2.087	10	0		DEAEHN
CC(C)[C@@H](NC(=O)CN1CCN2CCC[C@H]2C1)c1ccccc1	ZINC000246710109	145111578	/nfs/dbraw/zinc/11/15/78/145111578.db2.gz	UJYMOIGSMDTESQ-PKOBYXMFSA-N	0	3	315.461	2.280	10	0		DEAEHN
C[C@@H]1CN(CCc2ccc(F)c(F)c2)C[C@H]1N1CCOCC1	ZINC000246837636	145116573	/nfs/dbraw/zinc/11/65/73/145116573.db2.gz	SSZTUWSXMNZKSC-CXAGYDPISA-N	0	3	310.388	2.160	10	0		DEAEHN
O=C(NC[C@H]1CCOc2ccccc21)N1CCN2CCC[C@H]2C1	ZINC000247235210	145129733	/nfs/dbraw/zinc/12/97/33/145129733.db2.gz	DHBRXNQQOMPBPE-CABCVRRESA-N	0	3	315.417	2.042	10	0		DEAEHN
C[C@H](C(=O)NC1CCCC1)N1CCC[C@@H](Cc2nccn2C)C1	ZINC000247318342	145133560	/nfs/dbraw/zinc/13/35/60/145133560.db2.gz	SBLJJZQPXMPCOL-CABCVRRESA-N	0	3	318.465	2.122	10	0		DEAEHN
CCOC[C@@H]1CCCN(C(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)C1	ZINC000247480115	145138069	/nfs/dbraw/zinc/13/80/69/145138069.db2.gz	WAGCIAIRZZOZBT-BZUAXINKSA-N	0	3	311.470	2.173	10	0		DEAEHN
CCOCCN1CCN(Cc2ccc3c(c2)CCO3)C[C@H]1C	ZINC000247744399	145143696	/nfs/dbraw/zinc/14/36/96/145143696.db2.gz	XPVHPTPXXIJKKB-OAHLLOKOSA-N	0	3	304.434	2.164	10	0		DEAEHN
C[C@H](N[C@@H]1CCN(Cc2ccccn2)C[C@@H]1C)c1cnccn1	ZINC000248201107	145149789	/nfs/dbraw/zinc/14/97/89/145149789.db2.gz	YSNRKOGUUCXRPV-YQQAZPJKSA-N	0	3	311.433	2.433	10	0		DEAEHN
C[C@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)[C@H]1CCCO1	ZINC000248775835	145166702	/nfs/dbraw/zinc/16/67/02/145166702.db2.gz	TWPXMWJWRXQPKD-NUEKZKHPSA-N	0	3	305.422	2.156	10	0		DEAEHN
CN(C)c1ccncc1C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000248759947	145167035	/nfs/dbraw/zinc/16/70/35/145167035.db2.gz	YAJXNHXTJXCUFB-FUHWJXTLSA-N	0	3	324.428	2.323	10	0		DEAEHN
CC(C)C[C@H](CO)N(C)C(=O)N[C@H](C)CN1CCC[C@@H](C)C1	ZINC000249486004	145185371	/nfs/dbraw/zinc/18/53/71/145185371.db2.gz	YGFIMBLTGUALJV-BZUAXINKSA-N	0	3	313.486	2.155	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COCc2ccccc2F)CC[C@@H]1C	ZINC000251602784	145194854	/nfs/dbraw/zinc/19/48/54/145194854.db2.gz	FVWAKVPPKJNRKK-YSVLISHTSA-N	0	3	311.397	2.060	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)N2CCC([C@H]3CCCO3)CC2)C1	ZINC000251898659	145196756	/nfs/dbraw/zinc/19/67/56/145196756.db2.gz	QVBLMDFOVQTCAW-DJIMGWMZSA-N	0	3	323.481	2.316	10	0		DEAEHN
COc1cc(NC(=O)[C@]2(N)[C@@H]3CCCO[C@H]3C2(C)C)ccc1F	ZINC000261632093	145212362	/nfs/dbraw/zinc/21/23/62/145212362.db2.gz	DDJHQDNEQXSTFF-JDSLSITLSA-N	0	3	322.380	2.305	10	0		DEAEHN
CCc1ccc([C@@H]2CNCCN2CCS(=O)(=O)C(C)C)cc1	ZINC000261647893	145212947	/nfs/dbraw/zinc/21/29/47/145212947.db2.gz	GDQKWJXNKALSMZ-KRWDZBQOSA-N	0	3	324.490	2.019	10	0		DEAEHN
Cc1cccc2nc(CN3CCNC[C@@H]3c3cccnc3)cn21	ZINC000261663647	145214997	/nfs/dbraw/zinc/21/49/97/145214997.db2.gz	HAZMNTCRQZHWCI-QGZVFWFLSA-N	0	3	307.401	2.184	10	0		DEAEHN
CCN(CC)c1ccc(N[C@@H]2CCC[C@H]2[C@H]2COCCN2)cn1	ZINC000261894336	145238247	/nfs/dbraw/zinc/23/82/47/145238247.db2.gz	GYMFVIRCDLZNPQ-BRWVUGGUSA-N	0	3	318.465	2.497	10	0		DEAEHN
CCN(CC)c1ccc(N[C@@H]2CCC[C@H]2[C@@H]2COCCN2)cn1	ZINC000261894346	145238454	/nfs/dbraw/zinc/23/84/54/145238454.db2.gz	GYMFVIRCDLZNPQ-ZACQAIPSSA-N	0	3	318.465	2.497	10	0		DEAEHN
N[C@H](C(=O)NCCCCCc1ccccc1)C1CCOCC1	ZINC000261901861	145239805	/nfs/dbraw/zinc/23/98/05/145239805.db2.gz	WPXJSCWBBPVNFO-KRWDZBQOSA-N	0	3	304.434	2.270	10	0		DEAEHN
Cn1cnnc1-c1cccc(NC(=O)[C@H]2NCCCC2(C)C)c1	ZINC000261932769	145244247	/nfs/dbraw/zinc/24/42/47/145244247.db2.gz	SYOLFSRLIWXJEP-CQSZACIVSA-N	0	3	313.405	2.199	10	0		DEAEHN
N[C@@H](C(=O)N1CCC[C@H](Cc2ccccc2)C1)C1CCOCC1	ZINC000262003288	145251969	/nfs/dbraw/zinc/25/19/69/145251969.db2.gz	NPUMZBNMUMJHHC-SJLPKXTDSA-N	0	3	316.445	2.222	10	0		DEAEHN
Cc1cc(NC(=O)[C@H](N)C2CCOCC2)ccc1OC(C)C	ZINC000262013423	145252513	/nfs/dbraw/zinc/25/25/13/145252513.db2.gz	OFLBVDZJBOUNOR-MRXNPFEDSA-N	0	3	306.406	2.475	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)N1CCc2ccccc21	ZINC000262392408	145280904	/nfs/dbraw/zinc/28/09/04/145280904.db2.gz	BKNFUKHTKYLXRP-JOQOYGCGSA-N	0	3	300.402	2.108	10	0		DEAEHN
C[C@H]1C[NH2+]CC[C@@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1Cl	ZINC000262763318	145304507	/nfs/dbraw/zinc/30/45/07/145304507.db2.gz	JZOPUZFAYOMDRZ-KWQFWETISA-N	0	3	323.245	2.270	10	0		DEAEHN
Cc1nc2ccccc2cc1-c1nc([C@@H]2CNCCN2C)no1	ZINC000263226071	145338583	/nfs/dbraw/zinc/33/85/83/145338583.db2.gz	MSYWNKQZSDGBBN-HNNXBMFYSA-N	0	3	309.373	2.169	10	0		DEAEHN
Cc1cc(OCc2nc([C@@H]3CNCCN3C)no2)ccc1Cl	ZINC000263228908	145338821	/nfs/dbraw/zinc/33/88/21/145338821.db2.gz	NCTBVHXYLJKMGB-ZDUSSCGKSA-N	0	3	322.796	2.187	10	0		DEAEHN
COCC[C@H](COC)NCc1cnn(Cc2ccccc2)c1	ZINC000309699742	145350279	/nfs/dbraw/zinc/35/02/79/145350279.db2.gz	ABRSJNIDOAKXAR-QGZVFWFLSA-N	0	3	303.406	2.073	10	0		DEAEHN
CCCCn1cc(CNC(=O)[C@@H]2CCCN2CCC)c(C)n1	ZINC000358723513	147190647	/nfs/dbraw/zinc/19/06/47/147190647.db2.gz	WEACNRUDCPWRGM-INIZCTEOSA-N	0	3	306.454	2.482	10	0		DEAEHN
CC(=O)CCN(C)C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000372327051	148194366	/nfs/dbraw/zinc/19/43/66/148194366.db2.gz	WUVOAYVTPYLUGI-UHFFFAOYSA-N	0	3	302.418	2.336	10	0		DEAEHN
CC[C@@H]1CCCCN1C(=O)[C@@H](C)N1CCC[C@@H](c2nc[nH]n2)C1	ZINC000374548278	148259407	/nfs/dbraw/zinc/25/94/07/148259407.db2.gz	JRXMAJWWZIESPQ-RBSFLKMASA-N	0	3	319.453	2.164	10	0		DEAEHN
O=C(OCCNCCOC(=O)c1ccccc1)c1ccccc1	ZINC000003123333	401722079	/nfs/dbraw/zinc/72/20/79/401722079.db2.gz	SSKKNVDGEGQKNN-UHFFFAOYSA-N	0	3	313.353	2.290	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@H](C)c1ccc(C)cc1	ZINC000111833640	401725214	/nfs/dbraw/zinc/72/52/14/401725214.db2.gz	JMZFEBAAASMREB-NVXWUHKLSA-N	0	3	319.449	2.466	10	0		DEAEHN
CCc1c(C)nc(-c2ccc(OC)cc2)nc1N1CCNCC1	ZINC000006740009	401732142	/nfs/dbraw/zinc/73/21/42/401732142.db2.gz	OYCRURNNJLHDNC-UHFFFAOYSA-N	0	3	312.417	2.433	10	0		DEAEHN
CC[C@@H](C)C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000112256244	401734367	/nfs/dbraw/zinc/73/43/67/401734367.db2.gz	XPMFRKSNKBMRHV-CQSZACIVSA-N	0	3	317.433	2.497	10	0		DEAEHN
COCCOc1cccc(C(=O)N[C@@H](CC(C)C)CN(C)C)c1	ZINC000072016975	401701103	/nfs/dbraw/zinc/70/11/03/401701103.db2.gz	FRQMLVBPBAMBSA-INIZCTEOSA-N	0	3	322.449	2.418	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)CCn2cnc3ccccc32)CCN1C	ZINC000127904055	401755171	/nfs/dbraw/zinc/75/51/71/401755171.db2.gz	FEXQLWLCEIQCEA-LSDHHAIUSA-N	0	3	314.433	2.368	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N2CCN(c3cccs3)CC2)C1	ZINC000128072701	401761836	/nfs/dbraw/zinc/76/18/36/401761836.db2.gz	XPXMTTHMDUGQJV-CQSZACIVSA-N	0	3	322.478	2.064	10	0		DEAEHN
CC(=O)Nc1ccc(F)c(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000113225530	401770302	/nfs/dbraw/zinc/77/03/02/401770302.db2.gz	OSGGYDRUBCVPIQ-BXUZGUMPSA-N	0	3	319.380	2.093	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ccc(C(F)(F)F)nc1	ZINC000113230932	401771588	/nfs/dbraw/zinc/77/15/88/401771588.db2.gz	FYKHYLISRUAHDU-CMPLNLGQSA-N	0	3	313.323	2.409	10	0		DEAEHN
CCOc1ccc(C(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1OC	ZINC000113231835	401771655	/nfs/dbraw/zinc/77/16/55/401771655.db2.gz	WTOQTMDRQQRDIB-DZGCQCFKSA-N	0	3	318.417	2.403	10	0		DEAEHN
CCc1cc(C(=O)NC[C@H](C)CN2CCN(C)CC2)oc1CC	ZINC000128340439	401772124	/nfs/dbraw/zinc/77/21/24/401772124.db2.gz	OTOOFYWLQINHQI-AWEZNQCLSA-N	0	3	321.465	2.018	10	0		DEAEHN
CC[C@@H](CO)N1CCN(CCOc2cc(C)ccc2C)CC1	ZINC000075957436	401775310	/nfs/dbraw/zinc/77/53/10/401775310.db2.gz	OOPCJKSILRVGGC-KRWDZBQOSA-N	0	3	306.450	2.071	10	0		DEAEHN
CC(C)(C)NC(=O)CN1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000076107904	401782873	/nfs/dbraw/zinc/78/28/73/401782873.db2.gz	DBVUSLRVJMBHAJ-CVEARBPZSA-N	0	3	304.434	2.489	10	0		DEAEHN
CCNC(=O)CCN1CCC[C@H]1c1ccc2c(c1)OCCO2	ZINC000025922020	401837822	/nfs/dbraw/zinc/83/78/22/401837822.db2.gz	ABPORUPWIHDQSC-AWEZNQCLSA-N	0	3	304.390	2.121	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000115837858	401838314	/nfs/dbraw/zinc/83/83/14/401838314.db2.gz	UBXUSRFVGBSYLM-NVXWUHKLSA-N	0	3	316.449	2.001	10	0		DEAEHN
CCc1ccc([C@@H]2CCCCN2C[C@H](O)CN2CCOCC2)o1	ZINC000130973085	401842290	/nfs/dbraw/zinc/84/22/90/401842290.db2.gz	OOQOSPVGCJNSBD-WBVHZDCISA-N	0	3	322.449	2.062	10	0		DEAEHN
Cn1cc([C@H]2CCN([C@H](C(=O)NC3CC3)c3ccccc3)C2)cn1	ZINC000116310908	401848468	/nfs/dbraw/zinc/84/84/68/401848468.db2.gz	CAJKHLSXGNXGPO-YJBOKZPZSA-N	0	3	324.428	2.229	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CSCc1cscn1	ZINC000131491264	401851896	/nfs/dbraw/zinc/85/18/96/401851896.db2.gz	MOECFZDCTYGFPK-CYBMUJFWSA-N	0	3	313.492	2.319	10	0		DEAEHN
CN(C)[C@@H](CNC(=O)[C@@H]1CCCc2n[nH]cc21)c1ccccc1	ZINC000131690667	401854738	/nfs/dbraw/zinc/85/47/38/401854738.db2.gz	BDJRRHLVIHWFHK-PBHICJAKSA-N	0	3	312.417	2.249	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cccc(-n2cccn2)c1	ZINC000116764619	401858133	/nfs/dbraw/zinc/85/81/33/401858133.db2.gz	LGKHSZHTPZCINV-RHSMWYFYSA-N	0	3	310.401	2.181	10	0		DEAEHN
C[C@H](CC(=O)N1CCO[C@@H](CN(C)C)C1)c1ccccc1F	ZINC000116787506	401859185	/nfs/dbraw/zinc/85/91/85/401859185.db2.gz	FIVDOWPCXMHNQD-KGLIPLIRSA-N	0	3	308.397	2.108	10	0		DEAEHN
O=C(NC1CCN(C2CC2)CC1)c1coc(Br)c1	ZINC000030626879	401864730	/nfs/dbraw/zinc/86/47/30/401864730.db2.gz	RPIZYHUISHABQI-UHFFFAOYSA-N	0	3	313.195	2.399	10	0		DEAEHN
CCc1cnccc1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1	ZINC000119106503	401926210	/nfs/dbraw/zinc/92/62/10/401926210.db2.gz	ZDPLCJRLVJYKAC-HUUCEWRRSA-N	0	3	319.449	2.263	10	0		DEAEHN
CC1(C)Cc2cccc(CNC[C@@H]3CN(C4CC4)CCO3)c2O1	ZINC000119131612	401927586	/nfs/dbraw/zinc/92/75/86/401927586.db2.gz	BQSYZNSTUHGJML-QGZVFWFLSA-N	0	3	316.445	2.353	10	0		DEAEHN
C[C@H]1CCC[C@@H](CN2CCN(c3ccc4nncn4n3)CC2)C1	ZINC000133384685	401884307	/nfs/dbraw/zinc/88/43/07/401884307.db2.gz	FKCYVEBJYXLNHB-LSDHHAIUSA-N	0	3	314.437	2.073	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000034532556	401892970	/nfs/dbraw/zinc/89/29/70/401892970.db2.gz	YGBZVBILLZITTB-ROUUACIJSA-N	0	3	315.461	2.252	10	0		DEAEHN
CNCC(=O)Nc1ccc(Br)cc1Br	ZINC000034979663	401894524	/nfs/dbraw/zinc/89/45/24/401894524.db2.gz	MTMNAMATOCEGDD-UHFFFAOYSA-N	0	3	322.000	2.370	10	0		DEAEHN
CCc1ccc(S(=O)(=O)NC[C@H](C)N(CC)CC)s1	ZINC000036076791	401901727	/nfs/dbraw/zinc/90/17/27/401901727.db2.gz	ZQCTYSINTOEJAO-NSHDSACASA-N	0	3	304.481	2.319	10	0		DEAEHN
CC(C)(C)OC[C@H](O)CN(CCc1ccccc1)[C@@H]1CCOC1	ZINC000084496772	401905704	/nfs/dbraw/zinc/90/57/04/401905704.db2.gz	HKJSXDZZHVZCEK-QZTJIDSGSA-N	0	3	321.461	2.496	10	0		DEAEHN
CC(C)Oc1ccc(NC(=O)N2CCO[C@H](CN(C)C)C2)cc1	ZINC000118804910	401909071	/nfs/dbraw/zinc/90/90/71/401909071.db2.gz	ZDRNCVFCJAYBIM-MRXNPFEDSA-N	0	3	321.421	2.268	10	0		DEAEHN
CCc1ccc(CC(=O)NC[C@@H]2CCCN2CCOC)cc1	ZINC000118970270	401915930	/nfs/dbraw/zinc/91/59/30/401915930.db2.gz	JJMBUZFJHSAOHX-KRWDZBQOSA-N	0	3	304.434	2.019	10	0		DEAEHN
Cc1noc(CCN[C@H](C)c2ccc3c(c2)OCCCO3)n1	ZINC000089517877	401950842	/nfs/dbraw/zinc/95/08/42/401950842.db2.gz	QYQSHRIAIJEOLN-LLVKDONJSA-N	0	3	303.362	2.433	10	0		DEAEHN
CCCNC(=O)c1cccc(CNC(=O)[C@@H](CCC)N(C)C)c1	ZINC000136354571	401966433	/nfs/dbraw/zinc/96/64/33/401966433.db2.gz	YEELLYYEMGHPRH-MRXNPFEDSA-N	0	3	319.449	2.173	10	0		DEAEHN
O=C(c1ccccc1)N1CCCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000089883326	401969803	/nfs/dbraw/zinc/96/98/03/401969803.db2.gz	BCAXQNPHLMWNIC-SJORKVTESA-N	0	3	302.418	2.138	10	0		DEAEHN
CCN(CCc1nccs1)C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1	ZINC000119955444	401972596	/nfs/dbraw/zinc/97/25/96/401972596.db2.gz	DFVWVZZRVYSAOJ-OLZOCXBDSA-N	0	3	322.478	2.342	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cccnc1C(F)(F)F	ZINC000137076793	401978552	/nfs/dbraw/zinc/97/85/52/401978552.db2.gz	VOFKMGOYHGFVSF-GHMZBOCLSA-N	0	3	313.323	2.409	10	0		DEAEHN
CC[C@@H]1CCCCCN1C(=O)NC[C@@H]1CCCN1CCOC	ZINC000120340995	401987594	/nfs/dbraw/zinc/98/75/94/401987594.db2.gz	UNHUTEUTJGFMFZ-CVEARBPZSA-N	0	3	311.470	2.461	10	0		DEAEHN
Cc1ccc(NC(=O)C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c(C)c1	ZINC000150775548	401995146	/nfs/dbraw/zinc/99/51/46/401995146.db2.gz	NJWHEPIBONSMFY-GOEBONIOSA-N	0	3	317.433	2.087	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@@H](C)N1CCc2ccccc21)N(C)C	ZINC000135649983	401949443	/nfs/dbraw/zinc/94/94/43/401949443.db2.gz	UIUVYLJMDUHCMU-PBHICJAKSA-N	0	3	303.450	2.284	10	0		DEAEHN
CN(C)C[C@H](NC(=O)NCCc1nccs1)c1ccccc1	ZINC000051756885	402036306	/nfs/dbraw/zinc/03/63/06/402036306.db2.gz	NETCKYGNNCEDNK-AWEZNQCLSA-N	0	3	318.446	2.288	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NCCc2c[nH]c3ccccc23)C1	ZINC000052498455	402043005	/nfs/dbraw/zinc/04/30/05/402043005.db2.gz	HLGHFOQXOLETLK-OAHLLOKOSA-N	0	3	314.433	2.494	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2cccc(COC)c2)C1	ZINC000052525453	402043609	/nfs/dbraw/zinc/04/36/09/402043609.db2.gz	UJRAMGVAVDDSHE-INIZCTEOSA-N	0	3	305.422	2.117	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCc2ccc(COC)cc2)C1	ZINC000052524400	402043640	/nfs/dbraw/zinc/04/36/40/402043640.db2.gz	YUWISJFRFNYLET-INIZCTEOSA-N	0	3	305.422	2.117	10	0		DEAEHN
CCN(CC)C(=O)CCC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000151843875	402060622	/nfs/dbraw/zinc/06/06/22/402060622.db2.gz	QNFUMVYMBJMJMB-INIZCTEOSA-N	0	3	319.449	2.054	10	0		DEAEHN
CCc1oc(C(=O)NC[C@H](C)CN2CCN(CC)CC2)cc1C	ZINC000121886714	402055997	/nfs/dbraw/zinc/05/59/97/402055997.db2.gz	NLDPFHKJJXPNAI-AWEZNQCLSA-N	0	3	321.465	2.154	10	0		DEAEHN
O=C(NCCN1CCCC1)c1cnn(-c2cccc(Cl)c2)c1	ZINC000055036205	402074208	/nfs/dbraw/zinc/07/42/08/402074208.db2.gz	WNUKWIIJECPBMP-UHFFFAOYSA-N	0	3	318.808	2.351	10	0		DEAEHN
C[C@@H]1CN(CCc2ccc(F)c(F)c2)C[C@@H]1N1CCOCC1	ZINC000152152777	402078889	/nfs/dbraw/zinc/07/88/89/402078889.db2.gz	SSZTUWSXMNZKSC-DYVFJYSZSA-N	0	3	310.388	2.160	10	0		DEAEHN
C[C@@H](NCc1ccnn1C)c1cccc(OCCN(C)C)c1	ZINC000152186643	402080317	/nfs/dbraw/zinc/08/03/17/402080317.db2.gz	NFLZFWMYADHVKH-CQSZACIVSA-N	0	3	302.422	2.211	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)c2cccc(-n3cccn3)c2)CCN1C	ZINC000122666888	402089150	/nfs/dbraw/zinc/08/91/50/402089150.db2.gz	YCTOUVNCCWFDIH-GOEBONIOSA-N	0	3	312.417	2.427	10	0		DEAEHN
COCCN(C)CCCNC(=O)N[C@H]1CCCc2ccccc21	ZINC000060916768	402106904	/nfs/dbraw/zinc/10/69/04/402106904.db2.gz	FANXWGXCMSGTTJ-KRWDZBQOSA-N	0	3	319.449	2.332	10	0		DEAEHN
COc1ccc2oc(CNC[C@@H](C)N3CCOCC3)cc2c1	ZINC000123053333	402108245	/nfs/dbraw/zinc/10/82/45/402108245.db2.gz	YEASJSPNRPSYNO-CYBMUJFWSA-N	0	3	304.390	2.252	10	0		DEAEHN
CC(C)N(C)CC(=O)N(C)Cc1cnn(-c2ccccc2)c1	ZINC000063465161	402113077	/nfs/dbraw/zinc/11/30/77/402113077.db2.gz	RQJAWHBIAYWNQI-UHFFFAOYSA-N	0	3	300.406	2.171	10	0		DEAEHN
COc1cc(OC)cc(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1	ZINC000123426011	402127757	/nfs/dbraw/zinc/12/77/57/402127757.db2.gz	PFKJMXKAKWBZHF-JSGCOSHPSA-N	0	3	306.406	2.259	10	0		DEAEHN
CCc1ccc(S(=O)(=O)NCc2ccc3c(c2)CNC3)s1	ZINC000097829550	402133337	/nfs/dbraw/zinc/13/33/37/402133337.db2.gz	FARVEZSAHGMMDO-UHFFFAOYSA-N	0	3	322.455	2.392	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N(C)CCOCc2ccccc2)C1	ZINC000123352972	402123411	/nfs/dbraw/zinc/12/34/11/402123411.db2.gz	POZZTNKIOVMHNJ-QGZVFWFLSA-N	0	3	319.449	2.329	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)C(=O)c2ccc(Cl)cc2)CCN1C	ZINC000123761553	402145058	/nfs/dbraw/zinc/14/50/58/402145058.db2.gz	VMPCUPSGPCQDKP-SMDDNHRTSA-N	0	3	308.809	2.464	10	0		DEAEHN
Cc1cc(NC(=O)C(=O)N[C@H](CC(C)C)CN(C)C)ccc1F	ZINC000103323771	402185355	/nfs/dbraw/zinc/18/53/55/402185355.db2.gz	UBBAIMCXYWNQQV-CQSZACIVSA-N	0	3	323.412	2.165	10	0		DEAEHN
COC[C@H](C)C(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000103387365	402186454	/nfs/dbraw/zinc/18/64/54/402186454.db2.gz	DPDBKCXJXTWQBB-RDJZCZTQSA-N	0	3	304.434	2.440	10	0		DEAEHN
c1ccn2c(c1)nnc2C1CCN(C[C@@H]2CCCCO2)CC1	ZINC000067442938	402159916	/nfs/dbraw/zinc/15/99/16/402159916.db2.gz	RRVNBKJVOYGFDH-HNNXBMFYSA-N	0	3	300.406	2.478	10	0		DEAEHN
COc1cccc(OCCN2CC[C@@H](c3cnn(C)c3)C2)c1	ZINC000153832061	402172873	/nfs/dbraw/zinc/17/28/73/402172873.db2.gz	ZXXOBXWGDWJVBV-CQSZACIVSA-N	0	3	301.390	2.297	10	0		DEAEHN
Cc1c([C@@H](C)NC[C@@H]2CCCN2C)nnn1-c1ccc(F)cc1	ZINC000154588604	402219913	/nfs/dbraw/zinc/21/99/13/402219913.db2.gz	BXNCYWXPWYBYRH-WBMJQRKESA-N	0	3	317.412	2.460	10	0		DEAEHN
COc1cc(Cl)ccc1CNC(=O)NC[C@@H]1CCCN1C	ZINC000107839975	402241709	/nfs/dbraw/zinc/24/17/09/402241709.db2.gz	QTDHAZMJMNEWAU-ZDUSSCGKSA-N	0	3	311.813	2.242	10	0		DEAEHN
c1cncc(-c2cc(N3CCNCC3)nc(-c3cccnc3)n2)c1	ZINC000070451644	402260574	/nfs/dbraw/zinc/26/05/74/402260574.db2.gz	OYNRRECTPPCGGC-UHFFFAOYSA-N	0	3	318.384	2.010	10	0		DEAEHN
CN(C)C[C@H](NC(=O)c1cnn2c1CCCC2)c1ccccc1	ZINC000126047021	402261579	/nfs/dbraw/zinc/26/15/79/402261579.db2.gz	BJXVLNOSJIJUSF-INIZCTEOSA-N	0	3	312.417	2.252	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(CC(=O)N2CCC(C)CC2)C1	ZINC000105896597	402210441	/nfs/dbraw/zinc/21/04/41/402210441.db2.gz	SPJCODNHAYQHCN-MRXNPFEDSA-N	0	3	318.465	2.341	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2csc(Br)c2)C1	ZINC000070916233	402267033	/nfs/dbraw/zinc/26/70/33/402267033.db2.gz	TVGQIZUFFRKUGX-VIFPVBQESA-N	0	3	303.225	2.287	10	0		DEAEHN
CCn1nccc1CCN1C[C@@H](O)C[C@H]1c1cccc(OC)c1	ZINC000225787152	402323693	/nfs/dbraw/zinc/32/36/93/402323693.db2.gz	YRPGMLGYUMTPSX-WMZOPIPTSA-N	0	3	315.417	2.262	10	0		DEAEHN
COc1c(CNC[C@@](C)(O)c2cccc(Cl)c2)c(C)nn1C	ZINC000185112969	402325329	/nfs/dbraw/zinc/32/53/29/402325329.db2.gz	UMPMWXYRTYQEMJ-MRXNPFEDSA-N	0	3	323.824	2.388	10	0		DEAEHN
CC(C)[C@](C)(O)CN1CCCN(C(=O)c2ccccc2F)CC1	ZINC000184956430	402312463	/nfs/dbraw/zinc/31/24/63/402312463.db2.gz	OIGSTFYFMPJIPN-GOSISDBHSA-N	0	3	322.424	2.381	10	0		DEAEHN
CC(C)N1C[C@H](NC(=O)CSCc2ccccn2)[C@@H](C)C1	ZINC000159019097	402316443	/nfs/dbraw/zinc/31/64/43/402316443.db2.gz	DSPIJWSIHNYILP-ZFWWWQNUSA-N	0	3	307.463	2.160	10	0		DEAEHN
CC[C@H](Oc1ccccc1C)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000176520179	402316677	/nfs/dbraw/zinc/31/66/77/402316677.db2.gz	FCIZZGKHUHZTGH-CVEARBPZSA-N	0	3	302.418	2.459	10	0		DEAEHN
CC(C)c1nnc(CCC(=O)NCCN2CCCC[C@H]2C)o1	ZINC000176558892	402319369	/nfs/dbraw/zinc/31/93/69/402319369.db2.gz	VCYPHTAIVMYNIP-CYBMUJFWSA-N	0	3	308.426	2.116	10	0		DEAEHN
C[C@@H](CCN1CCN(C)CC1)NC(=O)NC1CCC(C)(C)CC1	ZINC000185453837	402354018	/nfs/dbraw/zinc/35/40/18/402354018.db2.gz	CZPGQMVVQWZXJK-HNNXBMFYSA-N	0	3	324.513	2.280	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(C(C)(C)C)nn1C	ZINC000176976905	402355924	/nfs/dbraw/zinc/35/59/24/402355924.db2.gz	LGMVGNVAVKBDPE-ZDUSSCGKSA-N	0	3	306.454	2.274	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)c1cc(NC(C)=O)ccc1F	ZINC000176980607	402356478	/nfs/dbraw/zinc/35/64/78/402356478.db2.gz	SFWULOFQZCNGKP-AWEZNQCLSA-N	0	3	321.396	2.340	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1cccc(NC(=O)OC)c1	ZINC000177014091	402359382	/nfs/dbraw/zinc/35/93/82/402359382.db2.gz	VDXNLKYFWAOAGS-OAHLLOKOSA-N	0	3	319.405	2.421	10	0		DEAEHN
CN(C)CCN(C(=O)CCc1ccnn1C)C1CCCCC1	ZINC000185913530	402388734	/nfs/dbraw/zinc/38/87/34/402388734.db2.gz	CSYHXJFSLAEXLY-UHFFFAOYSA-N	0	3	306.454	2.076	10	0		DEAEHN
CCc1oc(C(=O)OC)cc1CN1CC[C@H](c2cnn(C)c2)C1	ZINC000177189535	402379431	/nfs/dbraw/zinc/37/94/31/402379431.db2.gz	FEYKOCFNRRKDJW-LBPRGKRZSA-N	0	3	317.389	2.352	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCC1(OC)CCCCC1	ZINC000185920503	402389153	/nfs/dbraw/zinc/38/91/53/402389153.db2.gz	NZPLQOMTRLZTDQ-HNNXBMFYSA-N	0	3	311.470	2.461	10	0		DEAEHN
C[C@H]1C[C@H](NC(=O)Nc2nncs2)CN1Cc1ccccc1	ZINC000176677646	402327936	/nfs/dbraw/zinc/32/79/36/402327936.db2.gz	VTFPISPRRIKRTA-AAEUAGOBSA-N	0	3	317.418	2.323	10	0		DEAEHN
C[C@@H]1OCC[C@@]1(O)CNCc1ccc(Br)c(F)c1	ZINC000227971141	402334638	/nfs/dbraw/zinc/33/46/38/402334638.db2.gz	WRDZQEYXZLCCPA-TVQRCGJNSA-N	0	3	318.186	2.218	10	0		DEAEHN
Cc1cccc2ncnc(NC[C@H](O)CN3CCCCC3)c12	ZINC000176803688	402338598	/nfs/dbraw/zinc/33/85/98/402338598.db2.gz	JRZIEJSCHROPJR-AWEZNQCLSA-N	0	3	300.406	2.197	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1nccn1CC(C)C	ZINC000177545476	402414379	/nfs/dbraw/zinc/41/43/79/402414379.db2.gz	VHZQDAHHVRQWIK-HNNXBMFYSA-N	0	3	321.469	2.165	10	0		DEAEHN
C[C@@]1(CNC(=O)c2cnccn2)CCCN1Cc1ccccc1	ZINC000162379700	402418313	/nfs/dbraw/zinc/41/83/13/402418313.db2.gz	ZKFDIAOULIWEHF-SFHVURJKSA-N	0	3	310.401	2.261	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2c(C)nn(C)c2C)C12CCOCC2	ZINC000186304349	402419296	/nfs/dbraw/zinc/41/92/96/402419296.db2.gz	CHVKAVJLPQOXLZ-HZPDHXFCSA-N	0	3	307.438	2.101	10	0		DEAEHN
CCN(C(=O)[C@@H](C)COC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000186309436	402419877	/nfs/dbraw/zinc/41/98/77/402419877.db2.gz	HCCKMCRWAALSRE-DOTOQJQBSA-N	0	3	304.434	2.392	10	0		DEAEHN
Cc1nc(-c2cccc(NC(=O)C[C@@H]3CSCCN3)c2)no1	ZINC000237820219	402422165	/nfs/dbraw/zinc/42/21/65/402422165.db2.gz	KKFOPXYDSRCTRM-CYBMUJFWSA-N	0	3	318.402	2.079	10	0		DEAEHN
COC(=O)c1coc(C(=O)NCC(C)(C)N2CCCCC2)c1	ZINC000186345995	402423096	/nfs/dbraw/zinc/42/30/96/402423096.db2.gz	DOBCWWZZGSIVAO-UHFFFAOYSA-N	0	3	308.378	2.061	10	0		DEAEHN
C[C@@H]1C[C@H](NC(=O)N[C@@H]2CCOc3ccccc32)CN1C1CC1	ZINC000177668679	402425216	/nfs/dbraw/zinc/42/52/16/402425216.db2.gz	PGZDBZXFYFXRKM-DVOMOZLQSA-N	0	3	315.417	2.435	10	0		DEAEHN
CCC[C@H](C(=O)NCCCOc1cccc(OC)c1)N(C)C	ZINC000162573072	402425283	/nfs/dbraw/zinc/42/52/83/402425283.db2.gz	ZHTWYPGPHQDAEC-MRXNPFEDSA-N	0	3	308.422	2.311	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)Nc1cccc(C(C)=O)c1	ZINC000177699895	402427746	/nfs/dbraw/zinc/42/77/46/402427746.db2.gz	OHQPLKLBYJKAJA-QGZVFWFLSA-N	0	3	317.433	2.244	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(-c3cncnc3)cc2F)C1	ZINC000186590502	402444938	/nfs/dbraw/zinc/44/49/38/402444938.db2.gz	YPKKACPFYYNNID-CQSZACIVSA-N	0	3	314.364	2.059	10	0		DEAEHN
C[C@H](NCCNC(=O)c1ccccc1)c1ccc2c(c1)OCO2	ZINC000178023882	402453519	/nfs/dbraw/zinc/45/35/19/402453519.db2.gz	HYWHJXPLFRINMF-ZDUSSCGKSA-N	0	3	312.369	2.496	10	0		DEAEHN
C[C@@H]1CN(C[C@@H](O)COCc2ccc(Cl)cc2)CCCO1	ZINC000245406092	402457393	/nfs/dbraw/zinc/45/73/93/402457393.db2.gz	WAHOWBXKZSCTSJ-CZUORRHYSA-N	0	3	313.825	2.328	10	0		DEAEHN
CN(CCN(C)C1CC1)C(=O)C[C@@H]1CCOc2ccccc21	ZINC000186804635	402465085	/nfs/dbraw/zinc/46/50/85/402465085.db2.gz	XYMYSRAYAOGFSW-AWEZNQCLSA-N	0	3	302.418	2.495	10	0		DEAEHN
COc1ccc2[nH]cc(C3CCN([C@H]4CCNC4=O)CC3)c2c1	ZINC000178193110	402469640	/nfs/dbraw/zinc/46/96/40/402469640.db2.gz	NIROCYDLGIWUDX-KRWDZBQOSA-N	0	3	313.401	2.244	10	0		DEAEHN
CC[C@H]1CN(Cc2cc(F)c(F)cc2F)CCN1C[C@H](C)O	ZINC000245724014	402483015	/nfs/dbraw/zinc/48/30/15/402483015.db2.gz	ILNPOQPVCYDCGB-AAEUAGOBSA-N	0	3	316.367	2.381	10	0		DEAEHN
COc1cc(CN(C[C@@H](O)COC(C)C)C2CC2)cc(OC)c1	ZINC000036095102	286217611	/nfs/dbraw/zinc/21/76/11/286217611.db2.gz	VZKKAWLPQUUXBJ-MRXNPFEDSA-N	0	3	323.433	2.454	10	0		DEAEHN
COc1cc(CN(C)C[C@@H]2CCC[C@H]2O)cc2c1OCCO2	ZINC000245743796	402484757	/nfs/dbraw/zinc/48/47/57/402484757.db2.gz	GLSJBZLVLXLMMI-UONOGXRCSA-N	0	3	307.390	2.059	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)N[C@@H]1CCC[C@H]2OCC[C@H]21	ZINC000245748384	402485842	/nfs/dbraw/zinc/48/58/42/402485842.db2.gz	AMJFGYXVTPPNLM-QKPAOTATSA-N	0	3	309.454	2.118	10	0		DEAEHN
C[C@H](C(=O)N[C@@H](C)c1nnc2n1CCCC2)N1[C@H](C)CC[C@@H]1C	ZINC000245777342	402487408	/nfs/dbraw/zinc/48/74/08/402487408.db2.gz	LOMZIGUVYAUMKE-RFQIPJPRSA-N	0	3	319.453	2.053	10	0		DEAEHN
CO[C@@H]1CN(C(=O)NCC(C)(C)N2CCCCC2)CC[C@@H]1C	ZINC000187246702	402489973	/nfs/dbraw/zinc/48/99/73/402489973.db2.gz	ANGPQBABECVYFA-LSDHHAIUSA-N	0	3	311.470	2.317	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)NCCc2ccc(F)cc2)C1	ZINC000245863822	402491703	/nfs/dbraw/zinc/49/17/03/402491703.db2.gz	FUCIAJZFVFPAFK-DOTOQJQBSA-N	0	3	319.424	2.494	10	0		DEAEHN
CC(C)Oc1cccc(C(=O)NCCN2CCCC[C@@H]2C)n1	ZINC000169013179	402499630	/nfs/dbraw/zinc/49/96/30/402499630.db2.gz	IPTDMQQHEMUITD-AWEZNQCLSA-N	0	3	305.422	2.473	10	0		DEAEHN
CC(C)OC[C@H](O)CN1CCC[C@H]1c1ccc2c(c1)OCO2	ZINC000245997072	402502506	/nfs/dbraw/zinc/50/25/06/402502506.db2.gz	CNXOUWBGIBHGJF-CABCVRRESA-N	0	3	307.390	2.338	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@@H]2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000246001863	402502931	/nfs/dbraw/zinc/50/29/31/402502931.db2.gz	FOIDJCONTGAUDG-IJLUTSLNSA-N	0	3	307.360	2.453	10	0		DEAEHN
CO[C@@H]1CN(C(=O)N[C@H](C)CN2CCC[C@@H](C)C2)CC[C@@H]1C	ZINC000187620054	402505941	/nfs/dbraw/zinc/50/59/41/402505941.db2.gz	RTCZDMUUXDDZMP-QKPAOTATSA-N	0	3	311.470	2.173	10	0		DEAEHN
COc1ccccc1CNC(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000246062816	402506544	/nfs/dbraw/zinc/50/65/44/402506544.db2.gz	YNNOTBCKKDIDRO-HOTGVXAUSA-N	0	3	317.433	2.321	10	0		DEAEHN
Cc1cc(C)cc(OC[C@@H](O)CN2CCN3CCCC[C@H]3C2)c1	ZINC000246921151	402549933	/nfs/dbraw/zinc/54/99/33/402549933.db2.gz	SMQLJNPDELQLPY-ROUUACIJSA-N	0	3	318.461	2.213	10	0		DEAEHN
C[C@H](C(=O)N1CCc2ccccc21)N1CC[C@@H]2OCCC[C@@H]2C1	ZINC000246941914	402550519	/nfs/dbraw/zinc/55/05/19/402550519.db2.gz	WWCNXIOCGXQZOV-KYJSFNMBSA-N	0	3	314.429	2.465	10	0		DEAEHN
CC(C)[C@@H](O)CC(=O)Nc1ccc(N2CCCN(C)CC2)cc1	ZINC000178901034	402552636	/nfs/dbraw/zinc/55/26/36/402552636.db2.gz	ISTXBWJQKSKPGP-KRWDZBQOSA-N	0	3	319.449	2.174	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)Nc2ccc(NC(=O)C3CC3)cc2)C1	ZINC000171074260	402554647	/nfs/dbraw/zinc/55/46/47/402554647.db2.gz	QTKWJVDSCUDADF-OAHLLOKOSA-N	0	3	316.405	2.203	10	0		DEAEHN
CN1CCC[C@H]1CNC(=O)NCCCCOCc1ccccc1	ZINC000171190400	402565500	/nfs/dbraw/zinc/56/55/00/402565500.db2.gz	WIGVJHVPSIORSH-KRWDZBQOSA-N	0	3	319.449	2.377	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)N[C@@H](C)CN1CCCCC1	ZINC000189955838	402568409	/nfs/dbraw/zinc/56/84/09/402568409.db2.gz	OLTCHFJNTVHJSS-UONOGXRCSA-N	0	3	320.437	2.325	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N(C)[C@@H]1CCC[C@H](C)C1	ZINC000247480861	402568952	/nfs/dbraw/zinc/56/89/52/402568952.db2.gz	JKSRDJIFHCOFRR-ARFHVFGLSA-N	0	3	311.470	2.317	10	0		DEAEHN
C[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc(F)cc2nc[nH]c21	ZINC000247560459	402572221	/nfs/dbraw/zinc/57/22/21/402572221.db2.gz	ZZXIXTYLCMASDW-PWSUYJOCSA-N	0	3	302.353	2.011	10	0		DEAEHN
C[C@@H](C(=O)N[C@H]1CCCC[C@H]1C)N1CCCN(C2CC2)CC1	ZINC000246223868	402519026	/nfs/dbraw/zinc/51/90/26/402519026.db2.gz	ZYHOOUHVXDWADJ-VYDXJSESSA-N	0	3	307.482	2.240	10	0		DEAEHN
CC(C)[C@H](NC(=O)CN1CCN2CCC[C@@H]2C1)c1ccccc1	ZINC000178628306	402519594	/nfs/dbraw/zinc/51/95/94/402519594.db2.gz	UJYMOIGSMDTESQ-MJGOQNOKSA-N	0	3	315.461	2.280	10	0		DEAEHN
C[C@H](CNC(=O)NCCCc1ccccn1)N1CCC[C@@H](C)C1	ZINC000246258473	402521489	/nfs/dbraw/zinc/52/14/89/402521489.db2.gz	WPMAWNCQMFSXBS-HZPDHXFCSA-N	0	3	318.465	2.434	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCc2coc(-c3cccs3)n2)C1	ZINC000170827576	402529617	/nfs/dbraw/zinc/52/96/17/402529617.db2.gz	RCQKFLQMVFWKOE-GFCCVEGCSA-N	0	3	320.418	2.249	10	0		DEAEHN
COc1ccc(Cl)cc1CNC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170831578	402530459	/nfs/dbraw/zinc/53/04/59/402530459.db2.gz	DSZONEVXBNJTJE-CYBMUJFWSA-N	0	3	311.813	2.194	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)NCCOc2cccc(Cl)c2)C1	ZINC000170831506	402530529	/nfs/dbraw/zinc/53/05/29/402530529.db2.gz	YJHAPVFWFAGDBZ-CYBMUJFWSA-N	0	3	311.813	2.064	10	0		DEAEHN
CCCCOc1ncccc1CNC(=O)N1CC[C@@H](N(C)C)C1	ZINC000170834420	402530904	/nfs/dbraw/zinc/53/09/04/402530904.db2.gz	SHYBRRMXXFGUIX-OAHLLOKOSA-N	0	3	320.437	2.106	10	0		DEAEHN
Cc1cnccc1CNC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000190072008	402574056	/nfs/dbraw/zinc/57/40/56/402574056.db2.gz	SCEIYSCLAZIHKI-QGZVFWFLSA-N	0	3	312.417	2.492	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)/C=C/c2nc3ccccc3s2)C1	ZINC000170861238	402534226	/nfs/dbraw/zinc/53/42/26/402534226.db2.gz	CZUXPKRRNQLOOU-ABZNLYFFSA-N	0	3	301.415	2.472	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccc(OC[C@@H]3CCCO3)cc2)C1	ZINC000170861748	402534445	/nfs/dbraw/zinc/53/44/45/402534445.db2.gz	RYSOOCRJESVBPN-WBVHZDCISA-N	0	3	318.417	2.021	10	0		DEAEHN
Cc1c(C(=O)N2CC[C@@H](N(C)C)C2)cnn1Cc1ccccc1	ZINC000170866190	402534883	/nfs/dbraw/zinc/53/48/83/402534883.db2.gz	NNGNTTCCVOTDBN-MRXNPFEDSA-N	0	3	312.417	2.016	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2ccn(-c3cccc(Cl)c3)n2)C1	ZINC000170864641	402535065	/nfs/dbraw/zinc/53/50/65/402535065.db2.gz	BIACITXNKFDLEL-CQSZACIVSA-N	0	3	318.808	2.302	10	0		DEAEHN
Cc1sc(-c2ccco2)nc1C(=O)N1CC[C@@H](N(C)C)C1	ZINC000170867858	402535978	/nfs/dbraw/zinc/53/59/78/402535978.db2.gz	NHCSICABEXVSFB-LLVKDONJSA-N	0	3	305.403	2.488	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)NCCCc1ccccn1	ZINC000179175162	402578390	/nfs/dbraw/zinc/57/83/90/402578390.db2.gz	XANROCVPYGXBFH-INIZCTEOSA-N	0	3	306.454	2.290	10	0		DEAEHN
O=C1[C@H](N2CCN3CCC[C@@H]3C2)CCCN1c1ccccc1F	ZINC000179310667	402584613	/nfs/dbraw/zinc/58/46/13/402584613.db2.gz	MGLINLPOLHRZSW-RHSMWYFYSA-N	0	3	317.408	2.101	10	0		DEAEHN
O=C(c1cc(C2CCCCC2)n[nH]1)N1CCN2CCC[C@@H]2C1	ZINC000179343143	402585674	/nfs/dbraw/zinc/58/56/74/402585674.db2.gz	MRXGIAULJGYFHY-CQSZACIVSA-N	0	3	302.422	2.378	10	0		DEAEHN
O=C(N1CCN2CCC[C@@H]2C1)C1(c2ccccc2)CCOCC1	ZINC000171586460	402597684	/nfs/dbraw/zinc/59/76/84/402597684.db2.gz	CNUNUCJINWTLEB-QGZVFWFLSA-N	0	3	314.429	2.041	10	0		DEAEHN
COCOc1ccc(OC)cc1CN1CCCN(C2CC2)CC1	ZINC000179732413	402598933	/nfs/dbraw/zinc/59/89/33/402598933.db2.gz	VNHDVZPOMOHRCS-UHFFFAOYSA-N	0	3	320.433	2.348	10	0		DEAEHN
CCc1ccccc1NC(=O)[C@H](C)NCCn1cc(C)cn1	ZINC000171600721	402599842	/nfs/dbraw/zinc/59/98/42/402599842.db2.gz	YJMPUNGOYWYGOC-AWEZNQCLSA-N	0	3	300.406	2.371	10	0		DEAEHN
CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@H]1CCCOC1	ZINC000171614381	402601394	/nfs/dbraw/zinc/60/13/94/402601394.db2.gz	VRHYFYAQAXWHRR-INIZCTEOSA-N	0	3	323.412	2.078	10	0		DEAEHN
O=C(N[C@@H]1CCCOC1)N1CCCN(Cc2ccccc2)CC1	ZINC000171618903	402602146	/nfs/dbraw/zinc/60/21/46/402602146.db2.gz	XHSRMDAKZVFWJG-QGZVFWFLSA-N	0	3	317.433	2.083	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccccc1	ZINC000190475258	402604230	/nfs/dbraw/zinc/60/42/30/402604230.db2.gz	CJUHDITZZRNCIM-RDJZCZTQSA-N	0	3	304.434	2.392	10	0		DEAEHN
O=C1C[C@H](c2ccccc2)N(C[C@H](O)CC2CCCC2)CCN1	ZINC000190499033	402605727	/nfs/dbraw/zinc/60/57/27/402605727.db2.gz	QTWDAIUGSMRRCN-QZTJIDSGSA-N	0	3	316.445	2.491	10	0		DEAEHN
CN(C)C[C@@H]1CN(c2nc(C(F)F)nc3ccccc32)CCO1	ZINC000171727840	402615635	/nfs/dbraw/zinc/61/56/35/402615635.db2.gz	RMTRSKVYDAMZMH-LLVKDONJSA-N	0	3	322.359	2.334	10	0		DEAEHN
C[C@@H](O)CN(Cc1ccc(C(=O)OC(C)(C)C)cc1)[C@@H](C)CO	ZINC000190860915	402628294	/nfs/dbraw/zinc/62/82/94/402628294.db2.gz	YFZYMFJFEXQIJW-UONOGXRCSA-N	0	3	323.433	2.206	10	0		DEAEHN
CN(C(=O)NCC(C)(C)C)C1CCN(CCn2cccn2)CC1	ZINC000171759556	402619178	/nfs/dbraw/zinc/61/91/78/402619178.db2.gz	MHFIVZGQBIFHAB-UHFFFAOYSA-N	0	3	321.469	2.035	10	0		DEAEHN
C[C@@H]1OCCC[C@@H]1C(=O)NCc1ccccc1OCCN(C)C	ZINC000190701259	402619256	/nfs/dbraw/zinc/61/92/56/402619256.db2.gz	GABQBQMKBZGCSG-HOCLYGCPSA-N	0	3	320.433	2.058	10	0		DEAEHN
CCn1cc([C@H](C)N[C@H]2CCc3nnc(C(C)C)n3C2)cn1	ZINC000180535882	402619742	/nfs/dbraw/zinc/61/97/42/402619742.db2.gz	KSRQWBZHUKEVRW-JSGCOSHPSA-N	0	3	302.426	2.284	10	0		DEAEHN
CC[C@H](C)NC(=O)[C@H](C)N[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000249243313	402623703	/nfs/dbraw/zinc/62/37/03/402623703.db2.gz	SEVUWSVEUUVOKI-MJBXVCDLSA-N	0	3	315.421	2.221	10	0		DEAEHN
COc1ccc(CN(C)C(=O)[C@]2(C)CCCCN2)c(OC)c1	ZINC000180903366	402629727	/nfs/dbraw/zinc/62/97/27/402629727.db2.gz	AUCBSQJSJNGMML-KRWDZBQOSA-N	0	3	306.406	2.194	10	0		DEAEHN
C[C@H](NC(=O)N1CCCN(C2CC2)CC1)c1cccc(O)c1	ZINC000171945730	402635171	/nfs/dbraw/zinc/63/51/71/402635171.db2.gz	QUBRBEOHVSWOQL-ZDUSSCGKSA-N	0	3	303.406	2.333	10	0		DEAEHN
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C[C@@H](O)Cc1ccccc1	ZINC000249720106	402639229	/nfs/dbraw/zinc/63/92/29/402639229.db2.gz	LTWLKVIZQSXFGJ-FJIDUMEYSA-N	0	3	317.429	2.396	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NC[C@H](c2ccccc2)N(C)C)C1	ZINC000249811221	402642444	/nfs/dbraw/zinc/64/24/44/402642444.db2.gz	YVMNIDIUDCOISR-DLBZAZTESA-N	0	3	318.465	2.073	10	0		DEAEHN
CCOc1c(Cl)cccc1CC(=O)N1CC[C@H](N(C)C)C1	ZINC000191183985	402649116	/nfs/dbraw/zinc/64/91/16/402649116.db2.gz	DIZYZAMCZANJEM-ZDUSSCGKSA-N	0	3	310.825	2.444	10	0		DEAEHN
CC[C@@]1(CO)CCCN1CC(=O)N1CCC[C@@H](C(F)(F)F)C1	ZINC000252003233	402652127	/nfs/dbraw/zinc/65/21/27/402652127.db2.gz	WTUJWTALHAQUKV-OCCSQVGLSA-N	0	3	322.371	2.024	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N[C@@H](Cc2ccccc2)C(=O)N(C)C)C1(C)C	ZINC000181729193	402655208	/nfs/dbraw/zinc/65/52/08/402655208.db2.gz	KGQIVZPRWKCPIR-GVDBMIGSSA-N	0	3	318.461	2.479	10	0		DEAEHN
Cc1ccc(OCCCN2CC[C@H](N3CCOCC3)C2)cc1C	ZINC000173949134	402721072	/nfs/dbraw/zinc/72/10/72/402721072.db2.gz	PWTCWEAQKXDBDY-SFHVURJKSA-N	0	3	318.461	2.479	10	0		DEAEHN
CC(C)CCS(=O)(=O)N1CC[C@H]2CC[C@@H](C1)N2C(C)C	ZINC000173850531	402715669	/nfs/dbraw/zinc/71/56/69/402715669.db2.gz	HFNFELDXKHOJTD-CABCVRRESA-N	0	3	302.484	2.309	10	0		DEAEHN
Cc1ncsc1CCN1CCCC[C@H]1CN1CCOCC1	ZINC000172537861	402661497	/nfs/dbraw/zinc/66/14/97/402661497.db2.gz	CGIWFSVBACOJDR-HNNXBMFYSA-N	0	3	309.479	2.181	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)N(C)[C@@H]1CCN(C)C[C@H]1C	ZINC000253202726	402661885	/nfs/dbraw/zinc/66/18/85/402661885.db2.gz	CSKJYRJADICPIT-IUODEOHRSA-N	0	3	323.412	2.316	10	0		DEAEHN
Cc1ccccc1CNC(=O)[C@H](C)N1CCCN(C2CC2)CC1	ZINC000172543561	402662061	/nfs/dbraw/zinc/66/20/61/402662061.db2.gz	SFZRRQIBWCWEFO-INIZCTEOSA-N	0	3	315.461	2.170	10	0		DEAEHN
COCCCN(C)CCNC(=O)c1c[nH]c2cc(F)ccc12	ZINC000181999635	402663350	/nfs/dbraw/zinc/66/33/50/402663350.db2.gz	QFOYPBFUUHTPHZ-UHFFFAOYSA-N	0	3	307.369	2.005	10	0		DEAEHN
CN(C)CCn1ccc(NC(=O)N(C)Cc2ccc(F)cc2)n1	ZINC000172707443	402670737	/nfs/dbraw/zinc/67/07/37/402670737.db2.gz	HFTHHAXLTICQHJ-UHFFFAOYSA-N	0	3	319.384	2.248	10	0		DEAEHN
COc1ccccc1CCCN1CCN(C[C@@H](C)O)[C@H](C)C1	ZINC000182440945	402690152	/nfs/dbraw/zinc/69/01/52/402690152.db2.gz	ALXXJMDFQCFQNE-HZPDHXFCSA-N	0	3	306.450	2.015	10	0		DEAEHN
CNC(=O)Cc1nc(CN2C[C@H](C)[C@H]3CCCC[C@@H]32)cs1	ZINC000182497158	402695204	/nfs/dbraw/zinc/69/52/04/402695204.db2.gz	WBBBOVGJJKSHEL-YUTCNCBUSA-N	0	3	307.463	2.442	10	0		DEAEHN
Cc1ccc([C@@H]2OCCC[C@@H]2C(=O)N2CCCNCC2)cc1	ZINC000262484160	402726083	/nfs/dbraw/zinc/72/60/83/402726083.db2.gz	WGIJBHIWRUQAID-IRXDYDNUSA-N	0	3	302.418	2.285	10	0		DEAEHN
CCO[C@@H](CCNC(=O)N1CC[C@@H](N2CC=CC2)C1)C(C)C	ZINC000174324506	402736842	/nfs/dbraw/zinc/73/68/42/402736842.db2.gz	FREGVLPPANEOQL-CVEARBPZSA-N	0	3	309.454	2.093	10	0		DEAEHN
CCCNc1ccc(CNC(=O)N2CCN3CCC[C@@H]3C2)cc1	ZINC000192604344	402740013	/nfs/dbraw/zinc/74/00/13/402740013.db2.gz	LKZKETNRDGWFQH-QGZVFWFLSA-N	0	3	316.449	2.498	10	0		DEAEHN
COc1ccc(Cl)cc1NC(=O)CN[C@@H](C)[C@H]1CCCO1	ZINC000183152661	402743225	/nfs/dbraw/zinc/74/32/25/402743225.db2.gz	KAFZJCUNAKNXIT-GXFFZTMASA-N	0	3	312.797	2.444	10	0		DEAEHN
CC[C@H](Oc1ccccc1F)c1nc([C@@H]2CNCCN2C)no1	ZINC000263238967	402748890	/nfs/dbraw/zinc/74/88/90/402748890.db2.gz	OJQWUHFVGFPGBE-STQMWFEESA-N	0	3	320.368	2.315	10	0		DEAEHN
CCN1CC[C@@H](N(C)S(=O)(=O)c2cc(C)oc2C)[C@H](C)C1	ZINC000183233670	402749206	/nfs/dbraw/zinc/74/92/06/402749206.db2.gz	IOLIOBUVEOPTCL-BXUZGUMPSA-N	0	3	314.451	2.247	10	0		DEAEHN
CN1CCNC[C@H]1c1noc(/C=C/c2ccnc3ccccc23)n1	ZINC000263243918	402749702	/nfs/dbraw/zinc/74/97/02/402749702.db2.gz	PBLPHFVSMKWFMY-MOEXGYKKSA-N	0	3	321.384	2.364	10	0		DEAEHN
CS[C@H](c1nc([C@H]2CNCCN2C)no1)c1ccccc1	ZINC000263275994	402753089	/nfs/dbraw/zinc/75/30/89/402753089.db2.gz	SWFIFPHKCLURES-OLZOCXBDSA-N	0	3	304.419	2.098	10	0		DEAEHN
OCC[C@]1(CNCc2cnc(-c3ccco3)s2)CCOC1	ZINC000193152395	402767604	/nfs/dbraw/zinc/76/76/04/402767604.db2.gz	GIBKRLDXQKUIAE-OAHLLOKOSA-N	0	3	308.403	2.282	10	0		DEAEHN
COc1cc(C[NH2+]CCCCO)cc(Br)c1[O-]	ZINC000193275841	402769027	/nfs/dbraw/zinc/76/90/27/402769027.db2.gz	HADUSBRKPHPPDZ-UHFFFAOYSA-N	0	3	304.184	2.025	10	0		DEAEHN
Cc1ccccc1[C@H](CN1CCOCC1)N[C@@H]1CCCOC1	ZINC000183563414	402776269	/nfs/dbraw/zinc/77/62/69/402776269.db2.gz	LTIOEUVJPIHBSC-AEFFLSMTSA-N	0	3	304.434	2.137	10	0		DEAEHN
OCC1CCN(Cc2cccc(NCc3cocn3)c2)CC1	ZINC000192324111	402723167	/nfs/dbraw/zinc/72/31/67/402723167.db2.gz	PBQMPCZDRYIRBD-UHFFFAOYSA-N	0	3	301.390	2.491	10	0		DEAEHN
C[C@@H](C(=O)N1CCC(Cn2cccn2)CC1)N1CCCCCC1	ZINC000174049436	402724858	/nfs/dbraw/zinc/72/48/58/402724858.db2.gz	JELIPGMAHVWMKV-INIZCTEOSA-N	0	3	318.465	2.386	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2cc(C(=O)OC)ccc2C)C1	ZINC000194320959	402792291	/nfs/dbraw/zinc/79/22/91/402792291.db2.gz	WNAXUUCEDNZRSN-AWEZNQCLSA-N	0	3	319.405	2.387	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc3c(c2)CCC(=O)N3)C1	ZINC000194333673	402792605	/nfs/dbraw/zinc/79/26/05/402792605.db2.gz	MVNZABKBCHQUIR-AWEZNQCLSA-N	0	3	316.405	2.177	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc(OCCOC)cc2)C1	ZINC000194335941	402792859	/nfs/dbraw/zinc/79/28/59/402792859.db2.gz	IUAGBTDDEMVEHJ-HNNXBMFYSA-N	0	3	321.421	2.318	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)/C=C/c1ccc(F)cc1	ZINC000175286518	402794331	/nfs/dbraw/zinc/79/43/31/402794331.db2.gz	DTFRMBFGODYURU-XCUOTZKBSA-N	0	3	324.421	2.295	10	0		DEAEHN
CC1CCC(N2CCN(C(=O)[C@H]3CCOC[C@H]3C)CC2)CC1	ZINC000194374757	402794756	/nfs/dbraw/zinc/79/47/56/402794756.db2.gz	FXDQHVKOZDJHNW-MYBQVCMBSA-N	0	3	308.466	2.382	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)CC(=O)N(C)Cc1ccccc1F	ZINC000175341276	402798501	/nfs/dbraw/zinc/79/85/01/402798501.db2.gz	WAFBJJFTZBMOLG-MRXNPFEDSA-N	0	3	321.440	2.200	10	0		DEAEHN
CCN(C(=O)CN(C)C[C@@H]1CCCN1CC)c1ccccc1	ZINC000175349750	402799142	/nfs/dbraw/zinc/79/91/42/402799142.db2.gz	WSEHVGUMVBDVPC-KRWDZBQOSA-N	0	3	303.450	2.456	10	0		DEAEHN
O[C@@H]1c2ccccc2C[C@@H]1N1CCCN(c2ccccn2)CC1	ZINC000183811384	402799743	/nfs/dbraw/zinc/79/97/43/402799743.db2.gz	QXMPTOBGJORKTR-PKOBYXMFSA-N	0	3	309.413	2.252	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)S(=O)(=O)Cc1ccccc1C	ZINC000175395841	402803261	/nfs/dbraw/zinc/80/32/61/402803261.db2.gz	LUFWBQTWRUNPJJ-MRXNPFEDSA-N	0	3	310.463	2.241	10	0		DEAEHN
c1cc(-c2nc(CN3CCCN(C4CC4)CC3)no2)cs1	ZINC000195338049	402842839	/nfs/dbraw/zinc/84/28/39/402842839.db2.gz	XTFSYXVFOAAACG-UHFFFAOYSA-N	0	3	304.419	2.468	10	0		DEAEHN
C[C@H](CC1CCCCC1)NC(=O)N1CCO[C@H](CN(C)C)C1	ZINC000194621907	402806046	/nfs/dbraw/zinc/80/60/46/402806046.db2.gz	YFCABZAZVONBMY-GDBMZVCRSA-N	0	3	311.470	2.317	10	0		DEAEHN
O=C(c1cnc(-c2ccccc2)nc1)N1CCN2CCC[C@@H]2C1	ZINC000195338051	402842892	/nfs/dbraw/zinc/84/28/92/402842892.db2.gz	GSKCEQVWPAHKJE-MRXNPFEDSA-N	0	3	308.385	2.064	10	0		DEAEHN
CN1CCC[C@@H]1CNC(=O)c1ccn(-c2cccc(Cl)c2)n1	ZINC000194690794	402810394	/nfs/dbraw/zinc/81/03/94/402810394.db2.gz	ZNHILWZZHPTKAR-CQSZACIVSA-N	0	3	318.808	2.350	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)Cc1ccc(C)c(F)c1	ZINC000184043086	402813427	/nfs/dbraw/zinc/81/34/27/402813427.db2.gz	DCBJGOIVQQTNOH-CYBMUJFWSA-N	0	3	316.442	2.284	10	0		DEAEHN
Cc1ccccc1OCCN1C[C@@H](C)[C@H](N2CCOCC2)C1	ZINC000175587045	402819479	/nfs/dbraw/zinc/81/94/79/402819479.db2.gz	HPBUVYSSYQHUKU-IAGOWNOFSA-N	0	3	304.434	2.026	10	0		DEAEHN
Cc1cccc(C)c1OCCN1C[C@@H](C)[C@H](N2CCOCC2)C1	ZINC000175589943	402820238	/nfs/dbraw/zinc/82/02/38/402820238.db2.gz	KSZVYKQGEMDTEO-QZTJIDSGSA-N	0	3	318.461	2.335	10	0		DEAEHN
CC[C@H](CNC(=O)NC[C@@H]1CCCN1C)Oc1cccc(F)c1	ZINC000175598046	402820683	/nfs/dbraw/zinc/82/06/83/402820683.db2.gz	UBZRSDWFUNLHLY-LSDHHAIUSA-N	0	3	323.412	2.377	10	0		DEAEHN
CN(C)CCOc1ccccc1C(=O)NC1CCSCC1	ZINC000194902120	402821828	/nfs/dbraw/zinc/82/18/28/402821828.db2.gz	AKROAOQRHPSZRX-UHFFFAOYSA-N	0	3	308.447	2.252	10	0		DEAEHN
COC[C@@H](NC(=O)N1CCCN(C2CC2)CC1)c1ccc(C)o1	ZINC000175659187	402823908	/nfs/dbraw/zinc/82/39/08/402823908.db2.gz	HBCDMIHIWGZPFK-OAHLLOKOSA-N	0	3	321.421	2.155	10	0		DEAEHN
COc1cc(CN[C@@H]2CCc3nc(C(C)C)nn3C2)ccc1O	ZINC000194977498	402825116	/nfs/dbraw/zinc/82/51/16/402825116.db2.gz	PMACAMRFDGCBQN-CYBMUJFWSA-N	0	3	316.405	2.220	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)NCCc2ccc(F)cc2C)C1	ZINC000175944760	402844038	/nfs/dbraw/zinc/84/40/38/402844038.db2.gz	VQFXQJKPESXEFH-INIZCTEOSA-N	0	3	307.413	2.460	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)N2CCN3CCCC[C@H]3C2)c1	ZINC000195222460	402837721	/nfs/dbraw/zinc/83/77/21/402837721.db2.gz	BVQGOTBTTWJRLD-KRWDZBQOSA-N	0	3	316.449	2.450	10	0		DEAEHN
COC[C@](C)(CCO)NCc1ccc(OCC(F)F)cc1	ZINC000175851544	402838146	/nfs/dbraw/zinc/83/81/46/402838146.db2.gz	LRVGGVQTJXHEJD-HNNXBMFYSA-N	0	3	303.349	2.208	10	0		DEAEHN
COC[C@@](C)(CCO)NCc1ccc(OC)c(OC(F)F)c1	ZINC000175855649	402838505	/nfs/dbraw/zinc/83/85/05/402838505.db2.gz	NXPBYAMZYSZRCM-OAHLLOKOSA-N	0	3	319.348	2.174	10	0		DEAEHN
C[C@@H](NC[C@@H]1CN(C)CCO1)c1cc(Br)cs1	ZINC000194091870	402783778	/nfs/dbraw/zinc/78/37/78/402783778.db2.gz	LPPYRBFTWYWLNW-MWLCHTKSSA-N	0	3	319.268	2.492	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@@H](c2ccccc2)N(C)C)C1	ZINC000194128969	402785093	/nfs/dbraw/zinc/78/50/93/402785093.db2.gz	YVMNIDIUDCOISR-SJORKVTESA-N	0	3	318.465	2.073	10	0		DEAEHN
CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc([O-])c(F)c1	ZINC000175190494	402786571	/nfs/dbraw/zinc/78/65/71/402786571.db2.gz	ZFLRWQZYWCGJGV-ZIAGYGMSSA-N	0	3	321.396	2.300	10	0		DEAEHN
CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc([O-])c(F)c1	ZINC000175190494	402786573	/nfs/dbraw/zinc/78/65/73/402786573.db2.gz	ZFLRWQZYWCGJGV-ZIAGYGMSSA-N	0	3	321.396	2.300	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCC(OCC(C)C)CC2)C1	ZINC000194169683	402787130	/nfs/dbraw/zinc/78/71/30/402787130.db2.gz	DMTDDNPSTRSPFN-HNNXBMFYSA-N	0	3	311.470	2.317	10	0		DEAEHN
Cc1cn(-c2ccccc2)nc1C(=O)N1CCN2CCC[C@H]2C1	ZINC000184471952	402846102	/nfs/dbraw/zinc/84/61/02/402846102.db2.gz	ICJRFRODSKUZMW-INIZCTEOSA-N	0	3	310.401	2.101	10	0		DEAEHN
Cc1ccc(NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1C(N)=O	ZINC000175992069	402846241	/nfs/dbraw/zinc/84/62/41/402846241.db2.gz	RBUDKKAWKAWIBL-OCCSQVGLSA-N	0	3	318.421	2.040	10	0		DEAEHN
O=C(CN1CCC(c2ccn[nH]2)CC1)NCC1CCCCC1	ZINC000195506784	402848248	/nfs/dbraw/zinc/84/82/48/402848248.db2.gz	JJXNNCHODCSTPO-UHFFFAOYSA-N	0	3	304.438	2.286	10	0		DEAEHN
Cc1csc(=O)n1CCN1CC[C@@H](CNc2ccccn2)C1	ZINC000195515792	402848670	/nfs/dbraw/zinc/84/86/70/402848670.db2.gz	JPLULOCTDSJHJT-AWEZNQCLSA-N	0	3	318.446	2.047	10	0		DEAEHN
CSCCC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000176038598	402849702	/nfs/dbraw/zinc/84/97/02/402849702.db2.gz	CGQZBCLETRGEHJ-UHFFFAOYSA-N	0	3	322.474	2.013	10	0		DEAEHN
CCN(CC)C(=O)[C@H](C)N1CC[C@H](CNc2cccc(C)n2)C1	ZINC000195516264	402849883	/nfs/dbraw/zinc/84/98/83/402849883.db2.gz	HXCOHXJBWUNSLI-JKSUJKDBSA-N	0	3	318.465	2.381	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)c1csc(NC2CC2)n1	ZINC000265829639	402954507	/nfs/dbraw/zinc/95/45/07/402954507.db2.gz	PVWCFZPSBJMVMT-LLVKDONJSA-N	0	3	308.451	2.322	10	0		DEAEHN
Cc1ccc2ncnc(N3CCN(C[C@H]4CCOC4)CC3)c2c1	ZINC000267435987	403039246	/nfs/dbraw/zinc/03/92/46/403039246.db2.gz	XVJVYMQVLKFYNH-OAHLLOKOSA-N	0	3	312.417	2.097	10	0		DEAEHN
CN(Cc1nccs1)[C@H]1CC12CCN(Cc1cc[nH]n1)CC2	ZINC000275556375	403105484	/nfs/dbraw/zinc/10/54/84/403105484.db2.gz	GGISCCCSONLXIC-AWEZNQCLSA-N	0	3	317.462	2.353	10	0		DEAEHN
CN(Cc1ccccn1)[C@H]1CCCN(Cc2cncn2C)CC1	ZINC000275837227	403127608	/nfs/dbraw/zinc/12/76/08/403127608.db2.gz	VTBRIQTULAHFSI-KRWDZBQOSA-N	0	3	313.449	2.302	10	0		DEAEHN
COc1cccc2c1ncc(C)c2N1CCO[C@H](CN(C)C)C1	ZINC000276212476	403154054	/nfs/dbraw/zinc/15/40/54/403154054.db2.gz	KGVGVWBJEDDKRX-CQSZACIVSA-N	0	3	315.417	2.319	10	0		DEAEHN
c1c(CNCCCN2CCc3ccccc3C2)nc2ncccn12	ZINC000298220345	403334104	/nfs/dbraw/zinc/33/41/04/403334104.db2.gz	AJNDDZYAKFYIJP-UHFFFAOYSA-N	0	3	321.428	2.267	10	0		DEAEHN
Cc1cccc2c(NCC(C)(C)NS(C)(=O)=O)ccnc12	ZINC000301685044	403664884	/nfs/dbraw/zinc/66/48/84/403664884.db2.gz	UGCPZFWJOOUAAZ-UHFFFAOYSA-N	0	3	307.419	2.283	10	0		DEAEHN
C[C@H](NCCCS(=O)(=O)N(C)C)c1cccc(Cl)c1	ZINC000341073477	403762028	/nfs/dbraw/zinc/76/20/28/403762028.db2.gz	VHYBEIDOGAEVFS-NSHDSACASA-N	0	3	304.843	2.272	10	0		DEAEHN
c1cc(CCCN2CCO[C@]3(CCCOC3)C2)cc2c1OCC2	ZINC000289340695	403916907	/nfs/dbraw/zinc/91/69/07/403916907.db2.gz	HVFJUAJNGZXSKU-LJQANCHMSA-N	0	3	317.429	2.436	10	0		DEAEHN
Cn1ccc(N2CC[C@@H](NCc3cc4ccccc4[nH]c3=O)C2)n1	ZINC000363182844	404106945	/nfs/dbraw/zinc/10/69/45/404106945.db2.gz	HWQFHPXDICCVTR-OAHLLOKOSA-N	0	3	323.400	2.042	10	0		DEAEHN
O=C1NCC[C@@H]1N1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1	ZINC000329129791	404240104	/nfs/dbraw/zinc/24/01/04/404240104.db2.gz	NYQJXPWVKYBNOV-IIYDPXPESA-N	0	3	316.405	2.104	10	0		DEAEHN
CC1(C)CN(Cc2ccc(CO)cc2)C[C@@]2(CCCOC2)O1	ZINC000370041267	404314294	/nfs/dbraw/zinc/31/42/94/404314294.db2.gz	PNSVVRHNVWKSIR-GOSISDBHSA-N	0	3	305.418	2.339	10	0		DEAEHN
CO[C@@H]1COC[C@H]1n1cc(CN[C@H]2CCC(C)(C)C[C@H]2C)nn1	ZINC000329545251	404371631	/nfs/dbraw/zinc/37/16/31/404371631.db2.gz	ZHAUQEALZOAGBA-SLBVQIDZSA-N	0	3	322.453	2.169	10	0		DEAEHN
CC(=O)N1CCCN(Cc2ccccc2-c2ccnn2C)CC1	ZINC000350438609	404386801	/nfs/dbraw/zinc/38/68/01/404386801.db2.gz	KDGUJDUVULWEGC-UHFFFAOYSA-N	0	3	312.417	2.141	10	0		DEAEHN
Cc1noc([C@@H]2CCN(Cc3cn(C)nc3-c3cccnc3)C2)n1	ZINC000344850577	404405389	/nfs/dbraw/zinc/40/53/89/404405389.db2.gz	GFOYEHAGUZUNRF-CQSZACIVSA-N	0	3	324.388	2.163	10	0		DEAEHN
COCc1ccc(CNC(=O)CN2CCCC23CCC3)cc1	ZINC000373107062	404528817	/nfs/dbraw/zinc/52/88/17/404528817.db2.gz	PCOUHSBZBNDMDU-UHFFFAOYSA-N	0	3	302.418	2.468	10	0		DEAEHN
c1nnn(Cc2ccccc2)c1CN[C@@H]1CCC[C@H]2OCC[C@H]21	ZINC000291895450	404569908	/nfs/dbraw/zinc/56/99/08/404569908.db2.gz	IKQIDISSUOPOGG-RCCFBDPRSA-N	0	3	312.417	2.374	10	0		DEAEHN
CC(=O)CCN1CCC(n2cc(Br)cn2)CC1	ZINC000374011036	404669806	/nfs/dbraw/zinc/66/98/06/404669806.db2.gz	TYRNVKWCEJBOKU-UHFFFAOYSA-N	0	3	300.200	2.262	10	0		DEAEHN
COc1ccc2c(c1)[C@H](N)CCN2C(=O)Cc1c(C)noc1C	ZINC000365478472	404670820	/nfs/dbraw/zinc/67/08/20/404670820.db2.gz	ALSSACOHXHZFIB-OAHLLOKOSA-N	0	3	315.373	2.279	10	0		DEAEHN
Cc1ccsc1[C@@H](C)N[C@@H]1CCN(C2CCOCC2)C1=O	ZINC000358208580	404756497	/nfs/dbraw/zinc/75/64/97/404756497.db2.gz	WGFXKXSBFIMFMU-TZMCWYRMSA-N	0	3	308.447	2.487	10	0		DEAEHN
C[C@@](O)(C(=O)N1CCc2c1cccc2CN1CCCC1)C1CC1	ZINC000376170368	404813202	/nfs/dbraw/zinc/81/32/02/404813202.db2.gz	CHJYRIZLECGXQE-IBGZPJMESA-N	0	3	314.429	2.333	10	0		DEAEHN
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)c1ncccc1N	ZINC000382721644	405031853	/nfs/dbraw/zinc/03/18/53/405031853.db2.gz	NIJTWJZBGSZTLX-INIZCTEOSA-N	0	3	324.428	2.258	10	0		DEAEHN
CC1CCC(O)(CN2CCOC[C@@H]2[C@@H]2CCCC[C@@H]2O)CC1	ZINC000408040852	405096666	/nfs/dbraw/zinc/09/66/66/405096666.db2.gz	AFTIDHSPQYCUNW-RGUZKJPTSA-N	0	3	311.466	2.180	10	0		DEAEHN
Brc1cnn(CCN[C@@H]2CCCc3n[nH]cc32)c1	ZINC000367705937	405131130	/nfs/dbraw/zinc/13/11/30/405131130.db2.gz	IIUVSTGDIFBIMQ-LLVKDONJSA-N	0	3	310.199	2.036	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CCC[C@H](Cc2nccn2C)C1	ZINC000361543069	405123221	/nfs/dbraw/zinc/12/32/21/405123221.db2.gz	KBECMPNFRHWDCT-CVEARBPZSA-N	0	3	318.465	2.076	10	0		DEAEHN
CC(C)N1CC[C@H](NC2CC(OCc3ccccc3)C2)C1=O	ZINC000361545972	405125424	/nfs/dbraw/zinc/12/54/24/405125424.db2.gz	PVVIOROOPMLDFY-JCYILVPMSA-N	0	3	302.418	2.333	10	0		DEAEHN
C/C=C/C[C@H](NC(=O)c1cccc(CN(C)C)c1)C(=O)OCC	ZINC000361570821	405136966	/nfs/dbraw/zinc/13/69/66/405136966.db2.gz	YNBRFAPSFDTTSF-YERXGYGTSA-N	0	3	318.417	2.376	10	0		DEAEHN
C[NH+](C)C[C@H]1CCN(C(=O)c2ccc3c(c2[O-])OC(C)(C)C3)C1	ZINC000408405273	405197439	/nfs/dbraw/zinc/19/74/39/405197439.db2.gz	CIRPBMBJIFLYIA-GFCCVEGCSA-N	0	3	318.417	2.129	10	0		DEAEHN
O=C(NCCNc1ccncc1)[C@@H]1C[C@@H]1c1cc(F)ccc1F	ZINC000439042171	405263689	/nfs/dbraw/zinc/26/36/89/405263689.db2.gz	JUAHLCKECSCABA-UKRRQHHQSA-N	0	3	317.339	2.114	10	0		DEAEHN
C[C@H](C(=O)NCCNc1ccncc1)c1cccc(Cl)c1	ZINC000439040997	405263849	/nfs/dbraw/zinc/26/38/49/405263849.db2.gz	PCXXEKAPACPHLD-LBPRGKRZSA-N	0	3	303.793	2.489	10	0		DEAEHN
COC[C@@H](NCc1nc2cc(C)ccc2[nH]1)C1CCOCC1	ZINC000446825190	405393918	/nfs/dbraw/zinc/39/39/18/405393918.db2.gz	BBHNJLSUZKUKKE-MRXNPFEDSA-N	0	3	303.406	2.403	10	0		DEAEHN
COC[C@@H](NCc1nc2ccc(C)cc2[nH]1)C1CCOCC1	ZINC000446825190	405393921	/nfs/dbraw/zinc/39/39/21/405393921.db2.gz	BBHNJLSUZKUKKE-MRXNPFEDSA-N	0	3	303.406	2.403	10	0		DEAEHN
COc1cc(C)cc(NC(=O)N2C[C@@H]3CCN(C)[C@@H]3C2)c1C	ZINC000455294703	405394804	/nfs/dbraw/zinc/39/48/04/405394804.db2.gz	PBTSUCUALVPANG-DZGCQCFKSA-N	0	3	303.406	2.480	10	0		DEAEHN
C[C@@H](CNC(=O)N1C[C@@H](c2ccccc2)O[C@@H](C)C1)N(C)C	ZINC000455430150	405408802	/nfs/dbraw/zinc/40/88/02/405408802.db2.gz	JLGWKBDMLDMQCA-DZKIICNBSA-N	0	3	305.422	2.108	10	0		DEAEHN
CCOC(=O)[C@H]1CN(C/C=C/c2ccc(F)cc2)CC12COC2	ZINC000449366716	405526978	/nfs/dbraw/zinc/52/69/78/405526978.db2.gz	SEEXJJZYJOKNCG-QDLOVBKTSA-N	0	3	319.376	2.350	10	0		DEAEHN
O=C1[C@@H](N[C@@H]2CCC23CCOCC3)CCN1c1ccccc1	ZINC000558622328	405676160	/nfs/dbraw/zinc/67/61/60/405676160.db2.gz	XJBHCQJUNHVIOI-JKSUJKDBSA-N	0	3	300.402	2.341	10	0		DEAEHN
CC(=O)N(C)c1cccc(NC(=O)[C@H]2NCCCC2(C)C)c1	ZINC000423211383	405724271	/nfs/dbraw/zinc/72/42/71/405724271.db2.gz	HBWKRNNJJOAKKM-OAHLLOKOSA-N	0	3	303.406	2.386	10	0		DEAEHN
COc1nsc(CNC[C@H]2CC[C@H](O)C2)c1Br	ZINC000639096114	405879217	/nfs/dbraw/zinc/87/92/17/405879217.db2.gz	AOIYTGAAEPEHAB-YUMQZZPRSA-N	0	3	321.240	2.165	10	0		DEAEHN
CN(Cc1ccccc1)[C@H](CNC(=O)c1ncccc1N)C1CC1	ZINC000632555578	406180488	/nfs/dbraw/zinc/18/04/88/406180488.db2.gz	LJGMAPZNHZAUBW-QGZVFWFLSA-N	0	3	324.428	2.304	10	0		DEAEHN
Cc1cc(C[C@H](C)NC(=O)NC[C@H](C)N2CCCC[C@H]2C)[nH]n1	ZINC000487549252	406244923	/nfs/dbraw/zinc/24/49/23/406244923.db2.gz	HJAXNIBVERYZHM-CFVMTHIKSA-N	0	3	321.469	2.211	10	0		DEAEHN
c1c(CN2CCC[C@@H]2C2CCCC2)nnn1C[C@@H]1CCOC1	ZINC000637966291	406500208	/nfs/dbraw/zinc/50/02/08/406500208.db2.gz	XDWKADJCVXUOIR-WMLDXEAASA-N	0	3	304.438	2.469	10	0		DEAEHN
CC(=O)N1CC[C@@H](N[C@@H]2CCC(=O)NC2(C)C)c2ccccc21	ZINC000571261063	406497132	/nfs/dbraw/zinc/49/71/32/406497132.db2.gz	SQKNCFRALDRFJE-GDBMZVCRSA-N	0	3	315.417	2.131	10	0		DEAEHN
COc1ccccc1NC(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000637869023	406455558	/nfs/dbraw/zinc/45/55/58/406455558.db2.gz	KNHSWHZIQSCHHW-OAHLLOKOSA-N	0	3	313.401	2.093	10	0		DEAEHN
C[C@@H](NC(=O)NC1(CCO)CCCCC1)C1=CCN(C)CC1	ZINC000571302120	406505109	/nfs/dbraw/zinc/50/51/09/406505109.db2.gz	LEESFHXNCTXUHM-CQSZACIVSA-N	0	3	309.454	2.021	10	0		DEAEHN
C[C@H](NC(=O)[C@@H](N)CN(C)Cc1ccccc1)C1CCCC1	ZINC000637990002	406512728	/nfs/dbraw/zinc/51/27/28/406512728.db2.gz	CPMCTOWDFFOGTR-YOEHRIQHSA-N	0	3	303.450	2.141	10	0		DEAEHN
CC(C)(N)c1cn(Cc2ccc(Br)c(F)c2)nn1	ZINC000641138148	406655445	/nfs/dbraw/zinc/65/54/45/406655445.db2.gz	GHQXJEIVKSKBDC-UHFFFAOYSA-N	0	3	313.174	2.422	10	0		DEAEHN
CCN1CCN(C(=O)[C@@H]2CCc3nc(C(C)C)[nH]c3C2)[C@H](C)C1	ZINC000553329399	406750689	/nfs/dbraw/zinc/75/06/89/406750689.db2.gz	HERAPKWRKANTGY-ZIAGYGMSSA-N	0	3	318.465	2.191	10	0		DEAEHN
CCN1CCN(C(=O)[C@@H]2CCc3[nH]c(C(C)C)nc3C2)[C@H](C)C1	ZINC000553329399	406750693	/nfs/dbraw/zinc/75/06/93/406750693.db2.gz	HERAPKWRKANTGY-ZIAGYGMSSA-N	0	3	318.465	2.191	10	0		DEAEHN
COCCOc1ccccc1C(=O)N[C@H](CC(C)C)CN(C)C	ZINC000128960666	196007249	/nfs/dbraw/zinc/00/72/49/196007249.db2.gz	FLQUGAKMKZTCNE-OAHLLOKOSA-N	0	3	322.449	2.418	10	0		DEAEHN
COc1cc2c(cc1CNCC[C@H](C)[S@](C)=O)O[C@H](C)C2	ZINC000129395920	196044799	/nfs/dbraw/zinc/04/47/99/196044799.db2.gz	JEBUFYQRDAUQBC-SMDDFHAHSA-N	0	3	311.447	2.265	10	0		DEAEHN
Cc1cccc(NC(=O)C(=O)NC[C@H]2CCCN2CC(C)C)c1	ZINC000129406175	196045758	/nfs/dbraw/zinc/04/57/58/196045758.db2.gz	QMHLXKWPMZPVBQ-MRXNPFEDSA-N	0	3	317.433	2.170	10	0		DEAEHN
CS[C@@H](C)CCNCC(=O)Nc1ccc2c(c1)OCCO2	ZINC000130613409	196095885	/nfs/dbraw/zinc/09/58/85/196095885.db2.gz	PSUHGEWNKQILBQ-NSHDSACASA-N	0	3	310.419	2.128	10	0		DEAEHN
C[C@@H]1CC[C@@H](C(=O)NCC2(N3CCSCC3)CCCC2)O1	ZINC000130943245	196125527	/nfs/dbraw/zinc/12/55/27/196125527.db2.gz	URGQCBHRLCDEAF-KGLIPLIRSA-N	0	3	312.479	2.032	10	0		DEAEHN
CCN[C@H](C)c1c(CC)nn(CCCS(C)(=O)=O)c1CC	ZINC000131115194	196141514	/nfs/dbraw/zinc/14/15/14/196141514.db2.gz	IBTYCTBYBSELGS-GFCCVEGCSA-N	0	3	315.483	2.113	10	0		DEAEHN
CC(C)(C)[C@@H]1CCN(S(=O)(=O)c2cc(CN)ccc2F)C1	ZINC000131362701	196161619	/nfs/dbraw/zinc/16/16/19/196161619.db2.gz	FNIPZHRQLQPEGP-GFCCVEGCSA-N	0	3	314.426	2.341	10	0		DEAEHN
CCOC(=O)[C@H](NCCN(C)C)c1ccc(C(F)F)cc1	ZINC000131507232	196175400	/nfs/dbraw/zinc/17/54/00/196175400.db2.gz	BXJVDSNBLUYMDJ-CYBMUJFWSA-N	0	3	300.349	2.380	10	0		DEAEHN
COCC[C@H](N)C(=O)Nc1cc(Cl)ccc1Br	ZINC000131642537	196187251	/nfs/dbraw/zinc/18/72/51/196187251.db2.gz	NKXZJHPDXJHWFU-VIFPVBQESA-N	0	3	321.602	2.405	10	0		DEAEHN
CC(C)NCc1cc(S(=O)(=O)N2CC[C@H](C)[C@@H](C)C2)c[nH]1	ZINC000131733846	196195557	/nfs/dbraw/zinc/19/55/57/196195557.db2.gz	IUSSPXXHIXZSOP-STQMWFEESA-N	0	3	313.467	2.179	10	0		DEAEHN
NC1(C(=O)Nc2cc(Cl)cc3cccnc32)CCOCC1	ZINC000132082890	196225258	/nfs/dbraw/zinc/22/52/58/196225258.db2.gz	NVLWMYGGRFVBOA-UHFFFAOYSA-N	0	3	305.765	2.335	10	0		DEAEHN
NC1(C(=O)Nc2ccc(Cl)c3cccnc23)CCOCC1	ZINC000132144878	196229188	/nfs/dbraw/zinc/22/91/88/196229188.db2.gz	HWOQMVBVSYWCQE-UHFFFAOYSA-N	0	3	305.765	2.335	10	0		DEAEHN
C[C@H](CNC(=O)c1sc2cccnc2c1N)N1CCCC1	ZINC000132332486	196246669	/nfs/dbraw/zinc/24/66/69/196246669.db2.gz	VDZUVJWFWLZTQH-SNVBAGLBSA-N	0	3	304.419	2.093	10	0		DEAEHN
CC(C)[C@@H](CN(C)C)NC(=O)c1sc2cccnc2c1N	ZINC000132216237	196235876	/nfs/dbraw/zinc/23/58/76/196235876.db2.gz	XLTQGLWWCIATDD-SNVBAGLBSA-N	0	3	306.435	2.195	10	0		DEAEHN
C[C@H](CO)N(C)C[C@H](O)COc1c(Cl)cccc1Cl	ZINC000132241399	196237928	/nfs/dbraw/zinc/23/79/28/196237928.db2.gz	PPPOZEVNNTZJCG-ZJUUUORDSA-N	0	3	308.205	2.046	10	0		DEAEHN
CCC[C@H](C(=O)NCCCc1cc(OC)ccc1OC)N(C)C	ZINC000132482724	196258754	/nfs/dbraw/zinc/25/87/54/196258754.db2.gz	HTOLHJXLCJRIHR-MRXNPFEDSA-N	0	3	322.449	2.483	10	0		DEAEHN
C[C@@H]1CCC[C@]1(O)c1c(Br)cnn1CCN(C)C	ZINC000132488984	196260073	/nfs/dbraw/zinc/26/00/73/196260073.db2.gz	ZRHFBGNGEQDWPZ-ZWNOBZJWSA-N	0	3	316.243	2.215	10	0		DEAEHN
CNc1nc(N(C)C)nc(N2CCc3sccc3[C@@H]2C)n1	ZINC000132567430	196265933	/nfs/dbraw/zinc/26/59/33/196265933.db2.gz	SWSWOCOHNWRDGK-VIFPVBQESA-N	0	3	304.423	2.165	10	0		DEAEHN
N[C@H]1COC[C@H]1c1nc(-c2ccc(Cl)c(Cl)c2)no1	ZINC000133030084	196305814	/nfs/dbraw/zinc/30/58/14/196305814.db2.gz	RUZUPNXYCANEDH-XCBNKYQSSA-N	0	3	300.145	2.485	10	0		DEAEHN
COC(=O)Cc1csc(NC2C[C@H]3CCC[C@@H](C2)N3C)n1	ZINC000133993910	196351873	/nfs/dbraw/zinc/35/18/73/196351873.db2.gz	HLXYKTMRIOEZLM-VGPLMAKISA-N	0	3	309.435	2.286	10	0		DEAEHN
CC[C@@H](CSC)Nc1nc(NC)nc(N2CCCCC2)n1	ZINC000134268108	196374987	/nfs/dbraw/zinc/37/49/87/196374987.db2.gz	SGRMTDPHFUHTTM-NSHDSACASA-N	0	3	310.471	2.457	10	0		DEAEHN
COCC(C)(C)NC[C@H](O)c1cccc(Br)c1	ZINC000134309838	196378206	/nfs/dbraw/zinc/37/82/06/196378206.db2.gz	ABEVULGOYFKQBK-LBPRGKRZSA-N	0	3	302.212	2.497	10	0		DEAEHN
O=C(CCN[C@H]1CCSc2ccccc21)N1CCOCC1	ZINC000135133433	196447240	/nfs/dbraw/zinc/44/72/40/196447240.db2.gz	JJCVBWBDWHHWIS-AWEZNQCLSA-N	0	3	306.431	2.062	10	0		DEAEHN
NC[C@H](c1ccc(Cl)c(Br)c1)N1CCOCC1	ZINC000137142761	196566320	/nfs/dbraw/zinc/56/63/20/196566320.db2.gz	IKWPOSADDMGMMH-GFCCVEGCSA-N	0	3	319.630	2.435	10	0		DEAEHN
c1ccc(OC2CCC2)c(CN[C@@H](C2CC2)[C@@H]2CNCCO2)c1	ZINC000422915783	230274892	/nfs/dbraw/zinc/27/48/92/230274892.db2.gz	YZNPRTDMNJKRAX-OALUTQOASA-N	0	3	316.445	2.475	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCCC[C@H](c2c[nH]nc2N)C1	ZINC000616601901	422515767	/nfs/dbraw/zinc/51/57/67/422515767.db2.gz	LTQSCPNHHFAUSY-LBPRGKRZSA-N	0	3	323.441	2.086	10	0		DEAEHN
CC(C)(C)OC(=O)NCCN1CCC[C@@H](Nc2cc[nH]n2)CC1	ZINC000616600755	422517190	/nfs/dbraw/zinc/51/71/90/422517190.db2.gz	HSDKGAXWRYREBU-CYBMUJFWSA-N	0	3	323.441	2.201	10	0		DEAEHN
Cc1nnc(NC[C@H]2CCCN(C)[C@@H]2c2cccs2)nc1C	ZINC000359574189	424830630	/nfs/dbraw/zinc/83/06/30/424830630.db2.gz	HHUULAZFYUSIDE-HIFRSBDPSA-N	0	3	317.462	3.045	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)C(=O)NCCC2CCCC2)c1	ZINC000041827993	424809187	/nfs/dbraw/zinc/80/91/87/424809187.db2.gz	FQQBQPCIFBNUSG-UHFFFAOYSA-N	0	3	317.433	2.383	10	0		DEAEHN
c1ncn(C[C@@H]2CCCN(Cc3cnn(-c4ccccc4)c3)C2)n1	ZINC000105883780	424849503	/nfs/dbraw/zinc/84/95/03/424849503.db2.gz	OKPHOSVWLXIWOG-MRXNPFEDSA-N	0	3	322.416	2.376	10	0		DEAEHN
CCc1ccc([C@H](C)NC[C@H](O)COC[C@@H]2CCCO2)cc1	ZINC000121493795	424853590	/nfs/dbraw/zinc/85/35/90/424853590.db2.gz	NWQCUBJYSTZQGE-WBAXXEDZSA-N	0	3	307.434	2.456	10	0		DEAEHN
CCOCCCCNC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000194363956	424876081	/nfs/dbraw/zinc/87/60/81/424876081.db2.gz	IZCXXRJQBMKWMU-INIZCTEOSA-N	0	3	307.438	2.405	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)COc2ccc(F)cc2Cl)C1	ZINC000194635371	424877395	/nfs/dbraw/zinc/87/73/95/424877395.db2.gz	LOYVJLONCQQKBH-GFCCVEGCSA-N	0	3	314.788	2.458	10	0		DEAEHN
CCc1ccc([C@H](C)N[C@H](C)C(=O)N2CCN(CC)CC2)cc1	ZINC000192662021	424864692	/nfs/dbraw/zinc/86/46/92/424864692.db2.gz	DHFOZTCVDDHQHJ-JKSUJKDBSA-N	0	3	317.477	2.452	10	0		DEAEHN
CC[C@@H]1COC(C)(C)CN1C[C@H](O)COCc1ccccc1	ZINC000403898837	424925616	/nfs/dbraw/zinc/92/56/16/424925616.db2.gz	YZDUCJXPXAINAW-SJORKVTESA-N	0	3	307.434	2.454	10	0		DEAEHN
COC[C@@H](C)n1ccc(NC(=O)NCCN2CCCC[C@@H]2C)n1	ZINC000249576204	424887516	/nfs/dbraw/zinc/88/75/16/424887516.db2.gz	POWMZZGQLCBKTH-UONOGXRCSA-N	0	3	323.441	2.086	10	0		DEAEHN
C[C@H](CNC(=O)[C@@H]1CCOC[C@H]1C)N(C)Cc1ccccc1	ZINC000194334916	267782001	/nfs/dbraw/zinc/78/20/01/267782001.db2.gz	NNNQZNNCKYBYAK-BFYDXBDKSA-N	0	3	304.434	2.296	10	0		DEAEHN
C[C@H]1CCN[C@H](C(=O)NCCCCOCc2ccccc2)C1	ZINC000390703817	269097810	/nfs/dbraw/zinc/09/78/10/269097810.db2.gz	AUQYBAKASZAXLN-RDJZCZTQSA-N	0	3	304.434	2.488	10	0		DEAEHN
C[C@@H](COCc1ccccc1)NC(=O)[C@H]1NCCCC1(C)C	ZINC000390759547	269098163	/nfs/dbraw/zinc/09/81/63/269098163.db2.gz	YRKHMNXDWYXKEC-GOEBONIOSA-N	0	3	304.434	2.486	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CCN(CCCC(=O)N(C)C)CC2	ZINC000514946882	269338377	/nfs/dbraw/zinc/33/83/77/269338377.db2.gz	KDPTVFUKIGTWPI-UHFFFAOYSA-N	0	3	302.418	2.158	10	0		DEAEHN
O=C(NCCOCC1CCC1)NC[C@H]1CCCCN1C1CC1	ZINC000515345556	269350228	/nfs/dbraw/zinc/35/02/28/269350228.db2.gz	XMVCGWPRWYENAU-MRXNPFEDSA-N	0	3	309.454	2.119	10	0		DEAEHN
CC(C)c1nc2n(n1)C[C@@H](N[C@@H]1CCCc3c1cnn3C)CC2	ZINC000180635379	275762824	/nfs/dbraw/zinc/76/28/24/275762824.db2.gz	KTYQICBHBZLPKZ-GXTWGEPZSA-N	0	3	314.437	2.117	10	0		DEAEHN
CCC[C@@H](C(=O)NC[C@H](C)N1CCc2sccc2C1)N(C)C	ZINC000135635658	276021081	/nfs/dbraw/zinc/02/10/81/276021081.db2.gz	RQFIIIDGELAAAR-ZFWWWQNUSA-N	0	3	323.506	2.341	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)Cc1c(F)cccc1F	ZINC000122790934	276112753	/nfs/dbraw/zinc/11/27/53/276112753.db2.gz	MYOCVHCSEKBTPI-NSHDSACASA-N	0	3	320.405	2.115	10	0		DEAEHN
CCN(Cc1ccccc1)C(=O)CN1CCC[C@H]1C[C@H](C)O	ZINC000305212498	276141808	/nfs/dbraw/zinc/14/18/08/276141808.db2.gz	GLPNAVOSOWUSCO-RDJZCZTQSA-N	0	3	304.434	2.270	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)[C@@H]1CCCN1c1nccs1	ZINC000176999892	276169154	/nfs/dbraw/zinc/16/91/54/276169154.db2.gz	STAWWXHTBBOPBP-KGLIPLIRSA-N	0	3	322.478	2.055	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)N[C@H]2CCCOc3c(F)cccc32)C1	ZINC000183827672	276782461	/nfs/dbraw/zinc/78/24/61/276782461.db2.gz	MUWKKVZORDGMQN-DOMZBBRYSA-N	0	3	321.396	2.385	10	0		DEAEHN
COc1cccc2c(N3C[C@H]4OCCN(C)[C@H]4C3)cc(C)nc12	ZINC000130259889	278025531	/nfs/dbraw/zinc/02/55/31/278025531.db2.gz	FQZVJYRGVPTLFD-DOTOQJQBSA-N	0	3	313.401	2.071	10	0		DEAEHN
C[C@H](CN1CCCCC1)NC(=O)N1CC[C@@H]2OCCC[C@@H]2C1	ZINC000151269465	279301297	/nfs/dbraw/zinc/30/12/97/279301297.db2.gz	NSDSHQXQJSRTBK-OAGGEKHMSA-N	0	3	309.454	2.071	10	0		DEAEHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)c1cnn2c1CCCC2	ZINC000127214768	279309463	/nfs/dbraw/zinc/30/94/63/279309463.db2.gz	WDFWUQYXGCIREB-ZIAGYGMSSA-N	0	3	304.438	2.070	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N2CCCC[C@@H]2c2cn[nH]c2)C1	ZINC000182440915	279318491	/nfs/dbraw/zinc/31/84/91/279318491.db2.gz	OCAOAXQXMCVXPW-LSDHHAIUSA-N	0	3	305.426	2.131	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N1CCCC[C@@H]1c1ncc[nH]1	ZINC000175389375	279332603	/nfs/dbraw/zinc/33/26/03/279332603.db2.gz	SIWJAESCNSNILD-UONOGXRCSA-N	0	3	305.426	2.131	10	0		DEAEHN
C[C@H](CNC(=O)c1cnn2c1CCCC2)N1CCC[C@@H](C)C1	ZINC000246205822	279345881	/nfs/dbraw/zinc/34/58/81/279345881.db2.gz	BSPRMLFNLZEDRM-ZIAGYGMSSA-N	0	3	304.438	2.070	10	0		DEAEHN
C[C@@H]1CN(CC2CC[NH+](CCCCC(=O)[O-])CC2)C[C@@H](C)O1	ZINC000262261567	288152933	/nfs/dbraw/zinc/15/29/33/288152933.db2.gz	REFKKOXEUMIGTQ-HUUCEWRRSA-N	0	3	312.454	2.063	10	0		DEAEHN
C[C@H]1NC(=S)N(C[C@]2(C)CCCN2Cc2ccccc2)C1=O	ZINC000189417875	280043925	/nfs/dbraw/zinc/04/39/25/280043925.db2.gz	WQQUWHKRHHQRBI-DYVFJYSZSA-N	0	3	317.458	2.146	10	0		DEAEHN
CC(C)[C@H](NCC(=O)NC(N)=O)c1ccc(C(F)(F)F)cc1	ZINC000181509575	280323587	/nfs/dbraw/zinc/32/35/87/280323587.db2.gz	FTOWHYZGJIJHHY-LBPRGKRZSA-N	0	3	317.311	2.187	10	0		DEAEHN
CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cccc2c1OCO2	ZINC000247034432	281198471	/nfs/dbraw/zinc/19/84/71/281198471.db2.gz	UROCAYSMAGXILF-STQMWFEESA-N	0	3	302.374	2.114	10	0		DEAEHN
Cc1cccnc1CNC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000105093972	281411324	/nfs/dbraw/zinc/41/13/24/281411324.db2.gz	TZHFKEFXBUQNQN-KRWDZBQOSA-N	0	3	312.417	2.492	10	0		DEAEHN
Cc1cc(C)cc(NC(=O)NC[C@H](O)CN2CCCCC2)c1	ZINC000043274396	281435842	/nfs/dbraw/zinc/43/58/42/281435842.db2.gz	RENBCXYZWPRYLZ-INIZCTEOSA-N	0	3	305.422	2.272	10	0		DEAEHN
CN(C(=O)CN[C@H]1CCCC[C@@H]1n1cccn1)c1nccs1	ZINC000127963489	281743840	/nfs/dbraw/zinc/74/38/40/281743840.db2.gz	SHINZWWXXKGVLU-STQMWFEESA-N	0	3	319.434	2.076	10	0		DEAEHN
NC(=O)c1ccc(CN(C[C@@H]2CCCO2)[C@@H]2CCSC2)cc1	ZINC000123625812	295179296	/nfs/dbraw/zinc/17/92/96/295179296.db2.gz	WIDXNGBZRRDRKQ-CVEARBPZSA-N	0	3	320.458	2.272	10	0		DEAEHN
C[C@@H]1C[NH2+]CC[C@@H]1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000262765621	297107927	/nfs/dbraw/zinc/10/79/27/297107927.db2.gz	KRVKJDNMSNXDNF-PELKAZGASA-N	0	3	323.245	2.270	10	0		DEAEHN
C[C@H](CN[C@@H](C)c1ccc(F)cc1N(C)C)N1CCOCC1	ZINC000123468490	298779466	/nfs/dbraw/zinc/77/94/66/298779466.db2.gz	YNSMASNFZLCMQJ-KGLIPLIRSA-N	0	3	309.429	2.263	10	0		DEAEHN
Fc1ccc2c(c1)[C@@H](N[C@H]1CCc3ncnn3C1)CCCO2	ZINC000180599570	303133243	/nfs/dbraw/zinc/13/32/43/303133243.db2.gz	AEJVPTIWHMSVNC-JSGCOSHPSA-N	0	3	302.353	2.236	10	0		DEAEHN
CCS(=O)(=O)NCCN[C@H]1c2ccccc2CCC1(C)C	ZINC000183131240	333052680	/nfs/dbraw/zinc/05/26/80/333052680.db2.gz	COZQUQLEHXEDLU-HNNXBMFYSA-N	0	3	310.463	2.229	10	0		DEAEHN
C[C@@H](NCc1c(Br)cnn1C)[C@H]1CCCOC1	ZINC000388948007	335660846	/nfs/dbraw/zinc/66/08/46/335660846.db2.gz	HLCPIVOHUCLCEA-ZJUUUORDSA-N	0	3	302.216	2.087	10	0		DEAEHN
Cc1cc(NC(=O)CCN[C@@H](C)c2ccc3c(c2)OCO3)no1	ZINC000192478046	341841003	/nfs/dbraw/zinc/84/10/03/341841003.db2.gz	IDWFUZFNEYHNEU-NSHDSACASA-N	0	3	317.345	2.391	10	0		DEAEHN
Cc1c([C@H]2[C@H](NC/C=C/c3ccccc3)CC(=O)N2C)cnn1C	ZINC000328629546	533957782	/nfs/dbraw/zinc/95/77/82/533957782.db2.gz	OYLNQOIZPZQSGE-JWUWVAEESA-N	0	3	324.428	2.303	10	0		DEAEHN
COC(=O)c1ccc(NCCN2CCCCCC2)nc1OC	ZINC000302342149	534223681	/nfs/dbraw/zinc/22/36/81/534223681.db2.gz	WRTLOQQVNZEPHH-UHFFFAOYSA-N	0	3	307.394	2.165	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@@](C)(O)[C@H](C)c2ccccc2)C1	ZINC000246966293	519692164	/nfs/dbraw/zinc/69/21/64/519692164.db2.gz	FYFNSAXNCOBRNI-RRIFGTCXSA-N	0	3	318.461	2.386	10	0		DEAEHN
CCOCCN1CCN(CCCCCn2cccn2)C[C@@H]1C	ZINC000105835662	519920338	/nfs/dbraw/zinc/92/03/38/519920338.db2.gz	UENLGRPYRSLSOV-KRWDZBQOSA-N	0	3	308.470	2.096	10	0		DEAEHN
CCO[C@@H]1C[C@H](NCc2ccc(-c3cc[nH]n3)o2)[C@@]12CCCO2	ZINC000366009227	520427771	/nfs/dbraw/zinc/42/77/71/520427771.db2.gz	LIVVYKSLSAEDSQ-BBWFWOEESA-N	0	3	317.389	2.486	10	0		DEAEHN
CCN(Cc1ccccn1)C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000132417110	521391524	/nfs/dbraw/zinc/39/15/24/521391524.db2.gz	ABFQFQUMBHISDN-HOCLYGCPSA-N	0	3	304.438	2.342	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N(C)CCN(C)c2ccccc2)C1	ZINC000107838143	521645013	/nfs/dbraw/zinc/64/50/13/521645013.db2.gz	CCCYYUHOHWUKPR-INIZCTEOSA-N	0	3	318.465	2.249	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN(CC(=O)N2CCCC[C@@H]2C)C1	ZINC000105922556	522590236	/nfs/dbraw/zinc/59/02/36/522590236.db2.gz	LXZJKEWXTPJHAU-JKSUJKDBSA-N	0	3	318.465	2.483	10	0		DEAEHN
CC[C@](C)(CCO)NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248042939	523456757	/nfs/dbraw/zinc/45/67/57/523456757.db2.gz	MGLVBVYXUSSTMC-XYJFISCASA-N	0	3	319.449	2.282	10	0		DEAEHN
COCCN1CCC[C@H]1CN[C@@H](C)c1cc(OC)ccc1OC	ZINC000163285413	523835316	/nfs/dbraw/zinc/83/53/16/523835316.db2.gz	ASLBYFRMGWWBBW-GJZGRUSLSA-N	0	3	322.449	2.465	10	0		DEAEHN
C[C@H](CNC(=O)N(C)[C@@H](C)c1cnn(C)c1)N1CCC[C@@H](C)C1	ZINC000245920167	524394580	/nfs/dbraw/zinc/39/45/80/524394580.db2.gz	QKDIZYGRUNDJLW-KFWWJZLASA-N	0	3	321.469	2.243	10	0		DEAEHN
Cc1cc(C)nc(SCC(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)n1	ZINC000247373365	524600162	/nfs/dbraw/zinc/60/01/62/524600162.db2.gz	PHZIAALKIHAZOS-BXUZGUMPSA-N	0	3	322.478	2.030	10	0		DEAEHN
C[C@H](Cc1ccccc1F)N[C@H]1CCN(C2CCOCC2)C1=O	ZINC000364848273	524743525	/nfs/dbraw/zinc/74/35/25/524743525.db2.gz	PTUGJECDRXSLBV-DYVFJYSZSA-N	0	3	320.408	2.126	10	0		DEAEHN
Cc1cc(F)cc(NC(=O)C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000249194106	524940068	/nfs/dbraw/zinc/94/00/68/524940068.db2.gz	PWGHNLVGHVQMKV-SWLSCSKDSA-N	0	3	321.396	2.014	10	0		DEAEHN
Cc1cc(S(=O)(=O)[N-]C2CCC([NH3+])CC2)c(Cl)cc1F	ZINC000237785534	525404218	/nfs/dbraw/zinc/40/42/18/525404218.db2.gz	IQZAIDQZLYYKIE-UHFFFAOYSA-N	0	3	320.817	2.336	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)Nc1ccc2c(c1F)CCNC2	ZINC000261826628	534903196	/nfs/dbraw/zinc/90/31/96/534903196.db2.gz	YPGNHJGISQAJDH-HNNXBMFYSA-N	0	3	305.397	2.284	10	0		DEAEHN
C=Cc1ccc(CCNC(=O)N[C@H]2CNCCC2(F)F)cc1	ZINC000418195575	526271442	/nfs/dbraw/zinc/27/14/42/526271442.db2.gz	BYAATNPBHGAJSB-AWEZNQCLSA-N	0	3	309.360	2.169	10	0		DEAEHN
O=C(N[C@@H]1CCc2c[nH]nc2C1)c1cccc(CN2CCCC2)c1	ZINC000366038821	526955368	/nfs/dbraw/zinc/95/53/68/526955368.db2.gz	BUYAUQSVSZJRGC-QGZVFWFLSA-N	0	3	324.428	2.293	10	0		DEAEHN
CC(=O)c1ccc2c(c1)CN(C(=O)NC[C@@H]1CCCN1C)C2	ZINC000413164371	527342464	/nfs/dbraw/zinc/34/24/64/527342464.db2.gz	CLMJRTJISONHRC-INIZCTEOSA-N	0	3	301.390	2.009	10	0		DEAEHN
CCN1CC[C@@H](NC(=O)c2ccsc2Br)C1	ZINC000412874085	527796665	/nfs/dbraw/zinc/79/66/65/527796665.db2.gz	ICRLOESDDSDMNK-MRVPVSSYSA-N	0	3	303.225	2.335	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCCCNC1=O	ZINC000328874853	527895242	/nfs/dbraw/zinc/89/52/42/527895242.db2.gz	RVBQOZFLXPKEKK-ZNMIVQPWSA-N	0	3	307.438	2.218	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCN(Cc2ccccc2C)CC1	ZINC000193367137	528622294	/nfs/dbraw/zinc/62/22/94/528622294.db2.gz	WQWHLJBWMBWTLN-LJQANCHMSA-N	0	3	320.477	2.290	10	0		DEAEHN
CC[C@@H](C(=O)NCCc1cn(C)c2cc(C)ccc12)N(C)C	ZINC000188413350	529283844	/nfs/dbraw/zinc/28/38/44/529283844.db2.gz	GXERNXXSHCDJBO-INIZCTEOSA-N	0	3	301.434	2.486	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](N[C@H](Cc2ccc(Cl)cc2)C(N)=O)C1	ZINC000248706576	535258602	/nfs/dbraw/zinc/25/86/02/535258602.db2.gz	ABYGCGGRDMUVKX-DAXOMENPSA-N	0	3	323.868	2.055	10	0		DEAEHN
CCCN1CCC[C@H]1C(=O)N1CC[C@H](n2cc(Cl)cn2)C1	ZINC000358489501	535363946	/nfs/dbraw/zinc/36/39/46/535363946.db2.gz	YSWNEAOKAZEZBW-KBPBESRZSA-N	0	3	310.829	2.184	10	0		DEAEHN
CCOc1ccc2nc(NC(=O)C3(N)CCOCC3)sc2c1	ZINC000262141452	535444563	/nfs/dbraw/zinc/44/45/63/535444563.db2.gz	MKRGXMIGIGGHOZ-UHFFFAOYSA-N	0	3	321.402	2.141	10	0		DEAEHN
CC[C@H](NC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C)c1nccs1	ZINC000262433858	535856536	/nfs/dbraw/zinc/85/65/36/535856536.db2.gz	GCAYZPXWAXGODV-CENBSLRLSA-N	0	3	323.462	2.243	10	0		DEAEHN
CN1CC[C@@H](N2CCC[C@@H](c3nc(-c4ccccc4)c[nH]3)C2)C1=O	ZINC000247539354	536451681	/nfs/dbraw/zinc/45/16/81/536451681.db2.gz	QNXHJKYBSBOPML-NVXWUHKLSA-N	0	3	324.428	2.487	10	0		DEAEHN
COc1ccc(C[C@H](C)CN2CCCN(C)C(=O)C2)cc1F	ZINC000191664361	536516808	/nfs/dbraw/zinc/51/68/08/536516808.db2.gz	RDSQPSAHKHGHTA-ZDUSSCGKSA-N	0	3	308.397	2.177	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)NC[C@@H]1CCC[C@@H](C)C1	ZINC000247476473	536861142	/nfs/dbraw/zinc/86/11/42/536861142.db2.gz	IGSOPNNQOUZNKG-BZUAXINKSA-N	0	3	311.470	2.223	10	0		DEAEHN
COc1ccccc1C[C@H]1CCCN1CCN1CCO[C@@H](C)C1	ZINC000191465396	537056676	/nfs/dbraw/zinc/05/66/76/537056676.db2.gz	PRRFAKLYXGESGZ-FUHWJXTLSA-N	0	3	318.461	2.423	10	0		DEAEHN
CCN(CC)[C@@H](C)CNS(=O)(=O)c1ccc(C)nc1Cl	ZINC000185471965	625370694	/nfs/dbraw/zinc/37/06/94/625370694.db2.gz	QDVKHCQORTWSGW-NSHDSACASA-N	0	3	319.858	2.052	10	0		DEAEHN
CCOC[C@@H]1CCN(Cn2ncc3cc(C(=O)OC)ccc32)C1	ZINC000748087761	638508189	/nfs/dbraw/zinc/50/81/89/638508189.db2.gz	BZDDCXSBTXMZJV-CYBMUJFWSA-N	0	3	317.389	2.139	10	0		DEAEHN
CCN(CC)C(=O)C1(NC/C=C(\C)C(=O)OC)CCCCC1	ZINC000748818092	638595279	/nfs/dbraw/zinc/59/52/79/638595279.db2.gz	UFXBQRJEKCKXKY-GXDHUFHOSA-N	0	3	310.438	2.267	10	0		DEAEHN
CCCN1CCC[C@@H]1C(=O)N[C@H](C)[C@@H](O)c1ccc(C)cc1	ZINC000804483118	645779311	/nfs/dbraw/zinc/77/93/11/645779311.db2.gz	BMCRYDYJIKRZBB-DJIMGWMZSA-N	0	3	304.434	2.408	10	0		DEAEHN
CN(C)C[C@@H]1CN(Cn2c3ccccc3oc2=S)CCO1	ZINC000152968645	647305406	/nfs/dbraw/zinc/30/54/06/647305406.db2.gz	SVXIAOUINYRPAB-GFCCVEGCSA-N	0	3	307.419	2.184	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)C[C@H](O)c2ccc(Cl)cc2)C1	ZINC000179814315	648422624	/nfs/dbraw/zinc/42/26/24/648422624.db2.gz	BWURVULUHSCUPK-CABCVRRESA-N	0	3	310.825	2.364	10	0		DEAEHN
Brc1ccc2c(c1)[C@H](NCCn1cncn1)CCO2	ZINC000381649411	685400806	/nfs/dbraw/zinc/40/08/06/685400806.db2.gz	AQLRYOQDXQOMCQ-GFCCVEGCSA-N	0	3	323.194	2.154	10	0		DEAEHN
Cn1cc([C@H]2CCN(Cn3cnc4cc(F)c(F)cc43)C2)cn1	ZINC000116257470	684064112	/nfs/dbraw/zinc/06/41/12/684064112.db2.gz	LBUJIUZRGGVVSE-NSHDSACASA-N	0	3	317.343	2.495	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1cnc(Cl)c(C)c1	ZINC000117359797	684068897	/nfs/dbraw/zinc/06/88/97/684068897.db2.gz	BLSVALYIKPALPK-LLVKDONJSA-N	0	3	319.858	2.052	10	0		DEAEHN
O=C(CC1CCCC1)NC1CCN(CC[C@@H]2CCOC2=O)CC1	ZINC000120537454	684097218	/nfs/dbraw/zinc/09/72/18/684097218.db2.gz	SCZUIHCNBJQHNO-OAHLLOKOSA-N	0	3	322.449	2.101	10	0		DEAEHN
CCOCc1nc(Cl)cc(N2CCN(CC(C)C)CC2)n1	ZINC000129989137	684184475	/nfs/dbraw/zinc/18/44/75/684184475.db2.gz	XBJSSAZYVVOFGC-UHFFFAOYSA-N	0	3	312.845	2.445	10	0		DEAEHN
C[C@H]1[C@@H](NCc2ccnn2C)CCCN1C(=O)OC(C)(C)C	ZINC000189518023	684383058	/nfs/dbraw/zinc/38/30/58/684383058.db2.gz	YDYFUBHJTMTCQA-JSGCOSHPSA-N	0	3	308.426	2.298	10	0		DEAEHN
CC(C)(C)OC(=O)[C@H]1CCN(C[C@@H]2CC3(CCC3)C(=O)O2)C1	ZINC000192060005	684440711	/nfs/dbraw/zinc/44/07/11/684440711.db2.gz	ILAXHIZZXSOEIN-STQMWFEESA-N	0	3	309.406	2.136	10	0		DEAEHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@H]2CCCO[C@@H]2C)c1	ZINC000192196965	684444179	/nfs/dbraw/zinc/44/41/79/684444179.db2.gz	HMCBKDFUYDOSDT-VHDGCEQUSA-N	0	3	300.358	2.458	10	0		DEAEHN
O[C@H](CN1CCC(OC[C@H]2CCCCO2)CC1)c1cccnc1	ZINC000878173174	690335319	/nfs/dbraw/zinc/33/53/19/690335319.db2.gz	PUHFKSNOFDLRFT-QZTJIDSGSA-N	0	3	320.433	2.165	10	0		DEAEHN
CC(=O)N1C[C@H](NCc2cccnc2)CC[C@@H]1C(F)(F)F	ZINC000886038209	691989809	/nfs/dbraw/zinc/98/98/09/691989809.db2.gz	SITLTIFDKCFRQS-CHWSQXEVSA-N	0	3	301.312	2.113	10	0		DEAEHN
COc1cc(F)cc(CN[C@H]2CCO[C@@H]2c2cn(C)nc2C)c1	ZINC000886091371	692001421	/nfs/dbraw/zinc/00/14/21/692001421.db2.gz	VVCWNKWVQKEKAA-DLBZAZTESA-N	0	3	319.380	2.496	10	0		DEAEHN
Cc1cc(CNC2C[C@H]3CC[C@@H](C2)S3(=O)=O)cc(Cl)n1	ZINC000724324859	777276348	/nfs/dbraw/zinc/27/63/48/777276348.db2.gz	MZMRBIFHJVYXHJ-YHWZYXNKSA-N	0	3	314.838	2.241	10	0		DEAEHN
COc1ccc(Br)cc1CN[C@@H]1CC12CC(O)C2	ZINC000724948528	777532564	/nfs/dbraw/zinc/53/25/64/777532564.db2.gz	YFMLZTKVEBSTTC-HRDQMINSSA-N	0	3	312.207	2.461	10	0		DEAEHN
Cn1nc(Br)cc1CNC[C@H]1CC[C@@H](C2CC2)O1	ZINC000722321070	778616120	/nfs/dbraw/zinc/61/61/20/778616120.db2.gz	PESMIMMTPMSNFH-NEPJUHHUSA-N	0	3	314.227	2.230	10	0		DEAEHN
Cc1c(CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)cnn1C	ZINC000721860752	780397924	/nfs/dbraw/zinc/39/79/24/780397924.db2.gz	BYRCQGJQPWILPN-BXUZGUMPSA-N	0	3	308.426	2.074	10	0		DEAEHN
CO[C@]1(CN[C@@H](C)c2cc(C)sc2C)CCS(=O)(=O)C1	ZINC000721258029	781016673	/nfs/dbraw/zinc/01/66/73/781016673.db2.gz	GGGSCMBVTQUCQV-FZMZJTMJSA-N	0	3	317.476	2.219	10	0		DEAEHN
CCO[C@H]1C[C@](CO)(NCc2cnc3cc(C)ccn23)C1(C)C	ZINC000186578293	784404702	/nfs/dbraw/zinc/40/47/02/784404702.db2.gz	ZWZZDDGIUXYMAA-MAUKXSAKSA-N	0	3	317.433	2.298	10	0		DEAEHN
COC[C@@H](C)OC(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000586474508	791871458	/nfs/dbraw/zinc/87/14/58/791871458.db2.gz	AGNVHNKOJXLFJA-CQSZACIVSA-N	0	3	306.406	2.412	10	0		DEAEHN
C[C@@H](NCc1cn(C)nc1Br)[C@@H]1CCCOC1	ZINC000712397226	792185897	/nfs/dbraw/zinc/18/58/97/792185897.db2.gz	LYHYKSXLOXNXSH-NXEZZACHSA-N	0	3	302.216	2.087	10	0		DEAEHN
CC1(C)CCNCCN1S(=O)(=O)c1ccc(Cl)s1	ZINC000712598825	792192321	/nfs/dbraw/zinc/19/23/21/792192321.db2.gz	OOBWLQYPYQBANI-UHFFFAOYSA-N	0	3	308.856	2.164	10	0		DEAEHN
COc1cc([C@@H](C)N[C@H]2C[C@H](S(C)(=O)=O)C2)ccc1F	ZINC000714252113	792306264	/nfs/dbraw/zinc/30/62/64/792306264.db2.gz	SYFYUOOWULPMKW-YUSALJHKSA-N	0	3	301.383	2.061	10	0		DEAEHN
CS(=O)(=O)C1CC(NCc2ccccc2C(F)(F)F)C1	ZINC000716137463	792562085	/nfs/dbraw/zinc/56/20/85/792562085.db2.gz	AZGSWYJUZDPWRF-UHFFFAOYSA-N	0	3	307.337	2.371	10	0		DEAEHN
CS(=O)(=O)C1CC(NCc2cccc(Br)c2)C1	ZINC000716144182	792571550	/nfs/dbraw/zinc/57/15/50/792571550.db2.gz	ZQJGUPDAMUMFJT-UHFFFAOYSA-N	0	3	318.236	2.114	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@@H](N[C@H]2CCCc3n[nH]cc32)C1	ZINC000401684940	801841280	/nfs/dbraw/zinc/84/12/80/801841280.db2.gz	MUECVJLDTOIXQG-YPMHNXCESA-N	0	3	306.410	2.386	10	0		DEAEHN
CCc1nc(CN[C@@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)n[nH]1	ZINC000401796582	801851873	/nfs/dbraw/zinc/85/18/73/801851873.db2.gz	JVJYDGNNVVUKHK-NWDGAFQWSA-N	0	3	323.441	2.102	10	0		DEAEHN
CN1CCC[C@H]2[C@@H]1CCN2C(=O)c1ccc(Br)cn1	ZINC000720819089	1086168953	/nfs/dbraw/zinc/16/89/53/1086168953.db2.gz	YFTOEBIZYRDAMV-STQMWFEESA-N	0	3	324.222	2.153	10	0		DEAEHN
CN1CCC[C@H]2[C@@H]1CCN2C(=O)c1ncccc1Br	ZINC000720818273	1086169131	/nfs/dbraw/zinc/16/91/31/1086169131.db2.gz	UNRZOFUHJCAAJJ-RYUDHWBXSA-N	0	3	324.222	2.153	10	0		DEAEHN
C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1NCc1cc(Br)nn1C	ZINC000701043510	1086347672	/nfs/dbraw/zinc/34/76/72/1086347672.db2.gz	MATCLLXXDYMABT-UOKLYIGXSA-N	0	3	302.216	2.084	10	0		DEAEHN
CC[C@@H]1[C@@H](NCc2cnn(C)c2)CCN1C(=O)OC(C)(C)C	ZINC000704620958	1086584668	/nfs/dbraw/zinc/58/46/68/1086584668.db2.gz	KUQDAQMTSPSWSG-UONOGXRCSA-N	0	3	308.426	2.298	10	0		DEAEHN
CN(CCOCCNCc1cncs1)C(=O)OC(C)(C)C	ZINC000705891556	1086628066	/nfs/dbraw/zinc/62/80/66/1086628066.db2.gz	KWGCLDZHOJJRMG-UHFFFAOYSA-N	0	3	315.439	2.116	10	0		DEAEHN
CC(C)(C)OC(=O)N1CC[C@]2(NCc3cncnc3)CCC[C@H]12	ZINC000711623201	1087177647	/nfs/dbraw/zinc/17/76/47/1087177647.db2.gz	KOGQPVRYQRJKSB-WMLDXEAASA-N	0	3	318.421	2.498	10	0		DEAEHN
Cc1noc([C@@H]2CN(C[C@@H]3CCc4ccccc43)CCN2C)n1	ZINC000606442343	1088602135	/nfs/dbraw/zinc/60/21/35/1088602135.db2.gz	FSBTUSQUQVSORH-RDJZCZTQSA-N	0	3	312.417	2.397	10	0		DEAEHN
Cc1oc(Br)cc1C(=O)N[C@H]1CCN(C)[C@@H]1C	ZINC000719391790	1089082147	/nfs/dbraw/zinc/08/21/47/1089082147.db2.gz	BQFBEWBPHUFDQS-XCBNKYQSSA-N	0	3	301.184	2.173	10	0		DEAEHN
C[C@H]1[C@H](NC(=O)c2cscc2Br)CCN1C	ZINC000719399048	1089085710	/nfs/dbraw/zinc/08/57/10/1089085710.db2.gz	YNWWZCRNISESIF-OIBJUYFYSA-N	0	3	303.225	2.333	10	0		DEAEHN
C[C@H]1CC[NH2+]C[C@H]1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000193397914	290603336	/nfs/dbraw/zinc/60/33/36/290603336.db2.gz	QRVPDUTUGLMCEC-WCBMZHEXSA-N	0	3	323.245	2.270	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1	ZINC000278296474	214072955	/nfs/dbraw/zinc/07/29/55/214072955.db2.gz	HOQNURYFBHTISP-DYVFJYSZSA-N	0	3	317.433	2.224	10	0		DEAEHN
CN[C@@H]1c2ccccc2OC[C@@H]1Sc1nnc(N(C)C)s1	ZINC000081769398	192322918	/nfs/dbraw/zinc/32/29/18/192322918.db2.gz	VQKDAHAGDUIFMJ-NWDGAFQWSA-N	0	3	322.459	2.418	10	0		DEAEHN
CN[C@@H]1c2ccccc2CC[C@H]1Sc1nnnn1C1CC1	ZINC000081867648	192333488	/nfs/dbraw/zinc/33/34/88/192333488.db2.gz	HBDJBVSLZCDKAA-ZIAGYGMSSA-N	0	3	301.419	2.376	10	0		DEAEHN
CCCN[C@H]1c2ccc(OC)cc2CC[C@@H]1S(=O)(=O)CC	ZINC000081925725	192340495	/nfs/dbraw/zinc/34/04/95/192340495.db2.gz	RVXFIXGUCKNMJD-HOTGVXAUSA-N	0	3	311.447	2.485	10	0		DEAEHN
C[C@@]1(O)CCCN([C@@H](CN)c2ccc(Br)cc2)C1	ZINC000163010810	197606548	/nfs/dbraw/zinc/60/65/48/197606548.db2.gz	JNMDJJCOAAYXAS-UONOGXRCSA-N	0	3	313.239	2.296	10	0		DEAEHN
CCN[C@@H](c1ccccc1)[C@@H](C(C)C)S(=O)(=O)CCOC	ZINC000081943733	192343637	/nfs/dbraw/zinc/34/36/37/192343637.db2.gz	CYZHIPDCACRWEJ-JKSUJKDBSA-N	0	3	313.463	2.423	10	0		DEAEHN
CCN[C@@H](c1ccc(CC)cc1)[C@H](C)S(=O)(=O)CCOC	ZINC000081944995	192346259	/nfs/dbraw/zinc/34/62/59/192346259.db2.gz	OOHJJPSXYOBMNH-XJKSGUPXSA-N	0	3	313.463	2.349	10	0		DEAEHN
COc1cc(C)c(Br)cc1[C@@H](N)CCCC(N)=O	ZINC000088078807	185239006	/nfs/dbraw/zinc/23/90/06/185239006.db2.gz	CCSQZNDKLVMBDC-NSHDSACASA-N	0	3	315.211	2.422	10	0		DEAEHN
CC(C)(N)CS(=O)(=O)Cc1ccc(Br)s1	ZINC000088072445	185239027	/nfs/dbraw/zinc/23/90/27/185239027.db2.gz	PTLMCGQZIIBBEN-UHFFFAOYSA-N	0	3	312.254	2.163	10	0		DEAEHN
CC[C@H](CN)S(=O)(=O)Nc1ccc(F)c(C(F)(F)F)c1	ZINC000088472914	185252324	/nfs/dbraw/zinc/25/23/24/185252324.db2.gz	HZFNVMMCUBUORN-MRVPVSSYSA-N	0	3	314.304	2.324	10	0		DEAEHN
CN(CCn1cc(CNC(C)(C)C)nn1)CCC(F)(F)F	ZINC000088437566	185250374	/nfs/dbraw/zinc/25/03/74/185250374.db2.gz	AYYTZGDEEVEXPW-UHFFFAOYSA-N	0	3	307.364	2.050	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCc1ccc(OC)cc1	ZINC000177294615	282203362	/nfs/dbraw/zinc/20/33/62/282203362.db2.gz	JIWFYNMVBLAVIX-INIZCTEOSA-N	0	3	319.449	2.363	10	0		DEAEHN
CCCN[C@H](Cc1ccc2ccccc2n1)CS(C)(=O)=O	ZINC000088519505	185254532	/nfs/dbraw/zinc/25/45/32/185254532.db2.gz	OFDTXPQRYZLHTQ-OAHLLOKOSA-N	0	3	306.431	2.190	10	0		DEAEHN
CCCNCc1ccc(S(=O)(=O)N(C)C[C@H](C)CC)o1	ZINC000088543735	185256598	/nfs/dbraw/zinc/25/65/98/185256598.db2.gz	AYNXTKZOAKRIGP-GFCCVEGCSA-N	0	3	302.440	2.446	10	0		DEAEHN
C[C@@H](CN1CCCC1)NC(=O)c1sc2ncccc2c1N	ZINC000088641863	185260929	/nfs/dbraw/zinc/26/09/29/185260929.db2.gz	UFPZPEFIVKZIAN-JTQLQIEISA-N	0	3	304.419	2.093	10	0		DEAEHN
CN[C@H](C)[C@@H](C)S(=O)(=O)c1cccc(Br)c1	ZINC000081982668	192349430	/nfs/dbraw/zinc/34/94/30/192349430.db2.gz	DJCBZUIQSFGMRZ-RKDXNWHRSA-N	0	3	306.225	2.219	10	0		DEAEHN
N[C@H]1COC[C@H]1C(=O)Nc1ccccc1SC(F)(F)F	ZINC000090379820	185293517	/nfs/dbraw/zinc/29/35/17/185293517.db2.gz	UGHDQSIRUPYDLE-SFYZADRCSA-N	0	3	306.309	2.211	10	0		DEAEHN
CN(C)C[C@H]1CSCCCN1C(=O)Cc1ccc(F)cc1	ZINC000090699961	185310404	/nfs/dbraw/zinc/31/04/04/185310404.db2.gz	UGGAVUKENTUHHV-HNNXBMFYSA-N	0	3	310.438	2.264	10	0		DEAEHN
Cc1nc(C)c(C(=O)N2CCCSC[C@H]2CN(C)C)s1	ZINC000090700061	185310520	/nfs/dbraw/zinc/31/05/20/185310520.db2.gz	TXDKCZNCHLGXSG-GFCCVEGCSA-N	0	3	313.492	2.269	10	0		DEAEHN
COC(=O)CNC(=O)[C@H](C)N[C@H](C)c1ccc(CC(C)C)cc1	ZINC000181406307	199291908	/nfs/dbraw/zinc/29/19/08/199291908.db2.gz	BPABCLFDQSBSEG-KGLIPLIRSA-N	0	3	320.433	2.213	10	0		DEAEHN
COC(=O)c1csc(NC(=O)N2C[C@H]3CCCN3C[C@H]2C)c1	ZINC000092929233	185349387	/nfs/dbraw/zinc/34/93/87/185349387.db2.gz	ZACUTAWNGKJSBO-ZYHUDNBSSA-N	0	3	323.418	2.235	10	0		DEAEHN
CCO[C@H]1C[C@@H](NCc2cn(C)nc2CC)C12CCOCC2	ZINC000186393193	282274460	/nfs/dbraw/zinc/27/44/60/282274460.db2.gz	CUWUZABGGAXQKK-CVEARBPZSA-N	0	3	307.438	2.046	10	0		DEAEHN
CCO[C@@H]1C[C@@H](NCc2cn(C)nc2CC)C12CCOCC2	ZINC000186393230	282274666	/nfs/dbraw/zinc/27/46/66/282274666.db2.gz	CUWUZABGGAXQKK-HZPDHXFCSA-N	0	3	307.438	2.046	10	0		DEAEHN
O=C(c1cncc(Cl)n1)N1CCCC[C@H](N2CCCC2)C1	ZINC000192348144	282343356	/nfs/dbraw/zinc/34/33/56/282343356.db2.gz	GBYXBRYJDCHUDR-LBPRGKRZSA-N	0	3	308.813	2.221	10	0		DEAEHN
COc1cc2c(cc1CNCC[C@H](C)[S@](C)=O)O[C@@H](C)C2	ZINC000222592784	282370312	/nfs/dbraw/zinc/37/03/12/282370312.db2.gz	JEBUFYQRDAUQBC-OABGYEMISA-N	0	3	311.447	2.265	10	0		DEAEHN
CN(Cc1cc(Br)ccc1F)C[C@H]1CNCCO1	ZINC000125359933	539473151	/nfs/dbraw/zinc/47/31/51/539473151.db2.gz	QZBONGLHHKILOL-GFCCVEGCSA-N	0	3	317.202	2.008	10	0		DEAEHN
C[C@@H](NC(=O)N1C[C@@H](c2ccccc2)[C@H](N)C1)[C@@H]1CCCCO1	ZINC000333811174	282969905	/nfs/dbraw/zinc/96/99/05/282969905.db2.gz	PPFTUKDCWHNNOO-XBVQOTNRSA-N	0	3	317.433	2.080	10	0		DEAEHN
c1ccc2c(c1)CC[C@@H]2CCN1CCN(c2nccnn2)CC1	ZINC000625644468	365859066	/nfs/dbraw/zinc/85/90/66/365859066.db2.gz	ICFZXODQDXDDJX-MRXNPFEDSA-N	0	3	309.417	2.114	10	0		DEAEHN
COc1ccc2c(c1)CCC[C@@H]2NC[C@@H]1CCCS1(=O)=O	ZINC000126678867	185884265	/nfs/dbraw/zinc/88/42/65/185884265.db2.gz	MPELWIXJVOVGJD-HOCLYGCPSA-N	0	3	309.431	2.239	10	0		DEAEHN
COC1(CNCc2c[nH]c(-c3ccccc3)n2)CCOCC1	ZINC000178437827	539636661	/nfs/dbraw/zinc/63/66/61/539636661.db2.gz	AGVNPTPKHKYHDK-UHFFFAOYSA-N	0	3	301.390	2.362	10	0		DEAEHN
COC1(CNCc2cnc(-c3ccccc3)[nH]2)CCOCC1	ZINC000178437827	539636663	/nfs/dbraw/zinc/63/66/63/539636663.db2.gz	AGVNPTPKHKYHDK-UHFFFAOYSA-N	0	3	301.390	2.362	10	0		DEAEHN
Cc1n[nH]cc1[C@@H](C)N[C@@H](C)Cn1ncc2ccccc2c1=O	ZINC000181035318	539648131	/nfs/dbraw/zinc/64/81/31/539648131.db2.gz	RUJDYWBDYIHEDP-NWDGAFQWSA-N	0	3	311.389	2.167	10	0		DEAEHN
CCN1CCC[C@H](Nc2ncc(Br)c(OC)n2)C1	ZINC000180423201	539644888	/nfs/dbraw/zinc/64/48/88/539644888.db2.gz	AVCQDJWTZSABQD-VIFPVBQESA-N	0	3	315.215	2.144	10	0		DEAEHN
C[C@H](NCC(=O)Nc1ccc(OC(F)F)cc1)[C@@H]1CCCO1	ZINC000183179732	539660185	/nfs/dbraw/zinc/66/01/85/539660185.db2.gz	MEFJBAURILISTG-GWCFXTLKSA-N	0	3	314.332	2.384	10	0		DEAEHN
CN[C@@H](C[S@@](=O)C1CCCC1)c1ccc2c(c1)OCCO2	ZINC000084052350	192397757	/nfs/dbraw/zinc/39/77/57/192397757.db2.gz	PBHXRHTVWKUVEY-QKKBWIMNSA-N	0	3	309.431	2.410	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)C(=O)Nc2ccc(C(C)(C)C)cc2)C1	ZINC000170845222	197835471	/nfs/dbraw/zinc/83/54/71/197835471.db2.gz	JOXLWYLMSQXKJS-HNNXBMFYSA-N	0	3	317.433	2.085	10	0		DEAEHN
Cn1cc(CN2Cc3c(cccc3C(F)(F)F)[C@H]2CN)cn1	ZINC000071684184	191007952	/nfs/dbraw/zinc/00/79/52/191007952.db2.gz	AWDKNRSZGTYMOE-CQSZACIVSA-N	0	3	310.323	2.455	10	0		DEAEHN
Cc1ccsc1[C@@H]1C[C@H]1C(=O)NC[C@H](O)CN1CCCCC1	ZINC000133686436	186006930	/nfs/dbraw/zinc/00/69/30/186006930.db2.gz	ZQFPBVJXDUVZPT-RRFJBIMHSA-N	0	3	322.474	2.123	10	0		DEAEHN
C[C@H]1CCCCCN1S(=O)(=O)c1cc(CN)cc(F)c1F	ZINC000139105719	186020551	/nfs/dbraw/zinc/02/05/51/186020551.db2.gz	VSYGERVCLRUFEN-JTQLQIEISA-N	0	3	318.389	2.377	10	0		DEAEHN
CCC[C@@H]1CCN(S(=O)(=O)c2cc(CN)cc(F)c2F)C1	ZINC000139296474	186021861	/nfs/dbraw/zinc/02/18/61/186021861.db2.gz	JJGIXHCYHVIXRJ-SNVBAGLBSA-N	0	3	318.389	2.234	10	0		DEAEHN
CN(C)CCn1ncc(Cl)c1[C@H](O)[C@]1(C)CCCS1	ZINC000140179329	186025870	/nfs/dbraw/zinc/02/58/70/186025870.db2.gz	AIYNQFQWSDKOCZ-STQMWFEESA-N	0	3	303.859	2.417	10	0		DEAEHN
C[C@H](O)C(C)(C)NCc1cccc(NC(=O)C(F)(F)F)c1	ZINC000144873748	186035816	/nfs/dbraw/zinc/03/58/16/186035816.db2.gz	JXXTXKLTATYWMJ-VIFPVBQESA-N	0	3	304.312	2.436	10	0		DEAEHN
CC(C)[C@H](CN(C)C)N1C(=O)C2(CC2)N[C@@H]1c1cccs1	ZINC000145075246	186036259	/nfs/dbraw/zinc/03/62/59/186036259.db2.gz	KTSZAYYANHEFTA-JSGCOSHPSA-N	0	3	307.463	2.297	10	0		DEAEHN
C[C@@H](CN1CCCC1)N1C(=O)C2(CC2)N[C@@H]1c1ccsc1	ZINC000145809470	186037900	/nfs/dbraw/zinc/03/79/00/186037900.db2.gz	BHZZVKOXTQAGCT-JSGCOSHPSA-N	0	3	305.447	2.195	10	0		DEAEHN
CN[C@H](C[C@H]1CN(C)CCN1C)c1cc(Cl)ccc1OC	ZINC000149595471	186051967	/nfs/dbraw/zinc/05/19/67/186051967.db2.gz	YFIUIWAFSIIQHH-DZGCQCFKSA-N	0	3	311.857	2.245	10	0		DEAEHN
CCNc1nc(NCCC(F)(F)F)nc(N2CCCC2)n1	ZINC000150077608	186054681	/nfs/dbraw/zinc/05/46/81/186054681.db2.gz	BOWDQDMNXXPXJG-UHFFFAOYSA-N	0	3	304.320	2.268	10	0		DEAEHN
NCc1sc([C@H]2CCS(=O)(=O)C2)nc1-c1ccccc1	ZINC000150326866	186056740	/nfs/dbraw/zinc/05/67/40/186056740.db2.gz	CGHKDBJGWYKXEL-NSHDSACASA-N	0	3	308.428	2.171	10	0		DEAEHN
COc1ccccc1/C=C\CN1CC[C@@H](N2CCOCC2)C1	ZINC000255775699	539786686	/nfs/dbraw/zinc/78/66/86/539786686.db2.gz	SSJUCUIROSFXSB-XQDHMALISA-N	0	3	302.418	2.115	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NC2CCN(c3cccs3)CC2)C1	ZINC000155719597	186106294	/nfs/dbraw/zinc/10/62/94/186106294.db2.gz	QDQHBFXKTBCPJP-AWEZNQCLSA-N	0	3	322.478	2.062	10	0		DEAEHN
CC(C(=O)Nc1ccccc1OCC(F)(F)F)=C1CNC1	ZINC000163983176	186144723	/nfs/dbraw/zinc/14/47/23/186144723.db2.gz	TVMSCJZYMVTHQN-UHFFFAOYSA-N	0	3	300.280	2.486	10	0		DEAEHN
CC(C)[NH2+]Cc1ccc(S(=O)(=O)[N-]C2CC(C)C2)c(F)c1	ZINC000163993136	186145229	/nfs/dbraw/zinc/14/52/29/186145229.db2.gz	QEOYPUCKDSVKDU-UHFFFAOYSA-N	0	3	314.426	2.401	10	0		DEAEHN
O=C(Nc1ccccc1C(F)(F)F)OC[C@H]1CNCCO1	ZINC000164142241	186149612	/nfs/dbraw/zinc/14/96/12/186149612.db2.gz	FWPKZTKNKUQCLL-SECBINFHSA-N	0	3	304.268	2.242	10	0		DEAEHN
CN1CC[C@H](Nc2ccc(C(F)(F)F)c(C(N)=S)c2)C1	ZINC000164184848	186151676	/nfs/dbraw/zinc/15/16/76/186151676.db2.gz	VRFWSFNZENBEGM-VIFPVBQESA-N	0	3	303.353	2.456	10	0		DEAEHN
C[C@H]1CC[C@](CO)(N(C)Cc2cccc(C(=O)N(C)C)c2)C1	ZINC000187991279	186240544	/nfs/dbraw/zinc/24/05/44/186240544.db2.gz	INEVCNNMIGWWKB-KSSFIOAISA-N	0	3	304.434	2.371	10	0		DEAEHN
Cc1cccc(CNC(=O)CN(C)[C@]2(CO)CC[C@H](C)C2)c1	ZINC000188020768	186244971	/nfs/dbraw/zinc/24/49/71/186244971.db2.gz	YAOUZNVINIJVRE-MAUKXSAKSA-N	0	3	304.434	2.094	10	0		DEAEHN
CC(C)(C)N1CC[C@@H]1CNC(=O)c1cc(Br)c[nH]1	ZINC000617019940	363001027	/nfs/dbraw/zinc/00/10/27/363001027.db2.gz	VEWHZZDEKUQUPH-SNVBAGLBSA-N	0	3	314.227	2.380	10	0		DEAEHN
CCOc1cccc(CNC(=O)N2CCN3CCC[C@@H]3C2)c1	ZINC000171900459	198003656	/nfs/dbraw/zinc/00/36/56/198003656.db2.gz	KOSPJVSZBSMJBC-OAHLLOKOSA-N	0	3	303.406	2.075	10	0		DEAEHN
C/C(=C\C(=O)N1CCO[C@H](CN(C)C)C1)c1ccc(F)cc1	ZINC000172305844	198076204	/nfs/dbraw/zinc/07/62/04/198076204.db2.gz	LLYOSNFJEVOEQY-QSOAKEGCSA-N	0	3	306.381	2.018	10	0		DEAEHN
O=C(NCCc1cc(F)cc(F)c1)N1CC[C@H](N2CC=CC2)C1	ZINC000174482864	198340498	/nfs/dbraw/zinc/34/04/98/198340498.db2.gz	NDLYKHPSOPFCEX-INIZCTEOSA-N	0	3	321.371	2.163	10	0		DEAEHN
CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccnn1C	ZINC000174579718	198354898	/nfs/dbraw/zinc/35/48/98/198354898.db2.gz	PVOYVXHUXKAIPG-UHFFFAOYSA-N	0	3	312.373	2.158	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCCc2cccc(O)c2)CCN1C	ZINC000174616300	198359454	/nfs/dbraw/zinc/35/94/54/198359454.db2.gz	GAEJHGHKAOHXPU-ZFWWWQNUSA-N	0	3	305.422	2.059	10	0		DEAEHN
C[C@H]1C[C@H](N(C)C(=O)NCCc2cccc(O)c2)CCN1C	ZINC000174616275	198360034	/nfs/dbraw/zinc/36/00/34/198360034.db2.gz	GAEJHGHKAOHXPU-DZGCQCFKSA-N	0	3	305.422	2.059	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)NCc1cscn1	ZINC000051751608	354389046	/nfs/dbraw/zinc/38/90/46/354389046.db2.gz	CGCBVSXICMPMLE-CQSZACIVSA-N	0	3	318.446	2.115	10	0		DEAEHN
C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NC2CCN(C)CC2)c1	ZINC000054147899	354454675	/nfs/dbraw/zinc/45/46/75/354454675.db2.gz	LZECXEYYWQUAEM-MLGOLLRUSA-N	0	3	315.417	2.105	10	0		DEAEHN
Cc1c(C(=O)N2CCC(N(C)C)CC2)[nH]c2c1C(=O)CCC2	ZINC000063735228	354654854	/nfs/dbraw/zinc/65/48/54/354654854.db2.gz	JNIFHIMETYUSJO-UHFFFAOYSA-N	0	3	303.406	2.008	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@H](C)Oc2ccc(F)c(F)c2)C1	ZINC000066050053	354699114	/nfs/dbraw/zinc/69/91/14/354699114.db2.gz	XPFYLDRFHHVWDF-NWDGAFQWSA-N	0	3	312.360	2.333	10	0		DEAEHN
CC(C)NC(=O)c1cccnc1N1CCN[C@@H](c2ccccc2)C1	ZINC000065255735	354681079	/nfs/dbraw/zinc/68/10/79/354681079.db2.gz	GOUIHPBFTMKCBD-QGZVFWFLSA-N	0	3	324.428	2.371	10	0		DEAEHN
CCN1CCC[C@H]1CNC(=O)N(C)CCOc1ccc(C)cc1	ZINC000074489870	355032335	/nfs/dbraw/zinc/03/23/35/355032335.db2.gz	FLKHCQQQHQNMDF-INIZCTEOSA-N	0	3	319.449	2.500	10	0		DEAEHN
Cc1c(C(=O)N[C@@H]2CC[C@H](N(C)C)C2)oc2c1C(=O)CCC2	ZINC000093988771	355690786	/nfs/dbraw/zinc/69/07/86/355690786.db2.gz	DRAONSMHVGHOJF-NEPJUHHUSA-N	0	3	304.390	2.320	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1CCc2c1cccc2C	ZINC000111865114	355751244	/nfs/dbraw/zinc/75/12/44/355751244.db2.gz	XCINHWROYQLGEE-OAHLLOKOSA-N	0	3	317.433	2.178	10	0		DEAEHN
COc1ccc([C@H](C)NC(=O)N2CC[C@H](N(C)C)C2)cc1F	ZINC000170826817	355994462	/nfs/dbraw/zinc/99/44/62/355994462.db2.gz	NWXKEIZYUVVVIE-AAEUAGOBSA-N	0	3	309.385	2.241	10	0		DEAEHN
COc1ccc([C@@H](C)NC(=O)N2CC[C@H](N(C)C)C2)cc1F	ZINC000170826818	355994603	/nfs/dbraw/zinc/99/46/03/355994603.db2.gz	NWXKEIZYUVVVIE-YPMHNXCESA-N	0	3	309.385	2.241	10	0		DEAEHN
Cc1noc(C)c1C[C@@H](C)NC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000156762796	355953503	/nfs/dbraw/zinc/95/35/03/355953503.db2.gz	UWZXDRYJKDQFKL-IUODEOHRSA-N	0	3	324.469	2.498	10	0		DEAEHN
COc1ccc(F)cc1[C@@H](C)NC[C@@H](C)CS(C)(=O)=O	ZINC000179948425	356038700	/nfs/dbraw/zinc/03/87/00/356038700.db2.gz	IREAILPCEYIMAP-GHMZBOCLSA-N	0	3	303.399	2.166	10	0		DEAEHN
CN1CCN(C(=O)CN[C@H]2c3ccccc3CCC2(C)C)CC1	ZINC000183201870	356163930	/nfs/dbraw/zinc/16/39/30/356163930.db2.gz	QAXXXWVUBWXMBA-SFHVURJKSA-N	0	3	315.461	2.064	10	0		DEAEHN
NC(=S)CN(CC(=O)Nc1ccccc1F)C1CCCC1	ZINC000080222463	192013295	/nfs/dbraw/zinc/01/32/95/192013295.db2.gz	XWUWITVLOZDGFK-UHFFFAOYSA-N	0	3	309.410	2.295	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)c1c[nH]c(=O)c2ccccc12	ZINC000189712849	356216020	/nfs/dbraw/zinc/21/60/20/356216020.db2.gz	WKVDXVKLDJOTEO-CYBMUJFWSA-N	0	3	313.401	2.132	10	0		DEAEHN
Cc1nc(C)c(CN[C@@H]2CCCN(c3ncccn3)C2)s1	ZINC000080693673	192182046	/nfs/dbraw/zinc/18/20/46/192182046.db2.gz	ANTULUBYNCFNOC-CYBMUJFWSA-N	0	3	303.435	2.309	10	0		DEAEHN
CC[C@H](C)N1CCN(C[C@H](C(N)=S)c2ccccc2)CC1	ZINC000080797686	192191913	/nfs/dbraw/zinc/19/19/13/192191913.db2.gz	FTZHULBHXQHDCN-HOCLYGCPSA-N	0	3	305.491	2.472	10	0		DEAEHN
C[C@@H](N)c1csc(N2CCN(Cc3ccccc3)CC2)n1	ZINC000080807824	192192787	/nfs/dbraw/zinc/19/27/87/192192787.db2.gz	SNFFHNLWFSNUJJ-CYBMUJFWSA-N	0	3	302.447	2.485	10	0		DEAEHN
NC[C@@H]1c2ccccc2CCN1C(=O)c1ccncc1Cl	ZINC000227721056	356280275	/nfs/dbraw/zinc/28/02/75/356280275.db2.gz	BBZXTNBBYDFTPM-OAHLLOKOSA-N	0	3	301.777	2.433	10	0		DEAEHN
C[C@H]1CCC[C@@](N)(C(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1	ZINC000080915128	192201758	/nfs/dbraw/zinc/20/17/58/192201758.db2.gz	CBSNSEAGIMGTKE-VFZGTOFNSA-N	0	3	309.797	2.285	10	0		DEAEHN
CCn1cnnc1CN[C@H](C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000400469319	283157278	/nfs/dbraw/zinc/15/72/78/283157278.db2.gz	XEVPYIZFGXOIQA-CHWSQXEVSA-N	0	3	323.441	2.033	10	0		DEAEHN
CC(C)(C)OCCNC[C@@H](O)COc1ccccc1Cl	ZINC000308511314	356410276	/nfs/dbraw/zinc/41/02/76/356410276.db2.gz	ICHXSZSWDLGLKJ-GFCCVEGCSA-N	0	3	301.814	2.484	10	0		DEAEHN
COCC[C@@H](C)NCc1ccc(I)o1	ZINC000081709392	192316276	/nfs/dbraw/zinc/31/62/76/192316276.db2.gz	QGTXIVNTFVCBNE-MRVPVSSYSA-N	0	3	309.147	2.399	10	0		DEAEHN
CCC[C@@H](N)C(=O)N1CCC[C@@H]1c1ccc(OC)cc1OC	ZINC000236906199	202062990	/nfs/dbraw/zinc/06/29/90/202062990.db2.gz	ZZZWFAFWBZRVET-HUUCEWRRSA-N	0	3	306.406	2.495	10	0		DEAEHN
CCc1cnc(CCNC(=O)C[C@@H](N)c2ccccc2)s1	ZINC000237008730	202119873	/nfs/dbraw/zinc/11/98/73/202119873.db2.gz	NVINMVAESAXJOU-CQSZACIVSA-N	0	3	303.431	2.454	10	0		DEAEHN
CCOCC[C@H](O)CN1CCC[C@H](CC(=O)OC(C)(C)C)C1	ZINC000578875893	356885816	/nfs/dbraw/zinc/88/58/16/356885816.db2.gz	BYHPZAKIBIHVHM-CABCVRRESA-N	0	3	315.454	2.218	10	0		DEAEHN
C[C@@H]1CC[C@H](C)N1CC(=O)NCC[C@@H]1COc2ccccc2O1	ZINC000579785306	357029124	/nfs/dbraw/zinc/02/91/24/357029124.db2.gz	VBZWMBJUTQUFDO-QLFBSQMISA-N	0	3	318.417	2.206	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N2CCCCCC2)cs1	ZINC000088913265	192654573	/nfs/dbraw/zinc/65/45/73/192654573.db2.gz	XYBKSUITAGPELI-UHFFFAOYSA-N	0	3	302.465	2.422	10	0		DEAEHN
c1cnc(-c2ccnc(NC[C@H]3CCCCN3C3CC3)n2)cn1	ZINC000581112846	357131906	/nfs/dbraw/zinc/13/19/06/357131906.db2.gz	YQAGSAWNLLTFHV-CQSZACIVSA-N	0	3	310.405	2.362	10	0		DEAEHN
CC(C)N(Cc1ccccc1)S(=O)(=O)c1c[nH]c(CN)c1	ZINC000088915027	192657000	/nfs/dbraw/zinc/65/70/00/192657000.db2.gz	KXAUWKAJALGJPP-UHFFFAOYSA-N	0	3	307.419	2.073	10	0		DEAEHN
CN(CC(=O)NC(=O)NC1CCCCC1)C[C@H]1CC=CCC1	ZINC000581659588	357224593	/nfs/dbraw/zinc/22/45/93/357224593.db2.gz	OXBOZZPVZNZRQF-AWEZNQCLSA-N	0	3	307.438	2.433	10	0		DEAEHN
CCCNCc1cc(S(=O)(=O)N(C)[C@@H](C)CCC)cn1C	ZINC000088964509	192672442	/nfs/dbraw/zinc/67/24/42/192672442.db2.gz	JTCKCPUSDFQRAJ-ZDUSSCGKSA-N	0	3	315.483	2.334	10	0		DEAEHN
CNCc1cc(S(=O)(=O)NC2CCCCC2)cn1C(C)C	ZINC000088974796	192678111	/nfs/dbraw/zinc/67/81/11/192678111.db2.gz	YHUBZASYZVXFCH-UHFFFAOYSA-N	0	3	313.467	2.399	10	0		DEAEHN
COCc1cccc(CN2CCC[C@H](Cn3cncn3)C2)c1	ZINC000179224968	199001157	/nfs/dbraw/zinc/00/11/57/199001157.db2.gz	WTMODYQTZRESRL-KRWDZBQOSA-N	0	3	300.406	2.337	10	0		DEAEHN
CN(C)C[C@@H]1CN(CCOc2ccc(F)cc2Cl)CCO1	ZINC000179609540	199063333	/nfs/dbraw/zinc/06/33/33/199063333.db2.gz	LZLLBTNFUYXOLL-CYBMUJFWSA-N	0	3	316.804	2.120	10	0		DEAEHN
CC(C)N(CC(=O)NC12CC3CC(CC(C3)C1)C2)C[C@H](C)O	ZINC000592976815	357981072	/nfs/dbraw/zinc/98/10/72/357981072.db2.gz	WILAOBPRZIXIJK-IILDEKEXSA-N	0	3	308.466	2.163	10	0		DEAEHN
Cc1cccc(CSCC(=O)N[C@@H](CN)C(F)(F)F)c1	ZINC000594451980	358275874	/nfs/dbraw/zinc/27/58/74/358275874.db2.gz	VTUQYWQVCMACLV-NSHDSACASA-N	0	3	306.353	2.234	10	0		DEAEHN
C[C@@H](CCCc1ccccc1)C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000180862637	199219708	/nfs/dbraw/zinc/21/97/08/199219708.db2.gz	ZIYRQXBQVRNSHE-FUHWJXTLSA-N	0	3	318.461	2.434	10	0		DEAEHN
CCNCc1cc(C)c(C)c(S(=O)(=O)N[C@@H]2CC2(C)C)c1	ZINC000089014484	192697873	/nfs/dbraw/zinc/69/78/73/192697873.db2.gz	LIELITNJELQSGM-OAHLLOKOSA-N	0	3	310.463	2.490	10	0		DEAEHN
CN(c1ccccc1F)S(=O)(=O)c1cc(CN)ccc1F	ZINC000089021187	192699487	/nfs/dbraw/zinc/69/94/87/192699487.db2.gz	PSBPIXAEHIFISL-UHFFFAOYSA-N	0	3	312.341	2.249	10	0		DEAEHN
C[C@H](N[C@H]1CCCN(c2cccnn2)C1)c1cncc(F)c1	ZINC000089732202	192852092	/nfs/dbraw/zinc/85/20/92/192852092.db2.gz	UWCHAPMSUQTHGJ-WFASDCNBSA-N	0	3	301.369	2.330	10	0		DEAEHN
COc1ccc(F)cc1CNC(=O)NC[C@@H](C)N(C)C1CC1	ZINC000187090704	200060402	/nfs/dbraw/zinc/06/04/02/200060402.db2.gz	YAFJVHSJWKCENE-LLVKDONJSA-N	0	3	309.385	2.116	10	0		DEAEHN
C[C@@H]1CC[C@@](CO)(N(C)CC(=O)N(C)Cc2ccccc2F)C1	ZINC000187944510	200180877	/nfs/dbraw/zinc/18/08/77/200180877.db2.gz	ZHLOKLIWMJAHFJ-RDTXWAMCSA-N	0	3	322.424	2.267	10	0		DEAEHN
COc1ccc(F)c(C(=O)NCCN2CCCC[C@@H]2C)c1OC	ZINC000188235077	200213689	/nfs/dbraw/zinc/21/36/89/200213689.db2.gz	IZMKXZYUNXZSGI-LBPRGKRZSA-N	0	3	324.396	2.447	10	0		DEAEHN
Cc1cnn(CCNCc2cnn(Cc3ccc(F)cc3)c2)c1	ZINC000189167124	200359026	/nfs/dbraw/zinc/35/90/26/200359026.db2.gz	WGNDJCCEUFBTES-UHFFFAOYSA-N	0	3	313.380	2.365	10	0		DEAEHN
C1CN(c2nnc(C3CCOCC3)s2)C[C@@H]1N1CCCCC1	ZINC000338666494	404469743	/nfs/dbraw/zinc/46/97/43/404469743.db2.gz	UJPDNQHXCFQYJO-CQSZACIVSA-N	0	3	322.478	2.497	10	0		DEAEHN
CSCC[C@H](C)N(C)C(=O)[C@H](N)CN(C)Cc1ccccc1	ZINC000602455397	360380708	/nfs/dbraw/zinc/38/07/08/360380708.db2.gz	RXZYOLMGTTUNNB-GOEBONIOSA-N	0	3	323.506	2.046	10	0		DEAEHN
Cn1cc(CNC2CCN(Cc3ccc(Cl)cc3)CC2)nn1	ZINC000608053482	361160609	/nfs/dbraw/zinc/16/06/09/361160609.db2.gz	YRJZXPQIUXUMEU-UHFFFAOYSA-N	0	3	319.840	2.223	10	0		DEAEHN
CSCCCC(=O)Nc1ccc(-c2nnc(CN)[nH]2)cc1	ZINC000193346703	201035130	/nfs/dbraw/zinc/03/51/30/201035130.db2.gz	BHWPGAQKHZSSKE-UHFFFAOYSA-N	0	3	305.407	2.012	10	0		DEAEHN
COC[C@H](NC[C@H](C)N1CCOCC1)c1ccc(Cl)cc1	ZINC000193957471	201152315	/nfs/dbraw/zinc/15/23/15/201152315.db2.gz	INGMWVPMQDUHKV-BBRMVZONSA-N	0	3	312.841	2.338	10	0		DEAEHN
CCC(=O)N1CCOc2c(CN)cc(Br)cc2C1	ZINC000675071176	541286292	/nfs/dbraw/zinc/28/62/92/541286292.db2.gz	WTKIDPLRISRGGC-UHFFFAOYSA-N	0	3	313.195	2.039	10	0		DEAEHN
CC(=O)N1CC[C@H](N[C@@H]2C[C@@H](O)C23CCC3)c2ccccc21	ZINC000621764257	364539443	/nfs/dbraw/zinc/53/94/43/364539443.db2.gz	BWYZLMOSMUGUPW-USXIJHARSA-N	0	3	300.402	2.377	10	0		DEAEHN
CC1(C)[C@H](NCc2cccc(S(C)(=O)=O)c2)[C@@H]2CCCO[C@H]21	ZINC000449177918	240156366	/nfs/dbraw/zinc/15/63/66/240156366.db2.gz	WPJPELVLYWGYLF-ARFHVFGLSA-N	0	3	323.458	2.383	10	0		DEAEHN
C=Cn1cc(CNCC2(OCCO)CCC(F)(F)CC2)cn1	ZINC000623637592	365112359	/nfs/dbraw/zinc/11/23/59/365112359.db2.gz	BTQYJJBYVBVNPM-UHFFFAOYSA-N	0	3	315.364	2.030	10	0		DEAEHN
CN(CC[C@H]1CNCCO1)Cc1ccccc1Br	ZINC000091313776	193038285	/nfs/dbraw/zinc/03/82/85/193038285.db2.gz	YBACOHWWXUBWMU-ZDUSSCGKSA-N	0	3	313.239	2.259	10	0		DEAEHN
CN(C)[C@H]1CCCN(C(=O)C2(C(N)=S)CCCCCC2)C1	ZINC000091395330	193050320	/nfs/dbraw/zinc/05/03/20/193050320.db2.gz	FPMXCHFCMSORPN-ZDUSSCGKSA-N	0	3	311.495	2.166	10	0		DEAEHN
Cc1csc([C@@H]2CCCN([C@@H](C)CN3CCOCC3)C2)n1	ZINC000091552663	193072527	/nfs/dbraw/zinc/07/25/27/193072527.db2.gz	OJQJBFMXZLLYAW-LSDHHAIUSA-N	0	3	309.479	2.352	10	0		DEAEHN
Cc1n[nH]cc1CN1CCC[C@H](C(=O)Nc2cccc(C)n2)C1	ZINC000091686733	193091417	/nfs/dbraw/zinc/09/14/17/193091417.db2.gz	RWRMPAJBKVIIDT-AWEZNQCLSA-N	0	3	313.405	2.272	10	0		DEAEHN
C[C@H](N[C@H]1CCOC[C@@H]1O)c1cc(Br)ccc1F	ZINC000624236568	365345099	/nfs/dbraw/zinc/34/50/99/365345099.db2.gz	FREHELGYWAWVKX-HJIKLVIJSA-N	0	3	318.186	2.389	10	0		DEAEHN
Cc1ccccc1[C@H](C)N(C)C[C@H](O)CC1(O)CCOCC1	ZINC000630039924	367449605	/nfs/dbraw/zinc/44/96/05/367449605.db2.gz	ZKKCRMHUADQDMR-JKSUJKDBSA-N	0	3	307.434	2.280	10	0		DEAEHN
c1cc2c(cc1OCc1nc(CC3CC3)no1)OCCNC2	ZINC000630504046	367693683	/nfs/dbraw/zinc/69/36/83/367693683.db2.gz	MAMTZYDLAYXVEF-UHFFFAOYSA-N	0	3	301.346	2.083	10	0		DEAEHN
CCNCc1sccc1S(=O)(=O)N1C[C@H](C)[C@H](C)C1	ZINC000092113802	193161938	/nfs/dbraw/zinc/16/19/38/193161938.db2.gz	IKQHRAUSIIHKPF-PHIMTYICSA-N	0	3	302.465	2.134	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N2CCC[C@H]2C)c(F)c1	ZINC000092115735	193163261	/nfs/dbraw/zinc/16/32/61/193163261.db2.gz	NOYRZPOOCZAXCD-LLVKDONJSA-N	0	3	300.399	2.108	10	0		DEAEHN
NCc1ccc(S(=O)(=O)N2CCCCCCC2)c(F)c1	ZINC000092115569	193163397	/nfs/dbraw/zinc/16/33/97/193163397.db2.gz	SIXFUMMQJJPVOK-UHFFFAOYSA-N	0	3	300.399	2.239	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CCCCCC2)c(F)c1	ZINC000092115498	193163585	/nfs/dbraw/zinc/16/35/85/193163585.db2.gz	KTAQNHOAZPFODR-UHFFFAOYSA-N	0	3	300.399	2.110	10	0		DEAEHN
NCc1ccc(S(=O)(=O)N2CCC[C@H]3CCC[C@@H]32)c(F)c1	ZINC000092116264	193163833	/nfs/dbraw/zinc/16/38/33/193163833.db2.gz	SXVNLVRDKUDNGY-OCCSQVGLSA-N	0	3	312.410	2.238	10	0		DEAEHN
C[C@H]1CC[C@H](C)N(S(=O)(=O)c2ccc(CN)cc2F)C1	ZINC000092116280	193164235	/nfs/dbraw/zinc/16/42/35/193164235.db2.gz	NKEBNOBKMIXTIR-QWRGUYRKSA-N	0	3	300.399	2.094	10	0		DEAEHN
CC(=O)c1cccc(NC(=O)CN[C@H]2[C@@H](C)[C@H](C)O[C@H]2C)c1	ZINC000528757634	284001478	/nfs/dbraw/zinc/00/14/78/284001478.db2.gz	NDUSDBSOKGHRKA-PYERRIOISA-N	0	3	304.390	2.229	10	0		DEAEHN
CO[C@]1(C)C[C@H](NCC(=O)Nc2ccc3c(c2)OCO3)C1(C)C	ZINC000451488788	243021372	/nfs/dbraw/zinc/02/13/72/243021372.db2.gz	NAUXMJBDRYHZPB-WMLDXEAASA-N	0	3	320.389	2.147	10	0		DEAEHN
CC1(C)C[NH2+]CC[C@H]([N-]S(=O)(=O)c2ccc(Cl)s2)C1	ZINC000631979457	368479004	/nfs/dbraw/zinc/47/90/04/368479004.db2.gz	SOSZKRDOBBKSJE-VIFPVBQESA-N	0	3	322.883	2.458	10	0		DEAEHN
CCN(CC(C)(C)O)[C@H](C)C(=O)Nc1ccc(Cl)c(N)c1	ZINC000092965215	193189248	/nfs/dbraw/zinc/18/92/48/193189248.db2.gz	KSUPWOXQTSNFBM-SNVBAGLBSA-N	0	3	313.829	2.342	10	0		DEAEHN
CC(C)c1nc(N2CCS(=O)CC2)sc1CNC1CC1	ZINC000092999927	193192331	/nfs/dbraw/zinc/19/23/31/193192331.db2.gz	PKLZWVTTWKVXPE-UHFFFAOYSA-N	0	3	313.492	2.087	10	0		DEAEHN
C[C@H]1CN(CC(C)(C)O)CCN1c1nc2c(cccc2F)o1	ZINC000582157253	335012573	/nfs/dbraw/zinc/01/25/73/335012573.db2.gz	XPTXDGHGHDGIHF-NSHDSACASA-N	0	3	307.369	2.248	10	0		DEAEHN
CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)[C@@H](N)CCSC	ZINC000262125847	203206602	/nfs/dbraw/zinc/20/66/02/203206602.db2.gz	LJQWSGZKHLTNTA-SWHYSGLUSA-N	0	3	314.426	2.098	10	0		DEAEHN
O=C([C@H]1CSCCS1)N1CCCC[C@H](N2CCCC2)C1	ZINC000107531321	296143643	/nfs/dbraw/zinc/14/36/43/296143643.db2.gz	FBMPDXFDVQMOBE-UONOGXRCSA-N	0	3	314.520	2.312	10	0		DEAEHN
CN[C@@H](c1cccc(C(F)(F)F)c1)[C@H]1CN(C)CCN1C	ZINC000093894382	193325410	/nfs/dbraw/zinc/32/54/10/193325410.db2.gz	TUTNGVHBTVLJPB-KGLIPLIRSA-N	0	3	301.356	2.212	10	0		DEAEHN
CCNCc1ccc(S(=O)(=O)N[C@@H]2CCCC2(C)C)o1	ZINC000094332923	193359375	/nfs/dbraw/zinc/35/93/75/193359375.db2.gz	RPKXHVSJUONAIK-GFCCVEGCSA-N	0	3	300.424	2.246	10	0		DEAEHN
C[C@@]1(c2nc(-c3ncc(Cl)cc3Cl)no2)COC[C@H]1N	ZINC000094199330	193348604	/nfs/dbraw/zinc/34/86/04/193348604.db2.gz	HYMMURRUEZVWMM-PRHODGIISA-N	0	3	315.160	2.054	10	0		DEAEHN
CCC(N)(CC)C(=O)Nc1ccc(Cl)c(C(=O)N(C)C)c1	ZINC000094244044	193354559	/nfs/dbraw/zinc/35/45/59/193354559.db2.gz	IHDZEEOWSGMDCZ-UHFFFAOYSA-N	0	3	311.813	2.498	10	0		DEAEHN
CN[C@H](C)c1c(C)nn([C@H]2CCC[C@H](S(C)(=O)=O)C2)c1C	ZINC000094643986	193389846	/nfs/dbraw/zinc/38/98/46/193389846.db2.gz	IMSHDHNJSMPGKM-SWHYSGLUSA-N	0	3	313.467	2.309	10	0		DEAEHN
CCS(=O)(=O)c1ccc(NC(=O)[C@@H](CN)CC(C)C)cc1	ZINC000094697652	193391929	/nfs/dbraw/zinc/39/19/29/193391929.db2.gz	NDLUSELVECGYGE-GFCCVEGCSA-N	0	3	312.435	2.040	10	0		DEAEHN
CCOC(=O)C[C@]1(N2CCN(C)CC2)CSCC(C)(C)C1	ZINC000094491546	193373269	/nfs/dbraw/zinc/37/32/69/193373269.db2.gz	BYAJIIHJWUDNMD-MRXNPFEDSA-N	0	3	314.495	2.089	10	0		DEAEHN
Brc1cccn2nc(N[C@@H]3CCN(C4CC4)C3)nc12	ZINC000094604931	193384014	/nfs/dbraw/zinc/38/40/14/193384014.db2.gz	YQPDDXZMLVNOON-SECBINFHSA-N	0	3	322.210	2.140	10	0		DEAEHN
COc1ccc(C[C@H](C)N[C@H]2C[C@H]3CCCCN3C2=O)cc1	ZINC000453429537	245135889	/nfs/dbraw/zinc/13/58/89/245135889.db2.gz	IKAPJWWRKGZZNX-LXZKKBNFSA-N	0	3	302.418	2.369	10	0		DEAEHN
O=C(NCc1nccn1-c1ccccc1)[C@@H](C1CC1)N1CCCC1	ZINC000282808900	217265608	/nfs/dbraw/zinc/26/56/08/217265608.db2.gz	PCOWPSFZXKVGLZ-GOSISDBHSA-N	0	3	324.428	2.363	10	0		DEAEHN
CCCC1=Nc2ncnn2[C@@H](c2cc[nH]c2)C1C(=O)OCC	ZINC000017030679	182068887	/nfs/dbraw/zinc/06/88/87/182068887.db2.gz	JHAGTWPHUSXNIO-ZDUSSCGKSA-N	0	3	301.350	2.238	10	0		DEAEHN
COCCCNCC(=O)Nc1cccc(Br)c1	ZINC000034938157	182745258	/nfs/dbraw/zinc/74/52/58/182745258.db2.gz	DYFHJYVPRFYSBO-UHFFFAOYSA-N	0	3	301.184	2.014	10	0		DEAEHN
CC[C@H]1CN([C@@H](CN)c2ccc(Br)o2)CCO1	ZINC000036769387	182842446	/nfs/dbraw/zinc/84/24/46/182842446.db2.gz	IIIVTQIENQTQQJ-UWVGGRQHSA-N	0	3	303.200	2.153	10	0		DEAEHN
COC(=O)C(C)(C)N1CCN(c2ccnc3ccccc32)CC1	ZINC000489941598	248856263	/nfs/dbraw/zinc/85/62/63/248856263.db2.gz	VNJUXBRYCKXNSG-UHFFFAOYSA-N	0	3	313.401	2.308	10	0		DEAEHN
CO[C@@H]1CN[C@@H](C(=O)Nc2ccc3nc(SC)sc3c2)C1	ZINC000040632872	183111475	/nfs/dbraw/zinc/11/14/75/183111475.db2.gz	DMRXGIXEPTWSJK-GXSJLCMTSA-N	0	3	323.443	2.334	10	0		DEAEHN
COc1ccc([C@@H](CNC(=O)c2cscn2)N(C)C)cc1	ZINC000041499437	183194309	/nfs/dbraw/zinc/19/43/09/183194309.db2.gz	IYFNYQOZCWKNBJ-CQSZACIVSA-N	0	3	305.403	2.184	10	0		DEAEHN
CCCNCc1cccc(Br)c1OCC(=O)NC	ZINC000042411800	183266108	/nfs/dbraw/zinc/26/61/08/183266108.db2.gz	COHHREGEKASSGJ-UHFFFAOYSA-N	0	3	315.211	2.074	10	0		DEAEHN
CNCc1cccc(Br)c1O[C@@H]1CCC[C@H]1O	ZINC000042411603	183266128	/nfs/dbraw/zinc/26/61/28/183266128.db2.gz	WSGHFGJYIXXDLR-VXGBXAGGSA-N	0	3	300.196	2.461	10	0		DEAEHN
COC(=O)COc1c(Br)cccc1CNC(C)C	ZINC000042411918	183266175	/nfs/dbraw/zinc/26/61/75/183266175.db2.gz	IPMJHHUGBHFMCC-UHFFFAOYSA-N	0	3	316.195	2.499	10	0		DEAEHN
C[C@H](CNC(=O)c1cc(Br)cn1C)N1CCCC1	ZINC000042506249	183277743	/nfs/dbraw/zinc/27/77/43/183277743.db2.gz	WUJJBPGOLRBUEV-SNVBAGLBSA-N	0	3	314.227	2.002	10	0		DEAEHN
COCCN([C@@H](CN)c1ccccc1Cl)[C@@H](C)COC	ZINC000042603167	183290582	/nfs/dbraw/zinc/29/05/82/183290582.db2.gz	YSNSIMYCUQRUFG-WFASDCNBSA-N	0	3	300.830	2.323	10	0		DEAEHN
CCN([C@@H](CN)c1cc2c(c(Cl)c1)OCO2)[C@@H](C)COC	ZINC000042743067	183304382	/nfs/dbraw/zinc/30/43/82/183304382.db2.gz	VIUMHEQWSDOOLR-GWCFXTLKSA-N	0	3	314.813	2.425	10	0		DEAEHN
NC[C@H](c1ccc(Br)cc1)N1CCCC[C@@H]1CO	ZINC000042954128	183321454	/nfs/dbraw/zinc/32/14/54/183321454.db2.gz	DQYIPGPJPYFZMO-ZIAGYGMSSA-N	0	3	313.239	2.296	10	0		DEAEHN
C[C@H](N)[C@H](c1cccc(Cl)c1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043014545	183327530	/nfs/dbraw/zinc/32/75/30/183327530.db2.gz	WCXGXLMDUHLYAQ-NILFDRSVSA-N	0	3	309.841	2.281	10	0		DEAEHN
CC[C@@H](N)[C@H](c1cccc(Cl)c1)N1CCC[C@@H]1C(=O)NC	ZINC000043015796	183327664	/nfs/dbraw/zinc/32/76/64/183327664.db2.gz	PHPNBFVCNLXAIM-KFWWJZLASA-N	0	3	309.841	2.329	10	0		DEAEHN
C[C@@H](N)[C@H](c1cccc(Cl)c1)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043014548	183327932	/nfs/dbraw/zinc/32/79/32/183327932.db2.gz	WCXGXLMDUHLYAQ-KCPJHIHWSA-N	0	3	309.841	2.281	10	0		DEAEHN
C[C@@H](N)[C@@H](c1ccccc1Cl)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043051531	183332570	/nfs/dbraw/zinc/33/25/70/183332570.db2.gz	LGQYOMVDLCXDMW-DFBGVHRSSA-N	0	3	309.841	2.281	10	0		DEAEHN
CC[C@H](N)c1cccc(S(=O)(=O)N(CC)[C@@H](C)COC)c1	ZINC000042782203	183308267	/nfs/dbraw/zinc/30/82/67/183308267.db2.gz	QBFSHKVXJNMBOD-WFASDCNBSA-N	0	3	314.451	2.142	10	0		DEAEHN
C[C@H](N)[C@H](c1ccccc1Cl)N1CCC[C@@H]1C(=O)N(C)C	ZINC000043051532	183333002	/nfs/dbraw/zinc/33/30/02/183333002.db2.gz	LGQYOMVDLCXDMW-NILFDRSVSA-N	0	3	309.841	2.281	10	0		DEAEHN
CC[C@H](N)[C@@H](c1ccc(Cl)s1)N1CCC[C@@H]1C(N)=O	ZINC000043252232	183347181	/nfs/dbraw/zinc/34/71/81/183347181.db2.gz	PCPVIGAHYJYSNN-SBMIAAHKSA-N	0	3	301.843	2.130	10	0		DEAEHN
C[C@@H](N)[C@H](c1ccc(Cl)s1)N(C)CC(=O)NC1CC1	ZINC000043252663	183347327	/nfs/dbraw/zinc/34/73/27/183347327.db2.gz	DTTMHWWENHWEGM-AMIZOPFISA-N	0	3	301.843	2.000	10	0		DEAEHN
CCCCN(CC(N)=O)[C@@H](c1ccc(Cl)s1)[C@@H](C)N	ZINC000043254159	183348193	/nfs/dbraw/zinc/34/81/93/183348193.db2.gz	XDJPQTCHFTYUEF-NOZJJQNGSA-N	0	3	303.859	2.377	10	0		DEAEHN
COCCCN(CCOC)[C@H](CN)c1ccc(Cl)c(F)c1	ZINC000043390595	183357859	/nfs/dbraw/zinc/35/78/59/183357859.db2.gz	XVIGTYQBZOIWNS-OAHLLOKOSA-N	0	3	318.820	2.464	10	0		DEAEHN
COCCN([C@@H](CN)c1ccc(Cl)c(F)c1)[C@@H](C)COC	ZINC000043390621	183358748	/nfs/dbraw/zinc/35/87/48/183358748.db2.gz	JONXTGJDLYLXKU-NHYWBVRUSA-N	0	3	318.820	2.462	10	0		DEAEHN
C[C@@](O)(CN1CCC(Nc2cccnn2)CC1)c1ccccc1	ZINC000105805952	194134141	/nfs/dbraw/zinc/13/41/41/194134141.db2.gz	KDPXRSBBMHPAJA-GOSISDBHSA-N	0	3	312.417	2.261	10	0		DEAEHN
CCn1cnnc1C1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000105904702	194165933	/nfs/dbraw/zinc/16/59/33/194165933.db2.gz	CTIYTAXTASFJGW-MRXNPFEDSA-N	0	3	300.406	2.211	10	0		DEAEHN
CN(C)C[C@H]1CN(Cc2ncc(-c3ccc(F)cc3)o2)CCO1	ZINC000105926132	194171067	/nfs/dbraw/zinc/17/10/67/194171067.db2.gz	KTSAGHGRXYPKLB-HNNXBMFYSA-N	0	3	319.380	2.243	10	0		DEAEHN
CCOc1ccc(CNC(=O)NC[C@@H]2CCCN2C)cc1F	ZINC000106335534	194197915	/nfs/dbraw/zinc/19/79/15/194197915.db2.gz	LEUAVJXVBRTFSE-ZDUSSCGKSA-N	0	3	309.385	2.118	10	0		DEAEHN
Cc1cc(C)cc(CN2CCN(C(C)(C)C(N)=S)CC2)c1	ZINC000109470862	194266970	/nfs/dbraw/zinc/26/69/70/194266970.db2.gz	XUIAGIWGKMVGAF-UHFFFAOYSA-N	0	3	305.491	2.486	10	0		DEAEHN
CC[C@H](C(N)=S)N1CCN(Cc2cc(C)ccc2C)CC1	ZINC000109468945	194267083	/nfs/dbraw/zinc/26/70/83/194267083.db2.gz	KFEYCGFEHGQIEE-MRXNPFEDSA-N	0	3	305.491	2.486	10	0		DEAEHN
COC[C@@H](N)Cc1nc(-c2ccccc2Br)no1	ZINC000109518135	194271007	/nfs/dbraw/zinc/27/10/07/194271007.db2.gz	JWWIROWBYLPMJG-QMMMGPOBSA-N	0	3	312.167	2.015	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N(C)[C@H]2CCCNC2)c(Cl)c1	ZINC000110928512	194371500	/nfs/dbraw/zinc/37/15/00/194371500.db2.gz	VVLXKBOQFBSQBC-NSHDSACASA-N	0	3	302.827	2.021	10	0		DEAEHN
CCCN([C@@H]1CCCNC1)S(=O)(=O)c1cccc(Cl)c1	ZINC000110942194	194371734	/nfs/dbraw/zinc/37/17/34/194371734.db2.gz	VWDIJOBWVMOUHB-CYBMUJFWSA-N	0	3	316.854	2.493	10	0		DEAEHN
CCN(CC)c1nc(Cl)nc(N[C@@H](CN(C)C)C(C)C)n1	ZINC000061539299	184173660	/nfs/dbraw/zinc/17/36/60/184173660.db2.gz	XXERVWZLCWEFOF-NSHDSACASA-N	0	3	314.865	2.369	10	0		DEAEHN
CC(C)(CC(N)=O)C[C@H](N)c1cc2c(cc1Cl)NC(=O)C2	ZINC000061825498	184188899	/nfs/dbraw/zinc/18/88/99/184188899.db2.gz	WILSVEQOGTWEMT-NSHDSACASA-N	0	3	309.797	2.126	10	0		DEAEHN
Nc1cc(Cl)ccc1NC(=O)CCCN1CCCOCC1	ZINC000061913886	184195069	/nfs/dbraw/zinc/19/50/69/184195069.db2.gz	MJJIAWXQOPECHE-UHFFFAOYSA-N	0	3	311.813	2.363	10	0		DEAEHN
CNCc1cc(Br)cnc1N1CCCO[C@H](C)C1	ZINC000061935208	184196909	/nfs/dbraw/zinc/19/69/09/184196909.db2.gz	CFHTZZFMGWAQHQ-SNVBAGLBSA-N	0	3	314.227	2.179	10	0		DEAEHN
CN(CCNc1nc2c(cc1C(N)=S)CCCC2)C1CC1	ZINC000062010451	184201348	/nfs/dbraw/zinc/20/13/48/184201348.db2.gz	XWODPIKOFXHYBU-UHFFFAOYSA-N	0	3	304.463	2.101	10	0		DEAEHN
COCCNCc1cccc(OCc2ncc(Cl)n2C)c1	ZINC000062731703	184251290	/nfs/dbraw/zinc/25/12/90/184251290.db2.gz	LSFPQLWWFJIWQC-UHFFFAOYSA-N	0	3	309.797	2.389	10	0		DEAEHN
CO[C@@H]1CN[C@H](C(=O)Nc2cc(C(F)(F)F)ccc2F)C1	ZINC000062657520	184246799	/nfs/dbraw/zinc/24/67/99/184246799.db2.gz	AWAJJOJSNMBJOZ-KWQFWETISA-N	0	3	306.259	2.160	10	0		DEAEHN
[NH3+][C@H]1CCCCC[C@H]1[N-]S(=O)(=O)c1ccc(Cl)cc1F	ZINC000063213788	184279033	/nfs/dbraw/zinc/27/90/33/184279033.db2.gz	SITMCBBSDCISDH-NWDGAFQWSA-N	0	3	320.817	2.417	10	0		DEAEHN
CN(CC1CCN(C)CC1)C(=O)C1(C(N)=S)CCCCC1	ZINC000063124821	184271553	/nfs/dbraw/zinc/27/15/53/184271553.db2.gz	ZFMWKMLKMIKLHW-UHFFFAOYSA-N	0	3	311.495	2.023	10	0		DEAEHN
CS(=O)(=O)c1ccc(S[C@H](CN)c2ccccn2)cc1	ZINC000063131263	184272225	/nfs/dbraw/zinc/27/22/25/184272225.db2.gz	PEWVJXVOXQNXHW-CQSZACIVSA-N	0	3	308.428	2.277	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@H]1C[C@@H]1C1CCCCC1	ZINC000536020221	284929391	/nfs/dbraw/zinc/92/93/91/284929391.db2.gz	UALIKBLWGPMDAC-CVEARBPZSA-N	0	3	302.422	2.183	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2CCCC2(C)C)cc(CN)c1F	ZINC000159115062	197328117	/nfs/dbraw/zinc/32/81/17/197328117.db2.gz	KPLXXPMJOGLACT-UHFFFAOYSA-N	0	3	300.399	2.156	10	0		DEAEHN
CCCCNCC(=O)Nc1cccc(CCC(=O)N(C)C)c1	ZINC000066213973	184397079	/nfs/dbraw/zinc/39/70/79/184397079.db2.gz	FQRVSTLHEHVPOO-UHFFFAOYSA-N	0	3	305.422	2.036	10	0		DEAEHN
CCCN(CCC)C(=O)c1cccc(NC(=O)CNCC)c1	ZINC000066225767	184397663	/nfs/dbraw/zinc/39/76/63/184397663.db2.gz	WKHFGYOVULVASJ-UHFFFAOYSA-N	0	3	305.422	2.497	10	0		DEAEHN
c1nc(N2CCCC2)ncc1CN1CCC[C@]2(CCCOC2)C1	ZINC000537635074	285009135	/nfs/dbraw/zinc/00/91/35/285009135.db2.gz	PUFNLMCUWUJIKB-SFHVURJKSA-N	0	3	316.449	2.469	10	0		DEAEHN
CCc1ccc([C@@H](C)N[C@@H](C)C(=O)NC(=O)NC2CC2)cc1	ZINC000119672464	195015023	/nfs/dbraw/zinc/01/50/23/195015023.db2.gz	RACQJEMCEBMHAU-NEPJUHHUSA-N	0	3	303.406	2.276	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)c1cc(-c2ccncc2)on1	ZINC000120141525	195103647	/nfs/dbraw/zinc/10/36/47/195103647.db2.gz	AKDKQZKNROBDKB-CYBMUJFWSA-N	0	3	314.389	2.341	10	0		DEAEHN
N[C@@H](c1cc(F)cc(C(F)(F)F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000159215376	197336840	/nfs/dbraw/zinc/33/68/40/197336840.db2.gz	KLFZBSYOXQUJBR-RDDDGLTNSA-N	0	3	311.300	2.279	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)CCc1nc(C(C)C)no1	ZINC000120206881	195120047	/nfs/dbraw/zinc/12/00/47/195120047.db2.gz	QYTDTVQIXZXHSA-CYBMUJFWSA-N	0	3	310.442	2.218	10	0		DEAEHN
CCC[C@@H](C)N(C)S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159072690	197324676	/nfs/dbraw/zinc/32/46/76/197324676.db2.gz	WLEFFZXMZGKCIJ-LLVKDONJSA-N	0	3	302.415	2.402	10	0		DEAEHN
CCC[C@H](C)N(C)S(=O)(=O)c1cc(C)c(F)c(CN)c1	ZINC000159072830	197324255	/nfs/dbraw/zinc/32/42/55/197324255.db2.gz	WLEFFZXMZGKCIJ-NSHDSACASA-N	0	3	302.415	2.402	10	0		DEAEHN
CCNCc1cc(S(=O)(=O)N(C)C(C)C)cc(C)c1F	ZINC000159054693	197322621	/nfs/dbraw/zinc/32/26/21/197322621.db2.gz	LKYCEZGDDZXPPS-UHFFFAOYSA-N	0	3	302.415	2.273	10	0		DEAEHN
COc1ccc([C@H](CN)N(C)[C@@H]2CCOC2)c(Cl)c1OC	ZINC000158711968	197295986	/nfs/dbraw/zinc/29/59/86/197295986.db2.gz	FLOCSCBQZCDJIS-PWSUYJOCSA-N	0	3	314.813	2.078	10	0		DEAEHN
CNCc1sc(S(=O)(=O)N2C[C@H]3CCC[C@@H]3C2)cc1C	ZINC000158768399	197299677	/nfs/dbraw/zinc/29/96/77/197299677.db2.gz	GXCVGXXNZLPMIL-VXGBXAGGSA-N	0	3	314.476	2.197	10	0		DEAEHN
CCNCc1csc(S(=O)(=O)N2C[C@@H]3CCC[C@H]3C2)c1	ZINC000158746585	197298032	/nfs/dbraw/zinc/29/80/32/197298032.db2.gz	RMGKYODMWKLMFG-STQMWFEESA-N	0	3	314.476	2.278	10	0		DEAEHN
CCN[C@H](CS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CCOC1	ZINC000158714691	197296303	/nfs/dbraw/zinc/29/63/03/197296303.db2.gz	JXRAFVZOCSBSEL-BXUZGUMPSA-N	0	3	317.838	2.128	10	0		DEAEHN
C[C@@H]1C[C@H](Nc2nc(Br)cn3ccnc23)CCN1C	ZINC000158595312	197286812	/nfs/dbraw/zinc/28/68/12/197286812.db2.gz	PQDWDXQEOCGNBS-NXEZZACHSA-N	0	3	324.226	2.386	10	0		DEAEHN
CNCc1cc(Br)cnc1N(C)CCOC(C)C	ZINC000158343916	197264635	/nfs/dbraw/zinc/26/46/35/197264635.db2.gz	LCTIQPAYUQNPQC-UHFFFAOYSA-N	0	3	316.243	2.425	10	0		DEAEHN
CCC[C@H](C(=O)NCc1ccc(OC)c(OCC)c1)N(C)C	ZINC000158438895	197272424	/nfs/dbraw/zinc/27/24/24/197272424.db2.gz	RFJAHNREVXJRTO-CQSZACIVSA-N	0	3	308.422	2.440	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)c2ccc3nc(N)sc3c2)CCN1C	ZINC000157826130	197218994	/nfs/dbraw/zinc/21/89/94/197218994.db2.gz	MQVQJNQEKFVCQO-KOLCDFICSA-N	0	3	304.419	2.091	10	0		DEAEHN
NCc1cc(Br)ccc1Oc1nccn2cnnc12	ZINC000157519632	197193254	/nfs/dbraw/zinc/19/32/54/197193254.db2.gz	GVMAQKOZTNYMRS-UHFFFAOYSA-N	0	3	320.150	2.138	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-]CC(C)(C)SC)o1	ZINC000157463621	197188778	/nfs/dbraw/zinc/18/87/78/197188778.db2.gz	KMNIIAOQQUXPOU-UHFFFAOYSA-N	0	3	320.480	2.199	10	0		DEAEHN
Cc1cc2sc(C(=O)N(C)CCN(C)C)c(N)c2c(C)n1	ZINC000157023855	197156010	/nfs/dbraw/zinc/15/60/10/197156010.db2.gz	IODKYRLALQMVHB-UHFFFAOYSA-N	0	3	306.435	2.129	10	0		DEAEHN
CCC(C)(C)[C@H]1CCCN1CC(=O)NC1CCN(C(C)=O)CC1	ZINC000156833915	197143679	/nfs/dbraw/zinc/14/36/79/197143679.db2.gz	HPRIBUNYCGUVAD-MRXNPFEDSA-N	0	3	323.481	2.014	10	0		DEAEHN
CC(C)N1CCCC[C@H]1C(=O)N1CCC(Cn2cccn2)CC1	ZINC000156675152	197132512	/nfs/dbraw/zinc/13/25/12/197132512.db2.gz	HBAGSMXWKVMCNO-KRWDZBQOSA-N	0	3	318.465	2.385	10	0		DEAEHN
Cc1cc(Oc2cccc(S(C)(=O)=O)c2)c(CN)c(C)n1	ZINC000156507847	197118840	/nfs/dbraw/zinc/11/88/40/197118840.db2.gz	KYVPDYVRBKFLQA-UHFFFAOYSA-N	0	3	306.387	2.353	10	0		DEAEHN
COCC(=O)N1CCC(N[C@H]2CSc3ccccc32)CC1	ZINC000156335199	197105658	/nfs/dbraw/zinc/10/56/58/197105658.db2.gz	GNZRHAGJRXFUSK-AWEZNQCLSA-N	0	3	306.431	2.060	10	0		DEAEHN
O=S(=O)([N-]CC[NH2+][C@@H]1CC[C@@H]1C1CCC1)c1cccs1	ZINC000558696771	291903415	/nfs/dbraw/zinc/90/34/15/291903415.db2.gz	CKJVKPYEFOYHHC-CHWSQXEVSA-N	0	3	314.476	2.195	10	0		DEAEHN
Cc1cccc([S@](=O)CC(=O)Nc2ccccc2CN)c1	ZINC000156022693	197081001	/nfs/dbraw/zinc/08/10/01/197081001.db2.gz	GQTHPEMBNDXYSM-NRFANRHFSA-N	0	3	302.399	2.200	10	0		DEAEHN
CS(=O)(=O)c1ccc(F)c(N[C@@H]2CCN3CCC[C@@H]3C2)c1	ZINC000155931458	197076165	/nfs/dbraw/zinc/07/61/65/197076165.db2.gz	MJEXWZJUCRRIAJ-VXGBXAGGSA-N	0	3	312.410	2.268	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cccc(C[S@](C)=O)c2)C1	ZINC000155406992	197051838	/nfs/dbraw/zinc/05/18/38/197051838.db2.gz	LLHGWVFQQQMTKL-JFUMZLFPSA-N	0	3	322.474	2.024	10	0		DEAEHN
COc1cc2c(cc1F)ncnc2N1CC[C@H](N2CC=CC2)C1	ZINC000302551354	533164960	/nfs/dbraw/zinc/16/49/60/533164960.db2.gz	IIXSSAMGFZYQEV-LBPRGKRZSA-N	0	3	314.364	2.228	10	0		DEAEHN
Cc1cc(C)c(C(=O)NC[C@H](O)CN2CCCCC2)c(C)c1	ZINC000154525263	196971095	/nfs/dbraw/zinc/97/10/95/196971095.db2.gz	FYRUNYDRYINDFI-INIZCTEOSA-N	0	3	304.434	2.188	10	0		DEAEHN
COc1cc(OC)cc([C@@H]2CCN(CC[C@@H]3CCOC3=O)C2)c1	ZINC000120855545	195251449	/nfs/dbraw/zinc/25/14/49/195251449.db2.gz	BINZGKSOTUOFOR-ZIAGYGMSSA-N	0	3	319.401	2.446	10	0		DEAEHN
O=C(NCC1CC1)[C@@H]1CN(Cc2cccs2)C[C@@H]2OCC[C@@H]21	ZINC000247494626	257119525	/nfs/dbraw/zinc/11/95/25/257119525.db2.gz	NTVDCPRPZOCPAV-OAGGEKHMSA-N	0	3	320.458	2.111	10	0		DEAEHN
CO[C@@H]1CCN(C[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000443613445	533413775	/nfs/dbraw/zinc/41/37/75/533413775.db2.gz	BDANGDDPAFVOJI-QWHCGFSZSA-N	0	3	303.324	2.330	10	0		DEAEHN
CO[C@@H]1CCN(C[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000443613441	533415593	/nfs/dbraw/zinc/41/55/93/533415593.db2.gz	BDANGDDPAFVOJI-CHWSQXEVSA-N	0	3	303.324	2.330	10	0		DEAEHN
Cc1cc(S(=O)(=O)N2C[C@H](N)Cc3ccccc32)c(C)s1	ZINC000070196101	291978908	/nfs/dbraw/zinc/97/89/08/291978908.db2.gz	XOFUYCNRCWXKFU-CYBMUJFWSA-N	0	3	322.455	2.444	10	0		DEAEHN
CCN1C2(CCC(C(C)(C)CC)CC2)[C@H](N)CS1(=O)=O	ZINC000725256363	542770656	/nfs/dbraw/zinc/77/06/56/542770656.db2.gz	HHXYAWVCBDEVDJ-JVWICGRDSA-N	0	3	302.484	2.344	10	0		DEAEHN
CC(C)c1ccc(/C=C\CC(=O)NC[C@]2(O)CCN(C)C2)cc1	ZINC000358068357	133119182	/nfs/dbraw/zinc/11/91/82/133119182.db2.gz	QZPPEVAKCRLTMK-PHWHVTFISA-N	0	3	316.445	2.396	10	0		DEAEHN
C[C@@H](C(=O)N1C[C@]2(CCOC2)OC(C)(C)C1)N1[C@H](C)CC[C@@H]1C	ZINC000358234736	133130499	/nfs/dbraw/zinc/13/04/99/133130499.db2.gz	JCLJQADGTSZIBN-KRXQYRFLSA-N	0	3	324.465	2.044	10	0		DEAEHN
CN1CCC(CC(=O)NCc2nc3c(s2)CCCC3)CC1	ZINC000362749294	133249448	/nfs/dbraw/zinc/24/94/48/133249448.db2.gz	WXPHCYZFDPEXFM-UHFFFAOYSA-N	0	3	307.463	2.370	10	0		DEAEHN
C/C(=C\C(C)(C)C)C(=O)N1CCC(CN2CCN(C)CC2)CC1	ZINC000373504409	133393461	/nfs/dbraw/zinc/39/34/61/133393461.db2.gz	HIYPPIGEVQWCIV-JQIJEIRASA-N	0	3	321.509	2.465	10	0		DEAEHN
Cn1cc(C(=O)NC[C@H]2CCCN(C)C2)c2cc(F)ccc21	ZINC000563768749	292072553	/nfs/dbraw/zinc/07/25/53/292072553.db2.gz	WPCVQVIPOLKAPU-GFCCVEGCSA-N	0	3	303.381	2.389	10	0		DEAEHN
Cc1ccc(CCC(=O)N2CCO[C@@H](CN(C)C)C2)c(C)c1	ZINC000116791938	292093238	/nfs/dbraw/zinc/09/32/38/292093238.db2.gz	GESGYSTURDCUIL-KRWDZBQOSA-N	0	3	304.434	2.025	10	0		DEAEHN
C[C@H]1CC[C@@H](CN2CCC(c3nnc4ccccn43)CC2)O1	ZINC000188568908	145013763	/nfs/dbraw/zinc/01/37/63/145013763.db2.gz	FISFVGCZOCXVSZ-ZFWWWQNUSA-N	0	3	300.406	2.476	10	0		DEAEHN
O=C(NCc1ccc2c(c1)CNC2)c1cc(-c2cccnc2)on1	ZINC000188725172	145016360	/nfs/dbraw/zinc/01/63/60/145016360.db2.gz	ZBZIBMAQVHSCHY-UHFFFAOYSA-N	0	3	320.352	2.270	10	0		DEAEHN
CC[C@H]1CN2CCC[C@@H]2CN1CCCCCS(=O)(=O)CC	ZINC000190909402	145049723	/nfs/dbraw/zinc/04/97/23/145049723.db2.gz	BUZFWIXPKQLPLW-JKSUJKDBSA-N	0	3	316.511	2.150	10	0		DEAEHN
Cc1ccc(S(=O)(=O)C[C@H](C)N[C@@H]2CCOC[C@@H]2C)cc1	ZINC000191834196	145065679	/nfs/dbraw/zinc/06/56/79/145065679.db2.gz	QQPCNQPARFYVHI-OFQRWUPVSA-N	0	3	311.447	2.172	10	0		DEAEHN
Cn1c2ccc(CN3CCN4CCCC[C@@H]4C3)cc2sc1=O	ZINC000192620955	145076146	/nfs/dbraw/zinc/07/61/46/145076146.db2.gz	SEGITAZJZBLRGX-CQSZACIVSA-N	0	3	317.458	2.270	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)Cc1cccc(C)c1	ZINC000246275736	145096716	/nfs/dbraw/zinc/09/67/16/145096716.db2.gz	VGNJBEXCDAMWCV-SJORKVTESA-N	0	3	322.474	2.383	10	0		DEAEHN
COc1ccc(C)cc1NC(=O)[C@H](C)N1CCN2CCC[C@H]2C1	ZINC000246293412	145097461	/nfs/dbraw/zinc/09/74/61/145097461.db2.gz	IMVKDRDQPRAORX-GJZGRUSLSA-N	0	3	317.433	2.111	10	0		DEAEHN
COc1cccc([C@@H]2C[C@@H]2C(=O)NC[C@H](C)N(C)C2CC2)c1	ZINC000246390538	145101723	/nfs/dbraw/zinc/10/17/23/145101723.db2.gz	VMJJZJZSJPJFII-ZLIFDBKOSA-N	0	3	302.418	2.398	10	0		DEAEHN
C[C@H](C(=O)NCc1ccc(Cl)cc1)N1CCN2CCC[C@H]2C1	ZINC000246391717	145101781	/nfs/dbraw/zinc/10/17/81/145101781.db2.gz	PIVXPNPRNFTMSG-CJNGLKHVSA-N	0	3	321.852	2.125	10	0		DEAEHN
Cc1ccccc1CCNC(=O)CN1CC[C@@H]2OCCC[C@H]2C1	ZINC000246515549	145104984	/nfs/dbraw/zinc/10/49/84/145104984.db2.gz	FPINEMFUQFCQGT-ROUUACIJSA-N	0	3	316.445	2.155	10	0		DEAEHN
C[C@@H]1OCC[C@H]1N[C@H](CO)c1cccc(Br)c1	ZINC000246575604	145106843	/nfs/dbraw/zinc/10/68/43/145106843.db2.gz	YGIZUKBSADCLEB-ZWKOPEQDSA-N	0	3	300.196	2.250	10	0		DEAEHN
CCc1ccccc1OCC(=O)N1C[C@@H]2CCCN2C[C@H]1C	ZINC000246770519	145113729	/nfs/dbraw/zinc/11/37/29/145113729.db2.gz	AWBKNCXGQBZLEJ-ZBFHGGJFSA-N	0	3	302.418	2.323	10	0		DEAEHN
CCn1nc(C)c(C(=O)N2C[C@H]3CCCN3C[C@H]2C)c1Cl	ZINC000246816088	145115871	/nfs/dbraw/zinc/11/58/71/145115871.db2.gz	SGDWTZWXWYUQDG-ZYHUDNBSSA-N	0	3	310.829	2.174	10	0		DEAEHN
Cc1c(C(=O)N2C[C@H]3CCCN3C[C@H]2C)cnn1C(C)(C)C	ZINC000246992838	145122554	/nfs/dbraw/zinc/12/25/54/145122554.db2.gz	FHVMOZDJMUTPOE-TZMCWYRMSA-N	0	3	304.438	2.255	10	0		DEAEHN
Cc1nccn1C[C@@H]1CCCN1[C@H](C)C(=O)NC1CCCC1	ZINC000247108436	145126313	/nfs/dbraw/zinc/12/63/13/145126313.db2.gz	QXSBISPIFKXHFK-CJNGLKHVSA-N	0	3	304.438	2.103	10	0		DEAEHN
CC[C@H](C(=O)N1C[C@@H](C)O[C@@H](c2ccc(F)cc2)C1)N(C)C	ZINC000247115877	145127062	/nfs/dbraw/zinc/12/70/62/145127062.db2.gz	UERCIXGZUAHWHM-DAXOMENPSA-N	0	3	308.397	2.454	10	0		DEAEHN
CCc1nccn1[C@@H]1CCCN([C@H](C)C(=O)N2CCCCC2)C1	ZINC000247236089	145129932	/nfs/dbraw/zinc/12/99/32/145129932.db2.gz	RUEUPRMCKCYMDT-HZPDHXFCSA-N	0	3	318.465	2.483	10	0		DEAEHN
Cc1ccc(O[C@H](C)C(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1	ZINC000247249032	145130473	/nfs/dbraw/zinc/13/04/73/145130473.db2.gz	NLJUVLKUAFRQHZ-BZUAXINKSA-N	0	3	302.418	2.457	10	0		DEAEHN
CC(=O)Nc1cccc(CN2CCS[C@@H]3COCC[C@H]32)c1	ZINC000247293569	145132180	/nfs/dbraw/zinc/13/21/80/145132180.db2.gz	UHVMQVPDPMUQEN-HZPDHXFCSA-N	0	3	306.431	2.351	10	0		DEAEHN
Cc1ncc(CN(C)C(=O)N[C@H]2CN(C(C)C)C[C@H]2C)s1	ZINC000247383202	145135472	/nfs/dbraw/zinc/13/54/72/145135472.db2.gz	PWQYPESWENARDJ-RISCZKNCSA-N	0	3	310.467	2.322	10	0		DEAEHN
Cc1cc(C)nc(SCC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)n1	ZINC000247371148	145135495	/nfs/dbraw/zinc/13/54/95/145135495.db2.gz	KUPMYDKCWFFASV-KBPBESRZSA-N	0	3	322.478	2.127	10	0		DEAEHN
C[C@@H](Cc1ccccc1F)NC(=O)N1CCN2CCC[C@H]2C1	ZINC000247473944	145138322	/nfs/dbraw/zinc/13/83/22/145138322.db2.gz	HPYKJBXDKFBRCC-ZFWWWQNUSA-N	0	3	305.397	2.246	10	0		DEAEHN
CC[S@](=O)c1ccccc1C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000247481944	145138471	/nfs/dbraw/zinc/13/84/71/145138471.db2.gz	WFKLNDXCIIWQBO-OXDBHQQFSA-N	0	3	322.474	2.273	10	0		DEAEHN
C[C@@H](C(=O)N1CCC(C)CC1)N1CC[C@@]2(O)CCCC[C@H]2C1	ZINC000248162047	145149524	/nfs/dbraw/zinc/14/95/24/145149524.db2.gz	SHWCIHJTAOYMBF-BQFCYCMXSA-N	0	3	308.466	2.260	10	0		DEAEHN
CC[C@H]1CN(c2ccccc2)CCN1C[C@@H](O)COC(C)C	ZINC000248400651	145153334	/nfs/dbraw/zinc/15/33/34/145153334.db2.gz	XVBPLXSFVSFFMF-FUHWJXTLSA-N	0	3	306.450	2.373	10	0		DEAEHN
CN(CCN1CCS[C@H]2COCC[C@H]21)Cc1ccc(F)cc1	ZINC000248558465	145158491	/nfs/dbraw/zinc/15/84/91/145158491.db2.gz	IUNSXQFDPWAQAB-SJORKVTESA-N	0	3	324.465	2.464	10	0		DEAEHN
Cc1cnc([C@@H](C)CNC(=O)N2CCN3CCC[C@H]3C2)s1	ZINC000248615973	145161384	/nfs/dbraw/zinc/16/13/84/145161384.db2.gz	LXIIKBQPCLPYKU-AAEUAGOBSA-N	0	3	308.451	2.045	10	0		DEAEHN
CCCCOC[C@H](O)CN1CCC[C@@H](n2ccnc2CC)C1	ZINC000248662234	145163534	/nfs/dbraw/zinc/16/35/34/145163534.db2.gz	YDGKGCBBKVBBHY-HZPDHXFCSA-N	0	3	309.454	2.260	10	0		DEAEHN
Cc1cncc(CN2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)c1	ZINC000248885868	145172145	/nfs/dbraw/zinc/17/21/45/145172145.db2.gz	DYWGNFNQYOAXEK-XYJFISCASA-N	0	3	303.450	2.464	10	0		DEAEHN
Cc1nn(C)cc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000249030051	145176016	/nfs/dbraw/zinc/17/60/16/145176016.db2.gz	LNBFQVBMVOYFTL-HOCLYGCPSA-N	0	3	313.405	2.295	10	0		DEAEHN
CN(C[C@@H](O)COCc1ccccc1)C[C@@H](O)CC1CCCC1	ZINC000249113435	145179226	/nfs/dbraw/zinc/17/92/26/145179226.db2.gz	RNQVFVJLLHDTCK-RBUKOAKNSA-N	0	3	321.461	2.437	10	0		DEAEHN
CC[C@H](C)NC(=O)CN1CC[C@@H](CNc2cccc(C)n2)C1	ZINC000249869256	145190897	/nfs/dbraw/zinc/19/08/97/145190897.db2.gz	IZNZTKDCPARKBS-ZFWWWQNUSA-N	0	3	304.438	2.039	10	0		DEAEHN
Cc1cc2ncc([C@H](C)NCC[C@H](C)[S@](C)=O)c(C)n2n1	ZINC000252732889	145200129	/nfs/dbraw/zinc/20/01/29/145200129.db2.gz	WZYQOMYFHDIPOA-OABGYEMISA-N	0	3	308.451	2.154	10	0		DEAEHN
COc1ccccc1/C=C\CN1CCN(C[C@@H]2CCOC2)CC1	ZINC000255548483	145204484	/nfs/dbraw/zinc/20/44/84/145204484.db2.gz	VBZRDYKBDJPCEL-AATOQMJSSA-N	0	3	316.445	2.363	10	0		DEAEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)NCCc1ccc(F)cc1	ZINC000261649021	145213918	/nfs/dbraw/zinc/21/39/18/145213918.db2.gz	FNNXFSCOIRRICK-DAYGRLMNSA-N	0	3	320.408	2.017	10	0		DEAEHN
C[C@@H](NC(=O)[C@H](N)C1CCOCC1)c1ccc2c(c1)CCCC2	ZINC000261796762	145227215	/nfs/dbraw/zinc/22/72/15/145227215.db2.gz	NWWDZHZUOWFTDL-FZKQIMNGSA-N	0	3	316.445	2.497	10	0		DEAEHN
N[C@H](C(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1)C1CCOCC1	ZINC000261794982	145227376	/nfs/dbraw/zinc/22/73/76/145227376.db2.gz	NUFVTUVMGZLURI-ZBFHGGJFSA-N	0	3	322.836	2.410	10	0		DEAEHN
NC1(C(=O)Nc2ccc(Oc3ccncc3)cc2)CCOCC1	ZINC000261881517	145236881	/nfs/dbraw/zinc/23/68/81/145236881.db2.gz	PIRAAQOKJGQTRI-UHFFFAOYSA-N	0	3	313.357	2.320	10	0		DEAEHN
c1cnn(-c2ccc(CN3CCNC[C@@H]3c3cccnc3)cc2)c1	ZINC000262232528	145270779	/nfs/dbraw/zinc/27/07/79/145270779.db2.gz	OCXDOJYMWOVYLW-LJQANCHMSA-N	0	3	319.412	2.414	10	0		DEAEHN
CCC[C@](C)(N)C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1	ZINC000262301493	145275320	/nfs/dbraw/zinc/27/53/20/145275320.db2.gz	KUJQRWSHGHTQRT-BZNIZROVSA-N	0	3	311.376	2.177	10	0		DEAEHN
Cc1ccc(CNC(=O)[C@]2(N)[C@H]3CCCO[C@H]3C2(C)C)cc1	ZINC000262553499	145291855	/nfs/dbraw/zinc/29/18/55/145291855.db2.gz	SWEWQFFAPASAJS-HDMKZQKVSA-N	0	3	302.418	2.144	10	0		DEAEHN
c1ccc(N2CCO[C@H](CN3CCC[C@@]4(CCOC4)C3)C2)cc1	ZINC000565174498	292140831	/nfs/dbraw/zinc/14/08/31/292140831.db2.gz	WYWRRLKRWHXHDN-RTBURBONSA-N	0	3	316.445	2.394	10	0		DEAEHN
CCCc1cc(NCCN2CC=C(C)CC2)n2ncnc2n1	ZINC000358326440	147114518	/nfs/dbraw/zinc/11/45/18/147114518.db2.gz	WCIRTXDTSFQDDA-UHFFFAOYSA-N	0	3	300.410	2.141	10	0		DEAEHN
NC(=O)c1ccc(CN2CC[C@@H](c3nc(C4CC4)no3)C2)cc1	ZINC000375408115	148368046	/nfs/dbraw/zinc/36/80/46/148368046.db2.gz	BDUWXKXVDINRHR-CQSZACIVSA-N	0	3	312.373	2.035	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)Nc2ccc(C(=O)OC)cc2F)C1	ZINC000111763044	401723322	/nfs/dbraw/zinc/72/33/22/401723322.db2.gz	SPDZJXFXVCTYJK-LBPRGKRZSA-N	0	3	323.368	2.218	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C[C@@H](C)c1c(C)n[nH]c1C	ZINC000127232476	401725482	/nfs/dbraw/zinc/72/54/82/401725482.db2.gz	XNPYPCQIDWGMLU-IUODEOHRSA-N	0	3	306.454	2.463	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1C[C@H](C)c2ccccc21	ZINC000111867876	401726567	/nfs/dbraw/zinc/72/65/67/401726567.db2.gz	NZKQDGRVKDLPAL-LSDHHAIUSA-N	0	3	317.433	2.431	10	0		DEAEHN
O=c1[nH]c2ccccc2cc1CN1CCC[C@@H](Cn2cncn2)C1	ZINC000111229137	401701931	/nfs/dbraw/zinc/70/19/31/401701931.db2.gz	GEHAOFQRPUSERQ-CQSZACIVSA-N	0	3	323.400	2.032	10	0		DEAEHN
CC[C@H]1CN(CCCCCn2cc(C)cn2)CCN1C[C@@H](C)O	ZINC000111227874	401702061	/nfs/dbraw/zinc/70/20/61/401702061.db2.gz	NIMXNHQSLZNIIX-MSOLQXFVSA-N	0	3	322.497	2.139	10	0		DEAEHN
CC(C)CCOCCNC(=O)CN(C(C)C)C1CCOCC1	ZINC000077322673	401810020	/nfs/dbraw/zinc/81/00/20/401810020.db2.gz	FSZFIORQZSCPOG-UHFFFAOYSA-N	0	3	314.470	2.055	10	0		DEAEHN
CC(=O)Nc1cc(C(=O)N2C[C@H]3CCCN3C[C@H]2C)ccc1F	ZINC000113222349	401770532	/nfs/dbraw/zinc/77/05/32/401770532.db2.gz	GUZUTMGWBAYIFB-BXUZGUMPSA-N	0	3	319.380	2.093	10	0		DEAEHN
C[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cnc(-c2ccccc2)nc1	ZINC000113226949	401770939	/nfs/dbraw/zinc/77/09/39/401770939.db2.gz	GBAOJSKYQZLVTB-RHSMWYFYSA-N	0	3	322.412	2.452	10	0		DEAEHN
Cc1cccc(O[C@H](C)C(=O)N2C[C@H]3CCCN3C[C@@H]2C)c1	ZINC000113229473	401771221	/nfs/dbraw/zinc/77/12/21/401771221.db2.gz	LWNKIBRCIKFMMG-ARFHVFGLSA-N	0	3	302.418	2.457	10	0		DEAEHN
Cc1cnn(-c2ccc(C(=O)N3C[C@H]4CCCN4C[C@@H]3C)cc2)c1	ZINC000113228688	401771607	/nfs/dbraw/zinc/77/16/07/401771607.db2.gz	HKUKQUPTAHLDAL-MAUKXSAKSA-N	0	3	324.428	2.489	10	0		DEAEHN
Cc1ccc(S(=O)(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1C	ZINC000113305866	401776371	/nfs/dbraw/zinc/77/63/71/401776371.db2.gz	JFTYEHIXZOKDOJ-GJZGRUSLSA-N	0	3	308.447	2.161	10	0		DEAEHN
COc1ccccc1CCNC(=O)CN1C[C@@H](C)CC[C@@H]1C	ZINC000076149379	401785240	/nfs/dbraw/zinc/78/52/40/401785240.db2.gz	NLPSCRKAWCDBGZ-GJZGRUSLSA-N	0	3	304.434	2.474	10	0		DEAEHN
CC(C)C[C@@H](CN(C)C)NC(=O)CSCc1cccnc1	ZINC000077730644	401827650	/nfs/dbraw/zinc/82/76/50/401827650.db2.gz	MDMBJAAIIHSTFQ-HNNXBMFYSA-N	0	3	309.479	2.407	10	0		DEAEHN
CCN1CCCC[C@@H]1CNC(=O)NC[C@](C)(O)CCC(C)C	ZINC000077826000	401833984	/nfs/dbraw/zinc/83/39/84/401833984.db2.gz	DMZPSZGQIMHLKT-NVXWUHKLSA-N	0	3	313.486	2.347	10	0		DEAEHN
CN(C)C(=O)c1cccc(CN2CC[C@@H](c3cnn(C)c3)C2)c1	ZINC000116313407	401849217	/nfs/dbraw/zinc/84/92/17/401849217.db2.gz	XIPZXXDCVHWZPO-MRXNPFEDSA-N	0	3	312.417	2.111	10	0		DEAEHN
CN(C)[C@H]1CCCN(S(=O)(=O)c2c(F)cccc2Cl)C1	ZINC000131796036	401856687	/nfs/dbraw/zinc/85/66/87/401856687.db2.gz	LLTVAHJCBBMTFH-JTQLQIEISA-N	0	3	320.817	2.194	10	0		DEAEHN
Cc1ccc(N2CCCC2)c(C(=O)N2CC[C@@H](N(C)C)C2)c1	ZINC000116749112	401857782	/nfs/dbraw/zinc/85/77/82/401857782.db2.gz	KFGHHNUBOJTZRI-OAHLLOKOSA-N	0	3	301.434	2.371	10	0		DEAEHN
CCOCCN1CCN(C(=O)c2cc(C(C)C)[nH]n2)C[C@H]1CC	ZINC000116767884	401857904	/nfs/dbraw/zinc/85/79/04/401857904.db2.gz	PYFKHKLVGCUMEJ-CQSZACIVSA-N	0	3	322.453	2.106	10	0		DEAEHN
Cc1cc(C)cc([C@@H](C)NC(=O)N2CCO[C@H](CN(C)C)C2)c1	ZINC000117047445	401867525	/nfs/dbraw/zinc/86/75/25/401867525.db2.gz	AKBIHHPZVSVTTM-NVXWUHKLSA-N	0	3	319.449	2.336	10	0		DEAEHN
CN1CCO[C@@H](CNCc2cccn2Cc2cccs2)C1	ZINC000119089499	401925330	/nfs/dbraw/zinc/92/53/30/401925330.db2.gz	ZARXGJMQFXHUHE-HNNXBMFYSA-N	0	3	305.447	2.018	10	0		DEAEHN
CCCN(CC(F)(F)F)C(=O)COc1ccccc1CN	ZINC000042737760	401934514	/nfs/dbraw/zinc/93/45/14/401934514.db2.gz	VEOHHBVGDVHZPZ-UHFFFAOYSA-N	0	3	304.312	2.325	10	0		DEAEHN
CCN(CC)[C@H](C)CNS(=O)(=O)c1cc(C)sc1C	ZINC000032072684	401875923	/nfs/dbraw/zinc/87/59/23/401875923.db2.gz	FZVVZHYCVVFAFK-SNVBAGLBSA-N	0	3	304.481	2.374	10	0		DEAEHN
CCc1cnc(CCNC(=O)N2CC[C@H](N3CCCC3)C2)s1	ZINC000080532175	401890231	/nfs/dbraw/zinc/89/02/31/401890231.db2.gz	CBITXGMBPUDVLI-ZDUSSCGKSA-N	0	3	322.478	2.128	10	0		DEAEHN
CN(C)C[C@H]1CN(C(=O)Nc2cc(F)ccc2Cl)CCO1	ZINC000118818005	401909630	/nfs/dbraw/zinc/90/96/30/401909630.db2.gz	LVIAPMPQRYHBAS-NSHDSACASA-N	0	3	315.776	2.273	10	0		DEAEHN
CCN(CC)CC(=O)N1CCO[C@@H](c2ccc(F)c(C)c2)C1	ZINC000134777991	401913729	/nfs/dbraw/zinc/91/37/29/401913729.db2.gz	FFWKSZQOMWHAFX-MRXNPFEDSA-N	0	3	308.397	2.376	10	0		DEAEHN
Cc1noc(CCN[C@@H](C)c2ccc(N3CCOC3=O)cc2)n1	ZINC000089518030	401950645	/nfs/dbraw/zinc/95/06/45/401950645.db2.gz	KRJXSOSQZGAMBK-NSHDSACASA-N	0	3	316.361	2.228	10	0		DEAEHN
COc1ccccc1CCN(C)C(=O)CN1CCC(C)CC1	ZINC000136452695	401968072	/nfs/dbraw/zinc/96/80/72/401968072.db2.gz	NRQVUCJPCDYPEN-UHFFFAOYSA-N	0	3	304.434	2.428	10	0		DEAEHN
CCCC[C@@H](C(=O)OC)N1CCC[C@H](Cc2nccn2C)C1	ZINC000090003379	401977907	/nfs/dbraw/zinc/97/79/07/401977907.db2.gz	VXSAECIQRJLYNZ-CABCVRRESA-N	0	3	307.438	2.406	10	0		DEAEHN
COc1ccc([C@@H](C)NC(=O)C[C@H]2CSCCN2)cc1F	ZINC000091135123	401994651	/nfs/dbraw/zinc/99/46/51/401994651.db2.gz	UUFOJWBBFDJNJM-PWSUYJOCSA-N	0	3	312.410	2.107	10	0		DEAEHN
CCOC(=O)CCN1C[C@@H](C(=O)OC)C[C@@H](c2ccccc2)C1	ZINC000135461273	401940673	/nfs/dbraw/zinc/94/06/73/401940673.db2.gz	AGOVXMGEGTXHKW-CVEARBPZSA-N	0	3	319.401	2.218	10	0		DEAEHN
C[C@H](NC[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cnccn1	ZINC000095089255	402025308	/nfs/dbraw/zinc/02/53/08/402025308.db2.gz	QPFLGWDLIKXQCY-QWHCGFSZSA-N	0	3	306.410	2.384	10	0		DEAEHN
O=C1NCCC[C@H]1N[C@H]1CCc2cc(Br)ccc21	ZINC000050395464	402027886	/nfs/dbraw/zinc/02/78/86/402027886.db2.gz	VYVNKMUKUSFSOF-QWHCGFSZSA-N	0	3	309.207	2.305	10	0		DEAEHN
CSC[C@@H]1CCCN1C(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000121395440	402033519	/nfs/dbraw/zinc/03/35/19/402033519.db2.gz	FSYJKXJHGLNWND-KBPBESRZSA-N	0	3	301.500	2.500	10	0		DEAEHN
CCC[C@@H](C(=O)N1CCO[C@]2(CCc3ccccc32)C1)N(C)C	ZINC000121536604	402042860	/nfs/dbraw/zinc/04/28/60/402042860.db2.gz	BILUSEWYCGTCQD-PKOBYXMFSA-N	0	3	316.445	2.417	10	0		DEAEHN
C[C@H](NCc1ccnn1C)c1cccc(OCCN(C)C)c1	ZINC000152186564	402080377	/nfs/dbraw/zinc/08/03/77/402080377.db2.gz	NFLZFWMYADHVKH-AWEZNQCLSA-N	0	3	302.422	2.211	10	0		DEAEHN
COCCN(CC(=O)N1CCC[C@H](C(F)(F)F)C1)CC(C)C	ZINC000122909388	402100759	/nfs/dbraw/zinc/10/07/59/402100759.db2.gz	QRCXBIHBTSSAED-ZDUSSCGKSA-N	0	3	324.387	2.392	10	0		DEAEHN
C[C@H](CO)[C@H](C)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000151882577	402063019	/nfs/dbraw/zinc/06/30/19/402063019.db2.gz	ZDDPIYUCBBNAKK-IJEWVQPXSA-N	0	3	322.424	2.171	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)c2ccc(-n3cccn3)cc2)CCN1C	ZINC000123377712	402124687	/nfs/dbraw/zinc/12/46/87/402124687.db2.gz	BXWZQBCIMPADEH-YOEHRIQHSA-N	0	3	312.417	2.427	10	0		DEAEHN
COc1ccc([C@@H](C)NC[C@H](C)N2CCOCC2)c(OC)c1	ZINC000123481221	402130209	/nfs/dbraw/zinc/13/02/09/402130209.db2.gz	ZRVQQGYFOBAULC-UONOGXRCSA-N	0	3	308.422	2.075	10	0		DEAEHN
C[C@H](C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)c1cccnc1	ZINC000123527195	402132659	/nfs/dbraw/zinc/13/26/59/402132659.db2.gz	QSCQBFFWPFXDNB-XHSDSOJGSA-N	0	3	319.449	2.191	10	0		DEAEHN
c1nc2cnccn2c1CNC[C@@H]1CSc2ccccc2O1	ZINC000566217595	292218705	/nfs/dbraw/zinc/21/87/05/292218705.db2.gz	UGUUHYBFHNAZLD-CYBMUJFWSA-N	0	3	312.398	2.372	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)N(C)[C@@H]1CCSC1	ZINC000123367708	402123945	/nfs/dbraw/zinc/12/39/45/402123945.db2.gz	JMPGMOCHNWCWQE-HZPDHXFCSA-N	0	3	321.490	2.306	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1cc(C)cc(F)c1	ZINC000153431685	402144634	/nfs/dbraw/zinc/14/46/34/402144634.db2.gz	DSVCFFAWBSCEQT-OAHLLOKOSA-N	0	3	321.396	2.015	10	0		DEAEHN
COC[C@H](C)C(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000103387370	402186411	/nfs/dbraw/zinc/18/64/11/402186411.db2.gz	DPDBKCXJXTWQBB-DOTOQJQBSA-N	0	3	304.434	2.440	10	0		DEAEHN
COC[C@@H](C)C(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000103387372	402186432	/nfs/dbraw/zinc/18/64/32/402186432.db2.gz	DPDBKCXJXTWQBB-NVXWUHKLSA-N	0	3	304.434	2.440	10	0		DEAEHN
C[C@@H]1C[C@H](N(C)C(=O)c2cccc(-c3nc[nH]n3)c2)CCN1C	ZINC000154016534	402186999	/nfs/dbraw/zinc/18/69/99/402186999.db2.gz	DWRGAVAFALARLN-IUODEOHRSA-N	0	3	313.405	2.026	10	0		DEAEHN
CCOC[C@H](O)CN[C@@H](C)c1cccc(Br)c1	ZINC000069277657	402217498	/nfs/dbraw/zinc/21/74/98/402217498.db2.gz	BASMUZNWSLHJTQ-GXFFZTMASA-N	0	3	302.212	2.497	10	0		DEAEHN
COc1cccc(C(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)c1[O-]	ZINC000107529440	402234642	/nfs/dbraw/zinc/23/46/42/402234642.db2.gz	SUJMLDWOFSXVIT-CQSZACIVSA-N	0	3	318.417	2.491	10	0		DEAEHN
C[C@H](NC[C@@]1(CCO)CCOC1)c1ccc(F)cc1N(C)C	ZINC000125727809	402247283	/nfs/dbraw/zinc/24/72/83/402247283.db2.gz	UHFIPQMGNITJJX-SUMWQHHRSA-N	0	3	310.413	2.331	10	0		DEAEHN
O=C(CCN1CCN(C2CC2)CC1)NCc1ccccc1Cl	ZINC000125926021	402257237	/nfs/dbraw/zinc/25/72/37/402257237.db2.gz	VPHOZCWVOQVZBH-UHFFFAOYSA-N	0	3	321.852	2.126	10	0		DEAEHN
CCCN(C[C@@H]1CCCCO1)C(=O)NC[C@@H]1CCCN(C)C1	ZINC000108590348	402258044	/nfs/dbraw/zinc/25/80/44/402258044.db2.gz	KTQLUNPRWJSTSK-HOTGVXAUSA-N	0	3	311.470	2.319	10	0		DEAEHN
CN(C)C[C@@H](NC(=O)c1cnn2c1CCCC2)c1ccccc1	ZINC000126047246	402262184	/nfs/dbraw/zinc/26/21/84/402262184.db2.gz	BJXVLNOSJIJUSF-MRXNPFEDSA-N	0	3	312.417	2.252	10	0		DEAEHN
C[C@@H](C(=O)N1CCO[C@@H](CN(C)C)C1)c1ccc(Cl)s1	ZINC000176608400	402323019	/nfs/dbraw/zinc/32/30/19/402323019.db2.gz	SWBLKZJGPLRCAN-MNOVXSKESA-N	0	3	316.854	2.294	10	0		DEAEHN
C[C@@H](CNC(=O)N1CCN2CCC[C@@H]2C1)Oc1cccc(F)c1	ZINC000176097419	402278295	/nfs/dbraw/zinc/27/82/95/402278295.db2.gz	JKVUQSUKZHFTBM-DZGCQCFKSA-N	0	3	321.396	2.083	10	0		DEAEHN
O=C(N[C@@H]1CCOC2(CCCC2)C1)N1CC[C@H](N2CC=CC2)C1	ZINC000157251232	402293487	/nfs/dbraw/zinc/29/34/87/402293487.db2.gz	LBVFYFYIPUCSAI-CVEARBPZSA-N	0	3	319.449	2.134	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1nc(COC)cs1	ZINC000176382151	402304351	/nfs/dbraw/zinc/30/43/51/402304351.db2.gz	GYBZYZXLRAWTHA-LBPRGKRZSA-N	0	3	312.439	2.238	10	0		DEAEHN
CC(C)C[C@H](C)C(=O)NC[C@H](O)CN1CCc2ccccc2C1	ZINC000184863187	402305202	/nfs/dbraw/zinc/30/52/02/402305202.db2.gz	HXCFZVFOTJZFDP-YJBOKZPZSA-N	0	3	318.461	2.204	10	0		DEAEHN
C[C@@H](C(=O)NC[C@@H](c1ccccc1)N(C)C)C1CCOCC1	ZINC000158554990	402308298	/nfs/dbraw/zinc/30/82/98/402308298.db2.gz	HMBHCGFAVVQTKL-PBHICJAKSA-N	0	3	304.434	2.468	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCCOCc2ccccc2)CCN1C	ZINC000176443519	402310287	/nfs/dbraw/zinc/31/02/87/402310287.db2.gz	JLTOWBBTBVLBSZ-RDJZCZTQSA-N	0	3	319.449	2.327	10	0		DEAEHN
CC(C)[C@](C)(O)CN1CCCN(C(=O)c2cccs2)CC1	ZINC000185010046	402316956	/nfs/dbraw/zinc/31/69/56/402316956.db2.gz	QDJMKXOXEAXVMS-MRXNPFEDSA-N	0	3	310.463	2.303	10	0		DEAEHN
CO[C@H](C)c1nc(C)c(C(=O)NC[C@@H]2CCCN(C)C2)s1	ZINC000176563486	402319965	/nfs/dbraw/zinc/31/99/65/402319965.db2.gz	NTUPJFJIRBSFCL-NEPJUHHUSA-N	0	3	311.451	2.231	10	0		DEAEHN
CC(C)C[C@H](CO)N(C)Cc1cc(=O)n2cc(Cl)ccc2n1	ZINC000185321008	402343145	/nfs/dbraw/zinc/34/31/45/402343145.db2.gz	RHQYOOGNPOJBRL-CQSZACIVSA-N	0	3	323.824	2.187	10	0		DEAEHN
Cc1cccc2c1ncc(C)c2NCCNC(=O)c1ccn[nH]1	ZINC000185370488	402347827	/nfs/dbraw/zinc/34/78/27/402347827.db2.gz	SSTISZYPDLCVQB-UHFFFAOYSA-N	0	3	309.373	2.417	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)CCc1nnc(C(C)C)o1	ZINC000176973618	402355965	/nfs/dbraw/zinc/35/59/65/402355965.db2.gz	RDQVLBQTPGIPQA-ZDUSSCGKSA-N	0	3	308.426	2.068	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)CCCc1nc(C2CC2)no1	ZINC000176983885	402357165	/nfs/dbraw/zinc/35/71/65/402357165.db2.gz	BLDIWXUMWTTWRF-CQSZACIVSA-N	0	3	320.437	2.212	10	0		DEAEHN
COC1(CNC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)CCCCC1	ZINC000185897454	402387715	/nfs/dbraw/zinc/38/77/15/402387715.db2.gz	MKYRSROJPTURKX-CABCVRRESA-N	0	3	311.470	2.460	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)COc1cccc(OC)c1	ZINC000177010767	402359219	/nfs/dbraw/zinc/35/92/19/402359219.db2.gz	VIZQEODSAWBFHW-CQSZACIVSA-N	0	3	306.406	2.017	10	0		DEAEHN
COc1ccc(F)cc1CC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000185603294	402365007	/nfs/dbraw/zinc/36/50/07/402365007.db2.gz	CZSWXRFPPSPMFF-HNNXBMFYSA-N	0	3	310.413	2.469	10	0		DEAEHN
CCc1oc(C(=O)OC)cc1CN1CCCN(C2CC2)CC1	ZINC000177177128	402378617	/nfs/dbraw/zinc/37/86/17/402378617.db2.gz	NWQMAIQQMIUNLU-UHFFFAOYSA-N	0	3	306.406	2.299	10	0		DEAEHN
Brc1ccc2ncc(CN[C@H]3CCCOC3)n2c1	ZINC000236765078	402381323	/nfs/dbraw/zinc/38/13/23/402381323.db2.gz	DGQXHQSPLMCIQB-NSHDSACASA-N	0	3	310.195	2.365	10	0		DEAEHN
CC(C)(C)c1ccc(OCCCN2C[C@@H](O)C[C@@H]2CO)cc1	ZINC000185179357	402331296	/nfs/dbraw/zinc/33/12/96/402331296.db2.gz	SAAQNHUOZBTDCL-CVEARBPZSA-N	0	3	307.434	2.181	10	0		DEAEHN
COC(=O)[C@](C)(O)CN[C@H](C)c1cccc(Br)c1	ZINC000228639309	402339299	/nfs/dbraw/zinc/33/92/99/402339299.db2.gz	DWUVXAKCJLTNJU-NOZJJQNGSA-N	0	3	316.195	2.024	10	0		DEAEHN
COc1cccc(F)c1[C@@H](C)NC(=O)C[C@@H]1CSCCN1	ZINC000237282567	402402389	/nfs/dbraw/zinc/40/23/89/402402389.db2.gz	FWEMQZKWKBMAOT-GHMZBOCLSA-N	0	3	312.410	2.107	10	0		DEAEHN
C[C@H]1CCCCN1CCNC(=O)Nc1ccc([S@](C)=O)cc1	ZINC000177457806	402404363	/nfs/dbraw/zinc/40/43/63/402404363.db2.gz	XAUMTIOJEMULBY-XMHCIUCPSA-N	0	3	323.462	2.420	10	0		DEAEHN
CCc1nc(CNC(=O)N(C)C[C@@H]2CCCN2CC)cs1	ZINC000177497510	402409379	/nfs/dbraw/zinc/40/93/79/402409379.db2.gz	WTDTVIQCXLPJAQ-ZDUSSCGKSA-N	0	3	310.467	2.331	10	0		DEAEHN
CC(C)C[C@H]1OCCC[C@@H]1NC(=O)N1CCCN(C2CC2)CC1	ZINC000186216247	402411306	/nfs/dbraw/zinc/41/13/06/402411306.db2.gz	YJSGTXLBTPDQAU-DLBZAZTESA-N	0	3	323.481	2.460	10	0		DEAEHN
CCC[C@H](C(=O)NC1CCN(c2cccc(C)n2)CC1)N(C)C	ZINC000162183668	402412627	/nfs/dbraw/zinc/41/26/27/402412627.db2.gz	ZEDZUWUIGPXMJG-MRXNPFEDSA-N	0	3	318.465	2.205	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCCCn1ccnc1C	ZINC000177545106	402414545	/nfs/dbraw/zinc/41/45/45/402414545.db2.gz	BYKZZNSUFXHSSJ-INIZCTEOSA-N	0	3	321.469	2.097	10	0		DEAEHN
CCC[C@H](C(=O)NCc1cccc(NC(=O)N(C)C)c1)N(C)C	ZINC000162277944	402414973	/nfs/dbraw/zinc/41/49/73/402414973.db2.gz	QQQFPDUCRYXFJK-OAHLLOKOSA-N	0	3	320.437	2.127	10	0		DEAEHN
CCOCCC1(CNC(=O)N2CCN3CCC[C@@H]3C2)CCCC1	ZINC000177620779	402421069	/nfs/dbraw/zinc/42/10/69/402421069.db2.gz	VQHIBYWVFBGJSB-MRXNPFEDSA-N	0	3	323.481	2.463	10	0		DEAEHN
CCO[C@H]1C[C@@H](N[C@H](CO)c2ccccc2)C12CCOCC2	ZINC000186341234	402422815	/nfs/dbraw/zinc/42/28/15/402422815.db2.gz	JNLJITDDJNDKLH-ZACQAIPSSA-N	0	3	305.418	2.284	10	0		DEAEHN
CNC(=O)[C@H]1CCCN1C[C@H](C)Cc1ccc(OC)c(F)c1	ZINC000186641633	402450842	/nfs/dbraw/zinc/45/08/42/402450842.db2.gz	GLBZHJCXDWGPKN-IUODEOHRSA-N	0	3	308.397	2.223	10	0		DEAEHN
CC(C)c1ccccc1NC(=O)C(=O)N1CCN2CCC[C@@H]2C1	ZINC000177683063	402426207	/nfs/dbraw/zinc/42/62/07/402426207.db2.gz	PDTAHUQIHFMQSU-CQSZACIVSA-N	0	3	315.417	2.055	10	0		DEAEHN
Cc1c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cnn1CC(C)C	ZINC000162812971	402432965	/nfs/dbraw/zinc/43/29/65/402432965.db2.gz	MUQABUXFFRSHRI-ZFWWWQNUSA-N	0	3	304.438	2.156	10	0		DEAEHN
CCN1CCC[C@@H]1CN(C)C(=O)Cc1cc(F)ccc1OC	ZINC000186588789	402445028	/nfs/dbraw/zinc/44/50/28/402445028.db2.gz	IIXCHZSOECFREQ-OAHLLOKOSA-N	0	3	308.397	2.320	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCc1ccc(COC)cc1	ZINC000177361698	402394357	/nfs/dbraw/zinc/39/43/57/402394357.db2.gz	QVTHEQFNTCQBCQ-KRWDZBQOSA-N	0	3	319.449	2.459	10	0		DEAEHN
CCc1nc(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cs1	ZINC000246119583	402511846	/nfs/dbraw/zinc/51/18/46/402511846.db2.gz	IHKDLHQGEZWOKY-WCQYABFASA-N	0	3	310.467	2.330	10	0		DEAEHN
Cn1cc(CN2CCN3CCCC[C@H]3C2)c(-c2ccncc2)n1	ZINC000245551756	402469842	/nfs/dbraw/zinc/46/98/42/402469842.db2.gz	BUMGPZPLJMNECU-KRWDZBQOSA-N	0	3	311.433	2.152	10	0		DEAEHN
CC[C@@H](C)Oc1cc(C(=O)N2CCN3CCC[C@H]3C2)ccn1	ZINC000245566636	402471428	/nfs/dbraw/zinc/47/14/28/402471428.db2.gz	RCMGPYFQOCAAHQ-HIFRSBDPSA-N	0	3	303.406	2.179	10	0		DEAEHN
COCCCCNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000245621099	402474688	/nfs/dbraw/zinc/47/46/88/402474688.db2.gz	FBVNBHSJKFPKBW-HZPDHXFCSA-N	0	3	305.422	2.158	10	0		DEAEHN
Cc1cccc(C)c1CCNC(=O)N1CCN2CCC[C@H]2C1	ZINC000178264768	402477509	/nfs/dbraw/zinc/47/75/09/402477509.db2.gz	GPGWTNXNWBBBHY-INIZCTEOSA-N	0	3	301.434	2.336	10	0		DEAEHN
Cc1nccn1CCCCNC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1	ZINC000245675987	402478418	/nfs/dbraw/zinc/47/84/18/402478418.db2.gz	FWBNNTQIMUKUAH-GOEBONIOSA-N	0	3	321.469	2.096	10	0		DEAEHN
NCC1(c2nc(Cc3ccccc3Cl)no2)CCOCC1	ZINC000166103254	402481222	/nfs/dbraw/zinc/48/12/22/402481222.db2.gz	CTCZSPPAYNRJBE-UHFFFAOYSA-N	0	3	307.781	2.321	10	0		DEAEHN
COc1cnccc1[C@@H](C)NC(=O)N(C)CC1CCN(C)CC1	ZINC000187139899	402484496	/nfs/dbraw/zinc/48/44/96/402484496.db2.gz	XKLNLHLIQMRJIW-CYBMUJFWSA-N	0	3	320.437	2.134	10	0		DEAEHN
CC[C@@H]1CN(Cc2cc(F)c(F)c(F)c2)CCN1C[C@H](C)O	ZINC000245755604	402485713	/nfs/dbraw/zinc/48/57/13/402485713.db2.gz	ONNXXNRQRCLLIG-WCQYABFASA-N	0	3	316.367	2.381	10	0		DEAEHN
C[C@H](N[C@@H]1CCCN(c2cnn(C)c2)C1)c1cncc(F)c1	ZINC000166603433	402486082	/nfs/dbraw/zinc/48/60/82/402486082.db2.gz	AWDGWYHIDIYZFH-SWLSCSKDSA-N	0	3	303.385	2.274	10	0		DEAEHN
CC[C@H](C(=O)N1CCN2CCC[C@H]2C1)c1ccc(OC)cc1	ZINC000245866494	402492775	/nfs/dbraw/zinc/49/27/75/402492775.db2.gz	QHOZPBPYUZAWDZ-RDJZCZTQSA-N	0	3	302.418	2.495	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCCc1ccccn1	ZINC000178429510	402497409	/nfs/dbraw/zinc/49/74/09/402497409.db2.gz	OAUORLAMRIFHMM-INIZCTEOSA-N	0	3	304.438	2.140	10	0		DEAEHN
COc1cnccc1[C@H](C)NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000187501515	402503399	/nfs/dbraw/zinc/50/33/99/402503399.db2.gz	FZHQXEPTKDSTFH-RDBSUJKOSA-N	0	3	320.437	2.275	10	0		DEAEHN
Cc1cc2c(cc1C)O[C@H](C(=O)N1C[C@H]3CCCN3C[C@H]1C)C2	ZINC000246815873	402545859	/nfs/dbraw/zinc/54/58/59/402545859.db2.gz	KYTLEDRGIZDUEO-KYJSFNMBSA-N	0	3	314.429	2.302	10	0		DEAEHN
C[C@@H]1CCCN(CCNC(=O)N2CC[C@]3(O)CCCC[C@H]3C2)C1	ZINC000246913203	402549048	/nfs/dbraw/zinc/54/90/48/402549048.db2.gz	FXPMEHCCHPIJIM-SOLBZPMBSA-N	0	3	323.481	2.055	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N1C[C@H](C)CCC[C@@H]1C	ZINC000246922115	402549411	/nfs/dbraw/zinc/54/94/11/402549411.db2.gz	JEMACGWFAWGGII-OWCLPIDISA-N	0	3	311.470	2.317	10	0		DEAEHN
Cc1nn(-c2ccccc2)cc1C(=O)N1CCN2CCC[C@H]2C1	ZINC000171089896	402556395	/nfs/dbraw/zinc/55/63/95/402556395.db2.gz	NKQCKJKZYPSTAD-INIZCTEOSA-N	0	3	310.401	2.101	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)C2C[C@H]3CCC[C@@H](C2)C3=O)C1	ZINC000247442907	402567189	/nfs/dbraw/zinc/56/71/89/402567189.db2.gz	SDGAVEPLJIQAMU-JDOFQRQTSA-N	0	3	306.450	2.227	10	0		DEAEHN
C[C@H](Oc1cccc(F)c1)C(=O)N1C[C@@H]2CCCN2C[C@@H]1C	ZINC000247520388	402570870	/nfs/dbraw/zinc/57/08/70/402570870.db2.gz	WQQWLVYMBRPNJE-YDHLFZDLSA-N	0	3	306.381	2.288	10	0		DEAEHN
CCC[C@H](C(=O)N1CCc2c(cccc2NC(C)=O)C1)N(C)C	ZINC000178651170	402521815	/nfs/dbraw/zinc/52/18/15/402521815.db2.gz	WVHBVZXSTPIGLP-QGZVFWFLSA-N	0	3	317.433	2.260	10	0		DEAEHN
Cc1cc(C)n2c(CN[C@@H](CO)Cc3ccccc3C)cnc2n1	ZINC000188925386	402527706	/nfs/dbraw/zinc/52/77/06/402527706.db2.gz	OFSWUTDFILXQPZ-QGZVFWFLSA-N	0	3	324.428	2.348	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)NCc2coc(-c3cccs3)n2)C1	ZINC000170827580	402529848	/nfs/dbraw/zinc/52/98/48/402529848.db2.gz	RCQKFLQMVFWKOE-LBPRGKRZSA-N	0	3	320.418	2.249	10	0		DEAEHN
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@@H](N(C)C)C2)cc1	ZINC000170834792	402530710	/nfs/dbraw/zinc/53/07/10/402530710.db2.gz	FHCONRCONAHSDG-GOEBONIOSA-N	0	3	319.449	2.362	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)C(=O)Nc2ccccc2C(C)(C)C)C1	ZINC000170845130	402532128	/nfs/dbraw/zinc/53/21/28/402532128.db2.gz	OYLWKQXSPOGZBG-CYBMUJFWSA-N	0	3	317.433	2.085	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)c2ccc(OC[C@@H]3CCCO3)cc2)C1	ZINC000170861753	402534135	/nfs/dbraw/zinc/53/41/35/402534135.db2.gz	RYSOOCRJESVBPN-RDJZCZTQSA-N	0	3	318.417	2.021	10	0		DEAEHN
CC[C@@H](C(=O)NCCN1CCc2c(Cl)cccc2C1)N(C)C	ZINC000189416518	402536158	/nfs/dbraw/zinc/53/61/58/402536158.db2.gz	ASSVKAPOMMNFGI-INIZCTEOSA-N	0	3	323.868	2.155	10	0		DEAEHN
CCc1ccc(S(=O)(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)cc1	ZINC000247669769	402574210	/nfs/dbraw/zinc/57/42/10/402574210.db2.gz	ZFTFBMAOQBBKTK-NVXWUHKLSA-N	0	3	322.474	2.354	10	0		DEAEHN
CC[C@H](COC)NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179175062	402578302	/nfs/dbraw/zinc/57/83/02/402578302.db2.gz	CTRVCRWVZHMKIO-OWCLPIDISA-N	0	3	305.422	2.156	10	0		DEAEHN
COC(=O)c1cc(C)ccc1NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000179215211	402581596	/nfs/dbraw/zinc/58/15/96/402581596.db2.gz	RVRZPBGCANRVDJ-CYBMUJFWSA-N	0	3	317.389	2.094	10	0		DEAEHN
CN1CC[C@H](NC(=O)[C@@H]2CCCc3n[nH]cc32)[C@H]1c1ccccc1	ZINC000248045298	402581658	/nfs/dbraw/zinc/58/16/58/402581658.db2.gz	MVDGVHWKKSTESJ-FHLIZLRMSA-N	0	3	324.428	2.391	10	0		DEAEHN
CCCCN(CCO)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000248146562	402583454	/nfs/dbraw/zinc/58/34/54/402583454.db2.gz	ZSMPEKLQGUKXPK-IRXDYDNUSA-N	0	3	319.449	2.236	10	0		DEAEHN
CC(C)Cn1ncc(C(=O)N2CCN3CCC[C@H]3C2)c1C1CC1	ZINC000179332112	402585155	/nfs/dbraw/zinc/58/51/55/402585155.db2.gz	KOQFPYSSLQHAKC-HNNXBMFYSA-N	0	3	316.449	2.337	10	0		DEAEHN
CC[C@@]1(CO)CCCN(C(=O)N[C@H](CC(C)C)CN(C)C)C1	ZINC000190286485	402590274	/nfs/dbraw/zinc/59/02/74/402590274.db2.gz	IFNWKXOQZWJHCG-NVXWUHKLSA-N	0	3	313.486	2.157	10	0		DEAEHN
Cc1nn(C(C)(C)C)cc1C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000248473616	402592367	/nfs/dbraw/zinc/59/23/67/402592367.db2.gz	WWHVDVBGQGHYQR-DOMZBBRYSA-N	0	3	306.454	2.405	10	0		DEAEHN
CCOCCN1CCN(Cc2cnn(C(C)C)c2)C[C@H]1CC	ZINC000179513546	402593206	/nfs/dbraw/zinc/59/32/06/402593206.db2.gz	XJSUEETVYPORLI-QGZVFWFLSA-N	0	3	308.470	2.397	10	0		DEAEHN
Cc1ccc(OC[C@@H](O)CN2CCC[C@@H](c3cc[nH]n3)C2)cc1	ZINC000249377591	402627309	/nfs/dbraw/zinc/62/73/09/402627309.db2.gz	MLACEKLCXCNXDH-CVEARBPZSA-N	0	3	315.417	2.337	10	0		DEAEHN
COC[C@H](Nc1ccc(OC2CCN(C)CC2)nc1)C1CC1	ZINC000179745051	402599712	/nfs/dbraw/zinc/59/97/12/402599712.db2.gz	ORKJNGLOOUZEBK-INIZCTEOSA-N	0	3	305.422	2.392	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)c2cc(COC(C)(C)C)on2)C1	ZINC000248644981	402601051	/nfs/dbraw/zinc/60/10/51/402601051.db2.gz	QTEIYYLRSWIEBR-IUODEOHRSA-N	0	3	323.437	2.448	10	0		DEAEHN
COc1cc(CNCCc2nnc3n2CCCCC3)ccc1O	ZINC000180106579	402607756	/nfs/dbraw/zinc/60/77/56/402607756.db2.gz	BFLJJSPXPLNSQD-UHFFFAOYSA-N	0	3	316.405	2.051	10	0		DEAEHN
CN1CC[C@H](NC(=O)COCC(F)(F)F)[C@@H]1c1ccccc1	ZINC000180189355	402609669	/nfs/dbraw/zinc/60/96/69/402609669.db2.gz	PHYXNWUAXOBZEK-JSGCOSHPSA-N	0	3	316.323	2.127	10	0		DEAEHN
OC[C@@H]1CN(CCO[C@H]2CCCCO2)C[C@H]1c1ccsc1	ZINC000248836694	402610417	/nfs/dbraw/zinc/61/04/17/402610417.db2.gz	OMHYBMUFXZQEDS-JYJNAYRXSA-N	0	3	311.447	2.299	10	0		DEAEHN
O[C@@H](CSC[C@H]1CCCO1)CN1CCc2ccccc2C1	ZINC000249013912	402617941	/nfs/dbraw/zinc/61/79/41/402617941.db2.gz	JVMBSFIJODCBAX-IAGOWNOFSA-N	0	3	307.459	2.318	10	0		DEAEHN
C[C@H]1OCCC[C@H]1C(=O)NCc1ccccc1OCCN(C)C	ZINC000190701201	402619418	/nfs/dbraw/zinc/61/94/18/402619418.db2.gz	GABQBQMKBZGCSG-GDBMZVCRSA-N	0	3	320.433	2.058	10	0		DEAEHN
COCCOc1ccc(C(=O)N[C@@H](CC(C)C)CN(C)C)cc1	ZINC000171765732	402620363	/nfs/dbraw/zinc/62/03/63/402620363.db2.gz	AYPQKWHNOTXAOB-INIZCTEOSA-N	0	3	322.449	2.418	10	0		DEAEHN
CCN1CCN(c2ccccc2NC(=O)c2cn[nH]c2C)CC1	ZINC000171794765	402623120	/nfs/dbraw/zinc/62/31/20/402623120.db2.gz	AVYQHFGLSBZLMJ-UHFFFAOYSA-N	0	3	313.405	2.112	10	0		DEAEHN
CC[C@@](C)(O)CN1CCC[C@@H](N(C)C(=O)OC(C)(C)C)C1	ZINC000249433704	402629666	/nfs/dbraw/zinc/62/96/66/402629666.db2.gz	ZPSMRUWXXHLWKE-CZUORRHYSA-N	0	3	300.443	2.479	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@@H](C)N2CCc3ccccc3C2)C1	ZINC000171865612	402629723	/nfs/dbraw/zinc/62/97/23/402629723.db2.gz	DKDKSSCQDFJUDL-CRAIPNDOSA-N	0	3	315.461	2.034	10	0		DEAEHN
Cc1csc(CCCCNC(=O)N2CCN3CCC[C@@H]3C2)n1	ZINC000171906860	402632451	/nfs/dbraw/zinc/63/24/51/402632451.db2.gz	IUQFGNNJUYCGRQ-CQSZACIVSA-N	0	3	322.478	2.264	10	0		DEAEHN
CCCOc1ccc(CNC(=O)N2CCN3CCC[C@H]3C2)cc1	ZINC000171900456	402632462	/nfs/dbraw/zinc/63/24/62/402632462.db2.gz	APMRJFMXSIIHTB-INIZCTEOSA-N	0	3	317.433	2.465	10	0		DEAEHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1nncs1	ZINC000181028094	402633176	/nfs/dbraw/zinc/63/31/76/402633176.db2.gz	WBVFXSXVWDMSBR-NSHDSACASA-N	0	3	305.407	2.180	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)NC[C@H](c2ccccc2)N(C)C)C1	ZINC000249811227	402642361	/nfs/dbraw/zinc/64/23/61/402642361.db2.gz	YVMNIDIUDCOISR-IAGOWNOFSA-N	0	3	318.465	2.073	10	0		DEAEHN
CC(C)N1CC[C@@H](Nc2cc(C(F)(F)F)nc3ncnn32)C1	ZINC000172150505	402642710	/nfs/dbraw/zinc/64/27/10/402642710.db2.gz	YGPKNNRDZSBTEH-SECBINFHSA-N	0	3	314.315	2.038	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)[C@H](C)NC(=O)CC2CCCCC2)C1	ZINC000249866778	402643263	/nfs/dbraw/zinc/64/32/63/402643263.db2.gz	IDTMJJLBBUEYRK-GOEBONIOSA-N	0	3	323.481	2.062	10	0		DEAEHN
CO[C@@H]1CN(C[C@@H](O)COc2ccc(C)cc2C)CC[C@H]1C	ZINC000251545692	402648350	/nfs/dbraw/zinc/64/83/50/402648350.db2.gz	DVPLOTXCHIHEEF-QGPMSJSTSA-N	0	3	307.434	2.400	10	0		DEAEHN
Cc1ccc(OC2CCN(CC[C@H]3CCOC3=O)CC2)nc1	ZINC000181553463	402649659	/nfs/dbraw/zinc/64/96/59/402649659.db2.gz	UHUSWAXTFUVRCC-AWEZNQCLSA-N	0	3	304.390	2.186	10	0		DEAEHN
COC(=O)c1cccc(OCCN2CC[C@@H](C)[C@H](OC)C2)c1	ZINC000251896707	402650742	/nfs/dbraw/zinc/65/07/42/402650742.db2.gz	QQKUEEKNYOWCFG-CZUORRHYSA-N	0	3	307.390	2.209	10	0		DEAEHN
CC(C)N(C)c1ccc(CN2C[C@@H](C(N)=O)CC[C@@H]2C)cn1	ZINC000191239345	402653634	/nfs/dbraw/zinc/65/36/34/402653634.db2.gz	LZLWRYURHVCVGS-ZFWWWQNUSA-N	0	3	304.438	2.012	10	0		DEAEHN
c1ccc(CCc2noc(CN3CCN4CCC[C@@H]4C3)n2)cc1	ZINC000173702855	402709000	/nfs/dbraw/zinc/70/90/00/402709000.db2.gz	BQASOIKFJOLIGY-MRXNPFEDSA-N	0	3	312.417	2.135	10	0		DEAEHN
COc1cc(CNC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)ccc1O	ZINC000173709748	402709739	/nfs/dbraw/zinc/70/97/39/402709739.db2.gz	OMNGAZWLIWHDLV-GXTWGEPZSA-N	0	3	321.421	2.025	10	0		DEAEHN
CSc1ccc(OCCN2CC[C@@H](N3CCOCC3)C2)cc1	ZINC000173947511	402721388	/nfs/dbraw/zinc/72/13/88/402721388.db2.gz	DLTFWBQPWNUUKP-OAHLLOKOSA-N	0	3	322.474	2.194	10	0		DEAEHN
CN(c1cccnn1)C1CCN(Cc2ccc(CO)cc2)CC1	ZINC000182749756	402713750	/nfs/dbraw/zinc/71/37/50/402713750.db2.gz	HOKUGHAGYBBNTJ-UHFFFAOYSA-N	0	3	312.417	2.070	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H](C)c2ccc3c(c2)OCO3)C1	ZINC000253356087	402662501	/nfs/dbraw/zinc/66/25/01/402662501.db2.gz	WHOVFRXSXIZRSD-TZMCWYRMSA-N	0	3	319.405	2.260	10	0		DEAEHN
CCOC(=O)c1csc(C2CCN(C[C@H](O)CC)CC2)n1	ZINC000191568962	402679234	/nfs/dbraw/zinc/67/92/34/402679234.db2.gz	ZZISAKDPWKPMLV-GFCCVEGCSA-N	0	3	312.435	2.270	10	0		DEAEHN
COCCN1CCN(CCCc2ccccc2OC)C[C@H]1C	ZINC000182441270	402690390	/nfs/dbraw/zinc/69/03/90/402690390.db2.gz	UIZLGBGYYSDUBL-MRXNPFEDSA-N	0	3	306.450	2.280	10	0		DEAEHN
CN1CCN([C@@H]2CCCCN(C(=O)c3cccc(F)c3)C2)CC1	ZINC000173279531	402690607	/nfs/dbraw/zinc/69/06/07/402690607.db2.gz	UWWDFIYPCNXVJD-QGZVFWFLSA-N	0	3	319.424	2.068	10	0		DEAEHN
C[C@H]1C[C@@H](N(C)C(=O)NCCOc2ccccc2)CCN1C	ZINC000173366481	402694354	/nfs/dbraw/zinc/69/43/54/402694354.db2.gz	PAEAGZFPTCVBOD-GJZGRUSLSA-N	0	3	305.422	2.190	10	0		DEAEHN
C[C@H]1CC[C@H](C(N)=O)CN1CCOc1ccc(Cl)c(F)c1	ZINC000191993003	402703181	/nfs/dbraw/zinc/70/31/81/402703181.db2.gz	VSITUUYQNBIKEP-QWRGUYRKSA-N	0	3	314.788	2.444	10	0		DEAEHN
CN(CCCN1CCN(C)CC1)Cc1ccc2ccccc2n1	ZINC000182954694	402729361	/nfs/dbraw/zinc/72/93/61/402729361.db2.gz	NWSKLINFFWLDOQ-UHFFFAOYSA-N	0	3	312.461	2.304	10	0		DEAEHN
Cc1cnc([C@@H](NC(=O)NC[C@@H]2CCCN2C)C2CC2)s1	ZINC000174350575	402737057	/nfs/dbraw/zinc/73/70/57/402737057.db2.gz	MYYWWTNZYMSEMT-STQMWFEESA-N	0	3	308.451	2.296	10	0		DEAEHN
CCCCNC(=O)CN[C@H](C)c1ccccc1-n1cccn1	ZINC000183142928	402742996	/nfs/dbraw/zinc/74/29/96/402742996.db2.gz	NSUNLYYFWRAOEV-CQSZACIVSA-N	0	3	300.406	2.439	10	0		DEAEHN
C/C(=C/c1nc([C@H]2CNCCN2C)no1)c1cccc(F)c1	ZINC000263238997	402749066	/nfs/dbraw/zinc/74/90/66/402749066.db2.gz	OJXWIYLEUFCFIH-KOTGUFOOSA-N	0	3	302.353	2.345	10	0		DEAEHN
Cc1csc([C@@H](C)NC(=O)N2CC[C@@H](N3CC=CC3)C2)n1	ZINC000174661806	402751242	/nfs/dbraw/zinc/75/12/42/402751242.db2.gz	RMUVPCALZSCOSU-CHWSQXEVSA-N	0	3	306.435	2.168	10	0		DEAEHN
C[C@H](Oc1ccccc1Cl)c1nc([C@@H]2CNCCN2C)no1	ZINC000263257049	402751299	/nfs/dbraw/zinc/75/12/99/402751299.db2.gz	QOZIDOCOGHEQOV-JQWIXIFHSA-N	0	3	322.796	2.439	10	0		DEAEHN
Cc1ccc(CCc2nc([C@@H]3CNCCN3C)no2)c(C)c1	ZINC000263319426	402758589	/nfs/dbraw/zinc/75/85/89/402758589.db2.gz	ZZNQQMNMEBKTFV-HNNXBMFYSA-N	0	3	300.406	2.048	10	0		DEAEHN
CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cn(CCC(C)C)nn1	ZINC000175004791	402770794	/nfs/dbraw/zinc/77/07/94/402770794.db2.gz	MKMDBQYGQXZMAW-HUUCEWRRSA-N	0	3	319.453	2.023	10	0		DEAEHN
CCc1ccc([C@@H](CN2CCOCC2)N[C@@H]2CCCOC2)cc1	ZINC000183563470	402776213	/nfs/dbraw/zinc/77/62/13/402776213.db2.gz	XNIFQARHTAVSFC-RTBURBONSA-N	0	3	318.461	2.391	10	0		DEAEHN
C[C@H]1COCC[C@H]1C(=O)N(Cc1ccco1)C1CCN(C)CC1	ZINC000193944618	402779700	/nfs/dbraw/zinc/77/97/00/402779700.db2.gz	JNTDMWIRXMTJOT-WMLDXEAASA-N	0	3	320.433	2.375	10	0		DEAEHN
Cc1ccc(OC2CCN(C[C@H](O)COC(C)C)CC2)nc1	ZINC000182852117	402722064	/nfs/dbraw/zinc/72/20/64/402722064.db2.gz	QEKBPWBKALDAGS-HNNXBMFYSA-N	0	3	308.422	2.019	10	0		DEAEHN
C[C@H](C(=O)N1CCC(Cn2cccn2)CC1)N1CCCCCC1	ZINC000174049452	402724842	/nfs/dbraw/zinc/72/48/42/402724842.db2.gz	JELIPGMAHVWMKV-MRXNPFEDSA-N	0	3	318.465	2.386	10	0		DEAEHN
O=C(CCN1CCCN(c2ccccn2)CC1)NC1CCCC1	ZINC000183777144	402797200	/nfs/dbraw/zinc/79/72/00/402797200.db2.gz	AZJBUODUSAPQLF-UHFFFAOYSA-N	0	3	316.449	2.043	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)CC(=O)N1c2ccccc2C[C@@H]1C	ZINC000175341409	402798519	/nfs/dbraw/zinc/79/85/19/402798519.db2.gz	VYGNXUJXTFPUJP-RDJZCZTQSA-N	0	3	315.461	2.380	10	0		DEAEHN
O=C(CCCOc1ccccc1F)N1CCN2CCC[C@@H]2C1	ZINC000195336852	402842420	/nfs/dbraw/zinc/84/24/20/402842420.db2.gz	OTZHUGCFSBYELO-CQSZACIVSA-N	0	3	306.381	2.291	10	0		DEAEHN
CCCO[C@@H]1CCCN(C(=O)NC[C@@H]2CCCN2CC)CC1	ZINC000175368402	402800725	/nfs/dbraw/zinc/80/07/25/402800725.db2.gz	BPCWJPTUDPLJTD-JKSUJKDBSA-N	0	3	311.470	2.461	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)S(=O)(=O)Cc1ccc(F)cc1	ZINC000175399692	402803040	/nfs/dbraw/zinc/80/30/40/402803040.db2.gz	YCWQUWYCLCAEKF-HNNXBMFYSA-N	0	3	314.426	2.072	10	0		DEAEHN
COc1cccc2cc([C@@H](C)NC[C@H]3CN(C)CCO3)oc21	ZINC000175424536	402806045	/nfs/dbraw/zinc/80/60/45/402806045.db2.gz	BXRBPTORODVYKP-OCCSQVGLSA-N	0	3	304.390	2.423	10	0		DEAEHN
Cc1ccc(-c2nc(CC(=O)NC[C@@H]3CCCN3C)cs2)o1	ZINC000194704514	402811939	/nfs/dbraw/zinc/81/19/39/402811939.db2.gz	GLLVSUYIKGQCRM-ZDUSSCGKSA-N	0	3	319.430	2.464	10	0		DEAEHN
C[C@H]1CN2CCC[C@@H]2CN1C(=O)c1ncccc1Br	ZINC000194902338	402821695	/nfs/dbraw/zinc/82/16/95/402821695.db2.gz	UVLPXNXZUVDRTA-WDEREUQCSA-N	0	3	324.222	2.153	10	0		DEAEHN
COc1cc(CN[C@H]2CC(=O)N(c3ccccc3)C2)ccc1O	ZINC000194977047	402824908	/nfs/dbraw/zinc/82/49/08/402824908.db2.gz	XSQBAVHEWBGLBP-AWEZNQCLSA-N	0	3	312.369	2.296	10	0		DEAEHN
COc1cc(CN2CCC[C@@H](c3nc(C)no3)C2)ccc1O	ZINC000194973449	402825027	/nfs/dbraw/zinc/82/50/27/402825027.db2.gz	ZMUGHDCNFVEIQA-CYBMUJFWSA-N	0	3	303.362	2.472	10	0		DEAEHN
CN(C)[C@@H]1CCN(C(=O)c2cnc(OCC3CC3)c(Cl)c2)C1	ZINC000184244979	402830234	/nfs/dbraw/zinc/83/02/34/402830234.db2.gz	PEGAWCMFKVQICN-CYBMUJFWSA-N	0	3	323.824	2.300	10	0		DEAEHN
C[C@@H]1CCN(C[C@H](O)Cn2cccn2)[C@@H]1c1cccc(F)c1	ZINC000175147603	402783542	/nfs/dbraw/zinc/78/35/42/402783542.db2.gz	FHWOSXPYLYQAPN-COXVUDFISA-N	0	3	303.381	2.466	10	0		DEAEHN
CC/C=C/CCN1CCN(C[C@H]2CN(C(C)C)CCO2)CC1	ZINC000184520937	402848863	/nfs/dbraw/zinc/84/88/63/402848863.db2.gz	DKKXSNZCFMFZBB-QWNKOJSDSA-N	0	3	309.498	2.070	10	0		DEAEHN
CC(=O)N(C)c1ccc(C(=O)NCCN2CCC(C)CC2)cc1	ZINC000279409335	402939734	/nfs/dbraw/zinc/93/97/34/402939734.db2.gz	DPSYNNISBRKVJX-UHFFFAOYSA-N	0	3	317.433	2.131	10	0		DEAEHN
CC(C)c1nn(C)cc1NC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1	ZINC000280823193	403040540	/nfs/dbraw/zinc/04/05/40/403040540.db2.gz	UGSDYQQQHOICNJ-OLZOCXBDSA-N	0	3	307.442	2.490	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)N[C@H]2CCc3c2cccc3O)CN1C1CC1	ZINC000267864334	403040801	/nfs/dbraw/zinc/04/08/01/403040801.db2.gz	JSJGRZNKNZHLMD-HSMVNMDESA-N	0	3	315.417	2.304	10	0		DEAEHN
C[C@H]1NC(=O)CC[C@H]1NCc1cc(Br)cs1	ZINC000282361474	403146763	/nfs/dbraw/zinc/14/67/63/403146763.db2.gz	NHVRDBYZWMLTTP-GMSGAONNSA-N	0	3	303.225	2.267	10	0		DEAEHN
C[C@@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cn[nH]c1	ZINC000285084453	403277648	/nfs/dbraw/zinc/27/76/48/403277648.db2.gz	JSWBJIXJABRAMI-CRAIPNDOSA-N	0	3	314.433	2.351	10	0		DEAEHN
CCn1nccc1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000332950422	403639739	/nfs/dbraw/zinc/63/97/39/403639739.db2.gz	VISCKNCJCNIZMC-HOCLYGCPSA-N	0	3	313.405	2.470	10	0		DEAEHN
COc1cc(OC)c2ncnc(N(C)[C@@H]3CCCN(C)C3)c2c1	ZINC000302739778	403719320	/nfs/dbraw/zinc/71/93/20/403719320.db2.gz	QFNSSUDNVARSSY-GFCCVEGCSA-N	0	3	316.405	2.177	10	0		DEAEHN
c1ncc(N2CCN3CCC2CC3)nc1OCC1CCCC1	ZINC000302761384	403722430	/nfs/dbraw/zinc/72/24/30/403722430.db2.gz	KFUORTYVRMJZCR-UHFFFAOYSA-N	0	3	302.422	2.330	10	0		DEAEHN
NC(=O)CC1(NCc2ccc(Br)s2)CCC1	ZINC000336680644	403912015	/nfs/dbraw/zinc/91/20/15/403912015.db2.gz	OFIWVDVVEBEELZ-UHFFFAOYSA-N	0	3	303.225	2.398	10	0		DEAEHN
C[C@H](N[C@H]1CCC(=O)N[C@H]1C1CC1)C(=O)N1C[C@H](C)C[C@H](C)C1	ZINC000328861360	404162979	/nfs/dbraw/zinc/16/29/79/404162979.db2.gz	ARWLBJJDZYVCNF-OLFUQESBSA-N	0	3	321.465	2.367	10	0		DEAEHN
C/C(=C\C(=O)NC[C@@H]1CN2CCC[C@H]2CO1)c1cccc(F)c1	ZINC000363515340	404170451	/nfs/dbraw/zinc/17/04/51/404170451.db2.gz	FSZKSUUWFXVWGL-JQDBKHDNSA-N	0	3	318.392	2.208	10	0		DEAEHN
CO[C@@H]1COC[C@H]1n1cc(CN[C@H]2C[C@H](C)CC(C)(C)C2)nn1	ZINC000329544931	404371674	/nfs/dbraw/zinc/37/16/74/404371674.db2.gz	ZCJLXCQDRRSIEJ-WMHQRMGPSA-N	0	3	322.453	2.169	10	0		DEAEHN
CC(C(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1)S(C)(=O)=O	ZINC000373876546	404624264	/nfs/dbraw/zinc/62/42/64/404624264.db2.gz	QDEZDHIXZBXVNU-GAFUQQFSSA-N	0	3	315.822	2.135	10	0		DEAEHN
CCOC(=O)[C@]1(C(C)C)CCN(C[C@@H](O)CC(F)(F)F)C1	ZINC000373914249	404637889	/nfs/dbraw/zinc/63/78/89/404637889.db2.gz	XZNAUWDBBRKMLC-WCQYABFASA-N	0	3	311.344	2.211	10	0		DEAEHN
CN1CCC[C@H](N2CCN(C(=O)c3ccoc3C3CC3)CC2)C1	ZINC000366944267	404877985	/nfs/dbraw/zinc/87/79/85/404877985.db2.gz	CAUSEMCFGIAJAL-HNNXBMFYSA-N	0	3	317.433	2.009	10	0		DEAEHN
CC1CCC(O)(CN2CCOC[C@@H]2[C@H]2CCCC[C@@H]2O)CC1	ZINC000408040845	405096417	/nfs/dbraw/zinc/09/64/17/405096417.db2.gz	AFTIDHSPQYCUNW-MFJUZZNBSA-N	0	3	311.466	2.180	10	0		DEAEHN
C[C@@]1(CNC(=O)CCCCO)CCCN1Cc1ccccc1	ZINC000397983320	405059431	/nfs/dbraw/zinc/05/94/31/405059431.db2.gz	NBJKANGIJJNHCL-SFHVURJKSA-N	0	3	304.434	2.320	10	0		DEAEHN
Cc1nccc(N2CCN(CCCC3CCOCC3)CC2)n1	ZINC000361432565	405073012	/nfs/dbraw/zinc/07/30/12/405073012.db2.gz	QGPVNDDLSGLPEY-UHFFFAOYSA-N	0	3	304.438	2.114	10	0		DEAEHN
C[C@@H]1C[C@@H](NC(=O)NC[C@@H]2C[C@@H](C)O[C@@H](C)C2)CN1C1CC1	ZINC000408181482	405132938	/nfs/dbraw/zinc/13/29/38/405132938.db2.gz	CYDPOVDIXSAITC-UXXRCYHCSA-N	0	3	309.454	2.114	10	0		DEAEHN
CC(C)c1noc2ncc(C(=O)N3C[C@@H]4CCN(C)[C@@H]4C3)cc21	ZINC000408463184	405211671	/nfs/dbraw/zinc/21/16/71/405211671.db2.gz	FOFWKCZIEMTGLS-SMDDNHRTSA-N	0	3	314.389	2.122	10	0		DEAEHN
CC1(O)CC(C(=O)NCCN2CCC3(CCCCC3)CC2)C1	ZINC000408462160	405211926	/nfs/dbraw/zinc/21/19/26/405211926.db2.gz	XYRKLOOAELSSIV-UHFFFAOYSA-N	0	3	308.466	2.310	10	0		DEAEHN
O=C(Nc1c[nH]nc1[C@@H]1CCCN(CCCO)C1)C1CCCC1	ZINC000368033337	405221178	/nfs/dbraw/zinc/22/11/78/405221178.db2.gz	FPSWNBNWWDUVOL-CQSZACIVSA-N	0	3	320.437	2.100	10	0		DEAEHN
CO[C@H]1C[C@H](NCc2ccc(CS(C)(=O)=O)cc2)C12CCC2	ZINC000453064639	405280430	/nfs/dbraw/zinc/28/04/30/405280430.db2.gz	SEOPFKWTRUZOQV-HOTGVXAUSA-N	0	3	323.458	2.278	10	0		DEAEHN
COC(=O)CC1(CN2CCC(C(=O)N3CCCCC3)CC2)CC1	ZINC000440707029	405323539	/nfs/dbraw/zinc/32/35/39/405323539.db2.gz	UDVKYGQXUFXERE-UHFFFAOYSA-N	0	3	322.449	2.054	10	0		DEAEHN
CCN(Cc1ccoc1)C(=O)[C@@H](N)CN(C)Cc1ccccc1	ZINC000638446731	405475227	/nfs/dbraw/zinc/47/52/27/405475227.db2.gz	ZLQUJLZOZNZEQE-KRWDZBQOSA-N	0	3	315.417	2.087	10	0		DEAEHN
CS(=O)(=O)[C@H]1CCC[C@H](NCc2ccc(-c3cc[nH]n3)o2)C1	ZINC000577816113	405517556	/nfs/dbraw/zinc/51/75/56/405517556.db2.gz	GAGWYPYHKLHPKA-AAEUAGOBSA-N	0	3	323.418	2.115	10	0		DEAEHN
Cn1ccc(N2CCC[C@H](N[C@@H]3CC[C@H]3C3CCC3)C2=O)n1	ZINC000558696371	405691610	/nfs/dbraw/zinc/69/16/10/405691610.db2.gz	UHUGSZYLQONHLW-ZNMIVQPWSA-N	0	3	302.422	2.084	10	0		DEAEHN
O[C@]1(c2cn[nH]n2)CCN(Cc2ccc(-c3ccccc3)o2)C1	ZINC000583617303	405774977	/nfs/dbraw/zinc/77/49/77/405774977.db2.gz	DKBQYIXTUDVDML-QGZVFWFLSA-N	0	3	310.357	2.158	10	0		DEAEHN
CCn1nncc1CN1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000459517674	405937556	/nfs/dbraw/zinc/93/75/56/405937556.db2.gz	RHLAXDVRSOHINA-MRXNPFEDSA-N	0	3	313.449	2.252	10	0		DEAEHN
CC(C)(C)OC(=O)[C@]1(C)CCN(C[C@H](O)CC(F)(F)F)C1	ZINC000459565794	405958945	/nfs/dbraw/zinc/95/89/45/405958945.db2.gz	SJGWGFRKKWIRQW-ZWNOBZJWSA-N	0	3	311.344	2.353	10	0		DEAEHN
Cc1ccc(-c2cccc(CNC[C@@H](O)Cn3ccnn3)c2)cc1	ZINC000459700568	406010400	/nfs/dbraw/zinc/01/04/00/406010400.db2.gz	PUTIZCQVRWNBDU-LJQANCHMSA-N	0	3	322.412	2.404	10	0		DEAEHN
CC(=O)[C@@](C)(O)CN[C@@H](C)c1ccc(-n2cccn2)c(F)c1	ZINC000451067818	406037408	/nfs/dbraw/zinc/03/74/08/406037408.db2.gz	AIZDFFOWGYVSHX-ZBEGNZNMSA-N	0	3	305.353	2.002	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@@H]1CCc2cc(F)ccc21	ZINC000533811727	406161660	/nfs/dbraw/zinc/16/16/60/406161660.db2.gz	ICMNCSSBKSZTSM-MRXNPFEDSA-N	0	3	314.364	2.041	10	0		DEAEHN
c1nc2n(n1)[C@H](CN1CCC[C@H]1c1ccc3c(c1)OCO3)CC2	ZINC000639473997	406105524	/nfs/dbraw/zinc/10/55/24/406105524.db2.gz	QVKILVXEUOGHGC-KBPBESRZSA-N	0	3	312.373	2.331	10	0		DEAEHN
c1c2cccnc2oc1CN[C@@H]1CCCN(c2ncccn2)C1	ZINC000519521848	406204075	/nfs/dbraw/zinc/20/40/75/406204075.db2.gz	SDNMANNRVQHNHU-CQSZACIVSA-N	0	3	309.373	2.376	10	0		DEAEHN
c1c2cccnc2oc1CN[C@H]1CCCN(c2ncccn2)C1	ZINC000519521845	406204124	/nfs/dbraw/zinc/20/41/24/406204124.db2.gz	SDNMANNRVQHNHU-AWEZNQCLSA-N	0	3	309.373	2.376	10	0		DEAEHN
c1cc(N2CCCN(Cc3nc(CC4CC4)no3)CC2)ccn1	ZINC000639684715	406205251	/nfs/dbraw/zinc/20/52/51/406205251.db2.gz	KJLKOVBXEUUFPI-UHFFFAOYSA-N	0	3	313.405	2.129	10	0		DEAEHN
O=C(NCCNc1ccncc1)N[C@@H]1CCCc2sccc21	ZINC000547361741	406402172	/nfs/dbraw/zinc/40/21/72/406402172.db2.gz	DAEXAMSTHGJIPE-CQSZACIVSA-N	0	3	316.430	2.354	10	0		DEAEHN
c1c(CN2CCC[C@@H]2C2CCCC2)nnn1C[C@H]1CCOC1	ZINC000637966290	406500358	/nfs/dbraw/zinc/50/03/58/406500358.db2.gz	XDWKADJCVXUOIR-RHSMWYFYSA-N	0	3	304.438	2.469	10	0		DEAEHN
CN(Cc1ccc(Cl)cc1Cl)C(=O)[C@@H]1OCC[C@@H]1N	ZINC000637882761	406460736	/nfs/dbraw/zinc/46/07/36/406460736.db2.gz	YDBRRTPXUMCPHU-NWDGAFQWSA-N	0	3	303.189	2.068	10	0		DEAEHN
CC(C)CC1(CNC(=O)[C@@H](N)CN(C)Cc2ccccc2)CC1	ZINC000638044857	406540983	/nfs/dbraw/zinc/54/09/83/406540983.db2.gz	NKPCLYJVJLALIO-KRWDZBQOSA-N	0	3	317.477	2.388	10	0		DEAEHN
CC(=O)N1CCN(C[C@H]2CCN(c3ccccc3)C2)[C@@H](C)C1	ZINC000638094314	406567480	/nfs/dbraw/zinc/56/74/80/406567480.db2.gz	RBVVSGLSMLLGFG-DOTOQJQBSA-N	0	3	301.434	2.066	10	0		DEAEHN
CN(Cc1ccccc1)C[C@@H](N)C(=O)N(CC1CC1)CC1CC1	ZINC000638007074	406520680	/nfs/dbraw/zinc/52/06/80/406520680.db2.gz	LCGWLURUCBMLRK-GOSISDBHSA-N	0	3	315.461	2.094	10	0		DEAEHN
CN(C)CCc1ccccc1NC(=O)C(=O)NCCCC1CC1	ZINC000527329349	406619769	/nfs/dbraw/zinc/61/97/69/406619769.db2.gz	LSWYIELOAOBHOC-UHFFFAOYSA-N	0	3	317.433	2.036	10	0		DEAEHN
c1nc(N2CCCC2)ncc1CNC[C@@H]1CCN1C1CCCC1	ZINC000527807039	406758095	/nfs/dbraw/zinc/75/80/95/406758095.db2.gz	LOOOMOCXIMZATM-KRWDZBQOSA-N	0	3	315.465	2.183	10	0		DEAEHN
O[C@H]1CCN([C@H]2CCC[C@H]2NCc2cc(-c3ccco3)on2)C1	ZINC000643963456	407066222	/nfs/dbraw/zinc/06/62/22/407066222.db2.gz	XLNPSFHXGZIOAT-ZNMIVQPWSA-N	0	3	317.389	2.012	10	0		DEAEHN
CC(C)[C@H](NC(=O)C(C)(C)N1CCNCC1)c1cccs1	ZINC000129630536	196063137	/nfs/dbraw/zinc/06/31/37/196063137.db2.gz	MOBMOFNCWQVWEE-AWEZNQCLSA-N	0	3	309.479	2.245	10	0		DEAEHN
COCCNCCOc1ccc(OC)cc1Br	ZINC000129643322	196064434	/nfs/dbraw/zinc/06/44/34/196064434.db2.gz	HJHKZAZXDSAWFK-UHFFFAOYSA-N	0	3	304.184	2.073	10	0		DEAEHN
CCN[C@@H](Cc1nccn1C)c1ccc(Br)cn1	ZINC000130871664	196119189	/nfs/dbraw/zinc/11/91/89/196119189.db2.gz	TWYPRTQPQBPRPC-LBPRGKRZSA-N	0	3	309.211	2.471	10	0		DEAEHN
CCN(C)CCNC(=O)c1sc2cc(OC)ccc2c1N	ZINC000131251876	196154518	/nfs/dbraw/zinc/15/45/18/196154518.db2.gz	KBTUSKAYXZFBRD-UHFFFAOYSA-N	0	3	307.419	2.174	10	0		DEAEHN
N[C@@H](CSc1ncns1)c1ccc2c(c1)OCCCO2	ZINC000131325611	196160569	/nfs/dbraw/zinc/16/05/69/196160569.db2.gz	XEDCJZPTVAUZDH-JTQLQIEISA-N	0	3	309.416	2.492	10	0		DEAEHN
CNCc1ccc(S(=O)(=O)N2CC[C@H](C)[C@@H](C)C2)s1	ZINC000131751110	196195824	/nfs/dbraw/zinc/19/58/24/196195824.db2.gz	QQBKZEWLDRYZHJ-QWRGUYRKSA-N	0	3	302.465	2.134	10	0		DEAEHN
CC(C)C[C@H](O)c1c(Br)cnn1CCN(C)C	ZINC000132155252	196230643	/nfs/dbraw/zinc/23/06/43/196230643.db2.gz	YHRGLZAVELRXEE-NSHDSACASA-N	0	3	304.232	2.287	10	0		DEAEHN
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)C1(N)CCOCC1	ZINC000132157652	196231533	/nfs/dbraw/zinc/23/15/33/196231533.db2.gz	BEGZHDPVYRHVHN-UHFFFAOYSA-N	0	3	317.216	2.460	10	0		DEAEHN
CCCC[C@H](O)c1c(Br)cnn1CCN(C)C	ZINC000132190807	196233949	/nfs/dbraw/zinc/23/39/49/196233949.db2.gz	ONEORZPANQHHBK-NSHDSACASA-N	0	3	304.232	2.431	10	0		DEAEHN
C[C@@H]1CCCCN1CCNC(=O)N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2	ZINC000245564227	287270202	/nfs/dbraw/zinc/27/02/02/287270202.db2.gz	WEGOXVASBRBSHQ-QKPAOTATSA-N	0	3	321.465	2.118	10	0		DEAEHN
CCN[C@@H](C[C@@H]1CCCN(S(C)(=O)=O)C1)c1occc1C	ZINC000133190136	196320367	/nfs/dbraw/zinc/32/03/67/196320367.db2.gz	GANNZJBDVUVLLB-KBPBESRZSA-N	0	3	314.451	2.300	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@@H](C)CCSC)o1	ZINC000133218119	196321667	/nfs/dbraw/zinc/32/16/67/196321667.db2.gz	NVNAHSHTBKDSMC-NSHDSACASA-N	0	3	320.480	2.199	10	0		DEAEHN
CCC[NH2+]Cc1ccc(S(=O)(=O)[N-][C@H](C)CCSC)o1	ZINC000133218324	196321710	/nfs/dbraw/zinc/32/17/10/196321710.db2.gz	NVNAHSHTBKDSMC-LLVKDONJSA-N	0	3	320.480	2.199	10	0		DEAEHN
CCOCCCN(CC(F)(F)F)C(=O)[C@@]1(C)CCCCN1	ZINC000133253627	196325362	/nfs/dbraw/zinc/32/53/62/196325362.db2.gz	FAXURQFBWQFGSK-CYBMUJFWSA-N	0	3	310.360	2.336	10	0		DEAEHN
CN[C@@H](Cc1cc(C)ccc1OC)[C@@H]1CCCCS1(=O)=O	ZINC000133306668	196329590	/nfs/dbraw/zinc/32/95/90/196329590.db2.gz	KYGICFOWIPPZCC-HOCLYGCPSA-N	0	3	311.447	2.101	10	0		DEAEHN
CCN(CC)Cc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1	ZINC000133943788	196347740	/nfs/dbraw/zinc/34/77/40/196347740.db2.gz	LVHZOUYJABLGOV-UHFFFAOYSA-N	0	3	310.341	2.195	10	0		DEAEHN
COc1ccc(C[C@H](N)c2ccnn2C)cc1Br	ZINC000137175489	196568206	/nfs/dbraw/zinc/56/82/06/196568206.db2.gz	IKHHOGNYKYPDTM-NSHDSACASA-N	0	3	310.195	2.434	10	0		DEAEHN
Cc1cccc(N2CCN(CCCNCc3cocn3)CC2)c1	ZINC000192283117	225131352	/nfs/dbraw/zinc/13/13/52/225131352.db2.gz	PWYBFQMHOJVXOE-UHFFFAOYSA-N	0	3	314.433	2.285	10	0		DEAEHN
Cc1cc(NCCN2CC=C(C)CC2)nc(-c2ccccn2)n1	ZINC000358349688	424822063	/nfs/dbraw/zinc/82/20/63/424822063.db2.gz	ZQQRVRBDALSUKA-UHFFFAOYSA-N	0	3	309.417	2.911	10	0		DEAEHN
Cc1ccccc1OCCCC(=O)N1CCN2CCC[C@H]2C1	ZINC000195327692	424882967	/nfs/dbraw/zinc/88/29/67/424882967.db2.gz	NFFSRQJLGZVYNK-INIZCTEOSA-N	0	3	302.418	2.461	10	0		DEAEHN
c1cc(CN[C@@H]2CO[C@H](C3CC3)C2)cc(N2CCSCC2)n1	ZINC000639386458	424857837	/nfs/dbraw/zinc/85/78/37/424857837.db2.gz	IVMHOZRRDYLZFP-HOTGVXAUSA-N	0	3	319.474	2.292	10	0		DEAEHN
O[C@]1(CCNCc2ccc(Br)s2)CCOC1	ZINC000404189317	424926073	/nfs/dbraw/zinc/92/60/73/424926073.db2.gz	IDSGKMAAYSVBBX-LLVKDONJSA-N	0	3	306.225	2.142	10	0		DEAEHN
CCCN(CCN(C)C)C(=O)c1nscc1Br	ZINC000405041937	424930633	/nfs/dbraw/zinc/93/06/33/424930633.db2.gz	SQXAFNACECUTQQ-UHFFFAOYSA-N	0	3	320.256	2.319	10	0		DEAEHN
CCc1ccccc1S(=O)(=O)N1C[C@H]2CCCN2C[C@@H]1C	ZINC000186985974	267657117	/nfs/dbraw/zinc/65/71/17/267657117.db2.gz	QRBJFOOLPJEWEM-DZGCQCFKSA-N	0	3	308.447	2.106	10	0		DEAEHN
CC(C)CCC[C@@H](C)NC(=O)NC[C@H](O)CN1CCCCC1	ZINC000192804463	267744847	/nfs/dbraw/zinc/74/48/47/267744847.db2.gz	DMDZTLXABQCDJI-CVEARBPZSA-N	0	3	313.486	2.347	10	0		DEAEHN
Cc1ccccc1SCC(=O)N(C)[C@@H](CN)C(F)(F)F	ZINC000662976376	425770654	/nfs/dbraw/zinc/77/06/54/425770654.db2.gz	OSLLLLKRZBNQQP-NSHDSACASA-N	0	3	306.353	2.435	10	0		DEAEHN
Cc1ccc(CN(CCN(C)C)C(=O)[C@H]2CCOC[C@H]2C)o1	ZINC000194690626	268554281	/nfs/dbraw/zinc/55/42/81/268554281.db2.gz	KARMMOCTBZSEOX-CJNGLKHVSA-N	0	3	308.422	2.151	10	0		DEAEHN
CCN1CC[C@H](NC(=O)N2CCC[C@@H]2c2noc(C(C)C)n2)C1	ZINC000334110197	269019619	/nfs/dbraw/zinc/01/96/19/269019619.db2.gz	BDAOKGJBHDMDPI-QWHCGFSZSA-N	0	3	321.425	2.134	10	0		DEAEHN
COC[C@H](CN[C@@H](C)c1ccc(Br)cn1)OC	ZINC000516829976	269369986	/nfs/dbraw/zinc/36/99/86/269369986.db2.gz	JVNQPJDSDMAUAB-ONGXEEELSA-N	0	3	303.200	2.156	10	0		DEAEHN
C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@H]1COc2ccccc21	ZINC000246273797	274334310	/nfs/dbraw/zinc/33/43/10/274334310.db2.gz	JCOPEMLUQQSADJ-SNPRPXQTSA-N	0	3	303.406	2.102	10	0		DEAEHN
O=C([C@H]1CCCc2c(O)cccc21)N1CCN2CCC[C@@H]2C1	ZINC000190312490	275008220	/nfs/dbraw/zinc/00/82/20/275008220.db2.gz	SJKAXFHAMCVHLW-CJNGLKHVSA-N	0	3	300.402	2.119	10	0		DEAEHN
CCN1CCC[C@@H](NC(=O)N[C@H]2CCOc3ccc(F)cc32)C1	ZINC000245827624	276167337	/nfs/dbraw/zinc/16/73/37/276167337.db2.gz	ZLNAGHSJMKSKKR-HIFRSBDPSA-N	0	3	321.396	2.433	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)[C@@H]1CCCN1c1nccs1	ZINC000176999906	276180811	/nfs/dbraw/zinc/18/08/11/276180811.db2.gz	STAWWXHTBBOPBP-KBPBESRZSA-N	0	3	322.478	2.055	10	0		DEAEHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@H]1CCC(C)(C)O1	ZINC000252032652	276232116	/nfs/dbraw/zinc/23/21/16/276232116.db2.gz	ZVILJVMKUZSDCE-QLFBSQMISA-N	0	3	309.454	2.212	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)N[C@@H]2CCOC3(CCCC3)C2)C1	ZINC000151288475	276375672	/nfs/dbraw/zinc/37/56/72/276375672.db2.gz	NZAYJQGOPYQXHN-CABCVRRESA-N	0	3	309.454	2.262	10	0		DEAEHN
COC[C@H]1CCCN(CC(=O)N2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000246733996	277266120	/nfs/dbraw/zinc/26/61/20/277266120.db2.gz	LKQHZTNPPBKRQF-QWHCGFSZSA-N	0	3	322.371	2.146	10	0		DEAEHN
CO[C@@H]1CC[C@@H]2OCCN(CCCOCC(F)(F)F)[C@@H]2C1	ZINC000158009405	277295696	/nfs/dbraw/zinc/29/56/96/277295696.db2.gz	KVCZXXMFGIOAQX-UPJWGTAASA-N	0	3	311.344	2.224	10	0		DEAEHN
CCN(CC(C)(C)O)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000179477398	279062365	/nfs/dbraw/zinc/06/23/65/279062365.db2.gz	ZOEFJBZHTBQPRM-JKSUJKDBSA-N	0	3	319.449	2.234	10	0		DEAEHN
CC(C)C[C@H](CN(C)C)NC(=O)[C@@H]1OCCc2ccccc21	ZINC000129603471	279130604	/nfs/dbraw/zinc/13/06/04/279130604.db2.gz	ZVIXOEVIPKQABE-NVXWUHKLSA-N	0	3	304.434	2.393	10	0		DEAEHN
Cn1cncc1CN[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000245655849	279391675	/nfs/dbraw/zinc/39/16/75/279391675.db2.gz	FYNNSICBOAAJEE-HOTGVXAUSA-N	0	3	306.360	2.233	10	0		DEAEHN
Fc1ccc2c(c1)OCCC[C@H]2N[C@H]1CCc2ncnn2C1	ZINC000182131696	279466092	/nfs/dbraw/zinc/46/60/92/279466092.db2.gz	VTLSJDZYSYFNEG-GXTWGEPZSA-N	0	3	302.353	2.236	10	0		DEAEHN
C[C@H]1OCCC[C@H]1C(=O)N(CCN(C)C)Cc1cccs1	ZINC000189149842	280053502	/nfs/dbraw/zinc/05/35/02/280053502.db2.gz	MULQOPXUWLAKLP-UKRRQHHQSA-N	0	3	310.463	2.453	10	0		DEAEHN
O=C1[C@@H](N[C@@H]2CCCc3sccc32)CCN1C1CCOCC1	ZINC000367412114	280315267	/nfs/dbraw/zinc/31/52/67/280315267.db2.gz	GJNWUIYIKVSTKM-CABCVRRESA-N	0	3	320.458	2.495	10	0		DEAEHN
Cc1cccc2c1OCC[C@@H]2NC(=O)NC[C@H]1CCCN1C	ZINC000190347275	281283049	/nfs/dbraw/zinc/28/30/49/281283049.db2.gz	HTMPSMDFPHGXSC-HIFRSBDPSA-N	0	3	303.406	2.212	10	0		DEAEHN
C[C@H](C(=O)N[C@H]1Cc2ccccc2[C@@H]1O)N1[C@H](C)CC[C@@H]1C	ZINC000246026033	289377907	/nfs/dbraw/zinc/37/79/07/289377907.db2.gz	WSFOAFXJIXSUMU-PJSWFKRJSA-N	0	3	302.418	2.022	10	0		DEAEHN
CN(C)[C@H]1CCN(C(=O)C2(c3ccc(F)cc3)CCOCC2)C1	ZINC000170855599	289381769	/nfs/dbraw/zinc/38/17/69/289381769.db2.gz	RJEQMIOTWJEEMR-INIZCTEOSA-N	0	3	320.408	2.036	10	0		DEAEHN
C[C@H](N[C@@H]1CCCCC[C@H]1O)c1ccc(S(C)(=O)=O)cc1	ZINC000252884802	290004227	/nfs/dbraw/zinc/00/42/27/290004227.db2.gz	WZFADEFKDCBMKU-APHBMKBZSA-N	0	3	311.447	2.434	10	0		DEAEHN
N[C@H](C(=O)N1CC2(CCC2)c2c1cccc2F)C1CCOCC1	ZINC000261644962	295327271	/nfs/dbraw/zinc/32/72/71/295327271.db2.gz	DSBMOYYYPHIYIV-INIZCTEOSA-N	0	3	318.392	2.348	10	0		DEAEHN
Cc1cc(C)c(C)c(S(=O)(=O)N[C@@H]2CNCC[C@@H]2C)c1C	ZINC000193400215	301179231	/nfs/dbraw/zinc/17/92/31/301179231.db2.gz	NMCZFAJOEYTNOH-ZUZCIYMTSA-N	0	3	310.463	2.197	10	0		DEAEHN
Cc1cnn(CCN[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1	ZINC000105881204	302402897	/nfs/dbraw/zinc/40/28/97/302402897.db2.gz	CTZADLUNCCAMLM-GJZGRUSLSA-N	0	3	312.417	2.147	10	0		DEAEHN
CC(C)(CNC(=O)NCCOCC1CCC1)N1CCCCC1	ZINC000576798332	326319236	/nfs/dbraw/zinc/31/92/36/326319236.db2.gz	GNFLHDPBDYEJRT-UHFFFAOYSA-N	0	3	311.470	2.367	10	0		DEAEHN
CCOc1cccc(CNC[C@H]2CCC3(CCOCC3)[C@H]2O)n1	ZINC000577126304	326344636	/nfs/dbraw/zinc/34/46/36/326344636.db2.gz	KRDFGDRBCJVCJS-PBHICJAKSA-N	0	3	320.433	2.138	10	0		DEAEHN
COC[C@H](C)CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O	ZINC000188231813	333039665	/nfs/dbraw/zinc/03/96/65/333039665.db2.gz	XSLGRNHPQHHHGD-YGRLFVJLSA-N	0	3	314.788	2.457	10	0		DEAEHN
COC[C@@H](C)CN1CCN(Cc2ccc(OC)c(F)c2)CC1	ZINC000189576913	333142308	/nfs/dbraw/zinc/14/23/08/333142308.db2.gz	UGYLIWBHYDQXMZ-AWEZNQCLSA-N	0	3	310.413	2.234	10	0		DEAEHN
COC(C)(C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000398002289	337303460	/nfs/dbraw/zinc/30/34/60/337303460.db2.gz	XAAWODNGUAZXMI-GDBMZVCRSA-N	0	3	304.434	2.438	10	0		DEAEHN
c1cncc(O[C@@H]2CCCc3ccc(N4CCNCC4)nc32)c1	ZINC000584651826	337380990	/nfs/dbraw/zinc/38/09/90/337380990.db2.gz	VMJXPZMMHVIMSE-MRXNPFEDSA-N	0	3	310.401	2.343	10	0		DEAEHN
C[C@H](NCC1(CCO)CC1)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000188068051	533831096	/nfs/dbraw/zinc/83/10/96/533831096.db2.gz	DLCJKVXKVRCBHX-NSHDSACASA-N	0	3	315.410	2.042	10	0		DEAEHN
CC(C)OC(=O)CCN1CCC(NC(=O)C2CCCCC2)CC1	ZINC000157836847	519745346	/nfs/dbraw/zinc/74/53/46/519745346.db2.gz	UIKYPCVPZUGHEZ-UHFFFAOYSA-N	0	3	324.465	2.489	10	0		DEAEHN
CC[C@@H](C)[C@@H](N)C(=O)Nc1nc(Cc2ccccc2)ns1	ZINC000237021637	522306264	/nfs/dbraw/zinc/30/62/64/522306264.db2.gz	HRQHXTRBXSEJID-ZWNOBZJWSA-N	0	3	304.419	2.441	10	0		DEAEHN
CCc1nccn1[C@H]1CCCN(C[C@H](O)COC(C)(C)C)C1	ZINC000105922604	522599323	/nfs/dbraw/zinc/59/93/23/522599323.db2.gz	GAMGQJJCPOMWPN-GJZGRUSLSA-N	0	3	309.454	2.258	10	0		DEAEHN
COCc1ccc(CN2CCC[C@@H](Cn3cncn3)C2)cc1	ZINC000128509197	522971410	/nfs/dbraw/zinc/97/14/10/522971410.db2.gz	BSTSCJJHMQVNBP-QGZVFWFLSA-N	0	3	300.406	2.337	10	0		DEAEHN
CC(=O)N(c1nnc(SC[C@H](C)N(C)C)s1)C1CC1	ZINC000358863725	534751096	/nfs/dbraw/zinc/75/10/96/534751096.db2.gz	RJZPOHFKRSTQMT-QMMMGPOBSA-N	0	3	300.453	2.096	10	0		DEAEHN
C[C@H](CC(=O)N1CCO[C@@H](CN(C)C)C1)c1cccc(F)c1	ZINC000116797057	526229660	/nfs/dbraw/zinc/22/96/60/526229660.db2.gz	UVDRMOPECBOVLU-CJNGLKHVSA-N	0	3	308.397	2.108	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N(C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1[O-]	ZINC000331336366	527235019	/nfs/dbraw/zinc/23/50/19/527235019.db2.gz	IWXUBFUNSOUDGU-SMDDNHRTSA-N	0	3	304.390	2.150	10	0		DEAEHN
CC(=O)c1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[O-]	ZINC000331336366	527235022	/nfs/dbraw/zinc/23/50/22/527235022.db2.gz	IWXUBFUNSOUDGU-SMDDNHRTSA-N	0	3	304.390	2.150	10	0		DEAEHN
CCN1CC[C@H](NC(=O)c2ccsc2Br)C1	ZINC000412874088	527878137	/nfs/dbraw/zinc/87/81/37/527878137.db2.gz	ICRLOESDDSDMNK-QMMMGPOBSA-N	0	3	303.225	2.335	10	0		DEAEHN
CCC[C@]1(COC)CCCN1C(=O)N[C@H]1CCCN(CC)C1	ZINC000193471761	528525447	/nfs/dbraw/zinc/52/54/47/528525447.db2.gz	YPXWIVAFZDIVBD-DOTOQJQBSA-N	0	3	311.470	2.461	10	0		DEAEHN
CC(C)Oc1cccc(CN2CCN(C[C@H](C)O)[C@H](C)C2)c1	ZINC000247582095	535039734	/nfs/dbraw/zinc/03/97/34/535039734.db2.gz	IMYDHTZKPBOAEC-CVEARBPZSA-N	0	3	306.450	2.361	10	0		DEAEHN
CC1(C)[C@@H]2CN(CC(=O)NCCc3cccc4cccnc43)C[C@@H]21	ZINC000357773545	535041760	/nfs/dbraw/zinc/04/17/60/535041760.db2.gz	QOQDUNYUODHTHT-CALCHBBNSA-N	0	3	323.440	2.481	10	0		DEAEHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)CSCc2ccccn2)C1	ZINC000246828756	535256293	/nfs/dbraw/zinc/25/62/93/535256293.db2.gz	DSPIJWSIHNYILP-UKRRQHHQSA-N	0	3	307.463	2.160	10	0		DEAEHN
CCO[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2CCCN(CC)C2)C1(C)C	ZINC000247079169	535390354	/nfs/dbraw/zinc/39/03/54/535390354.db2.gz	VIJNQHWPNOSAMW-RBSFLKMASA-N	0	3	311.470	2.316	10	0		DEAEHN
CCOc1ccccc1/C=C/c1nc([C@H]2CNCCN2C)no1	ZINC000263158281	535485754	/nfs/dbraw/zinc/48/57/54/535485754.db2.gz	DPLOXZAIVPQMGX-MYSGNRETSA-N	0	3	314.389	2.215	10	0		DEAEHN
CCN1CCC[C@H](NC(=O)/C=C\c2ccc(OC)c(O)c2)C1	ZINC000492704385	535569281	/nfs/dbraw/zinc/56/92/81/535569281.db2.gz	KDVUHNRZYAESCR-LEJCZOIISA-N	0	3	304.390	2.015	10	0		DEAEHN
CCN1CCC[C@H]1CN(C)C(=O)NCCCn1nc(C)cc1C	ZINC000176140761	535586418	/nfs/dbraw/zinc/58/64/18/535586418.db2.gz	HDGVEVJTSQSXQS-INIZCTEOSA-N	0	3	321.469	2.016	10	0		DEAEHN
CC[C@@H](C)N[C@H](CNC(=O)Cn1nc(C)cc1C)c1ccco1	ZINC000359536793	535605413	/nfs/dbraw/zinc/60/54/13/535605413.db2.gz	KOZSZTROZKRKQC-IUODEOHRSA-N	0	3	318.421	2.339	10	0		DEAEHN
CN(C)C[C@@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2ccccc2O1	ZINC000193402077	535939915	/nfs/dbraw/zinc/93/99/15/535939915.db2.gz	YYUNMDBVFVWXRP-MJGOQNOKSA-N	0	3	324.424	2.279	10	0		DEAEHN
CN(C)Cc1cccc(NC(=O)C(=O)N2CCCC23CCC3)c1	ZINC000373177466	536035112	/nfs/dbraw/zinc/03/51/12/536035112.db2.gz	FJQOYCPGMAJLDJ-UHFFFAOYSA-N	0	3	315.417	2.232	10	0		DEAEHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)C[C@@H](O)c2ccccc2)C1	ZINC000246524985	536470216	/nfs/dbraw/zinc/47/02/16/536470216.db2.gz	UYMRFSFPIRDUNI-GVDBMIGSSA-N	0	3	302.418	2.053	10	0		DEAEHN
COc1ccc(/C(C)=C/c2nc([C@H]3CNCCN3C)no2)cc1	ZINC000263183207	536561081	/nfs/dbraw/zinc/56/10/81/536561081.db2.gz	GZCHNFSMTMBHIB-HBIYDYFMSA-N	0	3	314.389	2.215	10	0		DEAEHN
COCCOc1cccc(CN2CCC(n3cncn3)CC2)c1	ZINC000092647690	536707268	/nfs/dbraw/zinc/70/72/68/536707268.db2.gz	PUJAEPBQMKXFQA-UHFFFAOYSA-N	0	3	316.405	2.140	10	0		DEAEHN
COCCN1CCC[C@@H]1CNC(=O)N[C@@H]1CC[C@H](C)C[C@@H]1C	ZINC000247535438	536861510	/nfs/dbraw/zinc/86/15/10/536861510.db2.gz	XXTIGUDCYZBRHA-CAOSSQGBSA-N	0	3	311.470	2.221	10	0		DEAEHN
COc1ccccc1OCC(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000246669491	537089098	/nfs/dbraw/zinc/08/90/98/537089098.db2.gz	MAIDJYNNMBSVCN-GJZGRUSLSA-N	0	3	318.417	2.017	10	0		DEAEHN
CC[C@]1(C2CN(C(=O)OC(C)(C)C)C2)NCCc2nc[nH]c21	ZINC000716166135	563465216	/nfs/dbraw/zinc/46/52/16/563465216.db2.gz	YEQKXBZHEZOGRY-MRXNPFEDSA-N	0	3	306.410	2.028	10	0		DEAEHN
CC(C)(C)OC(=O)N(CCCCCO)c1ccc(CN)nc1	ZINC000757133461	623040576	/nfs/dbraw/zinc/04/05/76/623040576.db2.gz	IFJMKTZPEIKZQA-UHFFFAOYSA-N	0	3	309.410	2.444	10	0		DEAEHN
COc1cc(C[NH2+][C@H](C)C(C)(C)O)cc(Br)c1[O-]	ZINC000393964181	625219625	/nfs/dbraw/zinc/21/96/25/625219625.db2.gz	KYIDNLPWZVCVAD-MRVPVSSYSA-N	0	3	318.211	2.412	10	0		DEAEHN
CCN(CC)[C@H]1CCN(S(=O)(=O)/C=C\c2ccccc2)C1	ZINC000299735376	637006913	/nfs/dbraw/zinc/00/69/13/637006913.db2.gz	UZMWUJCAUBTPOA-KVNDZABWSA-N	0	3	308.447	2.403	10	0		DEAEHN
C[C@H](N[C@H]1CCC[C@H]1CNC(=O)OC(C)(C)C)c1nncn1C	ZINC000299982797	637014350	/nfs/dbraw/zinc/01/43/50/637014350.db2.gz	CVNBMZUVGMBAPK-AVGNSLFASA-N	0	3	323.441	2.159	10	0		DEAEHN
Cc1nonc1C(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1	ZINC000741606488	637996862	/nfs/dbraw/zinc/99/68/62/637996862.db2.gz	QFUCXPOOSLOFHC-FZMZJTMJSA-N	0	3	320.418	2.252	10	0		DEAEHN
COCCS(=O)(=O)CCCN1CCC2(C1)CCCCC2	ZINC000741807969	638016675	/nfs/dbraw/zinc/01/66/75/638016675.db2.gz	OJUGFTSCQIRGER-UHFFFAOYSA-N	0	3	303.468	2.094	10	0		DEAEHN
CC(C)(C)OC(=O)N(C[C@@H](O)C1CC1)c1ccc(CN)nc1	ZINC000757132451	645928122	/nfs/dbraw/zinc/92/81/22/645928122.db2.gz	BFPCMVJYWBIVIJ-CQSZACIVSA-N	0	3	307.394	2.053	10	0		DEAEHN
CN(CC1CC1)C(=O)CN1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000174384712	646808694	/nfs/dbraw/zinc/80/86/94/646808694.db2.gz	KNSZRAHQYMHYKY-ROUUACIJSA-N	0	3	316.445	2.443	10	0		DEAEHN
CCOCCN1CCN(C[C@H](O)c2ccc(C)cc2)C[C@@H]1C	ZINC000174782512	647346414	/nfs/dbraw/zinc/34/64/14/647346414.db2.gz	MWOGXXPZIXOUJJ-WMZOPIPTSA-N	0	3	306.450	2.071	10	0		DEAEHN
CC#CCCCCOC(=O)C1CC[C@@H](C(F)(F)F)NC1=O	ZINC000183956685	649209082	/nfs/dbraw/zinc/20/90/82/649209082.db2.gz	LKTCMSMPDHBGNJ-QWRGUYRKSA-N	0	3	305.296	2.180	10	0		DEAEHN
OC1(CN2CCN(c3cc(C4CC4)[nH]n3)CC2)CCCCC1	ZINC000189669373	684385687	/nfs/dbraw/zinc/38/56/87/684385687.db2.gz	CBTOHKJNJCKTKH-UHFFFAOYSA-N	0	3	304.438	2.104	10	0		DEAEHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@@H]1CCOC[C@@H]1C	ZINC000192515065	684451084	/nfs/dbraw/zinc/45/10/84/684451084.db2.gz	CQIAIUTUGVHSAU-YNEHKIRRSA-N	0	3	316.357	2.015	10	0		DEAEHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@@H]2CCOC[C@H]2C)c1	ZINC000192509501	684451418	/nfs/dbraw/zinc/45/14/18/684451418.db2.gz	LFJSHDBHSPDWLD-KCPJHIHWSA-N	0	3	316.357	2.015	10	0		DEAEHN
CC[C@@H]1CN(C[C@@H](O)c2cc(C)cc(C)c2)CCN1CCOC	ZINC000246810857	685137138	/nfs/dbraw/zinc/13/71/38/685137138.db2.gz	WJVQDVJSGAHRFM-RTBURBONSA-N	0	3	320.477	2.379	10	0		DEAEHN
O=C(C[C@@H]1COC(=O)C1)O[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000248383569	685157535	/nfs/dbraw/zinc/15/75/35/685157535.db2.gz	ANPWNIZDCKQKBH-HZPDHXFCSA-N	0	3	317.385	2.147	10	0		DEAEHN
CN(C)Cc1cc(O[C@@H]2CCN(Cc3cncs3)C2)ccn1	ZINC000886068857	691996729	/nfs/dbraw/zinc/99/67/29/691996729.db2.gz	YNIKTSWOPDTHRZ-OAHLLOKOSA-N	0	3	318.446	2.253	10	0		DEAEHN